USER MOD reduce.3.24.130724 H: found=0, std=0, add=943, rem=0, adj=22 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 63 THR OG1 : rot 116:sc= 0.283 USER MOD Set 1.2: A 65 THR OG1 : rot 180:sc= 0.271 USER MOD Single : A 12 THR OG1 : rot 38:sc= 0.129 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 GLN : amide:sc= 1.05 K(o=1,f=0) USER MOD Single : A 20 SER OG : rot -24:sc= 0.936 USER MOD Single : A 44 SER OG : rot 95:sc= 1.25 USER MOD Single : A 51 THR OG1 : rot 74:sc= 0.814 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot -27:sc= 0.223 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 ASN : amide:sc= -0.582 K(o=-0.58,f=-2.2!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot -25:sc= 0.249 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot -170:sc= 0.501 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 105 ASN : amide:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0.116 USER MOD Single : A 111 THR OG1 : rot 82:sc= 1.12 USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 SER OG : rot 154:sc= 1.43 USER MOD Single : A 133 HIS : no HE2:sc= 1.06 K(o=1.1,f=-3.6!) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 141 ASN : amide:sc= -1.81 K(o=-1.8,f=-2.4!) USER MOD ----------------------------------------------------------------- ATOM 31 N GLY A 4 -18.863 3.493 1.903 1.00 0.00 N ATOM 32 CA GLY A 4 -18.693 4.619 2.811 1.00 0.00 C ATOM 33 C GLY A 4 -19.155 5.938 2.207 1.00 0.00 C ATOM 34 O GLY A 4 -19.320 6.047 0.985 1.00 0.00 O ATOM 0 HA2 GLY A 4 -19.252 4.429 3.727 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -17.642 4.700 3.089 1.00 0.00 H new ATOM 38 N GLU A 5 -19.369 6.947 3.050 1.00 0.00 N ATOM 39 CA GLU A 5 -19.791 8.265 2.592 1.00 0.00 C ATOM 40 C GLU A 5 -18.588 9.022 2.018 1.00 0.00 C ATOM 41 O GLU A 5 -17.457 8.752 2.437 1.00 0.00 O ATOM 42 CB GLU A 5 -20.455 9.064 3.717 1.00 0.00 C ATOM 43 CG GLU A 5 -19.586 9.425 4.929 1.00 0.00 C ATOM 44 CD GLU A 5 -20.365 10.412 5.794 1.00 0.00 C ATOM 45 OE1 GLU A 5 -21.462 10.041 6.271 1.00 0.00 O ATOM 46 OE2 GLU A 5 -19.976 11.601 5.882 1.00 0.00 O ATOM 0 H GLU A 5 -19.255 6.873 4.061 1.00 0.00 H new ATOM 0 HA GLU A 5 -20.536 8.135 1.807 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -20.842 9.990 3.291 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -21.313 8.495 4.074 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -19.339 8.530 5.501 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -18.643 9.865 4.604 1.00 0.00 H new ATOM 53 N PRO A 6 -18.805 9.959 1.078 1.00 0.00 N ATOM 54 CA PRO A 6 -17.730 10.731 0.498 1.00 0.00 C ATOM 55 C PRO A 6 -17.288 11.818 1.483 1.00 0.00 C ATOM 56 O PRO A 6 -18.112 12.473 2.128 1.00 0.00 O ATOM 57 CB PRO A 6 -18.306 11.323 -0.786 1.00 0.00 C ATOM 58 CG PRO A 6 -19.770 11.533 -0.439 1.00 0.00 C ATOM 59 CD PRO A 6 -20.073 10.363 0.491 1.00 0.00 C ATOM 0 HA PRO A 6 -16.845 10.133 0.282 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -17.816 12.259 -1.054 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -18.185 10.647 -1.632 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -19.935 12.492 0.052 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -20.402 11.517 -1.327 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -20.782 10.657 1.265 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -20.526 9.538 -0.059 1.00 0.00 H new ATOM 67 N LEU A 7 -15.980 12.031 1.579 1.00 0.00 N ATOM 68 CA LEU A 7 -15.363 13.020 2.440 1.00 0.00 C ATOM 69 C LEU A 7 -14.469 13.877 1.553 1.00 0.00 C ATOM 70 O LEU A 7 -13.456 13.384 1.064 1.00 0.00 O ATOM 71 CB LEU A 7 -14.580 12.318 3.563 1.00 0.00 C ATOM 72 CG LEU A 7 -14.324 13.169 4.818 1.00 0.00 C ATOM 73 CD1 LEU A 7 -13.810 14.583 4.527 1.00 0.00 C ATOM 74 CD2 LEU A 7 -15.600 13.237 5.657 1.00 0.00 C ATOM 0 H LEU A 7 -15.300 11.497 1.037 1.00 0.00 H new ATOM 0 HA LEU A 7 -16.101 13.654 2.932 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -15.125 11.421 3.857 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -13.620 11.991 3.164 1.00 0.00 H new ATOM 0 HG LEU A 7 -13.524 12.672 5.367 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -13.656 15.115 5.466 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -12.866 14.523 3.985 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -14.542 15.119 3.923 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -15.419 13.840 6.547 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -16.399 13.689 5.069 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -15.894 12.230 5.955 1.00 0.00 H new ATOM 86 N VAL A 8 -14.888 15.108 1.275 1.00 0.00 N ATOM 87 CA VAL A 8 -14.155 16.069 0.464 1.00 0.00 C ATOM 88 C VAL A 8 -13.345 16.884 1.465 1.00 0.00 C ATOM 89 O VAL A 8 -13.936 17.560 2.310 1.00 0.00 O ATOM 90 CB VAL A 8 -15.139 17.009 -0.272 1.00 0.00 C ATOM 91 CG1 VAL A 8 -14.423 18.096 -1.090 1.00 0.00 C ATOM 92 CG2 VAL A 8 -16.049 16.238 -1.226 1.00 0.00 C ATOM 0 H VAL A 8 -15.776 15.474 1.620 1.00 0.00 H new ATOM 0 HA VAL A 8 -13.536 15.578 -0.287 1.00 0.00 H new ATOM 0 HB VAL A 8 -15.726 17.479 0.517 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -15.163 18.726 -1.584 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -13.812 18.707 -0.426 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -13.786 17.627 -1.840 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -16.726 16.932 -1.724 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -15.442 15.724 -1.972 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -16.629 15.506 -0.664 1.00 0.00 H new ATOM 102 N GLY A 9 -12.023 16.795 1.407 1.00 0.00 N ATOM 103 CA GLY A 9 -11.136 17.542 2.279 1.00 0.00 C ATOM 104 C GLY A 9 -11.160 18.981 1.786 1.00 0.00 C ATOM 105 O GLY A 9 -11.924 19.823 2.270 1.00 0.00 O ATOM 0 H GLY A 9 -11.534 16.194 0.744 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -11.468 17.481 3.315 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -10.125 17.136 2.244 1.00 0.00 H new ATOM 109 N GLY A 10 -10.388 19.262 0.745 1.00 0.00 N ATOM 110 CA GLY A 10 -10.308 20.562 0.131 1.00 0.00 C ATOM 111 C GLY A 10 -9.002 20.794 -0.603 1.00 0.00 C ATOM 112 O GLY A 10 -8.156 19.921 -0.768 1.00 0.00 O ATOM 0 H GLY A 10 -9.788 18.568 0.300 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -11.136 20.679 -0.568 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -10.428 21.327 0.898 1.00 0.00 H new ATOM 116 N ASP A 11 -8.885 22.007 -1.126 1.00 0.00 N ATOM 117 CA ASP A 11 -7.684 22.456 -1.830 1.00 0.00 C ATOM 118 C ASP A 11 -6.641 22.912 -0.790 1.00 0.00 C ATOM 119 O ASP A 11 -5.502 23.230 -1.129 1.00 0.00 O ATOM 120 CB ASP A 11 -8.012 23.652 -2.722 1.00 0.00 C ATOM 121 CG ASP A 11 -8.286 23.410 -4.205 1.00 0.00 C ATOM 122 OD1 ASP A 11 -8.330 22.243 -4.666 1.00 0.00 O ATOM 123 OD2 ASP A 11 -8.477 24.447 -4.894 1.00 0.00 O ATOM 0 H ASP A 11 -9.621 22.712 -1.076 1.00 0.00 H new ATOM 0 HA ASP A 11 -7.302 21.636 -2.438 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -8.887 24.148 -2.301 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -7.182 24.355 -2.650 1.00 0.00 H new ATOM 128 N THR A 12 -7.058 23.010 0.470 1.00 0.00 N ATOM 129 CA THR A 12 -6.311 23.431 1.628 1.00 0.00 C ATOM 130 C THR A 12 -5.959 22.204 2.467 1.00 0.00 C ATOM 131 O THR A 12 -6.835 21.390 2.771 1.00 0.00 O ATOM 132 CB THR A 12 -7.194 24.430 2.397 1.00 0.00 C ATOM 133 OG1 THR A 12 -8.484 23.886 2.631 1.00 0.00 O ATOM 134 CG2 THR A 12 -7.400 25.728 1.602 1.00 0.00 C ATOM 0 H THR A 12 -8.019 22.772 0.717 1.00 0.00 H new ATOM 0 HA THR A 12 -5.373 23.917 1.361 1.00 0.00 H new ATOM 0 HB THR A 12 -6.678 24.636 3.335 1.00 0.00 H new ATOM 0 HG1 THR A 12 -8.404 22.930 2.833 1.00 0.00 H new ATOM 0 HG21 THR A 12 -8.028 26.410 2.175 1.00 0.00 H new ATOM 0 HG22 THR A 12 -6.434 26.196 1.413 1.00 0.00 H new ATOM 0 HG23 THR A 12 -7.884 25.500 0.652 1.00 0.00 H new ATOM 142 N ASP A 13 -4.685 22.120 2.834 1.00 0.00 N ATOM 143 CA ASP A 13 -4.051 21.075 3.629 1.00 0.00 C ATOM 144 C ASP A 13 -4.824 20.727 4.898 1.00 0.00 C ATOM 145 O ASP A 13 -5.313 21.614 5.603 1.00 0.00 O ATOM 146 CB ASP A 13 -2.644 21.543 4.042 1.00 0.00 C ATOM 147 CG ASP A 13 -2.621 22.890 4.787 1.00 0.00 C ATOM 148 OD1 ASP A 13 -2.634 23.945 4.112 1.00 0.00 O ATOM 149 OD2 ASP A 13 -2.504 22.935 6.038 1.00 0.00 O ATOM 0 H ASP A 13 -4.015 22.839 2.561 1.00 0.00 H new ATOM 0 HA ASP A 13 -4.020 20.182 3.004 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -2.192 20.781 4.677 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -2.023 21.623 3.150 1.00 0.00 H new ATOM 154 N ASP A 14 -4.887 19.436 5.232 1.00 0.00 N ATOM 155 CA ASP A 14 -5.546 18.907 6.425 1.00 0.00 C ATOM 156 C ASP A 14 -5.253 17.415 6.477 1.00 0.00 C ATOM 157 O ASP A 14 -4.568 16.859 5.611 1.00 0.00 O ATOM 158 CB ASP A 14 -7.067 19.172 6.491 1.00 0.00 C ATOM 159 CG ASP A 14 -7.461 20.130 7.619 1.00 0.00 C ATOM 160 OD1 ASP A 14 -7.074 19.875 8.786 1.00 0.00 O ATOM 161 OD2 ASP A 14 -8.232 21.088 7.374 1.00 0.00 O ATOM 0 H ASP A 14 -4.465 18.706 4.658 1.00 0.00 H new ATOM 0 HA ASP A 14 -5.146 19.432 7.292 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -7.400 19.585 5.539 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -7.589 18.225 6.627 1.00 0.00 H new ATOM 166 N GLN A 15 -5.740 16.780 7.537 1.00 0.00 N ATOM 167 CA GLN A 15 -5.593 15.363 7.783 1.00 0.00 C ATOM 168 C GLN A 15 -6.987 14.731 7.681 1.00 0.00 C ATOM 169 O GLN A 15 -7.981 15.348 8.079 1.00 0.00 O ATOM 170 CB GLN A 15 -4.925 15.140 9.145 1.00 0.00 C ATOM 171 CG GLN A 15 -3.456 15.596 9.212 1.00 0.00 C ATOM 172 CD GLN A 15 -3.078 16.230 10.544 1.00 0.00 C ATOM 173 OE1 GLN A 15 -3.049 15.566 11.582 1.00 0.00 O ATOM 174 NE2 GLN A 15 -2.771 17.516 10.539 1.00 0.00 N ATOM 0 H GLN A 15 -6.264 17.260 8.269 1.00 0.00 H new ATOM 0 HA GLN A 15 -4.945 14.886 7.048 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -5.494 15.673 9.907 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -4.976 14.080 9.392 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -2.809 14.738 9.030 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -3.269 16.312 8.412 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -2.802 18.044 9.667 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -2.503 17.980 11.407 1.00 0.00 H new ATOM 183 N LEU A 16 -7.072 13.507 7.154 1.00 0.00 N ATOM 184 CA LEU A 16 -8.303 12.742 6.959 1.00 0.00 C ATOM 185 C LEU A 16 -8.037 11.291 7.369 1.00 0.00 C ATOM 186 O LEU A 16 -6.977 10.757 7.040 1.00 0.00 O ATOM 187 CB LEU A 16 -8.781 12.838 5.500 1.00 0.00 C ATOM 188 CG LEU A 16 -9.025 14.269 4.958 1.00 0.00 C ATOM 189 CD1 LEU A 16 -7.809 14.859 4.227 1.00 0.00 C ATOM 190 CD2 LEU A 16 -10.196 14.232 3.972 1.00 0.00 C ATOM 0 H LEU A 16 -6.245 13.000 6.837 1.00 0.00 H new ATOM 0 HA LEU A 16 -9.101 13.152 7.578 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -8.042 12.351 4.864 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -9.707 12.272 5.404 1.00 0.00 H new ATOM 0 HG LEU A 16 -9.232 14.901 5.822 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.048 15.862 3.873 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -6.962 14.908 4.911 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -7.553 14.226 3.377 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -10.377 15.234 3.584 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.956 13.561 3.147 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -11.090 13.874 4.482 1.00 0.00 H new ATOM 202 N GLN A 17 -8.963 10.623 8.064 1.00 0.00 N ATOM 203 CA GLN A 17 -8.785 9.240 8.514 1.00 0.00 C ATOM 204 C GLN A 17 -10.062 8.393 8.471 1.00 0.00 C ATOM 205 O GLN A 17 -11.111 8.809 8.972 1.00 0.00 O ATOM 206 CB GLN A 17 -8.308 9.227 9.978 1.00 0.00 C ATOM 207 CG GLN A 17 -6.931 9.864 10.231 1.00 0.00 C ATOM 208 CD GLN A 17 -6.275 9.290 11.485 1.00 0.00 C ATOM 209 OE1 GLN A 17 -6.176 9.927 12.535 1.00 0.00 O ATOM 210 NE2 GLN A 17 -5.894 8.021 11.443 1.00 0.00 N ATOM 0 H GLN A 17 -9.860 11.028 8.331 1.00 0.00 H new ATOM 0 HA GLN A 17 -8.061 8.810 7.822 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -9.047 9.747 10.587 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -8.280 8.194 10.324 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -6.285 9.693 9.370 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -7.041 10.943 10.337 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -5.975 7.493 10.574 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -5.519 7.573 12.279 1.00 0.00 H new ATOM 219 N GLY A 18 -9.932 7.157 7.986 1.00 0.00 N ATOM 220 CA GLY A 18 -10.990 6.156 7.884 1.00 0.00 C ATOM 221 C GLY A 18 -10.810 5.108 8.992 1.00 0.00 C ATOM 222 O GLY A 18 -11.788 4.676 9.606 1.00 0.00 O ATOM 0 H GLY A 18 -9.038 6.811 7.636 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -11.966 6.632 7.974 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -10.959 5.676 6.906 1.00 0.00 H new ATOM 226 N GLY A 19 -9.563 4.727 9.303 1.00 0.00 N ATOM 227 CA GLY A 19 -9.224 3.758 10.343 1.00 0.00 C ATOM 228 C GLY A 19 -9.543 2.320 9.946 1.00 0.00 C ATOM 229 O GLY A 19 -8.622 1.528 9.731 1.00 0.00 O ATOM 0 H GLY A 19 -8.743 5.097 8.822 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -8.162 3.838 10.574 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -9.768 4.006 11.254 1.00 0.00 H new ATOM 233 N SER A 20 -10.820 1.936 9.917 1.00 0.00 N ATOM 234 CA SER A 20 -11.279 0.605 9.525 1.00 0.00 C ATOM 235 C SER A 20 -12.781 0.660 9.250 1.00 0.00 C ATOM 236 O SER A 20 -13.541 1.048 10.140 1.00 0.00 O ATOM 237 CB SER A 20 -11.043 -0.459 10.611 1.00 0.00 C ATOM 238 OG SER A 20 -9.737 -0.448 11.168 1.00 0.00 O ATOM 0 H SER A 20 -11.584 2.561 10.173 1.00 0.00 H new ATOM 0 HA SER A 20 -10.706 0.321 8.642 1.00 0.00 H new ATOM 0 HB2 SER A 20 -11.768 -0.311 11.412 1.00 0.00 H new ATOM 0 HB3 SER A 20 -11.235 -1.444 10.186 1.00 0.00 H new ATOM 0 HG SER A 20 -9.111 -0.052 10.526 1.00 0.00 H new ATOM 244 N GLY A 21 -13.236 0.204 8.086 1.00 0.00 N ATOM 245 CA GLY A 21 -14.626 0.199 7.724 1.00 0.00 C ATOM 246 C GLY A 21 -14.836 0.480 6.249 1.00 0.00 C ATOM 247 O GLY A 21 -14.225 -0.145 5.379 1.00 0.00 O ATOM 0 H GLY A 21 -12.626 -0.177 7.363 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -15.061 -0.769 7.973 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -15.156 0.947 8.313 1.00 0.00 H new ATOM 251 N ALA A 22 -15.932 1.185 5.972 1.00 0.00 N ATOM 252 CA ALA A 22 -16.333 1.625 4.663 1.00 0.00 C ATOM 253 C ALA A 22 -16.474 3.136 4.789 1.00 0.00 C ATOM 254 O ALA A 22 -17.478 3.620 5.303 1.00 0.00 O ATOM 255 CB ALA A 22 -17.620 0.917 4.232 1.00 0.00 C ATOM 0 H ALA A 22 -16.587 1.472 6.699 1.00 0.00 H new ATOM 0 HA ALA A 22 -15.614 1.379 3.881 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -17.910 1.261 3.239 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -17.452 -0.160 4.208 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -18.416 1.145 4.941 1.00 0.00 H new ATOM 261 N ASP A 23 -15.451 3.861 4.358 1.00 0.00 N ATOM 262 CA ASP A 23 -15.339 5.316 4.323 1.00 0.00 C ATOM 263 C ASP A 23 -14.791 5.589 2.912 1.00 0.00 C ATOM 264 O ASP A 23 -14.262 4.651 2.294 1.00 0.00 O ATOM 265 CB ASP A 23 -14.449 5.851 5.459 1.00 0.00 C ATOM 266 CG ASP A 23 -15.172 5.790 6.806 1.00 0.00 C ATOM 267 OD1 ASP A 23 -15.926 6.732 7.110 1.00 0.00 O ATOM 268 OD2 ASP A 23 -15.033 4.783 7.548 1.00 0.00 O ATOM 0 H ASP A 23 -14.610 3.413 3.994 1.00 0.00 H new ATOM 0 HA ASP A 23 -16.282 5.835 4.494 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -13.530 5.267 5.510 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -14.161 6.880 5.245 1.00 0.00 H new ATOM 273 N ARG A 24 -14.962 6.799 2.359 1.00 0.00 N ATOM 274 CA ARG A 24 -14.489 7.169 1.015 1.00 0.00 C ATOM 275 C ARG A 24 -13.939 8.586 1.098 1.00 0.00 C ATOM 276 O ARG A 24 -14.738 9.518 1.085 1.00 0.00 O ATOM 277 CB ARG A 24 -15.608 6.997 -0.015 1.00 0.00 C ATOM 278 CG ARG A 24 -15.944 5.508 -0.150 1.00 0.00 C ATOM 279 CD ARG A 24 -16.608 5.197 -1.477 1.00 0.00 C ATOM 280 NE ARG A 24 -18.061 5.391 -1.465 1.00 0.00 N ATOM 281 CZ ARG A 24 -18.908 4.856 -2.349 1.00 0.00 C ATOM 282 NH1 ARG A 24 -18.441 4.090 -3.331 1.00 0.00 N ATOM 283 NH2 ARG A 24 -20.215 5.054 -2.227 1.00 0.00 N ATOM 0 H ARG A 24 -15.440 7.561 2.840 1.00 0.00 H new ATOM 0 HA ARG A 24 -13.689 6.512 0.674 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -16.492 7.555 0.294 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -15.297 7.401 -0.979 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -15.031 4.920 -0.054 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -16.603 5.209 0.665 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -16.172 5.830 -2.250 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -16.390 4.165 -1.750 1.00 0.00 H new ATOM 0 HE ARG A 24 -18.454 5.977 -0.728 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -17.439 3.913 -3.407 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -19.084 3.680 -4.008 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -20.576 5.616 -1.456 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -20.858 4.644 -2.904 1.00 0.00 H new ATOM 297 N LEU A 25 -12.620 8.788 1.177 1.00 0.00 N ATOM 298 CA LEU A 25 -12.041 10.133 1.322 1.00 0.00 C ATOM 299 C LEU A 25 -11.238 10.604 0.121 1.00 0.00 C ATOM 300 O LEU A 25 -10.514 9.841 -0.514 1.00 0.00 O ATOM 301 CB LEU A 25 -11.267 10.297 2.648 1.00 0.00 C ATOM 302 CG LEU A 25 -10.616 9.057 3.283 1.00 0.00 C ATOM 303 CD1 LEU A 25 -9.599 8.373 2.373 1.00 0.00 C ATOM 304 CD2 LEU A 25 -9.911 9.521 4.559 1.00 0.00 C ATOM 0 H LEU A 25 -11.930 8.038 1.143 1.00 0.00 H new ATOM 0 HA LEU A 25 -12.899 10.804 1.363 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -10.481 11.034 2.483 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -11.953 10.721 3.381 1.00 0.00 H new ATOM 0 HG LEU A 25 -11.397 8.322 3.477 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -9.179 7.506 2.884 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -10.091 8.050 1.455 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -8.800 9.073 2.129 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -9.434 8.668 5.042 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -9.155 10.265 4.307 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -10.641 9.961 5.238 1.00 0.00 H new ATOM 316 N ASP A 26 -11.303 11.911 -0.122 1.00 0.00 N ATOM 317 CA ASP A 26 -10.681 12.641 -1.214 1.00 0.00 C ATOM 318 C ASP A 26 -10.188 13.962 -0.675 1.00 0.00 C ATOM 319 O ASP A 26 -10.975 14.773 -0.196 1.00 0.00 O ATOM 320 CB ASP A 26 -11.783 12.889 -2.273 1.00 0.00 C ATOM 321 CG ASP A 26 -12.481 11.630 -2.815 1.00 0.00 C ATOM 322 OD1 ASP A 26 -11.902 10.835 -3.589 1.00 0.00 O ATOM 323 OD2 ASP A 26 -13.679 11.429 -2.480 1.00 0.00 O ATOM 0 H ASP A 26 -11.834 12.531 0.489 1.00 0.00 H new ATOM 0 HA ASP A 26 -9.846 12.093 -1.650 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -12.539 13.543 -1.838 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -11.341 13.427 -3.112 1.00 0.00 H new ATOM 328 N GLY A 27 -8.871 14.156 -0.704 1.00 0.00 N ATOM 329 CA GLY A 27 -8.259 15.380 -0.233 1.00 0.00 C ATOM 330 C GLY A 27 -8.568 16.479 -1.237 1.00 0.00 C ATOM 331 O GLY A 27 -9.382 17.357 -0.958 1.00 0.00 O ATOM 0 H GLY A 27 -8.206 13.466 -1.055 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -8.645 15.644 0.751 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -7.182 15.251 -0.129 1.00 0.00 H new ATOM 335 N GLY A 28 -7.958 16.419 -2.419 1.00 0.00 N ATOM 336 CA GLY A 28 -8.140 17.415 -3.475 1.00 0.00 C ATOM 337 C GLY A 28 -6.830 17.990 -4.031 1.00 0.00 C ATOM 338 O GLY A 28 -6.511 17.704 -5.187 1.00 0.00 O ATOM 0 H GLY A 28 -7.316 15.669 -2.674 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -8.701 16.963 -4.293 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -8.747 18.233 -3.087 1.00 0.00 H new ATOM 342 N ALA A 29 -6.136 18.872 -3.296 1.00 0.00 N ATOM 343 CA ALA A 29 -4.873 19.486 -3.736 1.00 0.00 C ATOM 344 C ALA A 29 -3.646 18.756 -3.153 1.00 0.00 C ATOM 345 O ALA A 29 -3.657 17.532 -3.075 1.00 0.00 O ATOM 346 CB ALA A 29 -4.888 20.988 -3.436 1.00 0.00 C ATOM 0 H ALA A 29 -6.438 19.182 -2.372 1.00 0.00 H new ATOM 0 HA ALA A 29 -4.783 19.375 -4.817 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -3.949 21.434 -3.765 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -5.718 21.457 -3.965 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -5.008 21.144 -2.364 1.00 0.00 H new ATOM 352 N GLY A 30 -2.558 19.476 -2.840 1.00 0.00 N ATOM 353 CA GLY A 30 -1.308 18.983 -2.278 1.00 0.00 C ATOM 354 C GLY A 30 -1.157 19.213 -0.773 1.00 0.00 C ATOM 355 O GLY A 30 -1.920 19.950 -0.146 1.00 0.00 O ATOM 0 H GLY A 30 -2.535 20.485 -2.986 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -1.230 17.915 -2.480 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -0.477 19.466 -2.792 1.00 0.00 H new ATOM 359 N ASP A 31 -0.101 18.585 -0.247 1.00 0.00 N ATOM 360 CA ASP A 31 0.399 18.529 1.115 1.00 0.00 C ATOM 361 C ASP A 31 -0.670 18.203 2.167 1.00 0.00 C ATOM 362 O ASP A 31 -0.731 18.735 3.277 1.00 0.00 O ATOM 363 CB ASP A 31 1.360 19.701 1.277 1.00 0.00 C ATOM 364 CG ASP A 31 1.738 20.158 2.690 1.00 0.00 C ATOM 365 OD1 ASP A 31 2.068 19.336 3.586 1.00 0.00 O ATOM 366 OD2 ASP A 31 1.868 21.378 2.899 1.00 0.00 O ATOM 0 H ASP A 31 0.499 18.031 -0.858 1.00 0.00 H new ATOM 0 HA ASP A 31 1.006 17.650 1.331 1.00 0.00 H new ATOM 0 HB2 ASP A 31 2.282 19.446 0.755 1.00 0.00 H new ATOM 0 HB3 ASP A 31 0.927 20.556 0.759 1.00 0.00 H new ATOM 371 N ASP A 32 -1.478 17.206 1.818 1.00 0.00 N ATOM 372 CA ASP A 32 -2.562 16.616 2.607 1.00 0.00 C ATOM 373 C ASP A 32 -2.029 15.308 3.197 1.00 0.00 C ATOM 374 O ASP A 32 -0.926 14.841 2.865 1.00 0.00 O ATOM 375 CB ASP A 32 -3.845 16.272 1.838 1.00 0.00 C ATOM 376 CG ASP A 32 -4.506 17.435 1.118 1.00 0.00 C ATOM 377 OD1 ASP A 32 -5.081 18.300 1.813 1.00 0.00 O ATOM 378 OD2 ASP A 32 -4.498 17.392 -0.136 1.00 0.00 O ATOM 0 H ASP A 32 -1.388 16.753 0.908 1.00 0.00 H new ATOM 0 HA ASP A 32 -2.844 17.372 3.339 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -3.613 15.498 1.106 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -4.564 15.844 2.537 1.00 0.00 H new ATOM 383 N ILE A 33 -2.763 14.781 4.170 1.00 0.00 N ATOM 384 CA ILE A 33 -2.429 13.520 4.847 1.00 0.00 C ATOM 385 C ILE A 33 -3.737 12.728 5.026 1.00 0.00 C ATOM 386 O ILE A 33 -4.490 12.974 5.969 1.00 0.00 O ATOM 387 CB ILE A 33 -1.551 13.789 6.110 1.00 0.00 C ATOM 388 CG1 ILE A 33 -1.705 12.832 7.309 1.00 0.00 C ATOM 389 CG2 ILE A 33 -1.556 15.252 6.581 1.00 0.00 C ATOM 390 CD1 ILE A 33 -1.286 11.401 6.976 1.00 0.00 C ATOM 0 H ILE A 33 -3.617 15.217 4.519 1.00 0.00 H new ATOM 0 HA ILE A 33 -1.780 12.869 4.261 1.00 0.00 H new ATOM 0 HB ILE A 33 -0.567 13.554 5.703 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -1.104 13.198 8.141 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -2.743 12.835 7.640 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -0.922 15.353 7.462 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -1.175 15.892 5.785 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -2.574 15.550 6.830 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -1.415 10.770 7.856 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -1.904 11.021 6.163 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -0.239 11.390 6.672 1.00 0.00 H new ATOM 402 N LEU A 34 -4.049 11.775 4.137 1.00 0.00 N ATOM 403 CA LEU A 34 -5.287 10.983 4.187 1.00 0.00 C ATOM 404 C LEU A 34 -4.997 9.486 4.334 1.00 0.00 C ATOM 405 O LEU A 34 -3.987 8.979 3.854 1.00 0.00 O ATOM 406 CB LEU A 34 -6.262 11.394 3.060 1.00 0.00 C ATOM 407 CG LEU A 34 -5.689 11.194 1.667 1.00 0.00 C ATOM 408 CD1 LEU A 34 -6.133 9.842 1.117 1.00 0.00 C ATOM 409 CD2 LEU A 34 -6.184 12.325 0.753 1.00 0.00 C ATOM 0 H LEU A 34 -3.443 11.529 3.354 1.00 0.00 H new ATOM 0 HA LEU A 34 -5.835 11.219 5.099 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -7.180 10.814 3.154 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -6.532 12.442 3.187 1.00 0.00 H new ATOM 0 HG LEU A 34 -4.600 11.214 1.710 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -5.720 9.702 0.118 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -5.775 9.048 1.772 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -7.221 9.809 1.068 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -5.777 12.188 -0.249 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -7.273 12.306 0.708 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -5.854 13.285 1.151 1.00 0.00 H new ATOM 421 N ASP A 35 -5.904 8.748 4.979 1.00 0.00 N ATOM 422 CA ASP A 35 -5.790 7.322 5.246 1.00 0.00 C ATOM 423 C ASP A 35 -7.146 6.641 5.189 1.00 0.00 C ATOM 424 O ASP A 35 -8.045 6.991 5.952 1.00 0.00 O ATOM 425 CB ASP A 35 -5.111 7.177 6.610 1.00 0.00 C ATOM 426 CG ASP A 35 -5.804 6.361 7.710 1.00 0.00 C ATOM 427 OD1 ASP A 35 -6.134 5.178 7.508 1.00 0.00 O ATOM 428 OD2 ASP A 35 -5.836 6.873 8.865 1.00 0.00 O ATOM 0 H ASP A 35 -6.769 9.148 5.341 1.00 0.00 H new ATOM 0 HA ASP A 35 -5.190 6.825 4.484 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -4.129 6.734 6.442 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -4.945 8.180 7.002 1.00 0.00 H new ATOM 433 N GLY A 36 -7.293 5.676 4.280 1.00 0.00 N ATOM 434 CA GLY A 36 -8.529 4.929 4.084 1.00 0.00 C ATOM 435 C GLY A 36 -8.845 3.950 5.207 1.00 0.00 C ATOM 436 O GLY A 36 -10.022 3.721 5.503 1.00 0.00 O ATOM 0 H GLY A 36 -6.543 5.390 3.651 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -9.355 5.633 3.986 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.465 4.380 3.144 1.00 0.00 H new ATOM 440 N GLY A 37 -7.819 3.385 5.842 1.00 0.00 N ATOM 441 CA GLY A 37 -7.959 2.427 6.925 1.00 0.00 C ATOM 442 C GLY A 37 -8.252 1.019 6.411 1.00 0.00 C ATOM 443 O GLY A 37 -8.620 0.850 5.246 1.00 0.00 O ATOM 0 H GLY A 37 -6.847 3.589 5.608 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -7.044 2.413 7.517 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -8.763 2.745 7.588 1.00 0.00 H new ATOM 447 N ALA A 38 -8.125 0.007 7.280 1.00 0.00 N ATOM 448 CA ALA A 38 -8.365 -1.385 6.911 1.00 0.00 C ATOM 449 C ALA A 38 -9.837 -1.601 6.543 1.00 0.00 C ATOM 450 O ALA A 38 -10.701 -1.770 7.411 1.00 0.00 O ATOM 451 CB ALA A 38 -7.953 -2.300 8.070 1.00 0.00 C ATOM 0 H ALA A 38 -7.854 0.135 8.255 1.00 0.00 H new ATOM 0 HA ALA A 38 -7.764 -1.631 6.035 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -8.132 -3.339 7.795 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -6.894 -2.159 8.286 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -8.540 -2.053 8.955 1.00 0.00 H new ATOM 457 N GLY A 39 -10.079 -1.767 5.249 1.00 0.00 N ATOM 458 CA GLY A 39 -11.349 -1.965 4.620 1.00 0.00 C ATOM 459 C GLY A 39 -11.233 -1.541 3.161 1.00 0.00 C ATOM 460 O GLY A 39 -10.234 -0.947 2.757 1.00 0.00 O ATOM 0 H GLY A 39 -9.319 -1.764 4.569 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -11.647 -3.011 4.689 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -12.118 -1.380 5.125 1.00 0.00 H new ATOM 464 N ARG A 40 -12.213 -1.885 2.322 1.00 0.00 N ATOM 465 CA ARG A 40 -12.168 -1.497 0.925 1.00 0.00 C ATOM 466 C ARG A 40 -12.693 -0.076 0.789 1.00 0.00 C ATOM 467 O ARG A 40 -13.905 0.157 0.691 1.00 0.00 O ATOM 468 CB ARG A 40 -12.896 -2.522 0.054 1.00 0.00 C ATOM 469 CG ARG A 40 -14.266 -3.039 0.529 1.00 0.00 C ATOM 470 CD ARG A 40 -14.079 -4.454 1.097 1.00 0.00 C ATOM 471 NE ARG A 40 -15.330 -5.140 1.451 1.00 0.00 N ATOM 472 CZ ARG A 40 -16.203 -5.674 0.593 1.00 0.00 C ATOM 473 NH1 ARG A 40 -16.055 -5.507 -0.716 1.00 0.00 N ATOM 474 NH2 ARG A 40 -17.222 -6.391 1.041 1.00 0.00 N ATOM 0 H ARG A 40 -13.036 -2.426 2.589 1.00 0.00 H new ATOM 0 HA ARG A 40 -11.141 -1.493 0.559 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -13.030 -2.083 -0.935 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -12.239 -3.383 -0.066 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -14.679 -2.376 1.290 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -14.974 -3.053 -0.299 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -13.543 -5.058 0.365 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -13.448 -4.395 1.984 1.00 0.00 H new ATOM 0 HE ARG A 40 -15.552 -5.215 2.444 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -15.268 -4.966 -1.075 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -16.728 -5.919 -1.362 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -17.342 -6.537 2.043 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -17.887 -6.798 0.384 1.00 0.00 H new ATOM 488 N ASP A 41 -11.774 0.876 0.733 1.00 0.00 N ATOM 489 CA ASP A 41 -12.038 2.301 0.581 1.00 0.00 C ATOM 490 C ASP A 41 -11.808 2.643 -0.879 1.00 0.00 C ATOM 491 O ASP A 41 -11.354 1.823 -1.688 1.00 0.00 O ATOM 492 CB ASP A 41 -11.177 3.156 1.524 1.00 0.00 C ATOM 493 CG ASP A 41 -10.888 4.620 1.165 1.00 0.00 C ATOM 494 OD1 ASP A 41 -11.838 5.351 0.825 1.00 0.00 O ATOM 495 OD2 ASP A 41 -9.730 5.040 1.295 1.00 0.00 O ATOM 0 H ASP A 41 -10.777 0.668 0.795 1.00 0.00 H new ATOM 0 HA ASP A 41 -13.067 2.527 0.863 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -11.658 3.148 2.502 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -10.217 2.652 1.637 1.00 0.00 H new ATOM 500 N ARG A 42 -12.356 3.778 -1.251 1.00 0.00 N ATOM 501 CA ARG A 42 -12.272 4.375 -2.554 1.00 0.00 C ATOM 502 C ARG A 42 -11.733 5.786 -2.336 1.00 0.00 C ATOM 503 O ARG A 42 -12.504 6.706 -2.050 1.00 0.00 O ATOM 504 CB ARG A 42 -13.658 4.349 -3.179 1.00 0.00 C ATOM 505 CG ARG A 42 -13.492 4.704 -4.655 1.00 0.00 C ATOM 506 CD ARG A 42 -14.726 4.917 -5.531 1.00 0.00 C ATOM 507 NE ARG A 42 -14.307 5.758 -6.666 1.00 0.00 N ATOM 508 CZ ARG A 42 -14.927 5.989 -7.823 1.00 0.00 C ATOM 509 NH1 ARG A 42 -16.040 5.350 -8.152 1.00 0.00 N ATOM 510 NH2 ARG A 42 -14.422 6.887 -8.654 1.00 0.00 N ATOM 0 H ARG A 42 -12.908 4.341 -0.604 1.00 0.00 H new ATOM 0 HA ARG A 42 -11.610 3.847 -3.240 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -14.112 3.364 -3.068 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -14.317 5.061 -2.683 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -12.897 5.616 -4.705 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -12.900 3.912 -5.115 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -15.119 3.963 -5.882 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -15.522 5.401 -4.965 1.00 0.00 H new ATOM 0 HE ARG A 42 -13.412 6.233 -6.549 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -16.441 4.663 -7.514 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -16.495 5.545 -9.044 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -13.571 7.390 -8.405 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -14.884 7.076 -9.543 1.00 0.00 H new ATOM 524 N LEU A 43 -10.441 5.978 -2.578 1.00 0.00 N ATOM 525 CA LEU A 43 -9.769 7.247 -2.398 1.00 0.00 C ATOM 526 C LEU A 43 -9.303 7.858 -3.718 1.00 0.00 C ATOM 527 O LEU A 43 -9.153 7.157 -4.720 1.00 0.00 O ATOM 528 CB LEU A 43 -8.554 7.029 -1.489 1.00 0.00 C ATOM 529 CG LEU A 43 -7.558 5.911 -1.873 1.00 0.00 C ATOM 530 CD1 LEU A 43 -6.116 6.431 -1.810 1.00 0.00 C ATOM 531 CD2 LEU A 43 -7.673 4.737 -0.909 1.00 0.00 C ATOM 0 H LEU A 43 -9.824 5.237 -2.911 1.00 0.00 H new ATOM 0 HA LEU A 43 -10.481 7.943 -1.953 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -8.001 7.967 -1.438 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -8.921 6.820 -0.484 1.00 0.00 H new ATOM 0 HG LEU A 43 -7.800 5.591 -2.886 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -5.428 5.631 -2.083 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -5.999 7.263 -2.504 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.895 6.769 -0.798 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.964 3.960 -1.196 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -7.452 5.075 0.104 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -8.686 4.335 -0.944 1.00 0.00 H new ATOM 543 N SER A 44 -9.127 9.174 -3.745 1.00 0.00 N ATOM 544 CA SER A 44 -8.641 9.937 -4.891 1.00 0.00 C ATOM 545 C SER A 44 -7.921 11.133 -4.275 1.00 0.00 C ATOM 546 O SER A 44 -8.600 12.070 -3.838 1.00 0.00 O ATOM 547 CB SER A 44 -9.754 10.360 -5.867 1.00 0.00 C ATOM 548 OG SER A 44 -10.993 9.699 -5.689 1.00 0.00 O ATOM 0 H SER A 44 -9.327 9.763 -2.937 1.00 0.00 H new ATOM 0 HA SER A 44 -7.983 9.333 -5.516 1.00 0.00 H new ATOM 0 HB2 SER A 44 -9.915 11.433 -5.767 1.00 0.00 H new ATOM 0 HB3 SER A 44 -9.409 10.183 -6.886 1.00 0.00 H new ATOM 0 HG SER A 44 -11.576 10.244 -5.120 1.00 0.00 H new ATOM 554 N GLY A 45 -6.591 11.082 -4.164 1.00 0.00 N ATOM 555 CA GLY A 45 -5.792 12.149 -3.583 1.00 0.00 C ATOM 556 C GLY A 45 -6.089 13.431 -4.332 1.00 0.00 C ATOM 557 O GLY A 45 -6.709 14.346 -3.790 1.00 0.00 O ATOM 0 H GLY A 45 -6.038 10.286 -4.481 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -6.026 12.265 -2.525 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -4.731 11.908 -3.650 1.00 0.00 H new ATOM 561 N GLY A 46 -5.792 13.449 -5.628 1.00 0.00 N ATOM 562 CA GLY A 46 -6.012 14.616 -6.469 1.00 0.00 C ATOM 563 C GLY A 46 -4.692 15.178 -6.969 1.00 0.00 C ATOM 564 O GLY A 46 -3.681 14.470 -7.004 1.00 0.00 O ATOM 0 H GLY A 46 -5.391 12.652 -6.123 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -6.641 14.345 -7.317 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -6.547 15.380 -5.905 1.00 0.00 H new ATOM 568 N ALA A 47 -4.722 16.423 -7.445 1.00 0.00 N ATOM 569 CA ALA A 47 -3.524 17.066 -7.956 1.00 0.00 C ATOM 570 C ALA A 47 -2.738 17.670 -6.794 1.00 0.00 C ATOM 571 O ALA A 47 -3.008 18.793 -6.353 1.00 0.00 O ATOM 572 CB ALA A 47 -3.921 18.133 -8.984 1.00 0.00 C ATOM 0 H ALA A 47 -5.562 17.000 -7.485 1.00 0.00 H new ATOM 0 HA ALA A 47 -2.884 16.337 -8.453 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -3.024 18.618 -9.370 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -4.462 17.663 -9.806 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -4.560 18.877 -8.508 1.00 0.00 H new ATOM 578 N GLY A 48 -1.665 17.001 -6.384 1.00 0.00 N ATOM 579 CA GLY A 48 -0.825 17.469 -5.301 1.00 0.00 C ATOM 580 C GLY A 48 0.011 16.347 -4.704 1.00 0.00 C ATOM 581 O GLY A 48 -0.109 15.195 -5.120 1.00 0.00 O ATOM 0 H GLY A 48 -1.358 16.120 -6.797 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -0.166 18.257 -5.667 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -1.448 17.910 -4.523 1.00 0.00 H new ATOM 585 N ALA A 49 0.895 16.700 -3.768 1.00 0.00 N ATOM 586 CA ALA A 49 1.786 15.764 -3.101 1.00 0.00 C ATOM 587 C ALA A 49 1.153 15.244 -1.802 1.00 0.00 C ATOM 588 O ALA A 49 1.454 15.763 -0.721 1.00 0.00 O ATOM 589 CB ALA A 49 3.137 16.447 -2.850 1.00 0.00 C ATOM 0 H ALA A 49 1.009 17.663 -3.451 1.00 0.00 H new ATOM 0 HA ALA A 49 1.953 14.896 -3.738 1.00 0.00 H new ATOM 0 HB1 ALA A 49 3.810 15.750 -2.350 1.00 0.00 H new ATOM 0 HB2 ALA A 49 3.573 16.752 -3.801 1.00 0.00 H new ATOM 0 HB3 ALA A 49 2.990 17.324 -2.220 1.00 0.00 H new ATOM 595 N ASP A 50 0.263 14.263 -1.911 1.00 0.00 N ATOM 596 CA ASP A 50 -0.431 13.629 -0.782 1.00 0.00 C ATOM 597 C ASP A 50 0.479 12.655 -0.046 1.00 0.00 C ATOM 598 O ASP A 50 1.593 12.338 -0.479 1.00 0.00 O ATOM 599 CB ASP A 50 -1.718 12.929 -1.221 1.00 0.00 C ATOM 600 CG ASP A 50 -2.620 12.416 -0.094 1.00 0.00 C ATOM 601 OD1 ASP A 50 -2.626 13.010 1.011 1.00 0.00 O ATOM 602 OD2 ASP A 50 -3.320 11.425 -0.338 1.00 0.00 O ATOM 0 H ASP A 50 -0.008 13.871 -2.813 1.00 0.00 H new ATOM 0 HA ASP A 50 -0.706 14.429 -0.094 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -2.294 13.622 -1.834 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -1.451 12.086 -1.858 1.00 0.00 H new ATOM 607 N THR A 51 0.037 12.262 1.135 1.00 0.00 N ATOM 608 CA THR A 51 0.715 11.340 2.038 1.00 0.00 C ATOM 609 C THR A 51 -0.306 10.268 2.478 1.00 0.00 C ATOM 610 O THR A 51 -1.073 10.491 3.422 1.00 0.00 O ATOM 611 CB THR A 51 1.370 12.119 3.201 1.00 0.00 C ATOM 612 OG1 THR A 51 1.614 13.479 2.881 1.00 0.00 O ATOM 613 CG2 THR A 51 2.727 11.505 3.566 1.00 0.00 C ATOM 0 H THR A 51 -0.851 12.593 1.513 1.00 0.00 H new ATOM 0 HA THR A 51 1.539 10.821 1.548 1.00 0.00 H new ATOM 0 HB THR A 51 0.663 12.058 4.028 1.00 0.00 H new ATOM 0 HG1 THR A 51 0.767 13.972 2.882 1.00 0.00 H new ATOM 0 HG21 THR A 51 3.172 12.068 4.387 1.00 0.00 H new ATOM 0 HG22 THR A 51 2.587 10.468 3.871 1.00 0.00 H new ATOM 0 HG23 THR A 51 3.388 11.542 2.700 1.00 0.00 H new ATOM 621 N PHE A 52 -0.326 9.091 1.835 1.00 0.00 N ATOM 622 CA PHE A 52 -1.276 8.014 2.129 1.00 0.00 C ATOM 623 C PHE A 52 -0.800 7.071 3.239 1.00 0.00 C ATOM 624 O PHE A 52 0.174 6.349 3.017 1.00 0.00 O ATOM 625 CB PHE A 52 -1.550 7.163 0.869 1.00 0.00 C ATOM 626 CG PHE A 52 -1.950 7.888 -0.395 1.00 0.00 C ATOM 627 CD1 PHE A 52 -3.271 8.329 -0.580 1.00 0.00 C ATOM 628 CD2 PHE A 52 -1.021 8.037 -1.440 1.00 0.00 C ATOM 629 CE1 PHE A 52 -3.640 8.963 -1.782 1.00 0.00 C ATOM 630 CE2 PHE A 52 -1.395 8.654 -2.639 1.00 0.00 C ATOM 631 CZ PHE A 52 -2.688 9.161 -2.794 1.00 0.00 C ATOM 0 H PHE A 52 0.327 8.860 1.086 1.00 0.00 H new ATOM 0 HA PHE A 52 -2.183 8.515 2.468 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -0.652 6.584 0.654 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.338 6.450 1.111 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -4.004 8.182 0.200 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -0.012 7.673 -1.316 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -4.657 9.297 -1.925 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -0.683 8.739 -3.446 1.00 0.00 H new ATOM 0 HZ PHE A 52 -2.954 9.703 -3.689 1.00 0.00 H new ATOM 641 N VAL A 53 -1.438 7.029 4.418 1.00 0.00 N ATOM 642 CA VAL A 53 -0.980 6.081 5.458 1.00 0.00 C ATOM 643 C VAL A 53 -1.666 4.714 5.242 1.00 0.00 C ATOM 644 O VAL A 53 -2.893 4.623 5.349 1.00 0.00 O ATOM 645 CB VAL A 53 -1.224 6.539 6.916 1.00 0.00 C ATOM 646 CG1 VAL A 53 -0.384 5.673 7.874 1.00 0.00 C ATOM 647 CG2 VAL A 53 -0.890 8.001 7.207 1.00 0.00 C ATOM 0 H VAL A 53 -2.237 7.609 4.674 1.00 0.00 H new ATOM 0 HA VAL A 53 0.102 6.020 5.340 1.00 0.00 H new ATOM 0 HB VAL A 53 -2.297 6.424 7.067 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -0.556 5.995 8.901 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -0.674 4.628 7.769 1.00 0.00 H new ATOM 0 HG13 VAL A 53 0.673 5.782 7.631 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -1.096 8.220 8.255 1.00 0.00 H new ATOM 0 HG22 VAL A 53 0.165 8.182 6.999 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -1.500 8.646 6.575 1.00 0.00 H new ATOM 657 N PHE A 54 -0.906 3.639 5.005 1.00 0.00 N ATOM 658 CA PHE A 54 -1.412 2.275 4.810 1.00 0.00 C ATOM 659 C PHE A 54 -0.502 1.319 5.557 1.00 0.00 C ATOM 660 O PHE A 54 0.566 0.989 5.045 1.00 0.00 O ATOM 661 CB PHE A 54 -1.523 1.922 3.322 1.00 0.00 C ATOM 662 CG PHE A 54 -2.596 2.673 2.560 1.00 0.00 C ATOM 663 CD1 PHE A 54 -3.934 2.650 3.005 1.00 0.00 C ATOM 664 CD2 PHE A 54 -2.271 3.339 1.365 1.00 0.00 C ATOM 665 CE1 PHE A 54 -4.939 3.291 2.262 1.00 0.00 C ATOM 666 CE2 PHE A 54 -3.277 3.980 0.625 1.00 0.00 C ATOM 667 CZ PHE A 54 -4.606 3.964 1.075 1.00 0.00 C ATOM 0 H PHE A 54 0.110 3.696 4.942 1.00 0.00 H new ATOM 0 HA PHE A 54 -2.423 2.195 5.210 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -0.561 2.113 2.847 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -1.716 0.853 3.232 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -4.187 2.137 3.921 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -1.249 3.357 1.017 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -5.964 3.266 2.602 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -3.027 4.488 -0.295 1.00 0.00 H new ATOM 0 HZ PHE A 54 -5.374 4.470 0.508 1.00 0.00 H new ATOM 677 N SER A 55 -0.866 0.876 6.768 1.00 0.00 N ATOM 678 CA SER A 55 0.020 -0.006 7.517 1.00 0.00 C ATOM 679 C SER A 55 -0.600 -1.099 8.406 1.00 0.00 C ATOM 680 O SER A 55 0.101 -1.604 9.299 1.00 0.00 O ATOM 681 CB SER A 55 0.988 0.905 8.287 1.00 0.00 C ATOM 682 OG SER A 55 0.378 1.517 9.406 1.00 0.00 O ATOM 0 H SER A 55 -1.743 1.109 7.234 1.00 0.00 H new ATOM 0 HA SER A 55 0.515 -0.641 6.782 1.00 0.00 H new ATOM 0 HB2 SER A 55 1.846 0.321 8.619 1.00 0.00 H new ATOM 0 HB3 SER A 55 1.368 1.676 7.617 1.00 0.00 H new ATOM 0 HG SER A 55 1.032 2.085 9.865 1.00 0.00 H new ATOM 688 N ALA A 56 -1.882 -1.450 8.254 1.00 0.00 N ATOM 689 CA ALA A 56 -2.476 -2.487 9.097 1.00 0.00 C ATOM 690 C ALA A 56 -2.385 -3.858 8.425 1.00 0.00 C ATOM 691 O ALA A 56 -2.152 -3.971 7.223 1.00 0.00 O ATOM 692 CB ALA A 56 -3.918 -2.108 9.462 1.00 0.00 C ATOM 0 H ALA A 56 -2.516 -1.039 7.568 1.00 0.00 H new ATOM 0 HA ALA A 56 -1.910 -2.558 10.026 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -4.351 -2.887 10.090 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -3.920 -1.162 10.004 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -4.509 -2.005 8.552 1.00 0.00 H new ATOM 698 N ARG A 57 -2.581 -4.932 9.200 1.00 0.00 N ATOM 699 CA ARG A 57 -2.542 -6.300 8.671 1.00 0.00 C ATOM 700 C ARG A 57 -3.618 -6.431 7.596 1.00 0.00 C ATOM 701 O ARG A 57 -3.350 -6.850 6.477 1.00 0.00 O ATOM 702 CB ARG A 57 -2.789 -7.335 9.785 1.00 0.00 C ATOM 703 CG ARG A 57 -1.546 -7.765 10.574 1.00 0.00 C ATOM 704 CD ARG A 57 -1.011 -6.708 11.536 1.00 0.00 C ATOM 705 NE ARG A 57 -0.127 -7.314 12.543 1.00 0.00 N ATOM 706 CZ ARG A 57 0.596 -6.646 13.443 1.00 0.00 C ATOM 707 NH1 ARG A 57 0.738 -5.329 13.373 1.00 0.00 N ATOM 708 NH2 ARG A 57 1.176 -7.301 14.440 1.00 0.00 N ATOM 0 H ARG A 57 -2.769 -4.878 10.201 1.00 0.00 H new ATOM 0 HA ARG A 57 -1.555 -6.493 8.251 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -3.517 -6.924 10.484 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -3.240 -8.222 9.340 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -1.784 -8.666 11.140 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -0.757 -8.030 9.870 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -0.466 -5.946 10.979 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -1.843 -6.207 12.031 1.00 0.00 H new ATOM 0 HE ARG A 57 -0.061 -8.332 12.554 1.00 0.00 H new ATOM 0 HH11 ARG A 57 0.290 -4.807 12.620 1.00 0.00 H new ATOM 0 HH12 ARG A 57 1.296 -4.838 14.072 1.00 0.00 H new ATOM 0 HH21 ARG A 57 1.068 -8.312 14.517 1.00 0.00 H new ATOM 0 HH22 ARG A 57 1.730 -6.793 15.130 1.00 0.00 H new ATOM 722 N GLU A 58 -4.835 -6.030 7.951 1.00 0.00 N ATOM 723 CA GLU A 58 -6.018 -6.060 7.102 1.00 0.00 C ATOM 724 C GLU A 58 -6.000 -4.920 6.066 1.00 0.00 C ATOM 725 O GLU A 58 -6.991 -4.687 5.389 1.00 0.00 O ATOM 726 CB GLU A 58 -7.250 -6.073 8.025 1.00 0.00 C ATOM 727 CG GLU A 58 -7.337 -7.422 8.771 1.00 0.00 C ATOM 728 CD GLU A 58 -8.335 -7.412 9.925 1.00 0.00 C ATOM 729 OE1 GLU A 58 -8.094 -6.673 10.910 1.00 0.00 O ATOM 730 OE2 GLU A 58 -9.285 -8.231 9.919 1.00 0.00 O ATOM 0 H GLU A 58 -5.031 -5.659 8.881 1.00 0.00 H new ATOM 0 HA GLU A 58 -6.046 -6.962 6.490 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -7.186 -5.255 8.742 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -8.155 -5.913 7.439 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -7.618 -8.202 8.064 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -6.350 -7.681 9.156 1.00 0.00 H new ATOM 737 N ASP A 59 -4.877 -4.213 5.921 1.00 0.00 N ATOM 738 CA ASP A 59 -4.638 -3.114 4.987 1.00 0.00 C ATOM 739 C ASP A 59 -3.357 -3.446 4.196 1.00 0.00 C ATOM 740 O ASP A 59 -2.611 -2.598 3.716 1.00 0.00 O ATOM 741 CB ASP A 59 -4.546 -1.842 5.816 1.00 0.00 C ATOM 742 CG ASP A 59 -4.156 -0.588 5.056 1.00 0.00 C ATOM 743 OD1 ASP A 59 -4.526 -0.440 3.868 1.00 0.00 O ATOM 744 OD2 ASP A 59 -3.484 0.224 5.725 1.00 0.00 O ATOM 0 H ASP A 59 -4.055 -4.408 6.493 1.00 0.00 H new ATOM 0 HA ASP A 59 -5.433 -2.971 4.255 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -5.511 -1.670 6.293 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -3.820 -2.002 6.614 1.00 0.00 H new ATOM 749 N SER A 60 -3.072 -4.742 4.059 1.00 0.00 N ATOM 750 CA SER A 60 -1.918 -5.272 3.353 1.00 0.00 C ATOM 751 C SER A 60 -2.319 -6.408 2.417 1.00 0.00 C ATOM 752 O SER A 60 -1.464 -6.875 1.660 1.00 0.00 O ATOM 753 CB SER A 60 -0.939 -5.826 4.406 1.00 0.00 C ATOM 754 OG SER A 60 0.310 -6.216 3.844 1.00 0.00 O ATOM 0 H SER A 60 -3.664 -5.473 4.453 1.00 0.00 H new ATOM 0 HA SER A 60 -1.466 -4.479 2.757 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.768 -5.069 5.171 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.393 -6.684 4.902 1.00 0.00 H new ATOM 0 HG SER A 60 0.183 -6.461 2.904 1.00 0.00 H new ATOM 760 N TYR A 61 -3.519 -6.975 2.553 1.00 0.00 N ATOM 761 CA TYR A 61 -3.982 -8.083 1.747 1.00 0.00 C ATOM 762 C TYR A 61 -5.478 -8.263 1.927 1.00 0.00 C ATOM 763 O TYR A 61 -6.121 -7.522 2.660 1.00 0.00 O ATOM 764 CB TYR A 61 -3.258 -9.345 2.245 1.00 0.00 C ATOM 765 CG TYR A 61 -3.165 -9.495 3.759 1.00 0.00 C ATOM 766 CD1 TYR A 61 -4.308 -9.816 4.520 1.00 0.00 C ATOM 767 CD2 TYR A 61 -1.913 -9.396 4.392 1.00 0.00 C ATOM 768 CE1 TYR A 61 -4.196 -10.082 5.895 1.00 0.00 C ATOM 769 CE2 TYR A 61 -1.796 -9.653 5.769 1.00 0.00 C ATOM 770 CZ TYR A 61 -2.934 -10.016 6.520 1.00 0.00 C ATOM 771 OH TYR A 61 -2.805 -10.342 7.832 1.00 0.00 O ATOM 0 H TYR A 61 -4.203 -6.663 3.243 1.00 0.00 H new ATOM 0 HA TYR A 61 -3.776 -7.900 0.692 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -3.770 -10.219 1.842 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -2.248 -9.349 1.834 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -5.276 -9.858 4.043 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -1.040 -9.122 3.819 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -5.073 -10.336 6.471 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -0.834 -9.573 6.253 1.00 0.00 H new ATOM 0 HH TYR A 61 -1.869 -10.243 8.103 1.00 0.00 H new ATOM 781 N ARG A 62 -6.023 -9.270 1.252 1.00 0.00 N ATOM 782 CA ARG A 62 -7.402 -9.716 1.313 1.00 0.00 C ATOM 783 C ARG A 62 -7.328 -11.153 1.823 1.00 0.00 C ATOM 784 O ARG A 62 -6.299 -11.819 1.651 1.00 0.00 O ATOM 785 CB ARG A 62 -8.117 -9.656 -0.041 1.00 0.00 C ATOM 786 CG ARG A 62 -7.368 -10.236 -1.251 1.00 0.00 C ATOM 787 CD ARG A 62 -8.355 -10.362 -2.418 1.00 0.00 C ATOM 788 NE ARG A 62 -7.767 -11.006 -3.600 1.00 0.00 N ATOM 789 CZ ARG A 62 -7.920 -12.273 -3.985 1.00 0.00 C ATOM 790 NH1 ARG A 62 -8.480 -13.173 -3.187 1.00 0.00 N ATOM 791 NH2 ARG A 62 -7.511 -12.619 -5.195 1.00 0.00 N ATOM 0 H ARG A 62 -5.471 -9.832 0.604 1.00 0.00 H new ATOM 0 HA ARG A 62 -7.986 -9.064 1.962 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -9.067 -10.182 0.054 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -8.350 -8.613 -0.255 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -6.535 -9.589 -1.527 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -6.946 -11.210 -1.004 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -9.223 -10.936 -2.092 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -8.713 -9.370 -2.692 1.00 0.00 H new ATOM 0 HE ARG A 62 -7.177 -10.420 -4.191 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -8.803 -12.901 -2.259 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -8.587 -14.137 -3.502 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -7.090 -11.922 -5.810 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -7.617 -13.582 -5.513 1.00 0.00 H new ATOM 805 N THR A 63 -8.415 -11.639 2.401 1.00 0.00 N ATOM 806 CA THR A 63 -8.505 -12.998 2.927 1.00 0.00 C ATOM 807 C THR A 63 -9.841 -13.589 2.485 1.00 0.00 C ATOM 808 O THR A 63 -10.665 -12.882 1.894 1.00 0.00 O ATOM 809 CB THR A 63 -8.295 -13.004 4.456 1.00 0.00 C ATOM 810 OG1 THR A 63 -9.006 -11.956 5.085 1.00 0.00 O ATOM 811 CG2 THR A 63 -6.812 -12.872 4.806 1.00 0.00 C ATOM 0 H THR A 63 -9.271 -11.097 2.521 1.00 0.00 H new ATOM 0 HA THR A 63 -7.712 -13.630 2.528 1.00 0.00 H new ATOM 0 HB THR A 63 -8.675 -13.959 4.820 1.00 0.00 H new ATOM 0 HG1 THR A 63 -9.694 -12.334 5.672 1.00 0.00 H new ATOM 0 HG21 THR A 63 -6.692 -12.879 5.889 1.00 0.00 H new ATOM 0 HG22 THR A 63 -6.261 -13.707 4.374 1.00 0.00 H new ATOM 0 HG23 THR A 63 -6.425 -11.936 4.404 1.00 0.00 H new ATOM 819 N ASP A 64 -10.052 -14.894 2.672 1.00 0.00 N ATOM 820 CA ASP A 64 -11.317 -15.534 2.296 1.00 0.00 C ATOM 821 C ASP A 64 -12.423 -14.955 3.180 1.00 0.00 C ATOM 822 O ASP A 64 -13.551 -14.756 2.722 1.00 0.00 O ATOM 823 CB ASP A 64 -11.256 -17.069 2.457 1.00 0.00 C ATOM 824 CG ASP A 64 -10.997 -17.834 1.152 1.00 0.00 C ATOM 825 OD1 ASP A 64 -11.328 -17.337 0.049 1.00 0.00 O ATOM 826 OD2 ASP A 64 -10.478 -18.968 1.226 1.00 0.00 O ATOM 0 H ASP A 64 -9.365 -15.528 3.081 1.00 0.00 H new ATOM 0 HA ASP A 64 -11.518 -15.333 1.244 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -10.470 -17.316 3.171 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -12.197 -17.415 2.886 1.00 0.00 H new ATOM 831 N THR A 65 -12.094 -14.663 4.445 1.00 0.00 N ATOM 832 CA THR A 65 -13.016 -14.099 5.413 1.00 0.00 C ATOM 833 C THR A 65 -13.533 -12.743 4.913 1.00 0.00 C ATOM 834 O THR A 65 -14.743 -12.506 4.957 1.00 0.00 O ATOM 835 CB THR A 65 -12.363 -14.060 6.802 1.00 0.00 C ATOM 836 OG1 THR A 65 -11.097 -13.424 6.804 1.00 0.00 O ATOM 837 CG2 THR A 65 -12.139 -15.473 7.351 1.00 0.00 C ATOM 0 H THR A 65 -11.159 -14.819 4.822 1.00 0.00 H new ATOM 0 HA THR A 65 -13.897 -14.732 5.520 1.00 0.00 H new ATOM 0 HB THR A 65 -13.060 -13.494 7.420 1.00 0.00 H new ATOM 0 HG1 THR A 65 -10.731 -13.427 7.713 1.00 0.00 H new ATOM 0 HG21 THR A 65 -11.675 -15.412 8.336 1.00 0.00 H new ATOM 0 HG22 THR A 65 -13.096 -15.988 7.432 1.00 0.00 H new ATOM 0 HG23 THR A 65 -11.486 -16.026 6.676 1.00 0.00 H new ATOM 845 N ALA A 66 -12.648 -11.847 4.464 1.00 0.00 N ATOM 846 CA ALA A 66 -13.032 -10.548 3.940 1.00 0.00 C ATOM 847 C ALA A 66 -11.912 -9.978 3.078 1.00 0.00 C ATOM 848 O ALA A 66 -10.725 -10.119 3.363 1.00 0.00 O ATOM 849 CB ALA A 66 -13.350 -9.570 5.074 1.00 0.00 C ATOM 0 H ALA A 66 -11.641 -12.011 4.457 1.00 0.00 H new ATOM 0 HA ALA A 66 -13.928 -10.682 3.334 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -13.635 -8.605 4.654 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -14.172 -9.962 5.672 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -12.470 -9.445 5.705 1.00 0.00 H new ATOM 855 N VAL A 67 -12.297 -9.284 2.021 1.00 0.00 N ATOM 856 CA VAL A 67 -11.475 -8.629 1.069 1.00 0.00 C ATOM 857 C VAL A 67 -11.278 -7.181 1.530 1.00 0.00 C ATOM 858 O VAL A 67 -12.221 -6.562 2.029 1.00 0.00 O ATOM 859 CB VAL A 67 -12.257 -8.737 -0.250 1.00 0.00 C ATOM 860 CG1 VAL A 67 -12.036 -10.101 -0.920 1.00 0.00 C ATOM 861 CG2 VAL A 67 -13.776 -8.472 -0.200 1.00 0.00 C ATOM 0 H VAL A 67 -13.287 -9.166 1.805 1.00 0.00 H new ATOM 0 HA VAL A 67 -10.480 -9.057 0.951 1.00 0.00 H new ATOM 0 HB VAL A 67 -11.835 -7.915 -0.828 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -12.602 -10.146 -1.850 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -10.976 -10.234 -1.134 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -12.373 -10.893 -0.252 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -14.198 -8.583 -1.199 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -14.248 -9.187 0.474 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -13.957 -7.459 0.160 1.00 0.00 H new ATOM 871 N PHE A 68 -10.091 -6.610 1.310 1.00 0.00 N ATOM 872 CA PHE A 68 -9.773 -5.235 1.689 1.00 0.00 C ATOM 873 C PHE A 68 -9.122 -4.517 0.496 1.00 0.00 C ATOM 874 O PHE A 68 -8.146 -3.786 0.642 1.00 0.00 O ATOM 875 CB PHE A 68 -8.919 -5.251 2.969 1.00 0.00 C ATOM 876 CG PHE A 68 -9.498 -6.080 4.112 1.00 0.00 C ATOM 877 CD1 PHE A 68 -10.756 -5.762 4.654 1.00 0.00 C ATOM 878 CD2 PHE A 68 -8.797 -7.186 4.627 1.00 0.00 C ATOM 879 CE1 PHE A 68 -11.293 -6.514 5.712 1.00 0.00 C ATOM 880 CE2 PHE A 68 -9.341 -7.960 5.663 1.00 0.00 C ATOM 881 CZ PHE A 68 -10.580 -7.611 6.219 1.00 0.00 C ATOM 0 H PHE A 68 -9.317 -7.097 0.859 1.00 0.00 H new ATOM 0 HA PHE A 68 -10.670 -4.664 1.929 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -7.929 -5.636 2.724 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -8.786 -4.225 3.313 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -11.316 -4.930 4.252 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -7.830 -7.442 4.220 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -12.251 -6.249 6.134 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -8.806 -8.823 6.032 1.00 0.00 H new ATOM 0 HZ PHE A 68 -10.986 -8.187 7.038 1.00 0.00 H new ATOM 891 N ASN A 69 -9.639 -4.782 -0.712 1.00 0.00 N ATOM 892 CA ASN A 69 -9.161 -4.209 -1.954 1.00 0.00 C ATOM 893 C ASN A 69 -9.445 -2.717 -2.049 1.00 0.00 C ATOM 894 O ASN A 69 -10.603 -2.320 -2.197 1.00 0.00 O ATOM 895 CB ASN A 69 -9.734 -4.949 -3.185 1.00 0.00 C ATOM 896 CG ASN A 69 -9.473 -4.238 -4.520 1.00 0.00 C ATOM 897 OD1 ASN A 69 -8.714 -4.706 -5.358 1.00 0.00 O ATOM 898 ND2 ASN A 69 -10.163 -3.144 -4.808 1.00 0.00 N ATOM 0 H ASN A 69 -10.423 -5.421 -0.843 1.00 0.00 H new ATOM 0 HA ASN A 69 -8.079 -4.339 -1.952 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -9.303 -5.949 -3.228 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -10.809 -5.071 -3.054 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -10.059 -2.701 -5.721 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -10.799 -2.745 -4.117 1.00 0.00 H new ATOM 905 N ASP A 70 -8.391 -1.916 -2.004 1.00 0.00 N ATOM 906 CA ASP A 70 -8.422 -0.460 -2.132 1.00 0.00 C ATOM 907 C ASP A 70 -8.592 -0.147 -3.636 1.00 0.00 C ATOM 908 O ASP A 70 -8.287 -0.989 -4.499 1.00 0.00 O ATOM 909 CB ASP A 70 -7.123 0.095 -1.488 1.00 0.00 C ATOM 910 CG ASP A 70 -6.476 1.329 -2.135 1.00 0.00 C ATOM 911 OD1 ASP A 70 -7.206 2.194 -2.651 1.00 0.00 O ATOM 912 OD2 ASP A 70 -5.223 1.393 -2.119 1.00 0.00 O ATOM 0 H ASP A 70 -7.446 -2.276 -1.871 1.00 0.00 H new ATOM 0 HA ASP A 70 -9.249 0.022 -1.611 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -7.341 0.337 -0.448 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -6.384 -0.706 -1.480 1.00 0.00 H new ATOM 917 N LEU A 71 -9.231 0.979 -3.957 1.00 0.00 N ATOM 918 CA LEU A 71 -9.455 1.456 -5.317 1.00 0.00 C ATOM 919 C LEU A 71 -9.085 2.930 -5.327 1.00 0.00 C ATOM 920 O LEU A 71 -9.846 3.767 -4.834 1.00 0.00 O ATOM 921 CB LEU A 71 -10.891 1.191 -5.796 1.00 0.00 C ATOM 922 CG LEU A 71 -11.224 1.841 -7.159 1.00 0.00 C ATOM 923 CD1 LEU A 71 -10.285 1.411 -8.297 1.00 0.00 C ATOM 924 CD2 LEU A 71 -12.654 1.454 -7.554 1.00 0.00 C ATOM 0 H LEU A 71 -9.619 1.604 -3.250 1.00 0.00 H new ATOM 0 HA LEU A 71 -8.833 0.912 -6.028 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -11.047 0.115 -5.870 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -11.589 1.564 -5.046 1.00 0.00 H new ATOM 0 HG LEU A 71 -11.104 2.916 -7.027 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -10.581 1.908 -9.221 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -9.261 1.689 -8.048 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -10.346 0.331 -8.430 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -12.901 1.907 -8.514 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -12.729 0.369 -7.634 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -13.350 1.811 -6.795 1.00 0.00 H new ATOM 936 N ILE A 72 -7.939 3.256 -5.917 1.00 0.00 N ATOM 937 CA ILE A 72 -7.438 4.617 -5.989 1.00 0.00 C ATOM 938 C ILE A 72 -7.787 5.211 -7.354 1.00 0.00 C ATOM 939 O ILE A 72 -7.645 4.521 -8.369 1.00 0.00 O ATOM 940 CB ILE A 72 -5.903 4.627 -5.813 1.00 0.00 C ATOM 941 CG1 ILE A 72 -5.367 3.692 -4.704 1.00 0.00 C ATOM 942 CG2 ILE A 72 -5.494 6.089 -5.552 1.00 0.00 C ATOM 943 CD1 ILE A 72 -3.854 3.469 -4.769 1.00 0.00 C ATOM 0 H ILE A 72 -7.328 2.572 -6.363 1.00 0.00 H new ATOM 0 HA ILE A 72 -7.895 5.207 -5.195 1.00 0.00 H new ATOM 0 HB ILE A 72 -5.454 4.229 -6.723 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -5.622 4.112 -3.731 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -5.871 2.729 -4.777 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -4.413 6.147 -5.421 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -5.790 6.707 -6.400 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -5.989 6.450 -4.650 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -3.549 2.803 -3.961 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -3.593 3.020 -5.727 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -3.341 4.425 -4.665 1.00 0.00 H new ATOM 955 N LEU A 73 -8.265 6.458 -7.396 1.00 0.00 N ATOM 956 CA LEU A 73 -8.594 7.161 -8.631 1.00 0.00 C ATOM 957 C LEU A 73 -7.539 8.235 -8.856 1.00 0.00 C ATOM 958 O LEU A 73 -7.365 9.124 -8.025 1.00 0.00 O ATOM 959 CB LEU A 73 -10.003 7.776 -8.642 1.00 0.00 C ATOM 960 CG LEU A 73 -10.982 7.155 -9.656 1.00 0.00 C ATOM 961 CD1 LEU A 73 -10.546 7.390 -11.104 1.00 0.00 C ATOM 962 CD2 LEU A 73 -11.239 5.659 -9.444 1.00 0.00 C ATOM 0 H LEU A 73 -8.436 7.013 -6.557 1.00 0.00 H new ATOM 0 HA LEU A 73 -8.597 6.431 -9.441 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -10.431 7.682 -7.644 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -9.915 8.842 -8.852 1.00 0.00 H new ATOM 0 HG LEU A 73 -11.920 7.678 -9.470 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -11.269 6.933 -11.780 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -10.493 8.461 -11.299 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -9.565 6.943 -11.266 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -11.939 5.299 -10.199 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -10.300 5.113 -9.530 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -11.662 5.499 -8.452 1.00 0.00 H new ATOM 974 N ASP A 74 -6.906 8.164 -10.016 1.00 0.00 N ATOM 975 CA ASP A 74 -5.866 9.018 -10.553 1.00 0.00 C ATOM 976 C ASP A 74 -4.742 9.242 -9.541 1.00 0.00 C ATOM 977 O ASP A 74 -4.700 10.254 -8.839 1.00 0.00 O ATOM 978 CB ASP A 74 -6.443 10.326 -11.108 1.00 0.00 C ATOM 979 CG ASP A 74 -7.744 10.181 -11.892 1.00 0.00 C ATOM 980 OD1 ASP A 74 -7.701 9.848 -13.104 1.00 0.00 O ATOM 981 OD2 ASP A 74 -8.816 10.466 -11.303 1.00 0.00 O ATOM 0 H ASP A 74 -7.137 7.421 -10.676 1.00 0.00 H new ATOM 0 HA ASP A 74 -5.413 8.501 -11.399 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -6.613 11.011 -10.277 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -5.697 10.788 -11.755 1.00 0.00 H new ATOM 986 N PHE A 75 -3.878 8.235 -9.405 1.00 0.00 N ATOM 987 CA PHE A 75 -2.718 8.272 -8.517 1.00 0.00 C ATOM 988 C PHE A 75 -1.561 8.830 -9.353 1.00 0.00 C ATOM 989 O PHE A 75 -1.491 8.521 -10.552 1.00 0.00 O ATOM 990 CB PHE A 75 -2.439 6.855 -8.009 1.00 0.00 C ATOM 991 CG PHE A 75 -1.258 6.674 -7.070 1.00 0.00 C ATOM 992 CD1 PHE A 75 0.054 6.656 -7.578 1.00 0.00 C ATOM 993 CD2 PHE A 75 -1.462 6.466 -5.693 1.00 0.00 C ATOM 994 CE1 PHE A 75 1.138 6.426 -6.713 1.00 0.00 C ATOM 995 CE2 PHE A 75 -0.381 6.211 -4.837 1.00 0.00 C ATOM 996 CZ PHE A 75 0.922 6.198 -5.346 1.00 0.00 C ATOM 0 H PHE A 75 -3.967 7.358 -9.917 1.00 0.00 H new ATOM 0 HA PHE A 75 -2.871 8.899 -7.639 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -3.334 6.496 -7.500 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -2.285 6.210 -8.874 1.00 0.00 H new ATOM 0 HD1 PHE A 75 0.228 6.819 -8.631 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -2.464 6.503 -5.291 1.00 0.00 H new ATOM 0 HE1 PHE A 75 2.145 6.425 -7.104 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -0.554 6.025 -3.787 1.00 0.00 H new ATOM 0 HZ PHE A 75 1.759 6.013 -4.689 1.00 0.00 H new ATOM 1006 N GLU A 76 -0.660 9.630 -8.781 1.00 0.00 N ATOM 1007 CA GLU A 76 0.460 10.207 -9.502 1.00 0.00 C ATOM 1008 C GLU A 76 1.701 10.211 -8.599 1.00 0.00 C ATOM 1009 O GLU A 76 1.953 11.172 -7.854 1.00 0.00 O ATOM 1010 CB GLU A 76 0.050 11.593 -10.033 1.00 0.00 C ATOM 1011 CG GLU A 76 0.448 11.824 -11.501 1.00 0.00 C ATOM 1012 CD GLU A 76 1.951 11.806 -11.801 1.00 0.00 C ATOM 1013 OE1 GLU A 76 2.707 10.982 -11.241 1.00 0.00 O ATOM 1014 OE2 GLU A 76 2.374 12.586 -12.686 1.00 0.00 O ATOM 0 H GLU A 76 -0.693 9.894 -7.796 1.00 0.00 H new ATOM 0 HA GLU A 76 0.730 9.612 -10.374 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -1.029 11.708 -9.934 1.00 0.00 H new ATOM 0 HB3 GLU A 76 0.510 12.363 -9.413 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -0.033 11.060 -12.112 1.00 0.00 H new ATOM 0 HG3 GLU A 76 0.046 12.786 -11.819 1.00 0.00 H new ATOM 1021 N ALA A 77 2.494 9.134 -8.694 1.00 0.00 N ATOM 1022 CA ALA A 77 3.719 8.932 -7.921 1.00 0.00 C ATOM 1023 C ALA A 77 4.727 10.069 -8.092 1.00 0.00 C ATOM 1024 O ALA A 77 5.710 10.121 -7.349 1.00 0.00 O ATOM 1025 CB ALA A 77 4.407 7.611 -8.293 1.00 0.00 C ATOM 0 H ALA A 77 2.292 8.361 -9.329 1.00 0.00 H new ATOM 0 HA ALA A 77 3.400 8.907 -6.879 1.00 0.00 H new ATOM 0 HB1 ALA A 77 5.314 7.493 -7.700 1.00 0.00 H new ATOM 0 HB2 ALA A 77 3.731 6.780 -8.092 1.00 0.00 H new ATOM 0 HB3 ALA A 77 4.665 7.621 -9.352 1.00 0.00 H new ATOM 1031 N SER A 78 4.573 10.930 -9.098 1.00 0.00 N ATOM 1032 CA SER A 78 5.481 12.052 -9.284 1.00 0.00 C ATOM 1033 C SER A 78 5.421 12.968 -8.045 1.00 0.00 C ATOM 1034 O SER A 78 6.477 13.393 -7.564 1.00 0.00 O ATOM 1035 CB SER A 78 5.164 12.793 -10.588 1.00 0.00 C ATOM 1036 OG SER A 78 6.255 13.626 -10.946 1.00 0.00 O ATOM 0 H SER A 78 3.829 10.869 -9.793 1.00 0.00 H new ATOM 0 HA SER A 78 6.505 11.691 -9.379 1.00 0.00 H new ATOM 0 HB2 SER A 78 4.965 12.076 -11.385 1.00 0.00 H new ATOM 0 HB3 SER A 78 4.262 13.392 -10.466 1.00 0.00 H new ATOM 0 HG SER A 78 6.048 14.096 -11.781 1.00 0.00 H new ATOM 1042 N GLU A 79 4.226 13.233 -7.493 1.00 0.00 N ATOM 1043 CA GLU A 79 4.030 14.093 -6.332 1.00 0.00 C ATOM 1044 C GLU A 79 3.728 13.342 -5.031 1.00 0.00 C ATOM 1045 O GLU A 79 4.375 13.621 -4.019 1.00 0.00 O ATOM 1046 CB GLU A 79 2.851 15.030 -6.606 1.00 0.00 C ATOM 1047 CG GLU A 79 2.971 15.923 -7.840 1.00 0.00 C ATOM 1048 CD GLU A 79 3.543 17.320 -7.555 1.00 0.00 C ATOM 1049 OE1 GLU A 79 2.980 18.086 -6.728 1.00 0.00 O ATOM 1050 OE2 GLU A 79 4.530 17.703 -8.227 1.00 0.00 O ATOM 0 H GLU A 79 3.356 12.843 -7.855 1.00 0.00 H new ATOM 0 HA GLU A 79 4.972 14.622 -6.189 1.00 0.00 H new ATOM 0 HB2 GLU A 79 1.950 14.426 -6.707 1.00 0.00 H new ATOM 0 HB3 GLU A 79 2.711 15.668 -5.734 1.00 0.00 H new ATOM 0 HG2 GLU A 79 3.606 15.426 -8.574 1.00 0.00 H new ATOM 0 HG3 GLU A 79 1.985 16.032 -8.293 1.00 0.00 H new ATOM 1057 N ASP A 80 2.722 12.462 -5.040 1.00 0.00 N ATOM 1058 CA ASP A 80 2.263 11.695 -3.879 1.00 0.00 C ATOM 1059 C ASP A 80 3.322 10.817 -3.198 1.00 0.00 C ATOM 1060 O ASP A 80 4.397 10.540 -3.743 1.00 0.00 O ATOM 1061 CB ASP A 80 0.951 10.965 -4.179 1.00 0.00 C ATOM 1062 CG ASP A 80 1.061 9.712 -5.044 1.00 0.00 C ATOM 1063 OD1 ASP A 80 1.912 8.847 -4.743 1.00 0.00 O ATOM 1064 OD2 ASP A 80 0.185 9.585 -5.933 1.00 0.00 O ATOM 0 H ASP A 80 2.187 12.258 -5.884 1.00 0.00 H new ATOM 0 HA ASP A 80 2.056 12.438 -3.109 1.00 0.00 H new ATOM 0 HB2 ASP A 80 0.488 10.688 -3.232 1.00 0.00 H new ATOM 0 HB3 ASP A 80 0.275 11.664 -4.672 1.00 0.00 H new ATOM 1069 N ARG A 81 3.017 10.408 -1.957 1.00 0.00 N ATOM 1070 CA ARG A 81 3.850 9.583 -1.086 1.00 0.00 C ATOM 1071 C ARG A 81 3.000 8.614 -0.277 1.00 0.00 C ATOM 1072 O ARG A 81 1.799 8.826 -0.118 1.00 0.00 O ATOM 1073 CB ARG A 81 4.623 10.477 -0.102 1.00 0.00 C ATOM 1074 CG ARG A 81 5.492 11.505 -0.823 1.00 0.00 C ATOM 1075 CD ARG A 81 6.770 11.841 -0.054 1.00 0.00 C ATOM 1076 NE ARG A 81 7.363 13.065 -0.599 1.00 0.00 N ATOM 1077 CZ ARG A 81 8.609 13.281 -1.019 1.00 0.00 C ATOM 1078 NH1 ARG A 81 9.563 12.364 -0.918 1.00 0.00 N ATOM 1079 NH2 ARG A 81 8.931 14.453 -1.546 1.00 0.00 N ATOM 0 H ARG A 81 2.133 10.661 -1.516 1.00 0.00 H new ATOM 0 HA ARG A 81 4.539 9.023 -1.718 1.00 0.00 H new ATOM 0 HB2 ARG A 81 3.918 10.992 0.550 1.00 0.00 H new ATOM 0 HB3 ARG A 81 5.251 9.855 0.536 1.00 0.00 H new ATOM 0 HG2 ARG A 81 5.756 11.123 -1.809 1.00 0.00 H new ATOM 0 HG3 ARG A 81 4.916 12.417 -0.978 1.00 0.00 H new ATOM 0 HD2 ARG A 81 6.546 11.973 1.004 1.00 0.00 H new ATOM 0 HD3 ARG A 81 7.479 11.017 -0.129 1.00 0.00 H new ATOM 0 HE ARG A 81 6.733 13.865 -0.666 1.00 0.00 H new ATOM 0 HH11 ARG A 81 9.354 11.454 -0.507 1.00 0.00 H new ATOM 0 HH12 ARG A 81 10.505 12.569 -1.252 1.00 0.00 H new ATOM 0 HH21 ARG A 81 8.226 15.186 -1.629 1.00 0.00 H new ATOM 0 HH22 ARG A 81 9.884 14.623 -1.869 1.00 0.00 H new ATOM 1093 N ILE A 82 3.621 7.592 0.323 1.00 0.00 N ATOM 1094 CA ILE A 82 2.921 6.588 1.124 1.00 0.00 C ATOM 1095 C ILE A 82 3.681 6.323 2.430 1.00 0.00 C ATOM 1096 O ILE A 82 4.908 6.185 2.438 1.00 0.00 O ATOM 1097 CB ILE A 82 2.724 5.271 0.321 1.00 0.00 C ATOM 1098 CG1 ILE A 82 2.349 5.512 -1.161 1.00 0.00 C ATOM 1099 CG2 ILE A 82 1.663 4.383 1.005 1.00 0.00 C ATOM 1100 CD1 ILE A 82 1.900 4.266 -1.926 1.00 0.00 C ATOM 0 H ILE A 82 4.628 7.440 0.265 1.00 0.00 H new ATOM 0 HA ILE A 82 1.933 6.977 1.372 1.00 0.00 H new ATOM 0 HB ILE A 82 3.686 4.759 0.319 1.00 0.00 H new ATOM 0 HG12 ILE A 82 1.550 6.252 -1.202 1.00 0.00 H new ATOM 0 HG13 ILE A 82 3.210 5.943 -1.672 1.00 0.00 H new ATOM 0 HG21 ILE A 82 1.534 3.464 0.433 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.990 4.139 2.016 1.00 0.00 H new ATOM 0 HG23 ILE A 82 0.715 4.918 1.050 1.00 0.00 H new ATOM 0 HD11 ILE A 82 1.659 4.537 -2.954 1.00 0.00 H new ATOM 0 HD12 ILE A 82 2.703 3.529 -1.924 1.00 0.00 H new ATOM 0 HD13 ILE A 82 1.017 3.843 -1.446 1.00 0.00 H new ATOM 1112 N ASP A 83 2.960 6.244 3.545 1.00 0.00 N ATOM 1113 CA ASP A 83 3.511 5.959 4.873 1.00 0.00 C ATOM 1114 C ASP A 83 3.082 4.540 5.264 1.00 0.00 C ATOM 1115 O ASP A 83 1.890 4.238 5.323 1.00 0.00 O ATOM 1116 CB ASP A 83 3.022 6.955 5.926 1.00 0.00 C ATOM 1117 CG ASP A 83 3.758 6.792 7.263 1.00 0.00 C ATOM 1118 OD1 ASP A 83 3.972 5.660 7.755 1.00 0.00 O ATOM 1119 OD2 ASP A 83 4.133 7.813 7.878 1.00 0.00 O ATOM 0 H ASP A 83 1.949 6.380 3.553 1.00 0.00 H new ATOM 0 HA ASP A 83 4.597 6.048 4.831 1.00 0.00 H new ATOM 0 HB2 ASP A 83 3.164 7.971 5.557 1.00 0.00 H new ATOM 0 HB3 ASP A 83 1.952 6.819 6.083 1.00 0.00 H new ATOM 1124 N LEU A 84 4.049 3.646 5.467 1.00 0.00 N ATOM 1125 CA LEU A 84 3.856 2.255 5.851 1.00 0.00 C ATOM 1126 C LEU A 84 4.965 1.794 6.786 1.00 0.00 C ATOM 1127 O LEU A 84 5.472 0.683 6.654 1.00 0.00 O ATOM 1128 CB LEU A 84 3.622 1.345 4.631 1.00 0.00 C ATOM 1129 CG LEU A 84 4.568 1.303 3.420 1.00 0.00 C ATOM 1130 CD1 LEU A 84 4.158 2.371 2.411 1.00 0.00 C ATOM 1131 CD2 LEU A 84 6.073 1.363 3.703 1.00 0.00 C ATOM 0 H LEU A 84 5.034 3.887 5.362 1.00 0.00 H new ATOM 0 HA LEU A 84 2.933 2.175 6.426 1.00 0.00 H new ATOM 0 HB2 LEU A 84 3.564 0.326 5.013 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.635 1.597 4.243 1.00 0.00 H new ATOM 0 HG LEU A 84 4.440 0.300 3.013 1.00 0.00 H new ATOM 0 HD11 LEU A 84 4.830 2.339 1.554 1.00 0.00 H new ATOM 0 HD12 LEU A 84 3.137 2.185 2.078 1.00 0.00 H new ATOM 0 HD13 LEU A 84 4.213 3.354 2.879 1.00 0.00 H new ATOM 0 HD21 LEU A 84 6.622 1.325 2.762 1.00 0.00 H new ATOM 0 HD22 LEU A 84 6.309 2.291 4.223 1.00 0.00 H new ATOM 0 HD23 LEU A 84 6.360 0.515 4.325 1.00 0.00 H new ATOM 1143 N SER A 85 5.322 2.614 7.777 1.00 0.00 N ATOM 1144 CA SER A 85 6.382 2.305 8.736 1.00 0.00 C ATOM 1145 C SER A 85 6.225 0.950 9.442 1.00 0.00 C ATOM 1146 O SER A 85 7.225 0.374 9.880 1.00 0.00 O ATOM 1147 CB SER A 85 6.521 3.465 9.725 1.00 0.00 C ATOM 1148 OG SER A 85 5.265 3.816 10.272 1.00 0.00 O ATOM 0 H SER A 85 4.879 3.519 7.937 1.00 0.00 H new ATOM 0 HA SER A 85 7.307 2.196 8.170 1.00 0.00 H new ATOM 0 HB2 SER A 85 7.205 3.185 10.526 1.00 0.00 H new ATOM 0 HB3 SER A 85 6.956 4.328 9.221 1.00 0.00 H new ATOM 0 HG SER A 85 5.378 4.558 10.902 1.00 0.00 H new ATOM 1154 N ALA A 86 5.001 0.421 9.564 1.00 0.00 N ATOM 1155 CA ALA A 86 4.744 -0.869 10.199 1.00 0.00 C ATOM 1156 C ALA A 86 4.847 -2.043 9.229 1.00 0.00 C ATOM 1157 O ALA A 86 4.888 -3.186 9.693 1.00 0.00 O ATOM 1158 CB ALA A 86 3.391 -0.852 10.911 1.00 0.00 C ATOM 0 H ALA A 86 4.158 0.883 9.221 1.00 0.00 H new ATOM 0 HA ALA A 86 5.529 -1.022 10.939 1.00 0.00 H new ATOM 0 HB1 ALA A 86 3.214 -1.820 11.379 1.00 0.00 H new ATOM 0 HB2 ALA A 86 3.392 -0.074 11.675 1.00 0.00 H new ATOM 0 HB3 ALA A 86 2.602 -0.649 10.187 1.00 0.00 H new ATOM 1164 N LEU A 87 4.814 -1.816 7.914 1.00 0.00 N ATOM 1165 CA LEU A 87 4.949 -2.912 6.958 1.00 0.00 C ATOM 1166 C LEU A 87 6.464 -3.109 6.820 1.00 0.00 C ATOM 1167 O LEU A 87 7.227 -2.159 6.653 1.00 0.00 O ATOM 1168 CB LEU A 87 4.196 -2.633 5.644 1.00 0.00 C ATOM 1169 CG LEU A 87 2.686 -3.004 5.655 1.00 0.00 C ATOM 1170 CD1 LEU A 87 1.965 -2.730 6.980 1.00 0.00 C ATOM 1171 CD2 LEU A 87 1.901 -2.283 4.551 1.00 0.00 C ATOM 0 H LEU A 87 4.696 -0.895 7.493 1.00 0.00 H new ATOM 0 HA LEU A 87 4.481 -3.838 7.291 1.00 0.00 H new ATOM 0 HB2 LEU A 87 4.292 -1.573 5.407 1.00 0.00 H new ATOM 0 HB3 LEU A 87 4.684 -3.185 4.840 1.00 0.00 H new ATOM 0 HG LEU A 87 2.699 -4.081 5.488 1.00 0.00 H new ATOM 0 HD11 LEU A 87 0.918 -3.020 6.891 1.00 0.00 H new ATOM 0 HD12 LEU A 87 2.435 -3.307 7.776 1.00 0.00 H new ATOM 0 HD13 LEU A 87 2.028 -1.668 7.216 1.00 0.00 H new ATOM 0 HD21 LEU A 87 0.852 -2.575 4.600 1.00 0.00 H new ATOM 0 HD22 LEU A 87 1.984 -1.205 4.690 1.00 0.00 H new ATOM 0 HD23 LEU A 87 2.308 -2.556 3.577 1.00 0.00 H new ATOM 1183 N GLY A 88 6.900 -4.357 6.937 1.00 0.00 N ATOM 1184 CA GLY A 88 8.271 -4.855 6.884 1.00 0.00 C ATOM 1185 C GLY A 88 8.905 -4.807 5.501 1.00 0.00 C ATOM 1186 O GLY A 88 9.484 -5.804 5.061 1.00 0.00 O ATOM 0 H GLY A 88 6.240 -5.120 7.086 1.00 0.00 H new ATOM 0 HA2 GLY A 88 8.883 -4.271 7.571 1.00 0.00 H new ATOM 0 HA3 GLY A 88 8.285 -5.885 7.241 1.00 0.00 H new ATOM 1190 N PHE A 89 8.753 -3.692 4.797 1.00 0.00 N ATOM 1191 CA PHE A 89 9.310 -3.483 3.458 1.00 0.00 C ATOM 1192 C PHE A 89 10.816 -3.772 3.422 1.00 0.00 C ATOM 1193 O PHE A 89 11.518 -3.645 4.428 1.00 0.00 O ATOM 1194 CB PHE A 89 9.019 -2.056 2.964 1.00 0.00 C ATOM 1195 CG PHE A 89 7.724 -1.968 2.184 1.00 0.00 C ATOM 1196 CD1 PHE A 89 6.494 -1.984 2.863 1.00 0.00 C ATOM 1197 CD2 PHE A 89 7.744 -1.948 0.776 1.00 0.00 C ATOM 1198 CE1 PHE A 89 5.291 -2.001 2.137 1.00 0.00 C ATOM 1199 CE2 PHE A 89 6.539 -1.950 0.055 1.00 0.00 C ATOM 1200 CZ PHE A 89 5.312 -1.981 0.735 1.00 0.00 C ATOM 0 H PHE A 89 8.229 -2.889 5.144 1.00 0.00 H new ATOM 0 HA PHE A 89 8.822 -4.189 2.785 1.00 0.00 H new ATOM 0 HB2 PHE A 89 8.972 -1.381 3.819 1.00 0.00 H new ATOM 0 HB3 PHE A 89 9.842 -1.717 2.335 1.00 0.00 H new ATOM 0 HD1 PHE A 89 6.473 -1.983 3.943 1.00 0.00 H new ATOM 0 HD2 PHE A 89 8.687 -1.931 0.250 1.00 0.00 H new ATOM 0 HE1 PHE A 89 4.347 -2.030 2.661 1.00 0.00 H new ATOM 0 HE2 PHE A 89 6.557 -1.928 -1.025 1.00 0.00 H new ATOM 0 HZ PHE A 89 4.386 -1.989 0.180 1.00 0.00 H new ATOM 1210 N SER A 90 11.314 -4.145 2.244 1.00 0.00 N ATOM 1211 CA SER A 90 12.717 -4.469 2.005 1.00 0.00 C ATOM 1212 C SER A 90 13.202 -4.023 0.620 1.00 0.00 C ATOM 1213 O SER A 90 14.395 -4.144 0.341 1.00 0.00 O ATOM 1214 CB SER A 90 12.915 -5.973 2.206 1.00 0.00 C ATOM 1215 OG SER A 90 14.283 -6.310 2.266 1.00 0.00 O ATOM 0 H SER A 90 10.736 -4.232 1.408 1.00 0.00 H new ATOM 0 HA SER A 90 13.324 -3.915 2.721 1.00 0.00 H new ATOM 0 HB2 SER A 90 12.421 -6.286 3.126 1.00 0.00 H new ATOM 0 HB3 SER A 90 12.441 -6.516 1.389 1.00 0.00 H new ATOM 0 HG SER A 90 14.808 -5.632 1.792 1.00 0.00 H new ATOM 1221 N GLY A 91 12.329 -3.493 -0.240 1.00 0.00 N ATOM 1222 CA GLY A 91 12.684 -3.051 -1.583 1.00 0.00 C ATOM 1223 C GLY A 91 11.859 -3.782 -2.635 1.00 0.00 C ATOM 1224 O GLY A 91 10.979 -4.591 -2.298 1.00 0.00 O ATOM 0 H GLY A 91 11.343 -3.359 -0.016 1.00 0.00 H new ATOM 0 HA2 GLY A 91 12.522 -1.977 -1.671 1.00 0.00 H new ATOM 0 HA3 GLY A 91 13.745 -3.229 -1.760 1.00 0.00 H new ATOM 1228 N LEU A 92 12.091 -3.443 -3.904 1.00 0.00 N ATOM 1229 CA LEU A 92 11.406 -4.057 -5.035 1.00 0.00 C ATOM 1230 C LEU A 92 11.923 -5.468 -5.247 1.00 0.00 C ATOM 1231 O LEU A 92 12.982 -5.856 -4.757 1.00 0.00 O ATOM 1232 CB LEU A 92 11.599 -3.285 -6.354 1.00 0.00 C ATOM 1233 CG LEU A 92 13.069 -3.045 -6.780 1.00 0.00 C ATOM 1234 CD1 LEU A 92 13.247 -3.229 -8.291 1.00 0.00 C ATOM 1235 CD2 LEU A 92 13.551 -1.645 -6.390 1.00 0.00 C ATOM 0 H LEU A 92 12.766 -2.728 -4.175 1.00 0.00 H new ATOM 0 HA LEU A 92 10.345 -4.049 -4.785 1.00 0.00 H new ATOM 0 HB2 LEU A 92 11.093 -3.830 -7.151 1.00 0.00 H new ATOM 0 HB3 LEU A 92 11.103 -2.319 -6.264 1.00 0.00 H new ATOM 0 HG LEU A 92 13.669 -3.786 -6.251 1.00 0.00 H new ATOM 0 HD11 LEU A 92 14.289 -3.054 -8.559 1.00 0.00 H new ATOM 0 HD12 LEU A 92 12.967 -4.245 -8.569 1.00 0.00 H new ATOM 0 HD13 LEU A 92 12.612 -2.519 -8.821 1.00 0.00 H new ATOM 0 HD21 LEU A 92 14.586 -1.515 -6.706 1.00 0.00 H new ATOM 0 HD22 LEU A 92 12.927 -0.896 -6.877 1.00 0.00 H new ATOM 0 HD23 LEU A 92 13.484 -1.525 -5.309 1.00 0.00 H new ATOM 1247 N GLY A 93 11.178 -6.232 -6.029 1.00 0.00 N ATOM 1248 CA GLY A 93 11.550 -7.586 -6.348 1.00 0.00 C ATOM 1249 C GLY A 93 10.425 -8.394 -6.956 1.00 0.00 C ATOM 1250 O GLY A 93 10.201 -8.301 -8.160 1.00 0.00 O ATOM 0 H GLY A 93 10.303 -5.926 -6.455 1.00 0.00 H new ATOM 0 HA2 GLY A 93 12.391 -7.570 -7.042 1.00 0.00 H new ATOM 0 HA3 GLY A 93 11.895 -8.083 -5.441 1.00 0.00 H new ATOM 1254 N ASP A 94 9.711 -9.179 -6.144 1.00 0.00 N ATOM 1255 CA ASP A 94 8.645 -10.042 -6.675 1.00 0.00 C ATOM 1256 C ASP A 94 7.491 -10.320 -5.708 1.00 0.00 C ATOM 1257 O ASP A 94 6.683 -11.222 -5.941 1.00 0.00 O ATOM 1258 CB ASP A 94 9.294 -11.376 -7.096 1.00 0.00 C ATOM 1259 CG ASP A 94 8.664 -12.006 -8.339 1.00 0.00 C ATOM 1260 OD1 ASP A 94 7.605 -11.565 -8.837 1.00 0.00 O ATOM 1261 OD2 ASP A 94 9.345 -12.865 -8.936 1.00 0.00 O ATOM 0 H ASP A 94 9.845 -9.237 -5.135 1.00 0.00 H new ATOM 0 HA ASP A 94 8.190 -9.509 -7.510 1.00 0.00 H new ATOM 0 HB2 ASP A 94 10.355 -11.210 -7.283 1.00 0.00 H new ATOM 0 HB3 ASP A 94 9.223 -12.081 -6.268 1.00 0.00 H new ATOM 1266 N GLY A 95 7.406 -9.580 -4.596 1.00 0.00 N ATOM 1267 CA GLY A 95 6.342 -9.810 -3.619 1.00 0.00 C ATOM 1268 C GLY A 95 6.563 -11.126 -2.855 1.00 0.00 C ATOM 1269 O GLY A 95 5.641 -11.677 -2.254 1.00 0.00 O ATOM 0 H GLY A 95 8.052 -8.828 -4.355 1.00 0.00 H new ATOM 0 HA2 GLY A 95 6.306 -8.979 -2.914 1.00 0.00 H new ATOM 0 HA3 GLY A 95 5.378 -9.839 -4.127 1.00 0.00 H new ATOM 1273 N TYR A 96 7.788 -11.665 -2.896 1.00 0.00 N ATOM 1274 CA TYR A 96 8.147 -12.910 -2.239 1.00 0.00 C ATOM 1275 C TYR A 96 8.595 -12.654 -0.805 1.00 0.00 C ATOM 1276 O TYR A 96 7.796 -12.253 0.038 1.00 0.00 O ATOM 1277 CB TYR A 96 9.105 -13.743 -3.121 1.00 0.00 C ATOM 1278 CG TYR A 96 9.454 -15.104 -2.531 1.00 0.00 C ATOM 1279 CD1 TYR A 96 8.453 -15.878 -1.914 1.00 0.00 C ATOM 1280 CD2 TYR A 96 10.781 -15.576 -2.536 1.00 0.00 C ATOM 1281 CE1 TYR A 96 8.767 -17.086 -1.274 1.00 0.00 C ATOM 1282 CE2 TYR A 96 11.099 -16.796 -1.907 1.00 0.00 C ATOM 1283 CZ TYR A 96 10.095 -17.548 -1.261 1.00 0.00 C ATOM 1284 OH TYR A 96 10.374 -18.732 -0.663 1.00 0.00 O ATOM 0 H TYR A 96 8.565 -11.234 -3.398 1.00 0.00 H new ATOM 0 HA TYR A 96 7.271 -13.549 -2.131 1.00 0.00 H new ATOM 0 HB2 TYR A 96 8.649 -13.888 -4.101 1.00 0.00 H new ATOM 0 HB3 TYR A 96 10.024 -13.178 -3.277 1.00 0.00 H new ATOM 0 HD1 TYR A 96 7.429 -15.537 -1.934 1.00 0.00 H new ATOM 0 HD2 TYR A 96 11.556 -15.002 -3.023 1.00 0.00 H new ATOM 0 HE1 TYR A 96 7.990 -17.660 -0.792 1.00 0.00 H new ATOM 0 HE2 TYR A 96 12.117 -17.157 -1.919 1.00 0.00 H new ATOM 0 HH TYR A 96 11.334 -18.917 -0.736 1.00 0.00 H new ATOM 1294 N GLY A 97 9.878 -12.846 -0.548 1.00 0.00 N ATOM 1295 CA GLY A 97 10.587 -12.696 0.713 1.00 0.00 C ATOM 1296 C GLY A 97 10.702 -11.239 1.141 1.00 0.00 C ATOM 1297 O GLY A 97 11.798 -10.700 1.245 1.00 0.00 O ATOM 0 H GLY A 97 10.512 -13.140 -1.291 1.00 0.00 H new ATOM 0 HA2 GLY A 97 10.069 -13.260 1.488 1.00 0.00 H new ATOM 0 HA3 GLY A 97 11.585 -13.125 0.620 1.00 0.00 H new ATOM 1301 N GLY A 98 9.564 -10.596 1.380 1.00 0.00 N ATOM 1302 CA GLY A 98 9.499 -9.207 1.809 1.00 0.00 C ATOM 1303 C GLY A 98 9.767 -8.217 0.678 1.00 0.00 C ATOM 1304 O GLY A 98 10.091 -7.059 0.951 1.00 0.00 O ATOM 0 H GLY A 98 8.648 -11.033 1.279 1.00 0.00 H new ATOM 0 HA2 GLY A 98 8.514 -9.009 2.231 1.00 0.00 H new ATOM 0 HA3 GLY A 98 10.225 -9.045 2.605 1.00 0.00 H new ATOM 1308 N THR A 99 9.549 -8.601 -0.582 1.00 0.00 N ATOM 1309 CA THR A 99 9.801 -7.720 -1.719 1.00 0.00 C ATOM 1310 C THR A 99 8.475 -7.115 -2.206 1.00 0.00 C ATOM 1311 O THR A 99 7.424 -7.311 -1.581 1.00 0.00 O ATOM 1312 CB THR A 99 10.662 -8.444 -2.772 1.00 0.00 C ATOM 1313 OG1 THR A 99 10.141 -9.703 -3.162 1.00 0.00 O ATOM 1314 CG2 THR A 99 12.077 -8.688 -2.242 1.00 0.00 C ATOM 0 H THR A 99 9.196 -9.523 -0.839 1.00 0.00 H new ATOM 0 HA THR A 99 10.406 -6.858 -1.438 1.00 0.00 H new ATOM 0 HB THR A 99 10.664 -7.781 -3.637 1.00 0.00 H new ATOM 0 HG1 THR A 99 10.804 -10.177 -3.705 1.00 0.00 H new ATOM 0 HG21 THR A 99 12.667 -9.200 -3.002 1.00 0.00 H new ATOM 0 HG22 THR A 99 12.545 -7.733 -2.002 1.00 0.00 H new ATOM 0 HG23 THR A 99 12.028 -9.304 -1.344 1.00 0.00 H new ATOM 1322 N LEU A 100 8.518 -6.316 -3.272 1.00 0.00 N ATOM 1323 CA LEU A 100 7.381 -5.618 -3.866 1.00 0.00 C ATOM 1324 C LEU A 100 7.412 -5.823 -5.377 1.00 0.00 C ATOM 1325 O LEU A 100 8.472 -5.646 -5.973 1.00 0.00 O ATOM 1326 CB LEU A 100 7.524 -4.121 -3.492 1.00 0.00 C ATOM 1327 CG LEU A 100 6.838 -3.087 -4.414 1.00 0.00 C ATOM 1328 CD1 LEU A 100 5.318 -3.065 -4.261 1.00 0.00 C ATOM 1329 CD2 LEU A 100 7.387 -1.686 -4.125 1.00 0.00 C ATOM 0 H LEU A 100 9.390 -6.130 -3.768 1.00 0.00 H new ATOM 0 HA LEU A 100 6.427 -5.997 -3.499 1.00 0.00 H new ATOM 0 HB2 LEU A 100 7.130 -3.987 -2.484 1.00 0.00 H new ATOM 0 HB3 LEU A 100 8.587 -3.884 -3.453 1.00 0.00 H new ATOM 0 HG LEU A 100 7.061 -3.388 -5.438 1.00 0.00 H new ATOM 0 HD11 LEU A 100 4.895 -2.319 -4.934 1.00 0.00 H new ATOM 0 HD12 LEU A 100 4.913 -4.047 -4.507 1.00 0.00 H new ATOM 0 HD13 LEU A 100 5.059 -2.813 -3.232 1.00 0.00 H new ATOM 0 HD21 LEU A 100 6.899 -0.962 -4.778 1.00 0.00 H new ATOM 0 HD22 LEU A 100 7.191 -1.426 -3.085 1.00 0.00 H new ATOM 0 HD23 LEU A 100 8.462 -1.672 -4.306 1.00 0.00 H new ATOM 1341 N LEU A 101 6.291 -6.209 -5.986 1.00 0.00 N ATOM 1342 CA LEU A 101 6.173 -6.403 -7.432 1.00 0.00 C ATOM 1343 C LEU A 101 5.161 -5.397 -7.950 1.00 0.00 C ATOM 1344 O LEU A 101 4.093 -5.247 -7.366 1.00 0.00 O ATOM 1345 CB LEU A 101 5.662 -7.805 -7.783 1.00 0.00 C ATOM 1346 CG LEU A 101 5.530 -8.062 -9.301 1.00 0.00 C ATOM 1347 CD1 LEU A 101 6.894 -8.104 -9.988 1.00 0.00 C ATOM 1348 CD2 LEU A 101 4.806 -9.382 -9.559 1.00 0.00 C ATOM 0 H LEU A 101 5.425 -6.399 -5.481 1.00 0.00 H new ATOM 0 HA LEU A 101 7.159 -6.275 -7.880 1.00 0.00 H new ATOM 0 HB2 LEU A 101 6.339 -8.545 -7.357 1.00 0.00 H new ATOM 0 HB3 LEU A 101 4.690 -7.955 -7.313 1.00 0.00 H new ATOM 0 HG LEU A 101 4.955 -7.234 -9.716 1.00 0.00 H new ATOM 0 HD11 LEU A 101 6.759 -8.287 -11.054 1.00 0.00 H new ATOM 0 HD12 LEU A 101 7.403 -7.151 -9.845 1.00 0.00 H new ATOM 0 HD13 LEU A 101 7.495 -8.904 -9.556 1.00 0.00 H new ATOM 0 HD21 LEU A 101 4.722 -9.547 -10.633 1.00 0.00 H new ATOM 0 HD22 LEU A 101 5.369 -10.200 -9.109 1.00 0.00 H new ATOM 0 HD23 LEU A 101 3.810 -9.343 -9.119 1.00 0.00 H new ATOM 1360 N LEU A 102 5.455 -4.766 -9.073 1.00 0.00 N ATOM 1361 CA LEU A 102 4.616 -3.778 -9.736 1.00 0.00 C ATOM 1362 C LEU A 102 4.317 -4.281 -11.152 1.00 0.00 C ATOM 1363 O LEU A 102 5.240 -4.680 -11.869 1.00 0.00 O ATOM 1364 CB LEU A 102 5.277 -2.392 -9.750 1.00 0.00 C ATOM 1365 CG LEU A 102 5.681 -1.810 -8.379 1.00 0.00 C ATOM 1366 CD1 LEU A 102 7.149 -2.109 -8.046 1.00 0.00 C ATOM 1367 CD2 LEU A 102 5.492 -0.290 -8.357 1.00 0.00 C ATOM 0 H LEU A 102 6.328 -4.936 -9.573 1.00 0.00 H new ATOM 0 HA LEU A 102 3.682 -3.658 -9.186 1.00 0.00 H new ATOM 0 HB2 LEU A 102 6.169 -2.445 -10.375 1.00 0.00 H new ATOM 0 HB3 LEU A 102 4.593 -1.692 -10.230 1.00 0.00 H new ATOM 0 HG LEU A 102 5.037 -2.284 -7.638 1.00 0.00 H new ATOM 0 HD11 LEU A 102 7.395 -1.683 -7.073 1.00 0.00 H new ATOM 0 HD12 LEU A 102 7.304 -3.188 -8.020 1.00 0.00 H new ATOM 0 HD13 LEU A 102 7.792 -1.669 -8.808 1.00 0.00 H new ATOM 0 HD21 LEU A 102 5.783 0.099 -7.381 1.00 0.00 H new ATOM 0 HD22 LEU A 102 6.113 0.165 -9.129 1.00 0.00 H new ATOM 0 HD23 LEU A 102 4.445 -0.051 -8.546 1.00 0.00 H new ATOM 1379 N LYS A 103 3.034 -4.342 -11.522 1.00 0.00 N ATOM 1380 CA LYS A 103 2.507 -4.778 -12.816 1.00 0.00 C ATOM 1381 C LYS A 103 1.340 -3.879 -13.227 1.00 0.00 C ATOM 1382 O LYS A 103 0.869 -3.050 -12.440 1.00 0.00 O ATOM 1383 CB LYS A 103 2.083 -6.258 -12.754 1.00 0.00 C ATOM 1384 CG LYS A 103 3.285 -7.211 -12.829 1.00 0.00 C ATOM 1385 CD LYS A 103 3.824 -7.326 -14.266 1.00 0.00 C ATOM 1386 CE LYS A 103 5.346 -7.177 -14.310 1.00 0.00 C ATOM 1387 NZ LYS A 103 5.853 -7.393 -15.680 1.00 0.00 N ATOM 0 H LYS A 103 2.288 -4.070 -10.882 1.00 0.00 H new ATOM 0 HA LYS A 103 3.288 -4.692 -13.571 1.00 0.00 H new ATOM 0 HB2 LYS A 103 1.536 -6.439 -11.829 1.00 0.00 H new ATOM 0 HB3 LYS A 103 1.400 -6.473 -13.576 1.00 0.00 H new ATOM 0 HG2 LYS A 103 4.076 -6.853 -12.170 1.00 0.00 H new ATOM 0 HG3 LYS A 103 2.992 -8.197 -12.469 1.00 0.00 H new ATOM 0 HD2 LYS A 103 3.540 -8.291 -14.686 1.00 0.00 H new ATOM 0 HD3 LYS A 103 3.365 -6.559 -14.890 1.00 0.00 H new ATOM 0 HE2 LYS A 103 5.629 -6.183 -13.965 1.00 0.00 H new ATOM 0 HE3 LYS A 103 5.806 -7.893 -13.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 6.888 -7.287 -15.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 5.600 -8.351 -15.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 5.429 -6.693 -16.322 1.00 0.00 H new ATOM 1401 N THR A 104 0.854 -4.022 -14.458 1.00 0.00 N ATOM 1402 CA THR A 104 -0.263 -3.240 -14.965 1.00 0.00 C ATOM 1403 C THR A 104 -1.343 -4.167 -15.529 1.00 0.00 C ATOM 1404 O THR A 104 -1.132 -5.374 -15.683 1.00 0.00 O ATOM 1405 CB THR A 104 0.234 -2.163 -15.954 1.00 0.00 C ATOM 1406 OG1 THR A 104 1.030 -2.699 -16.999 1.00 0.00 O ATOM 1407 CG2 THR A 104 1.064 -1.101 -15.233 1.00 0.00 C ATOM 0 H THR A 104 1.229 -4.689 -15.133 1.00 0.00 H new ATOM 0 HA THR A 104 -0.737 -2.691 -14.151 1.00 0.00 H new ATOM 0 HB THR A 104 -0.666 -1.725 -16.386 1.00 0.00 H new ATOM 0 HG1 THR A 104 1.316 -1.976 -17.596 1.00 0.00 H new ATOM 0 HG21 THR A 104 1.402 -0.354 -15.951 1.00 0.00 H new ATOM 0 HG22 THR A 104 0.454 -0.619 -14.469 1.00 0.00 H new ATOM 0 HG23 THR A 104 1.928 -1.571 -14.764 1.00 0.00 H new ATOM 1415 N ASN A 105 -2.528 -3.598 -15.764 1.00 0.00 N ATOM 1416 CA ASN A 105 -3.702 -4.274 -16.324 1.00 0.00 C ATOM 1417 C ASN A 105 -3.371 -4.755 -17.744 1.00 0.00 C ATOM 1418 O ASN A 105 -2.381 -4.300 -18.317 1.00 0.00 O ATOM 1419 CB ASN A 105 -4.885 -3.318 -16.342 1.00 0.00 C ATOM 1420 CG ASN A 105 -6.177 -3.843 -15.733 1.00 0.00 C ATOM 1421 OD1 ASN A 105 -6.220 -4.335 -14.608 1.00 0.00 O ATOM 1422 ND2 ASN A 105 -7.274 -3.617 -16.424 1.00 0.00 N ATOM 0 H ASN A 105 -2.703 -2.614 -15.561 1.00 0.00 H new ATOM 0 HA ASN A 105 -3.967 -5.134 -15.709 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -4.600 -2.409 -15.812 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -5.083 -3.036 -17.376 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -8.184 -3.851 -16.027 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -7.214 -3.208 -17.356 1.00 0.00 H new ATOM 1429 N ALA A 106 -4.239 -5.559 -18.369 1.00 0.00 N ATOM 1430 CA ALA A 106 -4.030 -6.072 -19.725 1.00 0.00 C ATOM 1431 C ALA A 106 -3.691 -4.941 -20.699 1.00 0.00 C ATOM 1432 O ALA A 106 -2.733 -5.072 -21.459 1.00 0.00 O ATOM 1433 CB ALA A 106 -5.251 -6.859 -20.214 1.00 0.00 C ATOM 0 H ALA A 106 -5.111 -5.873 -17.944 1.00 0.00 H new ATOM 0 HA ALA A 106 -3.180 -6.754 -19.690 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -5.066 -7.227 -21.223 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -5.431 -7.702 -19.547 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -6.125 -6.208 -20.220 1.00 0.00 H new ATOM 1439 N GLU A 107 -4.454 -3.846 -20.660 1.00 0.00 N ATOM 1440 CA GLU A 107 -4.234 -2.682 -21.513 1.00 0.00 C ATOM 1441 C GLU A 107 -3.378 -1.614 -20.817 1.00 0.00 C ATOM 1442 O GLU A 107 -2.984 -0.629 -21.447 1.00 0.00 O ATOM 1443 CB GLU A 107 -5.578 -2.026 -21.845 1.00 0.00 C ATOM 1444 CG GLU A 107 -6.545 -2.915 -22.628 1.00 0.00 C ATOM 1445 CD GLU A 107 -7.675 -2.079 -23.238 1.00 0.00 C ATOM 1446 OE1 GLU A 107 -7.388 -1.104 -23.972 1.00 0.00 O ATOM 1447 OE2 GLU A 107 -8.853 -2.425 -22.999 1.00 0.00 O ATOM 0 H GLU A 107 -5.249 -3.744 -20.029 1.00 0.00 H new ATOM 0 HA GLU A 107 -3.722 -3.037 -22.407 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -6.058 -1.721 -20.915 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -5.392 -1.119 -22.420 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -6.007 -3.439 -23.418 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -6.963 -3.675 -21.968 1.00 0.00 H new ATOM 1454 N GLY A 108 -3.109 -1.749 -19.516 1.00 0.00 N ATOM 1455 CA GLY A 108 -2.338 -0.773 -18.763 1.00 0.00 C ATOM 1456 C GLY A 108 -3.220 0.393 -18.324 1.00 0.00 C ATOM 1457 O GLY A 108 -2.717 1.474 -18.034 1.00 0.00 O ATOM 0 H GLY A 108 -3.424 -2.543 -18.959 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -1.895 -1.249 -17.888 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -1.515 -0.402 -19.375 1.00 0.00 H new ATOM 1461 N THR A 109 -4.535 0.195 -18.347 1.00 0.00 N ATOM 1462 CA THR A 109 -5.562 1.147 -17.955 1.00 0.00 C ATOM 1463 C THR A 109 -5.528 1.369 -16.442 1.00 0.00 C ATOM 1464 O THR A 109 -5.881 2.437 -15.939 1.00 0.00 O ATOM 1465 CB THR A 109 -6.907 0.551 -18.403 1.00 0.00 C ATOM 1466 OG1 THR A 109 -6.914 -0.859 -18.193 1.00 0.00 O ATOM 1467 CG2 THR A 109 -7.128 0.799 -19.899 1.00 0.00 C ATOM 0 H THR A 109 -4.933 -0.690 -18.660 1.00 0.00 H new ATOM 0 HA THR A 109 -5.403 2.120 -18.420 1.00 0.00 H new ATOM 0 HB THR A 109 -7.694 1.028 -17.820 1.00 0.00 H new ATOM 0 HG1 THR A 109 -7.775 -1.228 -18.480 1.00 0.00 H new ATOM 0 HG21 THR A 109 -8.084 0.371 -20.201 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.132 1.872 -20.093 1.00 0.00 H new ATOM 0 HG23 THR A 109 -6.325 0.331 -20.468 1.00 0.00 H new ATOM 1475 N ARG A 110 -5.106 0.339 -15.707 1.00 0.00 N ATOM 1476 CA ARG A 110 -4.974 0.325 -14.272 1.00 0.00 C ATOM 1477 C ARG A 110 -3.626 -0.292 -13.928 1.00 0.00 C ATOM 1478 O ARG A 110 -3.007 -0.966 -14.761 1.00 0.00 O ATOM 1479 CB ARG A 110 -6.134 -0.472 -13.667 1.00 0.00 C ATOM 1480 CG ARG A 110 -7.484 0.272 -13.686 1.00 0.00 C ATOM 1481 CD ARG A 110 -8.137 0.266 -12.297 1.00 0.00 C ATOM 1482 NE ARG A 110 -9.514 0.789 -12.327 1.00 0.00 N ATOM 1483 CZ ARG A 110 -10.617 0.049 -12.501 1.00 0.00 C ATOM 1484 NH1 ARG A 110 -10.520 -1.239 -12.791 1.00 0.00 N ATOM 1485 NH2 ARG A 110 -11.826 0.583 -12.386 1.00 0.00 N ATOM 0 H ARG A 110 -4.836 -0.549 -16.131 1.00 0.00 H new ATOM 0 HA ARG A 110 -5.015 1.333 -13.860 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -6.240 -1.410 -14.212 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -5.887 -0.728 -12.637 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -7.332 1.300 -14.015 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -8.152 -0.198 -14.408 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -8.145 -0.751 -11.906 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -7.537 0.866 -11.613 1.00 0.00 H new ATOM 0 HE ARG A 110 -9.637 1.794 -12.206 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -9.602 -1.673 -12.883 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -11.364 -1.797 -12.922 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -11.927 1.573 -12.162 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -12.654 0.004 -12.522 1.00 0.00 H new ATOM 1499 N THR A 111 -3.220 -0.151 -12.677 1.00 0.00 N ATOM 1500 CA THR A 111 -1.968 -0.662 -12.161 1.00 0.00 C ATOM 1501 C THR A 111 -2.286 -1.571 -10.970 1.00 0.00 C ATOM 1502 O THR A 111 -3.200 -1.283 -10.187 1.00 0.00 O ATOM 1503 CB THR A 111 -1.105 0.576 -11.886 1.00 0.00 C ATOM 1504 OG1 THR A 111 -0.840 1.201 -13.117 1.00 0.00 O ATOM 1505 CG2 THR A 111 0.255 0.308 -11.264 1.00 0.00 C ATOM 0 H THR A 111 -3.773 0.338 -11.973 1.00 0.00 H new ATOM 0 HA THR A 111 -1.395 -1.298 -12.835 1.00 0.00 H new ATOM 0 HB THR A 111 -1.679 1.170 -11.175 1.00 0.00 H new ATOM 0 HG1 THR A 111 -1.604 1.759 -13.372 1.00 0.00 H new ATOM 0 HG21 THR A 111 0.779 1.252 -11.114 1.00 0.00 H new ATOM 0 HG22 THR A 111 0.124 -0.191 -10.304 1.00 0.00 H new ATOM 0 HG23 THR A 111 0.839 -0.329 -11.928 1.00 0.00 H new ATOM 1513 N TYR A 112 -1.589 -2.710 -10.892 1.00 0.00 N ATOM 1514 CA TYR A 112 -1.734 -3.716 -9.843 1.00 0.00 C ATOM 1515 C TYR A 112 -0.331 -4.092 -9.351 1.00 0.00 C ATOM 1516 O TYR A 112 0.441 -4.753 -10.054 1.00 0.00 O ATOM 1517 CB TYR A 112 -2.435 -4.966 -10.418 1.00 0.00 C ATOM 1518 CG TYR A 112 -3.943 -5.022 -10.234 1.00 0.00 C ATOM 1519 CD1 TYR A 112 -4.795 -4.180 -10.975 1.00 0.00 C ATOM 1520 CD2 TYR A 112 -4.499 -5.939 -9.319 1.00 0.00 C ATOM 1521 CE1 TYR A 112 -6.188 -4.231 -10.782 1.00 0.00 C ATOM 1522 CE2 TYR A 112 -5.890 -6.010 -9.137 1.00 0.00 C ATOM 1523 CZ TYR A 112 -6.742 -5.147 -9.858 1.00 0.00 C ATOM 1524 OH TYR A 112 -8.093 -5.215 -9.669 1.00 0.00 O ATOM 0 H TYR A 112 -0.884 -2.962 -11.584 1.00 0.00 H new ATOM 0 HA TYR A 112 -2.333 -3.325 -9.020 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -2.216 -5.024 -11.484 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -1.998 -5.850 -9.954 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -4.377 -3.492 -11.695 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -3.851 -6.592 -8.754 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -6.835 -3.570 -11.340 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -6.308 -6.726 -8.445 1.00 0.00 H new ATOM 0 HH TYR A 112 -8.295 -5.901 -8.999 1.00 0.00 H new ATOM 1534 N LEU A 113 -0.052 -3.807 -8.085 1.00 0.00 N ATOM 1535 CA LEU A 113 1.206 -4.098 -7.398 1.00 0.00 C ATOM 1536 C LEU A 113 0.902 -5.061 -6.255 1.00 0.00 C ATOM 1537 O LEU A 113 -0.264 -5.285 -5.921 1.00 0.00 O ATOM 1538 CB LEU A 113 1.971 -2.832 -6.981 1.00 0.00 C ATOM 1539 CG LEU A 113 1.201 -1.888 -6.039 1.00 0.00 C ATOM 1540 CD1 LEU A 113 1.689 -2.046 -4.603 1.00 0.00 C ATOM 1541 CD2 LEU A 113 1.369 -0.437 -6.499 1.00 0.00 C ATOM 0 H LEU A 113 -0.728 -3.344 -7.478 1.00 0.00 H new ATOM 0 HA LEU A 113 1.903 -4.583 -8.081 1.00 0.00 H new ATOM 0 HB2 LEU A 113 2.899 -3.130 -6.493 1.00 0.00 H new ATOM 0 HB3 LEU A 113 2.246 -2.279 -7.879 1.00 0.00 H new ATOM 0 HG LEU A 113 0.144 -2.151 -6.073 1.00 0.00 H new ATOM 0 HD11 LEU A 113 1.133 -1.371 -3.953 1.00 0.00 H new ATOM 0 HD12 LEU A 113 1.533 -3.074 -4.277 1.00 0.00 H new ATOM 0 HD13 LEU A 113 2.751 -1.806 -4.551 1.00 0.00 H new ATOM 0 HD21 LEU A 113 0.821 0.223 -5.827 1.00 0.00 H new ATOM 0 HD22 LEU A 113 2.426 -0.171 -6.487 1.00 0.00 H new ATOM 0 HD23 LEU A 113 0.980 -0.329 -7.511 1.00 0.00 H new ATOM 1553 N LYS A 114 1.930 -5.700 -5.699 1.00 0.00 N ATOM 1554 CA LYS A 114 1.818 -6.663 -4.611 1.00 0.00 C ATOM 1555 C LYS A 114 2.963 -6.447 -3.634 1.00 0.00 C ATOM 1556 O LYS A 114 4.098 -6.252 -4.071 1.00 0.00 O ATOM 1557 CB LYS A 114 1.887 -8.107 -5.140 1.00 0.00 C ATOM 1558 CG LYS A 114 0.987 -8.471 -6.325 1.00 0.00 C ATOM 1559 CD LYS A 114 -0.489 -8.533 -5.926 1.00 0.00 C ATOM 1560 CE LYS A 114 -1.389 -8.609 -7.157 1.00 0.00 C ATOM 1561 NZ LYS A 114 -1.246 -9.904 -7.844 1.00 0.00 N ATOM 0 H LYS A 114 2.892 -5.556 -6.005 1.00 0.00 H new ATOM 0 HA LYS A 114 0.857 -6.514 -4.119 1.00 0.00 H new ATOM 0 HB2 LYS A 114 2.919 -8.311 -5.426 1.00 0.00 H new ATOM 0 HB3 LYS A 114 1.646 -8.779 -4.316 1.00 0.00 H new ATOM 0 HG2 LYS A 114 1.117 -7.735 -7.119 1.00 0.00 H new ATOM 0 HG3 LYS A 114 1.294 -9.435 -6.731 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -0.661 -9.403 -5.292 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -0.747 -7.653 -5.337 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -2.428 -8.465 -6.860 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -1.139 -7.801 -7.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -1.869 -9.926 -8.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -0.259 -10.029 -8.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -1.508 -10.673 -7.194 1.00 0.00 H new ATOM 1575 N SER A 115 2.676 -6.471 -2.337 1.00 0.00 N ATOM 1576 CA SER A 115 3.649 -6.293 -1.274 1.00 0.00 C ATOM 1577 C SER A 115 3.506 -7.486 -0.338 1.00 0.00 C ATOM 1578 O SER A 115 2.436 -7.682 0.252 1.00 0.00 O ATOM 1579 CB SER A 115 3.411 -4.949 -0.571 1.00 0.00 C ATOM 1580 OG SER A 115 4.192 -4.817 0.601 1.00 0.00 O ATOM 0 H SER A 115 1.729 -6.620 -1.989 1.00 0.00 H new ATOM 0 HA SER A 115 4.671 -6.259 -1.652 1.00 0.00 H new ATOM 0 HB2 SER A 115 3.646 -4.135 -1.257 1.00 0.00 H new ATOM 0 HB3 SER A 115 2.356 -4.856 -0.315 1.00 0.00 H new ATOM 0 HG SER A 115 4.345 -3.867 0.787 1.00 0.00 H new ATOM 1586 N PHE A 116 4.598 -8.250 -0.224 1.00 0.00 N ATOM 1587 CA PHE A 116 4.769 -9.444 0.596 1.00 0.00 C ATOM 1588 C PHE A 116 3.483 -10.276 0.700 1.00 0.00 C ATOM 1589 O PHE A 116 2.960 -10.506 1.794 1.00 0.00 O ATOM 1590 CB PHE A 116 5.358 -9.036 1.966 1.00 0.00 C ATOM 1591 CG PHE A 116 5.575 -10.142 2.998 1.00 0.00 C ATOM 1592 CD1 PHE A 116 5.922 -11.454 2.615 1.00 0.00 C ATOM 1593 CD2 PHE A 116 5.388 -9.861 4.365 1.00 0.00 C ATOM 1594 CE1 PHE A 116 6.087 -12.463 3.581 1.00 0.00 C ATOM 1595 CE2 PHE A 116 5.542 -10.872 5.330 1.00 0.00 C ATOM 1596 CZ PHE A 116 5.888 -12.176 4.942 1.00 0.00 C ATOM 0 H PHE A 116 5.447 -8.029 -0.744 1.00 0.00 H new ATOM 0 HA PHE A 116 5.480 -10.113 0.111 1.00 0.00 H new ATOM 0 HB2 PHE A 116 6.317 -8.549 1.788 1.00 0.00 H new ATOM 0 HB3 PHE A 116 4.698 -8.289 2.407 1.00 0.00 H new ATOM 0 HD1 PHE A 116 6.062 -11.686 1.570 1.00 0.00 H new ATOM 0 HD2 PHE A 116 5.124 -8.861 4.675 1.00 0.00 H new ATOM 0 HE1 PHE A 116 6.367 -13.460 3.276 1.00 0.00 H new ATOM 0 HE2 PHE A 116 5.393 -10.644 6.375 1.00 0.00 H new ATOM 0 HZ PHE A 116 6.000 -12.953 5.684 1.00 0.00 H new ATOM 1606 N GLU A 117 2.933 -10.696 -0.435 1.00 0.00 N ATOM 1607 CA GLU A 117 1.729 -11.516 -0.452 1.00 0.00 C ATOM 1608 C GLU A 117 2.055 -12.925 0.067 1.00 0.00 C ATOM 1609 O GLU A 117 3.208 -13.233 0.396 1.00 0.00 O ATOM 1610 CB GLU A 117 1.142 -11.555 -1.870 1.00 0.00 C ATOM 1611 CG GLU A 117 2.089 -12.176 -2.912 1.00 0.00 C ATOM 1612 CD GLU A 117 2.813 -11.124 -3.753 1.00 0.00 C ATOM 1613 OE1 GLU A 117 3.265 -10.108 -3.178 1.00 0.00 O ATOM 1614 OE2 GLU A 117 2.890 -11.335 -4.989 1.00 0.00 O ATOM 0 H GLU A 117 3.306 -10.480 -1.360 1.00 0.00 H new ATOM 0 HA GLU A 117 0.977 -11.081 0.206 1.00 0.00 H new ATOM 0 HB2 GLU A 117 0.211 -12.122 -1.853 1.00 0.00 H new ATOM 0 HB3 GLU A 117 0.891 -10.540 -2.178 1.00 0.00 H new ATOM 0 HG2 GLU A 117 2.825 -12.798 -2.403 1.00 0.00 H new ATOM 0 HG3 GLU A 117 1.519 -12.832 -3.570 1.00 0.00 H new ATOM 1621 N ALA A 118 1.049 -13.794 0.152 1.00 0.00 N ATOM 1622 CA ALA A 118 1.203 -15.160 0.607 1.00 0.00 C ATOM 1623 C ALA A 118 0.354 -16.099 -0.246 1.00 0.00 C ATOM 1624 O ALA A 118 0.178 -15.873 -1.442 1.00 0.00 O ATOM 1625 CB ALA A 118 0.946 -15.242 2.124 1.00 0.00 C ATOM 0 H ALA A 118 0.090 -13.556 -0.100 1.00 0.00 H new ATOM 0 HA ALA A 118 2.229 -15.500 0.469 1.00 0.00 H new ATOM 0 HB1 ALA A 118 1.064 -16.273 2.458 1.00 0.00 H new ATOM 0 HB2 ALA A 118 1.660 -14.607 2.649 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -0.068 -14.904 2.340 1.00 0.00 H new ATOM 1631 N ASP A 119 -0.048 -17.221 0.334 1.00 0.00 N ATOM 1632 CA ASP A 119 -0.863 -18.238 -0.306 1.00 0.00 C ATOM 1633 C ASP A 119 -2.299 -17.736 -0.354 1.00 0.00 C ATOM 1634 O ASP A 119 -2.702 -16.927 0.484 1.00 0.00 O ATOM 1635 CB ASP A 119 -0.750 -19.547 0.482 1.00 0.00 C ATOM 1636 CG ASP A 119 0.496 -20.307 0.051 1.00 0.00 C ATOM 1637 OD1 ASP A 119 1.569 -20.078 0.665 1.00 0.00 O ATOM 1638 OD2 ASP A 119 0.414 -21.067 -0.937 1.00 0.00 O ATOM 0 H ASP A 119 0.194 -17.454 1.297 1.00 0.00 H new ATOM 0 HA ASP A 119 -0.523 -18.432 -1.323 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -0.706 -19.335 1.550 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -1.636 -20.160 0.315 1.00 0.00 H new ATOM 1643 N ALA A 120 -3.085 -18.219 -1.319 1.00 0.00 N ATOM 1644 CA ALA A 120 -4.483 -17.826 -1.501 1.00 0.00 C ATOM 1645 C ALA A 120 -5.359 -18.166 -0.289 1.00 0.00 C ATOM 1646 O ALA A 120 -6.451 -17.619 -0.147 1.00 0.00 O ATOM 1647 CB ALA A 120 -5.030 -18.488 -2.769 1.00 0.00 C ATOM 0 H ALA A 120 -2.764 -18.903 -2.004 1.00 0.00 H new ATOM 0 HA ALA A 120 -4.515 -16.741 -1.603 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -6.071 -18.199 -2.910 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -4.444 -18.165 -3.630 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -4.964 -19.572 -2.671 1.00 0.00 H new ATOM 1653 N GLU A 121 -4.876 -19.035 0.586 1.00 0.00 N ATOM 1654 CA GLU A 121 -5.523 -19.496 1.801 1.00 0.00 C ATOM 1655 C GLU A 121 -5.109 -18.630 2.991 1.00 0.00 C ATOM 1656 O GLU A 121 -5.904 -18.371 3.898 1.00 0.00 O ATOM 1657 CB GLU A 121 -5.027 -20.927 2.013 1.00 0.00 C ATOM 1658 CG GLU A 121 -5.636 -21.635 3.223 1.00 0.00 C ATOM 1659 CD GLU A 121 -5.245 -23.106 3.185 1.00 0.00 C ATOM 1660 OE1 GLU A 121 -5.705 -23.831 2.273 1.00 0.00 O ATOM 1661 OE2 GLU A 121 -4.419 -23.530 4.032 1.00 0.00 O ATOM 0 H GLU A 121 -3.960 -19.464 0.455 1.00 0.00 H new ATOM 0 HA GLU A 121 -6.608 -19.442 1.718 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -5.245 -21.510 1.118 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -3.943 -20.910 2.125 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -5.282 -21.175 4.146 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -6.721 -21.533 3.212 1.00 0.00 H new ATOM 1668 N GLY A 122 -3.854 -18.184 2.981 1.00 0.00 N ATOM 1669 CA GLY A 122 -3.274 -17.372 4.024 1.00 0.00 C ATOM 1670 C GLY A 122 -3.724 -15.931 3.902 1.00 0.00 C ATOM 1671 O GLY A 122 -4.320 -15.400 4.843 1.00 0.00 O ATOM 0 H GLY A 122 -3.204 -18.389 2.222 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -3.562 -17.766 4.999 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -2.187 -17.423 3.968 1.00 0.00 H new ATOM 1675 N ARG A 123 -3.333 -15.285 2.796 1.00 0.00 N ATOM 1676 CA ARG A 123 -3.630 -13.891 2.453 1.00 0.00 C ATOM 1677 C ARG A 123 -2.903 -13.486 1.177 1.00 0.00 C ATOM 1678 O ARG A 123 -1.771 -13.919 0.956 1.00 0.00 O ATOM 1679 CB ARG A 123 -3.204 -12.899 3.557 1.00 0.00 C ATOM 1680 CG ARG A 123 -1.758 -12.960 4.082 1.00 0.00 C ATOM 1681 CD ARG A 123 -1.566 -13.999 5.186 1.00 0.00 C ATOM 1682 NE ARG A 123 -0.469 -13.637 6.089 1.00 0.00 N ATOM 1683 CZ ARG A 123 -0.370 -14.051 7.354 1.00 0.00 C ATOM 1684 NH1 ARG A 123 -1.234 -14.905 7.891 1.00 0.00 N ATOM 1685 NH2 ARG A 123 0.610 -13.601 8.116 1.00 0.00 N ATOM 0 H ARG A 123 -2.772 -15.746 2.080 1.00 0.00 H new ATOM 0 HA ARG A 123 -4.712 -13.843 2.327 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -3.378 -11.891 3.182 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -3.871 -13.042 4.407 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -1.086 -13.189 3.255 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -1.473 -11.978 4.461 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -2.489 -14.098 5.757 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -1.362 -14.972 4.738 1.00 0.00 H new ATOM 0 HE ARG A 123 0.266 -13.029 5.727 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -2.007 -15.268 7.332 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -1.125 -15.198 8.862 1.00 0.00 H new ATOM 0 HH21 ARG A 123 1.288 -12.939 7.737 1.00 0.00 H new ATOM 0 HH22 ARG A 123 0.689 -13.915 9.083 1.00 0.00 H new ATOM 1699 N ARG A 124 -3.498 -12.652 0.323 1.00 0.00 N ATOM 1700 CA ARG A 124 -2.841 -12.185 -0.900 1.00 0.00 C ATOM 1701 C ARG A 124 -3.117 -10.703 -1.092 1.00 0.00 C ATOM 1702 O ARG A 124 -4.167 -10.223 -0.670 1.00 0.00 O ATOM 1703 CB ARG A 124 -3.250 -13.057 -2.093 1.00 0.00 C ATOM 1704 CG ARG A 124 -2.054 -13.851 -2.664 1.00 0.00 C ATOM 1705 CD ARG A 124 -2.478 -15.293 -2.941 1.00 0.00 C ATOM 1706 NE ARG A 124 -1.574 -15.990 -3.866 1.00 0.00 N ATOM 1707 CZ ARG A 124 -1.677 -16.059 -5.197 1.00 0.00 C ATOM 1708 NH1 ARG A 124 -2.605 -15.374 -5.853 1.00 0.00 N ATOM 1709 NH2 ARG A 124 -0.846 -16.826 -5.882 1.00 0.00 N ATOM 0 H ARG A 124 -4.440 -12.284 0.457 1.00 0.00 H new ATOM 0 HA ARG A 124 -1.759 -12.291 -0.816 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -4.032 -13.751 -1.784 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -3.674 -12.427 -2.875 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -1.700 -13.383 -3.583 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -1.224 -13.835 -1.958 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -2.519 -15.841 -2.000 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -3.486 -15.296 -3.356 1.00 0.00 H new ATOM 0 HE ARG A 124 -0.781 -16.475 -3.446 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -3.258 -14.780 -5.341 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -2.666 -15.441 -6.869 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -0.129 -17.363 -5.395 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -0.922 -16.881 -6.898 1.00 0.00 H new ATOM 1723 N PHE A 125 -2.196 -9.982 -1.723 1.00 0.00 N ATOM 1724 CA PHE A 125 -2.335 -8.551 -1.954 1.00 0.00 C ATOM 1725 C PHE A 125 -3.228 -8.321 -3.172 1.00 0.00 C ATOM 1726 O PHE A 125 -3.061 -8.982 -4.207 1.00 0.00 O ATOM 1727 CB PHE A 125 -0.940 -7.928 -2.137 1.00 0.00 C ATOM 1728 CG PHE A 125 -0.885 -6.409 -2.052 1.00 0.00 C ATOM 1729 CD1 PHE A 125 -1.384 -5.608 -3.096 1.00 0.00 C ATOM 1730 CD2 PHE A 125 -0.301 -5.782 -0.933 1.00 0.00 C ATOM 1731 CE1 PHE A 125 -1.301 -4.208 -3.018 1.00 0.00 C ATOM 1732 CE2 PHE A 125 -0.270 -4.380 -0.830 1.00 0.00 C ATOM 1733 CZ PHE A 125 -0.768 -3.589 -1.877 1.00 0.00 C ATOM 0 H PHE A 125 -1.330 -10.376 -2.089 1.00 0.00 H new ATOM 0 HA PHE A 125 -2.807 -8.068 -1.098 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -0.274 -8.341 -1.379 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -0.548 -8.235 -3.107 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -1.833 -6.072 -3.962 1.00 0.00 H new ATOM 0 HD2 PHE A 125 0.127 -6.385 -0.146 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -1.650 -3.604 -3.842 1.00 0.00 H new ATOM 0 HE2 PHE A 125 0.137 -3.912 0.054 1.00 0.00 H new ATOM 0 HZ PHE A 125 -0.741 -2.512 -1.805 1.00 0.00 H new ATOM 1743 N GLU A 126 -4.198 -7.425 -3.064 1.00 0.00 N ATOM 1744 CA GLU A 126 -5.100 -7.084 -4.155 1.00 0.00 C ATOM 1745 C GLU A 126 -5.654 -5.692 -3.915 1.00 0.00 C ATOM 1746 O GLU A 126 -6.376 -5.468 -2.951 1.00 0.00 O ATOM 1747 CB GLU A 126 -6.229 -8.105 -4.309 1.00 0.00 C ATOM 1748 CG GLU A 126 -7.017 -7.887 -5.616 1.00 0.00 C ATOM 1749 CD GLU A 126 -7.661 -9.173 -6.134 1.00 0.00 C ATOM 1750 OE1 GLU A 126 -6.910 -10.165 -6.302 1.00 0.00 O ATOM 1751 OE2 GLU A 126 -8.893 -9.211 -6.350 1.00 0.00 O ATOM 0 H GLU A 126 -4.383 -6.907 -2.205 1.00 0.00 H new ATOM 0 HA GLU A 126 -4.540 -7.102 -5.090 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -5.813 -9.113 -4.298 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -6.906 -8.030 -3.458 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -7.792 -7.139 -5.449 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -6.347 -7.488 -6.378 1.00 0.00 H new ATOM 1758 N VAL A 127 -5.253 -4.766 -4.771 1.00 0.00 N ATOM 1759 CA VAL A 127 -5.630 -3.361 -4.795 1.00 0.00 C ATOM 1760 C VAL A 127 -5.680 -2.993 -6.281 1.00 0.00 C ATOM 1761 O VAL A 127 -5.089 -3.698 -7.108 1.00 0.00 O ATOM 1762 CB VAL A 127 -4.571 -2.524 -4.034 1.00 0.00 C ATOM 1763 CG1 VAL A 127 -4.789 -1.013 -4.147 1.00 0.00 C ATOM 1764 CG2 VAL A 127 -4.517 -2.889 -2.543 1.00 0.00 C ATOM 0 H VAL A 127 -4.606 -4.994 -5.525 1.00 0.00 H new ATOM 0 HA VAL A 127 -6.586 -3.166 -4.309 1.00 0.00 H new ATOM 0 HB VAL A 127 -3.627 -2.774 -4.518 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -4.011 -0.491 -3.590 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -4.747 -0.717 -5.195 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -5.765 -0.754 -3.736 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -3.762 -2.280 -2.046 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -5.490 -2.704 -2.088 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -4.261 -3.943 -2.435 1.00 0.00 H new ATOM 1774 N ALA A 128 -6.379 -1.917 -6.637 1.00 0.00 N ATOM 1775 CA ALA A 128 -6.492 -1.443 -8.003 1.00 0.00 C ATOM 1776 C ALA A 128 -6.216 0.053 -8.007 1.00 0.00 C ATOM 1777 O ALA A 128 -6.801 0.799 -7.226 1.00 0.00 O ATOM 1778 CB ALA A 128 -7.881 -1.763 -8.551 1.00 0.00 C ATOM 0 H ALA A 128 -6.890 -1.343 -5.966 1.00 0.00 H new ATOM 0 HA ALA A 128 -5.768 -1.940 -8.649 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -7.959 -1.404 -9.577 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -8.041 -2.841 -8.530 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -8.636 -1.273 -7.937 1.00 0.00 H new ATOM 1784 N LEU A 129 -5.334 0.488 -8.898 1.00 0.00 N ATOM 1785 CA LEU A 129 -4.945 1.878 -9.058 1.00 0.00 C ATOM 1786 C LEU A 129 -5.404 2.282 -10.447 1.00 0.00 C ATOM 1787 O LEU A 129 -5.027 1.628 -11.419 1.00 0.00 O ATOM 1788 CB LEU A 129 -3.419 1.962 -8.876 1.00 0.00 C ATOM 1789 CG LEU A 129 -2.796 3.359 -9.056 1.00 0.00 C ATOM 1790 CD1 LEU A 129 -1.467 3.375 -8.291 1.00 0.00 C ATOM 1791 CD2 LEU A 129 -2.496 3.787 -10.502 1.00 0.00 C ATOM 0 H LEU A 129 -4.857 -0.138 -9.547 1.00 0.00 H new ATOM 0 HA LEU A 129 -5.392 2.554 -8.329 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -3.171 1.601 -7.878 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -2.950 1.282 -9.587 1.00 0.00 H new ATOM 0 HG LEU A 129 -3.543 4.062 -8.687 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -0.998 4.353 -8.398 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -1.652 3.175 -7.236 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -0.805 2.609 -8.695 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -2.060 4.786 -10.503 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -1.794 3.085 -10.951 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -3.421 3.794 -11.079 1.00 0.00 H new ATOM 1803 N ASP A 130 -6.289 3.266 -10.561 1.00 0.00 N ATOM 1804 CA ASP A 130 -6.776 3.738 -11.852 1.00 0.00 C ATOM 1805 C ASP A 130 -5.740 4.735 -12.358 1.00 0.00 C ATOM 1806 O ASP A 130 -5.630 5.836 -11.813 1.00 0.00 O ATOM 1807 CB ASP A 130 -8.172 4.346 -11.716 1.00 0.00 C ATOM 1808 CG ASP A 130 -8.883 4.392 -13.066 1.00 0.00 C ATOM 1809 OD1 ASP A 130 -8.599 5.269 -13.913 1.00 0.00 O ATOM 1810 OD2 ASP A 130 -9.763 3.520 -13.278 1.00 0.00 O ATOM 0 H ASP A 130 -6.689 3.758 -9.762 1.00 0.00 H new ATOM 0 HA ASP A 130 -6.888 2.925 -12.569 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -8.761 3.759 -11.011 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -8.095 5.353 -11.307 1.00 0.00 H new ATOM 1815 N GLY A 131 -4.974 4.336 -13.373 1.00 0.00 N ATOM 1816 CA GLY A 131 -3.906 5.112 -13.982 1.00 0.00 C ATOM 1817 C GLY A 131 -2.625 4.272 -13.935 1.00 0.00 C ATOM 1818 O GLY A 131 -2.680 3.040 -13.807 1.00 0.00 O ATOM 0 H GLY A 131 -5.090 3.421 -13.809 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -4.158 5.365 -15.012 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -3.765 6.052 -13.448 1.00 0.00 H new ATOM 1822 N ASP A 132 -1.478 4.934 -14.075 1.00 0.00 N ATOM 1823 CA ASP A 132 -0.118 4.382 -14.060 1.00 0.00 C ATOM 1824 C ASP A 132 0.811 5.448 -13.454 1.00 0.00 C ATOM 1825 O ASP A 132 0.338 6.534 -13.113 1.00 0.00 O ATOM 1826 CB ASP A 132 0.280 3.992 -15.494 1.00 0.00 C ATOM 1827 CG ASP A 132 1.450 3.007 -15.597 1.00 0.00 C ATOM 1828 OD1 ASP A 132 2.145 2.696 -14.605 1.00 0.00 O ATOM 1829 OD2 ASP A 132 1.733 2.536 -16.727 1.00 0.00 O ATOM 0 H ASP A 132 -1.471 5.945 -14.212 1.00 0.00 H new ATOM 0 HA ASP A 132 -0.047 3.479 -13.453 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -0.587 3.556 -15.990 1.00 0.00 H new ATOM 0 HB3 ASP A 132 0.538 4.898 -16.042 1.00 0.00 H new ATOM 1834 N HIS A 133 2.104 5.183 -13.271 1.00 0.00 N ATOM 1835 CA HIS A 133 3.049 6.136 -12.700 1.00 0.00 C ATOM 1836 C HIS A 133 4.453 5.849 -13.230 1.00 0.00 C ATOM 1837 O HIS A 133 5.199 5.033 -12.691 1.00 0.00 O ATOM 1838 CB HIS A 133 2.985 6.181 -11.160 1.00 0.00 C ATOM 1839 CG HIS A 133 2.754 4.859 -10.437 1.00 0.00 C ATOM 1840 ND1 HIS A 133 1.929 4.681 -9.346 1.00 0.00 N ATOM 1841 CD2 HIS A 133 3.300 3.632 -10.726 1.00 0.00 C ATOM 1842 CE1 HIS A 133 1.982 3.388 -8.986 1.00 0.00 C ATOM 1843 NE2 HIS A 133 2.814 2.709 -9.791 1.00 0.00 N ATOM 0 H HIS A 133 2.528 4.289 -13.519 1.00 0.00 H new ATOM 0 HA HIS A 133 2.766 7.138 -13.021 1.00 0.00 H new ATOM 0 HB2 HIS A 133 3.919 6.608 -10.795 1.00 0.00 H new ATOM 0 HB3 HIS A 133 2.188 6.867 -10.874 1.00 0.00 H new ATOM 0 HD1 HIS A 133 1.374 5.406 -8.891 1.00 0.00 H new ATOM 0 HD2 HIS A 133 3.984 3.417 -11.533 1.00 0.00 H new ATOM 0 HE1 HIS A 133 1.432 2.955 -8.164 1.00 0.00 H new ATOM 1851 N THR A 134 4.775 6.453 -14.364 1.00 0.00 N ATOM 1852 CA THR A 134 6.068 6.330 -15.007 1.00 0.00 C ATOM 1853 C THR A 134 7.066 7.050 -14.080 1.00 0.00 C ATOM 1854 O THR A 134 6.696 7.960 -13.330 1.00 0.00 O ATOM 1855 CB THR A 134 5.956 6.899 -16.442 1.00 0.00 C ATOM 1856 OG1 THR A 134 6.741 6.184 -17.378 1.00 0.00 O ATOM 1857 CG2 THR A 134 6.285 8.387 -16.581 1.00 0.00 C ATOM 0 H THR A 134 4.127 7.055 -14.872 1.00 0.00 H new ATOM 0 HA THR A 134 6.420 5.307 -15.138 1.00 0.00 H new ATOM 0 HB THR A 134 4.896 6.774 -16.662 1.00 0.00 H new ATOM 0 HG1 THR A 134 6.633 6.582 -18.267 1.00 0.00 H new ATOM 0 HG21 THR A 134 6.177 8.688 -17.623 1.00 0.00 H new ATOM 0 HG22 THR A 134 5.602 8.970 -15.963 1.00 0.00 H new ATOM 0 HG23 THR A 134 7.310 8.565 -16.256 1.00 0.00 H new ATOM 1865 N GLY A 135 8.340 6.660 -14.114 1.00 0.00 N ATOM 1866 CA GLY A 135 9.357 7.271 -13.270 1.00 0.00 C ATOM 1867 C GLY A 135 9.042 7.080 -11.786 1.00 0.00 C ATOM 1868 O GLY A 135 9.480 7.896 -10.977 1.00 0.00 O ATOM 0 H GLY A 135 8.690 5.919 -14.722 1.00 0.00 H new ATOM 0 HA2 GLY A 135 10.330 6.834 -13.496 1.00 0.00 H new ATOM 0 HA3 GLY A 135 9.426 8.335 -13.494 1.00 0.00 H new ATOM 1872 N ASP A 136 8.441 5.939 -11.426 1.00 0.00 N ATOM 1873 CA ASP A 136 8.039 5.623 -10.054 1.00 0.00 C ATOM 1874 C ASP A 136 9.183 5.680 -9.032 1.00 0.00 C ATOM 1875 O ASP A 136 10.375 5.614 -9.350 1.00 0.00 O ATOM 1876 CB ASP A 136 7.421 4.209 -9.987 1.00 0.00 C ATOM 1877 CG ASP A 136 8.451 3.076 -10.114 1.00 0.00 C ATOM 1878 OD1 ASP A 136 9.200 2.793 -9.147 1.00 0.00 O ATOM 1879 OD2 ASP A 136 8.547 2.470 -11.205 1.00 0.00 O ATOM 0 H ASP A 136 8.218 5.199 -12.092 1.00 0.00 H new ATOM 0 HA ASP A 136 7.317 6.395 -9.788 1.00 0.00 H new ATOM 0 HB2 ASP A 136 6.889 4.100 -9.042 1.00 0.00 H new ATOM 0 HB3 ASP A 136 6.683 4.107 -10.782 1.00 0.00 H new ATOM 1884 N LEU A 137 8.772 5.875 -7.774 1.00 0.00 N ATOM 1885 CA LEU A 137 9.617 5.971 -6.599 1.00 0.00 C ATOM 1886 C LEU A 137 9.142 5.101 -5.460 1.00 0.00 C ATOM 1887 O LEU A 137 7.970 4.738 -5.387 1.00 0.00 O ATOM 1888 CB LEU A 137 9.834 7.404 -6.146 1.00 0.00 C ATOM 1889 CG LEU A 137 11.247 7.913 -6.452 1.00 0.00 C ATOM 1890 CD1 LEU A 137 11.286 9.425 -6.226 1.00 0.00 C ATOM 1891 CD2 LEU A 137 12.322 7.207 -5.612 1.00 0.00 C ATOM 0 H LEU A 137 7.783 5.974 -7.546 1.00 0.00 H new ATOM 0 HA LEU A 137 10.587 5.584 -6.911 1.00 0.00 H new ATOM 0 HB2 LEU A 137 9.105 8.050 -6.636 1.00 0.00 H new ATOM 0 HB3 LEU A 137 9.651 7.473 -5.074 1.00 0.00 H new ATOM 0 HG LEU A 137 11.476 7.684 -7.493 1.00 0.00 H new ATOM 0 HD11 LEU A 137 12.287 9.799 -6.441 1.00 0.00 H new ATOM 0 HD12 LEU A 137 10.568 9.910 -6.887 1.00 0.00 H new ATOM 0 HD13 LEU A 137 11.031 9.645 -5.189 1.00 0.00 H new ATOM 0 HD21 LEU A 137 13.304 7.605 -5.868 1.00 0.00 H new ATOM 0 HD22 LEU A 137 12.126 7.377 -4.553 1.00 0.00 H new ATOM 0 HD23 LEU A 137 12.300 6.137 -5.817 1.00 0.00 H new ATOM 1903 N SER A 138 10.081 4.799 -4.568 1.00 0.00 N ATOM 1904 CA SER A 138 9.894 3.975 -3.398 1.00 0.00 C ATOM 1905 C SER A 138 10.760 4.525 -2.275 1.00 0.00 C ATOM 1906 O SER A 138 10.227 5.183 -1.396 1.00 0.00 O ATOM 1907 CB SER A 138 10.285 2.545 -3.689 1.00 0.00 C ATOM 1908 OG SER A 138 9.573 1.974 -4.779 1.00 0.00 O ATOM 0 H SER A 138 11.037 5.144 -4.654 1.00 0.00 H new ATOM 0 HA SER A 138 8.844 3.990 -3.107 1.00 0.00 H new ATOM 0 HB2 SER A 138 11.353 2.505 -3.902 1.00 0.00 H new ATOM 0 HB3 SER A 138 10.115 1.941 -2.798 1.00 0.00 H new ATOM 0 HG SER A 138 9.872 1.051 -4.917 1.00 0.00 H new ATOM 1914 N ALA A 139 12.088 4.376 -2.354 1.00 0.00 N ATOM 1915 CA ALA A 139 13.088 4.821 -1.383 1.00 0.00 C ATOM 1916 C ALA A 139 13.003 6.308 -1.041 1.00 0.00 C ATOM 1917 O ALA A 139 13.775 6.792 -0.217 1.00 0.00 O ATOM 1918 CB ALA A 139 14.480 4.483 -1.921 1.00 0.00 C ATOM 0 H ALA A 139 12.518 3.910 -3.153 1.00 0.00 H new ATOM 0 HA ALA A 139 12.887 4.293 -0.451 1.00 0.00 H new ATOM 0 HB1 ALA A 139 15.235 4.810 -1.206 1.00 0.00 H new ATOM 0 HB2 ALA A 139 14.561 3.406 -2.068 1.00 0.00 H new ATOM 0 HB3 ALA A 139 14.636 4.992 -2.872 1.00 0.00 H new ATOM 1924 N ALA A 140 12.161 7.052 -1.754 1.00 0.00 N ATOM 1925 CA ALA A 140 11.922 8.470 -1.547 1.00 0.00 C ATOM 1926 C ALA A 140 10.429 8.781 -1.492 1.00 0.00 C ATOM 1927 O ALA A 140 10.025 9.626 -0.694 1.00 0.00 O ATOM 1928 CB ALA A 140 12.655 9.342 -2.565 1.00 0.00 C ATOM 0 H ALA A 140 11.608 6.665 -2.519 1.00 0.00 H new ATOM 0 HA ALA A 140 12.343 8.724 -0.574 1.00 0.00 H new ATOM 0 HB1 ALA A 140 12.442 10.392 -2.365 1.00 0.00 H new ATOM 0 HB2 ALA A 140 13.728 9.168 -2.487 1.00 0.00 H new ATOM 0 HB3 ALA A 140 12.318 9.089 -3.570 1.00 0.00 H new ATOM 1934 N ASN A 141 9.591 8.136 -2.317 1.00 0.00 N ATOM 1935 CA ASN A 141 8.148 8.427 -2.234 1.00 0.00 C ATOM 1936 C ASN A 141 7.514 7.752 -1.032 1.00 0.00 C ATOM 1937 O ASN A 141 6.398 8.075 -0.646 1.00 0.00 O ATOM 1938 CB ASN A 141 7.366 7.850 -3.426 1.00 0.00 C ATOM 1939 CG ASN A 141 7.280 8.756 -4.629 1.00 0.00 C ATOM 1940 OD1 ASN A 141 7.577 9.945 -4.567 1.00 0.00 O ATOM 1941 ND2 ASN A 141 6.966 8.160 -5.761 1.00 0.00 N ATOM 0 H ASN A 141 9.864 7.445 -3.015 1.00 0.00 H new ATOM 0 HA ASN A 141 8.092 9.515 -2.192 1.00 0.00 H new ATOM 0 HB2 ASN A 141 7.833 6.913 -3.728 1.00 0.00 H new ATOM 0 HB3 ASN A 141 6.355 7.611 -3.097 1.00 0.00 H new ATOM 0 HD21 ASN A 141 6.963 8.690 -6.633 1.00 0.00 H new ATOM 0 HD22 ASN A 141 6.725 7.169 -5.766 1.00 0.00 H new ATOM 1948 N VAL A 142 8.223 6.852 -0.384 1.00 0.00 N ATOM 1949 CA VAL A 142 7.687 6.072 0.700 1.00 0.00 C ATOM 1950 C VAL A 142 8.501 6.264 1.966 1.00 0.00 C ATOM 1951 O VAL A 142 9.697 6.577 1.904 1.00 0.00 O ATOM 1952 CB VAL A 142 7.644 4.629 0.144 1.00 0.00 C ATOM 1953 CG1 VAL A 142 6.814 3.718 1.034 1.00 0.00 C ATOM 1954 CG2 VAL A 142 7.059 4.565 -1.299 1.00 0.00 C ATOM 0 H VAL A 142 9.197 6.643 -0.601 1.00 0.00 H new ATOM 0 HA VAL A 142 6.688 6.372 1.016 1.00 0.00 H new ATOM 0 HB VAL A 142 8.680 4.290 0.122 1.00 0.00 H new ATOM 0 HG11 VAL A 142 6.804 2.712 0.616 1.00 0.00 H new ATOM 0 HG12 VAL A 142 7.249 3.691 2.033 1.00 0.00 H new ATOM 0 HG13 VAL A 142 5.794 4.097 1.092 1.00 0.00 H new ATOM 0 HG21 VAL A 142 7.051 3.531 -1.643 1.00 0.00 H new ATOM 0 HG22 VAL A 142 6.041 4.955 -1.297 1.00 0.00 H new ATOM 0 HG23 VAL A 142 7.676 5.165 -1.968 1.00 0.00 H new ATOM 1964 N VAL A 143 7.838 6.142 3.123 1.00 0.00 N ATOM 1965 CA VAL A 143 8.521 6.288 4.399 1.00 0.00 C ATOM 1966 C VAL A 143 9.631 5.233 4.434 1.00 0.00 C ATOM 1967 O VAL A 143 9.443 4.107 3.969 1.00 0.00 O ATOM 1968 CB VAL A 143 7.558 6.209 5.600 1.00 0.00 C ATOM 1969 CG1 VAL A 143 6.979 4.812 5.808 1.00 0.00 C ATOM 1970 CG2 VAL A 143 8.233 6.655 6.907 1.00 0.00 C ATOM 0 H VAL A 143 6.840 5.945 3.194 1.00 0.00 H new ATOM 0 HA VAL A 143 8.958 7.282 4.488 1.00 0.00 H new ATOM 0 HB VAL A 143 6.744 6.891 5.353 1.00 0.00 H new ATOM 0 HG11 VAL A 143 6.309 4.820 6.668 1.00 0.00 H new ATOM 0 HG12 VAL A 143 6.425 4.512 4.919 1.00 0.00 H new ATOM 0 HG13 VAL A 143 7.789 4.105 5.986 1.00 0.00 H new ATOM 0 HG21 VAL A 143 7.519 6.584 7.728 1.00 0.00 H new ATOM 0 HG22 VAL A 143 9.088 6.011 7.113 1.00 0.00 H new ATOM 0 HG23 VAL A 143 8.571 7.687 6.808 1.00 0.00 H new ATOM 1980 N PHE A 144 10.772 5.587 5.017 1.00 0.00 N ATOM 1981 CA PHE A 144 11.928 4.708 5.127 1.00 0.00 C ATOM 1982 C PHE A 144 11.634 3.403 5.874 1.00 0.00 C ATOM 1983 O PHE A 144 12.228 2.373 5.562 1.00 0.00 O ATOM 1984 CB PHE A 144 13.032 5.496 5.825 1.00 0.00 C ATOM 1985 CG PHE A 144 14.042 6.095 4.860 1.00 0.00 C ATOM 1986 CD1 PHE A 144 13.606 6.862 3.760 1.00 0.00 C ATOM 1987 CD2 PHE A 144 15.421 5.906 5.057 1.00 0.00 C ATOM 1988 CE1 PHE A 144 14.533 7.443 2.881 1.00 0.00 C ATOM 1989 CE2 PHE A 144 16.352 6.497 4.184 1.00 0.00 C ATOM 1990 CZ PHE A 144 15.908 7.268 3.097 1.00 0.00 C ATOM 0 H PHE A 144 10.920 6.507 5.432 1.00 0.00 H new ATOM 0 HA PHE A 144 12.229 4.399 4.126 1.00 0.00 H new ATOM 0 HB2 PHE A 144 12.582 6.296 6.413 1.00 0.00 H new ATOM 0 HB3 PHE A 144 13.551 4.840 6.524 1.00 0.00 H new ATOM 0 HD1 PHE A 144 12.549 7.004 3.592 1.00 0.00 H new ATOM 0 HD2 PHE A 144 15.768 5.303 5.884 1.00 0.00 H new ATOM 0 HE1 PHE A 144 14.188 8.024 2.039 1.00 0.00 H new ATOM 0 HE2 PHE A 144 17.410 6.358 4.350 1.00 0.00 H new ATOM 0 HZ PHE A 144 16.623 7.725 2.429 1.00 0.00 H new