USER MOD reduce.3.24.130724 H: found=0, std=0, add=873, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 871 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 5 SER OG : rot 180:sc= -0.0627 USER MOD Set 1.2: A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= 0.194 X(o=0.19,f=-0.06) USER MOD Single : A 17 ASN :FLIP amide:sc= -0.298 F(o=-1.3,f=-0.3) USER MOD Single : A 18 GLN : amide:sc= -4.64 K(o=-4.6,f=-9.5!) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= -0.251 USER MOD Single : A 29 SER OG : rot 33:sc= 0.198 USER MOD Single : A 33 THR OG1 : rot 176:sc= -2.63! USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ -172:sc= 0.00431 (180deg=-0.0316) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc=0.000949 USER MOD Single : A 52 GLN : amide:sc= -0.0195 K(o=-0.02,f=-1.5!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=-0.0063) USER MOD Single : A 61 ASN : amide:sc= 0.366 K(o=0.37,f=-2!) USER MOD Single : A 65 GLN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ -167:sc=-0.00505 (180deg=-0.121) USER MOD Single : A 74 THR OG1 : rot 84:sc= 0.667 USER MOD Single : A 77 TYR OH : rot 180:sc=-0.000724 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 46:sc= 0.405 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= -1.38 USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 104 GLN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 109 THR OG1 : rot 180:sc= -0.0315 USER MOD Single : A 112 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.385 42.117 19.286 1.00 0.00 N ATOM 2 CA GLY A 1 -2.622 42.668 17.965 1.00 0.00 C ATOM 3 C GLY A 1 -1.873 41.918 16.881 1.00 0.00 C ATOM 4 O GLY A 1 -0.648 41.997 16.795 1.00 0.00 O ATOM 0 H1 GLY A 1 -2.919 42.664 19.991 1.00 0.00 H new ATOM 0 H2 GLY A 1 -2.696 41.125 19.309 1.00 0.00 H new ATOM 0 H3 GLY A 1 -1.370 42.166 19.506 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -3.690 42.641 17.750 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -2.321 43.715 17.952 1.00 0.00 H new ATOM 8 N SER A 2 -2.611 41.186 16.052 1.00 0.00 N ATOM 9 CA SER A 2 -2.009 40.414 14.972 1.00 0.00 C ATOM 10 C SER A 2 -2.607 40.807 13.624 1.00 0.00 C ATOM 11 O SER A 2 -3.691 41.387 13.559 1.00 0.00 O ATOM 12 CB SER A 2 -2.208 38.917 15.214 1.00 0.00 C ATOM 13 OG SER A 2 -1.383 38.456 16.270 1.00 0.00 O ATOM 0 H SER A 2 -3.627 41.112 16.108 1.00 0.00 H new ATOM 0 HA SER A 2 -0.941 40.633 14.954 1.00 0.00 H new ATOM 0 HB2 SER A 2 -3.253 38.720 15.453 1.00 0.00 H new ATOM 0 HB3 SER A 2 -1.980 38.365 14.302 1.00 0.00 H new ATOM 0 HG SER A 2 -1.531 37.497 16.406 1.00 0.00 H new ATOM 19 N SER A 3 -1.891 40.487 12.551 1.00 0.00 N ATOM 20 CA SER A 3 -2.348 40.810 11.204 1.00 0.00 C ATOM 21 C SER A 3 -1.821 39.795 10.194 1.00 0.00 C ATOM 22 O SER A 3 -0.627 39.754 9.903 1.00 0.00 O ATOM 23 CB SER A 3 -1.894 42.218 10.812 1.00 0.00 C ATOM 24 OG SER A 3 -2.423 42.591 9.552 1.00 0.00 O ATOM 0 H SER A 3 -0.993 40.005 12.588 1.00 0.00 H new ATOM 0 HA SER A 3 -3.437 40.772 11.198 1.00 0.00 H new ATOM 0 HB2 SER A 3 -2.215 42.932 11.571 1.00 0.00 H new ATOM 0 HB3 SER A 3 -0.805 42.257 10.779 1.00 0.00 H new ATOM 0 HG SER A 3 -2.120 43.495 9.325 1.00 0.00 H new ATOM 30 N GLY A 4 -2.723 38.975 9.663 1.00 0.00 N ATOM 31 CA GLY A 4 -2.332 37.970 8.692 1.00 0.00 C ATOM 32 C GLY A 4 -2.064 38.561 7.322 1.00 0.00 C ATOM 33 O GLY A 4 -2.623 39.598 6.966 1.00 0.00 O ATOM 0 H GLY A 4 -3.718 38.989 9.888 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -1.437 37.457 9.045 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -3.119 37.220 8.613 1.00 0.00 H new ATOM 37 N SER A 5 -1.204 37.901 6.553 1.00 0.00 N ATOM 38 CA SER A 5 -0.858 38.371 5.216 1.00 0.00 C ATOM 39 C SER A 5 -1.813 37.797 4.174 1.00 0.00 C ATOM 40 O SER A 5 -2.326 38.520 3.321 1.00 0.00 O ATOM 41 CB SER A 5 0.582 37.983 4.873 1.00 0.00 C ATOM 42 OG SER A 5 0.744 36.576 4.870 1.00 0.00 O ATOM 0 H SER A 5 -0.734 37.040 6.832 1.00 0.00 H new ATOM 0 HA SER A 5 -0.947 39.457 5.205 1.00 0.00 H new ATOM 0 HB2 SER A 5 0.847 38.385 3.895 1.00 0.00 H new ATOM 0 HB3 SER A 5 1.264 38.429 5.596 1.00 0.00 H new ATOM 0 HG SER A 5 1.672 36.354 4.646 1.00 0.00 H new ATOM 48 N SER A 6 -2.047 36.490 4.251 1.00 0.00 N ATOM 49 CA SER A 6 -2.937 35.816 3.314 1.00 0.00 C ATOM 50 C SER A 6 -4.398 36.073 3.671 1.00 0.00 C ATOM 51 O SER A 6 -4.703 36.621 4.730 1.00 0.00 O ATOM 52 CB SER A 6 -2.659 34.312 3.305 1.00 0.00 C ATOM 53 OG SER A 6 -1.616 33.991 2.401 1.00 0.00 O ATOM 0 H SER A 6 -1.632 35.877 4.953 1.00 0.00 H new ATOM 0 HA SER A 6 -2.748 36.219 2.319 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.389 33.983 4.308 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.565 33.773 3.026 1.00 0.00 H new ATOM 0 HG SER A 6 -1.457 33.024 2.415 1.00 0.00 H new ATOM 59 N GLY A 7 -5.298 35.672 2.779 1.00 0.00 N ATOM 60 CA GLY A 7 -6.717 35.867 3.017 1.00 0.00 C ATOM 61 C GLY A 7 -7.438 34.568 3.317 1.00 0.00 C ATOM 62 O GLY A 7 -7.020 33.783 4.168 1.00 0.00 O ATOM 0 H GLY A 7 -5.070 35.216 1.896 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.851 36.555 3.852 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -7.168 36.336 2.142 1.00 0.00 H new ATOM 66 N PRO A 8 -8.551 34.328 2.607 1.00 0.00 N ATOM 67 CA PRO A 8 -9.356 33.116 2.785 1.00 0.00 C ATOM 68 C PRO A 8 -8.644 31.867 2.277 1.00 0.00 C ATOM 69 O PRO A 8 -7.742 31.934 1.441 1.00 0.00 O ATOM 70 CB PRO A 8 -10.607 33.396 1.949 1.00 0.00 C ATOM 71 CG PRO A 8 -10.163 34.375 0.918 1.00 0.00 C ATOM 72 CD PRO A 8 -9.108 35.220 1.577 1.00 0.00 C ATOM 0 HA PRO A 8 -9.565 32.916 3.836 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -10.989 32.484 1.490 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -11.410 33.804 2.563 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -9.763 33.865 0.042 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -10.997 34.988 0.577 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -8.346 35.538 0.866 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -9.532 36.124 2.015 1.00 0.00 H new ATOM 80 N PRO A 9 -9.057 30.699 2.790 1.00 0.00 N ATOM 81 CA PRO A 9 -8.472 29.412 2.402 1.00 0.00 C ATOM 82 C PRO A 9 -8.830 29.021 0.972 1.00 0.00 C ATOM 83 O PRO A 9 -9.994 29.073 0.576 1.00 0.00 O ATOM 84 CB PRO A 9 -9.091 28.426 3.396 1.00 0.00 C ATOM 85 CG PRO A 9 -10.374 29.061 3.810 1.00 0.00 C ATOM 86 CD PRO A 9 -10.127 30.544 3.790 1.00 0.00 C ATOM 0 HA PRO A 9 -7.383 29.436 2.427 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -9.261 27.453 2.935 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -8.436 28.263 4.252 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -11.181 28.791 3.129 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -10.671 28.728 4.804 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -11.023 31.097 3.508 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -9.819 30.913 4.768 1.00 0.00 H new ATOM 94 N VAL A 10 -7.821 28.629 0.200 1.00 0.00 N ATOM 95 CA VAL A 10 -8.029 28.228 -1.186 1.00 0.00 C ATOM 96 C VAL A 10 -7.153 27.034 -1.550 1.00 0.00 C ATOM 97 O VAL A 10 -5.932 27.156 -1.651 1.00 0.00 O ATOM 98 CB VAL A 10 -7.729 29.385 -2.156 1.00 0.00 C ATOM 99 CG1 VAL A 10 -6.240 29.696 -2.174 1.00 0.00 C ATOM 100 CG2 VAL A 10 -8.229 29.052 -3.554 1.00 0.00 C ATOM 0 H VAL A 10 -6.851 28.581 0.512 1.00 0.00 H new ATOM 0 HA VAL A 10 -9.078 27.948 -1.280 1.00 0.00 H new ATOM 0 HB VAL A 10 -8.257 30.273 -1.808 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -6.048 30.516 -2.865 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -5.916 29.981 -1.173 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -5.688 28.813 -2.496 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -8.008 29.881 -4.226 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -7.732 28.151 -3.913 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -9.306 28.885 -3.525 1.00 0.00 H new ATOM 110 N ILE A 11 -7.785 25.882 -1.746 1.00 0.00 N ATOM 111 CA ILE A 11 -7.063 24.666 -2.101 1.00 0.00 C ATOM 112 C ILE A 11 -6.481 24.763 -3.507 1.00 0.00 C ATOM 113 O ILE A 11 -7.210 24.698 -4.497 1.00 0.00 O ATOM 114 CB ILE A 11 -7.973 23.426 -2.017 1.00 0.00 C ATOM 115 CG1 ILE A 11 -8.537 23.275 -0.603 1.00 0.00 C ATOM 116 CG2 ILE A 11 -7.205 22.177 -2.423 1.00 0.00 C ATOM 117 CD1 ILE A 11 -9.873 22.566 -0.559 1.00 0.00 C ATOM 0 H ILE A 11 -8.795 25.765 -1.665 1.00 0.00 H new ATOM 0 HA ILE A 11 -6.251 24.559 -1.382 1.00 0.00 H new ATOM 0 HB ILE A 11 -8.806 23.557 -2.708 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -7.822 22.724 0.008 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -8.644 24.263 -0.156 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -7.861 21.309 -2.358 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -6.848 22.286 -3.447 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -6.355 22.039 -1.755 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -10.213 22.494 0.474 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -10.602 23.128 -1.143 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -9.767 21.565 -0.977 1.00 0.00 H new ATOM 129 N ARG A 12 -5.164 24.917 -3.587 1.00 0.00 N ATOM 130 CA ARG A 12 -4.484 25.021 -4.873 1.00 0.00 C ATOM 131 C ARG A 12 -4.630 23.730 -5.672 1.00 0.00 C ATOM 132 O ARG A 12 -5.181 23.730 -6.773 1.00 0.00 O ATOM 133 CB ARG A 12 -3.002 25.340 -4.665 1.00 0.00 C ATOM 134 CG ARG A 12 -2.752 26.714 -4.066 1.00 0.00 C ATOM 135 CD ARG A 12 -2.902 27.812 -5.108 1.00 0.00 C ATOM 136 NE ARG A 12 -1.779 27.837 -6.041 1.00 0.00 N ATOM 137 CZ ARG A 12 -1.776 28.538 -7.169 1.00 0.00 C ATOM 138 NH1 ARG A 12 -2.832 29.269 -7.502 1.00 0.00 N ATOM 139 NH2 ARG A 12 -0.716 28.511 -7.967 1.00 0.00 N ATOM 0 H ARG A 12 -4.546 24.973 -2.777 1.00 0.00 H new ATOM 0 HA ARG A 12 -4.948 25.830 -5.437 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -2.565 24.584 -4.013 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -2.487 25.272 -5.623 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -3.452 26.889 -3.249 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -1.749 26.750 -3.640 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -3.830 27.663 -5.661 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -2.980 28.778 -4.609 1.00 0.00 H new ATOM 0 HE ARG A 12 -0.951 27.286 -5.814 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -3.648 29.293 -6.891 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -2.827 29.807 -8.369 1.00 0.00 H new ATOM 0 HH21 ARG A 12 0.098 27.951 -7.714 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -0.716 29.050 -8.833 1.00 0.00 H new ATOM 153 N GLN A 13 -4.133 22.633 -5.110 1.00 0.00 N ATOM 154 CA GLN A 13 -4.208 21.335 -5.772 1.00 0.00 C ATOM 155 C GLN A 13 -4.847 20.294 -4.858 1.00 0.00 C ATOM 156 O GLN A 13 -5.397 19.298 -5.325 1.00 0.00 O ATOM 157 CB GLN A 13 -2.812 20.873 -6.194 1.00 0.00 C ATOM 158 CG GLN A 13 -2.769 19.432 -6.677 1.00 0.00 C ATOM 159 CD GLN A 13 -3.563 19.219 -7.950 1.00 0.00 C ATOM 160 OE1 GLN A 13 -3.170 19.677 -9.024 1.00 0.00 O ATOM 161 NE2 GLN A 13 -4.686 18.521 -7.838 1.00 0.00 N ATOM 0 H GLN A 13 -3.675 22.616 -4.199 1.00 0.00 H new ATOM 0 HA GLN A 13 -4.831 21.443 -6.660 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -2.447 21.525 -6.988 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -2.131 20.985 -5.351 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -1.732 19.141 -6.847 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -3.160 18.779 -5.896 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -4.974 18.160 -6.928 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -5.262 18.345 -8.662 1.00 0.00 H new ATOM 170 N GLY A 14 -4.768 20.532 -3.552 1.00 0.00 N ATOM 171 CA GLY A 14 -5.342 19.606 -2.594 1.00 0.00 C ATOM 172 C GLY A 14 -4.958 18.167 -2.876 1.00 0.00 C ATOM 173 O GLY A 14 -4.110 17.884 -3.723 1.00 0.00 O ATOM 0 H GLY A 14 -4.317 21.349 -3.141 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -5.013 19.876 -1.590 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -6.428 19.699 -2.610 1.00 0.00 H new ATOM 177 N PRO A 15 -5.590 17.230 -2.154 1.00 0.00 N ATOM 178 CA PRO A 15 -5.324 15.797 -2.313 1.00 0.00 C ATOM 179 C PRO A 15 -5.836 15.256 -3.644 1.00 0.00 C ATOM 180 O PRO A 15 -6.820 15.756 -4.191 1.00 0.00 O ATOM 181 CB PRO A 15 -6.090 15.163 -1.149 1.00 0.00 C ATOM 182 CG PRO A 15 -7.177 16.133 -0.838 1.00 0.00 C ATOM 183 CD PRO A 15 -6.611 17.496 -1.128 1.00 0.00 C ATOM 0 HA PRO A 15 -4.256 15.578 -2.309 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -6.495 14.190 -1.425 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -5.441 15.005 -0.287 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -8.059 15.939 -1.448 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -7.486 16.052 0.204 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -7.377 18.180 -1.492 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -6.177 17.949 -0.237 1.00 0.00 H new ATOM 191 N VAL A 16 -5.163 14.233 -4.160 1.00 0.00 N ATOM 192 CA VAL A 16 -5.551 13.624 -5.427 1.00 0.00 C ATOM 193 C VAL A 16 -5.945 12.163 -5.237 1.00 0.00 C ATOM 194 O VAL A 16 -5.694 11.574 -4.186 1.00 0.00 O ATOM 195 CB VAL A 16 -4.413 13.707 -6.462 1.00 0.00 C ATOM 196 CG1 VAL A 16 -4.019 15.155 -6.707 1.00 0.00 C ATOM 197 CG2 VAL A 16 -3.215 12.890 -6.002 1.00 0.00 C ATOM 0 H VAL A 16 -4.346 13.808 -3.720 1.00 0.00 H new ATOM 0 HA VAL A 16 -6.410 14.184 -5.797 1.00 0.00 H new ATOM 0 HB VAL A 16 -4.769 13.289 -7.403 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -3.214 15.194 -7.441 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -4.880 15.708 -7.083 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -3.680 15.603 -5.773 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -2.420 12.960 -6.745 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -2.855 13.277 -5.048 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -3.510 11.847 -5.883 1.00 0.00 H new ATOM 207 N ASN A 17 -6.562 11.584 -6.261 1.00 0.00 N ATOM 208 CA ASN A 17 -6.991 10.191 -6.207 1.00 0.00 C ATOM 209 C ASN A 17 -5.980 9.283 -6.900 1.00 0.00 C ATOM 210 O ASN A 17 -5.647 9.487 -8.067 1.00 0.00 O ATOM 211 CB ASN A 17 -8.366 10.033 -6.858 1.00 0.00 C ATOM 212 CG ASN A 17 -8.474 10.786 -8.170 1.00 0.00 C ATOM 213 OD1 ASN A 17 -9.594 11.472 -8.368 1.00 0.00 O flip ATOM 214 ND2 ASN A 17 -7.561 10.753 -8.995 1.00 0.00 N flip ATOM 0 H ASN A 17 -6.776 12.058 -7.139 1.00 0.00 H new ATOM 0 HA ASN A 17 -7.057 9.898 -5.159 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -8.563 8.975 -7.032 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -9.133 10.392 -6.172 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -6.718 10.213 -8.801 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -7.648 11.266 -9.872 1.00 0.00 H new ATOM 221 N GLN A 18 -5.496 8.282 -6.173 1.00 0.00 N ATOM 222 CA GLN A 18 -4.523 7.343 -6.718 1.00 0.00 C ATOM 223 C GLN A 18 -4.823 5.920 -6.260 1.00 0.00 C ATOM 224 O GLN A 18 -5.230 5.696 -5.119 1.00 0.00 O ATOM 225 CB GLN A 18 -3.107 7.740 -6.296 1.00 0.00 C ATOM 226 CG GLN A 18 -2.913 7.788 -4.789 1.00 0.00 C ATOM 227 CD GLN A 18 -3.289 9.132 -4.195 1.00 0.00 C ATOM 228 OE1 GLN A 18 -3.978 9.932 -4.828 1.00 0.00 O ATOM 229 NE2 GLN A 18 -2.836 9.386 -2.973 1.00 0.00 N ATOM 0 H GLN A 18 -5.762 8.100 -5.205 1.00 0.00 H new ATOM 0 HA GLN A 18 -4.593 7.377 -7.805 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -2.397 7.031 -6.723 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -2.872 8.718 -6.716 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -3.516 7.008 -4.324 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -1.871 7.569 -4.553 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -2.268 8.693 -2.485 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -3.056 10.274 -2.522 1.00 0.00 H new ATOM 238 N THR A 19 -4.619 4.959 -7.156 1.00 0.00 N ATOM 239 CA THR A 19 -4.869 3.557 -6.844 1.00 0.00 C ATOM 240 C THR A 19 -3.636 2.901 -6.234 1.00 0.00 C ATOM 241 O THR A 19 -2.509 3.161 -6.656 1.00 0.00 O ATOM 242 CB THR A 19 -5.288 2.769 -8.099 1.00 0.00 C ATOM 243 OG1 THR A 19 -6.375 3.433 -8.754 1.00 0.00 O ATOM 244 CG2 THR A 19 -5.700 1.350 -7.734 1.00 0.00 C ATOM 0 H THR A 19 -4.281 5.126 -8.104 1.00 0.00 H new ATOM 0 HA THR A 19 -5.684 3.535 -6.121 1.00 0.00 H new ATOM 0 HB THR A 19 -4.433 2.721 -8.773 1.00 0.00 H new ATOM 0 HG1 THR A 19 -6.634 2.927 -9.552 1.00 0.00 H new ATOM 0 HG21 THR A 19 -5.992 0.812 -8.636 1.00 0.00 H new ATOM 0 HG22 THR A 19 -4.862 0.838 -7.262 1.00 0.00 H new ATOM 0 HG23 THR A 19 -6.542 1.382 -7.042 1.00 0.00 H new ATOM 252 N VAL A 20 -3.856 2.049 -5.238 1.00 0.00 N ATOM 253 CA VAL A 20 -2.761 1.354 -4.571 1.00 0.00 C ATOM 254 C VAL A 20 -3.138 -0.090 -4.257 1.00 0.00 C ATOM 255 O VAL A 20 -4.317 -0.424 -4.145 1.00 0.00 O ATOM 256 CB VAL A 20 -2.359 2.064 -3.265 1.00 0.00 C ATOM 257 CG1 VAL A 20 -1.533 1.137 -2.386 1.00 0.00 C ATOM 258 CG2 VAL A 20 -1.596 3.344 -3.568 1.00 0.00 C ATOM 0 H VAL A 20 -4.782 1.823 -4.875 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.914 1.365 -5.257 1.00 0.00 H new ATOM 0 HB VAL A 20 -3.266 2.329 -2.722 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -1.258 1.656 -1.468 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -2.118 0.251 -2.141 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -0.630 0.839 -2.919 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.320 3.833 -2.634 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -0.695 3.105 -4.133 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -2.226 4.013 -4.155 1.00 0.00 H new ATOM 268 N ALA A 21 -2.128 -0.942 -4.115 1.00 0.00 N ATOM 269 CA ALA A 21 -2.352 -2.349 -3.811 1.00 0.00 C ATOM 270 C ALA A 21 -2.316 -2.599 -2.307 1.00 0.00 C ATOM 271 O ALA A 21 -1.724 -1.826 -1.553 1.00 0.00 O ATOM 272 CB ALA A 21 -1.317 -3.214 -4.516 1.00 0.00 C ATOM 0 H ALA A 21 -1.146 -0.682 -4.206 1.00 0.00 H new ATOM 0 HA ALA A 21 -3.343 -2.619 -4.174 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -1.497 -4.263 -4.279 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -1.393 -3.067 -5.593 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -0.319 -2.933 -4.181 1.00 0.00 H new ATOM 278 N VAL A 22 -2.954 -3.682 -1.875 1.00 0.00 N ATOM 279 CA VAL A 22 -2.995 -4.033 -0.461 1.00 0.00 C ATOM 280 C VAL A 22 -1.615 -3.912 0.175 1.00 0.00 C ATOM 281 O VAL A 22 -0.595 -4.076 -0.495 1.00 0.00 O ATOM 282 CB VAL A 22 -3.520 -5.466 -0.253 1.00 0.00 C ATOM 283 CG1 VAL A 22 -3.151 -5.975 1.132 1.00 0.00 C ATOM 284 CG2 VAL A 22 -5.025 -5.518 -0.466 1.00 0.00 C ATOM 0 H VAL A 22 -3.450 -4.332 -2.485 1.00 0.00 H new ATOM 0 HA VAL A 22 -3.677 -3.331 0.020 1.00 0.00 H new ATOM 0 HB VAL A 22 -3.049 -6.117 -0.990 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -3.530 -6.989 1.260 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -2.067 -5.977 1.242 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -3.591 -5.325 1.888 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -5.379 -6.538 -0.315 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -5.516 -4.854 0.246 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -5.260 -5.199 -1.481 1.00 0.00 H new ATOM 294 N ASP A 23 -1.590 -3.626 1.472 1.00 0.00 N ATOM 295 CA ASP A 23 -0.334 -3.484 2.200 1.00 0.00 C ATOM 296 C ASP A 23 0.666 -2.654 1.402 1.00 0.00 C ATOM 297 O ASP A 23 1.877 -2.807 1.555 1.00 0.00 O ATOM 298 CB ASP A 23 0.258 -4.860 2.510 1.00 0.00 C ATOM 299 CG ASP A 23 0.667 -5.609 1.257 1.00 0.00 C ATOM 300 OD1 ASP A 23 1.402 -5.027 0.432 1.00 0.00 O ATOM 301 OD2 ASP A 23 0.253 -6.777 1.102 1.00 0.00 O ATOM 0 H ASP A 23 -2.425 -3.488 2.041 1.00 0.00 H new ATOM 0 HA ASP A 23 -0.542 -2.967 3.137 1.00 0.00 H new ATOM 0 HB2 ASP A 23 1.126 -4.741 3.159 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -0.473 -5.451 3.061 1.00 0.00 H new ATOM 306 N GLY A 24 0.150 -1.774 0.549 1.00 0.00 N ATOM 307 CA GLY A 24 1.012 -0.933 -0.261 1.00 0.00 C ATOM 308 C GLY A 24 1.411 0.345 0.450 1.00 0.00 C ATOM 309 O GLY A 24 1.762 0.324 1.631 1.00 0.00 O ATOM 0 H GLY A 24 -0.849 -1.629 0.405 1.00 0.00 H new ATOM 0 HA2 GLY A 24 1.909 -1.490 -0.530 1.00 0.00 H new ATOM 0 HA3 GLY A 24 0.501 -0.683 -1.191 1.00 0.00 H new ATOM 313 N THR A 25 1.359 1.462 -0.268 1.00 0.00 N ATOM 314 CA THR A 25 1.721 2.754 0.300 1.00 0.00 C ATOM 315 C THR A 25 1.033 3.893 -0.442 1.00 0.00 C ATOM 316 O THR A 25 1.185 4.039 -1.655 1.00 0.00 O ATOM 317 CB THR A 25 3.244 2.978 0.262 1.00 0.00 C ATOM 318 OG1 THR A 25 3.924 1.802 0.715 1.00 0.00 O ATOM 319 CG2 THR A 25 3.639 4.163 1.130 1.00 0.00 C ATOM 0 H THR A 25 1.069 1.498 -1.245 1.00 0.00 H new ATOM 0 HA THR A 25 1.388 2.747 1.338 1.00 0.00 H new ATOM 0 HB THR A 25 3.531 3.190 -0.768 1.00 0.00 H new ATOM 0 HG1 THR A 25 4.892 1.952 0.686 1.00 0.00 H new ATOM 0 HG21 THR A 25 4.719 4.301 1.087 1.00 0.00 H new ATOM 0 HG22 THR A 25 3.143 5.063 0.765 1.00 0.00 H new ATOM 0 HG23 THR A 25 3.338 3.975 2.161 1.00 0.00 H new ATOM 327 N PHE A 26 0.275 4.700 0.293 1.00 0.00 N ATOM 328 CA PHE A 26 -0.438 5.828 -0.296 1.00 0.00 C ATOM 329 C PHE A 26 -0.384 7.045 0.622 1.00 0.00 C ATOM 330 O PHE A 26 -0.563 6.931 1.834 1.00 0.00 O ATOM 331 CB PHE A 26 -1.894 5.449 -0.575 1.00 0.00 C ATOM 332 CG PHE A 26 -2.752 5.422 0.657 1.00 0.00 C ATOM 333 CD1 PHE A 26 -2.789 4.299 1.468 1.00 0.00 C ATOM 334 CD2 PHE A 26 -3.522 6.520 1.006 1.00 0.00 C ATOM 335 CE1 PHE A 26 -3.579 4.271 2.601 1.00 0.00 C ATOM 336 CE2 PHE A 26 -4.313 6.499 2.139 1.00 0.00 C ATOM 337 CZ PHE A 26 -4.341 5.373 2.938 1.00 0.00 C ATOM 0 H PHE A 26 0.138 4.594 1.298 1.00 0.00 H new ATOM 0 HA PHE A 26 0.050 6.083 -1.237 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -2.316 6.159 -1.287 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -1.921 4.468 -1.049 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -2.193 3.436 1.211 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -3.504 7.403 0.385 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -3.601 3.388 3.223 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.908 7.362 2.399 1.00 0.00 H new ATOM 0 HZ PHE A 26 -4.957 5.354 3.825 1.00 0.00 H new ATOM 347 N VAL A 27 -0.135 8.211 0.034 1.00 0.00 N ATOM 348 CA VAL A 27 -0.058 9.451 0.798 1.00 0.00 C ATOM 349 C VAL A 27 -0.896 10.548 0.151 1.00 0.00 C ATOM 350 O VAL A 27 -0.976 10.642 -1.075 1.00 0.00 O ATOM 351 CB VAL A 27 1.397 9.940 0.928 1.00 0.00 C ATOM 352 CG1 VAL A 27 2.041 10.071 -0.444 1.00 0.00 C ATOM 353 CG2 VAL A 27 1.449 11.263 1.678 1.00 0.00 C ATOM 0 H VAL A 27 0.017 8.323 -0.968 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.451 9.236 1.792 1.00 0.00 H new ATOM 0 HB VAL A 27 1.960 9.202 1.499 1.00 0.00 H new ATOM 0 HG11 VAL A 27 3.068 10.418 -0.332 1.00 0.00 H new ATOM 0 HG12 VAL A 27 2.037 9.101 -0.942 1.00 0.00 H new ATOM 0 HG13 VAL A 27 1.479 10.788 -1.043 1.00 0.00 H new ATOM 0 HG21 VAL A 27 2.484 11.594 1.761 1.00 0.00 H new ATOM 0 HG22 VAL A 27 0.871 12.011 1.136 1.00 0.00 H new ATOM 0 HG23 VAL A 27 1.029 11.133 2.675 1.00 0.00 H new ATOM 363 N LEU A 28 -1.519 11.377 0.982 1.00 0.00 N ATOM 364 CA LEU A 28 -2.351 12.470 0.491 1.00 0.00 C ATOM 365 C LEU A 28 -1.807 13.818 0.952 1.00 0.00 C ATOM 366 O LEU A 28 -1.501 14.006 2.129 1.00 0.00 O ATOM 367 CB LEU A 28 -3.792 12.296 0.975 1.00 0.00 C ATOM 368 CG LEU A 28 -4.415 10.919 0.747 1.00 0.00 C ATOM 369 CD1 LEU A 28 -5.468 10.627 1.806 1.00 0.00 C ATOM 370 CD2 LEU A 28 -5.020 10.831 -0.647 1.00 0.00 C ATOM 0 H LEU A 28 -1.464 11.313 1.998 1.00 0.00 H new ATOM 0 HA LEU A 28 -2.334 12.446 -0.599 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.825 12.515 2.042 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -4.414 13.041 0.478 1.00 0.00 H new ATOM 0 HG LEU A 28 -3.629 10.168 0.828 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.900 9.643 1.627 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -5.006 10.647 2.793 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -6.252 11.382 1.757 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -5.459 9.844 -0.792 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -5.793 11.591 -0.757 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -4.242 10.995 -1.392 1.00 0.00 H new ATOM 382 N SER A 29 -1.690 14.754 0.015 1.00 0.00 N ATOM 383 CA SER A 29 -1.181 16.085 0.325 1.00 0.00 C ATOM 384 C SER A 29 -2.223 17.153 0.006 1.00 0.00 C ATOM 385 O SER A 29 -2.766 17.197 -1.099 1.00 0.00 O ATOM 386 CB SER A 29 0.103 16.359 -0.461 1.00 0.00 C ATOM 387 OG SER A 29 -0.129 16.289 -1.857 1.00 0.00 O ATOM 0 H SER A 29 -1.941 14.615 -0.964 1.00 0.00 H new ATOM 0 HA SER A 29 -0.961 16.123 1.392 1.00 0.00 H new ATOM 0 HB2 SER A 29 0.488 17.345 -0.202 1.00 0.00 H new ATOM 0 HB3 SER A 29 0.867 15.635 -0.179 1.00 0.00 H new ATOM 0 HG SER A 29 -1.036 16.604 -2.054 1.00 0.00 H new ATOM 393 N CYS A 30 -2.498 18.013 0.981 1.00 0.00 N ATOM 394 CA CYS A 30 -3.475 19.081 0.807 1.00 0.00 C ATOM 395 C CYS A 30 -2.793 20.446 0.801 1.00 0.00 C ATOM 396 O CYS A 30 -2.170 20.845 1.785 1.00 0.00 O ATOM 397 CB CYS A 30 -4.524 19.027 1.919 1.00 0.00 C ATOM 398 SG CYS A 30 -6.087 19.867 1.508 1.00 0.00 S ATOM 0 H CYS A 30 -2.057 17.991 1.901 1.00 0.00 H new ATOM 0 HA CYS A 30 -3.967 18.936 -0.155 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -4.735 17.984 2.154 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -4.107 19.478 2.819 1.00 0.00 H new ATOM 403 N VAL A 31 -2.915 21.157 -0.316 1.00 0.00 N ATOM 404 CA VAL A 31 -2.312 22.478 -0.450 1.00 0.00 C ATOM 405 C VAL A 31 -3.366 23.575 -0.357 1.00 0.00 C ATOM 406 O VAL A 31 -4.167 23.761 -1.273 1.00 0.00 O ATOM 407 CB VAL A 31 -1.559 22.617 -1.787 1.00 0.00 C ATOM 408 CG1 VAL A 31 -1.009 24.027 -1.945 1.00 0.00 C ATOM 409 CG2 VAL A 31 -0.444 21.587 -1.880 1.00 0.00 C ATOM 0 H VAL A 31 -3.426 20.841 -1.140 1.00 0.00 H new ATOM 0 HA VAL A 31 -1.604 22.588 0.371 1.00 0.00 H new ATOM 0 HB VAL A 31 -2.260 22.433 -2.601 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -0.480 24.107 -2.895 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -1.831 24.742 -1.926 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -0.321 24.243 -1.128 1.00 0.00 H new ATOM 0 HG21 VAL A 31 0.077 21.700 -2.831 1.00 0.00 H new ATOM 0 HG22 VAL A 31 0.259 21.737 -1.061 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -0.868 20.585 -1.815 1.00 0.00 H new ATOM 419 N ALA A 32 -3.360 24.300 0.757 1.00 0.00 N ATOM 420 CA ALA A 32 -4.314 25.382 0.970 1.00 0.00 C ATOM 421 C ALA A 32 -3.625 26.618 1.537 1.00 0.00 C ATOM 422 O ALA A 32 -2.733 26.513 2.380 1.00 0.00 O ATOM 423 CB ALA A 32 -5.431 24.925 1.897 1.00 0.00 C ATOM 0 H ALA A 32 -2.705 24.158 1.526 1.00 0.00 H new ATOM 0 HA ALA A 32 -4.744 25.650 0.005 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -6.136 25.742 2.048 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -5.949 24.076 1.451 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -5.009 24.629 2.857 1.00 0.00 H new ATOM 429 N THR A 33 -4.043 27.790 1.070 1.00 0.00 N ATOM 430 CA THR A 33 -3.465 29.047 1.529 1.00 0.00 C ATOM 431 C THR A 33 -4.249 29.615 2.706 1.00 0.00 C ATOM 432 O THR A 33 -5.281 29.071 3.098 1.00 0.00 O ATOM 433 CB THR A 33 -3.426 30.093 0.400 1.00 0.00 C ATOM 434 OG1 THR A 33 -4.713 30.705 0.255 1.00 0.00 O ATOM 435 CG2 THR A 33 -3.012 29.454 -0.917 1.00 0.00 C ATOM 0 H THR A 33 -4.781 27.895 0.373 1.00 0.00 H new ATOM 0 HA THR A 33 -2.445 28.829 1.847 1.00 0.00 H new ATOM 0 HB THR A 33 -2.690 30.852 0.664 1.00 0.00 H new ATOM 0 HG1 THR A 33 -4.664 31.414 -0.419 1.00 0.00 H new ATOM 0 HG21 THR A 33 -2.992 30.213 -1.699 1.00 0.00 H new ATOM 0 HG22 THR A 33 -2.020 29.014 -0.812 1.00 0.00 H new ATOM 0 HG23 THR A 33 -3.727 28.676 -1.185 1.00 0.00 H new ATOM 443 N GLY A 34 -3.752 30.713 3.268 1.00 0.00 N ATOM 444 CA GLY A 34 -4.419 31.336 4.396 1.00 0.00 C ATOM 445 C GLY A 34 -3.468 31.641 5.536 1.00 0.00 C ATOM 446 O GLY A 34 -2.431 30.993 5.679 1.00 0.00 O ATOM 0 H GLY A 34 -2.899 31.182 2.962 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -4.895 32.260 4.067 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -5.211 30.679 4.754 1.00 0.00 H new ATOM 450 N SER A 35 -3.821 32.630 6.351 1.00 0.00 N ATOM 451 CA SER A 35 -2.989 33.023 7.482 1.00 0.00 C ATOM 452 C SER A 35 -3.843 33.295 8.716 1.00 0.00 C ATOM 453 O SER A 35 -4.765 34.111 8.697 1.00 0.00 O ATOM 454 CB SER A 35 -2.169 34.266 7.131 1.00 0.00 C ATOM 455 OG SER A 35 -0.929 33.911 6.545 1.00 0.00 O ATOM 0 H SER A 35 -4.678 33.174 6.249 1.00 0.00 H new ATOM 0 HA SER A 35 -2.310 32.200 7.706 1.00 0.00 H new ATOM 0 HB2 SER A 35 -2.733 34.895 6.442 1.00 0.00 H new ATOM 0 HB3 SER A 35 -1.994 34.856 8.031 1.00 0.00 H new ATOM 0 HG SER A 35 -0.425 34.723 6.329 1.00 0.00 H new ATOM 461 N PRO A 36 -3.530 32.595 9.817 1.00 0.00 N ATOM 462 CA PRO A 36 -2.435 31.621 9.851 1.00 0.00 C ATOM 463 C PRO A 36 -2.742 30.375 9.027 1.00 0.00 C ATOM 464 O PRO A 36 -3.898 30.100 8.707 1.00 0.00 O ATOM 465 CB PRO A 36 -2.322 31.266 11.336 1.00 0.00 C ATOM 466 CG PRO A 36 -3.676 31.537 11.894 1.00 0.00 C ATOM 467 CD PRO A 36 -4.221 32.701 11.113 1.00 0.00 C ATOM 0 HA PRO A 36 -1.517 32.025 9.424 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -2.039 30.222 11.473 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -1.562 31.870 11.831 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -4.321 30.664 11.794 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -3.620 31.772 12.957 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -5.303 32.637 10.998 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -4.009 33.650 11.605 1.00 0.00 H new ATOM 475 N VAL A 37 -1.698 29.625 8.687 1.00 0.00 N ATOM 476 CA VAL A 37 -1.857 28.407 7.901 1.00 0.00 C ATOM 477 C VAL A 37 -3.110 27.644 8.317 1.00 0.00 C ATOM 478 O VAL A 37 -3.405 27.485 9.501 1.00 0.00 O ATOM 479 CB VAL A 37 -0.634 27.482 8.047 1.00 0.00 C ATOM 480 CG1 VAL A 37 -0.624 26.820 9.416 1.00 0.00 C ATOM 481 CG2 VAL A 37 -0.621 26.438 6.941 1.00 0.00 C ATOM 0 H VAL A 37 -0.734 29.839 8.943 1.00 0.00 H new ATOM 0 HA VAL A 37 -1.950 28.712 6.859 1.00 0.00 H new ATOM 0 HB VAL A 37 0.269 28.086 7.956 1.00 0.00 H new ATOM 0 HG11 VAL A 37 0.247 26.171 9.500 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -0.581 27.586 10.190 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -1.531 26.228 9.541 1.00 0.00 H new ATOM 0 HG21 VAL A 37 0.250 25.793 7.060 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -1.528 25.837 6.998 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -0.575 26.935 5.972 1.00 0.00 H new ATOM 491 N PRO A 38 -3.865 27.159 7.320 1.00 0.00 N ATOM 492 CA PRO A 38 -5.098 26.403 7.557 1.00 0.00 C ATOM 493 C PRO A 38 -4.828 25.026 8.154 1.00 0.00 C ATOM 494 O PRO A 38 -3.800 24.408 7.877 1.00 0.00 O ATOM 495 CB PRO A 38 -5.707 26.270 6.159 1.00 0.00 C ATOM 496 CG PRO A 38 -4.548 26.372 5.230 1.00 0.00 C ATOM 497 CD PRO A 38 -3.573 27.311 5.885 1.00 0.00 C ATOM 0 HA PRO A 38 -5.750 26.901 8.275 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -6.226 25.318 6.042 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -6.437 27.057 5.969 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -4.096 25.395 5.062 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -4.860 26.750 4.257 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -2.542 27.044 5.654 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -3.719 28.339 5.552 1.00 0.00 H new ATOM 505 N THR A 39 -5.759 24.549 8.975 1.00 0.00 N ATOM 506 CA THR A 39 -5.621 23.245 9.611 1.00 0.00 C ATOM 507 C THR A 39 -6.117 22.131 8.696 1.00 0.00 C ATOM 508 O THR A 39 -7.312 22.027 8.421 1.00 0.00 O ATOM 509 CB THR A 39 -6.396 23.184 10.941 1.00 0.00 C ATOM 510 OG1 THR A 39 -6.172 24.381 11.694 1.00 0.00 O ATOM 511 CG2 THR A 39 -5.970 21.975 11.760 1.00 0.00 C ATOM 0 H THR A 39 -6.616 25.047 9.215 1.00 0.00 H new ATOM 0 HA THR A 39 -4.559 23.102 9.810 1.00 0.00 H new ATOM 0 HB THR A 39 -7.458 23.093 10.714 1.00 0.00 H new ATOM 0 HG1 THR A 39 -6.669 24.335 12.537 1.00 0.00 H new ATOM 0 HG21 THR A 39 -6.531 21.953 12.695 1.00 0.00 H new ATOM 0 HG22 THR A 39 -6.170 21.064 11.195 1.00 0.00 H new ATOM 0 HG23 THR A 39 -4.904 22.040 11.978 1.00 0.00 H new ATOM 519 N ILE A 40 -5.191 21.301 8.227 1.00 0.00 N ATOM 520 CA ILE A 40 -5.535 20.194 7.344 1.00 0.00 C ATOM 521 C ILE A 40 -5.896 18.946 8.142 1.00 0.00 C ATOM 522 O ILE A 40 -5.090 18.443 8.926 1.00 0.00 O ATOM 523 CB ILE A 40 -4.378 19.859 6.383 1.00 0.00 C ATOM 524 CG1 ILE A 40 -3.899 21.123 5.667 1.00 0.00 C ATOM 525 CG2 ILE A 40 -4.814 18.806 5.376 1.00 0.00 C ATOM 526 CD1 ILE A 40 -4.916 21.694 4.703 1.00 0.00 C ATOM 0 H ILE A 40 -4.197 21.375 8.444 1.00 0.00 H new ATOM 0 HA ILE A 40 -6.399 20.512 6.761 1.00 0.00 H new ATOM 0 HB ILE A 40 -3.548 19.456 6.963 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -3.650 21.880 6.411 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -2.982 20.897 5.123 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -3.986 18.580 4.704 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -5.111 17.899 5.903 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -5.658 19.183 4.798 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -4.509 22.589 4.232 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -5.147 20.954 3.937 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -5.826 21.952 5.245 1.00 0.00 H new ATOM 538 N LEU A 41 -7.110 18.449 7.935 1.00 0.00 N ATOM 539 CA LEU A 41 -7.578 17.257 8.634 1.00 0.00 C ATOM 540 C LEU A 41 -7.826 16.114 7.656 1.00 0.00 C ATOM 541 O LEU A 41 -7.655 16.271 6.447 1.00 0.00 O ATOM 542 CB LEU A 41 -8.860 17.567 9.409 1.00 0.00 C ATOM 543 CG LEU A 41 -8.679 18.283 10.748 1.00 0.00 C ATOM 544 CD1 LEU A 41 -7.799 17.462 11.678 1.00 0.00 C ATOM 545 CD2 LEU A 41 -8.087 19.669 10.536 1.00 0.00 C ATOM 0 H LEU A 41 -7.788 18.853 7.289 1.00 0.00 H new ATOM 0 HA LEU A 41 -6.802 16.949 9.335 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -9.504 18.179 8.777 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -9.387 16.630 9.589 1.00 0.00 H new ATOM 0 HG LEU A 41 -9.658 18.395 11.213 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -7.682 17.987 12.626 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -8.263 16.492 11.856 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -6.821 17.317 11.220 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -7.965 20.164 11.500 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -7.116 19.579 10.049 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -8.755 20.258 9.908 1.00 0.00 H new ATOM 557 N TRP A 42 -8.231 14.965 8.186 1.00 0.00 N ATOM 558 CA TRP A 42 -8.505 13.796 7.358 1.00 0.00 C ATOM 559 C TRP A 42 -9.671 12.991 7.921 1.00 0.00 C ATOM 560 O TRP A 42 -9.707 12.685 9.113 1.00 0.00 O ATOM 561 CB TRP A 42 -7.260 12.913 7.260 1.00 0.00 C ATOM 562 CG TRP A 42 -6.114 13.577 6.557 1.00 0.00 C ATOM 563 CD1 TRP A 42 -4.983 14.084 7.130 1.00 0.00 C ATOM 564 CD2 TRP A 42 -5.990 13.807 5.149 1.00 0.00 C ATOM 565 NE1 TRP A 42 -4.164 14.616 6.164 1.00 0.00 N ATOM 566 CE2 TRP A 42 -4.758 14.458 4.940 1.00 0.00 C ATOM 567 CE3 TRP A 42 -6.799 13.526 4.045 1.00 0.00 C ATOM 568 CZ2 TRP A 42 -4.319 14.830 3.673 1.00 0.00 C ATOM 569 CZ3 TRP A 42 -6.362 13.897 2.787 1.00 0.00 C ATOM 570 CH2 TRP A 42 -5.131 14.542 2.609 1.00 0.00 C ATOM 0 H TRP A 42 -8.377 14.818 9.185 1.00 0.00 H new ATOM 0 HA TRP A 42 -8.776 14.143 6.361 1.00 0.00 H new ATOM 0 HB2 TRP A 42 -6.945 12.629 8.264 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -7.516 11.993 6.734 1.00 0.00 H new ATOM 0 HD1 TRP A 42 -4.764 14.069 8.188 1.00 0.00 H new ATOM 0 HE1 TRP A 42 -3.260 15.057 6.331 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -7.749 13.028 4.172 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 -3.371 15.328 3.534 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -6.980 13.686 1.927 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -4.817 14.817 1.613 1.00 0.00 H new ATOM 581 N ARG A 43 -10.622 12.652 7.057 1.00 0.00 N ATOM 582 CA ARG A 43 -11.790 11.883 7.470 1.00 0.00 C ATOM 583 C ARG A 43 -11.975 10.656 6.582 1.00 0.00 C ATOM 584 O ARG A 43 -11.808 10.727 5.364 1.00 0.00 O ATOM 585 CB ARG A 43 -13.045 12.756 7.420 1.00 0.00 C ATOM 586 CG ARG A 43 -13.013 13.925 8.391 1.00 0.00 C ATOM 587 CD ARG A 43 -14.395 14.530 8.581 1.00 0.00 C ATOM 588 NE ARG A 43 -15.146 13.858 9.638 1.00 0.00 N ATOM 589 CZ ARG A 43 -16.391 14.178 9.972 1.00 0.00 C ATOM 590 NH1 ARG A 43 -17.022 15.155 9.335 1.00 0.00 N ATOM 591 NH2 ARG A 43 -17.008 13.520 10.945 1.00 0.00 N ATOM 0 H ARG A 43 -10.607 12.898 6.067 1.00 0.00 H new ATOM 0 HA ARG A 43 -11.629 11.548 8.495 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -13.171 13.139 6.407 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -13.916 12.138 7.637 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -12.626 13.589 9.353 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -12.328 14.688 8.021 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -14.297 15.588 8.822 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -14.950 14.467 7.645 1.00 0.00 H new ATOM 0 HE ARG A 43 -14.689 13.102 10.148 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -16.551 15.663 8.586 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -17.978 15.398 9.594 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -16.526 12.768 11.437 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -17.964 13.766 11.201 1.00 0.00 H new ATOM 605 N LYS A 44 -12.319 9.531 7.199 1.00 0.00 N ATOM 606 CA LYS A 44 -12.528 8.288 6.466 1.00 0.00 C ATOM 607 C LYS A 44 -14.009 7.925 6.422 1.00 0.00 C ATOM 608 O LYS A 44 -14.536 7.313 7.352 1.00 0.00 O ATOM 609 CB LYS A 44 -11.732 7.152 7.112 1.00 0.00 C ATOM 610 CG LYS A 44 -11.402 6.020 6.154 1.00 0.00 C ATOM 611 CD LYS A 44 -10.497 4.986 6.804 1.00 0.00 C ATOM 612 CE LYS A 44 -10.543 3.660 6.060 1.00 0.00 C ATOM 613 NZ LYS A 44 -11.794 2.906 6.348 1.00 0.00 N ATOM 0 H LYS A 44 -12.459 9.454 8.206 1.00 0.00 H new ATOM 0 HA LYS A 44 -12.178 8.434 5.444 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -10.804 7.555 7.519 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -12.301 6.752 7.951 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -12.324 5.542 5.823 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -10.916 6.424 5.266 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -9.473 5.358 6.824 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -10.801 4.834 7.840 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -10.467 3.842 4.988 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -9.681 3.055 6.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -11.729 1.954 5.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -11.923 2.828 7.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -12.605 3.409 5.935 1.00 0.00 H new ATOM 627 N ASP A 45 -14.674 8.304 5.336 1.00 0.00 N ATOM 628 CA ASP A 45 -16.094 8.015 5.170 1.00 0.00 C ATOM 629 C ASP A 45 -16.897 8.538 6.357 1.00 0.00 C ATOM 630 O ASP A 45 -17.884 7.929 6.768 1.00 0.00 O ATOM 631 CB ASP A 45 -16.315 6.510 5.012 1.00 0.00 C ATOM 632 CG ASP A 45 -17.758 6.167 4.697 1.00 0.00 C ATOM 633 OD1 ASP A 45 -18.509 7.078 4.288 1.00 0.00 O ATOM 634 OD2 ASP A 45 -18.136 4.988 4.858 1.00 0.00 O ATOM 0 H ASP A 45 -14.253 8.812 4.558 1.00 0.00 H new ATOM 0 HA ASP A 45 -16.440 8.521 4.269 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -15.673 6.133 4.216 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -16.016 6.003 5.930 1.00 0.00 H new ATOM 639 N GLY A 46 -16.467 9.671 6.903 1.00 0.00 N ATOM 640 CA GLY A 46 -17.157 10.257 8.038 1.00 0.00 C ATOM 641 C GLY A 46 -16.433 10.009 9.347 1.00 0.00 C ATOM 642 O GLY A 46 -16.534 10.806 10.281 1.00 0.00 O ATOM 0 H GLY A 46 -15.653 10.194 6.580 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -17.261 11.331 7.881 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -18.164 9.845 8.099 1.00 0.00 H new ATOM 646 N VAL A 47 -15.702 8.901 9.417 1.00 0.00 N ATOM 647 CA VAL A 47 -14.959 8.551 10.622 1.00 0.00 C ATOM 648 C VAL A 47 -13.655 9.335 10.711 1.00 0.00 C ATOM 649 O VAL A 47 -12.741 9.135 9.910 1.00 0.00 O ATOM 650 CB VAL A 47 -14.643 7.044 10.668 1.00 0.00 C ATOM 651 CG1 VAL A 47 -13.891 6.694 11.943 1.00 0.00 C ATOM 652 CG2 VAL A 47 -15.922 6.228 10.552 1.00 0.00 C ATOM 0 H VAL A 47 -15.608 8.231 8.654 1.00 0.00 H new ATOM 0 HA VAL A 47 -15.593 8.808 11.471 1.00 0.00 H new ATOM 0 HB VAL A 47 -14.004 6.798 9.820 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -13.677 5.625 11.957 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -12.955 7.252 11.978 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -14.501 6.953 12.808 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -15.680 5.166 10.586 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -16.588 6.475 11.379 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -16.416 6.457 9.608 1.00 0.00 H new ATOM 662 N LEU A 48 -13.575 10.229 11.691 1.00 0.00 N ATOM 663 CA LEU A 48 -12.382 11.045 11.886 1.00 0.00 C ATOM 664 C LEU A 48 -11.124 10.181 11.880 1.00 0.00 C ATOM 665 O LEU A 48 -10.939 9.330 12.750 1.00 0.00 O ATOM 666 CB LEU A 48 -12.478 11.816 13.204 1.00 0.00 C ATOM 667 CG LEU A 48 -11.774 13.173 13.240 1.00 0.00 C ATOM 668 CD1 LEU A 48 -10.280 13.006 13.009 1.00 0.00 C ATOM 669 CD2 LEU A 48 -12.374 14.113 12.204 1.00 0.00 C ATOM 0 H LEU A 48 -14.322 10.407 12.362 1.00 0.00 H new ATOM 0 HA LEU A 48 -12.318 11.754 11.061 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -13.532 11.970 13.436 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -12.064 11.193 13.997 1.00 0.00 H new ATOM 0 HG LEU A 48 -11.921 13.611 14.227 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -9.796 13.982 13.038 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -9.860 12.370 13.788 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -10.112 12.546 12.035 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -11.861 15.074 12.244 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -12.258 13.681 11.210 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -13.433 14.259 12.415 1.00 0.00 H new ATOM 681 N VAL A 49 -10.262 10.408 10.894 1.00 0.00 N ATOM 682 CA VAL A 49 -9.020 9.653 10.777 1.00 0.00 C ATOM 683 C VAL A 49 -8.417 9.370 12.148 1.00 0.00 C ATOM 684 O VAL A 49 -8.544 10.174 13.071 1.00 0.00 O ATOM 685 CB VAL A 49 -7.986 10.404 9.918 1.00 0.00 C ATOM 686 CG1 VAL A 49 -7.413 11.587 10.684 1.00 0.00 C ATOM 687 CG2 VAL A 49 -6.879 9.461 9.470 1.00 0.00 C ATOM 0 H VAL A 49 -10.401 11.108 10.165 1.00 0.00 H new ATOM 0 HA VAL A 49 -9.268 8.709 10.291 1.00 0.00 H new ATOM 0 HB VAL A 49 -8.488 10.786 9.029 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -6.684 12.105 10.061 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -8.217 12.273 10.949 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -6.926 11.231 11.592 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -6.157 10.009 8.864 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -6.378 9.047 10.345 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -7.308 8.651 8.880 1.00 0.00 H new ATOM 697 N SER A 50 -7.759 8.222 12.273 1.00 0.00 N ATOM 698 CA SER A 50 -7.138 7.831 13.533 1.00 0.00 C ATOM 699 C SER A 50 -5.624 8.016 13.473 1.00 0.00 C ATOM 700 O SER A 50 -4.889 7.101 13.100 1.00 0.00 O ATOM 701 CB SER A 50 -7.472 6.374 13.861 1.00 0.00 C ATOM 702 OG SER A 50 -8.653 6.285 14.639 1.00 0.00 O ATOM 0 H SER A 50 -7.642 7.547 11.518 1.00 0.00 H new ATOM 0 HA SER A 50 -7.535 8.473 14.319 1.00 0.00 H new ATOM 0 HB2 SER A 50 -7.598 5.809 12.937 1.00 0.00 H new ATOM 0 HB3 SER A 50 -6.641 5.920 14.401 1.00 0.00 H new ATOM 0 HG SER A 50 -8.846 5.344 14.834 1.00 0.00 H new ATOM 708 N THR A 51 -5.165 9.207 13.843 1.00 0.00 N ATOM 709 CA THR A 51 -3.740 9.514 13.831 1.00 0.00 C ATOM 710 C THR A 51 -3.044 8.944 15.062 1.00 0.00 C ATOM 711 O THR A 51 -2.216 9.611 15.681 1.00 0.00 O ATOM 712 CB THR A 51 -3.493 11.033 13.773 1.00 0.00 C ATOM 713 OG1 THR A 51 -4.566 11.678 13.077 1.00 0.00 O ATOM 714 CG2 THR A 51 -2.175 11.341 13.079 1.00 0.00 C ATOM 0 H THR A 51 -5.759 9.975 14.155 1.00 0.00 H new ATOM 0 HA THR A 51 -3.325 9.051 12.936 1.00 0.00 H new ATOM 0 HB THR A 51 -3.444 11.410 14.795 1.00 0.00 H new ATOM 0 HG1 THR A 51 -4.402 12.644 13.046 1.00 0.00 H new ATOM 0 HG21 THR A 51 -2.022 12.420 13.050 1.00 0.00 H new ATOM 0 HG22 THR A 51 -1.357 10.873 13.627 1.00 0.00 H new ATOM 0 HG23 THR A 51 -2.200 10.951 12.062 1.00 0.00 H new ATOM 722 N GLN A 52 -3.386 7.708 15.410 1.00 0.00 N ATOM 723 CA GLN A 52 -2.793 7.050 16.568 1.00 0.00 C ATOM 724 C GLN A 52 -2.064 5.775 16.155 1.00 0.00 C ATOM 725 O GLN A 52 -1.079 5.382 16.780 1.00 0.00 O ATOM 726 CB GLN A 52 -3.871 6.722 17.603 1.00 0.00 C ATOM 727 CG GLN A 52 -4.964 5.808 17.074 1.00 0.00 C ATOM 728 CD GLN A 52 -6.186 5.780 17.971 1.00 0.00 C ATOM 729 OE1 GLN A 52 -6.270 6.525 18.947 1.00 0.00 O ATOM 730 NE2 GLN A 52 -7.141 4.918 17.643 1.00 0.00 N ATOM 0 H GLN A 52 -4.070 7.142 14.907 1.00 0.00 H new ATOM 0 HA GLN A 52 -2.069 7.734 17.012 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -3.402 6.251 18.467 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -4.323 7.651 17.952 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -5.257 6.138 16.077 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -4.569 4.797 16.972 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -7.029 4.319 16.825 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -7.987 4.854 18.209 1.00 0.00 H new ATOM 739 N ASP A 53 -2.554 5.134 15.100 1.00 0.00 N ATOM 740 CA ASP A 53 -1.949 3.904 14.603 1.00 0.00 C ATOM 741 C ASP A 53 -0.690 4.206 13.795 1.00 0.00 C ATOM 742 O ASP A 53 -0.667 5.133 12.986 1.00 0.00 O ATOM 743 CB ASP A 53 -2.948 3.130 13.743 1.00 0.00 C ATOM 744 CG ASP A 53 -2.436 1.757 13.353 1.00 0.00 C ATOM 745 OD1 ASP A 53 -1.258 1.656 12.949 1.00 0.00 O ATOM 746 OD2 ASP A 53 -3.212 0.784 13.453 1.00 0.00 O ATOM 0 H ASP A 53 -3.369 5.446 14.572 1.00 0.00 H new ATOM 0 HA ASP A 53 -1.671 3.293 15.461 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -3.886 3.023 14.288 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -3.167 3.702 12.842 1.00 0.00 H new ATOM 751 N SER A 54 0.356 3.417 14.022 1.00 0.00 N ATOM 752 CA SER A 54 1.620 3.602 13.318 1.00 0.00 C ATOM 753 C SER A 54 1.384 3.819 11.826 1.00 0.00 C ATOM 754 O SER A 54 2.034 4.656 11.200 1.00 0.00 O ATOM 755 CB SER A 54 2.529 2.391 13.533 1.00 0.00 C ATOM 756 OG SER A 54 3.839 2.646 13.054 1.00 0.00 O ATOM 0 H SER A 54 0.353 2.644 14.688 1.00 0.00 H new ATOM 0 HA SER A 54 2.108 4.489 13.723 1.00 0.00 H new ATOM 0 HB2 SER A 54 2.568 2.145 14.594 1.00 0.00 H new ATOM 0 HB3 SER A 54 2.113 1.524 13.020 1.00 0.00 H new ATOM 0 HG SER A 54 4.401 1.858 13.204 1.00 0.00 H new ATOM 762 N ARG A 55 0.452 3.057 11.264 1.00 0.00 N ATOM 763 CA ARG A 55 0.131 3.163 9.846 1.00 0.00 C ATOM 764 C ARG A 55 0.035 4.625 9.419 1.00 0.00 C ATOM 765 O ARG A 55 0.711 5.054 8.484 1.00 0.00 O ATOM 766 CB ARG A 55 -1.185 2.445 9.544 1.00 0.00 C ATOM 767 CG ARG A 55 -1.113 0.938 9.728 1.00 0.00 C ATOM 768 CD ARG A 55 -2.310 0.241 9.100 1.00 0.00 C ATOM 769 NE ARG A 55 -3.541 0.493 9.843 1.00 0.00 N ATOM 770 CZ ARG A 55 -4.755 0.359 9.321 1.00 0.00 C ATOM 771 NH1 ARG A 55 -4.899 -0.023 8.059 1.00 0.00 N ATOM 772 NH2 ARG A 55 -5.829 0.606 10.061 1.00 0.00 N ATOM 0 H ARG A 55 -0.094 2.359 11.769 1.00 0.00 H new ATOM 0 HA ARG A 55 0.933 2.689 9.281 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -1.964 2.845 10.193 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -1.481 2.663 8.518 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -0.194 0.559 9.280 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -1.070 0.702 10.791 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -2.430 0.583 8.072 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -2.124 -0.832 9.059 1.00 0.00 H new ATOM 0 HE ARG A 55 -3.465 0.788 10.816 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -4.076 -0.215 7.487 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -5.832 -0.125 7.660 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -5.723 0.899 11.032 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -6.760 0.503 9.658 1.00 0.00 H new ATOM 786 N ILE A 56 -0.810 5.383 10.109 1.00 0.00 N ATOM 787 CA ILE A 56 -0.994 6.796 9.801 1.00 0.00 C ATOM 788 C ILE A 56 0.077 7.649 10.472 1.00 0.00 C ATOM 789 O ILE A 56 0.311 7.538 11.676 1.00 0.00 O ATOM 790 CB ILE A 56 -2.383 7.293 10.245 1.00 0.00 C ATOM 791 CG1 ILE A 56 -3.483 6.482 9.556 1.00 0.00 C ATOM 792 CG2 ILE A 56 -2.539 8.775 9.938 1.00 0.00 C ATOM 793 CD1 ILE A 56 -3.806 5.183 10.260 1.00 0.00 C ATOM 0 H ILE A 56 -1.378 5.043 10.885 1.00 0.00 H new ATOM 0 HA ILE A 56 -0.910 6.896 8.719 1.00 0.00 H new ATOM 0 HB ILE A 56 -2.475 7.154 11.322 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -4.387 7.088 9.496 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -3.177 6.265 8.533 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -3.525 9.111 10.258 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -1.773 9.339 10.470 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -2.430 8.938 8.866 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -4.594 4.661 9.717 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -2.914 4.557 10.296 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -4.143 5.393 11.275 1.00 0.00 H new ATOM 805 N LYS A 57 0.724 8.503 9.686 1.00 0.00 N ATOM 806 CA LYS A 57 1.769 9.379 10.203 1.00 0.00 C ATOM 807 C LYS A 57 1.759 10.723 9.482 1.00 0.00 C ATOM 808 O LYS A 57 1.679 10.777 8.255 1.00 0.00 O ATOM 809 CB LYS A 57 3.140 8.716 10.051 1.00 0.00 C ATOM 810 CG LYS A 57 4.302 9.649 10.346 1.00 0.00 C ATOM 811 CD LYS A 57 4.601 9.713 11.834 1.00 0.00 C ATOM 812 CE LYS A 57 3.811 10.820 12.515 1.00 0.00 C ATOM 813 NZ LYS A 57 4.449 11.255 13.788 1.00 0.00 N ATOM 0 H LYS A 57 0.543 8.607 8.688 1.00 0.00 H new ATOM 0 HA LYS A 57 1.572 9.553 11.261 1.00 0.00 H new ATOM 0 HB2 LYS A 57 3.195 7.857 10.720 1.00 0.00 H new ATOM 0 HB3 LYS A 57 3.240 8.335 9.035 1.00 0.00 H new ATOM 0 HG2 LYS A 57 5.188 9.309 9.810 1.00 0.00 H new ATOM 0 HG3 LYS A 57 4.070 10.648 9.977 1.00 0.00 H new ATOM 0 HD2 LYS A 57 4.360 8.756 12.296 1.00 0.00 H new ATOM 0 HD3 LYS A 57 5.667 9.880 11.985 1.00 0.00 H new ATOM 0 HE2 LYS A 57 3.726 11.673 11.841 1.00 0.00 H new ATOM 0 HE3 LYS A 57 2.798 10.472 12.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 3.880 12.010 14.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 4.507 10.448 14.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 5.406 11.611 13.592 1.00 0.00 H new ATOM 827 N GLN A 58 1.841 11.803 10.251 1.00 0.00 N ATOM 828 CA GLN A 58 1.843 13.146 9.684 1.00 0.00 C ATOM 829 C GLN A 58 3.267 13.667 9.521 1.00 0.00 C ATOM 830 O GLN A 58 3.893 14.106 10.487 1.00 0.00 O ATOM 831 CB GLN A 58 1.037 14.098 10.571 1.00 0.00 C ATOM 832 CG GLN A 58 -0.446 14.128 10.240 1.00 0.00 C ATOM 833 CD GLN A 58 -1.123 15.400 10.712 1.00 0.00 C ATOM 834 OE1 GLN A 58 -0.907 15.852 11.837 1.00 0.00 O ATOM 835 NE2 GLN A 58 -1.949 15.986 9.852 1.00 0.00 N ATOM 0 H GLN A 58 1.907 11.775 11.268 1.00 0.00 H new ATOM 0 HA GLN A 58 1.379 13.098 8.699 1.00 0.00 H new ATOM 0 HB2 GLN A 58 1.162 13.804 11.613 1.00 0.00 H new ATOM 0 HB3 GLN A 58 1.443 15.105 10.473 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -0.576 14.030 9.162 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -0.935 13.269 10.699 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -2.099 15.577 8.930 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -2.433 16.845 10.114 1.00 0.00 H new ATOM 844 N LEU A 59 3.773 13.616 8.294 1.00 0.00 N ATOM 845 CA LEU A 59 5.125 14.082 8.004 1.00 0.00 C ATOM 846 C LEU A 59 5.202 15.604 8.073 1.00 0.00 C ATOM 847 O LEU A 59 6.032 16.161 8.791 1.00 0.00 O ATOM 848 CB LEU A 59 5.566 13.601 6.621 1.00 0.00 C ATOM 849 CG LEU A 59 5.532 12.089 6.395 1.00 0.00 C ATOM 850 CD1 LEU A 59 6.197 11.360 7.552 1.00 0.00 C ATOM 851 CD2 LEU A 59 4.099 11.609 6.213 1.00 0.00 C ATOM 0 H LEU A 59 3.268 13.257 7.484 1.00 0.00 H new ATOM 0 HA LEU A 59 5.795 13.667 8.757 1.00 0.00 H new ATOM 0 HB2 LEU A 59 4.930 14.075 5.873 1.00 0.00 H new ATOM 0 HB3 LEU A 59 6.582 13.952 6.443 1.00 0.00 H new ATOM 0 HG LEU A 59 6.088 11.865 5.485 1.00 0.00 H new ATOM 0 HD11 LEU A 59 6.163 10.285 7.373 1.00 0.00 H new ATOM 0 HD12 LEU A 59 7.235 11.681 7.636 1.00 0.00 H new ATOM 0 HD13 LEU A 59 5.670 11.590 8.478 1.00 0.00 H new ATOM 0 HD21 LEU A 59 4.094 10.531 6.053 1.00 0.00 H new ATOM 0 HD22 LEU A 59 3.520 11.846 7.105 1.00 0.00 H new ATOM 0 HD23 LEU A 59 3.656 12.106 5.350 1.00 0.00 H new ATOM 863 N GLU A 60 4.329 16.271 7.324 1.00 0.00 N ATOM 864 CA GLU A 60 4.299 17.729 7.302 1.00 0.00 C ATOM 865 C GLU A 60 2.862 18.243 7.331 1.00 0.00 C ATOM 866 O GLU A 60 1.912 17.465 7.269 1.00 0.00 O ATOM 867 CB GLU A 60 5.017 18.257 6.059 1.00 0.00 C ATOM 868 CG GLU A 60 6.404 17.669 5.861 1.00 0.00 C ATOM 869 CD GLU A 60 7.342 18.616 5.138 1.00 0.00 C ATOM 870 OE1 GLU A 60 6.852 19.444 4.342 1.00 0.00 O ATOM 871 OE2 GLU A 60 8.566 18.530 5.370 1.00 0.00 O ATOM 0 H GLU A 60 3.634 15.825 6.725 1.00 0.00 H new ATOM 0 HA GLU A 60 4.815 18.092 8.191 1.00 0.00 H new ATOM 0 HB2 GLU A 60 4.411 18.040 5.180 1.00 0.00 H new ATOM 0 HB3 GLU A 60 5.098 19.342 6.130 1.00 0.00 H new ATOM 0 HG2 GLU A 60 6.828 17.414 6.832 1.00 0.00 H new ATOM 0 HG3 GLU A 60 6.324 16.741 5.295 1.00 0.00 H new ATOM 878 N ASN A 61 2.714 19.561 7.425 1.00 0.00 N ATOM 879 CA ASN A 61 1.394 20.180 7.463 1.00 0.00 C ATOM 880 C ASN A 61 0.568 19.776 6.246 1.00 0.00 C ATOM 881 O ASN A 61 0.850 20.196 5.124 1.00 0.00 O ATOM 882 CB ASN A 61 1.524 21.703 7.522 1.00 0.00 C ATOM 883 CG ASN A 61 2.726 22.211 6.748 1.00 0.00 C ATOM 884 OD1 ASN A 61 3.860 22.139 7.223 1.00 0.00 O ATOM 885 ND2 ASN A 61 2.482 22.729 5.550 1.00 0.00 N ATOM 0 H ASN A 61 3.491 20.220 7.476 1.00 0.00 H new ATOM 0 HA ASN A 61 0.882 19.830 8.359 1.00 0.00 H new ATOM 0 HB2 ASN A 61 0.618 22.158 7.121 1.00 0.00 H new ATOM 0 HB3 ASN A 61 1.605 22.018 8.562 1.00 0.00 H new ATOM 0 HD21 ASN A 61 3.251 23.088 4.983 1.00 0.00 H new ATOM 0 HD22 ASN A 61 1.526 22.768 5.196 1.00 0.00 H new ATOM 892 N GLY A 62 -0.454 18.957 6.476 1.00 0.00 N ATOM 893 CA GLY A 62 -1.305 18.510 5.389 1.00 0.00 C ATOM 894 C GLY A 62 -0.796 17.238 4.740 1.00 0.00 C ATOM 895 O GLY A 62 -1.552 16.524 4.080 1.00 0.00 O ATOM 0 H GLY A 62 -0.708 18.595 7.395 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -2.314 18.343 5.766 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -1.372 19.296 4.637 1.00 0.00 H new ATOM 899 N VAL A 63 0.489 16.954 4.924 1.00 0.00 N ATOM 900 CA VAL A 63 1.098 15.760 4.350 1.00 0.00 C ATOM 901 C VAL A 63 0.943 14.563 5.281 1.00 0.00 C ATOM 902 O VAL A 63 1.623 14.464 6.303 1.00 0.00 O ATOM 903 CB VAL A 63 2.595 15.979 4.059 1.00 0.00 C ATOM 904 CG1 VAL A 63 3.192 14.754 3.383 1.00 0.00 C ATOM 905 CG2 VAL A 63 2.795 17.221 3.204 1.00 0.00 C ATOM 0 H VAL A 63 1.129 17.535 5.466 1.00 0.00 H new ATOM 0 HA VAL A 63 0.578 15.558 3.413 1.00 0.00 H new ATOM 0 HB VAL A 63 3.113 16.131 5.006 1.00 0.00 H new ATOM 0 HG11 VAL A 63 4.250 14.927 3.185 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.082 13.888 4.036 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.673 14.568 2.443 1.00 0.00 H new ATOM 0 HG21 VAL A 63 3.858 17.361 3.008 1.00 0.00 H new ATOM 0 HG22 VAL A 63 2.265 17.102 2.259 1.00 0.00 H new ATOM 0 HG23 VAL A 63 2.406 18.092 3.731 1.00 0.00 H new ATOM 915 N LEU A 64 0.044 13.653 4.920 1.00 0.00 N ATOM 916 CA LEU A 64 -0.201 12.460 5.722 1.00 0.00 C ATOM 917 C LEU A 64 -0.010 11.196 4.891 1.00 0.00 C ATOM 918 O LEU A 64 -0.607 11.047 3.825 1.00 0.00 O ATOM 919 CB LEU A 64 -1.617 12.493 6.302 1.00 0.00 C ATOM 920 CG LEU A 64 -2.082 11.221 7.010 1.00 0.00 C ATOM 921 CD1 LEU A 64 -1.699 11.258 8.482 1.00 0.00 C ATOM 922 CD2 LEU A 64 -3.585 11.042 6.853 1.00 0.00 C ATOM 0 H LEU A 64 -0.527 13.719 4.077 1.00 0.00 H new ATOM 0 HA LEU A 64 0.520 12.448 6.539 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -1.680 13.321 7.008 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -2.314 12.710 5.493 1.00 0.00 H new ATOM 0 HG LEU A 64 -1.584 10.369 6.548 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -2.038 10.344 8.969 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -0.616 11.338 8.574 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -2.168 12.119 8.958 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -3.898 10.131 7.363 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -4.101 11.898 7.289 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -3.834 10.969 5.794 1.00 0.00 H new ATOM 934 N GLN A 65 0.825 10.288 5.387 1.00 0.00 N ATOM 935 CA GLN A 65 1.094 9.036 4.689 1.00 0.00 C ATOM 936 C GLN A 65 0.612 7.843 5.508 1.00 0.00 C ATOM 937 O GLN A 65 0.811 7.790 6.722 1.00 0.00 O ATOM 938 CB GLN A 65 2.589 8.900 4.399 1.00 0.00 C ATOM 939 CG GLN A 65 2.943 7.659 3.596 1.00 0.00 C ATOM 940 CD GLN A 65 4.266 7.791 2.869 1.00 0.00 C ATOM 941 OE1 GLN A 65 4.304 8.057 1.667 1.00 0.00 O ATOM 942 NE2 GLN A 65 5.362 7.606 3.596 1.00 0.00 N ATOM 0 H GLN A 65 1.326 10.396 6.269 1.00 0.00 H new ATOM 0 HA GLN A 65 0.549 9.050 3.745 1.00 0.00 H new ATOM 0 HB2 GLN A 65 2.927 9.783 3.856 1.00 0.00 H new ATOM 0 HB3 GLN A 65 3.133 8.879 5.343 1.00 0.00 H new ATOM 0 HG2 GLN A 65 2.984 6.799 4.264 1.00 0.00 H new ATOM 0 HG3 GLN A 65 2.153 7.462 2.871 1.00 0.00 H new ATOM 0 HE21 GLN A 65 5.284 7.387 4.589 1.00 0.00 H new ATOM 0 HE22 GLN A 65 6.281 7.683 3.161 1.00 0.00 H new ATOM 951 N ILE A 66 -0.022 6.888 4.836 1.00 0.00 N ATOM 952 CA ILE A 66 -0.531 5.695 5.502 1.00 0.00 C ATOM 953 C ILE A 66 0.041 4.429 4.874 1.00 0.00 C ATOM 954 O ILE A 66 -0.273 4.094 3.732 1.00 0.00 O ATOM 955 CB ILE A 66 -2.069 5.633 5.447 1.00 0.00 C ATOM 956 CG1 ILE A 66 -2.675 6.900 6.055 1.00 0.00 C ATOM 957 CG2 ILE A 66 -2.575 4.396 6.174 1.00 0.00 C ATOM 958 CD1 ILE A 66 -2.865 8.018 5.054 1.00 0.00 C ATOM 0 H ILE A 66 -0.195 6.917 3.831 1.00 0.00 H new ATOM 0 HA ILE A 66 -0.215 5.755 6.543 1.00 0.00 H new ATOM 0 HB ILE A 66 -2.378 5.570 4.404 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -3.639 6.654 6.501 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -2.031 7.251 6.861 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -3.664 4.366 6.127 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -2.166 3.503 5.701 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -2.258 4.431 7.216 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -3.298 8.884 5.554 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -1.900 8.291 4.626 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -3.533 7.686 4.260 1.00 0.00 H new ATOM 970 N ARG A 67 0.879 3.727 5.629 1.00 0.00 N ATOM 971 CA ARG A 67 1.494 2.497 5.147 1.00 0.00 C ATOM 972 C ARG A 67 0.634 1.286 5.496 1.00 0.00 C ATOM 973 O ARG A 67 -0.262 1.369 6.337 1.00 0.00 O ATOM 974 CB ARG A 67 2.892 2.332 5.746 1.00 0.00 C ATOM 975 CG ARG A 67 3.905 3.331 5.212 1.00 0.00 C ATOM 976 CD ARG A 67 5.179 3.332 6.044 1.00 0.00 C ATOM 977 NE ARG A 67 5.949 2.105 5.866 1.00 0.00 N ATOM 978 CZ ARG A 67 6.890 1.698 6.712 1.00 0.00 C ATOM 979 NH1 ARG A 67 7.174 2.418 7.788 1.00 0.00 N ATOM 980 NH2 ARG A 67 7.548 0.569 6.481 1.00 0.00 N ATOM 0 H ARG A 67 1.148 3.989 6.577 1.00 0.00 H new ATOM 0 HA ARG A 67 1.576 2.563 4.062 1.00 0.00 H new ATOM 0 HB2 ARG A 67 2.828 2.436 6.829 1.00 0.00 H new ATOM 0 HB3 ARG A 67 3.248 1.322 5.543 1.00 0.00 H new ATOM 0 HG2 ARG A 67 4.145 3.089 4.177 1.00 0.00 H new ATOM 0 HG3 ARG A 67 3.468 4.330 5.213 1.00 0.00 H new ATOM 0 HD2 ARG A 67 5.793 4.189 5.766 1.00 0.00 H new ATOM 0 HD3 ARG A 67 4.924 3.451 7.097 1.00 0.00 H new ATOM 0 HE ARG A 67 5.754 1.528 5.048 1.00 0.00 H new ATOM 0 HH11 ARG A 67 6.670 3.286 7.968 1.00 0.00 H new ATOM 0 HH12 ARG A 67 7.896 2.104 8.436 1.00 0.00 H new ATOM 0 HH21 ARG A 67 7.332 0.013 5.654 1.00 0.00 H new ATOM 0 HH22 ARG A 67 8.270 0.257 7.131 1.00 0.00 H new ATOM 994 N TYR A 68 0.912 0.162 4.845 1.00 0.00 N ATOM 995 CA TYR A 68 0.162 -1.065 5.084 1.00 0.00 C ATOM 996 C TYR A 68 -1.309 -0.885 4.719 1.00 0.00 C ATOM 997 O TYR A 68 -2.198 -1.354 5.429 1.00 0.00 O ATOM 998 CB TYR A 68 0.287 -1.488 6.549 1.00 0.00 C ATOM 999 CG TYR A 68 1.704 -1.810 6.967 1.00 0.00 C ATOM 1000 CD1 TYR A 68 2.312 -2.996 6.575 1.00 0.00 C ATOM 1001 CD2 TYR A 68 2.435 -0.928 7.753 1.00 0.00 C ATOM 1002 CE1 TYR A 68 3.606 -3.295 6.956 1.00 0.00 C ATOM 1003 CE2 TYR A 68 3.730 -1.217 8.137 1.00 0.00 C ATOM 1004 CZ TYR A 68 4.311 -2.403 7.736 1.00 0.00 C ATOM 1005 OH TYR A 68 5.600 -2.696 8.116 1.00 0.00 O ATOM 0 H TYR A 68 1.651 0.075 4.148 1.00 0.00 H new ATOM 0 HA TYR A 68 0.582 -1.846 4.450 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -0.097 -0.689 7.183 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -0.341 -2.362 6.721 1.00 0.00 H new ATOM 0 HD1 TYR A 68 1.764 -3.696 5.962 1.00 0.00 H new ATOM 0 HD2 TYR A 68 1.983 0.000 8.069 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.063 -4.223 6.644 1.00 0.00 H new ATOM 0 HE2 TYR A 68 4.284 -0.519 8.747 1.00 0.00 H new ATOM 0 HH TYR A 68 5.955 -1.963 8.661 1.00 0.00 H new ATOM 1015 N ALA A 69 -1.556 -0.202 3.606 1.00 0.00 N ATOM 1016 CA ALA A 69 -2.917 0.039 3.144 1.00 0.00 C ATOM 1017 C ALA A 69 -3.689 -1.269 3.003 1.00 0.00 C ATOM 1018 O ALA A 69 -3.475 -2.029 2.058 1.00 0.00 O ATOM 1019 CB ALA A 69 -2.900 0.790 1.821 1.00 0.00 C ATOM 0 H ALA A 69 -0.831 0.194 3.008 1.00 0.00 H new ATOM 0 HA ALA A 69 -3.425 0.651 3.890 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -3.923 0.963 1.488 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -2.394 1.747 1.952 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -2.370 0.199 1.074 1.00 0.00 H new ATOM 1025 N LYS A 70 -4.586 -1.526 3.948 1.00 0.00 N ATOM 1026 CA LYS A 70 -5.391 -2.742 3.930 1.00 0.00 C ATOM 1027 C LYS A 70 -6.617 -2.569 3.039 1.00 0.00 C ATOM 1028 O LYS A 70 -6.937 -1.458 2.613 1.00 0.00 O ATOM 1029 CB LYS A 70 -5.826 -3.111 5.349 1.00 0.00 C ATOM 1030 CG LYS A 70 -4.673 -3.213 6.332 1.00 0.00 C ATOM 1031 CD LYS A 70 -5.168 -3.295 7.766 1.00 0.00 C ATOM 1032 CE LYS A 70 -4.047 -3.674 8.722 1.00 0.00 C ATOM 1033 NZ LYS A 70 -3.645 -5.100 8.569 1.00 0.00 N ATOM 0 H LYS A 70 -4.774 -0.908 4.737 1.00 0.00 H new ATOM 0 HA LYS A 70 -4.779 -3.547 3.524 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -6.534 -2.364 5.709 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -6.354 -4.064 5.322 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -4.074 -4.094 6.102 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -4.021 -2.347 6.220 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -5.591 -2.335 8.062 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -5.970 -4.030 7.834 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -3.184 -3.032 8.543 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -4.369 -3.496 9.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -3.045 -5.380 9.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -4.494 -5.700 8.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -3.114 -5.218 7.683 1.00 0.00 H new ATOM 1047 N LEU A 71 -7.302 -3.673 2.763 1.00 0.00 N ATOM 1048 CA LEU A 71 -8.495 -3.644 1.924 1.00 0.00 C ATOM 1049 C LEU A 71 -9.567 -2.746 2.533 1.00 0.00 C ATOM 1050 O LEU A 71 -10.167 -1.923 1.843 1.00 0.00 O ATOM 1051 CB LEU A 71 -9.046 -5.059 1.736 1.00 0.00 C ATOM 1052 CG LEU A 71 -8.282 -5.952 0.758 1.00 0.00 C ATOM 1053 CD1 LEU A 71 -8.774 -7.388 0.850 1.00 0.00 C ATOM 1054 CD2 LEU A 71 -8.422 -5.428 -0.664 1.00 0.00 C ATOM 0 H LEU A 71 -7.052 -4.600 3.108 1.00 0.00 H new ATOM 0 HA LEU A 71 -8.215 -3.238 0.952 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -9.065 -5.552 2.708 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -10.079 -4.983 1.397 1.00 0.00 H new ATOM 0 HG LEU A 71 -7.226 -5.934 1.028 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -8.219 -8.009 0.147 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -8.621 -7.761 1.863 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -9.836 -7.425 0.607 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -7.872 -6.076 -1.346 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -9.475 -5.416 -0.945 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -8.020 -4.417 -0.720 1.00 0.00 H new ATOM 1066 N GLY A 72 -9.801 -2.909 3.832 1.00 0.00 N ATOM 1067 CA GLY A 72 -10.799 -2.105 4.513 1.00 0.00 C ATOM 1068 C GLY A 72 -10.548 -0.618 4.359 1.00 0.00 C ATOM 1069 O GLY A 72 -11.483 0.183 4.387 1.00 0.00 O ATOM 0 H GLY A 72 -9.317 -3.584 4.425 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -11.786 -2.347 4.119 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -10.807 -2.361 5.572 1.00 0.00 H new ATOM 1073 N ASP A 73 -9.283 -0.246 4.199 1.00 0.00 N ATOM 1074 CA ASP A 73 -8.911 1.155 4.041 1.00 0.00 C ATOM 1075 C ASP A 73 -9.704 1.804 2.911 1.00 0.00 C ATOM 1076 O ASP A 73 -10.117 2.960 3.010 1.00 0.00 O ATOM 1077 CB ASP A 73 -7.412 1.280 3.766 1.00 0.00 C ATOM 1078 CG ASP A 73 -6.568 0.731 4.899 1.00 0.00 C ATOM 1079 OD1 ASP A 73 -7.022 -0.220 5.570 1.00 0.00 O ATOM 1080 OD2 ASP A 73 -5.453 1.251 5.116 1.00 0.00 O ATOM 0 H ASP A 73 -8.497 -0.896 4.175 1.00 0.00 H new ATOM 0 HA ASP A 73 -9.146 1.674 4.970 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -7.169 0.749 2.846 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -7.161 2.328 3.605 1.00 0.00 H new ATOM 1085 N THR A 74 -9.913 1.052 1.834 1.00 0.00 N ATOM 1086 CA THR A 74 -10.654 1.554 0.684 1.00 0.00 C ATOM 1087 C THR A 74 -11.830 2.418 1.122 1.00 0.00 C ATOM 1088 O THR A 74 -12.881 1.906 1.505 1.00 0.00 O ATOM 1089 CB THR A 74 -11.178 0.401 -0.193 1.00 0.00 C ATOM 1090 OG1 THR A 74 -10.110 -0.501 -0.506 1.00 0.00 O ATOM 1091 CG2 THR A 74 -11.791 0.935 -1.479 1.00 0.00 C ATOM 0 H THR A 74 -9.579 0.093 1.735 1.00 0.00 H new ATOM 0 HA THR A 74 -9.960 2.159 0.100 1.00 0.00 H new ATOM 0 HB THR A 74 -11.949 -0.130 0.365 1.00 0.00 H new ATOM 0 HG1 THR A 74 -9.991 -1.136 0.231 1.00 0.00 H new ATOM 0 HG21 THR A 74 -12.154 0.103 -2.082 1.00 0.00 H new ATOM 0 HG22 THR A 74 -12.622 1.598 -1.238 1.00 0.00 H new ATOM 0 HG23 THR A 74 -11.037 1.487 -2.040 1.00 0.00 H new ATOM 1099 N GLY A 75 -11.646 3.734 1.063 1.00 0.00 N ATOM 1100 CA GLY A 75 -12.702 4.649 1.456 1.00 0.00 C ATOM 1101 C GLY A 75 -12.625 5.973 0.722 1.00 0.00 C ATOM 1102 O GLY A 75 -12.160 6.033 -0.417 1.00 0.00 O ATOM 0 H GLY A 75 -10.785 4.182 0.750 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -13.670 4.186 1.263 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -12.642 4.828 2.530 1.00 0.00 H new ATOM 1106 N ARG A 76 -13.083 7.037 1.374 1.00 0.00 N ATOM 1107 CA ARG A 76 -13.066 8.366 0.774 1.00 0.00 C ATOM 1108 C ARG A 76 -12.337 9.359 1.674 1.00 0.00 C ATOM 1109 O ARG A 76 -12.885 9.828 2.671 1.00 0.00 O ATOM 1110 CB ARG A 76 -14.494 8.849 0.515 1.00 0.00 C ATOM 1111 CG ARG A 76 -14.571 10.285 0.021 1.00 0.00 C ATOM 1112 CD ARG A 76 -16.008 10.780 -0.032 1.00 0.00 C ATOM 1113 NE ARG A 76 -16.084 12.238 -0.069 1.00 0.00 N ATOM 1114 CZ ARG A 76 -17.221 12.917 0.023 1.00 0.00 C ATOM 1115 NH1 ARG A 76 -18.373 12.274 0.157 1.00 0.00 N ATOM 1116 NH2 ARG A 76 -17.209 14.243 -0.019 1.00 0.00 N ATOM 0 H ARG A 76 -13.470 7.005 2.317 1.00 0.00 H new ATOM 0 HA ARG A 76 -12.533 8.303 -0.175 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -14.962 8.195 -0.221 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -15.072 8.759 1.435 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -13.987 10.929 0.679 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -14.124 10.354 -0.971 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -16.501 10.369 -0.913 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -16.551 10.411 0.838 1.00 0.00 H new ATOM 0 HE ARG A 76 -15.216 12.763 -0.171 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -18.387 11.255 0.190 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -19.245 12.799 0.227 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -16.325 14.742 -0.122 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -18.083 14.763 0.052 1.00 0.00 H new ATOM 1130 N TYR A 77 -11.097 9.675 1.314 1.00 0.00 N ATOM 1131 CA TYR A 77 -10.291 10.610 2.090 1.00 0.00 C ATOM 1132 C TYR A 77 -10.563 12.049 1.662 1.00 0.00 C ATOM 1133 O TYR A 77 -10.269 12.439 0.531 1.00 0.00 O ATOM 1134 CB TYR A 77 -8.804 10.290 1.929 1.00 0.00 C ATOM 1135 CG TYR A 77 -8.375 9.030 2.646 1.00 0.00 C ATOM 1136 CD1 TYR A 77 -8.355 8.969 4.034 1.00 0.00 C ATOM 1137 CD2 TYR A 77 -7.990 7.899 1.936 1.00 0.00 C ATOM 1138 CE1 TYR A 77 -7.963 7.821 4.693 1.00 0.00 C ATOM 1139 CE2 TYR A 77 -7.598 6.746 2.587 1.00 0.00 C ATOM 1140 CZ TYR A 77 -7.585 6.711 3.965 1.00 0.00 C ATOM 1141 OH TYR A 77 -7.195 5.565 4.618 1.00 0.00 O ATOM 0 H TYR A 77 -10.629 9.297 0.490 1.00 0.00 H new ATOM 0 HA TYR A 77 -10.567 10.504 3.139 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -8.575 10.190 0.868 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.218 11.129 2.304 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -8.651 9.835 4.607 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -7.998 7.922 0.856 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -7.952 7.792 5.773 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -7.303 5.876 2.019 1.00 0.00 H new ATOM 0 HH TYR A 77 -6.962 4.877 3.960 1.00 0.00 H new ATOM 1151 N THR A 78 -11.126 12.835 2.574 1.00 0.00 N ATOM 1152 CA THR A 78 -11.438 14.230 2.293 1.00 0.00 C ATOM 1153 C THR A 78 -10.578 15.167 3.135 1.00 0.00 C ATOM 1154 O THR A 78 -10.293 14.885 4.299 1.00 0.00 O ATOM 1155 CB THR A 78 -12.923 14.538 2.558 1.00 0.00 C ATOM 1156 OG1 THR A 78 -13.748 13.771 1.675 1.00 0.00 O ATOM 1157 CG2 THR A 78 -13.211 16.020 2.369 1.00 0.00 C ATOM 0 H THR A 78 -11.375 12.528 3.514 1.00 0.00 H new ATOM 0 HA THR A 78 -11.223 14.395 1.237 1.00 0.00 H new ATOM 0 HB THR A 78 -13.148 14.269 3.590 1.00 0.00 H new ATOM 0 HG1 THR A 78 -14.691 13.972 1.851 1.00 0.00 H new ATOM 0 HG21 THR A 78 -14.266 16.213 2.562 1.00 0.00 H new ATOM 0 HG22 THR A 78 -12.603 16.600 3.063 1.00 0.00 H new ATOM 0 HG23 THR A 78 -12.970 16.310 1.346 1.00 0.00 H new ATOM 1165 N CYS A 79 -10.168 16.282 2.539 1.00 0.00 N ATOM 1166 CA CYS A 79 -9.341 17.261 3.234 1.00 0.00 C ATOM 1167 C CYS A 79 -10.192 18.405 3.776 1.00 0.00 C ATOM 1168 O CYS A 79 -11.197 18.784 3.173 1.00 0.00 O ATOM 1169 CB CYS A 79 -8.266 17.810 2.294 1.00 0.00 C ATOM 1170 SG CYS A 79 -7.432 19.306 2.913 1.00 0.00 S ATOM 0 H CYS A 79 -10.395 16.530 1.576 1.00 0.00 H new ATOM 0 HA CYS A 79 -8.859 16.762 4.074 1.00 0.00 H new ATOM 0 HB2 CYS A 79 -7.519 17.035 2.122 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -8.722 18.034 1.329 1.00 0.00 H new ATOM 1175 N ILE A 80 -9.783 18.952 4.915 1.00 0.00 N ATOM 1176 CA ILE A 80 -10.506 20.054 5.537 1.00 0.00 C ATOM 1177 C ILE A 80 -9.558 21.180 5.934 1.00 0.00 C ATOM 1178 O ILE A 80 -8.584 20.961 6.653 1.00 0.00 O ATOM 1179 CB ILE A 80 -11.280 19.586 6.784 1.00 0.00 C ATOM 1180 CG1 ILE A 80 -12.013 18.275 6.495 1.00 0.00 C ATOM 1181 CG2 ILE A 80 -12.261 20.660 7.232 1.00 0.00 C ATOM 1182 CD1 ILE A 80 -11.175 17.043 6.758 1.00 0.00 C ATOM 0 H ILE A 80 -8.954 18.650 5.427 1.00 0.00 H new ATOM 0 HA ILE A 80 -11.215 20.424 4.796 1.00 0.00 H new ATOM 0 HB ILE A 80 -10.568 19.411 7.591 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -12.914 18.229 7.107 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -12.335 18.270 5.454 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -12.801 20.315 8.114 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -11.716 21.572 7.474 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -12.970 20.863 6.429 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -11.759 16.151 6.532 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -10.287 17.065 6.126 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -10.875 17.024 7.806 1.00 0.00 H new ATOM 1194 N ALA A 81 -9.851 22.387 5.461 1.00 0.00 N ATOM 1195 CA ALA A 81 -9.027 23.549 5.769 1.00 0.00 C ATOM 1196 C ALA A 81 -9.814 24.585 6.565 1.00 0.00 C ATOM 1197 O ALA A 81 -10.579 25.366 5.999 1.00 0.00 O ATOM 1198 CB ALA A 81 -8.484 24.166 4.488 1.00 0.00 C ATOM 0 H ALA A 81 -10.653 22.585 4.863 1.00 0.00 H new ATOM 0 HA ALA A 81 -8.190 23.217 6.383 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -7.870 25.033 4.733 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -7.878 23.431 3.958 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -9.314 24.477 3.854 1.00 0.00 H new ATOM 1204 N SER A 82 -9.623 24.585 7.880 1.00 0.00 N ATOM 1205 CA SER A 82 -10.318 25.522 8.754 1.00 0.00 C ATOM 1206 C SER A 82 -9.457 26.751 9.028 1.00 0.00 C ATOM 1207 O SER A 82 -8.284 26.636 9.385 1.00 0.00 O ATOM 1208 CB SER A 82 -10.691 24.842 10.073 1.00 0.00 C ATOM 1209 OG SER A 82 -11.265 25.767 10.980 1.00 0.00 O ATOM 0 H SER A 82 -8.992 23.946 8.364 1.00 0.00 H new ATOM 0 HA SER A 82 -11.229 25.844 8.249 1.00 0.00 H new ATOM 0 HB2 SER A 82 -11.394 24.032 9.882 1.00 0.00 H new ATOM 0 HB3 SER A 82 -9.803 24.394 10.519 1.00 0.00 H new ATOM 0 HG SER A 82 -11.496 25.307 11.814 1.00 0.00 H new ATOM 1215 N THR A 83 -10.048 27.930 8.858 1.00 0.00 N ATOM 1216 CA THR A 83 -9.337 29.181 9.085 1.00 0.00 C ATOM 1217 C THR A 83 -10.266 30.246 9.657 1.00 0.00 C ATOM 1218 O THR A 83 -11.489 30.155 9.557 1.00 0.00 O ATOM 1219 CB THR A 83 -8.704 29.712 7.785 1.00 0.00 C ATOM 1220 OG1 THR A 83 -9.482 29.296 6.657 1.00 0.00 O ATOM 1221 CG2 THR A 83 -7.275 29.212 7.634 1.00 0.00 C ATOM 0 H THR A 83 -11.018 28.044 8.564 1.00 0.00 H new ATOM 0 HA THR A 83 -8.546 28.968 9.804 1.00 0.00 H new ATOM 0 HB THR A 83 -8.687 30.801 7.834 1.00 0.00 H new ATOM 0 HG1 THR A 83 -10.432 29.454 6.839 1.00 0.00 H new ATOM 0 HG21 THR A 83 -6.850 29.600 6.709 1.00 0.00 H new ATOM 0 HG22 THR A 83 -6.678 29.555 8.480 1.00 0.00 H new ATOM 0 HG23 THR A 83 -7.272 28.122 7.606 1.00 0.00 H new ATOM 1229 N PRO A 84 -9.674 31.282 10.270 1.00 0.00 N ATOM 1230 CA PRO A 84 -10.431 32.385 10.868 1.00 0.00 C ATOM 1231 C PRO A 84 -11.102 33.264 9.819 1.00 0.00 C ATOM 1232 O PRO A 84 -11.729 34.271 10.148 1.00 0.00 O ATOM 1233 CB PRO A 84 -9.363 33.178 11.626 1.00 0.00 C ATOM 1234 CG PRO A 84 -8.089 32.870 10.917 1.00 0.00 C ATOM 1235 CD PRO A 84 -8.220 31.456 10.425 1.00 0.00 C ATOM 0 HA PRO A 84 -11.244 32.026 11.499 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -9.577 34.247 11.609 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -9.316 32.878 12.673 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -7.928 33.558 10.087 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -7.235 32.973 11.587 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -7.695 31.309 9.481 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -7.804 30.743 11.136 1.00 0.00 H new ATOM 1243 N SER A 85 -10.967 32.876 8.554 1.00 0.00 N ATOM 1244 CA SER A 85 -11.558 33.631 7.456 1.00 0.00 C ATOM 1245 C SER A 85 -12.605 32.796 6.724 1.00 0.00 C ATOM 1246 O SER A 85 -13.553 33.332 6.152 1.00 0.00 O ATOM 1247 CB SER A 85 -10.473 34.082 6.477 1.00 0.00 C ATOM 1248 OG SER A 85 -10.947 35.114 5.629 1.00 0.00 O ATOM 0 H SER A 85 -10.454 32.043 8.265 1.00 0.00 H new ATOM 0 HA SER A 85 -12.048 34.510 7.874 1.00 0.00 H new ATOM 0 HB2 SER A 85 -9.603 34.433 7.031 1.00 0.00 H new ATOM 0 HB3 SER A 85 -10.147 33.234 5.875 1.00 0.00 H new ATOM 0 HG SER A 85 -10.234 35.385 5.014 1.00 0.00 H new ATOM 1254 N GLY A 86 -12.424 31.479 6.748 1.00 0.00 N ATOM 1255 CA GLY A 86 -13.360 30.590 6.084 1.00 0.00 C ATOM 1256 C GLY A 86 -12.957 29.134 6.199 1.00 0.00 C ATOM 1257 O GLY A 86 -12.054 28.792 6.962 1.00 0.00 O ATOM 0 H GLY A 86 -11.647 31.012 7.215 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -14.352 30.724 6.515 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -13.430 30.862 5.031 1.00 0.00 H new ATOM 1261 N GLU A 87 -13.629 28.273 5.441 1.00 0.00 N ATOM 1262 CA GLU A 87 -13.336 26.845 5.464 1.00 0.00 C ATOM 1263 C GLU A 87 -13.667 26.200 4.121 1.00 0.00 C ATOM 1264 O GLU A 87 -14.713 26.470 3.532 1.00 0.00 O ATOM 1265 CB GLU A 87 -14.126 26.158 6.580 1.00 0.00 C ATOM 1266 CG GLU A 87 -13.638 24.754 6.896 1.00 0.00 C ATOM 1267 CD GLU A 87 -14.356 23.691 6.086 1.00 0.00 C ATOM 1268 OE1 GLU A 87 -15.604 23.667 6.113 1.00 0.00 O ATOM 1269 OE2 GLU A 87 -13.669 22.885 5.426 1.00 0.00 O ATOM 0 H GLU A 87 -14.380 28.540 4.804 1.00 0.00 H new ATOM 0 HA GLU A 87 -12.270 26.722 5.654 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -14.067 26.766 7.483 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -15.177 26.113 6.295 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -12.567 24.693 6.701 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -13.780 24.554 7.958 1.00 0.00 H new ATOM 1276 N ALA A 88 -12.767 25.347 3.644 1.00 0.00 N ATOM 1277 CA ALA A 88 -12.963 24.662 2.372 1.00 0.00 C ATOM 1278 C ALA A 88 -12.538 23.200 2.464 1.00 0.00 C ATOM 1279 O ALA A 88 -11.906 22.786 3.437 1.00 0.00 O ATOM 1280 CB ALA A 88 -12.191 25.369 1.268 1.00 0.00 C ATOM 0 H ALA A 88 -11.895 25.114 4.119 1.00 0.00 H new ATOM 0 HA ALA A 88 -14.026 24.690 2.133 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -12.346 24.847 0.324 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -12.544 26.396 1.177 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -11.128 25.371 1.511 1.00 0.00 H new ATOM 1286 N THR A 89 -12.890 22.421 1.446 1.00 0.00 N ATOM 1287 CA THR A 89 -12.547 21.005 1.414 1.00 0.00 C ATOM 1288 C THR A 89 -12.237 20.547 -0.007 1.00 0.00 C ATOM 1289 O THR A 89 -12.478 21.275 -0.970 1.00 0.00 O ATOM 1290 CB THR A 89 -13.685 20.138 1.983 1.00 0.00 C ATOM 1291 OG1 THR A 89 -14.845 20.243 1.150 1.00 0.00 O ATOM 1292 CG2 THR A 89 -14.033 20.565 3.401 1.00 0.00 C ATOM 0 H THR A 89 -13.412 22.747 0.633 1.00 0.00 H new ATOM 0 HA THR A 89 -11.660 20.881 2.035 1.00 0.00 H new ATOM 0 HB THR A 89 -13.346 19.102 2.005 1.00 0.00 H new ATOM 0 HG1 THR A 89 -15.563 19.687 1.518 1.00 0.00 H new ATOM 0 HG21 THR A 89 -14.839 19.938 3.782 1.00 0.00 H new ATOM 0 HG22 THR A 89 -13.156 20.456 4.039 1.00 0.00 H new ATOM 0 HG23 THR A 89 -14.353 21.607 3.399 1.00 0.00 H new ATOM 1300 N TRP A 90 -11.702 19.337 -0.130 1.00 0.00 N ATOM 1301 CA TRP A 90 -11.360 18.782 -1.435 1.00 0.00 C ATOM 1302 C TRP A 90 -11.896 17.362 -1.580 1.00 0.00 C ATOM 1303 O TRP A 90 -12.191 16.696 -0.587 1.00 0.00 O ATOM 1304 CB TRP A 90 -9.844 18.791 -1.634 1.00 0.00 C ATOM 1305 CG TRP A 90 -9.433 18.717 -3.073 1.00 0.00 C ATOM 1306 CD1 TRP A 90 -8.840 17.659 -3.703 1.00 0.00 C ATOM 1307 CD2 TRP A 90 -9.583 19.742 -4.062 1.00 0.00 C ATOM 1308 NE1 TRP A 90 -8.613 17.965 -5.023 1.00 0.00 N ATOM 1309 CE2 TRP A 90 -9.060 19.236 -5.268 1.00 0.00 C ATOM 1310 CE3 TRP A 90 -10.110 21.036 -4.045 1.00 0.00 C ATOM 1311 CZ2 TRP A 90 -9.049 19.982 -6.444 1.00 0.00 C ATOM 1312 CZ3 TRP A 90 -10.097 21.775 -5.213 1.00 0.00 C ATOM 1313 CH2 TRP A 90 -9.571 21.246 -6.399 1.00 0.00 C ATOM 0 H TRP A 90 -11.496 18.722 0.657 1.00 0.00 H new ATOM 0 HA TRP A 90 -11.823 19.405 -2.200 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -9.432 19.698 -1.192 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -9.409 17.949 -1.096 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -8.587 16.720 -3.232 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -8.182 17.346 -5.709 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -10.520 21.451 -3.136 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -8.643 19.577 -7.359 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -10.499 22.777 -5.211 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -9.578 21.848 -7.296 1.00 0.00 H new ATOM 1324 N SER A 91 -12.018 16.904 -2.821 1.00 0.00 N ATOM 1325 CA SER A 91 -12.522 15.563 -3.095 1.00 0.00 C ATOM 1326 C SER A 91 -11.379 14.614 -3.442 1.00 0.00 C ATOM 1327 O SER A 91 -10.541 14.918 -4.291 1.00 0.00 O ATOM 1328 CB SER A 91 -13.535 15.601 -4.241 1.00 0.00 C ATOM 1329 OG SER A 91 -13.921 14.292 -4.624 1.00 0.00 O ATOM 0 H SER A 91 -11.775 17.441 -3.653 1.00 0.00 H new ATOM 0 HA SER A 91 -13.016 15.195 -2.195 1.00 0.00 H new ATOM 0 HB2 SER A 91 -14.414 16.168 -3.935 1.00 0.00 H new ATOM 0 HB3 SER A 91 -13.102 16.121 -5.096 1.00 0.00 H new ATOM 0 HG SER A 91 -14.570 14.343 -5.357 1.00 0.00 H new ATOM 1335 N ALA A 92 -11.352 13.463 -2.779 1.00 0.00 N ATOM 1336 CA ALA A 92 -10.315 12.467 -3.018 1.00 0.00 C ATOM 1337 C ALA A 92 -10.736 11.099 -2.494 1.00 0.00 C ATOM 1338 O ALA A 92 -11.379 10.994 -1.449 1.00 0.00 O ATOM 1339 CB ALA A 92 -9.007 12.903 -2.372 1.00 0.00 C ATOM 0 H ALA A 92 -12.037 13.197 -2.072 1.00 0.00 H new ATOM 0 HA ALA A 92 -10.166 12.384 -4.095 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -8.241 12.150 -2.558 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -8.691 13.855 -2.797 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -9.152 13.016 -1.298 1.00 0.00 H new ATOM 1345 N TYR A 93 -10.369 10.052 -3.225 1.00 0.00 N ATOM 1346 CA TYR A 93 -10.712 8.690 -2.835 1.00 0.00 C ATOM 1347 C TYR A 93 -9.571 7.728 -3.154 1.00 0.00 C ATOM 1348 O TYR A 93 -8.992 7.773 -4.240 1.00 0.00 O ATOM 1349 CB TYR A 93 -11.988 8.239 -3.548 1.00 0.00 C ATOM 1350 CG TYR A 93 -12.512 6.905 -3.065 1.00 0.00 C ATOM 1351 CD1 TYR A 93 -11.780 5.739 -3.253 1.00 0.00 C ATOM 1352 CD2 TYR A 93 -13.739 6.811 -2.420 1.00 0.00 C ATOM 1353 CE1 TYR A 93 -12.256 4.519 -2.815 1.00 0.00 C ATOM 1354 CE2 TYR A 93 -14.222 5.595 -1.976 1.00 0.00 C ATOM 1355 CZ TYR A 93 -13.476 4.452 -2.177 1.00 0.00 C ATOM 1356 OH TYR A 93 -13.953 3.238 -1.737 1.00 0.00 O ATOM 0 H TYR A 93 -9.834 10.121 -4.091 1.00 0.00 H new ATOM 0 HA TYR A 93 -10.882 8.680 -1.758 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -12.760 8.996 -3.407 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -11.794 8.177 -4.619 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -10.822 5.788 -3.750 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -14.326 7.704 -2.263 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -11.675 3.622 -2.972 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -15.177 5.540 -1.475 1.00 0.00 H new ATOM 0 HH TYR A 93 -14.825 3.365 -1.308 1.00 0.00 H new ATOM 1366 N ILE A 94 -9.254 6.860 -2.199 1.00 0.00 N ATOM 1367 CA ILE A 94 -8.184 5.886 -2.378 1.00 0.00 C ATOM 1368 C ILE A 94 -8.742 4.474 -2.509 1.00 0.00 C ATOM 1369 O ILE A 94 -9.616 4.068 -1.744 1.00 0.00 O ATOM 1370 CB ILE A 94 -7.186 5.925 -1.206 1.00 0.00 C ATOM 1371 CG1 ILE A 94 -6.622 7.337 -1.033 1.00 0.00 C ATOM 1372 CG2 ILE A 94 -6.063 4.924 -1.432 1.00 0.00 C ATOM 1373 CD1 ILE A 94 -5.590 7.706 -2.076 1.00 0.00 C ATOM 0 H ILE A 94 -9.722 6.811 -1.294 1.00 0.00 H new ATOM 0 HA ILE A 94 -7.663 6.155 -3.297 1.00 0.00 H new ATOM 0 HB ILE A 94 -7.712 5.650 -0.292 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -7.441 8.055 -1.074 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -6.173 7.422 -0.043 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -5.366 4.964 -0.595 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -6.480 3.920 -1.509 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -5.537 5.170 -2.354 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -5.233 8.720 -1.892 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -4.752 7.011 -2.021 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -6.040 7.654 -3.067 1.00 0.00 H new ATOM 1385 N GLU A 95 -8.230 3.729 -3.484 1.00 0.00 N ATOM 1386 CA GLU A 95 -8.678 2.360 -3.714 1.00 0.00 C ATOM 1387 C GLU A 95 -7.569 1.363 -3.389 1.00 0.00 C ATOM 1388 O GLU A 95 -6.403 1.587 -3.713 1.00 0.00 O ATOM 1389 CB GLU A 95 -9.127 2.185 -5.166 1.00 0.00 C ATOM 1390 CG GLU A 95 -9.259 0.732 -5.591 1.00 0.00 C ATOM 1391 CD GLU A 95 -10.248 0.543 -6.725 1.00 0.00 C ATOM 1392 OE1 GLU A 95 -11.219 1.325 -6.801 1.00 0.00 O ATOM 1393 OE2 GLU A 95 -10.053 -0.387 -7.535 1.00 0.00 O ATOM 0 H GLU A 95 -7.506 4.050 -4.127 1.00 0.00 H new ATOM 0 HA GLU A 95 -9.523 2.165 -3.054 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -10.086 2.684 -5.303 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -8.412 2.683 -5.821 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -8.283 0.357 -5.899 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -9.574 0.134 -4.736 1.00 0.00 H new ATOM 1400 N VAL A 96 -7.942 0.261 -2.747 1.00 0.00 N ATOM 1401 CA VAL A 96 -6.981 -0.772 -2.378 1.00 0.00 C ATOM 1402 C VAL A 96 -7.326 -2.104 -3.034 1.00 0.00 C ATOM 1403 O VAL A 96 -8.370 -2.692 -2.753 1.00 0.00 O ATOM 1404 CB VAL A 96 -6.922 -0.964 -0.851 1.00 0.00 C ATOM 1405 CG1 VAL A 96 -5.919 -2.048 -0.487 1.00 0.00 C ATOM 1406 CG2 VAL A 96 -6.575 0.348 -0.162 1.00 0.00 C ATOM 0 H VAL A 96 -8.903 0.060 -2.471 1.00 0.00 H new ATOM 0 HA VAL A 96 -6.006 -0.438 -2.733 1.00 0.00 H new ATOM 0 HB VAL A 96 -7.905 -1.281 -0.504 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -5.891 -2.169 0.596 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -6.216 -2.989 -0.950 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -4.930 -1.764 -0.846 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -6.538 0.194 0.916 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -5.604 0.697 -0.513 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.335 1.094 -0.396 1.00 0.00 H new ATOM 1416 N GLN A 97 -6.443 -2.573 -3.908 1.00 0.00 N ATOM 1417 CA GLN A 97 -6.655 -3.837 -4.605 1.00 0.00 C ATOM 1418 C GLN A 97 -5.664 -4.894 -4.128 1.00 0.00 C ATOM 1419 O GLN A 97 -4.478 -4.613 -3.959 1.00 0.00 O ATOM 1420 CB GLN A 97 -6.521 -3.639 -6.116 1.00 0.00 C ATOM 1421 CG GLN A 97 -5.121 -3.245 -6.556 1.00 0.00 C ATOM 1422 CD GLN A 97 -5.071 -2.786 -8.000 1.00 0.00 C ATOM 1423 OE1 GLN A 97 -5.926 -3.148 -8.809 1.00 0.00 O ATOM 1424 NE2 GLN A 97 -4.067 -1.983 -8.332 1.00 0.00 N ATOM 0 H GLN A 97 -5.574 -2.098 -4.151 1.00 0.00 H new ATOM 0 HA GLN A 97 -7.664 -4.183 -4.380 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -6.805 -4.562 -6.622 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -7.224 -2.870 -6.437 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -4.753 -2.446 -5.912 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -4.451 -4.094 -6.425 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -3.380 -1.708 -7.630 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -3.982 -1.641 -9.289 1.00 0.00 H new ATOM 1433 N GLU A 98 -6.159 -6.109 -3.915 1.00 0.00 N ATOM 1434 CA GLU A 98 -5.316 -7.207 -3.457 1.00 0.00 C ATOM 1435 C GLU A 98 -4.656 -7.915 -4.637 1.00 0.00 C ATOM 1436 O GLU A 98 -5.329 -8.334 -5.579 1.00 0.00 O ATOM 1437 CB GLU A 98 -6.140 -8.207 -2.643 1.00 0.00 C ATOM 1438 CG GLU A 98 -5.307 -9.055 -1.697 1.00 0.00 C ATOM 1439 CD GLU A 98 -6.109 -10.170 -1.054 1.00 0.00 C ATOM 1440 OE1 GLU A 98 -6.801 -9.901 -0.050 1.00 0.00 O ATOM 1441 OE2 GLU A 98 -6.043 -11.312 -1.555 1.00 0.00 O ATOM 0 H GLU A 98 -7.139 -6.358 -4.052 1.00 0.00 H new ATOM 0 HA GLU A 98 -4.534 -6.791 -2.822 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -6.889 -7.664 -2.067 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -6.678 -8.863 -3.327 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -4.468 -9.485 -2.244 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.887 -8.418 -0.918 1.00 0.00 H new ATOM 1448 N PHE A 99 -3.335 -8.044 -4.578 1.00 0.00 N ATOM 1449 CA PHE A 99 -2.583 -8.700 -5.642 1.00 0.00 C ATOM 1450 C PHE A 99 -1.468 -9.568 -5.064 1.00 0.00 C ATOM 1451 O PHE A 99 -0.703 -9.126 -4.208 1.00 0.00 O ATOM 1452 CB PHE A 99 -1.993 -7.659 -6.594 1.00 0.00 C ATOM 1453 CG PHE A 99 -0.612 -7.210 -6.211 1.00 0.00 C ATOM 1454 CD1 PHE A 99 -0.418 -6.372 -5.124 1.00 0.00 C ATOM 1455 CD2 PHE A 99 0.493 -7.626 -6.936 1.00 0.00 C ATOM 1456 CE1 PHE A 99 0.851 -5.957 -4.769 1.00 0.00 C ATOM 1457 CE2 PHE A 99 1.765 -7.214 -6.586 1.00 0.00 C ATOM 1458 CZ PHE A 99 1.944 -6.379 -5.501 1.00 0.00 C ATOM 0 H PHE A 99 -2.763 -7.703 -3.805 1.00 0.00 H new ATOM 0 HA PHE A 99 -3.269 -9.341 -6.196 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -1.965 -8.074 -7.601 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -2.653 -6.792 -6.625 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -1.269 -6.040 -4.548 1.00 0.00 H new ATOM 0 HD2 PHE A 99 0.359 -8.280 -7.785 1.00 0.00 H new ATOM 0 HE1 PHE A 99 0.988 -5.303 -3.920 1.00 0.00 H new ATOM 0 HE2 PHE A 99 2.618 -7.545 -7.160 1.00 0.00 H new ATOM 0 HZ PHE A 99 2.937 -6.056 -5.225 1.00 0.00 H new ATOM 1468 N GLY A 100 -1.384 -10.806 -5.540 1.00 0.00 N ATOM 1469 CA GLY A 100 -0.361 -11.717 -5.060 1.00 0.00 C ATOM 1470 C GLY A 100 -0.705 -12.316 -3.711 1.00 0.00 C ATOM 1471 O GLY A 100 0.178 -12.766 -2.980 1.00 0.00 O ATOM 0 H GLY A 100 -2.006 -11.195 -6.249 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -0.223 -12.519 -5.786 1.00 0.00 H new ATOM 0 HA3 GLY A 100 0.588 -11.186 -4.987 1.00 0.00 H new ATOM 1475 N VAL A 101 -1.992 -12.322 -3.378 1.00 0.00 N ATOM 1476 CA VAL A 101 -2.451 -12.870 -2.107 1.00 0.00 C ATOM 1477 C VAL A 101 -3.687 -13.741 -2.299 1.00 0.00 C ATOM 1478 O VAL A 101 -4.695 -13.316 -2.864 1.00 0.00 O ATOM 1479 CB VAL A 101 -2.774 -11.752 -1.099 1.00 0.00 C ATOM 1480 CG1 VAL A 101 -3.441 -12.328 0.141 1.00 0.00 C ATOM 1481 CG2 VAL A 101 -1.513 -10.986 -0.729 1.00 0.00 C ATOM 0 H VAL A 101 -2.735 -11.953 -3.971 1.00 0.00 H new ATOM 0 HA VAL A 101 -1.639 -13.480 -1.712 1.00 0.00 H new ATOM 0 HB VAL A 101 -3.470 -11.055 -1.567 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -3.662 -11.523 0.842 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -4.368 -12.827 -0.143 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -2.772 -13.047 0.613 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -1.761 -10.200 -0.016 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -0.791 -11.668 -0.280 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -1.082 -10.540 -1.625 1.00 0.00 H new ATOM 1491 N PRO A 102 -3.612 -14.990 -1.815 1.00 0.00 N ATOM 1492 CA PRO A 102 -4.717 -15.947 -1.920 1.00 0.00 C ATOM 1493 C PRO A 102 -5.897 -15.570 -1.031 1.00 0.00 C ATOM 1494 O PRO A 102 -5.821 -14.620 -0.252 1.00 0.00 O ATOM 1495 CB PRO A 102 -4.092 -17.263 -1.450 1.00 0.00 C ATOM 1496 CG PRO A 102 -2.968 -16.852 -0.562 1.00 0.00 C ATOM 1497 CD PRO A 102 -2.442 -15.563 -1.129 1.00 0.00 C ATOM 0 HA PRO A 102 -5.125 -15.990 -2.930 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -4.816 -17.876 -0.914 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -3.735 -17.855 -2.293 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -3.311 -16.716 0.464 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -2.190 -17.615 -0.539 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -2.071 -14.901 -0.346 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -1.616 -15.735 -1.819 1.00 0.00 H new ATOM 1505 N VAL A 103 -6.987 -16.320 -1.153 1.00 0.00 N ATOM 1506 CA VAL A 103 -8.183 -16.066 -0.359 1.00 0.00 C ATOM 1507 C VAL A 103 -8.191 -16.911 0.910 1.00 0.00 C ATOM 1508 O VAL A 103 -8.819 -17.968 0.958 1.00 0.00 O ATOM 1509 CB VAL A 103 -9.464 -16.356 -1.164 1.00 0.00 C ATOM 1510 CG1 VAL A 103 -10.698 -16.140 -0.301 1.00 0.00 C ATOM 1511 CG2 VAL A 103 -9.516 -15.487 -2.412 1.00 0.00 C ATOM 0 H VAL A 103 -7.067 -17.109 -1.794 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.164 -15.010 -0.089 1.00 0.00 H new ATOM 0 HB VAL A 103 -9.448 -17.400 -1.476 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -11.593 -16.350 -0.887 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -10.662 -16.809 0.559 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -10.724 -15.106 0.044 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -10.427 -15.705 -2.969 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -9.509 -14.436 -2.124 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -8.649 -15.697 -3.038 1.00 0.00 H new ATOM 1521 N GLN A 104 -7.490 -16.437 1.934 1.00 0.00 N ATOM 1522 CA GLN A 104 -7.416 -17.150 3.204 1.00 0.00 C ATOM 1523 C GLN A 104 -7.580 -16.190 4.378 1.00 0.00 C ATOM 1524 O GLN A 104 -7.131 -15.044 4.342 1.00 0.00 O ATOM 1525 CB GLN A 104 -6.084 -17.892 3.320 1.00 0.00 C ATOM 1526 CG GLN A 104 -5.996 -19.126 2.436 1.00 0.00 C ATOM 1527 CD GLN A 104 -4.642 -19.803 2.511 1.00 0.00 C ATOM 1528 OE1 GLN A 104 -3.626 -19.157 2.768 1.00 0.00 O ATOM 1529 NE2 GLN A 104 -4.620 -21.111 2.286 1.00 0.00 N ATOM 0 H GLN A 104 -6.965 -15.563 1.910 1.00 0.00 H new ATOM 0 HA GLN A 104 -8.231 -17.874 3.233 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -5.274 -17.210 3.060 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -5.931 -18.187 4.358 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -6.769 -19.835 2.731 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -6.200 -18.843 1.403 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -5.486 -21.607 2.076 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -3.737 -21.620 2.323 1.00 0.00 H new ATOM 1538 N PRO A 105 -8.239 -16.666 5.445 1.00 0.00 N ATOM 1539 CA PRO A 105 -8.478 -15.866 6.650 1.00 0.00 C ATOM 1540 C PRO A 105 -7.197 -15.605 7.435 1.00 0.00 C ATOM 1541 O PRO A 105 -6.149 -16.197 7.175 1.00 0.00 O ATOM 1542 CB PRO A 105 -9.439 -16.733 7.467 1.00 0.00 C ATOM 1543 CG PRO A 105 -9.173 -18.126 7.010 1.00 0.00 C ATOM 1544 CD PRO A 105 -8.802 -18.022 5.557 1.00 0.00 C ATOM 0 HA PRO A 105 -8.872 -14.878 6.412 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -9.257 -16.626 8.536 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -10.476 -16.449 7.290 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -8.367 -18.579 7.587 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -10.053 -18.755 7.144 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -8.076 -18.783 5.272 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -9.670 -18.151 4.910 1.00 0.00 H new ATOM 1552 N PRO A 106 -7.280 -14.698 8.420 1.00 0.00 N ATOM 1553 CA PRO A 106 -6.137 -14.339 9.264 1.00 0.00 C ATOM 1554 C PRO A 106 -5.733 -15.469 10.205 1.00 0.00 C ATOM 1555 O PRO A 106 -6.416 -16.490 10.293 1.00 0.00 O ATOM 1556 CB PRO A 106 -6.648 -13.136 10.061 1.00 0.00 C ATOM 1557 CG PRO A 106 -8.128 -13.302 10.090 1.00 0.00 C ATOM 1558 CD PRO A 106 -8.497 -13.954 8.786 1.00 0.00 C ATOM 0 HA PRO A 106 -5.245 -14.129 8.674 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -6.231 -13.122 11.068 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -6.364 -12.197 9.586 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -8.435 -13.918 10.935 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -8.627 -12.339 10.200 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -9.355 -14.617 8.897 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -8.760 -13.216 8.028 1.00 0.00 H new ATOM 1566 N ARG A 107 -4.621 -15.280 10.907 1.00 0.00 N ATOM 1567 CA ARG A 107 -4.127 -16.284 11.841 1.00 0.00 C ATOM 1568 C ARG A 107 -5.150 -16.554 12.941 1.00 0.00 C ATOM 1569 O ARG A 107 -5.922 -15.678 13.333 1.00 0.00 O ATOM 1570 CB ARG A 107 -2.805 -15.828 12.461 1.00 0.00 C ATOM 1571 CG ARG A 107 -2.864 -14.436 13.066 1.00 0.00 C ATOM 1572 CD ARG A 107 -3.268 -14.481 14.532 1.00 0.00 C ATOM 1573 NE ARG A 107 -3.733 -13.183 15.013 1.00 0.00 N ATOM 1574 CZ ARG A 107 -2.919 -12.179 15.321 1.00 0.00 C ATOM 1575 NH1 ARG A 107 -1.607 -12.324 15.199 1.00 0.00 N ATOM 1576 NH2 ARG A 107 -3.418 -11.028 15.752 1.00 0.00 N ATOM 0 H ARG A 107 -4.045 -14.440 10.847 1.00 0.00 H new ATOM 0 HA ARG A 107 -3.962 -17.208 11.287 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -2.512 -16.539 13.234 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -2.028 -15.850 11.697 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -1.890 -13.955 12.971 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -3.576 -13.826 12.510 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -4.056 -15.221 14.668 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -2.418 -14.806 15.132 1.00 0.00 H new ATOM 0 HE ARG A 107 -4.737 -13.039 15.118 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -1.220 -13.208 14.868 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -0.984 -11.552 15.436 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -4.427 -10.913 15.847 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -2.793 -10.258 15.988 1.00 0.00 H new ATOM 1590 N PRO A 108 -5.158 -17.794 13.451 1.00 0.00 N ATOM 1591 CA PRO A 108 -6.081 -18.208 14.512 1.00 0.00 C ATOM 1592 C PRO A 108 -5.756 -17.554 15.851 1.00 0.00 C ATOM 1593 O PRO A 108 -4.602 -17.229 16.131 1.00 0.00 O ATOM 1594 CB PRO A 108 -5.873 -19.723 14.592 1.00 0.00 C ATOM 1595 CG PRO A 108 -4.492 -19.943 14.079 1.00 0.00 C ATOM 1596 CD PRO A 108 -4.266 -18.888 13.032 1.00 0.00 C ATOM 0 HA PRO A 108 -7.109 -17.916 14.295 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -5.977 -20.083 15.615 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -6.609 -20.256 13.990 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -3.760 -19.859 14.882 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -4.388 -20.942 13.655 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -3.224 -18.568 13.002 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -4.516 -19.251 12.035 1.00 0.00 H new ATOM 1604 N THR A 109 -6.782 -17.364 16.675 1.00 0.00 N ATOM 1605 CA THR A 109 -6.605 -16.748 17.984 1.00 0.00 C ATOM 1606 C THR A 109 -7.619 -17.288 18.987 1.00 0.00 C ATOM 1607 O THR A 109 -8.827 -17.228 18.756 1.00 0.00 O ATOM 1608 CB THR A 109 -6.742 -15.216 17.908 1.00 0.00 C ATOM 1609 OG1 THR A 109 -5.872 -14.696 16.896 1.00 0.00 O ATOM 1610 CG2 THR A 109 -6.411 -14.575 19.247 1.00 0.00 C ATOM 0 H THR A 109 -7.743 -17.628 16.459 1.00 0.00 H new ATOM 0 HA THR A 109 -5.598 -16.999 18.317 1.00 0.00 H new ATOM 0 HB THR A 109 -7.775 -14.978 17.656 1.00 0.00 H new ATOM 0 HG1 THR A 109 -5.966 -13.721 16.853 1.00 0.00 H new ATOM 0 HG21 THR A 109 -6.515 -13.493 19.168 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.094 -14.950 20.009 1.00 0.00 H new ATOM 0 HG23 THR A 109 -5.386 -14.822 19.525 1.00 0.00 H new ATOM 1618 N ASP A 110 -7.120 -17.814 20.100 1.00 0.00 N ATOM 1619 CA ASP A 110 -7.983 -18.363 21.140 1.00 0.00 C ATOM 1620 C ASP A 110 -7.996 -17.459 22.369 1.00 0.00 C ATOM 1621 O ASP A 110 -7.316 -17.713 23.363 1.00 0.00 O ATOM 1622 CB ASP A 110 -7.518 -19.767 21.529 1.00 0.00 C ATOM 1623 CG ASP A 110 -7.199 -20.627 20.321 1.00 0.00 C ATOM 1624 OD1 ASP A 110 -6.040 -20.592 19.858 1.00 0.00 O ATOM 1625 OD2 ASP A 110 -8.109 -21.334 19.839 1.00 0.00 O ATOM 0 H ASP A 110 -6.123 -17.872 20.306 1.00 0.00 H new ATOM 0 HA ASP A 110 -8.997 -18.421 20.744 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -6.633 -19.691 22.161 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -8.293 -20.252 22.122 1.00 0.00 H new ATOM 1630 N PRO A 111 -8.787 -16.378 22.300 1.00 0.00 N ATOM 1631 CA PRO A 111 -8.907 -15.415 23.398 1.00 0.00 C ATOM 1632 C PRO A 111 -9.640 -15.996 24.602 1.00 0.00 C ATOM 1633 O PRO A 111 -9.351 -15.646 25.745 1.00 0.00 O ATOM 1634 CB PRO A 111 -9.716 -14.272 22.780 1.00 0.00 C ATOM 1635 CG PRO A 111 -10.494 -14.909 21.681 1.00 0.00 C ATOM 1636 CD PRO A 111 -9.625 -16.014 21.146 1.00 0.00 C ATOM 0 HA PRO A 111 -7.933 -15.109 23.780 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -10.375 -13.811 23.516 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -9.064 -13.486 22.399 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -11.442 -15.301 22.050 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -10.731 -14.186 20.900 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -10.219 -16.859 20.798 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -9.023 -15.678 20.302 1.00 0.00 H new ATOM 1644 N ASN A 112 -10.591 -16.886 24.337 1.00 0.00 N ATOM 1645 CA ASN A 112 -11.366 -17.516 25.399 1.00 0.00 C ATOM 1646 C ASN A 112 -10.451 -18.048 26.498 1.00 0.00 C ATOM 1647 O ASN A 112 -10.697 -17.830 27.686 1.00 0.00 O ATOM 1648 CB ASN A 112 -12.216 -18.655 24.833 1.00 0.00 C ATOM 1649 CG ASN A 112 -13.475 -18.154 24.153 1.00 0.00 C ATOM 1650 OD1 ASN A 112 -13.451 -17.763 22.985 1.00 0.00 O ATOM 1651 ND2 ASN A 112 -14.585 -18.163 24.882 1.00 0.00 N ATOM 0 H ASN A 112 -10.843 -17.187 23.396 1.00 0.00 H new ATOM 0 HA ASN A 112 -12.023 -16.761 25.831 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -11.623 -19.227 24.119 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -12.488 -19.337 25.639 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -15.463 -17.837 24.478 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -14.559 -18.495 25.846 1.00 0.00 H new ATOM 1658 N LEU A 113 -9.395 -18.745 26.095 1.00 0.00 N ATOM 1659 CA LEU A 113 -8.441 -19.307 27.045 1.00 0.00 C ATOM 1660 C LEU A 113 -8.169 -18.332 28.186 1.00 0.00 C ATOM 1661 O LEU A 113 -7.906 -17.151 27.957 1.00 0.00 O ATOM 1662 CB LEU A 113 -7.132 -19.658 26.336 1.00 0.00 C ATOM 1663 CG LEU A 113 -6.332 -20.815 26.937 1.00 0.00 C ATOM 1664 CD1 LEU A 113 -5.524 -21.522 25.860 1.00 0.00 C ATOM 1665 CD2 LEU A 113 -5.421 -20.312 28.047 1.00 0.00 C ATOM 0 H LEU A 113 -9.177 -18.935 25.117 1.00 0.00 H new ATOM 0 HA LEU A 113 -8.875 -20.215 27.464 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -7.358 -19.900 25.298 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -6.498 -18.771 26.326 1.00 0.00 H new ATOM 0 HG LEU A 113 -7.032 -21.532 27.365 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -4.962 -22.342 26.307 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -6.198 -21.916 25.099 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -4.833 -20.815 25.401 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -4.859 -21.148 28.464 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -4.728 -19.575 27.643 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -6.023 -19.853 28.831 1.00 0.00 H new ATOM 1677 N ILE A 114 -8.233 -18.834 29.414 1.00 0.00 N ATOM 1678 CA ILE A 114 -7.991 -18.008 30.590 1.00 0.00 C ATOM 1679 C ILE A 114 -6.502 -17.729 30.768 1.00 0.00 C ATOM 1680 O ILE A 114 -5.674 -18.639 30.798 1.00 0.00 O ATOM 1681 CB ILE A 114 -8.533 -18.675 31.868 1.00 0.00 C ATOM 1682 CG1 ILE A 114 -10.038 -18.920 31.743 1.00 0.00 C ATOM 1683 CG2 ILE A 114 -8.231 -17.813 33.085 1.00 0.00 C ATOM 1684 CD1 ILE A 114 -10.384 -20.163 30.953 1.00 0.00 C ATOM 0 H ILE A 114 -8.450 -19.809 29.621 1.00 0.00 H new ATOM 0 HA ILE A 114 -8.518 -17.068 30.429 1.00 0.00 H new ATOM 0 HB ILE A 114 -8.036 -19.637 31.996 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -10.469 -19.002 32.741 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -10.500 -18.056 31.266 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -8.620 -18.298 33.980 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -7.153 -17.685 33.182 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -8.703 -16.838 32.966 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -11.467 -20.274 30.905 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -9.983 -20.076 29.943 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -9.951 -21.036 31.441 1.00 0.00 H new ATOM 1696 N PRO A 115 -6.153 -16.440 30.892 1.00 0.00 N ATOM 1697 CA PRO A 115 -4.763 -16.010 31.072 1.00 0.00 C ATOM 1698 C PRO A 115 -4.211 -16.392 32.441 1.00 0.00 C ATOM 1699 O PRO A 115 -4.933 -16.383 33.437 1.00 0.00 O ATOM 1700 CB PRO A 115 -4.842 -14.487 30.934 1.00 0.00 C ATOM 1701 CG PRO A 115 -6.241 -14.144 31.315 1.00 0.00 C ATOM 1702 CD PRO A 115 -7.088 -15.302 30.866 1.00 0.00 C ATOM 0 HA PRO A 115 -4.094 -16.483 30.353 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -4.122 -13.993 31.586 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -4.620 -14.170 29.915 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -6.326 -13.992 32.391 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -6.560 -13.218 30.836 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -7.935 -15.463 31.533 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -7.495 -15.139 29.868 1.00 0.00 H new ATOM 1710 N SER A 116 -2.925 -16.728 32.483 1.00 0.00 N ATOM 1711 CA SER A 116 -2.277 -17.117 33.729 1.00 0.00 C ATOM 1712 C SER A 116 -1.780 -15.891 34.489 1.00 0.00 C ATOM 1713 O SER A 116 -1.146 -15.006 33.915 1.00 0.00 O ATOM 1714 CB SER A 116 -1.109 -18.064 33.447 1.00 0.00 C ATOM 1715 OG SER A 116 -1.570 -19.308 32.948 1.00 0.00 O ATOM 0 H SER A 116 -2.312 -16.738 31.668 1.00 0.00 H new ATOM 0 HA SER A 116 -3.013 -17.632 34.347 1.00 0.00 H new ATOM 0 HB2 SER A 116 -0.432 -17.607 32.725 1.00 0.00 H new ATOM 0 HB3 SER A 116 -0.538 -18.225 34.361 1.00 0.00 H new ATOM 0 HG SER A 116 -0.804 -19.895 32.774 1.00 0.00 H new ATOM 1721 N ALA A 117 -2.074 -15.846 35.784 1.00 0.00 N ATOM 1722 CA ALA A 117 -1.656 -14.731 36.624 1.00 0.00 C ATOM 1723 C ALA A 117 -1.510 -15.163 38.079 1.00 0.00 C ATOM 1724 O ALA A 117 -2.230 -16.034 38.568 1.00 0.00 O ATOM 1725 CB ALA A 117 -2.648 -13.583 36.509 1.00 0.00 C ATOM 0 H ALA A 117 -2.600 -16.569 36.274 1.00 0.00 H new ATOM 0 HA ALA A 117 -0.681 -14.391 36.275 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -2.323 -12.757 37.142 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -2.699 -13.248 35.473 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -3.634 -13.920 36.830 1.00 0.00 H new ATOM 1731 N PRO A 118 -0.557 -14.543 38.789 1.00 0.00 N ATOM 1732 CA PRO A 118 -0.295 -14.848 40.199 1.00 0.00 C ATOM 1733 C PRO A 118 -1.420 -14.376 41.113 1.00 0.00 C ATOM 1734 O PRO A 118 -1.588 -13.177 41.339 1.00 0.00 O ATOM 1735 CB PRO A 118 0.994 -14.076 40.495 1.00 0.00 C ATOM 1736 CG PRO A 118 1.002 -12.959 39.510 1.00 0.00 C ATOM 1737 CD PRO A 118 0.339 -13.495 38.271 1.00 0.00 C ATOM 0 HA PRO A 118 -0.216 -15.921 40.376 1.00 0.00 H new ATOM 0 HB2 PRO A 118 1.005 -13.701 41.518 1.00 0.00 H new ATOM 0 HB3 PRO A 118 1.872 -14.712 40.379 1.00 0.00 H new ATOM 0 HG2 PRO A 118 0.464 -12.093 39.897 1.00 0.00 H new ATOM 0 HG3 PRO A 118 2.020 -12.633 39.298 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -0.214 -12.718 37.743 1.00 0.00 H new ATOM 0 HD3 PRO A 118 1.068 -13.900 37.569 1.00 0.00 H new TER 1745 PRO A 118