USER MOD reduce.3.24.130724 H: found=0, std=0, add=1075, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1071 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 49 CYS SG : rot 21:sc= 1.07 USER MOD Set 1.2: A 55 SER OG : rot 180:sc= -0.0196 USER MOD Set 2.1: A 52 CYS SG : rot 170:sc= -0.0264 USER MOD Set 2.2: A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 176:sc= 0 (180deg=-0.0145) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 HIS : no HD1:sc=-0.00597 X(o=-0.006,f=-0.006) USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 ASN : amide:sc= 0.242 X(o=0.24,f=-0.042) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ -122:sc= 0.345 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 172:sc= 0.885 (180deg=0.814) USER MOD Single : A 33 ASN : amide:sc= 0.642 K(o=0.64,f=-6.5!) USER MOD Single : A 38 ASN : amide:sc= -0.14 X(o=-0.14,f=-0.14) USER MOD Single : A 39 CYS SG : rot 170:sc= 0 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 CYS SG : rot -170:sc= -0.756 USER MOD Single : A 45 ASN : amide:sc= 0.199 K(o=0.2,f=-3.9!) USER MOD Single : A 60 MET CE :methyl 177:sc= 0 (180deg=-0.0207) USER MOD Single : A 61 GLN : amide:sc= -0.139 X(o=-0.14,f=-0.18) USER MOD Single : A 64 CYS SG : rot 170:sc= -0.299 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.00578 USER MOD Single : A 66 CYS SG : rot 180:sc= 0 USER MOD Single : A 70 HIS : no HD1:sc= -0.903 K(o=-0.9,f=-1.4) USER MOD Single : A 74 THR OG1 : rot -90:sc= 1.4 USER MOD Single : A 75 GLN : amide:sc= 0.601 K(o=0.6,f=0) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 84 GLN : amide:sc= -0.0345 X(o=-0.034,f=-0.034) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0129) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 CYS SG : rot 180:sc= 0 USER MOD Single : A 108 CYS SG : rot -172:sc= 0.178 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 ASN : amide:sc= 0.966 K(o=0.97,f=-3.9!) USER MOD Single : A 124 MET CE :methyl 139:sc= -0.102 (180deg=-0.177) USER MOD Single : A 128 ASN : amide:sc= 0.736 K(o=0.74,f=-0.39) USER MOD Single : A 133 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.143 51.404 13.000 1.00 0.00 N ATOM 2 CA MET A 1 13.885 50.227 12.457 1.00 0.00 C ATOM 3 C MET A 1 13.392 49.879 11.036 1.00 0.00 C ATOM 4 O MET A 1 12.187 49.662 10.868 1.00 0.00 O ATOM 5 CB MET A 1 13.759 49.006 13.403 1.00 0.00 C ATOM 6 CG MET A 1 14.628 47.809 12.981 1.00 0.00 C ATOM 7 SD MET A 1 14.488 46.344 14.049 1.00 0.00 S ATOM 8 CE MET A 1 12.842 45.738 13.577 1.00 0.00 C ATOM 0 H1 MET A 1 13.489 51.622 13.956 1.00 0.00 H new ATOM 0 H2 MET A 1 13.295 52.226 12.381 1.00 0.00 H new ATOM 0 H3 MET A 1 12.127 51.185 13.041 1.00 0.00 H new ATOM 0 HA MET A 1 14.940 50.492 12.394 1.00 0.00 H new ATOM 0 HB2 MET A 1 14.037 49.309 14.412 1.00 0.00 H new ATOM 0 HB3 MET A 1 12.716 48.692 13.441 1.00 0.00 H new ATOM 0 HG2 MET A 1 14.360 47.525 11.963 1.00 0.00 H new ATOM 0 HG3 MET A 1 15.671 48.126 12.959 1.00 0.00 H new ATOM 0 HE1 MET A 1 12.637 44.801 14.094 1.00 0.00 H new ATOM 0 HE2 MET A 1 12.089 46.477 13.853 1.00 0.00 H new ATOM 0 HE3 MET A 1 12.810 45.573 12.500 1.00 0.00 H new ATOM 18 N PRO A 2 14.282 49.806 10.021 1.00 0.00 N ATOM 19 CA PRO A 2 13.926 49.394 8.660 1.00 0.00 C ATOM 20 C PRO A 2 13.744 47.868 8.566 1.00 0.00 C ATOM 21 O PRO A 2 14.332 47.117 9.345 1.00 0.00 O ATOM 22 CB PRO A 2 15.081 49.879 7.778 1.00 0.00 C ATOM 23 CG PRO A 2 16.288 49.779 8.708 1.00 0.00 C ATOM 24 CD PRO A 2 15.707 50.138 10.078 1.00 0.00 C ATOM 0 HA PRO A 2 12.974 49.820 8.344 1.00 0.00 H new ATOM 0 HB2 PRO A 2 15.201 49.256 6.892 1.00 0.00 H new ATOM 0 HB3 PRO A 2 14.923 50.900 7.431 1.00 0.00 H new ATOM 0 HG2 PRO A 2 16.718 48.777 8.703 1.00 0.00 H new ATOM 0 HG3 PRO A 2 17.080 50.467 8.414 1.00 0.00 H new ATOM 0 HD2 PRO A 2 16.205 49.579 10.870 1.00 0.00 H new ATOM 0 HD3 PRO A 2 15.851 51.196 10.296 1.00 0.00 H new ATOM 32 N VAL A 3 12.952 47.410 7.589 1.00 0.00 N ATOM 33 CA VAL A 3 12.644 45.984 7.348 1.00 0.00 C ATOM 34 C VAL A 3 12.023 45.783 5.957 1.00 0.00 C ATOM 35 O VAL A 3 11.254 46.625 5.492 1.00 0.00 O ATOM 36 CB VAL A 3 11.755 45.384 8.476 1.00 0.00 C ATOM 37 CG1 VAL A 3 10.358 46.026 8.565 1.00 0.00 C ATOM 38 CG2 VAL A 3 11.608 43.858 8.344 1.00 0.00 C ATOM 0 H VAL A 3 12.493 48.032 6.924 1.00 0.00 H new ATOM 0 HA VAL A 3 13.585 45.434 7.370 1.00 0.00 H new ATOM 0 HB VAL A 3 12.285 45.616 9.400 1.00 0.00 H new ATOM 0 HG11 VAL A 3 9.794 45.559 9.372 1.00 0.00 H new ATOM 0 HG12 VAL A 3 10.460 47.093 8.763 1.00 0.00 H new ATOM 0 HG13 VAL A 3 9.830 45.881 7.622 1.00 0.00 H new ATOM 0 HG21 VAL A 3 10.980 43.482 9.152 1.00 0.00 H new ATOM 0 HG22 VAL A 3 11.148 43.618 7.385 1.00 0.00 H new ATOM 0 HG23 VAL A 3 12.591 43.391 8.402 1.00 0.00 H new ATOM 48 N ARG A 4 12.359 44.664 5.300 1.00 0.00 N ATOM 49 CA ARG A 4 11.792 44.235 4.011 1.00 0.00 C ATOM 50 C ARG A 4 10.956 42.957 4.192 1.00 0.00 C ATOM 51 O ARG A 4 11.434 41.966 4.753 1.00 0.00 O ATOM 52 CB ARG A 4 12.920 44.008 2.985 1.00 0.00 C ATOM 53 CG ARG A 4 13.768 45.256 2.676 1.00 0.00 C ATOM 54 CD ARG A 4 12.962 46.404 2.053 1.00 0.00 C ATOM 55 NE ARG A 4 13.837 47.534 1.694 1.00 0.00 N ATOM 56 CZ ARG A 4 13.476 48.639 1.050 1.00 0.00 C ATOM 57 NH1 ARG A 4 12.236 48.844 0.652 1.00 0.00 N ATOM 58 NH2 ARG A 4 14.372 49.568 0.793 1.00 0.00 N ATOM 0 H ARG A 4 13.055 44.011 5.661 1.00 0.00 H new ATOM 0 HA ARG A 4 11.136 45.021 3.636 1.00 0.00 H new ATOM 0 HB2 ARG A 4 13.577 43.221 3.356 1.00 0.00 H new ATOM 0 HB3 ARG A 4 12.480 43.645 2.056 1.00 0.00 H new ATOM 0 HG2 ARG A 4 14.233 45.607 3.597 1.00 0.00 H new ATOM 0 HG3 ARG A 4 14.575 44.979 1.997 1.00 0.00 H new ATOM 0 HD2 ARG A 4 12.442 46.047 1.164 1.00 0.00 H new ATOM 0 HD3 ARG A 4 12.199 46.740 2.756 1.00 0.00 H new ATOM 0 HE ARG A 4 14.817 47.461 1.967 1.00 0.00 H new ATOM 0 HH11 ARG A 4 11.519 48.143 0.836 1.00 0.00 H new ATOM 0 HH12 ARG A 4 11.994 49.704 0.160 1.00 0.00 H new ATOM 0 HH21 ARG A 4 15.340 49.439 1.088 1.00 0.00 H new ATOM 0 HH22 ARG A 4 14.099 50.417 0.299 1.00 0.00 H new ATOM 72 N ARG A 5 9.706 42.991 3.717 1.00 0.00 N ATOM 73 CA ARG A 5 8.728 41.891 3.821 1.00 0.00 C ATOM 74 C ARG A 5 8.883 40.861 2.683 1.00 0.00 C ATOM 75 O ARG A 5 9.552 41.120 1.679 1.00 0.00 O ATOM 76 CB ARG A 5 7.299 42.473 3.870 1.00 0.00 C ATOM 77 CG ARG A 5 7.062 43.295 5.152 1.00 0.00 C ATOM 78 CD ARG A 5 5.648 43.888 5.224 1.00 0.00 C ATOM 79 NE ARG A 5 4.613 42.846 5.385 1.00 0.00 N ATOM 80 CZ ARG A 5 3.299 43.030 5.318 1.00 0.00 C ATOM 81 NH1 ARG A 5 2.767 44.216 5.099 1.00 0.00 N ATOM 82 NH2 ARG A 5 2.487 42.006 5.475 1.00 0.00 N ATOM 0 H ARG A 5 9.331 43.808 3.234 1.00 0.00 H new ATOM 0 HA ARG A 5 8.922 41.349 4.747 1.00 0.00 H new ATOM 0 HB2 ARG A 5 7.133 43.104 2.997 1.00 0.00 H new ATOM 0 HB3 ARG A 5 6.573 41.661 3.819 1.00 0.00 H new ATOM 0 HG2 ARG A 5 7.230 42.660 6.022 1.00 0.00 H new ATOM 0 HG3 ARG A 5 7.793 44.102 5.201 1.00 0.00 H new ATOM 0 HD2 ARG A 5 5.591 44.586 6.059 1.00 0.00 H new ATOM 0 HD3 ARG A 5 5.449 44.459 4.317 1.00 0.00 H new ATOM 0 HE ARG A 5 4.938 41.896 5.564 1.00 0.00 H new ATOM 0 HH11 ARG A 5 3.369 45.030 4.975 1.00 0.00 H new ATOM 0 HH12 ARG A 5 1.753 44.320 5.054 1.00 0.00 H new ATOM 0 HH21 ARG A 5 2.867 41.075 5.647 1.00 0.00 H new ATOM 0 HH22 ARG A 5 1.478 42.143 5.424 1.00 0.00 H new ATOM 96 N GLY A 6 8.253 39.691 2.847 1.00 0.00 N ATOM 97 CA GLY A 6 8.196 38.595 1.858 1.00 0.00 C ATOM 98 C GLY A 6 9.136 37.416 2.139 1.00 0.00 C ATOM 99 O GLY A 6 9.007 36.375 1.497 1.00 0.00 O ATOM 0 H GLY A 6 7.748 39.468 3.704 1.00 0.00 H new ATOM 0 HA2 GLY A 6 7.173 38.221 1.812 1.00 0.00 H new ATOM 0 HA3 GLY A 6 8.432 39.001 0.874 1.00 0.00 H new ATOM 103 N HIS A 7 10.047 37.549 3.105 1.00 0.00 N ATOM 104 CA HIS A 7 10.969 36.502 3.567 1.00 0.00 C ATOM 105 C HIS A 7 11.171 36.583 5.099 1.00 0.00 C ATOM 106 O HIS A 7 10.987 37.649 5.696 1.00 0.00 O ATOM 107 CB HIS A 7 12.321 36.650 2.839 1.00 0.00 C ATOM 108 CG HIS A 7 12.262 36.398 1.351 1.00 0.00 C ATOM 109 ND1 HIS A 7 12.309 37.349 0.356 1.00 0.00 N ATOM 110 CD2 HIS A 7 12.172 35.177 0.733 1.00 0.00 C ATOM 111 CE1 HIS A 7 12.248 36.717 -0.829 1.00 0.00 C ATOM 112 NE2 HIS A 7 12.165 35.383 -0.654 1.00 0.00 N ATOM 0 H HIS A 7 10.170 38.426 3.610 1.00 0.00 H new ATOM 0 HA HIS A 7 10.539 35.527 3.336 1.00 0.00 H new ATOM 0 HB2 HIS A 7 12.703 37.657 3.009 1.00 0.00 H new ATOM 0 HB3 HIS A 7 13.036 35.958 3.284 1.00 0.00 H new ATOM 0 HD2 HIS A 7 12.116 34.220 1.230 1.00 0.00 H new ATOM 0 HE1 HIS A 7 12.263 37.210 -1.790 1.00 0.00 H new ATOM 0 HE2 HIS A 7 12.109 34.670 -1.381 1.00 0.00 H new ATOM 120 N VAL A 8 11.572 35.474 5.738 1.00 0.00 N ATOM 121 CA VAL A 8 11.779 35.357 7.199 1.00 0.00 C ATOM 122 C VAL A 8 12.608 34.105 7.532 1.00 0.00 C ATOM 123 O VAL A 8 12.538 33.104 6.816 1.00 0.00 O ATOM 124 CB VAL A 8 10.428 35.388 7.972 1.00 0.00 C ATOM 125 CG1 VAL A 8 9.560 34.140 7.731 1.00 0.00 C ATOM 126 CG2 VAL A 8 10.622 35.606 9.481 1.00 0.00 C ATOM 0 H VAL A 8 11.769 34.605 5.242 1.00 0.00 H new ATOM 0 HA VAL A 8 12.348 36.225 7.532 1.00 0.00 H new ATOM 0 HB VAL A 8 9.893 36.245 7.563 1.00 0.00 H new ATOM 0 HG11 VAL A 8 8.634 34.226 8.299 1.00 0.00 H new ATOM 0 HG12 VAL A 8 9.328 34.057 6.669 1.00 0.00 H new ATOM 0 HG13 VAL A 8 10.102 33.252 8.054 1.00 0.00 H new ATOM 0 HG21 VAL A 8 9.650 35.620 9.975 1.00 0.00 H new ATOM 0 HG22 VAL A 8 11.226 34.796 9.891 1.00 0.00 H new ATOM 0 HG23 VAL A 8 11.128 36.557 9.649 1.00 0.00 H new ATOM 136 N ALA A 9 13.394 34.157 8.615 1.00 0.00 N ATOM 137 CA ALA A 9 14.158 33.015 9.133 1.00 0.00 C ATOM 138 C ALA A 9 13.238 31.852 9.592 1.00 0.00 C ATOM 139 O ALA A 9 12.101 32.110 10.007 1.00 0.00 O ATOM 140 CB ALA A 9 15.046 33.528 10.278 1.00 0.00 C ATOM 0 H ALA A 9 13.519 35.007 9.165 1.00 0.00 H new ATOM 0 HA ALA A 9 14.776 32.597 8.339 1.00 0.00 H new ATOM 0 HB1 ALA A 9 15.628 32.701 10.685 1.00 0.00 H new ATOM 0 HB2 ALA A 9 15.721 34.295 9.899 1.00 0.00 H new ATOM 0 HB3 ALA A 9 14.419 33.952 11.063 1.00 0.00 H new ATOM 146 N PRO A 10 13.703 30.583 9.544 1.00 0.00 N ATOM 147 CA PRO A 10 12.904 29.424 9.937 1.00 0.00 C ATOM 148 C PRO A 10 12.629 29.445 11.447 1.00 0.00 C ATOM 149 O PRO A 10 13.546 29.334 12.261 1.00 0.00 O ATOM 150 CB PRO A 10 13.702 28.192 9.492 1.00 0.00 C ATOM 151 CG PRO A 10 15.148 28.686 9.468 1.00 0.00 C ATOM 152 CD PRO A 10 15.007 30.151 9.056 1.00 0.00 C ATOM 0 HA PRO A 10 11.921 29.420 9.467 1.00 0.00 H new ATOM 0 HB2 PRO A 10 13.574 27.361 10.185 1.00 0.00 H new ATOM 0 HB3 PRO A 10 13.382 27.841 8.511 1.00 0.00 H new ATOM 0 HG2 PRO A 10 15.625 28.586 10.443 1.00 0.00 H new ATOM 0 HG3 PRO A 10 15.754 28.124 8.758 1.00 0.00 H new ATOM 0 HD2 PRO A 10 15.805 30.756 9.487 1.00 0.00 H new ATOM 0 HD3 PRO A 10 15.074 30.260 7.974 1.00 0.00 H new ATOM 160 N GLN A 11 11.353 29.594 11.817 1.00 0.00 N ATOM 161 CA GLN A 11 10.917 29.692 13.218 1.00 0.00 C ATOM 162 C GLN A 11 10.904 28.335 13.937 1.00 0.00 C ATOM 163 O GLN A 11 11.198 28.235 15.128 1.00 0.00 O ATOM 164 CB GLN A 11 9.530 30.356 13.260 1.00 0.00 C ATOM 165 CG GLN A 11 8.344 29.543 12.708 1.00 0.00 C ATOM 166 CD GLN A 11 7.046 30.355 12.717 1.00 0.00 C ATOM 167 OE1 GLN A 11 6.210 30.238 13.607 1.00 0.00 O ATOM 168 NE2 GLN A 11 6.826 31.225 11.750 1.00 0.00 N ATOM 0 H GLN A 11 10.585 29.651 11.148 1.00 0.00 H new ATOM 0 HA GLN A 11 11.641 30.303 13.757 1.00 0.00 H new ATOM 0 HB2 GLN A 11 9.310 30.614 14.296 1.00 0.00 H new ATOM 0 HB3 GLN A 11 9.586 31.292 12.704 1.00 0.00 H new ATOM 0 HG2 GLN A 11 8.565 29.222 11.690 1.00 0.00 H new ATOM 0 HG3 GLN A 11 8.213 28.641 13.305 1.00 0.00 H new ATOM 0 HE21 GLN A 11 7.509 31.338 11.000 1.00 0.00 H new ATOM 0 HE22 GLN A 11 5.973 31.785 11.752 1.00 0.00 H new ATOM 177 N ASN A 12 10.565 27.292 13.180 1.00 0.00 N ATOM 178 CA ASN A 12 10.419 25.900 13.602 1.00 0.00 C ATOM 179 C ASN A 12 11.441 25.014 12.869 1.00 0.00 C ATOM 180 O ASN A 12 11.100 24.164 12.046 1.00 0.00 O ATOM 181 CB ASN A 12 8.952 25.468 13.419 1.00 0.00 C ATOM 182 CG ASN A 12 8.312 25.903 12.096 1.00 0.00 C ATOM 183 OD1 ASN A 12 7.223 26.464 12.072 1.00 0.00 O ATOM 184 ND2 ASN A 12 8.980 25.724 10.971 1.00 0.00 N ATOM 0 H ASN A 12 10.372 27.406 12.185 1.00 0.00 H new ATOM 0 HA ASN A 12 10.645 25.785 14.662 1.00 0.00 H new ATOM 0 HB2 ASN A 12 8.896 24.382 13.493 1.00 0.00 H new ATOM 0 HB3 ASN A 12 8.363 25.874 14.242 1.00 0.00 H new ATOM 0 HD21 ASN A 12 8.589 26.052 10.088 1.00 0.00 H new ATOM 0 HD22 ASN A 12 9.887 25.258 10.985 1.00 0.00 H new ATOM 191 N THR A 13 12.715 25.266 13.157 1.00 0.00 N ATOM 192 CA THR A 13 13.913 24.623 12.569 1.00 0.00 C ATOM 193 C THR A 13 13.861 23.094 12.559 1.00 0.00 C ATOM 194 O THR A 13 14.377 22.476 11.631 1.00 0.00 O ATOM 195 CB THR A 13 15.178 25.066 13.315 1.00 0.00 C ATOM 196 OG1 THR A 13 15.019 24.814 14.698 1.00 0.00 O ATOM 197 CG2 THR A 13 15.444 26.557 13.122 1.00 0.00 C ATOM 0 H THR A 13 12.967 25.969 13.852 1.00 0.00 H new ATOM 0 HA THR A 13 13.934 24.951 11.530 1.00 0.00 H new ATOM 0 HB THR A 13 16.020 24.503 12.912 1.00 0.00 H new ATOM 0 HG1 THR A 13 15.827 25.095 15.177 1.00 0.00 H new ATOM 0 HG21 THR A 13 16.347 26.839 13.663 1.00 0.00 H new ATOM 0 HG22 THR A 13 15.576 26.769 12.061 1.00 0.00 H new ATOM 0 HG23 THR A 13 14.599 27.130 13.504 1.00 0.00 H new ATOM 205 N PHE A 14 13.211 22.486 13.555 1.00 0.00 N ATOM 206 CA PHE A 14 12.996 21.038 13.631 1.00 0.00 C ATOM 207 C PHE A 14 12.000 20.549 12.566 1.00 0.00 C ATOM 208 O PHE A 14 12.294 19.623 11.810 1.00 0.00 O ATOM 209 CB PHE A 14 12.505 20.690 15.042 1.00 0.00 C ATOM 210 CG PHE A 14 12.705 19.235 15.417 1.00 0.00 C ATOM 211 CD1 PHE A 14 11.750 18.266 15.055 1.00 0.00 C ATOM 212 CD2 PHE A 14 13.861 18.845 16.123 1.00 0.00 C ATOM 213 CE1 PHE A 14 11.950 16.915 15.396 1.00 0.00 C ATOM 214 CE2 PHE A 14 14.058 17.497 16.467 1.00 0.00 C ATOM 215 CZ PHE A 14 13.103 16.531 16.102 1.00 0.00 C ATOM 0 H PHE A 14 12.813 22.994 14.344 1.00 0.00 H new ATOM 0 HA PHE A 14 13.939 20.529 13.429 1.00 0.00 H new ATOM 0 HB2 PHE A 14 13.028 21.317 15.764 1.00 0.00 H new ATOM 0 HB3 PHE A 14 11.445 20.933 15.118 1.00 0.00 H new ATOM 0 HD1 PHE A 14 10.862 18.560 14.515 1.00 0.00 H new ATOM 0 HD2 PHE A 14 14.598 19.585 16.400 1.00 0.00 H new ATOM 0 HE1 PHE A 14 11.217 16.173 15.115 1.00 0.00 H new ATOM 0 HE2 PHE A 14 14.943 17.203 17.012 1.00 0.00 H new ATOM 0 HZ PHE A 14 13.256 15.494 16.364 1.00 0.00 H new ATOM 225 N LEU A 15 10.831 21.203 12.484 1.00 0.00 N ATOM 226 CA LEU A 15 9.788 20.937 11.486 1.00 0.00 C ATOM 227 C LEU A 15 10.303 21.194 10.066 1.00 0.00 C ATOM 228 O LEU A 15 9.967 20.451 9.151 1.00 0.00 O ATOM 229 CB LEU A 15 8.563 21.818 11.801 1.00 0.00 C ATOM 230 CG LEU A 15 7.410 21.672 10.787 1.00 0.00 C ATOM 231 CD1 LEU A 15 6.773 20.276 10.826 1.00 0.00 C ATOM 232 CD2 LEU A 15 6.332 22.728 11.059 1.00 0.00 C ATOM 0 H LEU A 15 10.580 21.952 13.129 1.00 0.00 H new ATOM 0 HA LEU A 15 9.501 19.887 11.535 1.00 0.00 H new ATOM 0 HB2 LEU A 15 8.193 21.567 12.795 1.00 0.00 H new ATOM 0 HB3 LEU A 15 8.877 22.861 11.832 1.00 0.00 H new ATOM 0 HG LEU A 15 7.837 21.817 9.795 1.00 0.00 H new ATOM 0 HD11 LEU A 15 5.967 20.223 10.094 1.00 0.00 H new ATOM 0 HD12 LEU A 15 7.527 19.525 10.590 1.00 0.00 H new ATOM 0 HD13 LEU A 15 6.372 20.087 11.822 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.523 22.616 10.337 1.00 0.00 H new ATOM 0 HD22 LEU A 15 5.940 22.596 12.067 1.00 0.00 H new ATOM 0 HD23 LEU A 15 6.766 23.723 10.966 1.00 0.00 H new ATOM 244 N ASP A 16 11.156 22.199 9.883 1.00 0.00 N ATOM 245 CA ASP A 16 11.767 22.536 8.591 1.00 0.00 C ATOM 246 C ASP A 16 12.535 21.359 7.975 1.00 0.00 C ATOM 247 O ASP A 16 12.539 21.195 6.755 1.00 0.00 O ATOM 248 CB ASP A 16 12.695 23.733 8.791 1.00 0.00 C ATOM 249 CG ASP A 16 13.138 24.350 7.455 1.00 0.00 C ATOM 250 OD1 ASP A 16 12.315 25.040 6.809 1.00 0.00 O ATOM 251 OD2 ASP A 16 14.312 24.150 7.062 1.00 0.00 O ATOM 0 H ASP A 16 11.450 22.816 10.640 1.00 0.00 H new ATOM 0 HA ASP A 16 10.970 22.781 7.889 1.00 0.00 H new ATOM 0 HB2 ASP A 16 12.186 24.490 9.388 1.00 0.00 H new ATOM 0 HB3 ASP A 16 13.574 23.420 9.354 1.00 0.00 H new ATOM 256 N THR A 17 13.111 20.497 8.821 1.00 0.00 N ATOM 257 CA THR A 17 13.776 19.256 8.386 1.00 0.00 C ATOM 258 C THR A 17 12.757 18.217 7.924 1.00 0.00 C ATOM 259 O THR A 17 13.032 17.460 7.000 1.00 0.00 O ATOM 260 CB THR A 17 14.662 18.682 9.502 1.00 0.00 C ATOM 261 OG1 THR A 17 15.509 19.689 10.015 1.00 0.00 O ATOM 262 CG2 THR A 17 15.549 17.545 8.986 1.00 0.00 C ATOM 0 H THR A 17 13.131 20.638 9.831 1.00 0.00 H new ATOM 0 HA THR A 17 14.415 19.506 7.539 1.00 0.00 H new ATOM 0 HB THR A 17 13.996 18.301 10.276 1.00 0.00 H new ATOM 0 HG1 THR A 17 16.069 19.314 10.727 1.00 0.00 H new ATOM 0 HG21 THR A 17 16.162 17.163 9.802 1.00 0.00 H new ATOM 0 HG22 THR A 17 14.922 16.743 8.597 1.00 0.00 H new ATOM 0 HG23 THR A 17 16.195 17.919 8.192 1.00 0.00 H new ATOM 270 N ILE A 18 11.562 18.208 8.516 1.00 0.00 N ATOM 271 CA ILE A 18 10.458 17.310 8.127 1.00 0.00 C ATOM 272 C ILE A 18 9.851 17.758 6.795 1.00 0.00 C ATOM 273 O ILE A 18 9.618 16.932 5.918 1.00 0.00 O ATOM 274 CB ILE A 18 9.377 17.236 9.233 1.00 0.00 C ATOM 275 CG1 ILE A 18 9.958 17.096 10.658 1.00 0.00 C ATOM 276 CG2 ILE A 18 8.383 16.099 8.933 1.00 0.00 C ATOM 277 CD1 ILE A 18 10.881 15.894 10.892 1.00 0.00 C ATOM 0 H ILE A 18 11.324 18.829 9.289 1.00 0.00 H new ATOM 0 HA ILE A 18 10.865 16.307 8.000 1.00 0.00 H new ATOM 0 HB ILE A 18 8.853 18.192 9.217 1.00 0.00 H new ATOM 0 HG12 ILE A 18 10.511 18.005 10.894 1.00 0.00 H new ATOM 0 HG13 ILE A 18 9.129 17.035 11.363 1.00 0.00 H new ATOM 0 HG21 ILE A 18 7.629 16.059 9.719 1.00 0.00 H new ATOM 0 HG22 ILE A 18 7.899 16.283 7.974 1.00 0.00 H new ATOM 0 HG23 ILE A 18 8.917 15.150 8.894 1.00 0.00 H new ATOM 0 HD11 ILE A 18 11.228 15.898 11.925 1.00 0.00 H new ATOM 0 HD12 ILE A 18 10.334 14.972 10.696 1.00 0.00 H new ATOM 0 HD13 ILE A 18 11.738 15.957 10.221 1.00 0.00 H new ATOM 289 N ILE A 19 9.670 19.070 6.609 1.00 0.00 N ATOM 290 CA ILE A 19 9.208 19.667 5.343 1.00 0.00 C ATOM 291 C ILE A 19 10.120 19.218 4.184 1.00 0.00 C ATOM 292 O ILE A 19 9.626 18.705 3.180 1.00 0.00 O ATOM 293 CB ILE A 19 9.101 21.209 5.497 1.00 0.00 C ATOM 294 CG1 ILE A 19 8.015 21.586 6.540 1.00 0.00 C ATOM 295 CG2 ILE A 19 8.787 21.871 4.143 1.00 0.00 C ATOM 296 CD1 ILE A 19 7.980 23.069 6.936 1.00 0.00 C ATOM 0 H ILE A 19 9.841 19.759 7.341 1.00 0.00 H new ATOM 0 HA ILE A 19 8.207 19.312 5.096 1.00 0.00 H new ATOM 0 HB ILE A 19 10.064 21.578 5.851 1.00 0.00 H new ATOM 0 HG12 ILE A 19 7.039 21.309 6.142 1.00 0.00 H new ATOM 0 HG13 ILE A 19 8.173 20.990 7.438 1.00 0.00 H new ATOM 0 HG21 ILE A 19 8.716 22.951 4.274 1.00 0.00 H new ATOM 0 HG22 ILE A 19 9.582 21.643 3.433 1.00 0.00 H new ATOM 0 HG23 ILE A 19 7.840 21.489 3.762 1.00 0.00 H new ATOM 0 HD11 ILE A 19 7.189 23.232 7.668 1.00 0.00 H new ATOM 0 HD12 ILE A 19 8.939 23.353 7.369 1.00 0.00 H new ATOM 0 HD13 ILE A 19 7.787 23.677 6.052 1.00 0.00 H new ATOM 308 N ARG A 20 11.447 19.305 4.347 1.00 0.00 N ATOM 309 CA ARG A 20 12.432 18.909 3.322 1.00 0.00 C ATOM 310 C ARG A 20 12.345 17.430 2.898 1.00 0.00 C ATOM 311 O ARG A 20 12.697 17.103 1.765 1.00 0.00 O ATOM 312 CB ARG A 20 13.851 19.213 3.832 1.00 0.00 C ATOM 313 CG ARG A 20 14.126 20.722 3.905 1.00 0.00 C ATOM 314 CD ARG A 20 15.396 21.035 4.704 1.00 0.00 C ATOM 315 NE ARG A 20 15.471 22.470 5.020 1.00 0.00 N ATOM 316 CZ ARG A 20 16.049 23.436 4.321 1.00 0.00 C ATOM 317 NH1 ARG A 20 16.707 23.219 3.199 1.00 0.00 N ATOM 318 NH2 ARG A 20 15.945 24.661 4.778 1.00 0.00 N ATOM 0 H ARG A 20 11.875 19.656 5.203 1.00 0.00 H new ATOM 0 HA ARG A 20 12.197 19.494 2.433 1.00 0.00 H new ATOM 0 HB2 ARG A 20 13.983 18.772 4.820 1.00 0.00 H new ATOM 0 HB3 ARG A 20 14.581 18.743 3.173 1.00 0.00 H new ATOM 0 HG2 ARG A 20 14.225 21.122 2.896 1.00 0.00 H new ATOM 0 HG3 ARG A 20 13.275 21.224 4.365 1.00 0.00 H new ATOM 0 HD2 ARG A 20 15.404 20.454 5.626 1.00 0.00 H new ATOM 0 HD3 ARG A 20 16.274 20.737 4.132 1.00 0.00 H new ATOM 0 HE ARG A 20 15.020 22.758 5.888 1.00 0.00 H new ATOM 0 HH11 ARG A 20 16.789 22.271 2.831 1.00 0.00 H new ATOM 0 HH12 ARG A 20 17.134 23.999 2.699 1.00 0.00 H new ATOM 0 HH21 ARG A 20 15.433 24.841 5.642 1.00 0.00 H new ATOM 0 HH22 ARG A 20 16.376 25.433 4.270 1.00 0.00 H new ATOM 332 N LYS A 21 11.867 16.533 3.769 1.00 0.00 N ATOM 333 CA LYS A 21 11.687 15.096 3.479 1.00 0.00 C ATOM 334 C LYS A 21 10.427 14.801 2.644 1.00 0.00 C ATOM 335 O LYS A 21 10.366 13.776 1.960 1.00 0.00 O ATOM 336 CB LYS A 21 11.620 14.342 4.817 1.00 0.00 C ATOM 337 CG LYS A 21 12.975 14.367 5.546 1.00 0.00 C ATOM 338 CD LYS A 21 12.892 13.918 7.009 1.00 0.00 C ATOM 339 CE LYS A 21 12.418 12.465 7.153 1.00 0.00 C ATOM 340 NZ LYS A 21 12.570 11.976 8.553 1.00 0.00 N ATOM 0 H LYS A 21 11.587 16.786 4.717 1.00 0.00 H new ATOM 0 HA LYS A 21 12.534 14.763 2.879 1.00 0.00 H new ATOM 0 HB2 LYS A 21 10.856 14.791 5.451 1.00 0.00 H new ATOM 0 HB3 LYS A 21 11.320 13.309 4.639 1.00 0.00 H new ATOM 0 HG2 LYS A 21 13.676 13.722 5.016 1.00 0.00 H new ATOM 0 HG3 LYS A 21 13.381 15.378 5.507 1.00 0.00 H new ATOM 0 HD2 LYS A 21 13.872 14.025 7.474 1.00 0.00 H new ATOM 0 HD3 LYS A 21 12.210 14.574 7.549 1.00 0.00 H new ATOM 0 HE2 LYS A 21 11.373 12.391 6.852 1.00 0.00 H new ATOM 0 HE3 LYS A 21 12.990 11.826 6.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 13.179 11.133 8.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 13.001 12.721 9.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 11.636 11.732 8.939 1.00 0.00 H new ATOM 354 N PHE A 22 9.428 15.687 2.702 1.00 0.00 N ATOM 355 CA PHE A 22 8.254 15.669 1.818 1.00 0.00 C ATOM 356 C PHE A 22 8.460 16.501 0.536 1.00 0.00 C ATOM 357 O PHE A 22 7.895 16.151 -0.502 1.00 0.00 O ATOM 358 CB PHE A 22 7.018 16.126 2.611 1.00 0.00 C ATOM 359 CG PHE A 22 6.529 15.088 3.604 1.00 0.00 C ATOM 360 CD1 PHE A 22 5.835 13.950 3.145 1.00 0.00 C ATOM 361 CD2 PHE A 22 6.786 15.236 4.980 1.00 0.00 C ATOM 362 CE1 PHE A 22 5.417 12.960 4.054 1.00 0.00 C ATOM 363 CE2 PHE A 22 6.369 14.246 5.889 1.00 0.00 C ATOM 364 CZ PHE A 22 5.691 13.105 5.426 1.00 0.00 C ATOM 0 H PHE A 22 9.410 16.452 3.377 1.00 0.00 H new ATOM 0 HA PHE A 22 8.099 14.646 1.474 1.00 0.00 H new ATOM 0 HB2 PHE A 22 7.256 17.046 3.144 1.00 0.00 H new ATOM 0 HB3 PHE A 22 6.213 16.361 1.914 1.00 0.00 H new ATOM 0 HD1 PHE A 22 5.623 13.837 2.092 1.00 0.00 H new ATOM 0 HD2 PHE A 22 7.305 16.112 5.339 1.00 0.00 H new ATOM 0 HE1 PHE A 22 4.886 12.089 3.698 1.00 0.00 H new ATOM 0 HE2 PHE A 22 6.570 14.363 6.944 1.00 0.00 H new ATOM 0 HZ PHE A 22 5.381 12.341 6.123 1.00 0.00 H new ATOM 374 N GLU A 23 9.281 17.556 0.583 1.00 0.00 N ATOM 375 CA GLU A 23 9.703 18.343 -0.589 1.00 0.00 C ATOM 376 C GLU A 23 10.667 17.565 -1.517 1.00 0.00 C ATOM 377 O GLU A 23 11.040 16.418 -1.253 1.00 0.00 O ATOM 378 CB GLU A 23 10.342 19.677 -0.149 1.00 0.00 C ATOM 379 CG GLU A 23 9.336 20.675 0.435 1.00 0.00 C ATOM 380 CD GLU A 23 9.933 22.089 0.548 1.00 0.00 C ATOM 381 OE1 GLU A 23 11.069 22.252 1.054 1.00 0.00 O ATOM 382 OE2 GLU A 23 9.265 23.060 0.116 1.00 0.00 O ATOM 0 H GLU A 23 9.682 17.897 1.457 1.00 0.00 H new ATOM 0 HA GLU A 23 8.802 18.550 -1.166 1.00 0.00 H new ATOM 0 HB2 GLU A 23 11.113 19.473 0.594 1.00 0.00 H new ATOM 0 HB3 GLU A 23 10.838 20.133 -1.006 1.00 0.00 H new ATOM 0 HG2 GLU A 23 8.447 20.705 -0.195 1.00 0.00 H new ATOM 0 HG3 GLU A 23 9.017 20.335 1.420 1.00 0.00 H new ATOM 389 N GLY A 24 11.057 18.182 -2.645 1.00 0.00 N ATOM 390 CA GLY A 24 12.023 17.625 -3.605 1.00 0.00 C ATOM 391 C GLY A 24 11.436 16.520 -4.486 1.00 0.00 C ATOM 392 O GLY A 24 12.196 15.777 -5.107 1.00 0.00 O ATOM 0 H GLY A 24 10.703 19.098 -2.920 1.00 0.00 H new ATOM 0 HA2 GLY A 24 12.395 18.428 -4.242 1.00 0.00 H new ATOM 0 HA3 GLY A 24 12.879 17.228 -3.059 1.00 0.00 H new ATOM 396 N GLN A 25 10.100 16.396 -4.497 1.00 0.00 N ATOM 397 CA GLN A 25 9.306 15.350 -5.154 1.00 0.00 C ATOM 398 C GLN A 25 9.589 13.944 -4.569 1.00 0.00 C ATOM 399 O GLN A 25 9.232 12.928 -5.163 1.00 0.00 O ATOM 400 CB GLN A 25 9.473 15.450 -6.681 1.00 0.00 C ATOM 401 CG GLN A 25 8.891 16.751 -7.262 1.00 0.00 C ATOM 402 CD GLN A 25 9.085 16.837 -8.779 1.00 0.00 C ATOM 403 OE1 GLN A 25 9.983 17.505 -9.284 1.00 0.00 O ATOM 404 NE2 GLN A 25 8.271 16.164 -9.570 1.00 0.00 N ATOM 0 H GLN A 25 9.507 17.071 -4.014 1.00 0.00 H new ATOM 0 HA GLN A 25 8.250 15.516 -4.942 1.00 0.00 H new ATOM 0 HB2 GLN A 25 10.532 15.388 -6.931 1.00 0.00 H new ATOM 0 HB3 GLN A 25 8.984 14.597 -7.152 1.00 0.00 H new ATOM 0 HG2 GLN A 25 7.828 16.809 -7.028 1.00 0.00 H new ATOM 0 HG3 GLN A 25 9.369 17.607 -6.786 1.00 0.00 H new ATOM 0 HE21 GLN A 25 7.519 15.603 -9.170 1.00 0.00 H new ATOM 0 HE22 GLN A 25 8.394 16.204 -10.582 1.00 0.00 H new ATOM 413 N SER A 26 10.187 13.866 -3.374 1.00 0.00 N ATOM 414 CA SER A 26 10.613 12.635 -2.684 1.00 0.00 C ATOM 415 C SER A 26 9.454 11.942 -1.942 1.00 0.00 C ATOM 416 O SER A 26 9.595 11.474 -0.806 1.00 0.00 O ATOM 417 CB SER A 26 11.786 12.944 -1.734 1.00 0.00 C ATOM 418 OG SER A 26 12.902 13.480 -2.441 1.00 0.00 O ATOM 0 H SER A 26 10.400 14.703 -2.831 1.00 0.00 H new ATOM 0 HA SER A 26 10.950 11.929 -3.443 1.00 0.00 H new ATOM 0 HB2 SER A 26 11.462 13.653 -0.972 1.00 0.00 H new ATOM 0 HB3 SER A 26 12.085 12.033 -1.215 1.00 0.00 H new ATOM 0 HG SER A 26 13.629 13.667 -1.811 1.00 0.00 H new ATOM 424 N ARG A 27 8.274 11.890 -2.572 1.00 0.00 N ATOM 425 CA ARG A 27 7.114 11.157 -2.050 1.00 0.00 C ATOM 426 C ARG A 27 7.362 9.634 -2.061 1.00 0.00 C ATOM 427 O ARG A 27 8.323 9.124 -2.635 1.00 0.00 O ATOM 428 CB ARG A 27 5.803 11.509 -2.773 1.00 0.00 C ATOM 429 CG ARG A 27 5.301 12.958 -2.629 1.00 0.00 C ATOM 430 CD ARG A 27 6.120 14.004 -3.400 1.00 0.00 C ATOM 431 NE ARG A 27 5.263 15.107 -3.874 1.00 0.00 N ATOM 432 CZ ARG A 27 5.097 16.320 -3.357 1.00 0.00 C ATOM 433 NH1 ARG A 27 5.743 16.745 -2.292 1.00 0.00 N ATOM 434 NH2 ARG A 27 4.255 17.150 -3.933 1.00 0.00 N ATOM 0 H ARG A 27 8.096 12.357 -3.461 1.00 0.00 H new ATOM 0 HA ARG A 27 6.992 11.478 -1.016 1.00 0.00 H new ATOM 0 HB2 ARG A 27 5.933 11.298 -3.834 1.00 0.00 H new ATOM 0 HB3 ARG A 27 5.023 10.841 -2.408 1.00 0.00 H new ATOM 0 HG2 ARG A 27 4.266 13.005 -2.969 1.00 0.00 H new ATOM 0 HG3 ARG A 27 5.301 13.224 -1.572 1.00 0.00 H new ATOM 0 HD2 ARG A 27 6.906 14.401 -2.757 1.00 0.00 H new ATOM 0 HD3 ARG A 27 6.612 13.531 -4.250 1.00 0.00 H new ATOM 0 HE ARG A 27 4.722 14.911 -4.716 1.00 0.00 H new ATOM 0 HH11 ARG A 27 6.409 16.133 -1.822 1.00 0.00 H new ATOM 0 HH12 ARG A 27 5.577 17.687 -1.937 1.00 0.00 H new ATOM 0 HH21 ARG A 27 3.741 16.859 -4.764 1.00 0.00 H new ATOM 0 HH22 ARG A 27 4.116 18.084 -3.548 1.00 0.00 H new ATOM 448 N LYS A 28 6.497 8.903 -1.360 1.00 0.00 N ATOM 449 CA LYS A 28 6.710 7.518 -0.934 1.00 0.00 C ATOM 450 C LYS A 28 5.895 6.544 -1.795 1.00 0.00 C ATOM 451 O LYS A 28 4.753 6.835 -2.138 1.00 0.00 O ATOM 452 CB LYS A 28 6.330 7.421 0.558 1.00 0.00 C ATOM 453 CG LYS A 28 7.201 8.322 1.448 1.00 0.00 C ATOM 454 CD LYS A 28 6.604 9.704 1.705 1.00 0.00 C ATOM 455 CE LYS A 28 7.552 10.657 2.444 1.00 0.00 C ATOM 456 NZ LYS A 28 8.931 10.822 1.879 1.00 0.00 N ATOM 0 H LYS A 28 5.594 9.272 -1.061 1.00 0.00 H new ATOM 0 HA LYS A 28 7.755 7.237 -1.064 1.00 0.00 H new ATOM 0 HB2 LYS A 28 5.283 7.697 0.681 1.00 0.00 H new ATOM 0 HB3 LYS A 28 6.428 6.387 0.888 1.00 0.00 H new ATOM 0 HG2 LYS A 28 7.363 7.824 2.404 1.00 0.00 H new ATOM 0 HG3 LYS A 28 8.179 8.441 0.981 1.00 0.00 H new ATOM 0 HD2 LYS A 28 6.323 10.152 0.752 1.00 0.00 H new ATOM 0 HD3 LYS A 28 5.689 9.592 2.287 1.00 0.00 H new ATOM 0 HE2 LYS A 28 7.082 11.640 2.482 1.00 0.00 H new ATOM 0 HE3 LYS A 28 7.647 10.309 3.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 9.424 11.587 2.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 9.461 9.935 1.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 8.866 11.060 0.869 1.00 0.00 H new ATOM 470 N PHE A 29 6.460 5.378 -2.112 1.00 0.00 N ATOM 471 CA PHE A 29 5.830 4.354 -2.952 1.00 0.00 C ATOM 472 C PHE A 29 6.526 2.990 -2.889 1.00 0.00 C ATOM 473 O PHE A 29 7.677 2.874 -2.472 1.00 0.00 O ATOM 474 CB PHE A 29 5.696 4.863 -4.403 1.00 0.00 C ATOM 475 CG PHE A 29 6.980 5.375 -5.030 1.00 0.00 C ATOM 476 CD1 PHE A 29 7.907 4.470 -5.581 1.00 0.00 C ATOM 477 CD2 PHE A 29 7.247 6.759 -5.062 1.00 0.00 C ATOM 478 CE1 PHE A 29 9.098 4.944 -6.159 1.00 0.00 C ATOM 479 CE2 PHE A 29 8.437 7.231 -5.645 1.00 0.00 C ATOM 480 CZ PHE A 29 9.361 6.325 -6.193 1.00 0.00 C ATOM 0 H PHE A 29 7.389 5.112 -1.785 1.00 0.00 H new ATOM 0 HA PHE A 29 4.834 4.182 -2.544 1.00 0.00 H new ATOM 0 HB2 PHE A 29 5.307 4.053 -5.020 1.00 0.00 H new ATOM 0 HB3 PHE A 29 4.956 5.663 -4.423 1.00 0.00 H new ATOM 0 HD1 PHE A 29 7.703 3.410 -5.560 1.00 0.00 H new ATOM 0 HD2 PHE A 29 6.539 7.456 -4.639 1.00 0.00 H new ATOM 0 HE1 PHE A 29 9.810 4.248 -6.577 1.00 0.00 H new ATOM 0 HE2 PHE A 29 8.641 8.291 -5.672 1.00 0.00 H new ATOM 0 HZ PHE A 29 10.274 6.690 -6.641 1.00 0.00 H new ATOM 490 N ILE A 30 5.803 1.958 -3.323 1.00 0.00 N ATOM 491 CA ILE A 30 6.197 0.541 -3.354 1.00 0.00 C ATOM 492 C ILE A 30 5.556 -0.158 -4.561 1.00 0.00 C ATOM 493 O ILE A 30 4.519 0.285 -5.051 1.00 0.00 O ATOM 494 CB ILE A 30 5.795 -0.165 -2.033 1.00 0.00 C ATOM 495 CG1 ILE A 30 4.269 -0.117 -1.784 1.00 0.00 C ATOM 496 CG2 ILE A 30 6.546 0.418 -0.826 1.00 0.00 C ATOM 497 CD1 ILE A 30 3.841 -0.827 -0.498 1.00 0.00 C ATOM 0 H ILE A 30 4.861 2.095 -3.688 1.00 0.00 H new ATOM 0 HA ILE A 30 7.281 0.481 -3.453 1.00 0.00 H new ATOM 0 HB ILE A 30 6.083 -1.210 -2.147 1.00 0.00 H new ATOM 0 HG12 ILE A 30 3.948 0.924 -1.740 1.00 0.00 H new ATOM 0 HG13 ILE A 30 3.756 -0.573 -2.630 1.00 0.00 H new ATOM 0 HG21 ILE A 30 6.237 -0.102 0.081 1.00 0.00 H new ATOM 0 HG22 ILE A 30 7.619 0.292 -0.969 1.00 0.00 H new ATOM 0 HG23 ILE A 30 6.315 1.479 -0.732 1.00 0.00 H new ATOM 0 HD11 ILE A 30 2.759 -0.755 -0.385 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.132 -1.876 -0.548 1.00 0.00 H new ATOM 0 HD13 ILE A 30 4.327 -0.356 0.357 1.00 0.00 H new ATOM 509 N ILE A 31 6.144 -1.256 -5.035 1.00 0.00 N ATOM 510 CA ILE A 31 5.628 -2.084 -6.132 1.00 0.00 C ATOM 511 C ILE A 31 5.430 -3.517 -5.640 1.00 0.00 C ATOM 512 O ILE A 31 6.343 -4.109 -5.065 1.00 0.00 O ATOM 513 CB ILE A 31 6.566 -2.053 -7.366 1.00 0.00 C ATOM 514 CG1 ILE A 31 6.781 -0.611 -7.888 1.00 0.00 C ATOM 515 CG2 ILE A 31 5.968 -2.916 -8.503 1.00 0.00 C ATOM 516 CD1 ILE A 31 8.034 0.088 -7.346 1.00 0.00 C ATOM 0 H ILE A 31 7.023 -1.608 -4.655 1.00 0.00 H new ATOM 0 HA ILE A 31 4.669 -1.674 -6.449 1.00 0.00 H new ATOM 0 HB ILE A 31 7.531 -2.453 -7.054 1.00 0.00 H new ATOM 0 HG12 ILE A 31 6.839 -0.638 -8.976 1.00 0.00 H new ATOM 0 HG13 ILE A 31 5.908 -0.012 -7.630 1.00 0.00 H new ATOM 0 HG21 ILE A 31 6.632 -2.890 -9.367 1.00 0.00 H new ATOM 0 HG22 ILE A 31 5.859 -3.945 -8.160 1.00 0.00 H new ATOM 0 HG23 ILE A 31 4.991 -2.522 -8.784 1.00 0.00 H new ATOM 0 HD11 ILE A 31 8.101 1.091 -7.766 1.00 0.00 H new ATOM 0 HD12 ILE A 31 7.973 0.153 -6.260 1.00 0.00 H new ATOM 0 HD13 ILE A 31 8.919 -0.483 -7.626 1.00 0.00 H new ATOM 528 N ALA A 32 4.263 -4.090 -5.921 1.00 0.00 N ATOM 529 CA ALA A 32 3.911 -5.470 -5.603 1.00 0.00 C ATOM 530 C ALA A 32 3.452 -6.233 -6.848 1.00 0.00 C ATOM 531 O ALA A 32 2.837 -5.655 -7.745 1.00 0.00 O ATOM 532 CB ALA A 32 2.816 -5.425 -4.541 1.00 0.00 C ATOM 0 H ALA A 32 3.510 -3.588 -6.393 1.00 0.00 H new ATOM 0 HA ALA A 32 4.783 -6.005 -5.226 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.525 -6.441 -4.276 1.00 0.00 H new ATOM 0 HB2 ALA A 32 3.189 -4.911 -3.655 1.00 0.00 H new ATOM 0 HB3 ALA A 32 1.951 -4.890 -4.933 1.00 0.00 H new ATOM 538 N ASN A 33 3.724 -7.539 -6.899 1.00 0.00 N ATOM 539 CA ASN A 33 3.245 -8.386 -7.989 1.00 0.00 C ATOM 540 C ASN A 33 1.758 -8.746 -7.811 1.00 0.00 C ATOM 541 O ASN A 33 1.342 -9.230 -6.757 1.00 0.00 O ATOM 542 CB ASN A 33 4.139 -9.626 -8.139 1.00 0.00 C ATOM 543 CG ASN A 33 4.075 -10.134 -9.571 1.00 0.00 C ATOM 544 OD1 ASN A 33 3.227 -10.940 -9.928 1.00 0.00 O ATOM 545 ND2 ASN A 33 4.920 -9.614 -10.441 1.00 0.00 N ATOM 0 H ASN A 33 4.275 -8.032 -6.196 1.00 0.00 H new ATOM 0 HA ASN A 33 3.313 -7.824 -8.920 1.00 0.00 H new ATOM 0 HB2 ASN A 33 5.168 -9.379 -7.876 1.00 0.00 H new ATOM 0 HB3 ASN A 33 3.813 -10.406 -7.451 1.00 0.00 H new ATOM 0 HD21 ASN A 33 4.870 -9.883 -11.424 1.00 0.00 H new ATOM 0 HD22 ASN A 33 5.623 -8.943 -10.131 1.00 0.00 H new ATOM 552 N ALA A 34 0.960 -8.551 -8.861 1.00 0.00 N ATOM 553 CA ALA A 34 -0.483 -8.834 -8.878 1.00 0.00 C ATOM 554 C ALA A 34 -0.826 -10.341 -8.853 1.00 0.00 C ATOM 555 O ALA A 34 -1.939 -10.715 -8.483 1.00 0.00 O ATOM 556 CB ALA A 34 -1.064 -8.172 -10.136 1.00 0.00 C ATOM 0 H ALA A 34 1.304 -8.183 -9.748 1.00 0.00 H new ATOM 0 HA ALA A 34 -0.922 -8.429 -7.966 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -2.137 -8.360 -10.184 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -0.886 -7.097 -10.097 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -0.583 -8.588 -11.021 1.00 0.00 H new ATOM 562 N ARG A 35 0.124 -11.204 -9.247 1.00 0.00 N ATOM 563 CA ARG A 35 -0.107 -12.632 -9.538 1.00 0.00 C ATOM 564 C ARG A 35 0.052 -13.571 -8.321 1.00 0.00 C ATOM 565 O ARG A 35 -0.172 -14.775 -8.456 1.00 0.00 O ATOM 566 CB ARG A 35 0.843 -13.075 -10.669 1.00 0.00 C ATOM 567 CG ARG A 35 0.763 -12.177 -11.923 1.00 0.00 C ATOM 568 CD ARG A 35 1.772 -12.599 -12.995 1.00 0.00 C ATOM 569 NE ARG A 35 3.161 -12.431 -12.523 1.00 0.00 N ATOM 570 CZ ARG A 35 4.263 -12.807 -13.164 1.00 0.00 C ATOM 571 NH1 ARG A 35 4.223 -13.319 -14.377 1.00 0.00 N ATOM 572 NH2 ARG A 35 5.437 -12.672 -12.585 1.00 0.00 N ATOM 0 H ARG A 35 1.096 -10.924 -9.376 1.00 0.00 H new ATOM 0 HA ARG A 35 -1.151 -12.719 -9.838 1.00 0.00 H new ATOM 0 HB2 ARG A 35 1.867 -13.074 -10.295 1.00 0.00 H new ATOM 0 HB3 ARG A 35 0.607 -14.101 -10.950 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -0.245 -12.220 -12.336 1.00 0.00 H new ATOM 0 HG3 ARG A 35 0.947 -11.141 -11.639 1.00 0.00 H new ATOM 0 HD2 ARG A 35 1.602 -13.641 -13.267 1.00 0.00 H new ATOM 0 HD3 ARG A 35 1.618 -12.005 -13.896 1.00 0.00 H new ATOM 0 HE ARG A 35 3.287 -11.982 -11.616 1.00 0.00 H new ATOM 0 HH11 ARG A 35 3.328 -13.437 -14.852 1.00 0.00 H new ATOM 0 HH12 ARG A 35 5.087 -13.598 -14.842 1.00 0.00 H new ATOM 0 HH21 ARG A 35 5.500 -12.279 -11.646 1.00 0.00 H new ATOM 0 HH22 ARG A 35 6.284 -12.960 -13.075 1.00 0.00 H new ATOM 586 N VAL A 36 0.466 -13.051 -7.157 1.00 0.00 N ATOM 587 CA VAL A 36 0.793 -13.835 -5.940 1.00 0.00 C ATOM 588 C VAL A 36 -0.261 -13.640 -4.838 1.00 0.00 C ATOM 589 O VAL A 36 -0.882 -12.581 -4.754 1.00 0.00 O ATOM 590 CB VAL A 36 2.226 -13.553 -5.420 1.00 0.00 C ATOM 591 CG1 VAL A 36 3.278 -13.896 -6.488 1.00 0.00 C ATOM 592 CG2 VAL A 36 2.444 -12.114 -4.928 1.00 0.00 C ATOM 0 H VAL A 36 0.589 -12.047 -7.024 1.00 0.00 H new ATOM 0 HA VAL A 36 0.770 -14.885 -6.231 1.00 0.00 H new ATOM 0 HB VAL A 36 2.346 -14.203 -4.553 1.00 0.00 H new ATOM 0 HG11 VAL A 36 4.274 -13.689 -6.097 1.00 0.00 H new ATOM 0 HG12 VAL A 36 3.202 -14.952 -6.747 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.104 -13.291 -7.378 1.00 0.00 H new ATOM 0 HG21 VAL A 36 3.471 -12.000 -4.581 1.00 0.00 H new ATOM 0 HG22 VAL A 36 2.257 -11.418 -5.746 1.00 0.00 H new ATOM 0 HG23 VAL A 36 1.758 -11.902 -4.108 1.00 0.00 H new ATOM 602 N GLU A 37 -0.447 -14.666 -3.998 1.00 0.00 N ATOM 603 CA GLU A 37 -1.562 -14.819 -3.044 1.00 0.00 C ATOM 604 C GLU A 37 -1.802 -13.584 -2.157 1.00 0.00 C ATOM 605 O GLU A 37 -2.902 -13.033 -2.112 1.00 0.00 O ATOM 606 CB GLU A 37 -1.259 -16.048 -2.163 1.00 0.00 C ATOM 607 CG GLU A 37 -2.403 -16.455 -1.223 1.00 0.00 C ATOM 608 CD GLU A 37 -3.620 -16.998 -1.989 1.00 0.00 C ATOM 609 OE1 GLU A 37 -3.556 -18.141 -2.501 1.00 0.00 O ATOM 610 OE2 GLU A 37 -4.657 -16.300 -2.072 1.00 0.00 O ATOM 0 H GLU A 37 0.204 -15.450 -3.960 1.00 0.00 H new ATOM 0 HA GLU A 37 -2.479 -14.945 -3.620 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -1.019 -16.892 -2.809 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -0.371 -15.841 -1.566 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -2.046 -17.214 -0.527 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -2.706 -15.593 -0.628 1.00 0.00 H new ATOM 617 N ASN A 38 -0.750 -13.149 -1.459 1.00 0.00 N ATOM 618 CA ASN A 38 -0.750 -12.033 -0.506 1.00 0.00 C ATOM 619 C ASN A 38 -0.061 -10.786 -1.090 1.00 0.00 C ATOM 620 O ASN A 38 0.569 -10.046 -0.343 1.00 0.00 O ATOM 621 CB ASN A 38 -0.162 -12.506 0.846 1.00 0.00 C ATOM 622 CG ASN A 38 1.063 -13.405 0.712 1.00 0.00 C ATOM 623 OD1 ASN A 38 1.020 -14.597 0.992 1.00 0.00 O ATOM 624 ND2 ASN A 38 2.174 -12.883 0.226 1.00 0.00 N ATOM 0 H ASN A 38 0.168 -13.585 -1.546 1.00 0.00 H new ATOM 0 HA ASN A 38 -1.775 -11.716 -0.313 1.00 0.00 H new ATOM 0 HB2 ASN A 38 0.105 -11.632 1.439 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -0.934 -13.042 1.398 1.00 0.00 H new ATOM 0 HD21 ASN A 38 2.995 -13.472 0.084 1.00 0.00 H new ATOM 0 HD22 ASN A 38 2.212 -11.891 -0.008 1.00 0.00 H new ATOM 631 N CYS A 39 -0.120 -10.578 -2.416 1.00 0.00 N ATOM 632 CA CYS A 39 0.311 -9.355 -3.130 1.00 0.00 C ATOM 633 C CYS A 39 1.606 -8.740 -2.560 1.00 0.00 C ATOM 634 O CYS A 39 1.620 -7.593 -2.106 1.00 0.00 O ATOM 635 CB CYS A 39 -0.874 -8.369 -3.164 1.00 0.00 C ATOM 636 SG CYS A 39 -2.251 -9.107 -4.096 1.00 0.00 S ATOM 0 H CYS A 39 -0.485 -11.287 -3.052 1.00 0.00 H new ATOM 0 HA CYS A 39 0.583 -9.616 -4.153 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -1.193 -8.133 -2.149 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -0.568 -7.432 -3.628 1.00 0.00 H new ATOM 0 HG CYS A 39 -3.317 -8.378 -3.946 1.00 0.00 H new ATOM 642 N ALA A 40 2.663 -9.552 -2.473 1.00 0.00 N ATOM 643 CA ALA A 40 3.886 -9.219 -1.744 1.00 0.00 C ATOM 644 C ALA A 40 4.657 -8.071 -2.418 1.00 0.00 C ATOM 645 O ALA A 40 4.752 -8.035 -3.648 1.00 0.00 O ATOM 646 CB ALA A 40 4.742 -10.487 -1.618 1.00 0.00 C ATOM 0 H ALA A 40 2.692 -10.471 -2.914 1.00 0.00 H new ATOM 0 HA ALA A 40 3.627 -8.861 -0.748 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.659 -10.255 -1.076 1.00 0.00 H new ATOM 0 HB2 ALA A 40 4.184 -11.251 -1.076 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.992 -10.857 -2.612 1.00 0.00 H new ATOM 652 N VAL A 41 5.235 -7.162 -1.625 1.00 0.00 N ATOM 653 CA VAL A 41 6.095 -6.082 -2.155 1.00 0.00 C ATOM 654 C VAL A 41 7.358 -6.692 -2.779 1.00 0.00 C ATOM 655 O VAL A 41 8.108 -7.395 -2.104 1.00 0.00 O ATOM 656 CB VAL A 41 6.471 -5.013 -1.098 1.00 0.00 C ATOM 657 CG1 VAL A 41 7.187 -3.833 -1.758 1.00 0.00 C ATOM 658 CG2 VAL A 41 5.201 -4.480 -0.409 1.00 0.00 C ATOM 0 H VAL A 41 5.126 -7.147 -0.611 1.00 0.00 H new ATOM 0 HA VAL A 41 5.515 -5.557 -2.915 1.00 0.00 H new ATOM 0 HB VAL A 41 7.129 -5.482 -0.367 1.00 0.00 H new ATOM 0 HG11 VAL A 41 7.443 -3.093 -1.000 1.00 0.00 H new ATOM 0 HG12 VAL A 41 8.097 -4.185 -2.243 1.00 0.00 H new ATOM 0 HG13 VAL A 41 6.532 -3.379 -2.501 1.00 0.00 H new ATOM 0 HG21 VAL A 41 5.477 -3.729 0.332 1.00 0.00 H new ATOM 0 HG22 VAL A 41 4.544 -4.031 -1.154 1.00 0.00 H new ATOM 0 HG23 VAL A 41 4.682 -5.302 0.083 1.00 0.00 H new ATOM 668 N ILE A 42 7.578 -6.421 -4.068 1.00 0.00 N ATOM 669 CA ILE A 42 8.761 -6.857 -4.840 1.00 0.00 C ATOM 670 C ILE A 42 9.804 -5.746 -4.999 1.00 0.00 C ATOM 671 O ILE A 42 10.949 -6.027 -5.358 1.00 0.00 O ATOM 672 CB ILE A 42 8.361 -7.395 -6.234 1.00 0.00 C ATOM 673 CG1 ILE A 42 7.599 -6.359 -7.091 1.00 0.00 C ATOM 674 CG2 ILE A 42 7.565 -8.697 -6.076 1.00 0.00 C ATOM 675 CD1 ILE A 42 7.423 -6.780 -8.552 1.00 0.00 C ATOM 0 H ILE A 42 6.922 -5.876 -4.627 1.00 0.00 H new ATOM 0 HA ILE A 42 9.214 -7.662 -4.262 1.00 0.00 H new ATOM 0 HB ILE A 42 9.280 -7.602 -6.783 1.00 0.00 H new ATOM 0 HG12 ILE A 42 6.617 -6.188 -6.650 1.00 0.00 H new ATOM 0 HG13 ILE A 42 8.133 -5.409 -7.057 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.285 -9.074 -7.060 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.179 -9.439 -5.565 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.666 -8.505 -5.491 1.00 0.00 H new ATOM 0 HD11 ILE A 42 6.880 -6.004 -9.091 1.00 0.00 H new ATOM 0 HD12 ILE A 42 8.402 -6.923 -9.010 1.00 0.00 H new ATOM 0 HD13 ILE A 42 6.862 -7.713 -8.597 1.00 0.00 H new ATOM 687 N TYR A 43 9.414 -4.497 -4.736 1.00 0.00 N ATOM 688 CA TYR A 43 10.290 -3.331 -4.769 1.00 0.00 C ATOM 689 C TYR A 43 9.741 -2.200 -3.891 1.00 0.00 C ATOM 690 O TYR A 43 8.538 -1.957 -3.858 1.00 0.00 O ATOM 691 CB TYR A 43 10.482 -2.866 -6.220 1.00 0.00 C ATOM 692 CG TYR A 43 11.764 -2.078 -6.410 1.00 0.00 C ATOM 693 CD1 TYR A 43 12.975 -2.757 -6.642 1.00 0.00 C ATOM 694 CD2 TYR A 43 11.760 -0.675 -6.281 1.00 0.00 C ATOM 695 CE1 TYR A 43 14.183 -2.039 -6.749 1.00 0.00 C ATOM 696 CE2 TYR A 43 12.964 0.049 -6.384 1.00 0.00 C ATOM 697 CZ TYR A 43 14.181 -0.631 -6.617 1.00 0.00 C ATOM 698 OH TYR A 43 15.345 0.073 -6.701 1.00 0.00 O ATOM 0 H TYR A 43 8.452 -4.266 -4.487 1.00 0.00 H new ATOM 0 HA TYR A 43 11.261 -3.612 -4.362 1.00 0.00 H new ATOM 0 HB2 TYR A 43 10.492 -3.734 -6.879 1.00 0.00 H new ATOM 0 HB3 TYR A 43 9.633 -2.250 -6.517 1.00 0.00 H new ATOM 0 HD1 TYR A 43 12.978 -3.833 -6.738 1.00 0.00 H new ATOM 0 HD2 TYR A 43 10.831 -0.153 -6.103 1.00 0.00 H new ATOM 0 HE1 TYR A 43 15.109 -2.564 -6.932 1.00 0.00 H new ATOM 0 HE2 TYR A 43 12.957 1.124 -6.285 1.00 0.00 H new ATOM 0 HH TYR A 43 15.158 1.028 -6.589 1.00 0.00 H new ATOM 708 N CYS A 44 10.616 -1.478 -3.197 1.00 0.00 N ATOM 709 CA CYS A 44 10.242 -0.379 -2.294 1.00 0.00 C ATOM 710 C CYS A 44 11.057 0.890 -2.591 1.00 0.00 C ATOM 711 O CYS A 44 12.178 0.773 -3.081 1.00 0.00 O ATOM 712 CB CYS A 44 10.449 -0.803 -0.825 1.00 0.00 C ATOM 713 SG CYS A 44 10.038 -2.534 -0.451 1.00 0.00 S ATOM 0 H CYS A 44 11.622 -1.638 -3.243 1.00 0.00 H new ATOM 0 HA CYS A 44 9.189 -0.154 -2.460 1.00 0.00 H new ATOM 0 HB2 CYS A 44 11.491 -0.628 -0.557 1.00 0.00 H new ATOM 0 HB3 CYS A 44 9.843 -0.157 -0.189 1.00 0.00 H new ATOM 0 HG CYS A 44 10.050 -2.714 0.836 1.00 0.00 H new ATOM 719 N ASN A 45 10.559 2.078 -2.230 1.00 0.00 N ATOM 720 CA ASN A 45 11.414 3.282 -2.180 1.00 0.00 C ATOM 721 C ASN A 45 12.280 3.307 -0.885 1.00 0.00 C ATOM 722 O ASN A 45 12.360 2.312 -0.167 1.00 0.00 O ATOM 723 CB ASN A 45 10.526 4.534 -2.366 1.00 0.00 C ATOM 724 CG ASN A 45 11.266 5.787 -2.847 1.00 0.00 C ATOM 725 OD1 ASN A 45 12.483 5.823 -2.975 1.00 0.00 O ATOM 726 ND2 ASN A 45 10.564 6.877 -3.090 1.00 0.00 N ATOM 0 H ASN A 45 9.585 2.237 -1.971 1.00 0.00 H new ATOM 0 HA ASN A 45 12.135 3.269 -2.997 1.00 0.00 H new ATOM 0 HB2 ASN A 45 9.738 4.299 -3.081 1.00 0.00 H new ATOM 0 HB3 ASN A 45 10.039 4.760 -1.417 1.00 0.00 H new ATOM 0 HD21 ASN A 45 11.036 7.733 -3.380 1.00 0.00 H new ATOM 0 HD22 ASN A 45 9.549 6.863 -2.988 1.00 0.00 H new ATOM 733 N ASP A 46 12.890 4.448 -0.551 1.00 0.00 N ATOM 734 CA ASP A 46 13.537 4.729 0.749 1.00 0.00 C ATOM 735 C ASP A 46 12.784 5.795 1.573 1.00 0.00 C ATOM 736 O ASP A 46 12.927 5.852 2.793 1.00 0.00 O ATOM 737 CB ASP A 46 14.978 5.199 0.513 1.00 0.00 C ATOM 738 CG ASP A 46 15.865 4.094 -0.086 1.00 0.00 C ATOM 739 OD1 ASP A 46 16.328 3.215 0.681 1.00 0.00 O ATOM 740 OD2 ASP A 46 16.121 4.123 -1.314 1.00 0.00 O ATOM 0 H ASP A 46 12.953 5.235 -1.197 1.00 0.00 H new ATOM 0 HA ASP A 46 13.521 3.802 1.322 1.00 0.00 H new ATOM 0 HB2 ASP A 46 14.972 6.059 -0.157 1.00 0.00 H new ATOM 0 HB3 ASP A 46 15.407 5.534 1.457 1.00 0.00 H new ATOM 745 N GLY A 47 11.937 6.607 0.923 1.00 0.00 N ATOM 746 CA GLY A 47 11.089 7.621 1.570 1.00 0.00 C ATOM 747 C GLY A 47 10.029 6.990 2.465 1.00 0.00 C ATOM 748 O GLY A 47 9.725 7.517 3.532 1.00 0.00 O ATOM 0 H GLY A 47 11.819 6.577 -0.090 1.00 0.00 H new ATOM 0 HA2 GLY A 47 11.712 8.291 2.163 1.00 0.00 H new ATOM 0 HA3 GLY A 47 10.604 8.229 0.806 1.00 0.00 H new ATOM 752 N PHE A 48 9.451 5.870 2.018 1.00 0.00 N ATOM 753 CA PHE A 48 8.362 5.179 2.719 1.00 0.00 C ATOM 754 C PHE A 48 8.858 4.527 4.031 1.00 0.00 C ATOM 755 O PHE A 48 8.117 4.497 5.008 1.00 0.00 O ATOM 756 CB PHE A 48 7.699 4.176 1.746 1.00 0.00 C ATOM 757 CG PHE A 48 8.218 2.765 1.833 1.00 0.00 C ATOM 758 CD1 PHE A 48 9.539 2.450 1.475 1.00 0.00 C ATOM 759 CD2 PHE A 48 7.388 1.786 2.390 1.00 0.00 C ATOM 760 CE1 PHE A 48 10.051 1.177 1.777 1.00 0.00 C ATOM 761 CE2 PHE A 48 7.891 0.512 2.656 1.00 0.00 C ATOM 762 CZ PHE A 48 9.231 0.206 2.374 1.00 0.00 C ATOM 0 H PHE A 48 9.729 5.412 1.150 1.00 0.00 H new ATOM 0 HA PHE A 48 7.603 5.897 3.029 1.00 0.00 H new ATOM 0 HB2 PHE A 48 6.626 4.164 1.936 1.00 0.00 H new ATOM 0 HB3 PHE A 48 7.838 4.536 0.727 1.00 0.00 H new ATOM 0 HD1 PHE A 48 10.156 3.180 0.972 1.00 0.00 H new ATOM 0 HD2 PHE A 48 6.357 2.017 2.614 1.00 0.00 H new ATOM 0 HE1 PHE A 48 11.081 0.944 1.549 1.00 0.00 H new ATOM 0 HE2 PHE A 48 7.246 -0.242 3.081 1.00 0.00 H new ATOM 0 HZ PHE A 48 9.629 -0.769 2.614 1.00 0.00 H new ATOM 772 N CYS A 49 10.130 4.093 4.087 1.00 0.00 N ATOM 773 CA CYS A 49 10.790 3.554 5.286 1.00 0.00 C ATOM 774 C CYS A 49 10.600 4.470 6.506 1.00 0.00 C ATOM 775 O CYS A 49 10.074 4.047 7.533 1.00 0.00 O ATOM 776 CB CYS A 49 12.291 3.352 4.994 1.00 0.00 C ATOM 777 SG CYS A 49 12.559 2.197 3.623 1.00 0.00 S ATOM 0 H CYS A 49 10.744 4.109 3.273 1.00 0.00 H new ATOM 0 HA CYS A 49 10.328 2.597 5.529 1.00 0.00 H new ATOM 0 HB2 CYS A 49 12.747 4.312 4.755 1.00 0.00 H new ATOM 0 HB3 CYS A 49 12.788 2.977 5.888 1.00 0.00 H new ATOM 0 HG CYS A 49 11.478 2.117 2.905 1.00 0.00 H new ATOM 783 N GLU A 50 10.973 5.745 6.359 1.00 0.00 N ATOM 784 CA GLU A 50 10.888 6.750 7.430 1.00 0.00 C ATOM 785 C GLU A 50 9.449 7.202 7.741 1.00 0.00 C ATOM 786 O GLU A 50 9.188 7.727 8.826 1.00 0.00 O ATOM 787 CB GLU A 50 11.743 7.970 7.057 1.00 0.00 C ATOM 788 CG GLU A 50 13.232 7.617 6.973 1.00 0.00 C ATOM 789 CD GLU A 50 14.091 8.886 6.866 1.00 0.00 C ATOM 790 OE1 GLU A 50 14.340 9.536 7.910 1.00 0.00 O ATOM 791 OE2 GLU A 50 14.510 9.248 5.741 1.00 0.00 O ATOM 0 H GLU A 50 11.347 6.115 5.485 1.00 0.00 H new ATOM 0 HA GLU A 50 11.265 6.274 8.335 1.00 0.00 H new ATOM 0 HB2 GLU A 50 11.409 8.369 6.099 1.00 0.00 H new ATOM 0 HB3 GLU A 50 11.597 8.756 7.798 1.00 0.00 H new ATOM 0 HG2 GLU A 50 13.525 7.048 7.855 1.00 0.00 H new ATOM 0 HG3 GLU A 50 13.410 6.978 6.108 1.00 0.00 H new ATOM 798 N LEU A 51 8.510 6.993 6.807 1.00 0.00 N ATOM 799 CA LEU A 51 7.094 7.349 6.958 1.00 0.00 C ATOM 800 C LEU A 51 6.424 6.530 8.073 1.00 0.00 C ATOM 801 O LEU A 51 5.766 7.099 8.947 1.00 0.00 O ATOM 802 CB LEU A 51 6.400 7.143 5.591 1.00 0.00 C ATOM 803 CG LEU A 51 5.030 7.827 5.433 1.00 0.00 C ATOM 804 CD1 LEU A 51 5.175 9.350 5.418 1.00 0.00 C ATOM 805 CD2 LEU A 51 4.355 7.338 4.147 1.00 0.00 C ATOM 0 H LEU A 51 8.720 6.562 5.906 1.00 0.00 H new ATOM 0 HA LEU A 51 7.002 8.393 7.258 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.063 7.511 4.808 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.274 6.073 5.425 1.00 0.00 H new ATOM 0 HG LEU A 51 4.407 7.561 6.287 1.00 0.00 H new ATOM 0 HD11 LEU A 51 4.192 9.808 5.305 1.00 0.00 H new ATOM 0 HD12 LEU A 51 5.625 9.682 6.354 1.00 0.00 H new ATOM 0 HD13 LEU A 51 5.811 9.647 4.584 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.385 7.824 4.038 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.983 7.584 3.290 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.216 6.258 4.197 1.00 0.00 H new ATOM 817 N CYS A 52 6.610 5.204 8.048 1.00 0.00 N ATOM 818 CA CYS A 52 6.000 4.259 9.001 1.00 0.00 C ATOM 819 C CYS A 52 6.985 3.655 10.023 1.00 0.00 C ATOM 820 O CYS A 52 6.548 3.120 11.042 1.00 0.00 O ATOM 821 CB CYS A 52 5.269 3.171 8.201 1.00 0.00 C ATOM 822 SG CYS A 52 3.969 3.939 7.187 1.00 0.00 S ATOM 0 H CYS A 52 7.199 4.746 7.353 1.00 0.00 H new ATOM 0 HA CYS A 52 5.297 4.819 9.617 1.00 0.00 H new ATOM 0 HB2 CYS A 52 5.974 2.636 7.564 1.00 0.00 H new ATOM 0 HB3 CYS A 52 4.832 2.438 8.878 1.00 0.00 H new ATOM 0 HG CYS A 52 3.493 3.062 6.354 1.00 0.00 H new ATOM 828 N GLY A 53 8.298 3.750 9.792 1.00 0.00 N ATOM 829 CA GLY A 53 9.361 3.370 10.737 1.00 0.00 C ATOM 830 C GLY A 53 9.944 1.973 10.506 1.00 0.00 C ATOM 831 O GLY A 53 10.842 1.563 11.240 1.00 0.00 O ATOM 0 H GLY A 53 8.667 4.106 8.910 1.00 0.00 H new ATOM 0 HA2 GLY A 53 10.166 4.102 10.672 1.00 0.00 H new ATOM 0 HA3 GLY A 53 8.964 3.422 11.751 1.00 0.00 H new ATOM 835 N TYR A 54 9.448 1.242 9.502 1.00 0.00 N ATOM 836 CA TYR A 54 10.011 -0.030 9.036 1.00 0.00 C ATOM 837 C TYR A 54 11.168 0.174 8.022 1.00 0.00 C ATOM 838 O TYR A 54 11.800 1.230 7.987 1.00 0.00 O ATOM 839 CB TYR A 54 8.851 -0.905 8.518 1.00 0.00 C ATOM 840 CG TYR A 54 7.873 -0.328 7.501 1.00 0.00 C ATOM 841 CD1 TYR A 54 8.197 0.752 6.656 1.00 0.00 C ATOM 842 CD2 TYR A 54 6.590 -0.901 7.419 1.00 0.00 C ATOM 843 CE1 TYR A 54 7.246 1.255 5.750 1.00 0.00 C ATOM 844 CE2 TYR A 54 5.632 -0.401 6.516 1.00 0.00 C ATOM 845 CZ TYR A 54 5.960 0.682 5.673 1.00 0.00 C ATOM 846 OH TYR A 54 5.044 1.173 4.792 1.00 0.00 O ATOM 0 H TYR A 54 8.621 1.527 8.977 1.00 0.00 H new ATOM 0 HA TYR A 54 10.490 -0.559 9.860 1.00 0.00 H new ATOM 0 HB2 TYR A 54 9.289 -1.801 8.078 1.00 0.00 H new ATOM 0 HB3 TYR A 54 8.271 -1.225 9.384 1.00 0.00 H new ATOM 0 HD1 TYR A 54 9.180 1.196 6.704 1.00 0.00 H new ATOM 0 HD2 TYR A 54 6.337 -1.735 8.057 1.00 0.00 H new ATOM 0 HE1 TYR A 54 7.502 2.086 5.109 1.00 0.00 H new ATOM 0 HE2 TYR A 54 4.649 -0.845 6.469 1.00 0.00 H new ATOM 0 HH TYR A 54 4.211 0.663 4.868 1.00 0.00 H new ATOM 856 N SER A 55 11.431 -0.806 7.151 1.00 0.00 N ATOM 857 CA SER A 55 12.408 -0.697 6.056 1.00 0.00 C ATOM 858 C SER A 55 12.136 -1.727 4.949 1.00 0.00 C ATOM 859 O SER A 55 11.381 -2.687 5.151 1.00 0.00 O ATOM 860 CB SER A 55 13.840 -0.849 6.598 1.00 0.00 C ATOM 861 OG SER A 55 14.800 -0.484 5.614 1.00 0.00 O ATOM 0 H SER A 55 10.965 -1.713 7.185 1.00 0.00 H new ATOM 0 HA SER A 55 12.303 0.294 5.614 1.00 0.00 H new ATOM 0 HB2 SER A 55 13.966 -0.225 7.483 1.00 0.00 H new ATOM 0 HB3 SER A 55 14.007 -1.880 6.909 1.00 0.00 H new ATOM 0 HG SER A 55 15.702 -0.587 5.983 1.00 0.00 H new ATOM 867 N ARG A 56 12.807 -1.569 3.801 1.00 0.00 N ATOM 868 CA ARG A 56 12.748 -2.484 2.650 1.00 0.00 C ATOM 869 C ARG A 56 12.964 -3.937 3.090 1.00 0.00 C ATOM 870 O ARG A 56 12.140 -4.786 2.779 1.00 0.00 O ATOM 871 CB ARG A 56 13.776 -2.040 1.585 1.00 0.00 C ATOM 872 CG ARG A 56 13.865 -3.027 0.404 1.00 0.00 C ATOM 873 CD ARG A 56 14.930 -2.655 -0.631 1.00 0.00 C ATOM 874 NE ARG A 56 14.468 -1.629 -1.587 1.00 0.00 N ATOM 875 CZ ARG A 56 15.274 -0.996 -2.444 1.00 0.00 C ATOM 876 NH1 ARG A 56 16.562 -1.263 -2.519 1.00 0.00 N ATOM 877 NH2 ARG A 56 14.811 -0.077 -3.260 1.00 0.00 N ATOM 0 H ARG A 56 13.427 -0.775 3.641 1.00 0.00 H new ATOM 0 HA ARG A 56 11.754 -2.439 2.204 1.00 0.00 H new ATOM 0 HB2 ARG A 56 13.503 -1.053 1.210 1.00 0.00 H new ATOM 0 HB3 ARG A 56 14.757 -1.944 2.049 1.00 0.00 H new ATOM 0 HG2 ARG A 56 14.079 -4.023 0.790 1.00 0.00 H new ATOM 0 HG3 ARG A 56 12.894 -3.078 -0.089 1.00 0.00 H new ATOM 0 HD2 ARG A 56 15.819 -2.290 -0.116 1.00 0.00 H new ATOM 0 HD3 ARG A 56 15.224 -3.550 -1.180 1.00 0.00 H new ATOM 0 HE ARG A 56 13.476 -1.390 -1.593 1.00 0.00 H new ATOM 0 HH11 ARG A 56 16.972 -1.972 -1.911 1.00 0.00 H new ATOM 0 HH12 ARG A 56 17.149 -0.761 -3.185 1.00 0.00 H new ATOM 0 HH21 ARG A 56 13.820 0.165 -3.247 1.00 0.00 H new ATOM 0 HH22 ARG A 56 15.442 0.395 -3.907 1.00 0.00 H new ATOM 891 N ALA A 57 14.006 -4.220 3.876 1.00 0.00 N ATOM 892 CA ALA A 57 14.332 -5.569 4.365 1.00 0.00 C ATOM 893 C ALA A 57 13.177 -6.251 5.132 1.00 0.00 C ATOM 894 O ALA A 57 13.066 -7.478 5.109 1.00 0.00 O ATOM 895 CB ALA A 57 15.591 -5.458 5.235 1.00 0.00 C ATOM 0 H ALA A 57 14.661 -3.507 4.198 1.00 0.00 H new ATOM 0 HA ALA A 57 14.507 -6.214 3.504 1.00 0.00 H new ATOM 0 HB1 ALA A 57 15.860 -6.444 5.614 1.00 0.00 H new ATOM 0 HB2 ALA A 57 16.412 -5.063 4.637 1.00 0.00 H new ATOM 0 HB3 ALA A 57 15.397 -4.788 6.073 1.00 0.00 H new ATOM 901 N GLU A 58 12.298 -5.464 5.765 1.00 0.00 N ATOM 902 CA GLU A 58 11.094 -5.948 6.451 1.00 0.00 C ATOM 903 C GLU A 58 9.912 -6.033 5.475 1.00 0.00 C ATOM 904 O GLU A 58 9.235 -7.058 5.398 1.00 0.00 O ATOM 905 CB GLU A 58 10.726 -5.004 7.611 1.00 0.00 C ATOM 906 CG GLU A 58 11.916 -4.588 8.481 1.00 0.00 C ATOM 907 CD GLU A 58 12.613 -5.785 9.150 1.00 0.00 C ATOM 908 OE1 GLU A 58 11.973 -6.479 9.976 1.00 0.00 O ATOM 909 OE2 GLU A 58 13.810 -6.026 8.873 1.00 0.00 O ATOM 0 H GLU A 58 12.407 -4.451 5.815 1.00 0.00 H new ATOM 0 HA GLU A 58 11.305 -6.943 6.843 1.00 0.00 H new ATOM 0 HB2 GLU A 58 10.258 -4.108 7.202 1.00 0.00 H new ATOM 0 HB3 GLU A 58 9.983 -5.493 8.241 1.00 0.00 H new ATOM 0 HG2 GLU A 58 12.638 -4.050 7.867 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.573 -3.896 9.251 1.00 0.00 H new ATOM 916 N VAL A 59 9.671 -4.958 4.713 1.00 0.00 N ATOM 917 CA VAL A 59 8.493 -4.804 3.840 1.00 0.00 C ATOM 918 C VAL A 59 8.570 -5.710 2.596 1.00 0.00 C ATOM 919 O VAL A 59 7.534 -6.060 2.034 1.00 0.00 O ATOM 920 CB VAL A 59 8.254 -3.303 3.510 1.00 0.00 C ATOM 921 CG1 VAL A 59 7.132 -3.124 2.473 1.00 0.00 C ATOM 922 CG2 VAL A 59 7.888 -2.581 4.819 1.00 0.00 C ATOM 0 H VAL A 59 10.299 -4.155 4.683 1.00 0.00 H new ATOM 0 HA VAL A 59 7.612 -5.149 4.381 1.00 0.00 H new ATOM 0 HB VAL A 59 9.160 -2.880 3.077 1.00 0.00 H new ATOM 0 HG11 VAL A 59 6.993 -2.063 2.267 1.00 0.00 H new ATOM 0 HG12 VAL A 59 7.402 -3.640 1.552 1.00 0.00 H new ATOM 0 HG13 VAL A 59 6.205 -3.542 2.864 1.00 0.00 H new ATOM 0 HG21 VAL A 59 7.715 -1.524 4.616 1.00 0.00 H new ATOM 0 HG22 VAL A 59 6.984 -3.023 5.238 1.00 0.00 H new ATOM 0 HG23 VAL A 59 8.706 -2.684 5.532 1.00 0.00 H new ATOM 932 N MET A 60 9.760 -6.199 2.223 1.00 0.00 N ATOM 933 CA MET A 60 9.989 -7.090 1.060 1.00 0.00 C ATOM 934 C MET A 60 9.322 -8.480 1.131 1.00 0.00 C ATOM 935 O MET A 60 9.404 -9.259 0.182 1.00 0.00 O ATOM 936 CB MET A 60 11.502 -7.226 0.805 1.00 0.00 C ATOM 937 CG MET A 60 12.042 -6.070 -0.043 1.00 0.00 C ATOM 938 SD MET A 60 11.563 -6.161 -1.790 1.00 0.00 S ATOM 939 CE MET A 60 12.912 -5.209 -2.532 1.00 0.00 C ATOM 0 H MET A 60 10.618 -5.984 2.731 1.00 0.00 H new ATOM 0 HA MET A 60 9.491 -6.601 0.223 1.00 0.00 H new ATOM 0 HB2 MET A 60 12.030 -7.255 1.758 1.00 0.00 H new ATOM 0 HB3 MET A 60 11.702 -8.171 0.301 1.00 0.00 H new ATOM 0 HG2 MET A 60 11.685 -5.128 0.374 1.00 0.00 H new ATOM 0 HG3 MET A 60 13.130 -6.058 0.026 1.00 0.00 H new ATOM 0 HE1 MET A 60 12.804 -5.209 -3.617 1.00 0.00 H new ATOM 0 HE2 MET A 60 12.879 -4.184 -2.164 1.00 0.00 H new ATOM 0 HE3 MET A 60 13.867 -5.660 -2.263 1.00 0.00 H new ATOM 949 N GLN A 61 8.636 -8.793 2.232 1.00 0.00 N ATOM 950 CA GLN A 61 7.835 -10.020 2.401 1.00 0.00 C ATOM 951 C GLN A 61 6.434 -9.731 2.984 1.00 0.00 C ATOM 952 O GLN A 61 5.730 -10.640 3.421 1.00 0.00 O ATOM 953 CB GLN A 61 8.668 -11.039 3.213 1.00 0.00 C ATOM 954 CG GLN A 61 8.371 -12.519 2.889 1.00 0.00 C ATOM 955 CD GLN A 61 7.279 -13.171 3.746 1.00 0.00 C ATOM 956 OE1 GLN A 61 7.288 -13.120 4.972 1.00 0.00 O ATOM 957 NE2 GLN A 61 6.323 -13.856 3.146 1.00 0.00 N ATOM 0 H GLN A 61 8.618 -8.190 3.054 1.00 0.00 H new ATOM 0 HA GLN A 61 7.619 -10.464 1.429 1.00 0.00 H new ATOM 0 HB2 GLN A 61 9.726 -10.847 3.034 1.00 0.00 H new ATOM 0 HB3 GLN A 61 8.488 -10.871 4.275 1.00 0.00 H new ATOM 0 HG2 GLN A 61 8.080 -12.593 1.841 1.00 0.00 H new ATOM 0 HG3 GLN A 61 9.291 -13.091 3.006 1.00 0.00 H new ATOM 0 HE21 GLN A 61 6.297 -13.911 2.128 1.00 0.00 H new ATOM 0 HE22 GLN A 61 5.610 -14.330 3.701 1.00 0.00 H new ATOM 966 N ARG A 62 6.011 -8.460 2.968 1.00 0.00 N ATOM 967 CA ARG A 62 4.702 -7.991 3.444 1.00 0.00 C ATOM 968 C ARG A 62 3.712 -7.810 2.278 1.00 0.00 C ATOM 969 O ARG A 62 4.157 -7.568 1.146 1.00 0.00 O ATOM 970 CB ARG A 62 4.878 -6.660 4.201 1.00 0.00 C ATOM 971 CG ARG A 62 5.631 -6.783 5.536 1.00 0.00 C ATOM 972 CD ARG A 62 4.892 -7.601 6.602 1.00 0.00 C ATOM 973 NE ARG A 62 5.653 -7.623 7.864 1.00 0.00 N ATOM 974 CZ ARG A 62 5.249 -8.128 9.026 1.00 0.00 C ATOM 975 NH1 ARG A 62 4.064 -8.686 9.175 1.00 0.00 N ATOM 976 NH2 ARG A 62 6.047 -8.081 10.071 1.00 0.00 N ATOM 0 H ARG A 62 6.592 -7.702 2.610 1.00 0.00 H new ATOM 0 HA ARG A 62 4.290 -8.744 4.115 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.413 -5.959 3.560 1.00 0.00 H new ATOM 0 HB3 ARG A 62 3.894 -6.231 4.391 1.00 0.00 H new ATOM 0 HG2 ARG A 62 6.603 -7.241 5.351 1.00 0.00 H new ATOM 0 HG3 ARG A 62 5.819 -5.783 5.927 1.00 0.00 H new ATOM 0 HD2 ARG A 62 3.904 -7.174 6.775 1.00 0.00 H new ATOM 0 HD3 ARG A 62 4.741 -8.620 6.245 1.00 0.00 H new ATOM 0 HE ARG A 62 6.585 -7.209 7.844 1.00 0.00 H new ATOM 0 HH11 ARG A 62 3.423 -8.741 8.384 1.00 0.00 H new ATOM 0 HH12 ARG A 62 3.788 -9.063 10.082 1.00 0.00 H new ATOM 0 HH21 ARG A 62 6.972 -7.658 9.988 1.00 0.00 H new ATOM 0 HH22 ARG A 62 5.741 -8.467 10.964 1.00 0.00 H new ATOM 990 N PRO A 63 2.389 -7.882 2.541 1.00 0.00 N ATOM 991 CA PRO A 63 1.361 -7.572 1.555 1.00 0.00 C ATOM 992 C PRO A 63 1.309 -6.061 1.302 1.00 0.00 C ATOM 993 O PRO A 63 1.431 -5.264 2.232 1.00 0.00 O ATOM 994 CB PRO A 63 0.049 -8.097 2.146 1.00 0.00 C ATOM 995 CG PRO A 63 0.260 -7.997 3.652 1.00 0.00 C ATOM 996 CD PRO A 63 1.764 -8.238 3.817 1.00 0.00 C ATOM 0 HA PRO A 63 1.561 -8.035 0.589 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -0.803 -7.499 1.821 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -0.146 -9.124 1.837 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -0.035 -7.020 4.035 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -0.328 -8.741 4.190 1.00 0.00 H new ATOM 0 HD2 PRO A 63 2.167 -7.631 4.628 1.00 0.00 H new ATOM 0 HD3 PRO A 63 1.964 -9.280 4.069 1.00 0.00 H new ATOM 1004 N CYS A 64 1.087 -5.661 0.046 1.00 0.00 N ATOM 1005 CA CYS A 64 1.053 -4.249 -0.372 1.00 0.00 C ATOM 1006 C CYS A 64 -0.119 -3.434 0.216 1.00 0.00 C ATOM 1007 O CYS A 64 -0.143 -2.206 0.099 1.00 0.00 O ATOM 1008 CB CYS A 64 1.017 -4.237 -1.902 1.00 0.00 C ATOM 1009 SG CYS A 64 1.731 -2.696 -2.524 1.00 0.00 S ATOM 0 H CYS A 64 0.924 -6.313 -0.721 1.00 0.00 H new ATOM 0 HA CYS A 64 1.942 -3.754 0.020 1.00 0.00 H new ATOM 0 HB2 CYS A 64 1.572 -5.089 -2.294 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -0.011 -4.338 -2.251 1.00 0.00 H new ATOM 0 HG CYS A 64 1.893 -2.781 -3.811 1.00 0.00 H new ATOM 1015 N THR A 65 -1.088 -4.118 0.838 1.00 0.00 N ATOM 1016 CA THR A 65 -2.190 -3.522 1.609 1.00 0.00 C ATOM 1017 C THR A 65 -1.704 -2.871 2.903 1.00 0.00 C ATOM 1018 O THR A 65 -2.367 -1.955 3.391 1.00 0.00 O ATOM 1019 CB THR A 65 -3.239 -4.585 1.953 1.00 0.00 C ATOM 1020 OG1 THR A 65 -2.582 -5.660 2.591 1.00 0.00 O ATOM 1021 CG2 THR A 65 -3.952 -5.118 0.708 1.00 0.00 C ATOM 0 H THR A 65 -1.129 -5.137 0.818 1.00 0.00 H new ATOM 0 HA THR A 65 -2.630 -2.748 0.980 1.00 0.00 H new ATOM 0 HB THR A 65 -3.990 -4.128 2.597 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.236 -6.352 2.822 1.00 0.00 H new ATOM 0 HG21 THR A 65 -4.686 -5.868 1.002 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.457 -4.297 0.198 1.00 0.00 H new ATOM 0 HG23 THR A 65 -3.222 -5.568 0.035 1.00 0.00 H new ATOM 1029 N CYS A 66 -0.566 -3.332 3.446 1.00 0.00 N ATOM 1030 CA CYS A 66 0.028 -2.864 4.704 1.00 0.00 C ATOM 1031 C CYS A 66 -0.975 -2.864 5.884 1.00 0.00 C ATOM 1032 O CYS A 66 -1.012 -1.934 6.692 1.00 0.00 O ATOM 1033 CB CYS A 66 0.736 -1.519 4.466 1.00 0.00 C ATOM 1034 SG CYS A 66 2.053 -1.692 3.221 1.00 0.00 S ATOM 0 H CYS A 66 -0.016 -4.068 3.003 1.00 0.00 H new ATOM 0 HA CYS A 66 0.788 -3.577 5.025 1.00 0.00 H new ATOM 0 HB2 CYS A 66 0.011 -0.775 4.134 1.00 0.00 H new ATOM 0 HB3 CYS A 66 1.160 -1.156 5.402 1.00 0.00 H new ATOM 0 HG CYS A 66 2.631 -0.542 3.039 1.00 0.00 H new ATOM 1040 N ASP A 67 -1.779 -3.930 5.997 1.00 0.00 N ATOM 1041 CA ASP A 67 -2.854 -4.088 6.992 1.00 0.00 C ATOM 1042 C ASP A 67 -2.357 -3.945 8.441 1.00 0.00 C ATOM 1043 O ASP A 67 -3.063 -3.427 9.306 1.00 0.00 O ATOM 1044 CB ASP A 67 -3.500 -5.465 6.772 1.00 0.00 C ATOM 1045 CG ASP A 67 -4.606 -5.776 7.795 1.00 0.00 C ATOM 1046 OD1 ASP A 67 -5.765 -5.343 7.589 1.00 0.00 O ATOM 1047 OD2 ASP A 67 -4.323 -6.498 8.782 1.00 0.00 O ATOM 0 H ASP A 67 -1.698 -4.736 5.377 1.00 0.00 H new ATOM 0 HA ASP A 67 -3.581 -3.288 6.850 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -3.919 -5.508 5.767 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -2.731 -6.235 6.830 1.00 0.00 H new ATOM 1052 N PHE A 68 -1.109 -4.347 8.694 1.00 0.00 N ATOM 1053 CA PHE A 68 -0.453 -4.239 9.994 1.00 0.00 C ATOM 1054 C PHE A 68 -0.229 -2.782 10.465 1.00 0.00 C ATOM 1055 O PHE A 68 0.011 -2.564 11.654 1.00 0.00 O ATOM 1056 CB PHE A 68 0.858 -5.039 9.946 1.00 0.00 C ATOM 1057 CG PHE A 68 1.830 -4.554 8.888 1.00 0.00 C ATOM 1058 CD1 PHE A 68 2.726 -3.513 9.187 1.00 0.00 C ATOM 1059 CD2 PHE A 68 1.797 -5.098 7.589 1.00 0.00 C ATOM 1060 CE1 PHE A 68 3.580 -3.015 8.190 1.00 0.00 C ATOM 1061 CE2 PHE A 68 2.645 -4.589 6.593 1.00 0.00 C ATOM 1062 CZ PHE A 68 3.543 -3.551 6.892 1.00 0.00 C ATOM 0 H PHE A 68 -0.514 -4.767 7.980 1.00 0.00 H new ATOM 0 HA PHE A 68 -1.121 -4.661 10.745 1.00 0.00 H new ATOM 0 HB2 PHE A 68 1.341 -4.987 10.922 1.00 0.00 H new ATOM 0 HB3 PHE A 68 0.627 -6.088 9.761 1.00 0.00 H new ATOM 0 HD1 PHE A 68 2.757 -3.097 10.183 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.119 -5.907 7.359 1.00 0.00 H new ATOM 0 HE1 PHE A 68 4.269 -2.216 8.422 1.00 0.00 H new ATOM 0 HE2 PHE A 68 2.607 -4.997 5.594 1.00 0.00 H new ATOM 0 HZ PHE A 68 4.202 -3.167 6.127 1.00 0.00 H new ATOM 1072 N LEU A 69 -0.337 -1.784 9.571 1.00 0.00 N ATOM 1073 CA LEU A 69 -0.314 -0.354 9.920 1.00 0.00 C ATOM 1074 C LEU A 69 -1.668 0.161 10.435 1.00 0.00 C ATOM 1075 O LEU A 69 -1.744 1.290 10.914 1.00 0.00 O ATOM 1076 CB LEU A 69 0.108 0.490 8.698 1.00 0.00 C ATOM 1077 CG LEU A 69 1.492 0.181 8.098 1.00 0.00 C ATOM 1078 CD1 LEU A 69 1.708 1.105 6.891 1.00 0.00 C ATOM 1079 CD2 LEU A 69 2.628 0.389 9.110 1.00 0.00 C ATOM 0 H LEU A 69 -0.444 -1.951 8.571 1.00 0.00 H new ATOM 0 HA LEU A 69 0.411 -0.250 10.727 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.640 0.358 7.917 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.087 1.541 8.985 1.00 0.00 H new ATOM 0 HG LEU A 69 1.513 -0.868 7.804 1.00 0.00 H new ATOM 0 HD11 LEU A 69 2.684 0.904 6.449 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.929 0.924 6.150 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.664 2.144 7.216 1.00 0.00 H new ATOM 0 HD21 LEU A 69 3.583 0.158 8.638 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.631 1.426 9.446 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.478 -0.269 9.966 1.00 0.00 H new ATOM 1091 N HIS A 70 -2.750 -0.609 10.313 1.00 0.00 N ATOM 1092 CA HIS A 70 -4.082 -0.191 10.735 1.00 0.00 C ATOM 1093 C HIS A 70 -4.216 -0.282 12.272 1.00 0.00 C ATOM 1094 O HIS A 70 -4.083 -1.362 12.862 1.00 0.00 O ATOM 1095 CB HIS A 70 -5.135 -1.046 10.007 1.00 0.00 C ATOM 1096 CG HIS A 70 -5.076 -1.033 8.489 1.00 0.00 C ATOM 1097 ND1 HIS A 70 -4.207 -0.333 7.673 1.00 0.00 N ATOM 1098 CD2 HIS A 70 -5.903 -1.741 7.658 1.00 0.00 C ATOM 1099 CE1 HIS A 70 -4.503 -0.624 6.393 1.00 0.00 C ATOM 1100 NE2 HIS A 70 -5.543 -1.473 6.329 1.00 0.00 N ATOM 0 H HIS A 70 -2.723 -1.548 9.915 1.00 0.00 H new ATOM 0 HA HIS A 70 -4.247 0.852 10.466 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -5.032 -2.077 10.345 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -6.124 -0.707 10.314 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -6.701 -2.397 7.974 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -3.978 -0.230 5.536 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -5.981 -1.846 5.487 1.00 0.00 H new ATOM 1108 N GLY A 71 -4.487 0.857 12.920 1.00 0.00 N ATOM 1109 CA GLY A 71 -4.742 0.983 14.360 1.00 0.00 C ATOM 1110 C GLY A 71 -6.245 1.025 14.687 1.00 0.00 C ATOM 1111 O GLY A 71 -7.071 0.760 13.807 1.00 0.00 O ATOM 0 H GLY A 71 -4.537 1.753 12.435 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -4.282 0.144 14.883 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -4.266 1.890 14.733 1.00 0.00 H new ATOM 1115 N PRO A 72 -6.627 1.397 15.926 1.00 0.00 N ATOM 1116 CA PRO A 72 -8.030 1.522 16.325 1.00 0.00 C ATOM 1117 C PRO A 72 -8.751 2.691 15.628 1.00 0.00 C ATOM 1118 O PRO A 72 -9.966 2.626 15.447 1.00 0.00 O ATOM 1119 CB PRO A 72 -7.999 1.695 17.849 1.00 0.00 C ATOM 1120 CG PRO A 72 -6.640 2.341 18.114 1.00 0.00 C ATOM 1121 CD PRO A 72 -5.746 1.710 17.046 1.00 0.00 C ATOM 0 HA PRO A 72 -8.601 0.643 16.025 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -8.817 2.326 18.197 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -8.094 0.738 18.362 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -6.683 3.426 18.016 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -6.280 2.126 19.120 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -4.956 2.396 16.742 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -5.260 0.811 17.424 1.00 0.00 H new ATOM 1129 N ARG A 73 -8.016 3.733 15.199 1.00 0.00 N ATOM 1130 CA ARG A 73 -8.572 4.900 14.492 1.00 0.00 C ATOM 1131 C ARG A 73 -8.648 4.695 12.966 1.00 0.00 C ATOM 1132 O ARG A 73 -9.183 5.550 12.256 1.00 0.00 O ATOM 1133 CB ARG A 73 -7.764 6.157 14.901 1.00 0.00 C ATOM 1134 CG ARG A 73 -8.578 7.466 14.851 1.00 0.00 C ATOM 1135 CD ARG A 73 -8.312 8.357 13.629 1.00 0.00 C ATOM 1136 NE ARG A 73 -9.291 9.462 13.595 1.00 0.00 N ATOM 1137 CZ ARG A 73 -9.996 9.896 12.556 1.00 0.00 C ATOM 1138 NH1 ARG A 73 -9.802 9.445 11.334 1.00 0.00 N ATOM 1139 NH2 ARG A 73 -10.921 10.811 12.738 1.00 0.00 N ATOM 0 H ARG A 73 -7.007 3.788 15.336 1.00 0.00 H new ATOM 0 HA ARG A 73 -9.610 5.039 14.793 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -7.380 6.017 15.912 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -6.901 6.252 14.243 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -9.639 7.216 14.874 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -8.366 8.041 15.752 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -7.299 8.757 13.672 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -8.383 7.767 12.715 1.00 0.00 H new ATOM 0 HE ARG A 73 -9.445 9.952 14.477 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -9.089 8.737 11.159 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -10.365 9.804 10.563 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -11.094 11.183 13.672 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -11.467 11.149 11.945 1.00 0.00 H new ATOM 1153 N THR A 74 -8.126 3.581 12.431 1.00 0.00 N ATOM 1154 CA THR A 74 -8.157 3.268 10.991 1.00 0.00 C ATOM 1155 C THR A 74 -9.585 2.939 10.560 1.00 0.00 C ATOM 1156 O THR A 74 -10.292 2.210 11.252 1.00 0.00 O ATOM 1157 CB THR A 74 -7.154 2.160 10.646 1.00 0.00 C ATOM 1158 OG1 THR A 74 -5.889 2.595 11.081 1.00 0.00 O ATOM 1159 CG2 THR A 74 -7.079 1.937 9.142 1.00 0.00 C ATOM 0 H THR A 74 -7.665 2.863 12.990 1.00 0.00 H new ATOM 0 HA THR A 74 -7.843 4.144 10.424 1.00 0.00 H new ATOM 0 HB THR A 74 -7.464 1.230 11.123 1.00 0.00 H new ATOM 0 HG1 THR A 74 -5.447 3.089 10.359 1.00 0.00 H new ATOM 0 HG21 THR A 74 -6.360 1.146 8.927 1.00 0.00 H new ATOM 0 HG22 THR A 74 -8.061 1.647 8.768 1.00 0.00 H new ATOM 0 HG23 THR A 74 -6.762 2.858 8.653 1.00 0.00 H new ATOM 1167 N GLN A 75 -10.027 3.524 9.443 1.00 0.00 N ATOM 1168 CA GLN A 75 -11.422 3.464 8.992 1.00 0.00 C ATOM 1169 C GLN A 75 -11.657 2.122 8.280 1.00 0.00 C ATOM 1170 O GLN A 75 -10.975 1.822 7.299 1.00 0.00 O ATOM 1171 CB GLN A 75 -11.746 4.644 8.051 1.00 0.00 C ATOM 1172 CG GLN A 75 -11.355 6.043 8.560 1.00 0.00 C ATOM 1173 CD GLN A 75 -12.143 6.529 9.777 1.00 0.00 C ATOM 1174 OE1 GLN A 75 -13.298 6.928 9.685 1.00 0.00 O ATOM 1175 NE2 GLN A 75 -11.552 6.542 10.954 1.00 0.00 N ATOM 0 H GLN A 75 -9.421 4.058 8.820 1.00 0.00 H new ATOM 0 HA GLN A 75 -12.084 3.540 9.854 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -11.243 4.472 7.099 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -12.817 4.639 7.851 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -10.294 6.039 8.810 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -11.489 6.759 7.749 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -10.591 6.213 11.046 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -12.055 6.881 11.774 1.00 0.00 H new ATOM 1184 N ARG A 76 -12.628 1.319 8.735 1.00 0.00 N ATOM 1185 CA ARG A 76 -12.825 -0.054 8.231 1.00 0.00 C ATOM 1186 C ARG A 76 -13.226 -0.085 6.745 1.00 0.00 C ATOM 1187 O ARG A 76 -12.786 -0.967 6.004 1.00 0.00 O ATOM 1188 CB ARG A 76 -13.847 -0.805 9.109 1.00 0.00 C ATOM 1189 CG ARG A 76 -13.248 -1.380 10.410 1.00 0.00 C ATOM 1190 CD ARG A 76 -12.711 -0.361 11.427 1.00 0.00 C ATOM 1191 NE ARG A 76 -13.783 0.500 11.963 1.00 0.00 N ATOM 1192 CZ ARG A 76 -13.630 1.518 12.807 1.00 0.00 C ATOM 1193 NH1 ARG A 76 -12.446 2.002 13.117 1.00 0.00 N ATOM 1194 NH2 ARG A 76 -14.689 2.070 13.357 1.00 0.00 N ATOM 0 H ARG A 76 -13.295 1.595 9.456 1.00 0.00 H new ATOM 0 HA ARG A 76 -11.866 -0.568 8.297 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -14.661 -0.126 9.364 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -14.281 -1.619 8.529 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -14.013 -1.981 10.901 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -12.435 -2.055 10.142 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -12.225 -0.889 12.248 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -11.951 0.259 10.952 1.00 0.00 H new ATOM 0 HE ARG A 76 -14.734 0.295 11.657 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -11.605 1.596 12.706 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -12.369 2.783 13.768 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -15.620 1.718 13.136 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -14.579 2.850 14.005 1.00 0.00 H new ATOM 1208 N ARG A 77 -13.973 0.928 6.280 1.00 0.00 N ATOM 1209 CA ARG A 77 -14.270 1.155 4.853 1.00 0.00 C ATOM 1210 C ARG A 77 -12.988 1.404 4.046 1.00 0.00 C ATOM 1211 O ARG A 77 -12.763 0.762 3.027 1.00 0.00 O ATOM 1212 CB ARG A 77 -15.265 2.327 4.729 1.00 0.00 C ATOM 1213 CG ARG A 77 -15.702 2.665 3.288 1.00 0.00 C ATOM 1214 CD ARG A 77 -16.381 1.521 2.521 1.00 0.00 C ATOM 1215 NE ARG A 77 -17.650 1.118 3.156 1.00 0.00 N ATOM 1216 CZ ARG A 77 -18.382 0.047 2.865 1.00 0.00 C ATOM 1217 NH1 ARG A 77 -18.029 -0.810 1.927 1.00 0.00 N ATOM 1218 NH2 ARG A 77 -19.499 -0.177 3.522 1.00 0.00 N ATOM 0 H ARG A 77 -14.396 1.625 6.893 1.00 0.00 H new ATOM 0 HA ARG A 77 -14.726 0.259 4.432 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -16.153 2.093 5.316 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -14.814 3.215 5.173 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -16.386 3.513 3.323 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -14.825 2.986 2.726 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -16.571 1.833 1.494 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -15.709 0.664 2.475 1.00 0.00 H new ATOM 0 HE ARG A 77 -18.003 1.725 3.896 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -17.170 -0.662 1.398 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -18.615 -1.621 1.731 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -19.800 0.470 4.251 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -20.064 -0.997 3.302 1.00 0.00 H new ATOM 1232 N ALA A 78 -12.107 2.287 4.514 1.00 0.00 N ATOM 1233 CA ALA A 78 -10.871 2.637 3.803 1.00 0.00 C ATOM 1234 C ALA A 78 -9.857 1.481 3.758 1.00 0.00 C ATOM 1235 O ALA A 78 -9.269 1.219 2.711 1.00 0.00 O ATOM 1236 CB ALA A 78 -10.295 3.888 4.458 1.00 0.00 C ATOM 0 H ALA A 78 -12.227 2.782 5.398 1.00 0.00 H new ATOM 0 HA ALA A 78 -11.102 2.838 2.757 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.374 4.173 3.950 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -11.016 4.702 4.385 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -10.083 3.684 5.508 1.00 0.00 H new ATOM 1242 N ALA A 79 -9.718 0.726 4.850 1.00 0.00 N ATOM 1243 CA ALA A 79 -8.924 -0.508 4.879 1.00 0.00 C ATOM 1244 C ALA A 79 -9.358 -1.517 3.793 1.00 0.00 C ATOM 1245 O ALA A 79 -8.515 -2.149 3.154 1.00 0.00 O ATOM 1246 CB ALA A 79 -9.038 -1.088 6.291 1.00 0.00 C ATOM 0 H ALA A 79 -10.154 0.953 5.744 1.00 0.00 H new ATOM 0 HA ALA A 79 -7.882 -0.286 4.647 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -8.459 -2.010 6.354 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -8.652 -0.368 7.012 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -10.084 -1.300 6.514 1.00 0.00 H new ATOM 1252 N ALA A 80 -10.667 -1.607 3.524 1.00 0.00 N ATOM 1253 CA ALA A 80 -11.228 -2.403 2.430 1.00 0.00 C ATOM 1254 C ALA A 80 -10.971 -1.785 1.054 1.00 0.00 C ATOM 1255 O ALA A 80 -10.638 -2.512 0.125 1.00 0.00 O ATOM 1256 CB ALA A 80 -12.735 -2.546 2.655 1.00 0.00 C ATOM 0 H ALA A 80 -11.376 -1.119 4.071 1.00 0.00 H new ATOM 0 HA ALA A 80 -10.734 -3.375 2.436 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -13.169 -3.137 1.848 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -12.915 -3.045 3.607 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -13.196 -1.558 2.670 1.00 0.00 H new ATOM 1262 N GLN A 81 -11.100 -0.461 0.908 1.00 0.00 N ATOM 1263 CA GLN A 81 -10.867 0.235 -0.366 1.00 0.00 C ATOM 1264 C GLN A 81 -9.467 -0.038 -0.924 1.00 0.00 C ATOM 1265 O GLN A 81 -9.346 -0.168 -2.134 1.00 0.00 O ATOM 1266 CB GLN A 81 -11.072 1.749 -0.204 1.00 0.00 C ATOM 1267 CG GLN A 81 -12.534 2.179 -0.067 1.00 0.00 C ATOM 1268 CD GLN A 81 -12.695 3.683 0.159 1.00 0.00 C ATOM 1269 OE1 GLN A 81 -12.819 4.159 1.279 1.00 0.00 O ATOM 1270 NE2 GLN A 81 -12.691 4.493 -0.880 1.00 0.00 N ATOM 0 H GLN A 81 -11.369 0.160 1.671 1.00 0.00 H new ATOM 0 HA GLN A 81 -11.595 -0.156 -1.077 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -10.523 2.085 0.676 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -10.636 2.256 -1.065 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -13.077 1.892 -0.967 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -12.989 1.641 0.765 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -12.589 4.114 -1.822 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -12.790 5.499 -0.743 1.00 0.00 H new ATOM 1279 N ILE A 82 -8.428 -0.197 -0.091 1.00 0.00 N ATOM 1280 CA ILE A 82 -7.091 -0.611 -0.572 1.00 0.00 C ATOM 1281 C ILE A 82 -7.155 -2.002 -1.221 1.00 0.00 C ATOM 1282 O ILE A 82 -6.691 -2.178 -2.345 1.00 0.00 O ATOM 1283 CB ILE A 82 -6.039 -0.576 0.564 1.00 0.00 C ATOM 1284 CG1 ILE A 82 -5.928 0.825 1.199 1.00 0.00 C ATOM 1285 CG2 ILE A 82 -4.663 -0.983 -0.002 1.00 0.00 C ATOM 1286 CD1 ILE A 82 -5.092 0.844 2.479 1.00 0.00 C ATOM 0 H ILE A 82 -8.482 -0.047 0.916 1.00 0.00 H new ATOM 0 HA ILE A 82 -6.775 0.107 -1.329 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.359 -1.274 1.337 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.487 1.511 0.475 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -6.929 1.196 1.421 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -3.920 -0.959 0.795 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -4.722 -1.991 -0.413 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -4.373 -0.287 -0.789 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -5.054 1.859 2.874 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -5.544 0.183 3.219 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -4.081 0.503 2.258 1.00 0.00 H new ATOM 1298 N ALA A 83 -7.752 -2.984 -0.537 1.00 0.00 N ATOM 1299 CA ALA A 83 -7.864 -4.364 -1.020 1.00 0.00 C ATOM 1300 C ALA A 83 -8.782 -4.489 -2.252 1.00 0.00 C ATOM 1301 O ALA A 83 -8.491 -5.258 -3.169 1.00 0.00 O ATOM 1302 CB ALA A 83 -8.350 -5.236 0.146 1.00 0.00 C ATOM 0 H ALA A 83 -8.176 -2.841 0.379 1.00 0.00 H new ATOM 0 HA ALA A 83 -6.886 -4.706 -1.359 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -8.442 -6.270 -0.187 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -7.633 -5.181 0.965 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -9.321 -4.877 0.489 1.00 0.00 H new ATOM 1308 N GLN A 84 -9.868 -3.711 -2.297 1.00 0.00 N ATOM 1309 CA GLN A 84 -10.788 -3.642 -3.435 1.00 0.00 C ATOM 1310 C GLN A 84 -10.168 -2.895 -4.624 1.00 0.00 C ATOM 1311 O GLN A 84 -10.452 -3.249 -5.766 1.00 0.00 O ATOM 1312 CB GLN A 84 -12.106 -2.965 -3.011 1.00 0.00 C ATOM 1313 CG GLN A 84 -12.941 -3.755 -1.985 1.00 0.00 C ATOM 1314 CD GLN A 84 -13.426 -5.108 -2.515 1.00 0.00 C ATOM 1315 OE1 GLN A 84 -14.290 -5.196 -3.379 1.00 0.00 O ATOM 1316 NE2 GLN A 84 -12.885 -6.211 -2.034 1.00 0.00 N ATOM 0 H GLN A 84 -10.137 -3.099 -1.527 1.00 0.00 H new ATOM 0 HA GLN A 84 -10.993 -4.663 -3.757 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -11.876 -1.985 -2.593 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -12.714 -2.797 -3.900 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -12.344 -3.917 -1.088 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -13.804 -3.157 -1.691 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -12.164 -6.154 -1.314 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -13.187 -7.121 -2.382 1.00 0.00 H new ATOM 1325 N ALA A 85 -9.292 -1.905 -4.400 1.00 0.00 N ATOM 1326 CA ALA A 85 -8.651 -1.157 -5.482 1.00 0.00 C ATOM 1327 C ALA A 85 -7.768 -2.053 -6.378 1.00 0.00 C ATOM 1328 O ALA A 85 -7.652 -1.802 -7.578 1.00 0.00 O ATOM 1329 CB ALA A 85 -7.836 -0.005 -4.907 1.00 0.00 C ATOM 0 H ALA A 85 -9.011 -1.604 -3.467 1.00 0.00 H new ATOM 0 HA ALA A 85 -9.443 -0.760 -6.117 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -7.362 0.546 -5.719 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -8.493 0.663 -4.350 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -7.069 -0.399 -4.240 1.00 0.00 H new ATOM 1335 N LEU A 86 -7.189 -3.125 -5.811 1.00 0.00 N ATOM 1336 CA LEU A 86 -6.399 -4.137 -6.533 1.00 0.00 C ATOM 1337 C LEU A 86 -7.239 -4.955 -7.535 1.00 0.00 C ATOM 1338 O LEU A 86 -6.680 -5.600 -8.422 1.00 0.00 O ATOM 1339 CB LEU A 86 -5.714 -5.088 -5.525 1.00 0.00 C ATOM 1340 CG LEU A 86 -4.857 -4.431 -4.422 1.00 0.00 C ATOM 1341 CD1 LEU A 86 -4.315 -5.516 -3.484 1.00 0.00 C ATOM 1342 CD2 LEU A 86 -3.699 -3.593 -4.975 1.00 0.00 C ATOM 0 H LEU A 86 -7.259 -3.317 -4.812 1.00 0.00 H new ATOM 0 HA LEU A 86 -5.649 -3.598 -7.112 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -6.487 -5.687 -5.043 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -5.080 -5.776 -6.084 1.00 0.00 H new ATOM 0 HG LEU A 86 -5.506 -3.744 -3.879 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.709 -5.054 -2.704 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -5.148 -6.051 -3.027 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.702 -6.215 -4.053 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -3.137 -3.159 -4.148 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -3.041 -4.228 -5.568 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -4.095 -2.795 -5.603 1.00 0.00 H new ATOM 1354 N LEU A 87 -8.574 -4.935 -7.426 1.00 0.00 N ATOM 1355 CA LEU A 87 -9.482 -5.563 -8.399 1.00 0.00 C ATOM 1356 C LEU A 87 -9.706 -4.687 -9.649 1.00 0.00 C ATOM 1357 O LEU A 87 -10.219 -5.181 -10.657 1.00 0.00 O ATOM 1358 CB LEU A 87 -10.824 -5.900 -7.716 1.00 0.00 C ATOM 1359 CG LEU A 87 -10.724 -6.734 -6.420 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -12.131 -6.954 -5.848 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -10.043 -8.091 -6.652 1.00 0.00 C ATOM 0 H LEU A 87 -9.060 -4.479 -6.654 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.011 -6.482 -8.747 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -11.339 -4.967 -7.487 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -11.447 -6.441 -8.428 1.00 0.00 H new ATOM 0 HG LEU A 87 -10.108 -6.177 -5.714 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -12.064 -7.543 -4.933 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -12.589 -5.990 -5.627 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -12.741 -7.486 -6.578 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -9.996 -8.640 -5.712 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -10.616 -8.666 -7.380 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -9.033 -7.931 -7.029 1.00 0.00 H new ATOM 1373 N GLY A 88 -9.329 -3.401 -9.599 1.00 0.00 N ATOM 1374 CA GLY A 88 -9.490 -2.430 -10.688 1.00 0.00 C ATOM 1375 C GLY A 88 -8.290 -2.385 -11.640 1.00 0.00 C ATOM 1376 O GLY A 88 -7.138 -2.514 -11.223 1.00 0.00 O ATOM 0 H GLY A 88 -8.890 -2.996 -8.772 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -10.387 -2.677 -11.256 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -9.645 -1.439 -10.262 1.00 0.00 H new ATOM 1380 N ALA A 89 -8.567 -2.142 -12.925 1.00 0.00 N ATOM 1381 CA ALA A 89 -7.563 -1.975 -13.987 1.00 0.00 C ATOM 1382 C ALA A 89 -7.100 -0.515 -14.188 1.00 0.00 C ATOM 1383 O ALA A 89 -6.236 -0.251 -15.027 1.00 0.00 O ATOM 1384 CB ALA A 89 -8.170 -2.536 -15.277 1.00 0.00 C ATOM 0 H ALA A 89 -9.524 -2.053 -13.268 1.00 0.00 H new ATOM 0 HA ALA A 89 -6.661 -2.514 -13.697 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -7.454 -2.431 -16.092 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -8.409 -3.590 -15.138 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -9.080 -1.987 -15.520 1.00 0.00 H new ATOM 1390 N GLU A 90 -7.683 0.427 -13.441 1.00 0.00 N ATOM 1391 CA GLU A 90 -7.433 1.871 -13.507 1.00 0.00 C ATOM 1392 C GLU A 90 -7.048 2.429 -12.121 1.00 0.00 C ATOM 1393 O GLU A 90 -7.240 1.773 -11.093 1.00 0.00 O ATOM 1394 CB GLU A 90 -8.691 2.569 -14.056 1.00 0.00 C ATOM 1395 CG GLU A 90 -8.912 2.284 -15.547 1.00 0.00 C ATOM 1396 CD GLU A 90 -10.137 3.043 -16.074 1.00 0.00 C ATOM 1397 OE1 GLU A 90 -9.987 4.197 -16.543 1.00 0.00 O ATOM 1398 OE2 GLU A 90 -11.264 2.493 -16.030 1.00 0.00 O ATOM 0 H GLU A 90 -8.380 0.190 -12.735 1.00 0.00 H new ATOM 0 HA GLU A 90 -6.593 2.064 -14.175 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -9.563 2.238 -13.492 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -8.603 3.645 -13.903 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -8.027 2.576 -16.112 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -9.049 1.214 -15.700 1.00 0.00 H new ATOM 1405 N GLU A 91 -6.478 3.640 -12.093 1.00 0.00 N ATOM 1406 CA GLU A 91 -5.965 4.290 -10.876 1.00 0.00 C ATOM 1407 C GLU A 91 -7.062 4.552 -9.829 1.00 0.00 C ATOM 1408 O GLU A 91 -8.214 4.849 -10.161 1.00 0.00 O ATOM 1409 CB GLU A 91 -5.270 5.617 -11.230 1.00 0.00 C ATOM 1410 CG GLU A 91 -4.024 5.452 -12.108 1.00 0.00 C ATOM 1411 CD GLU A 91 -3.491 6.820 -12.564 1.00 0.00 C ATOM 1412 OE1 GLU A 91 -2.887 7.551 -11.745 1.00 0.00 O ATOM 1413 OE2 GLU A 91 -3.678 7.178 -13.753 1.00 0.00 O ATOM 0 H GLU A 91 -6.357 4.208 -12.931 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.249 3.597 -10.434 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -5.982 6.262 -11.745 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -4.988 6.125 -10.308 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -3.250 4.922 -11.553 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.266 4.842 -12.979 1.00 0.00 H new ATOM 1420 N ARG A 92 -6.672 4.464 -8.549 1.00 0.00 N ATOM 1421 CA ARG A 92 -7.583 4.482 -7.396 1.00 0.00 C ATOM 1422 C ARG A 92 -6.888 5.079 -6.174 1.00 0.00 C ATOM 1423 O ARG A 92 -5.827 4.594 -5.777 1.00 0.00 O ATOM 1424 CB ARG A 92 -8.026 3.028 -7.119 1.00 0.00 C ATOM 1425 CG ARG A 92 -9.478 2.860 -6.639 1.00 0.00 C ATOM 1426 CD ARG A 92 -9.777 3.449 -5.255 1.00 0.00 C ATOM 1427 NE ARG A 92 -11.064 2.933 -4.744 1.00 0.00 N ATOM 1428 CZ ARG A 92 -12.257 3.518 -4.817 1.00 0.00 C ATOM 1429 NH1 ARG A 92 -12.423 4.727 -5.310 1.00 0.00 N ATOM 1430 NH2 ARG A 92 -13.321 2.881 -4.379 1.00 0.00 N ATOM 0 H ARG A 92 -5.692 4.376 -8.281 1.00 0.00 H new ATOM 0 HA ARG A 92 -8.453 5.103 -7.611 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -7.893 2.446 -8.031 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -7.361 2.601 -6.368 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -10.141 3.327 -7.367 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -9.719 1.797 -6.624 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -8.975 3.194 -4.563 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -9.812 4.537 -5.315 1.00 0.00 H new ATOM 0 HE ARG A 92 -11.035 2.024 -4.282 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -11.619 5.252 -5.654 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -13.355 5.139 -5.348 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -13.229 1.944 -3.986 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -14.238 3.324 -4.432 1.00 0.00 H new ATOM 1444 N LYS A 93 -7.489 6.085 -5.534 1.00 0.00 N ATOM 1445 CA LYS A 93 -7.016 6.649 -4.267 1.00 0.00 C ATOM 1446 C LYS A 93 -7.979 6.366 -3.102 1.00 0.00 C ATOM 1447 O LYS A 93 -9.197 6.413 -3.261 1.00 0.00 O ATOM 1448 CB LYS A 93 -6.765 8.161 -4.406 1.00 0.00 C ATOM 1449 CG LYS A 93 -6.068 8.536 -5.706 1.00 0.00 C ATOM 1450 CD LYS A 93 -5.470 9.942 -5.576 1.00 0.00 C ATOM 1451 CE LYS A 93 -4.227 9.897 -6.437 1.00 0.00 C ATOM 1452 NZ LYS A 93 -3.432 11.155 -6.383 1.00 0.00 N ATOM 0 H LYS A 93 -8.332 6.538 -5.887 1.00 0.00 H new ATOM 0 HA LYS A 93 -6.074 6.154 -4.031 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -7.717 8.688 -4.347 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -6.160 8.501 -3.566 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -5.283 7.814 -5.932 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -6.777 8.505 -6.534 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -6.167 10.705 -5.922 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -5.228 10.178 -4.540 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -3.601 9.065 -6.117 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -4.515 9.700 -7.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -2.594 11.063 -6.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -4.016 11.949 -6.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -3.130 11.333 -5.404 1.00 0.00 H new ATOM 1466 N VAL A 94 -7.409 6.098 -1.928 1.00 0.00 N ATOM 1467 CA VAL A 94 -8.099 5.962 -0.638 1.00 0.00 C ATOM 1468 C VAL A 94 -7.368 6.735 0.469 1.00 0.00 C ATOM 1469 O VAL A 94 -6.149 6.637 0.597 1.00 0.00 O ATOM 1470 CB VAL A 94 -8.319 4.471 -0.303 1.00 0.00 C ATOM 1471 CG1 VAL A 94 -7.076 3.598 -0.260 1.00 0.00 C ATOM 1472 CG2 VAL A 94 -9.066 4.338 1.029 1.00 0.00 C ATOM 0 H VAL A 94 -6.402 5.962 -1.842 1.00 0.00 H new ATOM 0 HA VAL A 94 -9.087 6.417 -0.712 1.00 0.00 H new ATOM 0 HB VAL A 94 -8.903 4.095 -1.143 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -7.359 2.574 -0.015 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -6.585 3.616 -1.233 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -6.392 3.977 0.499 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -9.217 3.283 1.258 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -8.480 4.801 1.823 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -10.033 4.835 0.955 1.00 0.00 H new ATOM 1482 N GLU A 95 -8.123 7.497 1.262 1.00 0.00 N ATOM 1483 CA GLU A 95 -7.662 8.203 2.465 1.00 0.00 C ATOM 1484 C GLU A 95 -7.902 7.332 3.712 1.00 0.00 C ATOM 1485 O GLU A 95 -9.004 6.823 3.912 1.00 0.00 O ATOM 1486 CB GLU A 95 -8.408 9.545 2.552 1.00 0.00 C ATOM 1487 CG GLU A 95 -8.022 10.379 3.776 1.00 0.00 C ATOM 1488 CD GLU A 95 -8.773 11.722 3.788 1.00 0.00 C ATOM 1489 OE1 GLU A 95 -8.556 12.559 2.881 1.00 0.00 O ATOM 1490 OE2 GLU A 95 -9.593 11.950 4.709 1.00 0.00 O ATOM 0 H GLU A 95 -9.115 7.647 1.078 1.00 0.00 H new ATOM 0 HA GLU A 95 -6.591 8.398 2.412 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -8.207 10.123 1.650 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -9.481 9.355 2.575 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -8.249 9.823 4.686 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -6.947 10.559 3.773 1.00 0.00 H new ATOM 1497 N ILE A 96 -6.878 7.147 4.555 1.00 0.00 N ATOM 1498 CA ILE A 96 -6.848 6.128 5.624 1.00 0.00 C ATOM 1499 C ILE A 96 -5.839 6.499 6.722 1.00 0.00 C ATOM 1500 O ILE A 96 -4.821 7.110 6.429 1.00 0.00 O ATOM 1501 CB ILE A 96 -6.536 4.744 4.991 1.00 0.00 C ATOM 1502 CG1 ILE A 96 -6.694 3.610 6.023 1.00 0.00 C ATOM 1503 CG2 ILE A 96 -5.150 4.707 4.324 1.00 0.00 C ATOM 1504 CD1 ILE A 96 -6.559 2.200 5.448 1.00 0.00 C ATOM 0 H ILE A 96 -6.028 7.710 4.516 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.823 6.081 6.109 1.00 0.00 H new ATOM 0 HB ILE A 96 -7.270 4.583 4.201 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -5.946 3.742 6.805 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.671 3.702 6.497 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -4.978 3.719 3.896 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -5.106 5.457 3.534 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.382 4.919 5.068 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.684 1.468 6.246 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -7.324 2.042 4.688 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.572 2.083 5.000 1.00 0.00 H new ATOM 1516 N ALA A 97 -6.082 6.143 7.989 1.00 0.00 N ATOM 1517 CA ALA A 97 -5.099 6.370 9.057 1.00 0.00 C ATOM 1518 C ALA A 97 -4.067 5.230 9.129 1.00 0.00 C ATOM 1519 O ALA A 97 -4.445 4.063 9.235 1.00 0.00 O ATOM 1520 CB ALA A 97 -5.817 6.601 10.394 1.00 0.00 C ATOM 0 H ALA A 97 -6.946 5.699 8.300 1.00 0.00 H new ATOM 0 HA ALA A 97 -4.534 7.273 8.826 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -5.079 6.768 11.179 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -6.465 7.474 10.313 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -6.417 5.725 10.641 1.00 0.00 H new ATOM 1526 N PHE A 98 -2.778 5.579 9.108 1.00 0.00 N ATOM 1527 CA PHE A 98 -1.644 4.679 9.343 1.00 0.00 C ATOM 1528 C PHE A 98 -1.012 4.971 10.713 1.00 0.00 C ATOM 1529 O PHE A 98 -0.852 6.130 11.100 1.00 0.00 O ATOM 1530 CB PHE A 98 -0.589 4.873 8.236 1.00 0.00 C ATOM 1531 CG PHE A 98 -0.817 4.217 6.880 1.00 0.00 C ATOM 1532 CD1 PHE A 98 -1.978 3.472 6.573 1.00 0.00 C ATOM 1533 CD2 PHE A 98 0.204 4.323 5.914 1.00 0.00 C ATOM 1534 CE1 PHE A 98 -2.099 2.832 5.325 1.00 0.00 C ATOM 1535 CE2 PHE A 98 0.082 3.682 4.669 1.00 0.00 C ATOM 1536 CZ PHE A 98 -1.068 2.930 4.377 1.00 0.00 C ATOM 0 H PHE A 98 -2.483 6.537 8.919 1.00 0.00 H new ATOM 0 HA PHE A 98 -2.001 3.649 9.328 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -0.479 5.945 8.070 1.00 0.00 H new ATOM 0 HB3 PHE A 98 0.364 4.511 8.622 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -2.775 3.393 7.298 1.00 0.00 H new ATOM 0 HD2 PHE A 98 1.089 4.902 6.133 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -2.988 2.263 5.096 1.00 0.00 H new ATOM 0 HE2 PHE A 98 0.872 3.768 3.937 1.00 0.00 H new ATOM 0 HZ PHE A 98 -1.159 2.428 3.425 1.00 0.00 H new ATOM 1546 N TYR A 99 -0.621 3.915 11.427 1.00 0.00 N ATOM 1547 CA TYR A 99 0.086 3.957 12.713 1.00 0.00 C ATOM 1548 C TYR A 99 1.558 3.521 12.540 1.00 0.00 C ATOM 1549 O TYR A 99 1.827 2.425 12.037 1.00 0.00 O ATOM 1550 CB TYR A 99 -0.672 3.044 13.693 1.00 0.00 C ATOM 1551 CG TYR A 99 -0.263 3.166 15.149 1.00 0.00 C ATOM 1552 CD1 TYR A 99 0.890 2.509 15.622 1.00 0.00 C ATOM 1553 CD2 TYR A 99 -1.065 3.902 16.045 1.00 0.00 C ATOM 1554 CE1 TYR A 99 1.244 2.591 16.982 1.00 0.00 C ATOM 1555 CE2 TYR A 99 -0.715 3.990 17.406 1.00 0.00 C ATOM 1556 CZ TYR A 99 0.441 3.329 17.881 1.00 0.00 C ATOM 1557 OH TYR A 99 0.772 3.385 19.202 1.00 0.00 O ATOM 0 H TYR A 99 -0.796 2.961 11.112 1.00 0.00 H new ATOM 0 HA TYR A 99 0.110 4.973 13.108 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -1.737 3.260 13.614 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -0.533 2.009 13.380 1.00 0.00 H new ATOM 0 HD1 TYR A 99 1.504 1.941 14.939 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -1.953 4.401 15.685 1.00 0.00 H new ATOM 0 HE1 TYR A 99 2.131 2.089 17.339 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -1.329 4.562 18.086 1.00 0.00 H new ATOM 0 HH TYR A 99 0.117 3.934 19.680 1.00 0.00 H new ATOM 1567 N ARG A 100 2.512 4.369 12.951 1.00 0.00 N ATOM 1568 CA ARG A 100 3.962 4.135 12.816 1.00 0.00 C ATOM 1569 C ARG A 100 4.597 3.457 14.042 1.00 0.00 C ATOM 1570 O ARG A 100 4.085 3.553 15.157 1.00 0.00 O ATOM 1571 CB ARG A 100 4.700 5.437 12.436 1.00 0.00 C ATOM 1572 CG ARG A 100 4.535 6.634 13.388 1.00 0.00 C ATOM 1573 CD ARG A 100 5.613 7.712 13.173 1.00 0.00 C ATOM 1574 NE ARG A 100 5.649 8.224 11.787 1.00 0.00 N ATOM 1575 CZ ARG A 100 5.906 9.467 11.397 1.00 0.00 C ATOM 1576 NH1 ARG A 100 6.164 10.444 12.243 1.00 0.00 N ATOM 1577 NH2 ARG A 100 5.908 9.734 10.111 1.00 0.00 N ATOM 0 H ARG A 100 2.294 5.260 13.398 1.00 0.00 H new ATOM 0 HA ARG A 100 4.079 3.422 12.000 1.00 0.00 H new ATOM 0 HB2 ARG A 100 5.764 5.213 12.354 1.00 0.00 H new ATOM 0 HB3 ARG A 100 4.362 5.742 11.446 1.00 0.00 H new ATOM 0 HG2 ARG A 100 3.549 7.076 13.243 1.00 0.00 H new ATOM 0 HG3 ARG A 100 4.578 6.283 14.419 1.00 0.00 H new ATOM 0 HD2 ARG A 100 5.431 8.541 13.856 1.00 0.00 H new ATOM 0 HD3 ARG A 100 6.589 7.298 13.427 1.00 0.00 H new ATOM 0 HE ARG A 100 5.455 7.548 11.048 1.00 0.00 H new ATOM 0 HH11 ARG A 100 6.172 10.261 13.246 1.00 0.00 H new ATOM 0 HH12 ARG A 100 6.356 11.383 11.894 1.00 0.00 H new ATOM 0 HH21 ARG A 100 5.715 8.994 9.436 1.00 0.00 H new ATOM 0 HH22 ARG A 100 6.103 10.681 9.787 1.00 0.00 H new ATOM 1591 N LYS A 101 5.773 2.846 13.850 1.00 0.00 N ATOM 1592 CA LYS A 101 6.557 2.152 14.897 1.00 0.00 C ATOM 1593 C LYS A 101 6.958 3.048 16.091 1.00 0.00 C ATOM 1594 O LYS A 101 7.199 2.539 17.187 1.00 0.00 O ATOM 1595 CB LYS A 101 7.819 1.516 14.267 1.00 0.00 C ATOM 1596 CG LYS A 101 7.629 0.092 13.724 1.00 0.00 C ATOM 1597 CD LYS A 101 6.989 0.036 12.328 1.00 0.00 C ATOM 1598 CE LYS A 101 6.824 -1.406 11.819 1.00 0.00 C ATOM 1599 NZ LYS A 101 5.853 -2.207 12.622 1.00 0.00 N ATOM 0 H LYS A 101 6.225 2.816 12.936 1.00 0.00 H new ATOM 0 HA LYS A 101 5.901 1.385 15.308 1.00 0.00 H new ATOM 0 HB2 LYS A 101 8.162 2.156 13.454 1.00 0.00 H new ATOM 0 HB3 LYS A 101 8.611 1.500 15.016 1.00 0.00 H new ATOM 0 HG2 LYS A 101 8.599 -0.405 13.688 1.00 0.00 H new ATOM 0 HG3 LYS A 101 7.008 -0.472 14.420 1.00 0.00 H new ATOM 0 HD2 LYS A 101 6.014 0.522 12.358 1.00 0.00 H new ATOM 0 HD3 LYS A 101 7.604 0.599 11.626 1.00 0.00 H new ATOM 0 HE2 LYS A 101 6.494 -1.382 10.780 1.00 0.00 H new ATOM 0 HE3 LYS A 101 7.794 -1.903 11.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 5.748 -3.151 12.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 6.203 -2.301 13.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 4.930 -1.727 12.630 1.00 0.00 H new ATOM 1613 N ASP A 102 6.999 4.373 15.905 1.00 0.00 N ATOM 1614 CA ASP A 102 7.288 5.355 16.963 1.00 0.00 C ATOM 1615 C ASP A 102 6.147 5.494 17.999 1.00 0.00 C ATOM 1616 O ASP A 102 6.349 6.085 19.063 1.00 0.00 O ATOM 1617 CB ASP A 102 7.596 6.705 16.299 1.00 0.00 C ATOM 1618 CG ASP A 102 8.183 7.738 17.279 1.00 0.00 C ATOM 1619 OD1 ASP A 102 9.261 7.472 17.862 1.00 0.00 O ATOM 1620 OD2 ASP A 102 7.587 8.831 17.427 1.00 0.00 O ATOM 0 H ASP A 102 6.829 4.804 14.996 1.00 0.00 H new ATOM 0 HA ASP A 102 8.149 5.000 17.529 1.00 0.00 H new ATOM 0 HB2 ASP A 102 8.299 6.549 15.480 1.00 0.00 H new ATOM 0 HB3 ASP A 102 6.681 7.106 15.862 1.00 0.00 H new ATOM 1625 N GLY A 103 4.961 4.937 17.709 1.00 0.00 N ATOM 1626 CA GLY A 103 3.794 4.950 18.602 1.00 0.00 C ATOM 1627 C GLY A 103 2.812 6.090 18.315 1.00 0.00 C ATOM 1628 O GLY A 103 2.111 6.537 19.222 1.00 0.00 O ATOM 0 H GLY A 103 4.784 4.455 16.828 1.00 0.00 H new ATOM 0 HA2 GLY A 103 3.269 3.999 18.513 1.00 0.00 H new ATOM 0 HA3 GLY A 103 4.138 5.029 19.633 1.00 0.00 H new ATOM 1632 N SER A 104 2.766 6.565 17.069 1.00 0.00 N ATOM 1633 CA SER A 104 1.926 7.696 16.631 1.00 0.00 C ATOM 1634 C SER A 104 1.169 7.364 15.333 1.00 0.00 C ATOM 1635 O SER A 104 1.472 6.369 14.672 1.00 0.00 O ATOM 1636 CB SER A 104 2.801 8.948 16.420 1.00 0.00 C ATOM 1637 OG SER A 104 3.398 9.382 17.638 1.00 0.00 O ATOM 0 H SER A 104 3.324 6.168 16.313 1.00 0.00 H new ATOM 0 HA SER A 104 1.190 7.890 17.411 1.00 0.00 H new ATOM 0 HB2 SER A 104 3.580 8.729 15.690 1.00 0.00 H new ATOM 0 HB3 SER A 104 2.193 9.752 16.006 1.00 0.00 H new ATOM 0 HG SER A 104 3.947 10.176 17.469 1.00 0.00 H new ATOM 1643 N CYS A 105 0.202 8.199 14.933 1.00 0.00 N ATOM 1644 CA CYS A 105 -0.581 8.008 13.705 1.00 0.00 C ATOM 1645 C CYS A 105 -0.851 9.313 12.935 1.00 0.00 C ATOM 1646 O CYS A 105 -0.589 10.418 13.416 1.00 0.00 O ATOM 1647 CB CYS A 105 -1.873 7.242 14.045 1.00 0.00 C ATOM 1648 SG CYS A 105 -2.998 8.253 15.055 1.00 0.00 S ATOM 0 H CYS A 105 -0.062 9.034 15.457 1.00 0.00 H new ATOM 0 HA CYS A 105 0.016 7.412 13.015 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -2.375 6.946 13.124 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.624 6.326 14.581 1.00 0.00 H new ATOM 0 HG CYS A 105 -4.074 7.573 15.318 1.00 0.00 H new ATOM 1654 N PHE A 106 -1.372 9.159 11.717 1.00 0.00 N ATOM 1655 CA PHE A 106 -1.659 10.226 10.755 1.00 0.00 C ATOM 1656 C PHE A 106 -2.581 9.710 9.647 1.00 0.00 C ATOM 1657 O PHE A 106 -2.582 8.519 9.335 1.00 0.00 O ATOM 1658 CB PHE A 106 -0.346 10.775 10.159 1.00 0.00 C ATOM 1659 CG PHE A 106 0.581 9.714 9.580 1.00 0.00 C ATOM 1660 CD1 PHE A 106 0.425 9.273 8.250 1.00 0.00 C ATOM 1661 CD2 PHE A 106 1.587 9.145 10.386 1.00 0.00 C ATOM 1662 CE1 PHE A 106 1.265 8.267 7.736 1.00 0.00 C ATOM 1663 CE2 PHE A 106 2.415 8.131 9.875 1.00 0.00 C ATOM 1664 CZ PHE A 106 2.256 7.690 8.550 1.00 0.00 C ATOM 0 H PHE A 106 -1.619 8.238 11.355 1.00 0.00 H new ATOM 0 HA PHE A 106 -2.168 11.038 11.274 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -0.590 11.492 9.375 1.00 0.00 H new ATOM 0 HB3 PHE A 106 0.189 11.322 10.935 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -0.340 9.708 7.624 1.00 0.00 H new ATOM 0 HD2 PHE A 106 1.722 9.490 11.401 1.00 0.00 H new ATOM 0 HE1 PHE A 106 1.148 7.938 6.714 1.00 0.00 H new ATOM 0 HE2 PHE A 106 3.175 7.689 10.502 1.00 0.00 H new ATOM 0 HZ PHE A 106 2.893 6.911 8.158 1.00 0.00 H new ATOM 1674 N LEU A 107 -3.337 10.613 9.019 1.00 0.00 N ATOM 1675 CA LEU A 107 -4.071 10.319 7.788 1.00 0.00 C ATOM 1676 C LEU A 107 -3.111 10.307 6.591 1.00 0.00 C ATOM 1677 O LEU A 107 -2.468 11.306 6.260 1.00 0.00 O ATOM 1678 CB LEU A 107 -5.213 11.331 7.573 1.00 0.00 C ATOM 1679 CG LEU A 107 -6.606 10.961 8.125 1.00 0.00 C ATOM 1680 CD1 LEU A 107 -7.131 9.625 7.588 1.00 0.00 C ATOM 1681 CD2 LEU A 107 -6.632 10.928 9.658 1.00 0.00 C ATOM 0 H LEU A 107 -3.457 11.570 9.351 1.00 0.00 H new ATOM 0 HA LEU A 107 -4.520 9.330 7.879 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -4.913 12.277 8.023 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -5.311 11.505 6.501 1.00 0.00 H new ATOM 0 HG LEU A 107 -7.265 11.754 7.771 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -8.114 9.423 8.014 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -7.210 9.675 6.502 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -6.444 8.826 7.866 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -7.633 10.663 9.999 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -5.918 10.187 10.018 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -6.364 11.910 10.048 1.00 0.00 H new ATOM 1693 N CYS A 108 -3.074 9.168 5.913 1.00 0.00 N ATOM 1694 CA CYS A 108 -2.348 8.886 4.686 1.00 0.00 C ATOM 1695 C CYS A 108 -3.324 8.851 3.495 1.00 0.00 C ATOM 1696 O CYS A 108 -4.423 8.302 3.596 1.00 0.00 O ATOM 1697 CB CYS A 108 -1.660 7.525 4.885 1.00 0.00 C ATOM 1698 SG CYS A 108 -0.576 7.159 3.479 1.00 0.00 S ATOM 0 H CYS A 108 -3.594 8.352 6.235 1.00 0.00 H new ATOM 0 HA CYS A 108 -1.608 9.656 4.470 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -1.080 7.534 5.808 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -2.411 6.742 4.988 1.00 0.00 H new ATOM 0 HG CYS A 108 -0.133 5.941 3.578 1.00 0.00 H new ATOM 1704 N LEU A 109 -2.919 9.393 2.348 1.00 0.00 N ATOM 1705 CA LEU A 109 -3.518 9.096 1.051 1.00 0.00 C ATOM 1706 C LEU A 109 -2.715 7.952 0.419 1.00 0.00 C ATOM 1707 O LEU A 109 -1.514 8.101 0.194 1.00 0.00 O ATOM 1708 CB LEU A 109 -3.502 10.363 0.170 1.00 0.00 C ATOM 1709 CG LEU A 109 -4.516 10.333 -0.999 1.00 0.00 C ATOM 1710 CD1 LEU A 109 -5.975 10.351 -0.515 1.00 0.00 C ATOM 1711 CD2 LEU A 109 -4.273 11.563 -1.887 1.00 0.00 C ATOM 0 H LEU A 109 -2.152 10.063 2.294 1.00 0.00 H new ATOM 0 HA LEU A 109 -4.559 8.789 1.155 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -3.711 11.230 0.796 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -2.499 10.497 -0.236 1.00 0.00 H new ATOM 0 HG LEU A 109 -4.364 9.404 -1.549 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -6.644 10.329 -1.375 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -6.161 9.479 0.112 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -6.156 11.258 0.062 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -4.980 11.558 -2.717 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -4.411 12.470 -1.298 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -3.255 11.535 -2.277 1.00 0.00 H new ATOM 1723 N VAL A 110 -3.377 6.823 0.159 1.00 0.00 N ATOM 1724 CA VAL A 110 -2.817 5.681 -0.577 1.00 0.00 C ATOM 1725 C VAL A 110 -3.390 5.691 -1.995 1.00 0.00 C ATOM 1726 O VAL A 110 -4.600 5.537 -2.167 1.00 0.00 O ATOM 1727 CB VAL A 110 -3.121 4.322 0.093 1.00 0.00 C ATOM 1728 CG1 VAL A 110 -2.436 3.188 -0.660 1.00 0.00 C ATOM 1729 CG2 VAL A 110 -2.695 4.293 1.570 1.00 0.00 C ATOM 0 H VAL A 110 -4.340 6.671 0.460 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.732 5.790 -0.585 1.00 0.00 H new ATOM 0 HB VAL A 110 -4.202 4.186 0.054 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.662 2.239 -0.173 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.797 3.163 -1.688 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.358 3.349 -0.658 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.929 3.318 1.997 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.622 4.473 1.643 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -3.231 5.067 2.119 1.00 0.00 H new ATOM 1739 N ASP A 111 -2.532 5.851 -2.999 1.00 0.00 N ATOM 1740 CA ASP A 111 -2.868 5.782 -4.414 1.00 0.00 C ATOM 1741 C ASP A 111 -2.349 4.450 -4.968 1.00 0.00 C ATOM 1742 O ASP A 111 -1.143 4.225 -4.921 1.00 0.00 O ATOM 1743 CB ASP A 111 -2.210 6.953 -5.172 1.00 0.00 C ATOM 1744 CG ASP A 111 -2.109 8.273 -4.380 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -3.115 8.689 -3.765 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -1.043 8.928 -4.462 1.00 0.00 O ATOM 0 H ASP A 111 -1.542 6.040 -2.840 1.00 0.00 H new ATOM 0 HA ASP A 111 -3.948 5.849 -4.543 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -1.207 6.651 -5.474 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -2.776 7.138 -6.085 1.00 0.00 H new ATOM 1751 N VAL A 112 -3.208 3.587 -5.517 1.00 0.00 N ATOM 1752 CA VAL A 112 -2.743 2.471 -6.364 1.00 0.00 C ATOM 1753 C VAL A 112 -2.771 2.899 -7.821 1.00 0.00 C ATOM 1754 O VAL A 112 -3.769 3.421 -8.315 1.00 0.00 O ATOM 1755 CB VAL A 112 -3.461 1.125 -6.147 1.00 0.00 C ATOM 1756 CG1 VAL A 112 -4.968 1.208 -6.088 1.00 0.00 C ATOM 1757 CG2 VAL A 112 -3.075 0.049 -7.175 1.00 0.00 C ATOM 0 H VAL A 112 -4.220 3.633 -5.396 1.00 0.00 H new ATOM 0 HA VAL A 112 -1.720 2.261 -6.051 1.00 0.00 H new ATOM 0 HB VAL A 112 -3.102 0.832 -5.160 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -5.381 0.211 -5.933 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -5.265 1.856 -5.264 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -5.347 1.616 -7.025 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -3.619 -0.871 -6.960 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -3.329 0.395 -8.177 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -2.003 -0.141 -7.118 1.00 0.00 H new ATOM 1767 N VAL A 113 -1.654 2.640 -8.490 1.00 0.00 N ATOM 1768 CA VAL A 113 -1.447 2.886 -9.915 1.00 0.00 C ATOM 1769 C VAL A 113 -1.145 1.517 -10.545 1.00 0.00 C ATOM 1770 O VAL A 113 -0.060 0.979 -10.309 1.00 0.00 O ATOM 1771 CB VAL A 113 -0.317 3.920 -10.121 1.00 0.00 C ATOM 1772 CG1 VAL A 113 -0.021 4.131 -11.615 1.00 0.00 C ATOM 1773 CG2 VAL A 113 -0.672 5.271 -9.474 1.00 0.00 C ATOM 0 H VAL A 113 -0.834 2.237 -8.038 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.323 3.321 -10.397 1.00 0.00 H new ATOM 0 HB VAL A 113 0.574 3.520 -9.637 1.00 0.00 H new ATOM 0 HG11 VAL A 113 0.778 4.864 -11.728 1.00 0.00 H new ATOM 0 HG12 VAL A 113 0.288 3.186 -12.062 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -0.919 4.493 -12.116 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.142 5.977 -9.636 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -1.585 5.661 -9.924 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -0.825 5.133 -8.404 1.00 0.00 H new ATOM 1783 N PRO A 114 -2.109 0.898 -11.256 1.00 0.00 N ATOM 1784 CA PRO A 114 -1.948 -0.441 -11.811 1.00 0.00 C ATOM 1785 C PRO A 114 -1.052 -0.405 -13.051 1.00 0.00 C ATOM 1786 O PRO A 114 -1.150 0.502 -13.877 1.00 0.00 O ATOM 1787 CB PRO A 114 -3.361 -0.931 -12.134 1.00 0.00 C ATOM 1788 CG PRO A 114 -4.128 0.357 -12.413 1.00 0.00 C ATOM 1789 CD PRO A 114 -3.468 1.376 -11.486 1.00 0.00 C ATOM 0 HA PRO A 114 -1.459 -1.119 -11.112 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -3.368 -1.597 -12.997 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -3.795 -1.484 -11.301 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -4.046 0.654 -13.459 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -5.190 0.246 -12.196 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -3.460 2.367 -11.940 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -4.015 1.460 -10.547 1.00 0.00 H new ATOM 1797 N VAL A 115 -0.182 -1.410 -13.166 1.00 0.00 N ATOM 1798 CA VAL A 115 0.789 -1.549 -14.269 1.00 0.00 C ATOM 1799 C VAL A 115 0.421 -2.757 -15.133 1.00 0.00 C ATOM 1800 O VAL A 115 0.325 -3.878 -14.631 1.00 0.00 O ATOM 1801 CB VAL A 115 2.230 -1.696 -13.730 1.00 0.00 C ATOM 1802 CG1 VAL A 115 3.267 -1.886 -14.850 1.00 0.00 C ATOM 1803 CG2 VAL A 115 2.632 -0.475 -12.889 1.00 0.00 C ATOM 0 H VAL A 115 -0.126 -2.168 -12.486 1.00 0.00 H new ATOM 0 HA VAL A 115 0.750 -0.645 -14.877 1.00 0.00 H new ATOM 0 HB VAL A 115 2.226 -2.593 -13.111 1.00 0.00 H new ATOM 0 HG11 VAL A 115 4.261 -1.984 -14.413 1.00 0.00 H new ATOM 0 HG12 VAL A 115 3.030 -2.786 -15.417 1.00 0.00 H new ATOM 0 HG13 VAL A 115 3.246 -1.023 -15.515 1.00 0.00 H new ATOM 0 HG21 VAL A 115 3.650 -0.605 -12.522 1.00 0.00 H new ATOM 0 HG22 VAL A 115 2.580 0.423 -13.504 1.00 0.00 H new ATOM 0 HG23 VAL A 115 1.952 -0.376 -12.043 1.00 0.00 H new ATOM 1813 N LYS A 116 0.264 -2.530 -16.441 1.00 0.00 N ATOM 1814 CA LYS A 116 0.098 -3.589 -17.445 1.00 0.00 C ATOM 1815 C LYS A 116 1.422 -4.018 -18.100 1.00 0.00 C ATOM 1816 O LYS A 116 2.382 -3.249 -18.179 1.00 0.00 O ATOM 1817 CB LYS A 116 -0.924 -3.174 -18.517 1.00 0.00 C ATOM 1818 CG LYS A 116 -2.345 -3.107 -17.949 1.00 0.00 C ATOM 1819 CD LYS A 116 -3.378 -2.802 -19.044 1.00 0.00 C ATOM 1820 CE LYS A 116 -4.731 -3.403 -18.640 1.00 0.00 C ATOM 1821 NZ LYS A 116 -5.770 -3.179 -19.684 1.00 0.00 N ATOM 0 H LYS A 116 0.248 -1.591 -16.839 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.280 -4.459 -16.908 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.649 -2.201 -18.925 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -0.895 -3.886 -19.342 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -2.591 -4.055 -17.470 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -2.393 -2.338 -17.178 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -3.472 -1.725 -19.183 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -3.051 -3.219 -19.996 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -4.616 -4.473 -18.465 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -5.059 -2.960 -17.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -6.669 -3.599 -19.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -5.898 -2.158 -19.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -5.469 -3.623 -20.575 1.00 0.00 H new ATOM 1835 N ASN A 117 1.446 -5.262 -18.588 1.00 0.00 N ATOM 1836 CA ASN A 117 2.576 -5.847 -19.312 1.00 0.00 C ATOM 1837 C ASN A 117 2.427 -5.665 -20.834 1.00 0.00 C ATOM 1838 O ASN A 117 1.480 -5.042 -21.319 1.00 0.00 O ATOM 1839 CB ASN A 117 2.759 -7.318 -18.883 1.00 0.00 C ATOM 1840 CG ASN A 117 1.828 -8.299 -19.582 1.00 0.00 C ATOM 1841 OD1 ASN A 117 2.225 -8.965 -20.524 1.00 0.00 O ATOM 1842 ND2 ASN A 117 0.569 -8.386 -19.197 1.00 0.00 N ATOM 0 H ASN A 117 0.660 -5.905 -18.487 1.00 0.00 H new ATOM 0 HA ASN A 117 3.491 -5.316 -19.049 1.00 0.00 H new ATOM 0 HB2 ASN A 117 3.790 -7.614 -19.076 1.00 0.00 H new ATOM 0 HB3 ASN A 117 2.603 -7.392 -17.807 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -0.072 -9.010 -19.687 1.00 0.00 H new ATOM 0 HD22 ASN A 117 0.237 -7.829 -18.409 1.00 0.00 H new ATOM 1849 N GLU A 118 3.347 -6.270 -21.580 1.00 0.00 N ATOM 1850 CA GLU A 118 3.395 -6.240 -23.051 1.00 0.00 C ATOM 1851 C GLU A 118 2.161 -6.865 -23.748 1.00 0.00 C ATOM 1852 O GLU A 118 1.888 -6.536 -24.904 1.00 0.00 O ATOM 1853 CB GLU A 118 4.697 -6.901 -23.538 1.00 0.00 C ATOM 1854 CG GLU A 118 4.884 -8.341 -23.039 1.00 0.00 C ATOM 1855 CD GLU A 118 6.110 -8.994 -23.694 1.00 0.00 C ATOM 1856 OE1 GLU A 118 5.984 -9.563 -24.805 1.00 0.00 O ATOM 1857 OE2 GLU A 118 7.216 -8.941 -23.105 1.00 0.00 O ATOM 0 H GLU A 118 4.107 -6.814 -21.171 1.00 0.00 H new ATOM 0 HA GLU A 118 3.375 -5.189 -23.338 1.00 0.00 H new ATOM 0 HB2 GLU A 118 4.709 -6.899 -24.628 1.00 0.00 H new ATOM 0 HB3 GLU A 118 5.544 -6.299 -23.209 1.00 0.00 H new ATOM 0 HG2 GLU A 118 5.002 -8.342 -21.955 1.00 0.00 H new ATOM 0 HG3 GLU A 118 3.992 -8.926 -23.263 1.00 0.00 H new ATOM 1864 N ASP A 119 1.393 -7.723 -23.062 1.00 0.00 N ATOM 1865 CA ASP A 119 0.157 -8.344 -23.575 1.00 0.00 C ATOM 1866 C ASP A 119 -1.123 -7.582 -23.162 1.00 0.00 C ATOM 1867 O ASP A 119 -2.231 -7.990 -23.519 1.00 0.00 O ATOM 1868 CB ASP A 119 0.091 -9.816 -23.123 1.00 0.00 C ATOM 1869 CG ASP A 119 1.165 -10.696 -23.786 1.00 0.00 C ATOM 1870 OD1 ASP A 119 1.182 -10.786 -25.038 1.00 0.00 O ATOM 1871 OD2 ASP A 119 1.955 -11.344 -23.058 1.00 0.00 O ATOM 0 H ASP A 119 1.617 -8.014 -22.110 1.00 0.00 H new ATOM 0 HA ASP A 119 0.197 -8.295 -24.663 1.00 0.00 H new ATOM 0 HB2 ASP A 119 0.207 -9.864 -22.040 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -0.895 -10.218 -23.356 1.00 0.00 H new ATOM 1876 N GLY A 120 -0.990 -6.479 -22.411 1.00 0.00 N ATOM 1877 CA GLY A 120 -2.110 -5.614 -22.008 1.00 0.00 C ATOM 1878 C GLY A 120 -2.935 -6.139 -20.828 1.00 0.00 C ATOM 1879 O GLY A 120 -4.083 -5.725 -20.669 1.00 0.00 O ATOM 0 H GLY A 120 -0.088 -6.157 -22.061 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -1.717 -4.631 -21.749 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -2.771 -5.478 -22.864 1.00 0.00 H new ATOM 1883 N ALA A 121 -2.365 -7.015 -19.992 1.00 0.00 N ATOM 1884 CA ALA A 121 -2.958 -7.494 -18.736 1.00 0.00 C ATOM 1885 C ALA A 121 -2.226 -6.871 -17.539 1.00 0.00 C ATOM 1886 O ALA A 121 -1.035 -6.577 -17.642 1.00 0.00 O ATOM 1887 CB ALA A 121 -2.900 -9.032 -18.700 1.00 0.00 C ATOM 0 H ALA A 121 -1.449 -7.424 -20.176 1.00 0.00 H new ATOM 0 HA ALA A 121 -4.003 -7.190 -18.677 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -3.339 -9.391 -17.769 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -3.458 -9.437 -19.544 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -1.862 -9.358 -18.761 1.00 0.00 H new ATOM 1893 N VAL A 122 -2.912 -6.674 -16.412 1.00 0.00 N ATOM 1894 CA VAL A 122 -2.329 -6.068 -15.195 1.00 0.00 C ATOM 1895 C VAL A 122 -1.506 -7.124 -14.448 1.00 0.00 C ATOM 1896 O VAL A 122 -2.022 -8.193 -14.125 1.00 0.00 O ATOM 1897 CB VAL A 122 -3.407 -5.452 -14.266 1.00 0.00 C ATOM 1898 CG1 VAL A 122 -2.801 -4.814 -13.003 1.00 0.00 C ATOM 1899 CG2 VAL A 122 -4.215 -4.364 -14.993 1.00 0.00 C ATOM 0 H VAL A 122 -3.894 -6.929 -16.309 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.682 -5.247 -15.504 1.00 0.00 H new ATOM 0 HB VAL A 122 -4.052 -6.282 -13.978 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -3.598 -4.398 -12.387 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.262 -5.572 -12.435 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -2.113 -4.019 -13.291 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -4.962 -3.952 -14.315 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -3.544 -3.570 -15.320 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -4.712 -4.798 -15.860 1.00 0.00 H new ATOM 1909 N ILE A 123 -0.227 -6.824 -14.180 1.00 0.00 N ATOM 1910 CA ILE A 123 0.724 -7.771 -13.539 1.00 0.00 C ATOM 1911 C ILE A 123 1.435 -7.213 -12.300 1.00 0.00 C ATOM 1912 O ILE A 123 1.881 -7.984 -11.455 1.00 0.00 O ATOM 1913 CB ILE A 123 1.745 -8.334 -14.555 1.00 0.00 C ATOM 1914 CG1 ILE A 123 2.920 -7.394 -14.909 1.00 0.00 C ATOM 1915 CG2 ILE A 123 1.057 -8.872 -15.821 1.00 0.00 C ATOM 1916 CD1 ILE A 123 2.595 -5.998 -15.446 1.00 0.00 C ATOM 0 H ILE A 123 0.187 -5.918 -14.399 1.00 0.00 H new ATOM 0 HA ILE A 123 0.101 -8.590 -13.179 1.00 0.00 H new ATOM 0 HB ILE A 123 2.210 -9.166 -14.026 1.00 0.00 H new ATOM 0 HG12 ILE A 123 3.530 -7.272 -14.014 1.00 0.00 H new ATOM 0 HG13 ILE A 123 3.539 -7.900 -15.650 1.00 0.00 H new ATOM 0 HG21 ILE A 123 1.810 -9.258 -16.508 1.00 0.00 H new ATOM 0 HG22 ILE A 123 0.369 -9.673 -15.549 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.503 -8.067 -16.304 1.00 0.00 H new ATOM 0 HD11 ILE A 123 3.522 -5.461 -15.647 1.00 0.00 H new ATOM 0 HD12 ILE A 123 2.020 -6.087 -16.368 1.00 0.00 H new ATOM 0 HD13 ILE A 123 2.011 -5.450 -14.706 1.00 0.00 H new ATOM 1928 N MET A 124 1.525 -5.891 -12.163 1.00 0.00 N ATOM 1929 CA MET A 124 2.040 -5.200 -10.967 1.00 0.00 C ATOM 1930 C MET A 124 1.139 -4.040 -10.524 1.00 0.00 C ATOM 1931 O MET A 124 0.451 -3.417 -11.334 1.00 0.00 O ATOM 1932 CB MET A 124 3.467 -4.691 -11.236 1.00 0.00 C ATOM 1933 CG MET A 124 4.505 -5.817 -11.194 1.00 0.00 C ATOM 1934 SD MET A 124 6.142 -5.316 -11.790 1.00 0.00 S ATOM 1935 CE MET A 124 5.833 -5.343 -13.574 1.00 0.00 C ATOM 0 H MET A 124 1.235 -5.247 -12.899 1.00 0.00 H new ATOM 0 HA MET A 124 2.051 -5.923 -10.151 1.00 0.00 H new ATOM 0 HB2 MET A 124 3.499 -4.207 -12.212 1.00 0.00 H new ATOM 0 HB3 MET A 124 3.726 -3.934 -10.496 1.00 0.00 H new ATOM 0 HG2 MET A 124 4.595 -6.179 -10.170 1.00 0.00 H new ATOM 0 HG3 MET A 124 4.148 -6.652 -11.797 1.00 0.00 H new ATOM 0 HE1 MET A 124 6.314 -4.483 -14.040 1.00 0.00 H new ATOM 0 HE2 MET A 124 6.239 -6.260 -14.000 1.00 0.00 H new ATOM 0 HE3 MET A 124 4.759 -5.302 -13.758 1.00 0.00 H new ATOM 1945 N PHE A 125 1.205 -3.715 -9.234 1.00 0.00 N ATOM 1946 CA PHE A 125 0.596 -2.533 -8.621 1.00 0.00 C ATOM 1947 C PHE A 125 1.682 -1.663 -8.002 1.00 0.00 C ATOM 1948 O PHE A 125 2.530 -2.162 -7.267 1.00 0.00 O ATOM 1949 CB PHE A 125 -0.398 -2.984 -7.542 1.00 0.00 C ATOM 1950 CG PHE A 125 -1.573 -3.746 -8.107 1.00 0.00 C ATOM 1951 CD1 PHE A 125 -2.514 -3.065 -8.902 1.00 0.00 C ATOM 1952 CD2 PHE A 125 -1.711 -5.125 -7.867 1.00 0.00 C ATOM 1953 CE1 PHE A 125 -3.584 -3.775 -9.475 1.00 0.00 C ATOM 1954 CE2 PHE A 125 -2.789 -5.827 -8.431 1.00 0.00 C ATOM 1955 CZ PHE A 125 -3.708 -5.157 -9.255 1.00 0.00 C ATOM 0 H PHE A 125 1.705 -4.292 -8.558 1.00 0.00 H new ATOM 0 HA PHE A 125 0.069 -1.952 -9.378 1.00 0.00 H new ATOM 0 HB2 PHE A 125 0.121 -3.611 -6.817 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -0.763 -2.110 -7.004 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -2.415 -2.003 -9.071 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -0.990 -5.642 -7.251 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -4.311 -3.258 -10.084 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -2.911 -6.881 -8.231 1.00 0.00 H new ATOM 0 HZ PHE A 125 -4.513 -5.706 -9.721 1.00 0.00 H new ATOM 1965 N ILE A 126 1.630 -0.358 -8.266 1.00 0.00 N ATOM 1966 CA ILE A 126 2.429 0.646 -7.549 1.00 0.00 C ATOM 1967 C ILE A 126 1.495 1.289 -6.526 1.00 0.00 C ATOM 1968 O ILE A 126 0.503 1.888 -6.942 1.00 0.00 O ATOM 1969 CB ILE A 126 3.018 1.709 -8.510 1.00 0.00 C ATOM 1970 CG1 ILE A 126 3.758 1.088 -9.718 1.00 0.00 C ATOM 1971 CG2 ILE A 126 3.948 2.653 -7.720 1.00 0.00 C ATOM 1972 CD1 ILE A 126 4.113 2.104 -10.810 1.00 0.00 C ATOM 0 H ILE A 126 1.029 0.039 -8.988 1.00 0.00 H new ATOM 0 HA ILE A 126 3.286 0.177 -7.065 1.00 0.00 H new ATOM 0 HB ILE A 126 2.185 2.274 -8.928 1.00 0.00 H new ATOM 0 HG12 ILE A 126 4.673 0.611 -9.367 1.00 0.00 H new ATOM 0 HG13 ILE A 126 3.136 0.305 -10.151 1.00 0.00 H new ATOM 0 HG21 ILE A 126 4.364 3.402 -8.394 1.00 0.00 H new ATOM 0 HG22 ILE A 126 3.380 3.149 -6.933 1.00 0.00 H new ATOM 0 HG23 ILE A 126 4.758 2.076 -7.274 1.00 0.00 H new ATOM 0 HD11 ILE A 126 4.630 1.597 -11.625 1.00 0.00 H new ATOM 0 HD12 ILE A 126 3.201 2.564 -11.190 1.00 0.00 H new ATOM 0 HD13 ILE A 126 4.761 2.875 -10.393 1.00 0.00 H new ATOM 1984 N LEU A 127 1.775 1.160 -5.230 1.00 0.00 N ATOM 1985 CA LEU A 127 1.039 1.840 -4.155 1.00 0.00 C ATOM 1986 C LEU A 127 1.899 3.013 -3.680 1.00 0.00 C ATOM 1987 O LEU A 127 3.107 2.858 -3.513 1.00 0.00 O ATOM 1988 CB LEU A 127 0.722 0.862 -2.999 1.00 0.00 C ATOM 1989 CG LEU A 127 -0.530 -0.033 -3.176 1.00 0.00 C ATOM 1990 CD1 LEU A 127 -1.815 0.729 -2.880 1.00 0.00 C ATOM 1991 CD2 LEU A 127 -0.609 -0.734 -4.536 1.00 0.00 C ATOM 0 H LEU A 127 2.533 0.570 -4.887 1.00 0.00 H new ATOM 0 HA LEU A 127 0.080 2.207 -4.520 1.00 0.00 H new ATOM 0 HB2 LEU A 127 1.587 0.215 -2.853 1.00 0.00 H new ATOM 0 HB3 LEU A 127 0.600 1.442 -2.084 1.00 0.00 H new ATOM 0 HG LEU A 127 -0.419 -0.826 -2.436 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -2.670 0.067 -3.015 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -1.795 1.090 -1.852 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -1.901 1.576 -3.561 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -1.513 -1.341 -4.581 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.634 0.013 -5.329 1.00 0.00 H new ATOM 0 HD23 LEU A 127 0.264 -1.374 -4.667 1.00 0.00 H new ATOM 2003 N ASN A 128 1.297 4.185 -3.484 1.00 0.00 N ATOM 2004 CA ASN A 128 2.000 5.436 -3.199 1.00 0.00 C ATOM 2005 C ASN A 128 1.374 6.128 -1.979 1.00 0.00 C ATOM 2006 O ASN A 128 0.162 6.325 -1.954 1.00 0.00 O ATOM 2007 CB ASN A 128 1.968 6.390 -4.409 1.00 0.00 C ATOM 2008 CG ASN A 128 2.216 5.755 -5.779 1.00 0.00 C ATOM 2009 OD1 ASN A 128 3.269 5.917 -6.380 1.00 0.00 O ATOM 2010 ND2 ASN A 128 1.244 5.052 -6.338 1.00 0.00 N ATOM 0 H ASN A 128 0.283 4.294 -3.520 1.00 0.00 H new ATOM 0 HA ASN A 128 3.041 5.190 -2.986 1.00 0.00 H new ATOM 0 HB2 ASN A 128 0.996 6.882 -4.431 1.00 0.00 H new ATOM 0 HB3 ASN A 128 2.716 7.167 -4.252 1.00 0.00 H new ATOM 0 HD21 ASN A 128 1.375 4.648 -7.266 1.00 0.00 H new ATOM 0 HD22 ASN A 128 0.364 4.914 -5.841 1.00 0.00 H new ATOM 2017 N PHE A 129 2.192 6.481 -0.983 1.00 0.00 N ATOM 2018 CA PHE A 129 1.780 7.028 0.311 1.00 0.00 C ATOM 2019 C PHE A 129 2.120 8.526 0.429 1.00 0.00 C ATOM 2020 O PHE A 129 3.212 8.952 0.052 1.00 0.00 O ATOM 2021 CB PHE A 129 2.470 6.217 1.430 1.00 0.00 C ATOM 2022 CG PHE A 129 2.331 4.699 1.374 1.00 0.00 C ATOM 2023 CD1 PHE A 129 1.176 4.083 0.852 1.00 0.00 C ATOM 2024 CD2 PHE A 129 3.371 3.894 1.878 1.00 0.00 C ATOM 2025 CE1 PHE A 129 1.064 2.681 0.836 1.00 0.00 C ATOM 2026 CE2 PHE A 129 3.261 2.493 1.857 1.00 0.00 C ATOM 2027 CZ PHE A 129 2.105 1.885 1.341 1.00 0.00 C ATOM 0 H PHE A 129 3.205 6.389 -1.061 1.00 0.00 H new ATOM 0 HA PHE A 129 0.697 6.944 0.406 1.00 0.00 H new ATOM 0 HB2 PHE A 129 3.532 6.460 1.418 1.00 0.00 H new ATOM 0 HB3 PHE A 129 2.076 6.558 2.387 1.00 0.00 H new ATOM 0 HD1 PHE A 129 0.373 4.691 0.462 1.00 0.00 H new ATOM 0 HD2 PHE A 129 4.259 4.356 2.283 1.00 0.00 H new ATOM 0 HE1 PHE A 129 0.176 2.216 0.435 1.00 0.00 H new ATOM 0 HE2 PHE A 129 4.067 1.883 2.238 1.00 0.00 H new ATOM 0 HZ PHE A 129 2.017 0.809 1.333 1.00 0.00 H new ATOM 2037 N GLU A 130 1.214 9.317 1.009 1.00 0.00 N ATOM 2038 CA GLU A 130 1.401 10.745 1.300 1.00 0.00 C ATOM 2039 C GLU A 130 0.632 11.119 2.574 1.00 0.00 C ATOM 2040 O GLU A 130 -0.531 10.753 2.700 1.00 0.00 O ATOM 2041 CB GLU A 130 0.861 11.597 0.130 1.00 0.00 C ATOM 2042 CG GLU A 130 1.923 11.880 -0.939 1.00 0.00 C ATOM 2043 CD GLU A 130 1.411 12.910 -1.958 1.00 0.00 C ATOM 2044 OE1 GLU A 130 1.427 14.126 -1.652 1.00 0.00 O ATOM 2045 OE2 GLU A 130 0.998 12.518 -3.075 1.00 0.00 O ATOM 0 H GLU A 130 0.299 8.972 1.299 1.00 0.00 H new ATOM 0 HA GLU A 130 2.465 10.937 1.436 1.00 0.00 H new ATOM 0 HB2 GLU A 130 0.018 11.082 -0.330 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.483 12.542 0.519 1.00 0.00 H new ATOM 0 HG2 GLU A 130 2.832 12.251 -0.466 1.00 0.00 H new ATOM 0 HG3 GLU A 130 2.185 10.954 -1.451 1.00 0.00 H new ATOM 2052 N VAL A 131 1.227 11.879 3.500 1.00 0.00 N ATOM 2053 CA VAL A 131 0.496 12.380 4.685 1.00 0.00 C ATOM 2054 C VAL A 131 -0.450 13.497 4.239 1.00 0.00 C ATOM 2055 O VAL A 131 0.005 14.532 3.751 1.00 0.00 O ATOM 2056 CB VAL A 131 1.415 12.883 5.823 1.00 0.00 C ATOM 2057 CG1 VAL A 131 0.588 13.331 7.043 1.00 0.00 C ATOM 2058 CG2 VAL A 131 2.393 11.788 6.263 1.00 0.00 C ATOM 0 H VAL A 131 2.206 12.163 3.459 1.00 0.00 H new ATOM 0 HA VAL A 131 -0.056 11.538 5.104 1.00 0.00 H new ATOM 0 HB VAL A 131 1.975 13.733 5.433 1.00 0.00 H new ATOM 0 HG11 VAL A 131 1.258 13.680 7.829 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -0.082 14.140 6.751 1.00 0.00 H new ATOM 0 HG13 VAL A 131 0.001 12.490 7.414 1.00 0.00 H new ATOM 0 HG21 VAL A 131 3.028 12.167 7.064 1.00 0.00 H new ATOM 0 HG22 VAL A 131 1.834 10.924 6.621 1.00 0.00 H new ATOM 0 HG23 VAL A 131 3.014 11.493 5.417 1.00 0.00 H new ATOM 2068 N VAL A 132 -1.756 13.284 4.419 1.00 0.00 N ATOM 2069 CA VAL A 132 -2.800 14.268 4.070 1.00 0.00 C ATOM 2070 C VAL A 132 -3.227 15.131 5.271 1.00 0.00 C ATOM 2071 O VAL A 132 -3.673 16.261 5.077 1.00 0.00 O ATOM 2072 CB VAL A 132 -4.001 13.593 3.366 1.00 0.00 C ATOM 2073 CG1 VAL A 132 -4.966 12.871 4.299 1.00 0.00 C ATOM 2074 CG2 VAL A 132 -4.762 14.579 2.466 1.00 0.00 C ATOM 0 H VAL A 132 -2.128 12.420 4.813 1.00 0.00 H new ATOM 0 HA VAL A 132 -2.358 14.960 3.353 1.00 0.00 H new ATOM 0 HB VAL A 132 -3.549 12.817 2.748 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -5.774 12.430 3.716 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -4.434 12.085 4.835 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -5.381 13.581 5.014 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -5.598 14.066 1.990 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -5.139 15.405 3.069 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -4.090 14.966 1.700 1.00 0.00 H new ATOM 2084 N MET A 133 -3.050 14.628 6.503 1.00 0.00 N ATOM 2085 CA MET A 133 -3.390 15.314 7.760 1.00 0.00 C ATOM 2086 C MET A 133 -2.735 14.601 8.954 1.00 0.00 C ATOM 2087 O MET A 133 -2.776 13.376 9.043 1.00 0.00 O ATOM 2088 CB MET A 133 -4.927 15.402 7.889 1.00 0.00 C ATOM 2089 CG MET A 133 -5.418 15.973 9.222 1.00 0.00 C ATOM 2090 SD MET A 133 -4.862 17.664 9.569 1.00 0.00 S ATOM 2091 CE MET A 133 -5.688 17.907 11.160 1.00 0.00 C ATOM 0 H MET A 133 -2.653 13.701 6.657 1.00 0.00 H new ATOM 0 HA MET A 133 -2.997 16.331 7.753 1.00 0.00 H new ATOM 0 HB2 MET A 133 -5.313 16.021 7.079 1.00 0.00 H new ATOM 0 HB3 MET A 133 -5.348 14.405 7.757 1.00 0.00 H new ATOM 0 HG2 MET A 133 -6.508 15.954 9.231 1.00 0.00 H new ATOM 0 HG3 MET A 133 -5.081 15.321 10.028 1.00 0.00 H new ATOM 0 HE1 MET A 133 -5.462 18.904 11.539 1.00 0.00 H new ATOM 0 HE2 MET A 133 -6.765 17.803 11.030 1.00 0.00 H new ATOM 0 HE3 MET A 133 -5.335 17.160 11.871 1.00 0.00 H new ATOM 2101 N GLU A 134 -2.130 15.347 9.880 1.00 0.00 N ATOM 2102 CA GLU A 134 -1.472 14.790 11.070 1.00 0.00 C ATOM 2103 C GLU A 134 -2.446 14.731 12.262 1.00 0.00 C ATOM 2104 O GLU A 134 -3.109 15.725 12.581 1.00 0.00 O ATOM 2105 CB GLU A 134 -0.224 15.626 11.397 1.00 0.00 C ATOM 2106 CG GLU A 134 0.615 15.016 12.524 1.00 0.00 C ATOM 2107 CD GLU A 134 1.885 15.844 12.767 1.00 0.00 C ATOM 2108 OE1 GLU A 134 1.834 16.825 13.549 1.00 0.00 O ATOM 2109 OE2 GLU A 134 2.945 15.523 12.180 1.00 0.00 O ATOM 0 H GLU A 134 -2.081 16.364 9.827 1.00 0.00 H new ATOM 0 HA GLU A 134 -1.161 13.765 10.865 1.00 0.00 H new ATOM 0 HB2 GLU A 134 0.391 15.720 10.502 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -0.530 16.633 11.681 1.00 0.00 H new ATOM 0 HG2 GLU A 134 0.025 14.970 13.439 1.00 0.00 H new ATOM 0 HG3 GLU A 134 0.886 13.992 12.268 1.00 0.00 H new ATOM 2116 N LYS A 135 -2.521 13.564 12.919 1.00 0.00 N ATOM 2117 CA LYS A 135 -3.362 13.304 14.105 1.00 0.00 C ATOM 2118 C LYS A 135 -2.577 13.257 15.430 1.00 0.00 C ATOM 2119 O LYS A 135 -3.205 13.508 16.485 1.00 0.00 O ATOM 2120 CB LYS A 135 -4.168 12.010 13.878 1.00 0.00 C ATOM 2121 CG LYS A 135 -5.300 12.172 12.843 1.00 0.00 C ATOM 2122 CD LYS A 135 -6.452 13.054 13.364 1.00 0.00 C ATOM 2123 CE LYS A 135 -7.600 13.153 12.350 1.00 0.00 C ATOM 2124 NZ LYS A 135 -8.682 14.057 12.838 1.00 0.00 N ATOM 2125 OXT LYS A 135 -1.349 13.006 15.430 1.00 0.00 O ATOM 0 H LYS A 135 -1.982 12.747 12.633 1.00 0.00 H new ATOM 0 HA LYS A 135 -4.040 14.150 14.215 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -3.492 11.222 13.547 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -4.596 11.685 14.826 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -4.895 12.610 11.931 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -5.690 11.189 12.578 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -6.829 12.643 14.300 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -6.074 14.053 13.583 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -7.216 13.523 11.399 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -8.010 12.160 12.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -9.442 14.102 12.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -9.064 13.690 13.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -8.295 15.010 12.992 1.00 0.00 H new TER 2139 LYS A 135