USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 832 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 39 LYS NZ :NH3+ -169:sc= -1.4! (180deg=0) USER MOD Set 1.2: A 41 ASN : amide:sc= -3.89! C(o=-5.3!,f=-29!) USER MOD Set 2.1: A 26 THR OG1 : rot -59:sc= 2.22 USER MOD Set 2.2: A 28 SER OG : rot 94:sc= 0.11 USER MOD Set 3.1: A 13 TYR OH : rot 63:sc= 1.42 USER MOD Set 3.2: A 19 LYS NZ :NH3+ -132:sc= 0.247! (180deg=0) USER MOD Single : A 5 ASN : amide:sc= 0.381 K(o=0.38,f=-6.3!) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.234 USER MOD Single : A 15 GLN : amide:sc= 0.124 K(o=0.12,f=-4.8!) USER MOD Single : A 16 THR OG1 : rot 110:sc= 1.04 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 23 ASN : amide:sc= -0.706 K(o=-0.71,f=-5.3!) USER MOD Single : A 24 TYR OH : rot 24:sc= 0.939 USER MOD Single : A 27 LYS NZ :NH3+ -153:sc= 0.304! (180deg=-1.15!) USER MOD Single : A 31 GLN : amide:sc= -1.45 X(o=-1.4,f=-1.8) USER MOD Single : A 38 SER OG : rot 68:sc= 0.653 USER MOD Single : A 49 LYS NZ :NH3+ 157:sc= -0.0796 (180deg=-1.06!) USER MOD Single : A 50 SER OG : rot -52:sc= 0.0168 USER MOD Single : A 57 SER OG : rot 33:sc= -1.79! USER MOD Single : A 58 ASN : amide:sc= -1.9 K(o=-1.9,f=-7.3!) USER MOD Single : A 62 LYS NZ :NH3+ -173:sc= -4.6! (180deg=-5.94!) USER MOD Single : A 66 LYS NZ :NH3+ -168:sc= 0.494! (180deg=0.268!) USER MOD Single : A 67 SER OG : rot 77:sc= 1.07 USER MOD Single : A 70 THR OG1 : rot 180:sc=-0.00898 USER MOD Single : A 77 ASN : amide:sc= 0.186 X(o=0.19,f=-0.18) USER MOD Single : A 78 TYR OH : rot 168:sc= 0.322 USER MOD Single : A 79 THR OG1 : rot -68:sc= -0.284! USER MOD Single : A 80 SER OG : rot 180:sc= -0.0399 USER MOD Single : A 84 ASN : amide:sc= 0.965 K(o=0.97,f=-14!) USER MOD Single : A 85 SER OG : rot 97:sc= 0.504 USER MOD Single : A 90 TYR OH : rot 63:sc= -0.955 USER MOD Single : A 91 SER OG : rot 130:sc= 1.18 USER MOD Single : A 92 SER OG : rot 110:sc= 0.985 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ 160:sc= -1.37! (180deg=-3.08!) USER MOD Single : A 99 THR OG1 : rot 96:sc= -0.369 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 TYR OH : rot 0:sc= -1.7! USER MOD Single : A 104 GLN : amide:sc= 0.268 K(o=0.27,f=-0.3) USER MOD Single : A 105 THR OG1 : rot -103:sc= 0.907 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ -152:sc= -1.18! (180deg=-2.89!) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 3 13.681 16.751 37.912 1.00 0.00 N ATOM 2 CA VAL A 3 13.614 16.152 39.274 1.00 0.00 C ATOM 3 C VAL A 3 14.537 14.936 39.326 1.00 0.00 C ATOM 4 O VAL A 3 14.320 13.964 38.635 1.00 0.00 O ATOM 5 CB VAL A 3 12.168 15.736 39.576 1.00 0.00 C ATOM 6 CG1 VAL A 3 12.044 15.229 41.017 1.00 0.00 C ATOM 7 CG2 VAL A 3 11.264 16.955 39.395 1.00 0.00 C ATOM 0 HA VAL A 3 13.934 16.878 40.021 1.00 0.00 H new ATOM 0 HB VAL A 3 11.875 14.935 38.897 1.00 0.00 H new ATOM 0 HG11 VAL A 3 11.012 14.939 41.213 1.00 0.00 H new ATOM 0 HG12 VAL A 3 12.696 14.367 41.157 1.00 0.00 H new ATOM 0 HG13 VAL A 3 12.336 16.020 41.708 1.00 0.00 H new ATOM 0 HG21 VAL A 3 10.231 16.677 39.606 1.00 0.00 H new ATOM 0 HG22 VAL A 3 11.575 17.743 40.081 1.00 0.00 H new ATOM 0 HG23 VAL A 3 11.340 17.315 38.369 1.00 0.00 H new ATOM 17 N ILE A 4 15.585 15.004 40.121 1.00 0.00 N ATOM 18 CA ILE A 4 16.558 13.862 40.213 1.00 0.00 C ATOM 19 C ILE A 4 17.545 14.128 41.369 1.00 0.00 C ATOM 20 O ILE A 4 17.682 15.250 41.806 1.00 0.00 O ATOM 21 CB ILE A 4 17.303 13.735 38.876 1.00 0.00 C ATOM 22 CG1 ILE A 4 17.450 12.254 38.534 1.00 0.00 C ATOM 23 CG2 ILE A 4 18.683 14.384 38.973 1.00 0.00 C ATOM 24 CD1 ILE A 4 18.173 12.116 37.189 1.00 0.00 C ATOM 0 H ILE A 4 15.808 15.805 40.712 1.00 0.00 H new ATOM 0 HA ILE A 4 16.033 12.928 40.414 1.00 0.00 H new ATOM 0 HB ILE A 4 16.737 14.244 38.095 1.00 0.00 H new ATOM 0 HG12 ILE A 4 18.011 11.742 39.316 1.00 0.00 H new ATOM 0 HG13 ILE A 4 16.469 11.781 38.483 1.00 0.00 H new ATOM 0 HG21 ILE A 4 19.199 14.286 38.018 1.00 0.00 H new ATOM 0 HG22 ILE A 4 18.572 15.440 39.219 1.00 0.00 H new ATOM 0 HG23 ILE A 4 19.264 13.889 39.752 1.00 0.00 H new ATOM 0 HD11 ILE A 4 18.280 11.060 36.940 1.00 0.00 H new ATOM 0 HD12 ILE A 4 17.594 12.615 36.412 1.00 0.00 H new ATOM 0 HD13 ILE A 4 19.159 12.575 37.257 1.00 0.00 H new ATOM 36 N ASN A 5 18.211 13.125 41.894 1.00 0.00 N ATOM 37 CA ASN A 5 19.136 13.378 43.038 1.00 0.00 C ATOM 38 C ASN A 5 20.339 12.430 42.979 1.00 0.00 C ATOM 39 O ASN A 5 20.882 12.043 44.012 1.00 0.00 O ATOM 40 CB ASN A 5 18.378 13.113 44.332 1.00 0.00 C ATOM 41 CG ASN A 5 17.793 11.693 44.295 1.00 0.00 C ATOM 42 OD1 ASN A 5 17.998 10.945 43.349 1.00 0.00 O ATOM 43 ND2 ASN A 5 17.091 11.270 45.308 1.00 0.00 N ATOM 0 H ASN A 5 18.153 12.155 41.582 1.00 0.00 H new ATOM 0 HA ASN A 5 19.492 14.407 42.990 1.00 0.00 H new ATOM 0 HB2 ASN A 5 19.045 13.222 45.187 1.00 0.00 H new ATOM 0 HB3 ASN A 5 17.580 13.845 44.456 1.00 0.00 H new ATOM 0 HD21 ASN A 5 16.717 10.321 45.308 1.00 0.00 H new ATOM 0 HD22 ASN A 5 16.916 11.888 46.101 1.00 0.00 H new ATOM 50 N THR A 6 20.731 12.015 41.801 1.00 0.00 N ATOM 51 CA THR A 6 21.881 11.062 41.691 1.00 0.00 C ATOM 52 C THR A 6 23.124 11.812 41.183 1.00 0.00 C ATOM 53 O THR A 6 23.030 12.842 40.537 1.00 0.00 O ATOM 54 CB THR A 6 21.533 9.929 40.714 1.00 0.00 C ATOM 55 OG1 THR A 6 21.525 10.429 39.392 1.00 0.00 O ATOM 56 CG2 THR A 6 20.158 9.337 41.037 1.00 0.00 C ATOM 0 H THR A 6 20.309 12.292 40.915 1.00 0.00 H new ATOM 0 HA THR A 6 22.086 10.637 42.674 1.00 0.00 H new ATOM 0 HB THR A 6 22.285 9.146 40.812 1.00 0.00 H new ATOM 0 HG1 THR A 6 21.305 9.705 38.770 1.00 0.00 H new ATOM 0 HG21 THR A 6 19.932 8.536 40.333 1.00 0.00 H new ATOM 0 HG22 THR A 6 20.163 8.937 42.051 1.00 0.00 H new ATOM 0 HG23 THR A 6 19.399 10.115 40.957 1.00 0.00 H new ATOM 64 N PHE A 7 24.295 11.289 41.446 1.00 0.00 N ATOM 65 CA PHE A 7 25.551 11.977 40.985 1.00 0.00 C ATOM 66 C PHE A 7 25.560 12.108 39.450 1.00 0.00 C ATOM 67 O PHE A 7 25.573 13.203 38.924 1.00 0.00 O ATOM 68 CB PHE A 7 26.804 11.197 41.428 1.00 0.00 C ATOM 69 CG PHE A 7 26.526 9.716 41.429 1.00 0.00 C ATOM 70 CD1 PHE A 7 25.788 9.138 42.473 1.00 0.00 C ATOM 71 CD2 PHE A 7 27.017 8.913 40.395 1.00 0.00 C ATOM 72 CE1 PHE A 7 25.554 7.761 42.481 1.00 0.00 C ATOM 73 CE2 PHE A 7 26.776 7.538 40.403 1.00 0.00 C ATOM 74 CZ PHE A 7 26.045 6.962 41.446 1.00 0.00 C ATOM 0 H PHE A 7 24.441 10.419 41.958 1.00 0.00 H new ATOM 0 HA PHE A 7 25.569 12.968 41.439 1.00 0.00 H new ATOM 0 HB2 PHE A 7 27.634 11.417 40.757 1.00 0.00 H new ATOM 0 HB3 PHE A 7 27.107 11.518 42.425 1.00 0.00 H new ATOM 0 HD1 PHE A 7 25.401 9.757 43.269 1.00 0.00 H new ATOM 0 HD2 PHE A 7 27.583 9.357 39.589 1.00 0.00 H new ATOM 0 HE1 PHE A 7 24.993 7.314 43.288 1.00 0.00 H new ATOM 0 HE2 PHE A 7 27.154 6.919 39.603 1.00 0.00 H new ATOM 0 HZ PHE A 7 25.860 5.898 41.452 1.00 0.00 H new ATOM 84 N ASP A 8 25.547 11.007 38.727 1.00 0.00 N ATOM 85 CA ASP A 8 25.566 11.087 37.226 1.00 0.00 C ATOM 86 C ASP A 8 24.372 11.910 36.749 1.00 0.00 C ATOM 87 O ASP A 8 24.481 12.721 35.850 1.00 0.00 O ATOM 88 CB ASP A 8 25.498 9.663 36.652 1.00 0.00 C ATOM 89 CG ASP A 8 26.913 9.180 36.335 1.00 0.00 C ATOM 90 OD1 ASP A 8 27.768 9.325 37.184 1.00 0.00 O ATOM 91 OD2 ASP A 8 27.122 8.695 35.238 1.00 0.00 O ATOM 0 H ASP A 8 25.524 10.062 39.109 1.00 0.00 H new ATOM 0 HA ASP A 8 26.482 11.568 36.885 1.00 0.00 H new ATOM 0 HB2 ASP A 8 25.024 8.992 37.368 1.00 0.00 H new ATOM 0 HB3 ASP A 8 24.886 9.651 35.750 1.00 0.00 H new ATOM 96 N GLY A 9 23.237 11.715 37.360 1.00 0.00 N ATOM 97 CA GLY A 9 22.025 12.476 36.974 1.00 0.00 C ATOM 98 C GLY A 9 22.292 13.980 37.118 1.00 0.00 C ATOM 99 O GLY A 9 21.985 14.761 36.236 1.00 0.00 O ATOM 0 H GLY A 9 23.100 11.050 38.121 1.00 0.00 H new ATOM 0 HA2 GLY A 9 21.749 12.242 35.946 1.00 0.00 H new ATOM 0 HA3 GLY A 9 21.184 12.184 37.604 1.00 0.00 H new ATOM 103 N VAL A 10 22.895 14.385 38.209 1.00 0.00 N ATOM 104 CA VAL A 10 23.210 15.827 38.398 1.00 0.00 C ATOM 105 C VAL A 10 24.258 16.252 37.367 1.00 0.00 C ATOM 106 O VAL A 10 24.166 17.310 36.761 1.00 0.00 O ATOM 107 CB VAL A 10 23.747 16.038 39.806 1.00 0.00 C ATOM 108 CG1 VAL A 10 24.256 17.467 39.914 1.00 0.00 C ATOM 109 CG2 VAL A 10 22.618 15.821 40.827 1.00 0.00 C ATOM 0 H VAL A 10 23.181 13.775 38.975 1.00 0.00 H new ATOM 0 HA VAL A 10 22.311 16.428 38.262 1.00 0.00 H new ATOM 0 HB VAL A 10 24.552 15.332 40.010 1.00 0.00 H new ATOM 0 HG11 VAL A 10 24.646 17.640 40.917 1.00 0.00 H new ATOM 0 HG12 VAL A 10 25.049 17.627 39.184 1.00 0.00 H new ATOM 0 HG13 VAL A 10 23.438 18.160 39.719 1.00 0.00 H new ATOM 0 HG21 VAL A 10 23.005 15.973 41.835 1.00 0.00 H new ATOM 0 HG22 VAL A 10 21.814 16.531 40.636 1.00 0.00 H new ATOM 0 HG23 VAL A 10 22.234 14.805 40.735 1.00 0.00 H new ATOM 119 N ALA A 11 25.230 15.406 37.132 1.00 0.00 N ATOM 120 CA ALA A 11 26.280 15.718 36.125 1.00 0.00 C ATOM 121 C ALA A 11 25.643 15.834 34.752 1.00 0.00 C ATOM 122 O ALA A 11 25.762 16.856 34.097 1.00 0.00 O ATOM 123 CB ALA A 11 27.329 14.613 36.072 1.00 0.00 C ATOM 0 H ALA A 11 25.338 14.506 37.601 1.00 0.00 H new ATOM 0 HA ALA A 11 26.757 16.655 36.412 1.00 0.00 H new ATOM 0 HB1 ALA A 11 28.085 14.865 35.329 1.00 0.00 H new ATOM 0 HB2 ALA A 11 27.801 14.512 37.049 1.00 0.00 H new ATOM 0 HB3 ALA A 11 26.852 13.671 35.800 1.00 0.00 H new ATOM 129 N ASP A 12 24.968 14.798 34.304 1.00 0.00 N ATOM 130 CA ASP A 12 24.321 14.856 32.963 1.00 0.00 C ATOM 131 C ASP A 12 23.470 16.114 32.884 1.00 0.00 C ATOM 132 O ASP A 12 23.585 16.899 31.959 1.00 0.00 O ATOM 133 CB ASP A 12 23.401 13.650 32.770 1.00 0.00 C ATOM 134 CG ASP A 12 24.150 12.549 32.039 1.00 0.00 C ATOM 135 OD1 ASP A 12 25.246 12.223 32.477 1.00 0.00 O ATOM 136 OD2 ASP A 12 23.617 12.046 31.063 1.00 0.00 O ATOM 0 H ASP A 12 24.841 13.922 34.811 1.00 0.00 H new ATOM 0 HA ASP A 12 25.095 14.856 32.195 1.00 0.00 H new ATOM 0 HB2 ASP A 12 23.053 13.287 33.737 1.00 0.00 H new ATOM 0 HB3 ASP A 12 22.517 13.941 32.202 1.00 0.00 H new ATOM 141 N TYR A 13 22.607 16.307 33.854 1.00 0.00 N ATOM 142 CA TYR A 13 21.724 17.512 33.876 1.00 0.00 C ATOM 143 C TYR A 13 22.554 18.811 33.876 1.00 0.00 C ATOM 144 O TYR A 13 22.327 19.711 33.079 1.00 0.00 O ATOM 145 CB TYR A 13 20.889 17.436 35.134 1.00 0.00 C ATOM 146 CG TYR A 13 19.721 18.394 35.055 1.00 0.00 C ATOM 147 CD1 TYR A 13 18.512 17.998 34.485 1.00 0.00 C ATOM 148 CD2 TYR A 13 19.850 19.673 35.601 1.00 0.00 C ATOM 149 CE1 TYR A 13 17.431 18.889 34.451 1.00 0.00 C ATOM 150 CE2 TYR A 13 18.768 20.570 35.580 1.00 0.00 C ATOM 151 CZ TYR A 13 17.554 20.177 35.003 1.00 0.00 C ATOM 152 OH TYR A 13 16.486 21.045 34.977 1.00 0.00 O ATOM 0 H TYR A 13 22.477 15.671 34.641 1.00 0.00 H new ATOM 0 HA TYR A 13 21.095 17.527 32.986 1.00 0.00 H new ATOM 0 HB2 TYR A 13 20.523 16.419 35.274 1.00 0.00 H new ATOM 0 HB3 TYR A 13 21.505 17.675 36.001 1.00 0.00 H new ATOM 0 HD1 TYR A 13 18.409 17.006 34.070 1.00 0.00 H new ATOM 0 HD2 TYR A 13 20.788 19.975 36.043 1.00 0.00 H new ATOM 0 HE1 TYR A 13 16.499 18.585 33.999 1.00 0.00 H new ATOM 0 HE2 TYR A 13 18.872 21.557 36.006 1.00 0.00 H new ATOM 0 HH TYR A 13 15.750 20.674 35.507 1.00 0.00 H new ATOM 162 N LEU A 14 23.523 18.900 34.753 1.00 0.00 N ATOM 163 CA LEU A 14 24.399 20.108 34.821 1.00 0.00 C ATOM 164 C LEU A 14 25.361 20.154 33.616 1.00 0.00 C ATOM 165 O LEU A 14 25.532 21.193 33.000 1.00 0.00 O ATOM 166 CB LEU A 14 25.207 20.061 36.125 1.00 0.00 C ATOM 167 CG LEU A 14 26.100 21.309 36.215 1.00 0.00 C ATOM 168 CD1 LEU A 14 25.864 22.021 37.534 1.00 0.00 C ATOM 169 CD2 LEU A 14 27.573 20.911 36.128 1.00 0.00 C ATOM 0 H LEU A 14 23.746 18.175 35.435 1.00 0.00 H new ATOM 0 HA LEU A 14 23.776 21.002 34.796 1.00 0.00 H new ATOM 0 HB2 LEU A 14 24.534 20.019 36.982 1.00 0.00 H new ATOM 0 HB3 LEU A 14 25.819 19.159 36.155 1.00 0.00 H new ATOM 0 HG LEU A 14 25.850 21.972 35.387 1.00 0.00 H new ATOM 0 HD11 LEU A 14 26.501 22.904 37.590 1.00 0.00 H new ATOM 0 HD12 LEU A 14 24.819 22.322 37.603 1.00 0.00 H new ATOM 0 HD13 LEU A 14 26.103 21.349 38.358 1.00 0.00 H new ATOM 0 HD21 LEU A 14 28.195 21.803 36.193 1.00 0.00 H new ATOM 0 HD22 LEU A 14 27.817 20.238 36.950 1.00 0.00 H new ATOM 0 HD23 LEU A 14 27.758 20.408 35.179 1.00 0.00 H new ATOM 181 N GLN A 15 26.007 19.061 33.269 1.00 0.00 N ATOM 182 CA GLN A 15 26.940 19.104 32.105 1.00 0.00 C ATOM 183 C GLN A 15 26.179 19.483 30.811 1.00 0.00 C ATOM 184 O GLN A 15 26.777 19.917 29.856 1.00 0.00 O ATOM 185 CB GLN A 15 27.621 17.733 31.942 1.00 0.00 C ATOM 186 CG GLN A 15 28.735 17.586 32.999 1.00 0.00 C ATOM 187 CD GLN A 15 29.499 16.292 32.768 1.00 0.00 C ATOM 188 OE1 GLN A 15 29.022 15.220 33.077 1.00 0.00 O ATOM 189 NE2 GLN A 15 30.665 16.340 32.195 1.00 0.00 N ATOM 0 H GLN A 15 25.927 18.158 33.736 1.00 0.00 H new ATOM 0 HA GLN A 15 27.700 19.864 32.287 1.00 0.00 H new ATOM 0 HB2 GLN A 15 26.888 16.934 32.057 1.00 0.00 H new ATOM 0 HB3 GLN A 15 28.040 17.640 30.940 1.00 0.00 H new ATOM 0 HG2 GLN A 15 29.416 18.435 32.943 1.00 0.00 H new ATOM 0 HG3 GLN A 15 28.302 17.589 33.999 1.00 0.00 H new ATOM 0 HE21 GLN A 15 31.068 17.240 31.934 1.00 0.00 H new ATOM 0 HE22 GLN A 15 31.176 15.478 32.006 1.00 0.00 H new ATOM 198 N THR A 16 24.885 19.326 30.766 1.00 0.00 N ATOM 199 CA THR A 16 24.108 19.663 29.532 1.00 0.00 C ATOM 200 C THR A 16 23.471 21.066 29.639 1.00 0.00 C ATOM 201 O THR A 16 23.405 21.818 28.682 1.00 0.00 O ATOM 202 CB THR A 16 22.992 18.617 29.374 1.00 0.00 C ATOM 203 OG1 THR A 16 23.534 17.319 29.559 1.00 0.00 O ATOM 204 CG2 THR A 16 22.389 18.726 27.976 1.00 0.00 C ATOM 0 H THR A 16 24.322 18.974 31.541 1.00 0.00 H new ATOM 0 HA THR A 16 24.780 19.660 28.674 1.00 0.00 H new ATOM 0 HB THR A 16 22.215 18.795 30.118 1.00 0.00 H new ATOM 0 HG1 THR A 16 23.209 16.946 30.405 1.00 0.00 H new ATOM 0 HG21 THR A 16 21.598 17.985 27.862 1.00 0.00 H new ATOM 0 HG22 THR A 16 21.974 19.724 27.835 1.00 0.00 H new ATOM 0 HG23 THR A 16 23.164 18.547 27.231 1.00 0.00 H new ATOM 212 N TYR A 17 22.955 21.399 30.782 1.00 0.00 N ATOM 213 CA TYR A 17 22.268 22.725 30.941 1.00 0.00 C ATOM 214 C TYR A 17 23.070 23.675 31.835 1.00 0.00 C ATOM 215 O TYR A 17 22.550 24.682 32.284 1.00 0.00 O ATOM 216 CB TYR A 17 20.897 22.489 31.558 1.00 0.00 C ATOM 217 CG TYR A 17 20.069 21.645 30.632 1.00 0.00 C ATOM 218 CD1 TYR A 17 19.295 22.258 29.613 1.00 0.00 C ATOM 219 CD2 TYR A 17 20.037 20.245 30.802 1.00 0.00 C ATOM 220 CE1 TYR A 17 18.490 21.457 28.768 1.00 0.00 C ATOM 221 CE2 TYR A 17 19.238 19.462 29.955 1.00 0.00 C ATOM 222 CZ TYR A 17 18.465 20.064 28.944 1.00 0.00 C ATOM 223 OH TYR A 17 17.698 19.276 28.112 1.00 0.00 O ATOM 0 H TYR A 17 22.974 20.817 31.620 1.00 0.00 H new ATOM 0 HA TYR A 17 22.179 23.189 29.959 1.00 0.00 H new ATOM 0 HB2 TYR A 17 21.001 21.993 32.523 1.00 0.00 H new ATOM 0 HB3 TYR A 17 20.400 23.442 31.741 1.00 0.00 H new ATOM 0 HD1 TYR A 17 19.320 23.330 29.483 1.00 0.00 H new ATOM 0 HD2 TYR A 17 20.624 19.779 31.579 1.00 0.00 H new ATOM 0 HE1 TYR A 17 17.897 21.916 27.991 1.00 0.00 H new ATOM 0 HE2 TYR A 17 19.216 18.389 30.080 1.00 0.00 H new ATOM 0 HH TYR A 17 17.796 18.336 28.370 1.00 0.00 H new ATOM 233 N HIS A 18 24.331 23.392 32.073 1.00 0.00 N ATOM 234 CA HIS A 18 25.178 24.308 32.913 1.00 0.00 C ATOM 235 C HIS A 18 24.428 24.725 34.181 1.00 0.00 C ATOM 236 O HIS A 18 24.707 25.753 34.770 1.00 0.00 O ATOM 237 CB HIS A 18 25.552 25.569 32.096 1.00 0.00 C ATOM 238 CG HIS A 18 26.790 25.300 31.277 1.00 0.00 C ATOM 239 ND1 HIS A 18 26.779 24.471 30.171 1.00 0.00 N ATOM 240 CD2 HIS A 18 28.087 25.745 31.397 1.00 0.00 C ATOM 241 CE1 HIS A 18 28.028 24.443 29.673 1.00 0.00 C ATOM 242 NE2 HIS A 18 28.865 25.199 30.384 1.00 0.00 N ATOM 0 H HIS A 18 24.813 22.564 31.722 1.00 0.00 H new ATOM 0 HA HIS A 18 26.084 23.775 33.201 1.00 0.00 H new ATOM 0 HB2 HIS A 18 24.726 25.848 31.442 1.00 0.00 H new ATOM 0 HB3 HIS A 18 25.725 26.410 32.767 1.00 0.00 H new ATOM 0 HD2 HIS A 18 28.445 26.417 32.163 1.00 0.00 H new ATOM 0 HE1 HIS A 18 28.318 23.876 28.801 1.00 0.00 H new ATOM 0 HE2 HIS A 18 29.861 25.345 30.220 1.00 0.00 H new ATOM 250 N LYS A 19 23.492 23.928 34.604 1.00 0.00 N ATOM 251 CA LYS A 19 22.712 24.267 35.832 1.00 0.00 C ATOM 252 C LYS A 19 22.416 23.003 36.646 1.00 0.00 C ATOM 253 O LYS A 19 22.322 21.905 36.116 1.00 0.00 O ATOM 254 CB LYS A 19 21.394 24.929 35.440 1.00 0.00 C ATOM 255 CG LYS A 19 20.390 23.859 34.985 1.00 0.00 C ATOM 256 CD LYS A 19 19.127 24.505 34.365 1.00 0.00 C ATOM 257 CE LYS A 19 18.266 23.381 33.726 1.00 0.00 C ATOM 258 NZ LYS A 19 17.005 23.268 34.515 1.00 0.00 N ATOM 0 H LYS A 19 23.229 23.052 34.153 1.00 0.00 H new ATOM 0 HA LYS A 19 23.304 24.952 36.439 1.00 0.00 H new ATOM 0 HB2 LYS A 19 20.989 25.484 36.286 1.00 0.00 H new ATOM 0 HB3 LYS A 19 21.562 25.648 34.638 1.00 0.00 H new ATOM 0 HG2 LYS A 19 20.861 23.201 34.255 1.00 0.00 H new ATOM 0 HG3 LYS A 19 20.105 23.239 35.835 1.00 0.00 H new ATOM 0 HD2 LYS A 19 18.556 25.032 35.130 1.00 0.00 H new ATOM 0 HD3 LYS A 19 19.408 25.242 33.613 1.00 0.00 H new ATOM 0 HE2 LYS A 19 18.045 23.614 32.684 1.00 0.00 H new ATOM 0 HE3 LYS A 19 18.807 22.435 33.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 16.824 22.269 34.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 17.098 23.810 35.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 16.212 23.646 33.958 1.00 0.00 H new ATOM 272 N LEU A 20 22.223 23.166 37.933 1.00 0.00 N ATOM 273 CA LEU A 20 21.916 22.003 38.810 1.00 0.00 C ATOM 274 C LEU A 20 20.442 21.592 38.630 1.00 0.00 C ATOM 275 O LEU A 20 19.583 22.412 38.377 1.00 0.00 O ATOM 276 CB LEU A 20 22.160 22.422 40.271 1.00 0.00 C ATOM 277 CG LEU A 20 23.651 22.690 40.515 1.00 0.00 C ATOM 278 CD1 LEU A 20 23.969 24.163 40.242 1.00 0.00 C ATOM 279 CD2 LEU A 20 24.013 22.361 41.968 1.00 0.00 C ATOM 0 H LEU A 20 22.266 24.065 38.413 1.00 0.00 H new ATOM 0 HA LEU A 20 22.552 21.157 38.549 1.00 0.00 H new ATOM 0 HB2 LEU A 20 21.582 23.317 40.499 1.00 0.00 H new ATOM 0 HB3 LEU A 20 21.811 21.638 40.943 1.00 0.00 H new ATOM 0 HG LEU A 20 24.233 22.059 39.843 1.00 0.00 H new ATOM 0 HD11 LEU A 20 25.029 24.345 40.418 1.00 0.00 H new ATOM 0 HD12 LEU A 20 23.726 24.402 39.207 1.00 0.00 H new ATOM 0 HD13 LEU A 20 23.378 24.792 40.907 1.00 0.00 H new ATOM 0 HD21 LEU A 20 25.073 22.554 42.132 1.00 0.00 H new ATOM 0 HD22 LEU A 20 23.423 22.984 42.640 1.00 0.00 H new ATOM 0 HD23 LEU A 20 23.801 21.310 42.167 1.00 0.00 H new ATOM 291 N PRO A 21 20.162 20.326 38.793 1.00 0.00 N ATOM 292 CA PRO A 21 18.787 19.762 38.662 1.00 0.00 C ATOM 293 C PRO A 21 17.707 20.647 39.249 1.00 0.00 C ATOM 294 O PRO A 21 17.939 21.387 40.188 1.00 0.00 O ATOM 295 CB PRO A 21 18.844 18.429 39.389 1.00 0.00 C ATOM 296 CG PRO A 21 20.297 18.020 39.367 1.00 0.00 C ATOM 297 CD PRO A 21 21.137 19.289 39.141 1.00 0.00 C ATOM 0 HA PRO A 21 18.516 19.668 37.610 1.00 0.00 H new ATOM 0 HB2 PRO A 21 18.478 18.524 40.411 1.00 0.00 H new ATOM 0 HB3 PRO A 21 18.219 17.685 38.895 1.00 0.00 H new ATOM 0 HG2 PRO A 21 20.574 17.541 40.306 1.00 0.00 H new ATOM 0 HG3 PRO A 21 20.478 17.295 38.573 1.00 0.00 H new ATOM 0 HD2 PRO A 21 21.697 19.557 40.037 1.00 0.00 H new ATOM 0 HD3 PRO A 21 21.864 19.145 38.342 1.00 0.00 H new ATOM 305 N ASP A 22 16.538 20.604 38.648 1.00 0.00 N ATOM 306 CA ASP A 22 15.413 21.469 39.097 1.00 0.00 C ATOM 307 C ASP A 22 14.981 21.110 40.536 1.00 0.00 C ATOM 308 O ASP A 22 13.792 20.937 40.843 1.00 0.00 O ATOM 309 CB ASP A 22 14.258 21.255 38.143 1.00 0.00 C ATOM 310 CG ASP A 22 14.196 19.773 37.793 1.00 0.00 C ATOM 311 OD1 ASP A 22 13.694 19.021 38.603 1.00 0.00 O ATOM 312 OD2 ASP A 22 14.705 19.406 36.747 1.00 0.00 O ATOM 0 H ASP A 22 16.320 19.997 37.857 1.00 0.00 H new ATOM 0 HA ASP A 22 15.727 22.513 39.098 1.00 0.00 H new ATOM 0 HB2 ASP A 22 13.323 21.577 38.601 1.00 0.00 H new ATOM 0 HB3 ASP A 22 14.394 21.853 37.242 1.00 0.00 H new ATOM 317 N ASN A 23 15.933 20.984 41.424 1.00 0.00 N ATOM 318 CA ASN A 23 15.593 20.647 42.833 1.00 0.00 C ATOM 319 C ASN A 23 16.807 20.813 43.737 1.00 0.00 C ATOM 320 O ASN A 23 16.926 20.153 44.759 1.00 0.00 O ATOM 321 CB ASN A 23 15.096 19.205 42.928 1.00 0.00 C ATOM 322 CG ASN A 23 16.085 18.253 42.267 1.00 0.00 C ATOM 323 OD1 ASN A 23 15.805 17.721 41.223 1.00 0.00 O ATOM 324 ND2 ASN A 23 17.246 18.014 42.825 1.00 0.00 N ATOM 0 H ASN A 23 16.928 21.100 41.232 1.00 0.00 H new ATOM 0 HA ASN A 23 14.808 21.329 43.159 1.00 0.00 H new ATOM 0 HB2 ASN A 23 14.961 18.929 43.974 1.00 0.00 H new ATOM 0 HB3 ASN A 23 14.122 19.118 42.447 1.00 0.00 H new ATOM 0 HD21 ASN A 23 17.907 17.381 42.376 1.00 0.00 H new ATOM 0 HD22 ASN A 23 17.489 18.461 43.709 1.00 0.00 H new ATOM 331 N TYR A 24 17.712 21.670 43.370 1.00 0.00 N ATOM 332 CA TYR A 24 18.929 21.854 44.221 1.00 0.00 C ATOM 333 C TYR A 24 18.984 23.285 44.735 1.00 0.00 C ATOM 334 O TYR A 24 19.080 24.232 43.981 1.00 0.00 O ATOM 335 CB TYR A 24 20.170 21.525 43.397 1.00 0.00 C ATOM 336 CG TYR A 24 20.530 20.087 43.628 1.00 0.00 C ATOM 337 CD1 TYR A 24 21.267 19.754 44.748 1.00 0.00 C ATOM 338 CD2 TYR A 24 20.126 19.098 42.723 1.00 0.00 C ATOM 339 CE1 TYR A 24 21.621 18.432 44.973 1.00 0.00 C ATOM 340 CE2 TYR A 24 20.474 17.767 42.949 1.00 0.00 C ATOM 341 CZ TYR A 24 21.223 17.440 44.072 1.00 0.00 C ATOM 342 OH TYR A 24 21.576 16.135 44.298 1.00 0.00 O ATOM 0 H TYR A 24 17.670 22.247 42.530 1.00 0.00 H new ATOM 0 HA TYR A 24 18.889 21.184 45.080 1.00 0.00 H new ATOM 0 HB2 TYR A 24 19.979 21.702 42.339 1.00 0.00 H new ATOM 0 HB3 TYR A 24 20.998 22.173 43.684 1.00 0.00 H new ATOM 0 HD1 TYR A 24 21.567 20.521 45.447 1.00 0.00 H new ATOM 0 HD2 TYR A 24 19.546 19.366 41.852 1.00 0.00 H new ATOM 0 HE1 TYR A 24 22.204 18.169 45.844 1.00 0.00 H new ATOM 0 HE2 TYR A 24 20.164 16.998 42.257 1.00 0.00 H new ATOM 0 HH TYR A 24 21.746 16.003 45.254 1.00 0.00 H new ATOM 352 N ILE A 25 18.937 23.447 46.025 1.00 0.00 N ATOM 353 CA ILE A 25 18.993 24.815 46.613 1.00 0.00 C ATOM 354 C ILE A 25 20.222 24.901 47.532 1.00 0.00 C ATOM 355 O ILE A 25 20.531 23.961 48.261 1.00 0.00 O ATOM 356 CB ILE A 25 17.650 25.144 47.317 1.00 0.00 C ATOM 357 CG1 ILE A 25 17.448 24.287 48.579 1.00 0.00 C ATOM 358 CG2 ILE A 25 16.509 24.856 46.320 1.00 0.00 C ATOM 359 CD1 ILE A 25 16.170 24.755 49.269 1.00 0.00 C ATOM 0 H ILE A 25 18.862 22.688 46.703 1.00 0.00 H new ATOM 0 HA ILE A 25 19.114 25.577 45.843 1.00 0.00 H new ATOM 0 HB ILE A 25 17.656 26.190 47.623 1.00 0.00 H new ATOM 0 HG12 ILE A 25 17.374 23.232 48.315 1.00 0.00 H new ATOM 0 HG13 ILE A 25 18.302 24.389 49.249 1.00 0.00 H new ATOM 0 HG21 ILE A 25 15.551 25.079 46.789 1.00 0.00 H new ATOM 0 HG22 ILE A 25 16.633 25.480 45.435 1.00 0.00 H new ATOM 0 HG23 ILE A 25 16.535 23.806 46.030 1.00 0.00 H new ATOM 0 HD11 ILE A 25 16.004 24.162 50.168 1.00 0.00 H new ATOM 0 HD12 ILE A 25 16.267 25.806 49.540 1.00 0.00 H new ATOM 0 HD13 ILE A 25 15.325 24.632 48.592 1.00 0.00 H new ATOM 371 N THR A 26 20.956 26.005 47.469 1.00 0.00 N ATOM 372 CA THR A 26 22.187 26.150 48.304 1.00 0.00 C ATOM 373 C THR A 26 21.842 26.247 49.784 1.00 0.00 C ATOM 374 O THR A 26 20.682 26.421 50.188 1.00 0.00 O ATOM 375 CB THR A 26 22.955 27.427 47.878 1.00 0.00 C ATOM 376 OG1 THR A 26 22.322 28.563 48.456 1.00 0.00 O ATOM 377 CG2 THR A 26 22.964 27.583 46.345 1.00 0.00 C ATOM 0 H THR A 26 20.746 26.805 46.872 1.00 0.00 H new ATOM 0 HA THR A 26 22.807 25.267 48.149 1.00 0.00 H new ATOM 0 HB THR A 26 23.985 27.344 48.224 1.00 0.00 H new ATOM 0 HG1 THR A 26 21.390 28.606 48.156 1.00 0.00 H new ATOM 0 HG21 THR A 26 23.509 28.487 46.074 1.00 0.00 H new ATOM 0 HG22 THR A 26 23.450 26.718 45.894 1.00 0.00 H new ATOM 0 HG23 THR A 26 21.939 27.655 45.981 1.00 0.00 H new ATOM 385 N LYS A 27 22.876 26.165 50.608 1.00 0.00 N ATOM 386 CA LYS A 27 22.670 26.269 52.078 1.00 0.00 C ATOM 387 C LYS A 27 22.326 27.730 52.346 1.00 0.00 C ATOM 388 O LYS A 27 21.456 28.069 53.132 1.00 0.00 O ATOM 389 CB LYS A 27 23.957 25.890 52.830 1.00 0.00 C ATOM 390 CG LYS A 27 24.210 24.377 52.679 1.00 0.00 C ATOM 391 CD LYS A 27 25.679 24.036 52.977 1.00 0.00 C ATOM 392 CE LYS A 27 26.475 24.143 51.687 1.00 0.00 C ATOM 393 NZ LYS A 27 27.700 23.284 51.741 1.00 0.00 N ATOM 0 H LYS A 27 23.844 26.031 50.315 1.00 0.00 H new ATOM 0 HA LYS A 27 21.883 25.595 52.417 1.00 0.00 H new ATOM 0 HB2 LYS A 27 24.802 26.453 52.434 1.00 0.00 H new ATOM 0 HB3 LYS A 27 23.866 26.151 53.884 1.00 0.00 H new ATOM 0 HG2 LYS A 27 23.559 23.826 53.358 1.00 0.00 H new ATOM 0 HG3 LYS A 27 23.957 24.061 51.667 1.00 0.00 H new ATOM 0 HD2 LYS A 27 26.081 24.718 53.727 1.00 0.00 H new ATOM 0 HD3 LYS A 27 25.758 23.029 53.387 1.00 0.00 H new ATOM 0 HE2 LYS A 27 25.852 23.842 50.845 1.00 0.00 H new ATOM 0 HE3 LYS A 27 26.761 25.181 51.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 28.431 23.683 51.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 28.057 23.250 52.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 27.463 22.322 51.425 1.00 0.00 H new ATOM 407 N SER A 28 22.982 28.596 51.608 1.00 0.00 N ATOM 408 CA SER A 28 22.687 30.060 51.676 1.00 0.00 C ATOM 409 C SER A 28 21.173 30.202 51.791 1.00 0.00 C ATOM 410 O SER A 28 20.637 30.637 52.803 1.00 0.00 O ATOM 411 CB SER A 28 23.171 30.742 50.363 1.00 0.00 C ATOM 412 OG SER A 28 23.953 29.808 49.611 1.00 0.00 O ATOM 0 H SER A 28 23.721 28.343 50.952 1.00 0.00 H new ATOM 0 HA SER A 28 23.191 30.526 52.522 1.00 0.00 H new ATOM 0 HB2 SER A 28 22.316 31.076 49.775 1.00 0.00 H new ATOM 0 HB3 SER A 28 23.763 31.627 50.595 1.00 0.00 H new ATOM 0 HG SER A 28 23.380 29.352 48.959 1.00 0.00 H new ATOM 418 N GLU A 29 20.496 29.897 50.718 1.00 0.00 N ATOM 419 CA GLU A 29 19.024 30.009 50.729 1.00 0.00 C ATOM 420 C GLU A 29 18.465 29.098 51.853 1.00 0.00 C ATOM 421 O GLU A 29 17.776 29.547 52.738 1.00 0.00 O ATOM 422 CB GLU A 29 18.426 29.676 49.360 1.00 0.00 C ATOM 423 CG GLU A 29 19.232 30.392 48.243 1.00 0.00 C ATOM 424 CD GLU A 29 19.311 29.473 46.998 1.00 0.00 C ATOM 425 OE1 GLU A 29 20.196 28.639 47.040 1.00 0.00 O ATOM 426 OE2 GLU A 29 18.518 29.593 46.054 1.00 0.00 O ATOM 0 H GLU A 29 20.904 29.577 49.840 1.00 0.00 H new ATOM 0 HA GLU A 29 18.736 31.040 50.936 1.00 0.00 H new ATOM 0 HB2 GLU A 29 18.443 28.598 49.199 1.00 0.00 H new ATOM 0 HB3 GLU A 29 17.382 29.988 49.324 1.00 0.00 H new ATOM 0 HG2 GLU A 29 18.754 31.336 47.982 1.00 0.00 H new ATOM 0 HG3 GLU A 29 20.235 30.630 48.598 1.00 0.00 H new ATOM 433 N ALA A 30 18.718 27.820 51.834 1.00 0.00 N ATOM 434 CA ALA A 30 18.187 26.953 52.948 1.00 0.00 C ATOM 435 C ALA A 30 18.261 27.712 54.308 1.00 0.00 C ATOM 436 O ALA A 30 17.268 27.836 55.025 1.00 0.00 O ATOM 437 CB ALA A 30 19.011 25.670 53.042 1.00 0.00 C ATOM 0 H ALA A 30 19.257 27.336 51.116 1.00 0.00 H new ATOM 0 HA ALA A 30 17.147 26.707 52.732 1.00 0.00 H new ATOM 0 HB1 ALA A 30 18.624 25.047 53.848 1.00 0.00 H new ATOM 0 HB2 ALA A 30 18.946 25.126 52.100 1.00 0.00 H new ATOM 0 HB3 ALA A 30 20.052 25.920 53.245 1.00 0.00 H new ATOM 443 N GLN A 31 19.417 28.253 54.645 1.00 0.00 N ATOM 444 CA GLN A 31 19.551 29.003 55.918 1.00 0.00 C ATOM 445 C GLN A 31 18.548 30.172 55.954 1.00 0.00 C ATOM 446 O GLN A 31 17.771 30.270 56.891 1.00 0.00 O ATOM 447 CB GLN A 31 20.968 29.521 56.019 1.00 0.00 C ATOM 448 CG GLN A 31 21.899 28.344 56.320 1.00 0.00 C ATOM 449 CD GLN A 31 23.297 28.588 55.733 1.00 0.00 C ATOM 450 OE1 GLN A 31 23.632 29.684 55.332 1.00 0.00 O ATOM 451 NE2 GLN A 31 24.139 27.606 55.678 1.00 0.00 N ATOM 0 H GLN A 31 20.267 28.200 54.084 1.00 0.00 H new ATOM 0 HA GLN A 31 19.336 28.348 56.762 1.00 0.00 H new ATOM 0 HB2 GLN A 31 21.261 30.006 55.088 1.00 0.00 H new ATOM 0 HB3 GLN A 31 21.041 30.272 56.806 1.00 0.00 H new ATOM 0 HG2 GLN A 31 21.973 28.200 57.398 1.00 0.00 H new ATOM 0 HG3 GLN A 31 21.480 27.428 55.904 1.00 0.00 H new ATOM 0 HE21 GLN A 31 23.867 26.682 56.012 1.00 0.00 H new ATOM 0 HE22 GLN A 31 25.074 27.757 55.300 1.00 0.00 H new ATOM 460 N ALA A 32 18.598 31.105 54.997 1.00 0.00 N ATOM 461 CA ALA A 32 17.651 32.281 55.028 1.00 0.00 C ATOM 462 C ALA A 32 16.188 31.794 55.065 1.00 0.00 C ATOM 463 O ALA A 32 15.339 32.344 55.757 1.00 0.00 O ATOM 464 CB ALA A 32 17.874 33.138 53.777 1.00 0.00 C ATOM 0 H ALA A 32 19.248 31.095 54.211 1.00 0.00 H new ATOM 0 HA ALA A 32 17.845 32.871 55.924 1.00 0.00 H new ATOM 0 HB1 ALA A 32 17.193 33.989 53.793 1.00 0.00 H new ATOM 0 HB2 ALA A 32 18.903 33.497 53.760 1.00 0.00 H new ATOM 0 HB3 ALA A 32 17.684 32.538 52.887 1.00 0.00 H new ATOM 470 N LEU A 33 15.916 30.736 54.356 1.00 0.00 N ATOM 471 CA LEU A 33 14.552 30.134 54.327 1.00 0.00 C ATOM 472 C LEU A 33 14.086 29.815 55.744 1.00 0.00 C ATOM 473 O LEU A 33 12.902 29.802 56.038 1.00 0.00 O ATOM 474 CB LEU A 33 14.661 28.851 53.514 1.00 0.00 C ATOM 475 CG LEU A 33 13.272 28.306 53.152 1.00 0.00 C ATOM 476 CD1 LEU A 33 12.586 29.258 52.175 1.00 0.00 C ATOM 477 CD2 LEU A 33 13.431 26.949 52.474 1.00 0.00 C ATOM 0 H LEU A 33 16.601 30.249 53.779 1.00 0.00 H new ATOM 0 HA LEU A 33 13.830 30.822 53.887 1.00 0.00 H new ATOM 0 HB2 LEU A 33 15.229 29.041 52.603 1.00 0.00 H new ATOM 0 HB3 LEU A 33 15.212 28.102 54.083 1.00 0.00 H new ATOM 0 HG LEU A 33 12.674 28.211 54.058 1.00 0.00 H new ATOM 0 HD11 LEU A 33 11.600 28.869 51.919 1.00 0.00 H new ATOM 0 HD12 LEU A 33 12.480 30.240 52.637 1.00 0.00 H new ATOM 0 HD13 LEU A 33 13.187 29.346 51.270 1.00 0.00 H new ATOM 0 HD21 LEU A 33 12.449 26.555 52.214 1.00 0.00 H new ATOM 0 HD22 LEU A 33 14.028 27.062 51.569 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.930 26.259 53.154 1.00 0.00 H new ATOM 489 N GLY A 34 15.009 29.546 56.616 1.00 0.00 N ATOM 490 CA GLY A 34 14.645 29.210 58.024 1.00 0.00 C ATOM 491 C GLY A 34 15.183 27.818 58.375 1.00 0.00 C ATOM 492 O GLY A 34 14.471 26.967 58.886 1.00 0.00 O ATOM 0 H GLY A 34 16.009 29.543 56.417 1.00 0.00 H new ATOM 0 HA2 GLY A 34 15.059 29.954 58.705 1.00 0.00 H new ATOM 0 HA3 GLY A 34 13.562 29.234 58.146 1.00 0.00 H new ATOM 496 N TRP A 35 16.457 27.585 58.125 1.00 0.00 N ATOM 497 CA TRP A 35 17.063 26.257 58.463 1.00 0.00 C ATOM 498 C TRP A 35 17.430 26.229 59.955 1.00 0.00 C ATOM 499 O TRP A 35 17.837 27.234 60.524 1.00 0.00 O ATOM 500 CB TRP A 35 18.318 26.018 57.598 1.00 0.00 C ATOM 501 CG TRP A 35 18.361 24.595 57.121 1.00 0.00 C ATOM 502 CD1 TRP A 35 17.287 23.881 56.716 1.00 0.00 C ATOM 503 CD2 TRP A 35 19.517 23.712 56.953 1.00 0.00 C ATOM 504 NE1 TRP A 35 17.704 22.620 56.343 1.00 0.00 N ATOM 505 CE2 TRP A 35 19.062 22.468 56.465 1.00 0.00 C ATOM 506 CE3 TRP A 35 20.897 23.861 57.183 1.00 0.00 C ATOM 507 CZ2 TRP A 35 19.935 21.410 56.213 1.00 0.00 C ATOM 508 CZ3 TRP A 35 21.782 22.800 56.925 1.00 0.00 C ATOM 509 CH2 TRP A 35 21.297 21.571 56.440 1.00 0.00 C ATOM 0 H TRP A 35 17.098 28.257 57.703 1.00 0.00 H new ATOM 0 HA TRP A 35 16.343 25.465 58.258 1.00 0.00 H new ATOM 0 HB2 TRP A 35 18.313 26.695 56.744 1.00 0.00 H new ATOM 0 HB3 TRP A 35 19.214 26.242 58.176 1.00 0.00 H new ATOM 0 HD1 TRP A 35 16.269 24.239 56.689 1.00 0.00 H new ATOM 0 HE1 TRP A 35 17.076 21.886 56.015 1.00 0.00 H new ATOM 0 HE3 TRP A 35 21.279 24.798 57.561 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 19.554 20.469 55.843 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 22.840 22.929 57.100 1.00 0.00 H new ATOM 0 HH2 TRP A 35 21.980 20.757 56.245 1.00 0.00 H new ATOM 520 N VAL A 36 17.295 25.084 60.591 1.00 0.00 N ATOM 521 CA VAL A 36 17.634 24.976 62.046 1.00 0.00 C ATOM 522 C VAL A 36 18.404 23.671 62.315 1.00 0.00 C ATOM 523 O VAL A 36 17.965 22.582 61.957 1.00 0.00 O ATOM 524 CB VAL A 36 16.337 24.988 62.867 1.00 0.00 C ATOM 525 CG1 VAL A 36 16.645 24.707 64.346 1.00 0.00 C ATOM 526 CG2 VAL A 36 15.677 26.371 62.758 1.00 0.00 C ATOM 0 H VAL A 36 16.964 24.220 60.162 1.00 0.00 H new ATOM 0 HA VAL A 36 18.261 25.820 62.334 1.00 0.00 H new ATOM 0 HB VAL A 36 15.669 24.218 62.480 1.00 0.00 H new ATOM 0 HG11 VAL A 36 15.718 24.718 64.919 1.00 0.00 H new ATOM 0 HG12 VAL A 36 17.118 23.730 64.440 1.00 0.00 H new ATOM 0 HG13 VAL A 36 17.318 25.474 64.730 1.00 0.00 H new ATOM 0 HG21 VAL A 36 14.756 26.381 63.340 1.00 0.00 H new ATOM 0 HG22 VAL A 36 16.358 27.130 63.142 1.00 0.00 H new ATOM 0 HG23 VAL A 36 15.448 26.584 61.714 1.00 0.00 H new ATOM 536 N ALA A 37 19.553 23.786 62.951 1.00 0.00 N ATOM 537 CA ALA A 37 20.401 22.592 63.271 1.00 0.00 C ATOM 538 C ALA A 37 19.608 21.574 64.098 1.00 0.00 C ATOM 539 O ALA A 37 19.536 20.417 63.742 1.00 0.00 O ATOM 540 CB ALA A 37 21.628 23.049 64.068 1.00 0.00 C ATOM 0 H ALA A 37 19.942 24.675 63.266 1.00 0.00 H new ATOM 0 HA ALA A 37 20.712 22.118 62.340 1.00 0.00 H new ATOM 0 HB1 ALA A 37 22.250 22.186 64.305 1.00 0.00 H new ATOM 0 HB2 ALA A 37 22.204 23.759 63.474 1.00 0.00 H new ATOM 0 HB3 ALA A 37 21.304 23.527 64.992 1.00 0.00 H new ATOM 546 N SER A 38 19.007 21.988 65.187 1.00 0.00 N ATOM 547 CA SER A 38 18.220 21.031 66.031 1.00 0.00 C ATOM 548 C SER A 38 16.938 20.605 65.302 1.00 0.00 C ATOM 549 O SER A 38 15.860 20.579 65.867 1.00 0.00 O ATOM 550 CB SER A 38 17.863 21.697 67.359 1.00 0.00 C ATOM 551 OG SER A 38 16.828 22.650 67.142 1.00 0.00 O ATOM 0 H SER A 38 19.027 22.949 65.529 1.00 0.00 H new ATOM 0 HA SER A 38 18.825 20.144 66.219 1.00 0.00 H new ATOM 0 HB2 SER A 38 17.538 20.947 68.080 1.00 0.00 H new ATOM 0 HB3 SER A 38 18.741 22.186 67.782 1.00 0.00 H new ATOM 0 HG SER A 38 16.000 22.185 66.900 1.00 0.00 H new ATOM 557 N LYS A 39 17.062 20.242 64.059 1.00 0.00 N ATOM 558 CA LYS A 39 15.886 19.784 63.272 1.00 0.00 C ATOM 559 C LYS A 39 16.374 19.347 61.893 1.00 0.00 C ATOM 560 O LYS A 39 16.059 18.269 61.419 1.00 0.00 O ATOM 561 CB LYS A 39 14.882 20.933 63.128 1.00 0.00 C ATOM 562 CG LYS A 39 13.676 20.472 62.305 1.00 0.00 C ATOM 563 CD LYS A 39 12.422 21.246 62.748 1.00 0.00 C ATOM 564 CE LYS A 39 11.947 22.171 61.627 1.00 0.00 C ATOM 565 NZ LYS A 39 12.840 23.360 61.582 1.00 0.00 N ATOM 0 H LYS A 39 17.944 20.243 63.546 1.00 0.00 H new ATOM 0 HA LYS A 39 15.395 18.952 63.777 1.00 0.00 H new ATOM 0 HB2 LYS A 39 14.555 21.267 64.113 1.00 0.00 H new ATOM 0 HB3 LYS A 39 15.359 21.786 62.644 1.00 0.00 H new ATOM 0 HG2 LYS A 39 13.862 20.638 61.244 1.00 0.00 H new ATOM 0 HG3 LYS A 39 13.520 19.401 62.437 1.00 0.00 H new ATOM 0 HD2 LYS A 39 11.629 20.547 63.012 1.00 0.00 H new ATOM 0 HD3 LYS A 39 12.643 21.830 63.642 1.00 0.00 H new ATOM 0 HE2 LYS A 39 11.966 21.647 60.671 1.00 0.00 H new ATOM 0 HE3 LYS A 39 10.916 22.479 61.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 12.426 24.081 60.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 12.946 23.751 62.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 13.773 23.080 61.217 1.00 0.00 H new ATOM 579 N GLY A 40 17.134 20.203 61.241 1.00 0.00 N ATOM 580 CA GLY A 40 17.654 19.879 59.875 1.00 0.00 C ATOM 581 C GLY A 40 16.464 19.729 58.929 1.00 0.00 C ATOM 582 O GLY A 40 16.271 18.708 58.301 1.00 0.00 O ATOM 0 H GLY A 40 17.415 21.115 61.601 1.00 0.00 H new ATOM 0 HA2 GLY A 40 18.319 20.669 59.525 1.00 0.00 H new ATOM 0 HA3 GLY A 40 18.237 18.958 59.900 1.00 0.00 H new ATOM 586 N ASN A 41 15.654 20.744 58.848 1.00 0.00 N ATOM 587 CA ASN A 41 14.439 20.690 57.975 1.00 0.00 C ATOM 588 C ASN A 41 14.839 20.703 56.497 1.00 0.00 C ATOM 589 O ASN A 41 15.941 21.100 56.141 1.00 0.00 O ATOM 590 CB ASN A 41 13.521 21.901 58.271 1.00 0.00 C ATOM 591 CG ASN A 41 14.230 22.925 59.167 1.00 0.00 C ATOM 592 OD1 ASN A 41 14.591 22.652 60.298 1.00 0.00 O ATOM 593 ND2 ASN A 41 14.437 24.117 58.712 1.00 0.00 N ATOM 0 H ASN A 41 15.779 21.621 59.353 1.00 0.00 H new ATOM 0 HA ASN A 41 13.902 19.766 58.188 1.00 0.00 H new ATOM 0 HB2 ASN A 41 13.226 22.375 57.335 1.00 0.00 H new ATOM 0 HB3 ASN A 41 12.607 21.559 58.757 1.00 0.00 H new ATOM 0 HD21 ASN A 41 14.897 24.814 59.298 1.00 0.00 H new ATOM 0 HD22 ASN A 41 14.140 24.361 57.767 1.00 0.00 H new ATOM 600 N LEU A 42 13.942 20.297 55.629 1.00 0.00 N ATOM 601 CA LEU A 42 14.269 20.316 54.170 1.00 0.00 C ATOM 602 C LEU A 42 13.058 19.893 53.344 1.00 0.00 C ATOM 603 O LEU A 42 12.509 20.672 52.601 1.00 0.00 O ATOM 604 CB LEU A 42 15.432 19.372 53.902 1.00 0.00 C ATOM 605 CG LEU A 42 15.769 19.388 52.415 1.00 0.00 C ATOM 606 CD1 LEU A 42 16.262 20.770 52.004 1.00 0.00 C ATOM 607 CD2 LEU A 42 16.864 18.375 52.136 1.00 0.00 C ATOM 0 H LEU A 42 13.009 19.958 55.865 1.00 0.00 H new ATOM 0 HA LEU A 42 14.545 21.330 53.882 1.00 0.00 H new ATOM 0 HB2 LEU A 42 16.301 19.674 54.486 1.00 0.00 H new ATOM 0 HB3 LEU A 42 15.173 18.361 54.216 1.00 0.00 H new ATOM 0 HG LEU A 42 14.872 19.139 51.847 1.00 0.00 H new ATOM 0 HD11 LEU A 42 16.500 20.770 50.940 1.00 0.00 H new ATOM 0 HD12 LEU A 42 15.484 21.508 52.202 1.00 0.00 H new ATOM 0 HD13 LEU A 42 17.155 21.022 52.575 1.00 0.00 H new ATOM 0 HD21 LEU A 42 17.107 18.385 51.073 1.00 0.00 H new ATOM 0 HD22 LEU A 42 17.752 18.631 52.713 1.00 0.00 H new ATOM 0 HD23 LEU A 42 16.521 17.380 52.421 1.00 0.00 H new ATOM 619 N ALA A 43 12.640 18.667 53.467 1.00 0.00 N ATOM 620 CA ALA A 43 11.473 18.188 52.677 1.00 0.00 C ATOM 621 C ALA A 43 10.240 18.987 53.059 1.00 0.00 C ATOM 622 O ALA A 43 9.285 19.005 52.337 1.00 0.00 O ATOM 623 CB ALA A 43 11.211 16.699 52.956 1.00 0.00 C ATOM 0 H ALA A 43 13.058 17.971 54.084 1.00 0.00 H new ATOM 0 HA ALA A 43 11.691 18.320 51.617 1.00 0.00 H new ATOM 0 HB1 ALA A 43 10.355 16.364 52.371 1.00 0.00 H new ATOM 0 HB2 ALA A 43 12.090 16.117 52.679 1.00 0.00 H new ATOM 0 HB3 ALA A 43 11.003 16.559 54.017 1.00 0.00 H new ATOM 629 N ASP A 44 10.253 19.626 54.192 1.00 0.00 N ATOM 630 CA ASP A 44 9.078 20.433 54.642 1.00 0.00 C ATOM 631 C ASP A 44 9.110 21.793 53.921 1.00 0.00 C ATOM 632 O ASP A 44 8.240 22.126 53.122 1.00 0.00 O ATOM 633 CB ASP A 44 9.198 20.606 56.172 1.00 0.00 C ATOM 634 CG ASP A 44 10.636 21.010 56.546 1.00 0.00 C ATOM 635 OD1 ASP A 44 11.564 20.304 56.174 1.00 0.00 O ATOM 636 OD2 ASP A 44 10.796 22.033 57.183 1.00 0.00 O ATOM 0 H ASP A 44 11.041 19.626 54.840 1.00 0.00 H new ATOM 0 HA ASP A 44 8.132 19.946 54.405 1.00 0.00 H new ATOM 0 HB2 ASP A 44 8.497 21.366 56.516 1.00 0.00 H new ATOM 0 HB3 ASP A 44 8.931 19.676 56.673 1.00 0.00 H new ATOM 641 N VAL A 45 10.120 22.575 54.191 1.00 0.00 N ATOM 642 CA VAL A 45 10.219 23.899 53.524 1.00 0.00 C ATOM 643 C VAL A 45 10.637 23.736 52.046 1.00 0.00 C ATOM 644 O VAL A 45 10.564 24.678 51.278 1.00 0.00 O ATOM 645 CB VAL A 45 11.233 24.782 54.253 1.00 0.00 C ATOM 646 CG1 VAL A 45 10.731 25.115 55.675 1.00 0.00 C ATOM 647 CG2 VAL A 45 12.562 24.024 54.320 1.00 0.00 C ATOM 0 H VAL A 45 10.875 22.354 54.841 1.00 0.00 H new ATOM 0 HA VAL A 45 9.238 24.373 53.559 1.00 0.00 H new ATOM 0 HB VAL A 45 11.365 25.722 53.718 1.00 0.00 H new ATOM 0 HG11 VAL A 45 11.463 25.744 56.181 1.00 0.00 H new ATOM 0 HG12 VAL A 45 9.780 25.645 55.611 1.00 0.00 H new ATOM 0 HG13 VAL A 45 10.594 24.192 56.238 1.00 0.00 H new ATOM 0 HG21 VAL A 45 13.303 24.634 54.836 1.00 0.00 H new ATOM 0 HG22 VAL A 45 12.421 23.089 54.862 1.00 0.00 H new ATOM 0 HG23 VAL A 45 12.910 23.809 53.310 1.00 0.00 H new ATOM 657 N ALA A 46 11.061 22.558 51.649 1.00 0.00 N ATOM 658 CA ALA A 46 11.464 22.324 50.236 1.00 0.00 C ATOM 659 C ALA A 46 11.137 20.866 49.828 1.00 0.00 C ATOM 660 O ALA A 46 12.022 20.054 49.671 1.00 0.00 O ATOM 661 CB ALA A 46 12.965 22.608 50.121 1.00 0.00 C ATOM 0 H ALA A 46 11.144 21.743 52.256 1.00 0.00 H new ATOM 0 HA ALA A 46 10.916 22.983 49.563 1.00 0.00 H new ATOM 0 HB1 ALA A 46 13.289 22.444 49.093 1.00 0.00 H new ATOM 0 HB2 ALA A 46 13.162 23.642 50.403 1.00 0.00 H new ATOM 0 HB3 ALA A 46 13.514 21.940 50.785 1.00 0.00 H new ATOM 667 N PRO A 47 9.871 20.547 49.653 1.00 0.00 N ATOM 668 CA PRO A 47 9.407 19.165 49.251 1.00 0.00 C ATOM 669 C PRO A 47 9.993 18.665 47.919 1.00 0.00 C ATOM 670 O PRO A 47 9.783 19.251 46.879 1.00 0.00 O ATOM 671 CB PRO A 47 7.880 19.326 49.118 1.00 0.00 C ATOM 672 CG PRO A 47 7.569 20.522 49.969 1.00 0.00 C ATOM 673 CD PRO A 47 8.748 21.462 49.839 1.00 0.00 C ATOM 0 HA PRO A 47 9.730 18.425 49.983 1.00 0.00 H new ATOM 0 HB2 PRO A 47 7.584 19.485 48.081 1.00 0.00 H new ATOM 0 HB3 PRO A 47 7.353 18.439 49.468 1.00 0.00 H new ATOM 0 HG2 PRO A 47 6.650 21.005 49.638 1.00 0.00 H new ATOM 0 HG3 PRO A 47 7.419 20.230 51.008 1.00 0.00 H new ATOM 0 HD2 PRO A 47 8.634 22.140 48.993 1.00 0.00 H new ATOM 0 HD3 PRO A 47 8.873 22.080 50.728 1.00 0.00 H new ATOM 681 N GLY A 48 10.663 17.545 47.934 1.00 0.00 N ATOM 682 CA GLY A 48 11.222 16.990 46.669 1.00 0.00 C ATOM 683 C GLY A 48 12.428 17.821 46.236 1.00 0.00 C ATOM 684 O GLY A 48 12.619 18.088 45.053 1.00 0.00 O ATOM 0 H GLY A 48 10.848 16.990 48.769 1.00 0.00 H new ATOM 0 HA2 GLY A 48 11.517 15.951 46.815 1.00 0.00 H new ATOM 0 HA3 GLY A 48 10.462 16.999 45.888 1.00 0.00 H new ATOM 688 N LYS A 49 13.237 18.230 47.181 1.00 0.00 N ATOM 689 CA LYS A 49 14.447 19.072 46.843 1.00 0.00 C ATOM 690 C LYS A 49 15.686 18.625 47.670 1.00 0.00 C ATOM 691 O LYS A 49 15.642 17.695 48.482 1.00 0.00 O ATOM 692 CB LYS A 49 14.108 20.543 47.117 1.00 0.00 C ATOM 693 CG LYS A 49 12.776 20.898 46.418 1.00 0.00 C ATOM 694 CD LYS A 49 13.020 21.056 44.915 1.00 0.00 C ATOM 695 CE LYS A 49 11.734 20.842 44.136 1.00 0.00 C ATOM 696 NZ LYS A 49 11.897 19.672 43.209 1.00 0.00 N ATOM 0 H LYS A 49 13.120 18.023 48.173 1.00 0.00 H new ATOM 0 HA LYS A 49 14.700 18.943 45.791 1.00 0.00 H new ATOM 0 HB2 LYS A 49 14.026 20.716 48.190 1.00 0.00 H new ATOM 0 HB3 LYS A 49 14.907 21.187 46.750 1.00 0.00 H new ATOM 0 HG2 LYS A 49 12.038 20.116 46.598 1.00 0.00 H new ATOM 0 HG3 LYS A 49 12.370 21.821 46.831 1.00 0.00 H new ATOM 0 HD2 LYS A 49 13.415 22.051 44.708 1.00 0.00 H new ATOM 0 HD3 LYS A 49 13.773 20.340 44.587 1.00 0.00 H new ATOM 0 HE2 LYS A 49 10.906 20.663 44.822 1.00 0.00 H new ATOM 0 HE3 LYS A 49 11.488 21.739 43.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 10.962 19.281 42.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 12.370 19.984 42.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 12.473 18.940 43.672 1.00 0.00 H new ATOM 710 N SER A 50 16.821 19.228 47.420 1.00 0.00 N ATOM 711 CA SER A 50 18.034 18.816 48.150 1.00 0.00 C ATOM 712 C SER A 50 18.989 20.013 48.345 1.00 0.00 C ATOM 713 O SER A 50 18.890 21.048 47.691 1.00 0.00 O ATOM 714 CB SER A 50 18.706 17.682 47.367 1.00 0.00 C ATOM 715 OG SER A 50 17.851 16.543 47.439 1.00 0.00 O ATOM 0 H SER A 50 16.949 19.982 46.745 1.00 0.00 H new ATOM 0 HA SER A 50 17.769 18.459 49.145 1.00 0.00 H new ATOM 0 HB2 SER A 50 18.866 17.976 46.330 1.00 0.00 H new ATOM 0 HB3 SER A 50 19.685 17.453 47.788 1.00 0.00 H new ATOM 0 HG SER A 50 17.620 16.366 48.375 1.00 0.00 H new ATOM 721 N ILE A 51 19.911 19.876 49.250 1.00 0.00 N ATOM 722 CA ILE A 51 20.874 20.968 49.529 1.00 0.00 C ATOM 723 C ILE A 51 22.065 20.877 48.550 1.00 0.00 C ATOM 724 O ILE A 51 22.754 19.865 48.471 1.00 0.00 O ATOM 725 CB ILE A 51 21.368 20.815 50.976 1.00 0.00 C ATOM 726 CG1 ILE A 51 20.148 20.795 51.943 1.00 0.00 C ATOM 727 CG2 ILE A 51 22.327 21.973 51.301 1.00 0.00 C ATOM 728 CD1 ILE A 51 19.722 22.204 52.273 1.00 0.00 C ATOM 0 H ILE A 51 20.039 19.038 49.818 1.00 0.00 H new ATOM 0 HA ILE A 51 20.394 21.938 49.399 1.00 0.00 H new ATOM 0 HB ILE A 51 21.907 19.876 51.098 1.00 0.00 H new ATOM 0 HG12 ILE A 51 19.320 20.255 51.484 1.00 0.00 H new ATOM 0 HG13 ILE A 51 20.408 20.262 52.858 1.00 0.00 H new ATOM 0 HG21 ILE A 51 22.683 21.873 52.326 1.00 0.00 H new ATOM 0 HG22 ILE A 51 23.176 21.945 50.618 1.00 0.00 H new ATOM 0 HG23 ILE A 51 21.802 22.922 51.190 1.00 0.00 H new ATOM 0 HD11 ILE A 51 18.868 22.177 52.950 1.00 0.00 H new ATOM 0 HD12 ILE A 51 20.548 22.731 52.751 1.00 0.00 H new ATOM 0 HD13 ILE A 51 19.442 22.724 51.357 1.00 0.00 H new ATOM 740 N GLY A 52 22.340 21.950 47.848 1.00 0.00 N ATOM 741 CA GLY A 52 23.499 21.960 46.891 1.00 0.00 C ATOM 742 C GLY A 52 23.519 23.264 46.099 1.00 0.00 C ATOM 743 O GLY A 52 22.509 23.918 45.928 1.00 0.00 O ATOM 0 H GLY A 52 21.813 22.822 47.894 1.00 0.00 H new ATOM 0 HA2 GLY A 52 24.434 21.845 47.440 1.00 0.00 H new ATOM 0 HA3 GLY A 52 23.424 21.113 46.209 1.00 0.00 H new ATOM 747 N GLY A 53 24.667 23.665 45.639 1.00 0.00 N ATOM 748 CA GLY A 53 24.750 24.932 44.847 1.00 0.00 C ATOM 749 C GLY A 53 25.730 25.922 45.497 1.00 0.00 C ATOM 750 O GLY A 53 26.180 26.870 44.867 1.00 0.00 O ATOM 0 H GLY A 53 25.552 23.176 45.773 1.00 0.00 H new ATOM 0 HA2 GLY A 53 25.073 24.709 43.830 1.00 0.00 H new ATOM 0 HA3 GLY A 53 23.762 25.386 44.776 1.00 0.00 H new ATOM 754 N ASP A 54 26.067 25.726 46.744 1.00 0.00 N ATOM 755 CA ASP A 54 27.028 26.673 47.413 1.00 0.00 C ATOM 756 C ASP A 54 28.427 26.495 46.823 1.00 0.00 C ATOM 757 O ASP A 54 28.597 26.050 45.699 1.00 0.00 O ATOM 758 CB ASP A 54 27.113 26.388 48.927 1.00 0.00 C ATOM 759 CG ASP A 54 25.737 26.091 49.470 1.00 0.00 C ATOM 760 OD1 ASP A 54 25.223 25.043 49.146 1.00 0.00 O ATOM 761 OD2 ASP A 54 25.265 26.869 50.275 1.00 0.00 O ATOM 0 H ASP A 54 25.727 24.963 47.329 1.00 0.00 H new ATOM 0 HA ASP A 54 26.666 27.688 47.248 1.00 0.00 H new ATOM 0 HB2 ASP A 54 27.776 25.543 49.110 1.00 0.00 H new ATOM 0 HB3 ASP A 54 27.540 27.247 49.444 1.00 0.00 H new ATOM 766 N ILE A 55 29.438 26.828 47.592 1.00 0.00 N ATOM 767 CA ILE A 55 30.831 26.684 47.097 1.00 0.00 C ATOM 768 C ILE A 55 31.684 25.879 48.090 1.00 0.00 C ATOM 769 O ILE A 55 31.606 26.055 49.295 1.00 0.00 O ATOM 770 CB ILE A 55 31.426 28.089 46.897 1.00 0.00 C ATOM 771 CG1 ILE A 55 30.619 28.844 45.824 1.00 0.00 C ATOM 772 CG2 ILE A 55 32.874 27.965 46.446 1.00 0.00 C ATOM 773 CD1 ILE A 55 29.818 29.970 46.486 1.00 0.00 C ATOM 0 H ILE A 55 29.351 27.193 48.541 1.00 0.00 H new ATOM 0 HA ILE A 55 30.827 26.143 46.151 1.00 0.00 H new ATOM 0 HB ILE A 55 31.381 28.639 47.837 1.00 0.00 H new ATOM 0 HG12 ILE A 55 31.291 29.255 45.071 1.00 0.00 H new ATOM 0 HG13 ILE A 55 29.946 28.158 45.310 1.00 0.00 H new ATOM 0 HG21 ILE A 55 33.297 28.959 46.304 1.00 0.00 H new ATOM 0 HG22 ILE A 55 33.447 27.432 47.205 1.00 0.00 H new ATOM 0 HG23 ILE A 55 32.916 27.415 45.506 1.00 0.00 H new ATOM 0 HD11 ILE A 55 29.247 30.505 45.727 1.00 0.00 H new ATOM 0 HD12 ILE A 55 29.135 29.546 47.223 1.00 0.00 H new ATOM 0 HD13 ILE A 55 30.501 30.661 46.980 1.00 0.00 H new ATOM 785 N PHE A 56 32.529 25.015 47.579 1.00 0.00 N ATOM 786 CA PHE A 56 33.418 24.221 48.464 1.00 0.00 C ATOM 787 C PHE A 56 34.842 24.788 48.373 1.00 0.00 C ATOM 788 O PHE A 56 35.612 24.405 47.514 1.00 0.00 O ATOM 789 CB PHE A 56 33.412 22.754 48.019 1.00 0.00 C ATOM 790 CG PHE A 56 33.848 21.886 49.172 1.00 0.00 C ATOM 791 CD1 PHE A 56 35.206 21.785 49.502 1.00 0.00 C ATOM 792 CD2 PHE A 56 32.893 21.186 49.915 1.00 0.00 C ATOM 793 CE1 PHE A 56 35.607 20.982 50.578 1.00 0.00 C ATOM 794 CE2 PHE A 56 33.290 20.384 50.990 1.00 0.00 C ATOM 795 CZ PHE A 56 34.648 20.280 51.323 1.00 0.00 C ATOM 0 H PHE A 56 32.636 24.830 46.582 1.00 0.00 H new ATOM 0 HA PHE A 56 33.065 24.279 49.493 1.00 0.00 H new ATOM 0 HB2 PHE A 56 32.414 22.466 47.688 1.00 0.00 H new ATOM 0 HB3 PHE A 56 34.082 22.616 47.170 1.00 0.00 H new ATOM 0 HD1 PHE A 56 35.943 22.326 48.927 1.00 0.00 H new ATOM 0 HD2 PHE A 56 31.847 21.265 49.659 1.00 0.00 H new ATOM 0 HE1 PHE A 56 36.653 20.904 50.833 1.00 0.00 H new ATOM 0 HE2 PHE A 56 32.551 19.845 51.564 1.00 0.00 H new ATOM 0 HZ PHE A 56 34.955 19.660 52.152 1.00 0.00 H new ATOM 805 N SER A 57 35.168 25.732 49.219 1.00 0.00 N ATOM 806 CA SER A 57 36.528 26.371 49.207 1.00 0.00 C ATOM 807 C SER A 57 37.624 25.313 49.438 1.00 0.00 C ATOM 808 O SER A 57 38.621 25.566 50.081 1.00 0.00 O ATOM 809 CB SER A 57 36.584 27.423 50.329 1.00 0.00 C ATOM 810 OG SER A 57 35.785 26.988 51.436 1.00 0.00 O ATOM 0 H SER A 57 34.538 26.097 49.934 1.00 0.00 H new ATOM 0 HA SER A 57 36.700 26.839 48.238 1.00 0.00 H new ATOM 0 HB2 SER A 57 37.615 27.574 50.649 1.00 0.00 H new ATOM 0 HB3 SER A 57 36.221 28.382 49.960 1.00 0.00 H new ATOM 0 HG SER A 57 35.818 26.011 51.499 1.00 0.00 H new ATOM 816 N ASN A 58 37.440 24.128 48.916 1.00 0.00 N ATOM 817 CA ASN A 58 38.455 23.039 49.084 1.00 0.00 C ATOM 818 C ASN A 58 39.039 23.068 50.506 1.00 0.00 C ATOM 819 O ASN A 58 40.205 22.778 50.712 1.00 0.00 O ATOM 820 CB ASN A 58 39.581 23.240 48.058 1.00 0.00 C ATOM 821 CG ASN A 58 40.554 22.054 48.103 1.00 0.00 C ATOM 822 OD1 ASN A 58 40.150 20.913 48.236 1.00 0.00 O ATOM 823 ND2 ASN A 58 41.831 22.273 47.999 1.00 0.00 N ATOM 0 H ASN A 58 36.619 23.863 48.372 1.00 0.00 H new ATOM 0 HA ASN A 58 37.976 22.073 48.924 1.00 0.00 H new ATOM 0 HB2 ASN A 58 39.159 23.336 47.058 1.00 0.00 H new ATOM 0 HB3 ASN A 58 40.115 24.167 48.269 1.00 0.00 H new ATOM 0 HD21 ASN A 58 42.486 21.492 48.029 1.00 0.00 H new ATOM 0 HD22 ASN A 58 42.178 23.226 47.887 1.00 0.00 H new ATOM 830 N ARG A 59 38.257 23.411 51.492 1.00 0.00 N ATOM 831 CA ARG A 59 38.797 23.444 52.884 1.00 0.00 C ATOM 832 C ARG A 59 39.152 22.026 53.344 1.00 0.00 C ATOM 833 O ARG A 59 38.835 21.616 54.443 1.00 0.00 O ATOM 834 CB ARG A 59 37.755 24.061 53.824 1.00 0.00 C ATOM 835 CG ARG A 59 37.767 25.585 53.657 1.00 0.00 C ATOM 836 CD ARG A 59 36.693 26.217 54.551 1.00 0.00 C ATOM 837 NE ARG A 59 35.641 26.832 53.682 1.00 0.00 N ATOM 838 CZ ARG A 59 34.511 27.240 54.182 1.00 0.00 C ATOM 839 NH1 ARG A 59 34.274 27.121 55.445 1.00 0.00 N ATOM 840 NH2 ARG A 59 33.614 27.761 53.408 1.00 0.00 N ATOM 0 H ARG A 59 37.275 23.668 51.398 1.00 0.00 H new ATOM 0 HA ARG A 59 39.701 24.053 52.905 1.00 0.00 H new ATOM 0 HB2 ARG A 59 36.765 23.666 53.598 1.00 0.00 H new ATOM 0 HB3 ARG A 59 37.976 23.794 54.857 1.00 0.00 H new ATOM 0 HG2 ARG A 59 38.749 25.980 53.918 1.00 0.00 H new ATOM 0 HG3 ARG A 59 37.585 25.847 52.615 1.00 0.00 H new ATOM 0 HD2 ARG A 59 36.251 25.462 55.201 1.00 0.00 H new ATOM 0 HD3 ARG A 59 37.138 26.973 55.198 1.00 0.00 H new ATOM 0 HE ARG A 59 35.813 26.933 52.682 1.00 0.00 H new ATOM 0 HH11 ARG A 59 34.975 26.705 56.058 1.00 0.00 H new ATOM 0 HH12 ARG A 59 33.386 27.443 55.830 1.00 0.00 H new ATOM 0 HH21 ARG A 59 33.793 27.851 52.408 1.00 0.00 H new ATOM 0 HH22 ARG A 59 32.728 28.081 53.798 1.00 0.00 H new ATOM 854 N GLU A 60 39.802 21.279 52.501 1.00 0.00 N ATOM 855 CA GLU A 60 40.174 19.889 52.871 1.00 0.00 C ATOM 856 C GLU A 60 41.451 19.467 52.127 1.00 0.00 C ATOM 857 O GLU A 60 42.197 18.621 52.581 1.00 0.00 O ATOM 858 CB GLU A 60 39.029 18.945 52.488 1.00 0.00 C ATOM 859 CG GLU A 60 37.911 19.013 53.537 1.00 0.00 C ATOM 860 CD GLU A 60 37.083 17.742 53.453 1.00 0.00 C ATOM 861 OE1 GLU A 60 36.392 17.578 52.467 1.00 0.00 O ATOM 862 OE2 GLU A 60 37.188 16.921 54.354 1.00 0.00 O ATOM 0 H GLU A 60 40.093 21.572 51.568 1.00 0.00 H new ATOM 0 HA GLU A 60 40.356 19.840 53.945 1.00 0.00 H new ATOM 0 HB2 GLU A 60 38.636 19.218 51.509 1.00 0.00 H new ATOM 0 HB3 GLU A 60 39.401 17.924 52.409 1.00 0.00 H new ATOM 0 HG2 GLU A 60 38.336 19.121 54.535 1.00 0.00 H new ATOM 0 HG3 GLU A 60 37.282 19.886 53.362 1.00 0.00 H new ATOM 869 N GLY A 61 41.692 20.047 50.979 1.00 0.00 N ATOM 870 CA GLY A 61 42.901 19.682 50.176 1.00 0.00 C ATOM 871 C GLY A 61 42.643 18.352 49.473 1.00 0.00 C ATOM 872 O GLY A 61 43.554 17.604 49.194 1.00 0.00 O ATOM 0 H GLY A 61 41.099 20.763 50.559 1.00 0.00 H new ATOM 0 HA2 GLY A 61 43.116 20.460 49.444 1.00 0.00 H new ATOM 0 HA3 GLY A 61 43.774 19.603 50.824 1.00 0.00 H new ATOM 876 N LYS A 62 41.399 18.056 49.193 1.00 0.00 N ATOM 877 CA LYS A 62 41.062 16.771 48.514 1.00 0.00 C ATOM 878 C LYS A 62 40.570 17.050 47.097 1.00 0.00 C ATOM 879 O LYS A 62 40.117 16.159 46.409 1.00 0.00 O ATOM 880 CB LYS A 62 39.959 16.045 49.299 1.00 0.00 C ATOM 881 CG LYS A 62 40.441 15.753 50.725 1.00 0.00 C ATOM 882 CD LYS A 62 39.672 14.555 51.304 1.00 0.00 C ATOM 883 CE LYS A 62 39.243 14.867 52.742 1.00 0.00 C ATOM 884 NZ LYS A 62 37.854 15.413 52.732 1.00 0.00 N ATOM 0 H LYS A 62 40.600 18.653 49.407 1.00 0.00 H new ATOM 0 HA LYS A 62 41.954 16.145 48.473 1.00 0.00 H new ATOM 0 HB2 LYS A 62 39.058 16.658 49.328 1.00 0.00 H new ATOM 0 HB3 LYS A 62 39.695 15.114 48.797 1.00 0.00 H new ATOM 0 HG2 LYS A 62 41.510 15.542 50.720 1.00 0.00 H new ATOM 0 HG3 LYS A 62 40.292 16.630 51.355 1.00 0.00 H new ATOM 0 HD2 LYS A 62 38.797 14.341 50.691 1.00 0.00 H new ATOM 0 HD3 LYS A 62 40.299 13.664 51.286 1.00 0.00 H new ATOM 0 HE2 LYS A 62 39.287 13.964 53.351 1.00 0.00 H new ATOM 0 HE3 LYS A 62 39.927 15.588 53.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 37.601 15.737 53.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 37.800 16.213 52.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 37.191 14.670 52.432 1.00 0.00 H new ATOM 898 N LEU A 63 40.665 18.275 46.655 1.00 0.00 N ATOM 899 CA LEU A 63 40.210 18.623 45.276 1.00 0.00 C ATOM 900 C LEU A 63 41.314 19.414 44.564 1.00 0.00 C ATOM 901 O LEU A 63 42.022 20.194 45.181 1.00 0.00 O ATOM 902 CB LEU A 63 38.955 19.488 45.359 1.00 0.00 C ATOM 903 CG LEU A 63 37.873 18.740 46.138 1.00 0.00 C ATOM 904 CD1 LEU A 63 37.275 19.659 47.196 1.00 0.00 C ATOM 905 CD2 LEU A 63 36.768 18.289 45.184 1.00 0.00 C ATOM 0 H LEU A 63 41.041 19.056 47.193 1.00 0.00 H new ATOM 0 HA LEU A 63 39.992 17.709 44.723 1.00 0.00 H new ATOM 0 HB2 LEU A 63 39.184 20.434 45.850 1.00 0.00 H new ATOM 0 HB3 LEU A 63 38.598 19.727 44.357 1.00 0.00 H new ATOM 0 HG LEU A 63 38.319 17.869 46.618 1.00 0.00 H new ATOM 0 HD11 LEU A 63 36.504 19.123 47.750 1.00 0.00 H new ATOM 0 HD12 LEU A 63 38.058 19.981 47.883 1.00 0.00 H new ATOM 0 HD13 LEU A 63 36.835 20.532 46.713 1.00 0.00 H new ATOM 0 HD21 LEU A 63 35.999 17.756 45.744 1.00 0.00 H new ATOM 0 HD22 LEU A 63 36.327 19.160 44.700 1.00 0.00 H new ATOM 0 HD23 LEU A 63 37.189 17.628 44.426 1.00 0.00 H new ATOM 917 N PRO A 64 41.458 19.212 43.274 1.00 0.00 N ATOM 918 CA PRO A 64 42.489 19.925 42.454 1.00 0.00 C ATOM 919 C PRO A 64 42.252 21.448 42.412 1.00 0.00 C ATOM 920 O PRO A 64 41.179 21.906 42.054 1.00 0.00 O ATOM 921 CB PRO A 64 42.348 19.304 41.052 1.00 0.00 C ATOM 922 CG PRO A 64 40.998 18.664 41.018 1.00 0.00 C ATOM 923 CD PRO A 64 40.653 18.283 42.459 1.00 0.00 C ATOM 0 HA PRO A 64 43.489 19.809 42.872 1.00 0.00 H new ATOM 0 HB2 PRO A 64 42.438 20.065 40.277 1.00 0.00 H new ATOM 0 HB3 PRO A 64 43.133 18.570 40.870 1.00 0.00 H new ATOM 0 HG2 PRO A 64 40.255 19.350 40.611 1.00 0.00 H new ATOM 0 HG3 PRO A 64 41.004 17.783 40.376 1.00 0.00 H new ATOM 0 HD2 PRO A 64 39.587 18.397 42.658 1.00 0.00 H new ATOM 0 HD3 PRO A 64 40.907 17.244 42.669 1.00 0.00 H new ATOM 931 N GLY A 65 43.248 22.228 42.783 1.00 0.00 N ATOM 932 CA GLY A 65 43.096 23.721 42.785 1.00 0.00 C ATOM 933 C GLY A 65 43.774 24.334 41.555 1.00 0.00 C ATOM 934 O GLY A 65 44.180 23.639 40.653 1.00 0.00 O ATOM 0 H GLY A 65 44.162 21.891 43.085 1.00 0.00 H new ATOM 0 HA2 GLY A 65 42.038 23.984 42.793 1.00 0.00 H new ATOM 0 HA3 GLY A 65 43.534 24.135 43.693 1.00 0.00 H new ATOM 938 N LYS A 66 43.873 25.634 41.509 1.00 0.00 N ATOM 939 CA LYS A 66 44.518 26.322 40.332 1.00 0.00 C ATOM 940 C LYS A 66 44.408 27.847 40.516 1.00 0.00 C ATOM 941 O LYS A 66 43.438 28.349 41.055 1.00 0.00 O ATOM 942 CB LYS A 66 43.808 25.884 39.034 1.00 0.00 C ATOM 943 CG LYS A 66 44.141 26.828 37.866 1.00 0.00 C ATOM 944 CD LYS A 66 43.171 26.555 36.708 1.00 0.00 C ATOM 945 CE LYS A 66 43.090 27.774 35.783 1.00 0.00 C ATOM 946 NZ LYS A 66 41.663 28.013 35.412 1.00 0.00 N ATOM 0 H LYS A 66 43.535 26.262 42.238 1.00 0.00 H new ATOM 0 HA LYS A 66 45.571 26.047 40.268 1.00 0.00 H new ATOM 0 HB2 LYS A 66 44.107 24.867 38.779 1.00 0.00 H new ATOM 0 HB3 LYS A 66 42.730 25.868 39.195 1.00 0.00 H new ATOM 0 HG2 LYS A 66 44.061 27.867 38.187 1.00 0.00 H new ATOM 0 HG3 LYS A 66 45.169 26.674 37.539 1.00 0.00 H new ATOM 0 HD2 LYS A 66 43.503 25.684 36.144 1.00 0.00 H new ATOM 0 HD3 LYS A 66 42.181 26.322 37.101 1.00 0.00 H new ATOM 0 HE2 LYS A 66 43.501 28.652 36.281 1.00 0.00 H new ATOM 0 HE3 LYS A 66 43.688 27.607 34.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 41.617 28.701 34.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 41.228 27.118 35.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 41.148 28.387 36.235 1.00 0.00 H new ATOM 960 N SER A 67 45.380 28.593 40.059 1.00 0.00 N ATOM 961 CA SER A 67 45.305 30.081 40.200 1.00 0.00 C ATOM 962 C SER A 67 44.192 30.612 39.289 1.00 0.00 C ATOM 963 O SER A 67 44.432 31.383 38.372 1.00 0.00 O ATOM 964 CB SER A 67 46.641 30.700 39.792 1.00 0.00 C ATOM 965 OG SER A 67 46.704 30.757 38.373 1.00 0.00 O ATOM 0 H SER A 67 46.218 28.241 39.597 1.00 0.00 H new ATOM 0 HA SER A 67 45.090 30.344 41.236 1.00 0.00 H new ATOM 0 HB2 SER A 67 46.739 31.700 40.215 1.00 0.00 H new ATOM 0 HB3 SER A 67 47.467 30.106 40.183 1.00 0.00 H new ATOM 0 HG SER A 67 46.154 31.501 38.051 1.00 0.00 H new ATOM 971 N GLY A 68 42.980 30.188 39.530 1.00 0.00 N ATOM 972 CA GLY A 68 41.829 30.641 38.687 1.00 0.00 C ATOM 973 C GLY A 68 40.845 29.479 38.496 1.00 0.00 C ATOM 974 O GLY A 68 40.792 28.857 37.438 1.00 0.00 O ATOM 0 H GLY A 68 42.734 29.542 40.280 1.00 0.00 H new ATOM 0 HA2 GLY A 68 41.326 31.483 39.162 1.00 0.00 H new ATOM 0 HA3 GLY A 68 42.189 30.990 37.719 1.00 0.00 H new ATOM 978 N ARG A 69 40.058 29.186 39.505 1.00 0.00 N ATOM 979 CA ARG A 69 39.065 28.071 39.400 1.00 0.00 C ATOM 980 C ARG A 69 38.174 28.072 40.644 1.00 0.00 C ATOM 981 O ARG A 69 38.461 28.734 41.625 1.00 0.00 O ATOM 982 CB ARG A 69 39.813 26.723 39.278 1.00 0.00 C ATOM 983 CG ARG A 69 39.404 25.745 40.395 1.00 0.00 C ATOM 984 CD ARG A 69 40.453 24.636 40.500 1.00 0.00 C ATOM 985 NE ARG A 69 40.091 23.506 39.593 1.00 0.00 N ATOM 986 CZ ARG A 69 40.986 22.628 39.236 1.00 0.00 C ATOM 987 NH1 ARG A 69 42.221 22.763 39.573 1.00 0.00 N ATOM 988 NH2 ARG A 69 40.636 21.638 38.489 1.00 0.00 N ATOM 0 H ARG A 69 40.062 29.674 40.401 1.00 0.00 H new ATOM 0 HA ARG A 69 38.444 28.210 38.515 1.00 0.00 H new ATOM 0 HB2 ARG A 69 39.602 26.276 38.307 1.00 0.00 H new ATOM 0 HB3 ARG A 69 40.888 26.897 39.322 1.00 0.00 H new ATOM 0 HG2 ARG A 69 39.319 26.273 41.345 1.00 0.00 H new ATOM 0 HG3 ARG A 69 38.425 25.317 40.180 1.00 0.00 H new ATOM 0 HD2 ARG A 69 41.435 25.026 40.234 1.00 0.00 H new ATOM 0 HD3 ARG A 69 40.518 24.281 41.529 1.00 0.00 H new ATOM 0 HE ARG A 69 39.134 23.420 39.250 1.00 0.00 H new ATOM 0 HH11 ARG A 69 42.513 23.567 40.128 1.00 0.00 H new ATOM 0 HH12 ARG A 69 42.907 22.066 39.285 1.00 0.00 H new ATOM 0 HH21 ARG A 69 39.667 21.547 38.183 1.00 0.00 H new ATOM 0 HH22 ARG A 69 41.328 20.945 38.203 1.00 0.00 H new ATOM 1002 N THR A 70 37.108 27.323 40.617 1.00 0.00 N ATOM 1003 CA THR A 70 36.210 27.273 41.802 1.00 0.00 C ATOM 1004 C THR A 70 35.636 25.859 41.963 1.00 0.00 C ATOM 1005 O THR A 70 35.554 25.094 41.012 1.00 0.00 O ATOM 1006 CB THR A 70 35.085 28.302 41.642 1.00 0.00 C ATOM 1007 OG1 THR A 70 35.660 29.599 41.527 1.00 0.00 O ATOM 1008 CG2 THR A 70 34.170 28.267 42.867 1.00 0.00 C ATOM 0 H THR A 70 36.821 26.745 39.827 1.00 0.00 H new ATOM 0 HA THR A 70 36.778 27.517 42.699 1.00 0.00 H new ATOM 0 HB THR A 70 34.502 28.067 40.751 1.00 0.00 H new ATOM 0 HG1 THR A 70 34.948 30.264 41.423 1.00 0.00 H new ATOM 0 HG21 THR A 70 33.373 29.001 42.747 1.00 0.00 H new ATOM 0 HG22 THR A 70 33.736 27.272 42.968 1.00 0.00 H new ATOM 0 HG23 THR A 70 34.749 28.503 43.760 1.00 0.00 H new ATOM 1016 N TRP A 71 35.248 25.521 43.170 1.00 0.00 N ATOM 1017 CA TRP A 71 34.679 24.172 43.464 1.00 0.00 C ATOM 1018 C TRP A 71 33.313 24.333 44.165 1.00 0.00 C ATOM 1019 O TRP A 71 33.160 25.161 45.047 1.00 0.00 O ATOM 1020 CB TRP A 71 35.648 23.436 44.407 1.00 0.00 C ATOM 1021 CG TRP A 71 36.550 22.551 43.619 1.00 0.00 C ATOM 1022 CD1 TRP A 71 37.857 22.792 43.364 1.00 0.00 C ATOM 1023 CD2 TRP A 71 36.238 21.279 42.993 1.00 0.00 C ATOM 1024 NE1 TRP A 71 38.370 21.741 42.623 1.00 0.00 N ATOM 1025 CE2 TRP A 71 37.404 20.785 42.361 1.00 0.00 C ATOM 1026 CE3 TRP A 71 35.061 20.515 42.911 1.00 0.00 C ATOM 1027 CZ2 TRP A 71 37.400 19.571 41.672 1.00 0.00 C ATOM 1028 CZ3 TRP A 71 35.053 19.293 42.217 1.00 0.00 C ATOM 1029 CH2 TRP A 71 36.222 18.824 41.599 1.00 0.00 C ATOM 0 H TRP A 71 35.304 26.139 43.979 1.00 0.00 H new ATOM 0 HA TRP A 71 34.546 23.609 42.540 1.00 0.00 H new ATOM 0 HB2 TRP A 71 36.237 24.158 44.973 1.00 0.00 H new ATOM 0 HB3 TRP A 71 35.086 22.845 45.131 1.00 0.00 H new ATOM 0 HD1 TRP A 71 38.410 23.662 43.686 1.00 0.00 H new ATOM 0 HE1 TRP A 71 39.339 21.679 42.309 1.00 0.00 H new ATOM 0 HE3 TRP A 71 34.157 20.869 43.384 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 38.302 19.212 41.199 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 34.144 18.713 42.159 1.00 0.00 H new ATOM 0 HH2 TRP A 71 36.211 17.885 41.066 1.00 0.00 H new ATOM 1040 N ARG A 72 32.327 23.548 43.796 1.00 0.00 N ATOM 1041 CA ARG A 72 30.980 23.651 44.462 1.00 0.00 C ATOM 1042 C ARG A 72 30.534 22.242 44.923 1.00 0.00 C ATOM 1043 O ARG A 72 30.987 21.246 44.379 1.00 0.00 O ATOM 1044 CB ARG A 72 29.965 24.224 43.456 1.00 0.00 C ATOM 1045 CG ARG A 72 30.484 25.546 42.855 1.00 0.00 C ATOM 1046 CD ARG A 72 29.836 25.758 41.478 1.00 0.00 C ATOM 1047 NE ARG A 72 29.490 27.209 41.269 1.00 0.00 N ATOM 1048 CZ ARG A 72 28.796 27.870 42.142 1.00 0.00 C ATOM 1049 NH1 ARG A 72 28.305 27.263 43.174 1.00 0.00 N ATOM 1050 NH2 ARG A 72 28.567 29.131 41.965 1.00 0.00 N ATOM 0 H ARG A 72 32.393 22.841 43.064 1.00 0.00 H new ATOM 0 HA ARG A 72 31.038 24.310 45.329 1.00 0.00 H new ATOM 0 HB2 ARG A 72 29.787 23.501 42.660 1.00 0.00 H new ATOM 0 HB3 ARG A 72 29.009 24.394 43.952 1.00 0.00 H new ATOM 0 HG2 ARG A 72 30.245 26.379 43.516 1.00 0.00 H new ATOM 0 HG3 ARG A 72 31.569 25.516 42.760 1.00 0.00 H new ATOM 0 HD2 ARG A 72 30.517 25.425 40.695 1.00 0.00 H new ATOM 0 HD3 ARG A 72 28.936 25.149 41.397 1.00 0.00 H new ATOM 0 HE ARG A 72 29.808 27.681 40.423 1.00 0.00 H new ATOM 0 HH11 ARG A 72 28.464 26.264 43.301 1.00 0.00 H new ATOM 0 HH12 ARG A 72 27.759 27.784 43.860 1.00 0.00 H new ATOM 0 HH21 ARG A 72 28.932 29.605 41.139 1.00 0.00 H new ATOM 0 HH22 ARG A 72 28.021 29.651 42.652 1.00 0.00 H new ATOM 1064 N GLU A 73 29.653 22.155 45.912 1.00 0.00 N ATOM 1065 CA GLU A 73 29.183 20.812 46.425 1.00 0.00 C ATOM 1066 C GLU A 73 27.649 20.664 46.296 1.00 0.00 C ATOM 1067 O GLU A 73 26.917 21.617 46.034 1.00 0.00 O ATOM 1068 CB GLU A 73 29.587 20.684 47.909 1.00 0.00 C ATOM 1069 CG GLU A 73 28.608 21.481 48.801 1.00 0.00 C ATOM 1070 CD GLU A 73 28.114 20.627 49.988 1.00 0.00 C ATOM 1071 OE1 GLU A 73 28.394 19.442 50.032 1.00 0.00 O ATOM 1072 OE2 GLU A 73 27.452 21.182 50.851 1.00 0.00 O ATOM 0 H GLU A 73 29.240 22.959 46.385 1.00 0.00 H new ATOM 0 HA GLU A 73 29.647 20.027 45.828 1.00 0.00 H new ATOM 0 HB2 GLU A 73 29.587 19.635 48.204 1.00 0.00 H new ATOM 0 HB3 GLU A 73 30.602 21.055 48.050 1.00 0.00 H new ATOM 0 HG2 GLU A 73 29.101 22.378 49.175 1.00 0.00 H new ATOM 0 HG3 GLU A 73 27.756 21.810 48.207 1.00 0.00 H new ATOM 1079 N ALA A 74 27.165 19.466 46.467 1.00 0.00 N ATOM 1080 CA ALA A 74 25.691 19.232 46.361 1.00 0.00 C ATOM 1081 C ALA A 74 25.302 17.853 46.922 1.00 0.00 C ATOM 1082 O ALA A 74 25.971 16.868 46.680 1.00 0.00 O ATOM 1083 CB ALA A 74 25.277 19.319 44.896 1.00 0.00 C ATOM 0 H ALA A 74 27.722 18.637 46.675 1.00 0.00 H new ATOM 0 HA ALA A 74 25.177 19.994 46.947 1.00 0.00 H new ATOM 0 HB1 ALA A 74 24.204 19.149 44.811 1.00 0.00 H new ATOM 0 HB2 ALA A 74 25.520 20.308 44.507 1.00 0.00 H new ATOM 0 HB3 ALA A 74 25.811 18.562 44.321 1.00 0.00 H new ATOM 1089 N ASP A 75 24.219 17.797 47.685 1.00 0.00 N ATOM 1090 CA ASP A 75 23.741 16.516 48.305 1.00 0.00 C ATOM 1091 C ASP A 75 23.429 15.464 47.248 1.00 0.00 C ATOM 1092 O ASP A 75 23.120 15.773 46.109 1.00 0.00 O ATOM 1093 CB ASP A 75 22.457 16.813 49.090 1.00 0.00 C ATOM 1094 CG ASP A 75 22.792 16.995 50.552 1.00 0.00 C ATOM 1095 OD1 ASP A 75 23.698 17.750 50.828 1.00 0.00 O ATOM 1096 OD2 ASP A 75 22.164 16.354 51.378 1.00 0.00 O ATOM 0 H ASP A 75 23.640 18.607 47.904 1.00 0.00 H new ATOM 0 HA ASP A 75 24.528 16.128 48.952 1.00 0.00 H new ATOM 0 HB2 ASP A 75 21.980 17.712 48.701 1.00 0.00 H new ATOM 0 HB3 ASP A 75 21.746 15.996 48.968 1.00 0.00 H new ATOM 1101 N ILE A 76 23.524 14.216 47.620 1.00 0.00 N ATOM 1102 CA ILE A 76 23.239 13.119 46.651 1.00 0.00 C ATOM 1103 C ILE A 76 22.395 12.020 47.307 1.00 0.00 C ATOM 1104 O ILE A 76 22.567 11.706 48.469 1.00 0.00 O ATOM 1105 CB ILE A 76 24.556 12.498 46.139 1.00 0.00 C ATOM 1106 CG1 ILE A 76 25.437 13.608 45.562 1.00 0.00 C ATOM 1107 CG2 ILE A 76 24.246 11.489 45.031 1.00 0.00 C ATOM 1108 CD1 ILE A 76 24.762 14.249 44.346 1.00 0.00 C ATOM 0 H ILE A 76 23.788 13.908 48.556 1.00 0.00 H new ATOM 0 HA ILE A 76 22.686 13.548 45.816 1.00 0.00 H new ATOM 0 HB ILE A 76 25.069 11.998 46.961 1.00 0.00 H new ATOM 0 HG12 ILE A 76 25.624 14.365 46.323 1.00 0.00 H new ATOM 0 HG13 ILE A 76 26.406 13.199 45.275 1.00 0.00 H new ATOM 0 HG21 ILE A 76 25.175 11.050 44.669 1.00 0.00 H new ATOM 0 HG22 ILE A 76 23.602 10.703 45.425 1.00 0.00 H new ATOM 0 HG23 ILE A 76 23.739 11.995 44.209 1.00 0.00 H new ATOM 0 HD11 ILE A 76 25.402 15.036 43.948 1.00 0.00 H new ATOM 0 HD12 ILE A 76 24.599 13.492 43.579 1.00 0.00 H new ATOM 0 HD13 ILE A 76 23.804 14.676 44.644 1.00 0.00 H new ATOM 1120 N ASN A 77 21.480 11.443 46.562 1.00 0.00 N ATOM 1121 CA ASN A 77 20.624 10.353 47.123 1.00 0.00 C ATOM 1122 C ASN A 77 19.829 10.859 48.343 1.00 0.00 C ATOM 1123 O ASN A 77 20.020 10.403 49.464 1.00 0.00 O ATOM 1124 CB ASN A 77 21.506 9.170 47.535 1.00 0.00 C ATOM 1125 CG ASN A 77 21.744 8.267 46.334 1.00 0.00 C ATOM 1126 OD1 ASN A 77 20.806 7.781 45.731 1.00 0.00 O ATOM 1127 ND2 ASN A 77 22.963 8.007 45.963 1.00 0.00 N ATOM 0 H ASN A 77 21.291 11.682 45.589 1.00 0.00 H new ATOM 0 HA ASN A 77 19.917 10.034 46.357 1.00 0.00 H new ATOM 0 HB2 ASN A 77 22.458 9.531 47.925 1.00 0.00 H new ATOM 0 HB3 ASN A 77 21.026 8.608 48.336 1.00 0.00 H new ATOM 0 HD21 ASN A 77 23.134 7.395 45.165 1.00 0.00 H new ATOM 0 HD22 ASN A 77 23.748 8.415 46.470 1.00 0.00 H new ATOM 1134 N TYR A 78 18.921 11.785 48.128 1.00 0.00 N ATOM 1135 CA TYR A 78 18.090 12.315 49.253 1.00 0.00 C ATOM 1136 C TYR A 78 16.604 12.166 48.908 1.00 0.00 C ATOM 1137 O TYR A 78 16.230 12.020 47.745 1.00 0.00 O ATOM 1138 CB TYR A 78 18.407 13.797 49.488 1.00 0.00 C ATOM 1139 CG TYR A 78 17.391 14.385 50.446 1.00 0.00 C ATOM 1140 CD1 TYR A 78 17.439 14.068 51.810 1.00 0.00 C ATOM 1141 CD2 TYR A 78 16.409 15.260 49.968 1.00 0.00 C ATOM 1142 CE1 TYR A 78 16.508 14.636 52.691 1.00 0.00 C ATOM 1143 CE2 TYR A 78 15.482 15.822 50.845 1.00 0.00 C ATOM 1144 CZ TYR A 78 15.528 15.517 52.204 1.00 0.00 C ATOM 1145 OH TYR A 78 14.613 16.099 53.054 1.00 0.00 O ATOM 0 H TYR A 78 18.721 12.196 47.216 1.00 0.00 H new ATOM 0 HA TYR A 78 18.317 11.750 50.157 1.00 0.00 H new ATOM 0 HB2 TYR A 78 19.412 13.905 49.896 1.00 0.00 H new ATOM 0 HB3 TYR A 78 18.387 14.339 48.542 1.00 0.00 H new ATOM 0 HD1 TYR A 78 18.191 13.388 52.182 1.00 0.00 H new ATOM 0 HD2 TYR A 78 16.369 15.501 48.916 1.00 0.00 H new ATOM 0 HE1 TYR A 78 16.544 14.396 53.743 1.00 0.00 H new ATOM 0 HE2 TYR A 78 14.726 16.496 50.470 1.00 0.00 H new ATOM 0 HH TYR A 78 14.141 16.818 52.584 1.00 0.00 H new ATOM 1155 N THR A 79 15.749 12.192 49.910 1.00 0.00 N ATOM 1156 CA THR A 79 14.277 12.051 49.668 1.00 0.00 C ATOM 1157 C THR A 79 13.552 13.021 50.597 1.00 0.00 C ATOM 1158 O THR A 79 13.107 14.083 50.193 1.00 0.00 O ATOM 1159 CB THR A 79 13.839 10.607 49.988 1.00 0.00 C ATOM 1160 OG1 THR A 79 13.884 10.390 51.399 1.00 0.00 O ATOM 1161 CG2 THR A 79 14.776 9.619 49.289 1.00 0.00 C ATOM 0 H THR A 79 16.013 12.306 50.889 1.00 0.00 H new ATOM 0 HA THR A 79 14.039 12.271 48.627 1.00 0.00 H new ATOM 0 HB THR A 79 12.820 10.455 49.632 1.00 0.00 H new ATOM 0 HG1 THR A 79 14.816 10.403 51.702 1.00 0.00 H new ATOM 0 HG21 THR A 79 14.465 8.599 49.516 1.00 0.00 H new ATOM 0 HG22 THR A 79 14.735 9.779 48.212 1.00 0.00 H new ATOM 0 HG23 THR A 79 15.796 9.774 49.641 1.00 0.00 H new ATOM 1169 N SER A 80 13.450 12.657 51.835 1.00 0.00 N ATOM 1170 CA SER A 80 12.777 13.526 52.833 1.00 0.00 C ATOM 1171 C SER A 80 13.424 13.289 54.203 1.00 0.00 C ATOM 1172 O SER A 80 13.265 12.225 54.787 1.00 0.00 O ATOM 1173 CB SER A 80 11.289 13.166 52.916 1.00 0.00 C ATOM 1174 OG SER A 80 10.869 13.175 54.270 1.00 0.00 O ATOM 0 H SER A 80 13.810 11.778 52.208 1.00 0.00 H new ATOM 0 HA SER A 80 12.879 14.570 52.538 1.00 0.00 H new ATOM 0 HB2 SER A 80 10.700 13.878 52.338 1.00 0.00 H new ATOM 0 HB3 SER A 80 11.118 12.182 52.479 1.00 0.00 H new ATOM 0 HG SER A 80 9.917 12.946 54.319 1.00 0.00 H new ATOM 1180 N GLY A 81 14.125 14.260 54.739 1.00 0.00 N ATOM 1181 CA GLY A 81 14.755 14.078 56.090 1.00 0.00 C ATOM 1182 C GLY A 81 15.927 15.047 56.229 1.00 0.00 C ATOM 1183 O GLY A 81 15.739 16.238 56.390 1.00 0.00 O ATOM 0 H GLY A 81 14.289 15.168 54.303 1.00 0.00 H new ATOM 0 HA2 GLY A 81 14.021 14.260 56.875 1.00 0.00 H new ATOM 0 HA3 GLY A 81 15.100 13.051 56.209 1.00 0.00 H new ATOM 1187 N PHE A 82 17.129 14.546 56.130 1.00 0.00 N ATOM 1188 CA PHE A 82 18.331 15.424 56.238 1.00 0.00 C ATOM 1189 C PHE A 82 19.397 14.954 55.229 1.00 0.00 C ATOM 1190 O PHE A 82 19.125 14.137 54.363 1.00 0.00 O ATOM 1191 CB PHE A 82 18.871 15.333 57.668 1.00 0.00 C ATOM 1192 CG PHE A 82 19.896 16.415 57.892 1.00 0.00 C ATOM 1193 CD1 PHE A 82 19.494 17.758 57.966 1.00 0.00 C ATOM 1194 CD2 PHE A 82 21.251 16.081 58.008 1.00 0.00 C ATOM 1195 CE1 PHE A 82 20.448 18.766 58.156 1.00 0.00 C ATOM 1196 CE2 PHE A 82 22.205 17.088 58.199 1.00 0.00 C ATOM 1197 CZ PHE A 82 21.804 18.433 58.271 1.00 0.00 C ATOM 0 H PHE A 82 17.332 13.558 55.978 1.00 0.00 H new ATOM 0 HA PHE A 82 18.072 16.459 56.013 1.00 0.00 H new ATOM 0 HB2 PHE A 82 18.055 15.438 58.383 1.00 0.00 H new ATOM 0 HB3 PHE A 82 19.319 14.354 57.837 1.00 0.00 H new ATOM 0 HD1 PHE A 82 18.449 18.014 57.876 1.00 0.00 H new ATOM 0 HD2 PHE A 82 21.560 15.048 57.950 1.00 0.00 H new ATOM 0 HE1 PHE A 82 20.138 19.799 58.214 1.00 0.00 H new ATOM 0 HE2 PHE A 82 23.250 16.831 58.291 1.00 0.00 H new ATOM 0 HZ PHE A 82 22.541 19.209 58.415 1.00 0.00 H new ATOM 1207 N ARG A 83 20.597 15.468 55.312 1.00 0.00 N ATOM 1208 CA ARG A 83 21.645 15.035 54.356 1.00 0.00 C ATOM 1209 C ARG A 83 22.072 13.590 54.679 1.00 0.00 C ATOM 1210 O ARG A 83 21.334 12.825 55.270 1.00 0.00 O ATOM 1211 CB ARG A 83 22.852 15.973 54.456 1.00 0.00 C ATOM 1212 CG ARG A 83 22.395 17.440 54.467 1.00 0.00 C ATOM 1213 CD ARG A 83 23.498 18.333 53.875 1.00 0.00 C ATOM 1214 NE ARG A 83 24.843 17.729 54.148 1.00 0.00 N ATOM 1215 CZ ARG A 83 25.905 18.096 53.479 1.00 0.00 C ATOM 1216 NH1 ARG A 83 25.813 18.910 52.472 1.00 0.00 N ATOM 1217 NH2 ARG A 83 27.062 17.614 53.808 1.00 0.00 N ATOM 0 H ARG A 83 20.890 16.164 55.998 1.00 0.00 H new ATOM 0 HA ARG A 83 21.249 15.072 53.341 1.00 0.00 H new ATOM 0 HB2 ARG A 83 23.415 15.755 55.363 1.00 0.00 H new ATOM 0 HB3 ARG A 83 23.524 15.802 53.615 1.00 0.00 H new ATOM 0 HG2 ARG A 83 21.477 17.549 53.889 1.00 0.00 H new ATOM 0 HG3 ARG A 83 22.169 17.753 55.487 1.00 0.00 H new ATOM 0 HD2 ARG A 83 23.351 18.444 52.801 1.00 0.00 H new ATOM 0 HD3 ARG A 83 23.443 19.331 54.310 1.00 0.00 H new ATOM 0 HE ARG A 83 24.932 17.016 54.872 1.00 0.00 H new ATOM 0 HH11 ARG A 83 24.902 19.274 52.192 1.00 0.00 H new ATOM 0 HH12 ARG A 83 26.652 19.186 51.961 1.00 0.00 H new ATOM 0 HH21 ARG A 83 27.138 16.955 54.582 1.00 0.00 H new ATOM 0 HH22 ARG A 83 27.896 17.894 53.292 1.00 0.00 H new ATOM 1231 N ASN A 84 23.270 13.227 54.308 1.00 0.00 N ATOM 1232 CA ASN A 84 23.782 11.849 54.574 1.00 0.00 C ATOM 1233 C ASN A 84 25.298 11.839 54.274 1.00 0.00 C ATOM 1234 O ASN A 84 25.953 12.860 54.403 1.00 0.00 O ATOM 1235 CB ASN A 84 23.026 10.857 53.661 1.00 0.00 C ATOM 1236 CG ASN A 84 23.050 11.368 52.219 1.00 0.00 C ATOM 1237 OD1 ASN A 84 24.057 11.876 51.770 1.00 0.00 O ATOM 1238 ND2 ASN A 84 21.981 11.283 51.476 1.00 0.00 N ATOM 0 H ASN A 84 23.928 13.837 53.823 1.00 0.00 H new ATOM 0 HA ASN A 84 23.621 11.554 55.611 1.00 0.00 H new ATOM 0 HB2 ASN A 84 23.488 9.871 53.716 1.00 0.00 H new ATOM 0 HB3 ASN A 84 21.996 10.746 54.001 1.00 0.00 H new ATOM 0 HD21 ASN A 84 21.993 11.643 50.522 1.00 0.00 H new ATOM 0 HD22 ASN A 84 21.133 10.857 51.850 1.00 0.00 H new ATOM 1245 N SER A 85 25.870 10.722 53.892 1.00 0.00 N ATOM 1246 CA SER A 85 27.338 10.685 53.603 1.00 0.00 C ATOM 1247 C SER A 85 27.587 10.767 52.085 1.00 0.00 C ATOM 1248 O SER A 85 28.718 10.841 51.634 1.00 0.00 O ATOM 1249 CB SER A 85 27.899 9.377 54.154 1.00 0.00 C ATOM 1250 OG SER A 85 27.524 8.313 53.295 1.00 0.00 O ATOM 0 H SER A 85 25.383 9.834 53.768 1.00 0.00 H new ATOM 0 HA SER A 85 27.831 11.536 54.074 1.00 0.00 H new ATOM 0 HB2 SER A 85 28.985 9.435 54.228 1.00 0.00 H new ATOM 0 HB3 SER A 85 27.520 9.199 55.160 1.00 0.00 H new ATOM 0 HG SER A 85 28.256 8.122 52.672 1.00 0.00 H new ATOM 1256 N ASP A 86 26.536 10.782 51.296 1.00 0.00 N ATOM 1257 CA ASP A 86 26.698 10.841 49.807 1.00 0.00 C ATOM 1258 C ASP A 86 26.703 12.305 49.328 1.00 0.00 C ATOM 1259 O ASP A 86 25.728 13.022 49.463 1.00 0.00 O ATOM 1260 CB ASP A 86 25.531 10.076 49.157 1.00 0.00 C ATOM 1261 CG ASP A 86 26.115 9.072 48.157 1.00 0.00 C ATOM 1262 OD1 ASP A 86 26.956 8.292 48.566 1.00 0.00 O ATOM 1263 OD2 ASP A 86 25.724 9.099 46.992 1.00 0.00 O ATOM 0 H ASP A 86 25.570 10.756 51.622 1.00 0.00 H new ATOM 0 HA ASP A 86 27.646 10.386 49.521 1.00 0.00 H new ATOM 0 HB2 ASP A 86 24.945 9.559 49.917 1.00 0.00 H new ATOM 0 HB3 ASP A 86 24.857 10.768 48.652 1.00 0.00 H new ATOM 1268 N ARG A 87 27.794 12.742 48.756 1.00 0.00 N ATOM 1269 CA ARG A 87 27.885 14.145 48.247 1.00 0.00 C ATOM 1270 C ARG A 87 28.630 14.158 46.915 1.00 0.00 C ATOM 1271 O ARG A 87 29.496 13.345 46.673 1.00 0.00 O ATOM 1272 CB ARG A 87 28.649 15.007 49.260 1.00 0.00 C ATOM 1273 CG ARG A 87 27.788 15.173 50.503 1.00 0.00 C ATOM 1274 CD ARG A 87 26.743 16.271 50.230 1.00 0.00 C ATOM 1275 NE ARG A 87 25.417 16.041 50.910 1.00 0.00 N ATOM 1276 CZ ARG A 87 25.073 14.866 51.378 1.00 0.00 C ATOM 1277 NH1 ARG A 87 25.915 14.103 51.992 1.00 0.00 N ATOM 1278 NH2 ARG A 87 23.823 14.556 51.445 1.00 0.00 N ATOM 0 H ARG A 87 28.635 12.182 48.618 1.00 0.00 H new ATOM 0 HA ARG A 87 26.880 14.544 48.108 1.00 0.00 H new ATOM 0 HB2 ARG A 87 29.598 14.537 49.517 1.00 0.00 H new ATOM 0 HB3 ARG A 87 28.882 15.980 48.829 1.00 0.00 H new ATOM 0 HG2 ARG A 87 27.294 14.233 50.750 1.00 0.00 H new ATOM 0 HG3 ARG A 87 28.406 15.443 51.359 1.00 0.00 H new ATOM 0 HD2 ARG A 87 27.145 17.230 50.557 1.00 0.00 H new ATOM 0 HD3 ARG A 87 26.580 16.343 49.155 1.00 0.00 H new ATOM 0 HE ARG A 87 24.769 16.822 51.009 1.00 0.00 H new ATOM 0 HH11 ARG A 87 26.879 14.410 52.124 1.00 0.00 H new ATOM 0 HH12 ARG A 87 25.616 13.194 52.345 1.00 0.00 H new ATOM 0 HH21 ARG A 87 23.115 15.222 51.136 1.00 0.00 H new ATOM 0 HH22 ARG A 87 23.542 13.645 51.807 1.00 0.00 H new ATOM 1292 N ILE A 88 28.309 15.098 46.063 1.00 0.00 N ATOM 1293 CA ILE A 88 29.007 15.206 44.755 1.00 0.00 C ATOM 1294 C ILE A 88 29.701 16.566 44.681 1.00 0.00 C ATOM 1295 O ILE A 88 29.143 17.577 45.071 1.00 0.00 O ATOM 1296 CB ILE A 88 28.013 15.055 43.596 1.00 0.00 C ATOM 1297 CG1 ILE A 88 28.783 14.827 42.292 1.00 0.00 C ATOM 1298 CG2 ILE A 88 27.156 16.310 43.470 1.00 0.00 C ATOM 1299 CD1 ILE A 88 27.821 14.924 41.107 1.00 0.00 C ATOM 0 H ILE A 88 27.586 15.800 46.223 1.00 0.00 H new ATOM 0 HA ILE A 88 29.744 14.408 44.670 1.00 0.00 H new ATOM 0 HB ILE A 88 27.363 14.202 43.793 1.00 0.00 H new ATOM 0 HG12 ILE A 88 29.576 15.568 42.192 1.00 0.00 H new ATOM 0 HG13 ILE A 88 29.261 13.848 42.306 1.00 0.00 H new ATOM 0 HG21 ILE A 88 26.455 16.190 42.644 1.00 0.00 H new ATOM 0 HG22 ILE A 88 26.603 16.467 44.396 1.00 0.00 H new ATOM 0 HG23 ILE A 88 27.797 17.171 43.280 1.00 0.00 H new ATOM 0 HD11 ILE A 88 28.369 14.762 40.179 1.00 0.00 H new ATOM 0 HD12 ILE A 88 27.044 14.166 41.206 1.00 0.00 H new ATOM 0 HD13 ILE A 88 27.363 15.913 41.090 1.00 0.00 H new ATOM 1311 N LEU A 89 30.915 16.578 44.188 1.00 0.00 N ATOM 1312 CA LEU A 89 31.701 17.833 44.080 1.00 0.00 C ATOM 1313 C LEU A 89 31.917 18.130 42.592 1.00 0.00 C ATOM 1314 O LEU A 89 32.428 17.296 41.847 1.00 0.00 O ATOM 1315 CB LEU A 89 33.055 17.627 44.773 1.00 0.00 C ATOM 1316 CG LEU A 89 33.030 18.175 46.210 1.00 0.00 C ATOM 1317 CD1 LEU A 89 33.124 19.700 46.188 1.00 0.00 C ATOM 1318 CD2 LEU A 89 31.732 17.755 46.909 1.00 0.00 C ATOM 0 H LEU A 89 31.400 15.747 43.850 1.00 0.00 H new ATOM 0 HA LEU A 89 31.178 18.665 44.553 1.00 0.00 H new ATOM 0 HB2 LEU A 89 33.301 16.565 44.790 1.00 0.00 H new ATOM 0 HB3 LEU A 89 33.838 18.127 44.203 1.00 0.00 H new ATOM 0 HG LEU A 89 33.881 17.768 46.755 1.00 0.00 H new ATOM 0 HD11 LEU A 89 33.106 20.080 47.209 1.00 0.00 H new ATOM 0 HD12 LEU A 89 34.054 20.000 45.706 1.00 0.00 H new ATOM 0 HD13 LEU A 89 32.279 20.109 45.633 1.00 0.00 H new ATOM 0 HD21 LEU A 89 31.723 18.147 47.926 1.00 0.00 H new ATOM 0 HD22 LEU A 89 30.878 18.151 46.360 1.00 0.00 H new ATOM 0 HD23 LEU A 89 31.671 16.667 46.939 1.00 0.00 H new ATOM 1330 N TYR A 90 31.547 19.304 42.164 1.00 0.00 N ATOM 1331 CA TYR A 90 31.720 19.683 40.730 1.00 0.00 C ATOM 1332 C TYR A 90 32.654 20.886 40.636 1.00 0.00 C ATOM 1333 O TYR A 90 32.473 21.893 41.301 1.00 0.00 O ATOM 1334 CB TYR A 90 30.367 20.008 40.098 1.00 0.00 C ATOM 1335 CG TYR A 90 29.394 20.582 41.121 1.00 0.00 C ATOM 1336 CD1 TYR A 90 29.033 19.847 42.249 1.00 0.00 C ATOM 1337 CD2 TYR A 90 28.840 21.846 40.914 1.00 0.00 C ATOM 1338 CE1 TYR A 90 28.116 20.376 43.165 1.00 0.00 C ATOM 1339 CE2 TYR A 90 27.930 22.378 41.835 1.00 0.00 C ATOM 1340 CZ TYR A 90 27.567 21.639 42.958 1.00 0.00 C ATOM 1341 OH TYR A 90 26.657 22.156 43.857 1.00 0.00 O ATOM 0 H TYR A 90 31.128 20.026 42.750 1.00 0.00 H new ATOM 0 HA TYR A 90 32.156 18.845 40.186 1.00 0.00 H new ATOM 0 HB2 TYR A 90 30.506 20.722 39.286 1.00 0.00 H new ATOM 0 HB3 TYR A 90 29.943 19.105 39.659 1.00 0.00 H new ATOM 0 HD1 TYR A 90 29.461 18.870 42.416 1.00 0.00 H new ATOM 0 HD2 TYR A 90 29.115 22.416 40.039 1.00 0.00 H new ATOM 0 HE1 TYR A 90 27.833 19.803 44.035 1.00 0.00 H new ATOM 0 HE2 TYR A 90 27.510 23.360 41.675 1.00 0.00 H new ATOM 0 HH TYR A 90 27.085 22.261 44.732 1.00 0.00 H new ATOM 1351 N SER A 91 33.666 20.775 39.828 1.00 0.00 N ATOM 1352 CA SER A 91 34.660 21.870 39.687 1.00 0.00 C ATOM 1353 C SER A 91 34.331 22.808 38.522 1.00 0.00 C ATOM 1354 O SER A 91 33.633 22.462 37.585 1.00 0.00 O ATOM 1355 CB SER A 91 36.002 21.230 39.409 1.00 0.00 C ATOM 1356 OG SER A 91 36.114 21.009 38.011 1.00 0.00 O ATOM 0 H SER A 91 33.850 19.956 39.248 1.00 0.00 H new ATOM 0 HA SER A 91 34.656 22.461 40.603 1.00 0.00 H new ATOM 0 HB2 SER A 91 36.809 21.875 39.756 1.00 0.00 H new ATOM 0 HB3 SER A 91 36.092 20.288 39.950 1.00 0.00 H new ATOM 0 HG SER A 91 36.971 21.360 37.692 1.00 0.00 H new ATOM 1362 N SER A 92 34.873 24.001 38.573 1.00 0.00 N ATOM 1363 CA SER A 92 34.648 24.994 37.483 1.00 0.00 C ATOM 1364 C SER A 92 35.382 24.519 36.239 1.00 0.00 C ATOM 1365 O SER A 92 35.082 24.931 35.140 1.00 0.00 O ATOM 1366 CB SER A 92 35.206 26.356 37.903 1.00 0.00 C ATOM 1367 OG SER A 92 36.519 26.194 38.444 1.00 0.00 O ATOM 0 H SER A 92 35.468 24.330 39.333 1.00 0.00 H new ATOM 0 HA SER A 92 33.581 25.088 37.283 1.00 0.00 H new ATOM 0 HB2 SER A 92 35.236 27.027 37.045 1.00 0.00 H new ATOM 0 HB3 SER A 92 34.551 26.815 38.644 1.00 0.00 H new ATOM 0 HG SER A 92 37.177 26.572 37.824 1.00 0.00 H new ATOM 1373 N ASP A 93 36.338 23.644 36.406 1.00 0.00 N ATOM 1374 CA ASP A 93 37.093 23.133 35.217 1.00 0.00 C ATOM 1375 C ASP A 93 36.311 21.993 34.559 1.00 0.00 C ATOM 1376 O ASP A 93 36.814 21.318 33.685 1.00 0.00 O ATOM 1377 CB ASP A 93 38.480 22.641 35.644 1.00 0.00 C ATOM 1378 CG ASP A 93 38.759 23.090 37.072 1.00 0.00 C ATOM 1379 OD1 ASP A 93 39.288 24.175 37.248 1.00 0.00 O ATOM 1380 OD2 ASP A 93 38.438 22.329 37.972 1.00 0.00 O ATOM 0 H ASP A 93 36.630 23.262 37.306 1.00 0.00 H new ATOM 0 HA ASP A 93 37.216 23.943 34.498 1.00 0.00 H new ATOM 0 HB2 ASP A 93 38.529 21.554 35.577 1.00 0.00 H new ATOM 0 HB3 ASP A 93 39.241 23.037 34.972 1.00 0.00 H new ATOM 1385 N TRP A 94 35.075 21.790 34.966 1.00 0.00 N ATOM 1386 CA TRP A 94 34.231 20.708 34.373 1.00 0.00 C ATOM 1387 C TRP A 94 34.642 19.345 34.951 1.00 0.00 C ATOM 1388 O TRP A 94 34.542 18.330 34.283 1.00 0.00 O ATOM 1389 CB TRP A 94 34.394 20.703 32.848 1.00 0.00 C ATOM 1390 CG TRP A 94 33.053 20.675 32.181 1.00 0.00 C ATOM 1391 CD1 TRP A 94 32.121 21.650 32.267 1.00 0.00 C ATOM 1392 CD2 TRP A 94 32.481 19.637 31.329 1.00 0.00 C ATOM 1393 NE1 TRP A 94 31.028 21.289 31.501 1.00 0.00 N ATOM 1394 CE2 TRP A 94 31.198 20.055 30.908 1.00 0.00 C ATOM 1395 CE3 TRP A 94 32.952 18.391 30.877 1.00 0.00 C ATOM 1396 CZ2 TRP A 94 30.407 19.267 30.072 1.00 0.00 C ATOM 1397 CZ3 TRP A 94 32.159 17.590 30.035 1.00 0.00 C ATOM 1398 CH2 TRP A 94 30.890 18.031 29.630 1.00 0.00 C ATOM 0 H TRP A 94 34.614 22.337 35.693 1.00 0.00 H new ATOM 0 HA TRP A 94 33.186 20.894 34.620 1.00 0.00 H new ATOM 0 HB2 TRP A 94 34.946 21.588 32.532 1.00 0.00 H new ATOM 0 HB3 TRP A 94 34.978 19.836 32.541 1.00 0.00 H new ATOM 0 HD1 TRP A 94 32.215 22.561 32.840 1.00 0.00 H new ATOM 0 HE1 TRP A 94 30.195 21.866 31.388 1.00 0.00 H new ATOM 0 HE3 TRP A 94 33.930 18.046 31.179 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 29.429 19.609 29.768 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 32.528 16.632 29.699 1.00 0.00 H new ATOM 0 HH2 TRP A 94 30.287 17.417 28.978 1.00 0.00 H new ATOM 1409 N LEU A 95 35.100 19.313 36.187 1.00 0.00 N ATOM 1410 CA LEU A 95 35.512 18.012 36.803 1.00 0.00 C ATOM 1411 C LEU A 95 34.433 17.534 37.777 1.00 0.00 C ATOM 1412 O LEU A 95 33.868 18.313 38.517 1.00 0.00 O ATOM 1413 CB LEU A 95 36.837 18.185 37.562 1.00 0.00 C ATOM 1414 CG LEU A 95 37.919 18.692 36.609 1.00 0.00 C ATOM 1415 CD1 LEU A 95 39.088 19.255 37.418 1.00 0.00 C ATOM 1416 CD2 LEU A 95 38.415 17.531 35.745 1.00 0.00 C ATOM 0 H LEU A 95 35.204 20.130 36.789 1.00 0.00 H new ATOM 0 HA LEU A 95 35.642 17.275 36.011 1.00 0.00 H new ATOM 0 HB2 LEU A 95 36.706 18.888 38.385 1.00 0.00 H new ATOM 0 HB3 LEU A 95 37.142 17.235 38.000 1.00 0.00 H new ATOM 0 HG LEU A 95 37.506 19.475 35.972 1.00 0.00 H new ATOM 0 HD11 LEU A 95 39.860 19.617 36.739 1.00 0.00 H new ATOM 0 HD12 LEU A 95 38.737 20.079 38.040 1.00 0.00 H new ATOM 0 HD13 LEU A 95 39.502 18.472 38.053 1.00 0.00 H new ATOM 0 HD21 LEU A 95 39.187 17.888 35.064 1.00 0.00 H new ATOM 0 HD22 LEU A 95 38.828 16.752 36.385 1.00 0.00 H new ATOM 0 HD23 LEU A 95 37.583 17.124 35.170 1.00 0.00 H new ATOM 1428 N ILE A 96 34.138 16.258 37.763 1.00 0.00 N ATOM 1429 CA ILE A 96 33.082 15.705 38.670 1.00 0.00 C ATOM 1430 C ILE A 96 33.718 14.785 39.723 1.00 0.00 C ATOM 1431 O ILE A 96 34.350 13.790 39.395 1.00 0.00 O ATOM 1432 CB ILE A 96 32.087 14.896 37.829 1.00 0.00 C ATOM 1433 CG1 ILE A 96 31.633 15.730 36.621 1.00 0.00 C ATOM 1434 CG2 ILE A 96 30.870 14.519 38.678 1.00 0.00 C ATOM 1435 CD1 ILE A 96 30.937 17.018 37.100 1.00 0.00 C ATOM 0 H ILE A 96 34.586 15.570 37.158 1.00 0.00 H new ATOM 0 HA ILE A 96 32.573 16.525 39.177 1.00 0.00 H new ATOM 0 HB ILE A 96 32.575 13.986 37.479 1.00 0.00 H new ATOM 0 HG12 ILE A 96 32.492 15.981 35.999 1.00 0.00 H new ATOM 0 HG13 ILE A 96 30.951 15.147 36.002 1.00 0.00 H new ATOM 0 HG21 ILE A 96 30.168 13.945 38.073 1.00 0.00 H new ATOM 0 HG22 ILE A 96 31.192 13.918 39.529 1.00 0.00 H new ATOM 0 HG23 ILE A 96 30.382 15.425 39.037 1.00 0.00 H new ATOM 0 HD11 ILE A 96 30.619 17.602 36.237 1.00 0.00 H new ATOM 0 HD12 ILE A 96 30.067 16.759 37.703 1.00 0.00 H new ATOM 0 HD13 ILE A 96 31.632 17.606 37.700 1.00 0.00 H new ATOM 1447 N TYR A 97 33.565 15.122 40.989 1.00 0.00 N ATOM 1448 CA TYR A 97 34.153 14.277 42.089 1.00 0.00 C ATOM 1449 C TYR A 97 33.008 13.799 43.007 1.00 0.00 C ATOM 1450 O TYR A 97 32.051 14.524 43.240 1.00 0.00 O ATOM 1451 CB TYR A 97 35.138 15.125 42.911 1.00 0.00 C ATOM 1452 CG TYR A 97 36.496 15.155 42.229 1.00 0.00 C ATOM 1453 CD1 TYR A 97 36.603 15.596 40.906 1.00 0.00 C ATOM 1454 CD2 TYR A 97 37.645 14.744 42.920 1.00 0.00 C ATOM 1455 CE1 TYR A 97 37.851 15.638 40.278 1.00 0.00 C ATOM 1456 CE2 TYR A 97 38.898 14.781 42.282 1.00 0.00 C ATOM 1457 CZ TYR A 97 38.995 15.230 40.959 1.00 0.00 C ATOM 1458 OH TYR A 97 40.219 15.294 40.330 1.00 0.00 O ATOM 0 H TYR A 97 33.057 15.947 41.308 1.00 0.00 H new ATOM 0 HA TYR A 97 34.677 13.421 41.663 1.00 0.00 H new ATOM 0 HB2 TYR A 97 34.754 16.139 43.019 1.00 0.00 H new ATOM 0 HB3 TYR A 97 35.236 14.712 43.915 1.00 0.00 H new ATOM 0 HD1 TYR A 97 35.719 15.905 40.368 1.00 0.00 H new ATOM 0 HD2 TYR A 97 37.568 14.400 43.941 1.00 0.00 H new ATOM 0 HE1 TYR A 97 37.928 15.989 39.259 1.00 0.00 H new ATOM 0 HE2 TYR A 97 39.784 14.464 42.812 1.00 0.00 H new ATOM 0 HH TYR A 97 40.917 14.975 40.939 1.00 0.00 H new ATOM 1468 N LYS A 98 33.083 12.591 43.519 1.00 0.00 N ATOM 1469 CA LYS A 98 31.986 12.081 44.395 1.00 0.00 C ATOM 1470 C LYS A 98 32.570 11.479 45.687 1.00 0.00 C ATOM 1471 O LYS A 98 33.649 10.898 45.696 1.00 0.00 O ATOM 1472 CB LYS A 98 31.182 11.016 43.609 1.00 0.00 C ATOM 1473 CG LYS A 98 30.370 10.105 44.556 1.00 0.00 C ATOM 1474 CD LYS A 98 29.216 10.894 45.191 1.00 0.00 C ATOM 1475 CE LYS A 98 27.900 10.113 45.057 1.00 0.00 C ATOM 1476 NZ LYS A 98 27.907 8.947 45.982 1.00 0.00 N ATOM 0 H LYS A 98 33.855 11.941 43.367 1.00 0.00 H new ATOM 0 HA LYS A 98 31.325 12.900 44.679 1.00 0.00 H new ATOM 0 HB2 LYS A 98 30.507 11.511 42.911 1.00 0.00 H new ATOM 0 HB3 LYS A 98 31.865 10.408 43.015 1.00 0.00 H new ATOM 0 HG2 LYS A 98 29.976 9.252 44.003 1.00 0.00 H new ATOM 0 HG3 LYS A 98 31.020 9.707 45.335 1.00 0.00 H new ATOM 0 HD2 LYS A 98 29.430 11.082 46.243 1.00 0.00 H new ATOM 0 HD3 LYS A 98 29.121 11.866 44.707 1.00 0.00 H new ATOM 0 HE2 LYS A 98 27.056 10.764 45.285 1.00 0.00 H new ATOM 0 HE3 LYS A 98 27.772 9.772 44.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 26.931 8.628 46.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 28.459 8.173 45.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 28.336 9.225 46.888 1.00 0.00 H new ATOM 1490 N THR A 99 31.828 11.589 46.768 1.00 0.00 N ATOM 1491 CA THR A 99 32.256 11.014 48.078 1.00 0.00 C ATOM 1492 C THR A 99 31.117 10.133 48.624 1.00 0.00 C ATOM 1493 O THR A 99 30.026 10.134 48.090 1.00 0.00 O ATOM 1494 CB THR A 99 32.533 12.136 49.084 1.00 0.00 C ATOM 1495 OG1 THR A 99 32.693 11.565 50.368 1.00 0.00 O ATOM 1496 CG2 THR A 99 31.368 13.123 49.117 1.00 0.00 C ATOM 0 H THR A 99 30.926 12.064 46.792 1.00 0.00 H new ATOM 0 HA THR A 99 33.164 10.428 47.934 1.00 0.00 H new ATOM 0 HB THR A 99 33.436 12.669 48.787 1.00 0.00 H new ATOM 0 HG1 THR A 99 33.647 11.438 50.553 1.00 0.00 H new ATOM 0 HG21 THR A 99 31.581 13.913 49.837 1.00 0.00 H new ATOM 0 HG22 THR A 99 31.233 13.560 48.128 1.00 0.00 H new ATOM 0 HG23 THR A 99 30.457 12.601 49.410 1.00 0.00 H new ATOM 1504 N THR A 100 31.350 9.405 49.688 1.00 0.00 N ATOM 1505 CA THR A 100 30.247 8.561 50.274 1.00 0.00 C ATOM 1506 C THR A 100 30.391 8.482 51.798 1.00 0.00 C ATOM 1507 O THR A 100 29.594 7.852 52.464 1.00 0.00 O ATOM 1508 CB THR A 100 30.303 7.144 49.701 1.00 0.00 C ATOM 1509 OG1 THR A 100 31.578 6.580 49.967 1.00 0.00 O ATOM 1510 CG2 THR A 100 30.064 7.172 48.191 1.00 0.00 C ATOM 0 H THR A 100 32.244 9.354 50.176 1.00 0.00 H new ATOM 0 HA THR A 100 29.293 9.023 50.019 1.00 0.00 H new ATOM 0 HB THR A 100 29.526 6.541 50.170 1.00 0.00 H new ATOM 0 HG1 THR A 100 31.616 5.671 49.602 1.00 0.00 H new ATOM 0 HG21 THR A 100 30.107 6.157 47.797 1.00 0.00 H new ATOM 0 HG22 THR A 100 29.083 7.600 47.986 1.00 0.00 H new ATOM 0 HG23 THR A 100 30.832 7.780 47.712 1.00 0.00 H new ATOM 1518 N ASP A 101 31.405 9.082 52.362 1.00 0.00 N ATOM 1519 CA ASP A 101 31.588 9.004 53.836 1.00 0.00 C ATOM 1520 C ASP A 101 31.482 10.407 54.408 1.00 0.00 C ATOM 1521 O ASP A 101 31.923 10.693 55.508 1.00 0.00 O ATOM 1522 CB ASP A 101 32.960 8.417 54.116 1.00 0.00 C ATOM 1523 CG ASP A 101 33.955 8.919 53.065 1.00 0.00 C ATOM 1524 OD1 ASP A 101 33.768 10.018 52.553 1.00 0.00 O ATOM 1525 OD2 ASP A 101 34.878 8.186 52.767 1.00 0.00 O ATOM 0 H ASP A 101 32.113 9.622 51.864 1.00 0.00 H new ATOM 0 HA ASP A 101 30.827 8.373 54.296 1.00 0.00 H new ATOM 0 HB2 ASP A 101 33.293 8.703 55.114 1.00 0.00 H new ATOM 0 HB3 ASP A 101 32.912 7.328 54.096 1.00 0.00 H new ATOM 1530 N ALA A 102 30.874 11.270 53.652 1.00 0.00 N ATOM 1531 CA ALA A 102 30.677 12.683 54.095 1.00 0.00 C ATOM 1532 C ALA A 102 31.986 13.479 53.948 1.00 0.00 C ATOM 1533 O ALA A 102 32.550 13.944 54.922 1.00 0.00 O ATOM 1534 CB ALA A 102 30.206 12.701 55.561 1.00 0.00 C ATOM 0 H ALA A 102 30.497 11.057 52.729 1.00 0.00 H new ATOM 0 HA ALA A 102 29.918 13.151 53.467 1.00 0.00 H new ATOM 0 HB1 ALA A 102 30.062 13.732 55.884 1.00 0.00 H new ATOM 0 HB2 ALA A 102 29.264 12.159 55.647 1.00 0.00 H new ATOM 0 HB3 ALA A 102 30.958 12.225 56.191 1.00 0.00 H new ATOM 1540 N TYR A 103 32.450 13.635 52.731 1.00 0.00 N ATOM 1541 CA TYR A 103 33.706 14.411 52.452 1.00 0.00 C ATOM 1542 C TYR A 103 34.962 13.680 52.981 1.00 0.00 C ATOM 1543 O TYR A 103 36.075 14.034 52.631 1.00 0.00 O ATOM 1544 CB TYR A 103 33.623 15.802 53.114 1.00 0.00 C ATOM 1545 CG TYR A 103 32.266 16.436 52.866 1.00 0.00 C ATOM 1546 CD1 TYR A 103 32.017 17.122 51.672 1.00 0.00 C ATOM 1547 CD2 TYR A 103 31.260 16.346 53.834 1.00 0.00 C ATOM 1548 CE1 TYR A 103 30.763 17.715 51.446 1.00 0.00 C ATOM 1549 CE2 TYR A 103 30.010 16.938 53.609 1.00 0.00 C ATOM 1550 CZ TYR A 103 29.761 17.622 52.416 1.00 0.00 C ATOM 1551 OH TYR A 103 28.522 18.200 52.200 1.00 0.00 O ATOM 0 H TYR A 103 32.002 13.249 51.900 1.00 0.00 H new ATOM 0 HA TYR A 103 33.794 14.510 51.370 1.00 0.00 H new ATOM 0 HB2 TYR A 103 33.796 15.711 54.186 1.00 0.00 H new ATOM 0 HB3 TYR A 103 34.408 16.446 52.718 1.00 0.00 H new ATOM 0 HD1 TYR A 103 32.791 17.196 50.922 1.00 0.00 H new ATOM 0 HD2 TYR A 103 31.447 15.819 54.758 1.00 0.00 H new ATOM 0 HE1 TYR A 103 30.574 18.243 50.523 1.00 0.00 H new ATOM 0 HE2 TYR A 103 29.237 16.865 54.360 1.00 0.00 H new ATOM 0 HH TYR A 103 28.512 18.632 51.321 1.00 0.00 H new ATOM 1561 N GLN A 104 34.813 12.665 53.800 1.00 0.00 N ATOM 1562 CA GLN A 104 36.015 11.941 54.336 1.00 0.00 C ATOM 1563 C GLN A 104 36.935 11.533 53.169 1.00 0.00 C ATOM 1564 O GLN A 104 37.976 12.133 52.958 1.00 0.00 O ATOM 1565 CB GLN A 104 35.551 10.710 55.138 1.00 0.00 C ATOM 1566 CG GLN A 104 35.669 11.016 56.641 1.00 0.00 C ATOM 1567 CD GLN A 104 34.966 9.937 57.472 1.00 0.00 C ATOM 1568 OE1 GLN A 104 35.578 9.304 58.305 1.00 0.00 O ATOM 1569 NE2 GLN A 104 33.698 9.702 57.281 1.00 0.00 N ATOM 0 H GLN A 104 33.914 12.306 54.121 1.00 0.00 H new ATOM 0 HA GLN A 104 36.580 12.593 55.002 1.00 0.00 H new ATOM 0 HB2 GLN A 104 34.520 10.462 54.884 1.00 0.00 H new ATOM 0 HB3 GLN A 104 36.160 9.843 54.882 1.00 0.00 H new ATOM 0 HG2 GLN A 104 36.720 11.072 56.924 1.00 0.00 H new ATOM 0 HG3 GLN A 104 35.229 11.990 56.854 1.00 0.00 H new ATOM 0 HE21 GLN A 104 33.181 10.233 56.581 1.00 0.00 H new ATOM 0 HE22 GLN A 104 33.223 8.987 57.832 1.00 0.00 H new ATOM 1578 N THR A 105 36.549 10.557 52.393 1.00 0.00 N ATOM 1579 CA THR A 105 37.379 10.149 51.230 1.00 0.00 C ATOM 1580 C THR A 105 36.771 10.775 49.980 1.00 0.00 C ATOM 1581 O THR A 105 35.796 11.499 50.053 1.00 0.00 O ATOM 1582 CB THR A 105 37.368 8.624 51.103 1.00 0.00 C ATOM 1583 OG1 THR A 105 36.066 8.205 50.725 1.00 0.00 O ATOM 1584 CG2 THR A 105 37.745 7.986 52.442 1.00 0.00 C ATOM 0 H THR A 105 35.689 10.023 52.518 1.00 0.00 H new ATOM 0 HA THR A 105 38.409 10.481 51.358 1.00 0.00 H new ATOM 0 HB THR A 105 38.092 8.314 50.349 1.00 0.00 H new ATOM 0 HG1 THR A 105 35.598 7.846 51.508 1.00 0.00 H new ATOM 0 HG21 THR A 105 37.735 6.901 52.343 1.00 0.00 H new ATOM 0 HG22 THR A 105 38.743 8.315 52.734 1.00 0.00 H new ATOM 0 HG23 THR A 105 37.026 8.288 53.204 1.00 0.00 H new ATOM 1592 N PHE A 106 37.337 10.529 48.840 1.00 0.00 N ATOM 1593 CA PHE A 106 36.781 11.137 47.606 1.00 0.00 C ATOM 1594 C PHE A 106 37.236 10.343 46.383 1.00 0.00 C ATOM 1595 O PHE A 106 38.388 9.984 46.260 1.00 0.00 O ATOM 1596 CB PHE A 106 37.280 12.582 47.493 1.00 0.00 C ATOM 1597 CG PHE A 106 36.114 13.539 47.549 1.00 0.00 C ATOM 1598 CD1 PHE A 106 35.122 13.488 46.560 1.00 0.00 C ATOM 1599 CD2 PHE A 106 36.019 14.483 48.587 1.00 0.00 C ATOM 1600 CE1 PHE A 106 34.040 14.374 46.603 1.00 0.00 C ATOM 1601 CE2 PHE A 106 34.932 15.367 48.631 1.00 0.00 C ATOM 1602 CZ PHE A 106 33.944 15.309 47.641 1.00 0.00 C ATOM 0 H PHE A 106 38.157 9.937 48.707 1.00 0.00 H new ATOM 0 HA PHE A 106 35.692 11.123 47.653 1.00 0.00 H new ATOM 0 HB2 PHE A 106 37.977 12.798 48.302 1.00 0.00 H new ATOM 0 HB3 PHE A 106 37.825 12.715 46.558 1.00 0.00 H new ATOM 0 HD1 PHE A 106 35.193 12.763 45.763 1.00 0.00 H new ATOM 0 HD2 PHE A 106 36.783 14.527 49.349 1.00 0.00 H new ATOM 0 HE1 PHE A 106 33.280 14.337 45.837 1.00 0.00 H new ATOM 0 HE2 PHE A 106 34.857 16.092 49.428 1.00 0.00 H new ATOM 0 HZ PHE A 106 33.105 15.988 47.678 1.00 0.00 H new ATOM 1612 N THR A 107 36.333 10.078 45.482 1.00 0.00 N ATOM 1613 CA THR A 107 36.692 9.330 44.238 1.00 0.00 C ATOM 1614 C THR A 107 36.179 10.117 43.020 1.00 0.00 C ATOM 1615 O THR A 107 35.089 10.673 43.045 1.00 0.00 O ATOM 1616 CB THR A 107 36.027 7.961 44.268 1.00 0.00 C ATOM 1617 OG1 THR A 107 36.545 7.209 45.359 1.00 0.00 O ATOM 1618 CG2 THR A 107 36.305 7.234 42.955 1.00 0.00 C ATOM 0 H THR A 107 35.352 10.349 45.552 1.00 0.00 H new ATOM 0 HA THR A 107 37.773 9.210 44.174 1.00 0.00 H new ATOM 0 HB THR A 107 34.950 8.077 44.392 1.00 0.00 H new ATOM 0 HG1 THR A 107 36.117 6.328 45.381 1.00 0.00 H new ATOM 0 HG21 THR A 107 35.830 6.253 42.974 1.00 0.00 H new ATOM 0 HG22 THR A 107 35.904 7.815 42.125 1.00 0.00 H new ATOM 0 HG23 THR A 107 37.381 7.113 42.827 1.00 0.00 H new ATOM 1626 N LYS A 108 36.948 10.188 41.955 1.00 0.00 N ATOM 1627 CA LYS A 108 36.496 10.957 40.755 1.00 0.00 C ATOM 1628 C LYS A 108 35.638 10.075 39.853 1.00 0.00 C ATOM 1629 O LYS A 108 35.928 8.914 39.648 1.00 0.00 O ATOM 1630 CB LYS A 108 37.730 11.444 39.983 1.00 0.00 C ATOM 1631 CG LYS A 108 37.307 12.120 38.671 1.00 0.00 C ATOM 1632 CD LYS A 108 38.558 12.487 37.855 1.00 0.00 C ATOM 1633 CE LYS A 108 38.247 12.412 36.352 1.00 0.00 C ATOM 1634 NZ LYS A 108 37.863 13.763 35.855 1.00 0.00 N ATOM 0 H LYS A 108 37.864 9.748 41.868 1.00 0.00 H new ATOM 0 HA LYS A 108 35.898 11.810 41.076 1.00 0.00 H new ATOM 0 HB2 LYS A 108 38.296 12.146 40.595 1.00 0.00 H new ATOM 0 HB3 LYS A 108 38.389 10.603 39.770 1.00 0.00 H new ATOM 0 HG2 LYS A 108 36.668 11.451 38.095 1.00 0.00 H new ATOM 0 HG3 LYS A 108 36.723 13.015 38.883 1.00 0.00 H new ATOM 0 HD2 LYS A 108 38.890 13.492 38.116 1.00 0.00 H new ATOM 0 HD3 LYS A 108 39.374 11.807 38.100 1.00 0.00 H new ATOM 0 HE2 LYS A 108 39.118 12.047 35.808 1.00 0.00 H new ATOM 0 HE3 LYS A 108 37.438 11.703 36.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 37.226 13.665 35.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 37.378 14.286 36.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 38.717 14.282 35.567 1.00 0.00 H new ATOM 1648 N ILE A 109 34.579 10.627 39.317 1.00 0.00 N ATOM 1649 CA ILE A 109 33.692 9.826 38.422 1.00 0.00 C ATOM 1650 C ILE A 109 33.780 10.363 36.984 1.00 0.00 C ATOM 1651 O ILE A 109 33.678 9.613 36.028 1.00 0.00 O ATOM 1652 CB ILE A 109 32.243 9.881 38.939 1.00 0.00 C ATOM 1653 CG1 ILE A 109 31.852 11.323 39.273 1.00 0.00 C ATOM 1654 CG2 ILE A 109 32.130 9.029 40.215 1.00 0.00 C ATOM 1655 CD1 ILE A 109 30.364 11.379 39.626 1.00 0.00 C ATOM 0 H ILE A 109 34.291 11.595 39.460 1.00 0.00 H new ATOM 0 HA ILE A 109 34.019 8.786 38.422 1.00 0.00 H new ATOM 0 HB ILE A 109 31.577 9.498 38.165 1.00 0.00 H new ATOM 0 HG12 ILE A 109 32.449 11.689 40.108 1.00 0.00 H new ATOM 0 HG13 ILE A 109 32.060 11.974 38.424 1.00 0.00 H new ATOM 0 HG21 ILE A 109 31.106 9.064 40.586 1.00 0.00 H new ATOM 0 HG22 ILE A 109 32.399 7.997 39.989 1.00 0.00 H new ATOM 0 HG23 ILE A 109 32.805 9.421 40.975 1.00 0.00 H new ATOM 0 HD11 ILE A 109 30.085 12.405 39.864 1.00 0.00 H new ATOM 0 HD12 ILE A 109 29.775 11.030 38.777 1.00 0.00 H new ATOM 0 HD13 ILE A 109 30.170 10.741 40.488 1.00 0.00 H new ATOM 1667 N ARG A 110 34.000 11.640 36.820 1.00 0.00 N ATOM 1668 CA ARG A 110 34.121 12.199 35.451 1.00 0.00 C ATOM 1669 C ARG A 110 35.146 13.342 35.462 1.00 0.00 C ATOM 1670 O ARG A 110 35.965 13.397 34.555 1.00 0.00 O ATOM 1671 CB ARG A 110 32.757 12.716 34.963 1.00 0.00 C ATOM 1672 CG ARG A 110 31.720 11.574 34.934 1.00 0.00 C ATOM 1673 CD ARG A 110 30.555 11.984 34.025 1.00 0.00 C ATOM 1674 NE ARG A 110 29.373 11.086 34.248 1.00 0.00 N ATOM 1675 CZ ARG A 110 28.187 11.433 33.807 1.00 0.00 C ATOM 1676 NH1 ARG A 110 28.021 12.551 33.169 1.00 0.00 N ATOM 1677 NH2 ARG A 110 27.161 10.663 33.990 1.00 0.00 N ATOM 1678 OXT ARG A 110 35.115 14.136 36.391 1.00 0.00 O ATOM 0 H ARG A 110 34.100 12.316 37.577 1.00 0.00 H new ATOM 0 HA ARG A 110 34.455 11.416 34.770 1.00 0.00 H new ATOM 0 HB2 ARG A 110 32.409 13.514 35.619 1.00 0.00 H new ATOM 0 HB3 ARG A 110 32.861 13.145 33.967 1.00 0.00 H new ATOM 0 HG2 ARG A 110 32.180 10.657 34.567 1.00 0.00 H new ATOM 0 HG3 ARG A 110 31.358 11.368 35.941 1.00 0.00 H new ATOM 0 HD2 ARG A 110 30.276 13.018 34.226 1.00 0.00 H new ATOM 0 HD3 ARG A 110 30.865 11.934 32.981 1.00 0.00 H new ATOM 0 HE ARG A 110 29.492 10.203 34.744 1.00 0.00 H new ATOM 0 HH11 ARG A 110 28.816 13.168 33.007 1.00 0.00 H new ATOM 0 HH12 ARG A 110 27.095 12.812 32.830 1.00 0.00 H new ATOM 0 HH21 ARG A 110 27.270 9.776 34.482 1.00 0.00 H new ATOM 0 HH22 ARG A 110 26.244 10.944 33.642 1.00 0.00 H new