USER MOD reduce.3.24.130724 H: found=0, std=0, add=990, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1004 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 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 143 ASN : amide:sc= -4.49! C(o=-4.5!,f=-12!) USER MOD Set 2.1: A 38 LYS NZ :NH3+ -124:sc= -0.0311 (180deg=-0.172) USER MOD Set 2.2: A 90 THR OG1 : rot -170:sc= -0.63 USER MOD Set 3.1: A 11 SER OG : rot 180:sc= 0.658 USER MOD Set 3.2: A 14 THR OG1 : rot 89:sc= 0.693 USER MOD Set 4.1: A 5 ASN : amide:sc= -3.23 K(o=-9.5,f=-15!) USER MOD Set 4.2: A 33 HIS :FLIP no HD1:sc= -6.31! C(o=-10!,f=-9.5!) USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 61:sc= -3.27! USER MOD Single : A 16 SER OG : rot 77:sc= 0.286 USER MOD Single : A 17 SER OG : rot 71:sc= 0.0159 USER MOD Single : A 18 TYR OH : rot 180:sc= -0.101 USER MOD Single : A 19 SER OG : rot 180:sc= -0.433 USER MOD Single : A 22 GLN : amide:sc= -3.58! C(o=-3.6!,f=-7.4!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 135:sc= -0.0473 (180deg=-0.487) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 15:sc= -2.87! USER MOD Single : A 65 LYS NZ :NH3+ -168:sc= -0.0102 (180deg=-0.169) USER MOD Single : A 66 THR OG1 : rot 180:sc= -0.0506 USER MOD Single : A 67 CYS SG : rot -150:sc= -2.64 USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc=-0.00946 K(o=-0.0095,f=-1.4!) USER MOD Single : A 75 ASN : amide:sc= -6.65! C(o=-6.7!,f=-10!) USER MOD Single : A 78 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0106) USER MOD Single : A 84 ASN : amide:sc= 0 X(o=0,f=-0.054) USER MOD Single : A 91 CYS SG : rot 180:sc= -0.0116 USER MOD Single : A 93 ASN : amide:sc= -4.15 K(o=-4.1,f=-5.2!) USER MOD Single : A 94 CYS SG : rot -117:sc= 0.123 USER MOD Single : A 95 TYR OH : rot -37:sc= -5.26! USER MOD Single : A 111 GLN : amide:sc=-0.00414 K(o=-0.0041,f=-0.52) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 HIS : no HD1:sc= -4.59! C(o=-4.6!,f=-9.5!) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 LYS NZ :NH3+ -103:sc= -1.91! (180deg=-3.79!) USER MOD Single : A 123 ASN : amide:sc= -4.35 K(o=-4.3,f=-5.6!) USER MOD Single : A 125 ASN :FLIP amide:sc= -0.0279 F(o=-0.59,f=-0.028) USER MOD Single : A 126 SER OG : rot 180:sc= -1.87! USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 TYR OH : rot 180:sc= -3.44! USER MOD Single : A 135 SER OG : rot 180:sc=-0.00868 USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 TYR OH : rot 80:sc= 0.00223 USER MOD Single : A 144 HIS : no HD1:sc=-0.00798 X(o=-0.008,f=-0.27) USER MOD ----------------------------------------------------------------- ATOM 38 N GLU A 4 14.678 -1.085 -12.320 1.00 0.00 N ATOM 39 CA GLU A 4 14.075 -1.691 -13.501 1.00 0.00 C ATOM 40 C GLU A 4 12.627 -1.239 -13.675 1.00 0.00 C ATOM 41 O GLU A 4 12.178 -0.979 -14.793 1.00 0.00 O ATOM 42 CB GLU A 4 14.136 -3.216 -13.405 1.00 0.00 C ATOM 43 CG GLU A 4 15.542 -3.778 -13.544 1.00 0.00 C ATOM 44 CD GLU A 4 15.576 -5.290 -13.440 1.00 0.00 C ATOM 45 OE1 GLU A 4 15.540 -5.811 -12.307 1.00 0.00 O ATOM 46 OE2 GLU A 4 15.641 -5.955 -14.497 1.00 0.00 O ATOM 0 HA GLU A 4 14.643 -1.363 -14.372 1.00 0.00 H new ATOM 0 HB2 GLU A 4 13.722 -3.528 -12.446 1.00 0.00 H new ATOM 0 HB3 GLU A 4 13.503 -3.646 -14.181 1.00 0.00 H new ATOM 0 HG2 GLU A 4 15.958 -3.474 -14.504 1.00 0.00 H new ATOM 0 HG3 GLU A 4 16.179 -3.349 -12.770 1.00 0.00 H new ATOM 54 N ASN A 5 11.898 -1.151 -12.567 1.00 0.00 N ATOM 55 CA ASN A 5 10.500 -0.729 -12.610 1.00 0.00 C ATOM 56 C ASN A 5 10.032 -0.177 -11.263 1.00 0.00 C ATOM 57 O ASN A 5 9.183 0.711 -11.212 1.00 0.00 O ATOM 58 CB ASN A 5 9.610 -1.900 -13.031 1.00 0.00 C ATOM 59 CG ASN A 5 9.757 -3.097 -12.112 1.00 0.00 C ATOM 60 OD1 ASN A 5 10.783 -3.265 -11.454 1.00 0.00 O ATOM 61 ND2 ASN A 5 8.730 -3.937 -12.065 1.00 0.00 N ATOM 0 H ASN A 5 12.248 -1.365 -11.633 1.00 0.00 H new ATOM 0 HA ASN A 5 10.420 0.073 -13.344 1.00 0.00 H new ATOM 0 HB2 ASN A 5 8.569 -1.577 -13.039 1.00 0.00 H new ATOM 0 HB3 ASN A 5 9.860 -2.195 -14.050 1.00 0.00 H new ATOM 0 HD21 ASN A 5 8.772 -4.761 -11.466 1.00 0.00 H new ATOM 0 HD22 ASN A 5 7.899 -3.758 -12.628 1.00 0.00 H new ATOM 68 N TYR A 6 10.586 -0.706 -10.173 1.00 0.00 N ATOM 69 CA TYR A 6 10.211 -0.257 -8.836 1.00 0.00 C ATOM 70 C TYR A 6 11.446 0.070 -8.004 1.00 0.00 C ATOM 71 O TYR A 6 12.535 -0.443 -8.262 1.00 0.00 O ATOM 72 CB TYR A 6 9.375 -1.322 -8.127 1.00 0.00 C ATOM 73 CG TYR A 6 10.114 -2.619 -7.884 1.00 0.00 C ATOM 74 CD1 TYR A 6 10.092 -3.640 -8.826 1.00 0.00 C ATOM 75 CD2 TYR A 6 10.835 -2.821 -6.713 1.00 0.00 C ATOM 76 CE1 TYR A 6 10.767 -4.827 -8.608 1.00 0.00 C ATOM 77 CE2 TYR A 6 11.514 -4.004 -6.490 1.00 0.00 C ATOM 78 CZ TYR A 6 11.475 -5.003 -7.438 1.00 0.00 C ATOM 79 OH TYR A 6 12.149 -6.183 -7.218 1.00 0.00 O ATOM 0 H TYR A 6 11.292 -1.442 -10.190 1.00 0.00 H new ATOM 0 HA TYR A 6 9.615 0.649 -8.943 1.00 0.00 H new ATOM 0 HB2 TYR A 6 9.034 -0.925 -7.171 1.00 0.00 H new ATOM 0 HB3 TYR A 6 8.486 -1.528 -8.723 1.00 0.00 H new ATOM 0 HD1 TYR A 6 9.539 -3.504 -9.744 1.00 0.00 H new ATOM 0 HD2 TYR A 6 10.865 -2.042 -5.966 1.00 0.00 H new ATOM 0 HE1 TYR A 6 10.740 -5.612 -9.350 1.00 0.00 H new ATOM 0 HE2 TYR A 6 12.073 -4.145 -5.577 1.00 0.00 H new ATOM 0 HH TYR A 6 12.598 -6.146 -6.348 1.00 0.00 H new ATOM 89 N TYR A 7 11.268 0.928 -7.005 1.00 0.00 N ATOM 90 CA TYR A 7 12.369 1.323 -6.135 1.00 0.00 C ATOM 91 C TYR A 7 11.985 1.184 -4.663 1.00 0.00 C ATOM 92 O TYR A 7 10.810 1.268 -4.303 1.00 0.00 O ATOM 93 CB TYR A 7 12.801 2.761 -6.441 1.00 0.00 C ATOM 94 CG TYR A 7 11.791 3.810 -6.028 1.00 0.00 C ATOM 95 CD1 TYR A 7 10.797 4.231 -6.904 1.00 0.00 C ATOM 96 CD2 TYR A 7 11.834 4.375 -4.762 1.00 0.00 C ATOM 97 CE1 TYR A 7 9.875 5.187 -6.524 1.00 0.00 C ATOM 98 CE2 TYR A 7 10.915 5.330 -4.375 1.00 0.00 C ATOM 99 CZ TYR A 7 9.937 5.734 -5.260 1.00 0.00 C ATOM 100 OH TYR A 7 9.020 6.686 -4.879 1.00 0.00 O ATOM 0 H TYR A 7 10.373 1.362 -6.778 1.00 0.00 H new ATOM 0 HA TYR A 7 13.208 0.655 -6.329 1.00 0.00 H new ATOM 0 HB2 TYR A 7 13.745 2.961 -5.934 1.00 0.00 H new ATOM 0 HB3 TYR A 7 12.988 2.853 -7.511 1.00 0.00 H new ATOM 0 HD1 TYR A 7 10.745 3.805 -7.895 1.00 0.00 H new ATOM 0 HD2 TYR A 7 12.599 4.063 -4.067 1.00 0.00 H new ATOM 0 HE1 TYR A 7 9.108 5.505 -7.215 1.00 0.00 H new ATOM 0 HE2 TYR A 7 10.962 5.758 -3.385 1.00 0.00 H new ATOM 0 HH TYR A 7 9.203 6.967 -3.958 1.00 0.00 H new ATOM 110 N ILE A 8 12.989 0.976 -3.821 1.00 0.00 N ATOM 111 CA ILE A 8 12.778 0.828 -2.387 1.00 0.00 C ATOM 112 C ILE A 8 13.724 1.742 -1.611 1.00 0.00 C ATOM 113 O ILE A 8 14.751 2.171 -2.137 1.00 0.00 O ATOM 114 CB ILE A 8 13.021 -0.626 -1.932 1.00 0.00 C ATOM 115 CG1 ILE A 8 12.248 -1.606 -2.816 1.00 0.00 C ATOM 116 CG2 ILE A 8 12.616 -0.799 -0.474 1.00 0.00 C ATOM 117 CD1 ILE A 8 10.750 -1.412 -2.768 1.00 0.00 C ATOM 0 H ILE A 8 13.965 0.906 -4.110 1.00 0.00 H new ATOM 0 HA ILE A 8 11.742 1.100 -2.183 1.00 0.00 H new ATOM 0 HB ILE A 8 14.085 -0.842 -2.029 1.00 0.00 H new ATOM 0 HG12 ILE A 8 12.587 -1.498 -3.846 1.00 0.00 H new ATOM 0 HG13 ILE A 8 12.484 -2.624 -2.508 1.00 0.00 H new ATOM 0 HG21 ILE A 8 12.793 -1.830 -0.167 1.00 0.00 H new ATOM 0 HG22 ILE A 8 13.207 -0.128 0.150 1.00 0.00 H new ATOM 0 HG23 ILE A 8 11.558 -0.563 -0.360 1.00 0.00 H new ATOM 0 HD11 ILE A 8 10.268 -2.141 -3.419 1.00 0.00 H new ATOM 0 HD12 ILE A 8 10.398 -1.549 -1.746 1.00 0.00 H new ATOM 0 HD13 ILE A 8 10.502 -0.405 -3.105 1.00 0.00 H new ATOM 129 N SER A 9 13.386 2.027 -0.359 1.00 0.00 N ATOM 130 CA SER A 9 14.228 2.872 0.480 1.00 0.00 C ATOM 131 C SER A 9 14.699 2.086 1.708 1.00 0.00 C ATOM 132 O SER A 9 14.166 2.260 2.804 1.00 0.00 O ATOM 133 CB SER A 9 13.469 4.132 0.911 1.00 0.00 C ATOM 134 OG SER A 9 12.489 3.833 1.888 1.00 0.00 O ATOM 0 H SER A 9 12.539 1.687 0.096 1.00 0.00 H new ATOM 0 HA SER A 9 15.099 3.180 -0.098 1.00 0.00 H new ATOM 0 HB2 SER A 9 14.172 4.864 1.310 1.00 0.00 H new ATOM 0 HB3 SER A 9 12.993 4.587 0.043 1.00 0.00 H new ATOM 0 HG SER A 9 12.922 3.453 2.681 1.00 0.00 H new ATOM 140 N PRO A 10 15.640 1.135 1.519 1.00 0.00 N ATOM 141 CA PRO A 10 16.322 0.861 0.262 1.00 0.00 C ATOM 142 C PRO A 10 16.000 -0.519 -0.303 1.00 0.00 C ATOM 143 O PRO A 10 15.214 -1.268 0.276 1.00 0.00 O ATOM 144 CB PRO A 10 17.761 0.874 0.756 1.00 0.00 C ATOM 145 CG PRO A 10 17.684 0.238 2.125 1.00 0.00 C ATOM 146 CD PRO A 10 16.228 0.298 2.562 1.00 0.00 C ATOM 0 HA PRO A 10 16.061 1.554 -0.538 1.00 0.00 H new ATOM 0 HB2 PRO A 10 18.416 0.311 0.091 1.00 0.00 H new ATOM 0 HB3 PRO A 10 18.156 1.889 0.809 1.00 0.00 H new ATOM 0 HG2 PRO A 10 18.034 -0.794 2.091 1.00 0.00 H new ATOM 0 HG3 PRO A 10 18.321 0.768 2.833 1.00 0.00 H new ATOM 0 HD2 PRO A 10 15.771 -0.691 2.600 1.00 0.00 H new ATOM 0 HD3 PRO A 10 16.116 0.739 3.552 1.00 0.00 H new ATOM 154 N SER A 11 16.603 -0.844 -1.447 1.00 0.00 N ATOM 155 CA SER A 11 16.366 -2.128 -2.109 1.00 0.00 C ATOM 156 C SER A 11 16.530 -3.298 -1.142 1.00 0.00 C ATOM 157 O SER A 11 16.994 -3.124 -0.015 1.00 0.00 O ATOM 158 CB SER A 11 17.324 -2.295 -3.290 1.00 0.00 C ATOM 159 OG SER A 11 18.673 -2.285 -2.858 1.00 0.00 O ATOM 0 H SER A 11 17.260 -0.235 -1.935 1.00 0.00 H new ATOM 0 HA SER A 11 15.337 -2.130 -2.469 1.00 0.00 H new ATOM 0 HB2 SER A 11 17.111 -3.232 -3.805 1.00 0.00 H new ATOM 0 HB3 SER A 11 17.163 -1.492 -4.009 1.00 0.00 H new ATOM 0 HG SER A 11 19.265 -2.395 -3.631 1.00 0.00 H new ATOM 165 N LEU A 12 16.135 -4.487 -1.587 1.00 0.00 N ATOM 166 CA LEU A 12 16.222 -5.674 -0.748 1.00 0.00 C ATOM 167 C LEU A 12 17.666 -5.959 -0.350 1.00 0.00 C ATOM 168 O LEU A 12 17.944 -6.314 0.796 1.00 0.00 O ATOM 169 CB LEU A 12 15.639 -6.882 -1.487 1.00 0.00 C ATOM 170 CG LEU A 12 14.119 -6.857 -1.666 1.00 0.00 C ATOM 171 CD1 LEU A 12 13.722 -5.818 -2.704 1.00 0.00 C ATOM 172 CD2 LEU A 12 13.608 -8.233 -2.066 1.00 0.00 C ATOM 0 H LEU A 12 15.754 -4.652 -2.519 1.00 0.00 H new ATOM 0 HA LEU A 12 15.646 -5.491 0.159 1.00 0.00 H new ATOM 0 HB2 LEU A 12 16.105 -6.947 -2.470 1.00 0.00 H new ATOM 0 HB3 LEU A 12 15.911 -7.787 -0.945 1.00 0.00 H new ATOM 0 HG LEU A 12 13.664 -6.584 -0.714 1.00 0.00 H new ATOM 0 HD11 LEU A 12 12.638 -5.814 -2.819 1.00 0.00 H new ATOM 0 HD12 LEU A 12 14.056 -4.833 -2.379 1.00 0.00 H new ATOM 0 HD13 LEU A 12 14.187 -6.062 -3.659 1.00 0.00 H new ATOM 0 HD21 LEU A 12 12.526 -8.198 -2.189 1.00 0.00 H new ATOM 0 HD22 LEU A 12 14.070 -8.534 -3.006 1.00 0.00 H new ATOM 0 HD23 LEU A 12 13.861 -8.955 -1.290 1.00 0.00 H new ATOM 184 N ASP A 13 18.587 -5.791 -1.293 1.00 0.00 N ATOM 185 CA ASP A 13 19.999 -6.025 -1.024 1.00 0.00 C ATOM 186 C ASP A 13 20.546 -4.986 -0.052 1.00 0.00 C ATOM 187 O ASP A 13 21.221 -5.324 0.919 1.00 0.00 O ATOM 188 CB ASP A 13 20.801 -6.002 -2.326 1.00 0.00 C ATOM 189 CG ASP A 13 20.513 -7.202 -3.207 1.00 0.00 C ATOM 190 OD1 ASP A 13 20.788 -7.125 -4.422 1.00 0.00 O ATOM 191 OD2 ASP A 13 20.018 -8.221 -2.679 1.00 0.00 O ATOM 0 H ASP A 13 18.381 -5.495 -2.247 1.00 0.00 H new ATOM 0 HA ASP A 13 20.098 -7.009 -0.567 1.00 0.00 H new ATOM 0 HB2 ASP A 13 20.571 -5.089 -2.875 1.00 0.00 H new ATOM 0 HB3 ASP A 13 21.865 -5.974 -2.093 1.00 0.00 H new ATOM 197 N THR A 14 20.258 -3.715 -0.325 1.00 0.00 N ATOM 198 CA THR A 14 20.713 -2.630 0.539 1.00 0.00 C ATOM 199 C THR A 14 20.169 -2.790 1.956 1.00 0.00 C ATOM 200 O THR A 14 20.874 -2.568 2.939 1.00 0.00 O ATOM 201 CB THR A 14 20.292 -1.278 -0.044 1.00 0.00 C ATOM 202 OG1 THR A 14 20.832 -1.100 -1.342 1.00 0.00 O ATOM 203 CG2 THR A 14 20.718 -0.093 0.795 1.00 0.00 C ATOM 0 H THR A 14 19.714 -3.413 -1.134 1.00 0.00 H new ATOM 0 HA THR A 14 21.801 -2.670 0.590 1.00 0.00 H new ATOM 0 HB THR A 14 19.203 -1.308 -0.066 1.00 0.00 H new ATOM 0 HG1 THR A 14 20.209 -1.460 -2.008 1.00 0.00 H new ATOM 0 HG21 THR A 14 20.384 0.829 0.319 1.00 0.00 H new ATOM 0 HG22 THR A 14 20.273 -0.171 1.787 1.00 0.00 H new ATOM 0 HG23 THR A 14 21.804 -0.083 0.885 1.00 0.00 H new ATOM 211 N LEU A 15 18.900 -3.179 2.043 1.00 0.00 N ATOM 212 CA LEU A 15 18.243 -3.375 3.327 1.00 0.00 C ATOM 213 C LEU A 15 18.944 -4.458 4.144 1.00 0.00 C ATOM 214 O LEU A 15 19.165 -4.301 5.344 1.00 0.00 O ATOM 215 CB LEU A 15 16.776 -3.747 3.106 1.00 0.00 C ATOM 216 CG LEU A 15 15.965 -3.984 4.379 1.00 0.00 C ATOM 217 CD1 LEU A 15 15.954 -2.732 5.240 1.00 0.00 C ATOM 218 CD2 LEU A 15 14.550 -4.411 4.028 1.00 0.00 C ATOM 0 H LEU A 15 18.306 -3.365 1.235 1.00 0.00 H new ATOM 0 HA LEU A 15 18.299 -2.442 3.888 1.00 0.00 H new ATOM 0 HB2 LEU A 15 16.299 -2.952 2.533 1.00 0.00 H new ATOM 0 HB3 LEU A 15 16.735 -4.649 2.495 1.00 0.00 H new ATOM 0 HG LEU A 15 16.433 -4.785 4.950 1.00 0.00 H new ATOM 0 HD11 LEU A 15 15.372 -2.917 6.143 1.00 0.00 H new ATOM 0 HD12 LEU A 15 16.976 -2.470 5.514 1.00 0.00 H new ATOM 0 HD13 LEU A 15 15.506 -1.910 4.681 1.00 0.00 H new ATOM 0 HD21 LEU A 15 13.982 -4.577 4.944 1.00 0.00 H new ATOM 0 HD22 LEU A 15 14.069 -3.629 3.440 1.00 0.00 H new ATOM 0 HD23 LEU A 15 14.582 -5.334 3.449 1.00 0.00 H new ATOM 230 N SER A 16 19.293 -5.552 3.477 1.00 0.00 N ATOM 231 CA SER A 16 19.968 -6.672 4.126 1.00 0.00 C ATOM 232 C SER A 16 21.309 -6.236 4.706 1.00 0.00 C ATOM 233 O SER A 16 21.697 -6.674 5.787 1.00 0.00 O ATOM 234 CB SER A 16 20.164 -7.827 3.142 1.00 0.00 C ATOM 235 OG SER A 16 18.921 -8.415 2.795 1.00 0.00 O ATOM 0 H SER A 16 19.119 -5.688 2.481 1.00 0.00 H new ATOM 0 HA SER A 16 19.337 -7.017 4.945 1.00 0.00 H new ATOM 0 HB2 SER A 16 20.662 -7.463 2.243 1.00 0.00 H new ATOM 0 HB3 SER A 16 20.816 -8.580 3.585 1.00 0.00 H new ATOM 0 HG SER A 16 18.455 -7.840 2.153 1.00 0.00 H new ATOM 241 N SER A 17 22.018 -5.381 3.974 1.00 0.00 N ATOM 242 CA SER A 17 23.322 -4.889 4.417 1.00 0.00 C ATOM 243 C SER A 17 23.204 -4.111 5.731 1.00 0.00 C ATOM 244 O SER A 17 24.209 -3.709 6.317 1.00 0.00 O ATOM 245 CB SER A 17 23.944 -4.000 3.339 1.00 0.00 C ATOM 246 OG SER A 17 24.226 -4.743 2.167 1.00 0.00 O ATOM 0 H SER A 17 21.713 -5.014 3.072 1.00 0.00 H new ATOM 0 HA SER A 17 23.966 -5.752 4.589 1.00 0.00 H new ATOM 0 HB2 SER A 17 23.264 -3.182 3.100 1.00 0.00 H new ATOM 0 HB3 SER A 17 24.862 -3.551 3.718 1.00 0.00 H new ATOM 0 HG SER A 17 23.386 -4.985 1.723 1.00 0.00 H new ATOM 252 N TYR A 18 21.973 -3.921 6.191 1.00 0.00 N ATOM 253 CA TYR A 18 21.713 -3.209 7.437 1.00 0.00 C ATOM 254 C TYR A 18 22.368 -3.917 8.612 1.00 0.00 C ATOM 255 O TYR A 18 22.669 -5.108 8.549 1.00 0.00 O ATOM 256 CB TYR A 18 20.206 -3.130 7.701 1.00 0.00 C ATOM 257 CG TYR A 18 19.495 -1.930 7.104 1.00 0.00 C ATOM 258 CD1 TYR A 18 20.156 -0.998 6.312 1.00 0.00 C ATOM 259 CD2 TYR A 18 18.143 -1.734 7.351 1.00 0.00 C ATOM 260 CE1 TYR A 18 19.490 0.090 5.783 1.00 0.00 C ATOM 261 CE2 TYR A 18 17.470 -0.653 6.826 1.00 0.00 C ATOM 262 CZ TYR A 18 18.145 0.257 6.043 1.00 0.00 C ATOM 263 OH TYR A 18 17.476 1.339 5.518 1.00 0.00 O ATOM 0 H TYR A 18 21.134 -4.253 5.716 1.00 0.00 H new ATOM 0 HA TYR A 18 22.129 -2.207 7.336 1.00 0.00 H new ATOM 0 HB2 TYR A 18 19.740 -4.036 7.313 1.00 0.00 H new ATOM 0 HB3 TYR A 18 20.044 -3.126 8.779 1.00 0.00 H new ATOM 0 HD1 TYR A 18 21.208 -1.127 6.107 1.00 0.00 H new ATOM 0 HD2 TYR A 18 17.609 -2.443 7.967 1.00 0.00 H new ATOM 0 HE1 TYR A 18 20.018 0.805 5.170 1.00 0.00 H new ATOM 0 HE2 TYR A 18 16.417 -0.520 7.028 1.00 0.00 H new ATOM 0 HH TYR A 18 16.536 1.308 5.795 1.00 0.00 H new ATOM 273 N SER A 19 22.558 -3.178 9.696 1.00 0.00 N ATOM 274 CA SER A 19 23.141 -3.741 10.903 1.00 0.00 C ATOM 275 C SER A 19 22.090 -4.581 11.617 1.00 0.00 C ATOM 276 O SER A 19 20.935 -4.612 11.193 1.00 0.00 O ATOM 277 CB SER A 19 23.647 -2.629 11.824 1.00 0.00 C ATOM 278 OG SER A 19 22.590 -1.767 12.211 1.00 0.00 O ATOM 0 H SER A 19 22.317 -2.189 9.763 1.00 0.00 H new ATOM 0 HA SER A 19 23.990 -4.369 10.634 1.00 0.00 H new ATOM 0 HB2 SER A 19 24.106 -3.067 12.710 1.00 0.00 H new ATOM 0 HB3 SER A 19 24.421 -2.055 11.315 1.00 0.00 H new ATOM 0 HG SER A 19 22.939 -1.066 12.800 1.00 0.00 H new ATOM 284 N LEU A 20 22.478 -5.271 12.681 1.00 0.00 N ATOM 285 CA LEU A 20 21.531 -6.110 13.414 1.00 0.00 C ATOM 286 C LEU A 20 20.375 -5.265 13.946 1.00 0.00 C ATOM 287 O LEU A 20 19.209 -5.630 13.802 1.00 0.00 O ATOM 288 CB LEU A 20 22.234 -6.827 14.566 1.00 0.00 C ATOM 289 CG LEU A 20 23.214 -7.923 14.144 1.00 0.00 C ATOM 290 CD1 LEU A 20 24.028 -8.398 15.338 1.00 0.00 C ATOM 291 CD2 LEU A 20 22.469 -9.087 13.508 1.00 0.00 C ATOM 0 H LEU A 20 23.427 -5.270 13.054 1.00 0.00 H new ATOM 0 HA LEU A 20 21.132 -6.859 12.730 1.00 0.00 H new ATOM 0 HB2 LEU A 20 22.772 -6.088 15.159 1.00 0.00 H new ATOM 0 HB3 LEU A 20 21.478 -7.267 15.215 1.00 0.00 H new ATOM 0 HG LEU A 20 23.899 -7.508 13.405 1.00 0.00 H new ATOM 0 HD11 LEU A 20 24.720 -9.178 15.020 1.00 0.00 H new ATOM 0 HD12 LEU A 20 24.590 -7.561 15.751 1.00 0.00 H new ATOM 0 HD13 LEU A 20 23.358 -8.797 16.100 1.00 0.00 H new ATOM 0 HD21 LEU A 20 23.181 -9.858 13.214 1.00 0.00 H new ATOM 0 HD22 LEU A 20 21.761 -9.502 14.226 1.00 0.00 H new ATOM 0 HD23 LEU A 20 21.930 -8.736 12.628 1.00 0.00 H new ATOM 303 N LEU A 21 20.706 -4.131 14.551 1.00 0.00 N ATOM 304 CA LEU A 21 19.694 -3.223 15.079 1.00 0.00 C ATOM 305 C LEU A 21 18.913 -2.549 13.951 1.00 0.00 C ATOM 306 O LEU A 21 17.697 -2.372 14.037 1.00 0.00 O ATOM 307 CB LEU A 21 20.344 -2.168 15.973 1.00 0.00 C ATOM 308 CG LEU A 21 19.376 -1.157 16.592 1.00 0.00 C ATOM 309 CD1 LEU A 21 19.906 -0.661 17.928 1.00 0.00 C ATOM 310 CD2 LEU A 21 19.147 0.009 15.643 1.00 0.00 C ATOM 0 H LEU A 21 21.667 -3.818 14.688 1.00 0.00 H new ATOM 0 HA LEU A 21 18.993 -3.810 15.673 1.00 0.00 H new ATOM 0 HB2 LEU A 21 20.879 -2.674 16.776 1.00 0.00 H new ATOM 0 HB3 LEU A 21 21.087 -1.626 15.388 1.00 0.00 H new ATOM 0 HG LEU A 21 18.421 -1.654 16.764 1.00 0.00 H new ATOM 0 HD11 LEU A 21 19.205 0.057 18.354 1.00 0.00 H new ATOM 0 HD12 LEU A 21 20.021 -1.504 18.610 1.00 0.00 H new ATOM 0 HD13 LEU A 21 20.873 -0.180 17.780 1.00 0.00 H new ATOM 0 HD21 LEU A 21 18.456 0.719 16.099 1.00 0.00 H new ATOM 0 HD22 LEU A 21 20.096 0.505 15.441 1.00 0.00 H new ATOM 0 HD23 LEU A 21 18.724 -0.360 14.709 1.00 0.00 H new ATOM 322 N GLN A 22 19.635 -2.150 12.902 1.00 0.00 N ATOM 323 CA GLN A 22 19.026 -1.470 11.761 1.00 0.00 C ATOM 324 C GLN A 22 18.017 -2.355 11.032 1.00 0.00 C ATOM 325 O GLN A 22 16.943 -1.892 10.645 1.00 0.00 O ATOM 326 CB GLN A 22 20.114 -1.010 10.784 1.00 0.00 C ATOM 327 CG GLN A 22 19.593 -0.114 9.673 1.00 0.00 C ATOM 328 CD GLN A 22 20.711 0.497 8.850 1.00 0.00 C ATOM 329 OE1 GLN A 22 21.703 -0.162 8.545 1.00 0.00 O ATOM 330 NE2 GLN A 22 20.553 1.765 8.488 1.00 0.00 N ATOM 0 H GLN A 22 20.642 -2.287 12.821 1.00 0.00 H new ATOM 0 HA GLN A 22 18.486 -0.606 12.148 1.00 0.00 H new ATOM 0 HB2 GLN A 22 20.886 -0.476 11.338 1.00 0.00 H new ATOM 0 HB3 GLN A 22 20.587 -1.886 10.341 1.00 0.00 H new ATOM 0 HG2 GLN A 22 18.939 -0.692 9.020 1.00 0.00 H new ATOM 0 HG3 GLN A 22 18.987 0.682 10.106 1.00 0.00 H new ATOM 0 HE21 GLN A 22 19.713 2.273 8.764 1.00 0.00 H new ATOM 0 HE22 GLN A 22 21.272 2.231 7.934 1.00 0.00 H new ATOM 339 N LEU A 23 18.352 -3.631 10.865 1.00 0.00 N ATOM 340 CA LEU A 23 17.465 -4.574 10.196 1.00 0.00 C ATOM 341 C LEU A 23 16.166 -4.725 10.975 1.00 0.00 C ATOM 342 O LEU A 23 15.084 -4.833 10.399 1.00 0.00 O ATOM 343 CB LEU A 23 18.141 -5.934 10.044 1.00 0.00 C ATOM 344 CG LEU A 23 19.304 -5.977 9.053 1.00 0.00 C ATOM 345 CD1 LEU A 23 20.054 -7.294 9.165 1.00 0.00 C ATOM 346 CD2 LEU A 23 18.793 -5.778 7.633 1.00 0.00 C ATOM 0 H LEU A 23 19.232 -4.035 11.185 1.00 0.00 H new ATOM 0 HA LEU A 23 17.239 -4.183 9.204 1.00 0.00 H new ATOM 0 HB2 LEU A 23 18.505 -6.252 11.021 1.00 0.00 H new ATOM 0 HB3 LEU A 23 17.392 -6.661 9.732 1.00 0.00 H new ATOM 0 HG LEU A 23 19.993 -5.168 9.294 1.00 0.00 H new ATOM 0 HD11 LEU A 23 20.878 -7.305 8.452 1.00 0.00 H new ATOM 0 HD12 LEU A 23 20.447 -7.404 10.176 1.00 0.00 H new ATOM 0 HD13 LEU A 23 19.375 -8.119 8.948 1.00 0.00 H new ATOM 0 HD21 LEU A 23 19.631 -5.811 6.937 1.00 0.00 H new ATOM 0 HD22 LEU A 23 18.085 -6.570 7.387 1.00 0.00 H new ATOM 0 HD23 LEU A 23 18.296 -4.811 7.557 1.00 0.00 H new ATOM 358 N ARG A 24 16.297 -4.751 12.296 1.00 0.00 N ATOM 359 CA ARG A 24 15.154 -4.903 13.184 1.00 0.00 C ATOM 360 C ARG A 24 14.406 -3.583 13.377 1.00 0.00 C ATOM 361 O ARG A 24 13.315 -3.555 13.945 1.00 0.00 O ATOM 362 CB ARG A 24 15.625 -5.431 14.537 1.00 0.00 C ATOM 363 CG ARG A 24 16.189 -6.841 14.472 1.00 0.00 C ATOM 364 CD ARG A 24 16.681 -7.307 15.832 1.00 0.00 C ATOM 365 NE ARG A 24 15.607 -7.341 16.824 1.00 0.00 N ATOM 366 CZ ARG A 24 14.776 -8.369 16.986 1.00 0.00 C ATOM 367 NH1 ARG A 24 14.888 -9.453 16.228 1.00 0.00 N ATOM 368 NH2 ARG A 24 13.827 -8.313 17.912 1.00 0.00 N ATOM 0 H ARG A 24 17.192 -4.668 12.778 1.00 0.00 H new ATOM 0 HA ARG A 24 14.464 -5.612 12.725 1.00 0.00 H new ATOM 0 HB2 ARG A 24 16.387 -4.761 14.935 1.00 0.00 H new ATOM 0 HB3 ARG A 24 14.789 -5.414 15.236 1.00 0.00 H new ATOM 0 HG2 ARG A 24 15.422 -7.524 14.108 1.00 0.00 H new ATOM 0 HG3 ARG A 24 17.010 -6.873 13.756 1.00 0.00 H new ATOM 0 HD2 ARG A 24 17.118 -8.301 15.738 1.00 0.00 H new ATOM 0 HD3 ARG A 24 17.472 -6.642 16.178 1.00 0.00 H new ATOM 0 HE ARG A 24 15.487 -6.528 17.428 1.00 0.00 H new ATOM 0 HH11 ARG A 24 15.615 -9.503 15.514 1.00 0.00 H new ATOM 0 HH12 ARG A 24 14.247 -10.236 16.359 1.00 0.00 H new ATOM 0 HH21 ARG A 24 13.735 -7.483 18.498 1.00 0.00 H new ATOM 0 HH22 ARG A 24 13.190 -9.099 18.037 1.00 0.00 H new ATOM 382 N LYS A 25 15.000 -2.486 12.910 1.00 0.00 N ATOM 383 CA LYS A 25 14.383 -1.174 13.041 1.00 0.00 C ATOM 384 C LYS A 25 14.349 -0.438 11.704 1.00 0.00 C ATOM 385 O LYS A 25 15.231 0.357 11.414 1.00 0.00 O ATOM 386 CB LYS A 25 15.136 -0.334 14.078 1.00 0.00 C ATOM 387 CG LYS A 25 14.500 1.021 14.341 1.00 0.00 C ATOM 388 CD LYS A 25 15.284 1.811 15.376 1.00 0.00 C ATOM 389 CE LYS A 25 14.648 3.167 15.640 1.00 0.00 C ATOM 390 NZ LYS A 25 15.338 3.904 16.736 1.00 0.00 N ATOM 0 H LYS A 25 15.905 -2.483 12.439 1.00 0.00 H new ATOM 0 HA LYS A 25 13.356 -1.322 13.374 1.00 0.00 H new ATOM 0 HB2 LYS A 25 15.188 -0.889 15.014 1.00 0.00 H new ATOM 0 HB3 LYS A 25 16.161 -0.185 13.738 1.00 0.00 H new ATOM 0 HG2 LYS A 25 14.449 1.587 13.411 1.00 0.00 H new ATOM 0 HG3 LYS A 25 13.475 0.883 14.686 1.00 0.00 H new ATOM 0 HD2 LYS A 25 15.335 1.244 16.306 1.00 0.00 H new ATOM 0 HD3 LYS A 25 16.308 1.949 15.030 1.00 0.00 H new ATOM 0 HE2 LYS A 25 14.676 3.764 14.728 1.00 0.00 H new ATOM 0 HE3 LYS A 25 13.598 3.031 15.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 14.873 4.822 16.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 15.290 3.347 17.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 16.334 4.058 16.478 1.00 0.00 H new ATOM 404 N VAL A 26 13.313 -0.731 10.913 1.00 0.00 N ATOM 405 CA VAL A 26 13.083 -0.127 9.590 1.00 0.00 C ATOM 406 C VAL A 26 12.661 1.343 9.687 1.00 0.00 C ATOM 407 O VAL A 26 11.474 1.633 9.823 1.00 0.00 O ATOM 408 CB VAL A 26 12.010 -0.896 8.794 1.00 0.00 C ATOM 409 CG1 VAL A 26 12.025 -0.458 7.340 1.00 0.00 C ATOM 410 CG2 VAL A 26 12.226 -2.399 8.905 1.00 0.00 C ATOM 0 H VAL A 26 12.595 -1.407 11.176 1.00 0.00 H new ATOM 0 HA VAL A 26 14.038 -0.186 9.068 1.00 0.00 H new ATOM 0 HB VAL A 26 11.033 -0.666 9.218 1.00 0.00 H new ATOM 0 HG11 VAL A 26 11.263 -1.007 6.787 1.00 0.00 H new ATOM 0 HG12 VAL A 26 11.818 0.610 7.280 1.00 0.00 H new ATOM 0 HG13 VAL A 26 13.005 -0.662 6.909 1.00 0.00 H new ATOM 0 HG21 VAL A 26 11.457 -2.920 8.335 1.00 0.00 H new ATOM 0 HG22 VAL A 26 13.208 -2.656 8.508 1.00 0.00 H new ATOM 0 HG23 VAL A 26 12.168 -2.699 9.951 1.00 0.00 H new ATOM 420 N PRO A 27 13.613 2.305 9.651 1.00 0.00 N ATOM 421 CA PRO A 27 13.279 3.730 9.762 1.00 0.00 C ATOM 422 C PRO A 27 12.353 4.221 8.642 1.00 0.00 C ATOM 423 O PRO A 27 11.141 4.309 8.837 1.00 0.00 O ATOM 424 CB PRO A 27 14.645 4.442 9.735 1.00 0.00 C ATOM 425 CG PRO A 27 15.660 3.372 9.973 1.00 0.00 C ATOM 426 CD PRO A 27 15.057 2.094 9.470 1.00 0.00 C ATOM 0 HA PRO A 27 12.715 3.938 10.671 1.00 0.00 H new ATOM 0 HB2 PRO A 27 14.812 4.934 8.777 1.00 0.00 H new ATOM 0 HB3 PRO A 27 14.701 5.213 10.503 1.00 0.00 H new ATOM 0 HG2 PRO A 27 16.589 3.595 9.449 1.00 0.00 H new ATOM 0 HG3 PRO A 27 15.902 3.296 11.033 1.00 0.00 H new ATOM 0 HD2 PRO A 27 15.309 1.915 8.425 1.00 0.00 H new ATOM 0 HD3 PRO A 27 15.411 1.232 10.036 1.00 0.00 H new ATOM 434 N HIS A 28 12.912 4.553 7.476 1.00 0.00 N ATOM 435 CA HIS A 28 12.105 5.038 6.359 1.00 0.00 C ATOM 436 C HIS A 28 11.794 3.926 5.361 1.00 0.00 C ATOM 437 O HIS A 28 12.700 3.336 4.775 1.00 0.00 O ATOM 438 CB HIS A 28 12.814 6.195 5.653 1.00 0.00 C ATOM 439 CG HIS A 28 12.862 7.451 6.467 1.00 0.00 C ATOM 440 ND1 HIS A 28 13.898 7.752 7.327 1.00 0.00 N ATOM 441 CD2 HIS A 28 11.993 8.485 6.551 1.00 0.00 C ATOM 442 CE1 HIS A 28 13.662 8.917 7.905 1.00 0.00 C ATOM 443 NE2 HIS A 28 12.514 9.382 7.450 1.00 0.00 N ATOM 0 H HIS A 28 13.912 4.495 7.283 1.00 0.00 H new ATOM 0 HA HIS A 28 11.159 5.392 6.768 1.00 0.00 H new ATOM 0 HB2 HIS A 28 13.832 5.891 5.407 1.00 0.00 H new ATOM 0 HB3 HIS A 28 12.306 6.401 4.711 1.00 0.00 H new ATOM 0 HD2 HIS A 28 11.063 8.586 6.011 1.00 0.00 H new ATOM 0 HE1 HIS A 28 14.300 9.405 8.627 1.00 0.00 H new ATOM 0 HE2 HIS A 28 12.083 10.266 7.722 1.00 0.00 H new ATOM 452 N LEU A 29 10.507 3.657 5.161 1.00 0.00 N ATOM 453 CA LEU A 29 10.082 2.625 4.222 1.00 0.00 C ATOM 454 C LEU A 29 9.454 3.231 2.971 1.00 0.00 C ATOM 455 O LEU A 29 8.433 3.915 3.045 1.00 0.00 O ATOM 456 CB LEU A 29 9.085 1.672 4.883 1.00 0.00 C ATOM 457 CG LEU A 29 9.710 0.575 5.742 1.00 0.00 C ATOM 458 CD1 LEU A 29 8.662 -0.062 6.642 1.00 0.00 C ATOM 459 CD2 LEU A 29 10.365 -0.476 4.858 1.00 0.00 C ATOM 0 H LEU A 29 9.743 4.138 5.635 1.00 0.00 H new ATOM 0 HA LEU A 29 10.972 2.070 3.927 1.00 0.00 H new ATOM 0 HB2 LEU A 29 8.405 2.255 5.504 1.00 0.00 H new ATOM 0 HB3 LEU A 29 8.483 1.204 4.105 1.00 0.00 H new ATOM 0 HG LEU A 29 10.476 1.024 6.375 1.00 0.00 H new ATOM 0 HD11 LEU A 29 9.126 -0.841 7.246 1.00 0.00 H new ATOM 0 HD12 LEU A 29 8.234 0.698 7.296 1.00 0.00 H new ATOM 0 HD13 LEU A 29 7.874 -0.499 6.029 1.00 0.00 H new ATOM 0 HD21 LEU A 29 10.807 -1.253 5.482 1.00 0.00 H new ATOM 0 HD22 LEU A 29 9.615 -0.920 4.204 1.00 0.00 H new ATOM 0 HD23 LEU A 29 11.143 -0.010 4.254 1.00 0.00 H new ATOM 471 N VAL A 30 10.057 2.955 1.821 1.00 0.00 N ATOM 472 CA VAL A 30 9.543 3.446 0.551 1.00 0.00 C ATOM 473 C VAL A 30 9.454 2.305 -0.456 1.00 0.00 C ATOM 474 O VAL A 30 10.473 1.794 -0.920 1.00 0.00 O ATOM 475 CB VAL A 30 10.430 4.570 -0.024 1.00 0.00 C ATOM 476 CG1 VAL A 30 9.820 5.145 -1.295 1.00 0.00 C ATOM 477 CG2 VAL A 30 10.642 5.664 1.012 1.00 0.00 C ATOM 0 H VAL A 30 10.904 2.392 1.743 1.00 0.00 H new ATOM 0 HA VAL A 30 8.549 3.854 0.735 1.00 0.00 H new ATOM 0 HB VAL A 30 11.400 4.143 -0.278 1.00 0.00 H new ATOM 0 HG11 VAL A 30 10.463 5.936 -1.682 1.00 0.00 H new ATOM 0 HG12 VAL A 30 9.725 4.357 -2.042 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.835 5.555 -1.073 1.00 0.00 H new ATOM 0 HG21 VAL A 30 11.270 6.449 0.589 1.00 0.00 H new ATOM 0 HG22 VAL A 30 9.678 6.085 1.299 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.130 5.243 1.891 1.00 0.00 H new ATOM 487 N VAL A 31 8.234 1.900 -0.781 1.00 0.00 N ATOM 488 CA VAL A 31 8.019 0.815 -1.729 1.00 0.00 C ATOM 489 C VAL A 31 7.013 1.223 -2.801 1.00 0.00 C ATOM 490 O VAL A 31 5.929 1.715 -2.488 1.00 0.00 O ATOM 491 CB VAL A 31 7.516 -0.456 -1.007 1.00 0.00 C ATOM 492 CG1 VAL A 31 7.296 -1.601 -1.988 1.00 0.00 C ATOM 493 CG2 VAL A 31 8.495 -0.866 0.086 1.00 0.00 C ATOM 0 H VAL A 31 7.378 2.306 -0.402 1.00 0.00 H new ATOM 0 HA VAL A 31 8.976 0.598 -2.204 1.00 0.00 H new ATOM 0 HB VAL A 31 6.555 -0.225 -0.548 1.00 0.00 H new ATOM 0 HG11 VAL A 31 6.943 -2.480 -1.448 1.00 0.00 H new ATOM 0 HG12 VAL A 31 6.553 -1.307 -2.729 1.00 0.00 H new ATOM 0 HG13 VAL A 31 8.235 -1.836 -2.489 1.00 0.00 H new ATOM 0 HG21 VAL A 31 8.128 -1.762 0.586 1.00 0.00 H new ATOM 0 HG22 VAL A 31 9.470 -1.071 -0.357 1.00 0.00 H new ATOM 0 HG23 VAL A 31 8.589 -0.058 0.812 1.00 0.00 H new ATOM 503 N GLY A 32 7.369 1.006 -4.063 1.00 0.00 N ATOM 504 CA GLY A 32 6.469 1.354 -5.146 1.00 0.00 C ATOM 505 C GLY A 32 7.036 1.029 -6.513 1.00 0.00 C ATOM 506 O GLY A 32 8.224 0.737 -6.653 1.00 0.00 O ATOM 0 H GLY A 32 8.258 0.598 -4.353 1.00 0.00 H new ATOM 0 HA2 GLY A 32 5.527 0.822 -5.013 1.00 0.00 H new ATOM 0 HA3 GLY A 32 6.244 2.419 -5.096 1.00 0.00 H new ATOM 510 N HIS A 33 6.180 1.095 -7.527 1.00 0.00 N ATOM 511 CA HIS A 33 6.581 0.819 -8.898 1.00 0.00 C ATOM 512 C HIS A 33 6.335 2.044 -9.773 1.00 0.00 C ATOM 513 O HIS A 33 5.262 2.646 -9.718 1.00 0.00 O ATOM 514 CB HIS A 33 5.803 -0.378 -9.451 1.00 0.00 C ATOM 515 CG HIS A 33 6.189 -1.685 -8.831 1.00 0.00 C ATOM 516 ND1 HIS A 33 6.973 -2.687 -9.294 1.00 0.00 N flip ATOM 517 CD2 HIS A 33 5.747 -2.089 -7.589 1.00 0.00 C flip ATOM 518 CE1 HIS A 33 6.992 -3.667 -8.332 1.00 0.00 C flip ATOM 519 NE2 HIS A 33 6.246 -3.282 -7.314 1.00 0.00 N flip ATOM 0 H HIS A 33 5.195 1.340 -7.421 1.00 0.00 H new ATOM 0 HA HIS A 33 7.645 0.582 -8.906 1.00 0.00 H new ATOM 0 HB2 HIS A 33 4.737 -0.212 -9.293 1.00 0.00 H new ATOM 0 HB3 HIS A 33 5.960 -0.436 -10.528 1.00 0.00 H new ATOM 0 HD2 HIS A 33 5.095 -1.520 -6.942 1.00 0.00 H new ATOM 0 HE1 HIS A 33 7.530 -4.601 -8.398 1.00 0.00 H new ATOM 0 HE2 HIS A 33 6.082 -3.815 -6.460 1.00 0.00 H new ATOM 528 N LYS A 34 7.326 2.414 -10.576 1.00 0.00 N ATOM 529 CA LYS A 34 7.193 3.570 -11.454 1.00 0.00 C ATOM 530 C LYS A 34 6.039 3.372 -12.433 1.00 0.00 C ATOM 531 O LYS A 34 5.276 4.300 -12.705 1.00 0.00 O ATOM 532 CB LYS A 34 8.493 3.814 -12.218 1.00 0.00 C ATOM 533 CG LYS A 34 9.634 4.303 -11.339 1.00 0.00 C ATOM 534 CD LYS A 34 10.902 4.526 -12.146 1.00 0.00 C ATOM 535 CE LYS A 34 12.043 5.015 -11.269 1.00 0.00 C ATOM 536 NZ LYS A 34 12.342 4.065 -10.162 1.00 0.00 N ATOM 0 H LYS A 34 8.224 1.934 -10.637 1.00 0.00 H new ATOM 0 HA LYS A 34 6.980 4.443 -10.837 1.00 0.00 H new ATOM 0 HB2 LYS A 34 8.795 2.889 -12.709 1.00 0.00 H new ATOM 0 HB3 LYS A 34 8.311 4.547 -13.004 1.00 0.00 H new ATOM 0 HG2 LYS A 34 9.345 5.233 -10.849 1.00 0.00 H new ATOM 0 HG3 LYS A 34 9.826 3.574 -10.551 1.00 0.00 H new ATOM 0 HD2 LYS A 34 11.191 3.596 -12.635 1.00 0.00 H new ATOM 0 HD3 LYS A 34 10.710 5.254 -12.934 1.00 0.00 H new ATOM 0 HE2 LYS A 34 12.936 5.153 -11.879 1.00 0.00 H new ATOM 0 HE3 LYS A 34 11.788 5.989 -10.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 13.371 3.932 -10.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 11.976 4.449 -9.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 11.888 3.150 -10.358 1.00 0.00 H new ATOM 550 N SER A 35 5.917 2.157 -12.952 1.00 0.00 N ATOM 551 CA SER A 35 4.845 1.830 -13.883 1.00 0.00 C ATOM 552 C SER A 35 3.512 1.771 -13.154 1.00 0.00 C ATOM 553 O SER A 35 2.489 2.235 -13.657 1.00 0.00 O ATOM 554 CB SER A 35 5.127 0.493 -14.574 1.00 0.00 C ATOM 555 OG SER A 35 6.339 0.539 -15.304 1.00 0.00 O ATOM 0 H SER A 35 6.547 1.382 -12.744 1.00 0.00 H new ATOM 0 HA SER A 35 4.796 2.611 -14.641 1.00 0.00 H new ATOM 0 HB2 SER A 35 5.178 -0.301 -13.829 1.00 0.00 H new ATOM 0 HB3 SER A 35 4.304 0.247 -15.245 1.00 0.00 H new ATOM 0 HG SER A 35 6.495 -0.328 -15.733 1.00 0.00 H new ATOM 561 N TYR A 36 3.542 1.200 -11.955 1.00 0.00 N ATOM 562 CA TYR A 36 2.348 1.074 -11.132 1.00 0.00 C ATOM 563 C TYR A 36 2.717 0.737 -9.691 1.00 0.00 C ATOM 564 O TYR A 36 2.997 -0.416 -9.366 1.00 0.00 O ATOM 565 CB TYR A 36 1.419 -0.002 -11.707 1.00 0.00 C ATOM 566 CG TYR A 36 2.042 -1.381 -11.784 1.00 0.00 C ATOM 567 CD1 TYR A 36 2.903 -1.714 -12.823 1.00 0.00 C ATOM 568 CD2 TYR A 36 1.762 -2.352 -10.828 1.00 0.00 C ATOM 569 CE1 TYR A 36 3.468 -2.973 -12.906 1.00 0.00 C ATOM 570 CE2 TYR A 36 2.325 -3.612 -10.904 1.00 0.00 C ATOM 571 CZ TYR A 36 3.177 -3.917 -11.944 1.00 0.00 C ATOM 572 OH TYR A 36 3.738 -5.171 -12.024 1.00 0.00 O ATOM 0 H TYR A 36 4.386 0.815 -11.531 1.00 0.00 H new ATOM 0 HA TYR A 36 1.826 2.031 -11.137 1.00 0.00 H new ATOM 0 HB2 TYR A 36 0.519 -0.055 -11.094 1.00 0.00 H new ATOM 0 HB3 TYR A 36 1.106 0.300 -12.707 1.00 0.00 H new ATOM 0 HD1 TYR A 36 3.134 -0.977 -13.578 1.00 0.00 H new ATOM 0 HD2 TYR A 36 1.094 -2.117 -10.013 1.00 0.00 H new ATOM 0 HE1 TYR A 36 4.134 -3.216 -13.721 1.00 0.00 H new ATOM 0 HE2 TYR A 36 2.099 -4.354 -10.152 1.00 0.00 H new ATOM 0 HH TYR A 36 3.432 -5.715 -11.269 1.00 0.00 H new ATOM 582 N GLY A 37 2.715 1.748 -8.826 1.00 0.00 N ATOM 583 CA GLY A 37 3.047 1.520 -7.432 1.00 0.00 C ATOM 584 C GLY A 37 3.601 2.748 -6.735 1.00 0.00 C ATOM 585 O GLY A 37 4.725 3.171 -7.003 1.00 0.00 O ATOM 0 H GLY A 37 2.491 2.714 -9.064 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.155 1.184 -6.904 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.778 0.714 -7.368 1.00 0.00 H new ATOM 589 N LYS A 38 2.815 3.310 -5.823 1.00 0.00 N ATOM 590 CA LYS A 38 3.235 4.483 -5.064 1.00 0.00 C ATOM 591 C LYS A 38 2.790 4.360 -3.610 1.00 0.00 C ATOM 592 O LYS A 38 1.720 4.842 -3.237 1.00 0.00 O ATOM 593 CB LYS A 38 2.659 5.756 -5.688 1.00 0.00 C ATOM 594 CG LYS A 38 3.058 7.028 -4.957 1.00 0.00 C ATOM 595 CD LYS A 38 2.458 8.260 -5.617 1.00 0.00 C ATOM 596 CE LYS A 38 2.861 9.533 -4.890 1.00 0.00 C ATOM 597 NZ LYS A 38 2.324 9.573 -3.502 1.00 0.00 N ATOM 0 H LYS A 38 1.881 2.971 -5.591 1.00 0.00 H new ATOM 0 HA LYS A 38 4.323 4.543 -5.093 1.00 0.00 H new ATOM 0 HB2 LYS A 38 2.990 5.824 -6.724 1.00 0.00 H new ATOM 0 HB3 LYS A 38 1.572 5.682 -5.704 1.00 0.00 H new ATOM 0 HG2 LYS A 38 2.728 6.972 -3.920 1.00 0.00 H new ATOM 0 HG3 LYS A 38 4.144 7.115 -4.941 1.00 0.00 H new ATOM 0 HD2 LYS A 38 2.785 8.314 -6.655 1.00 0.00 H new ATOM 0 HD3 LYS A 38 1.371 8.175 -5.629 1.00 0.00 H new ATOM 0 HE2 LYS A 38 3.948 9.606 -4.861 1.00 0.00 H new ATOM 0 HE3 LYS A 38 2.498 10.398 -5.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 1.762 10.439 -3.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 1.721 8.741 -3.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 3.113 9.567 -2.824 1.00 0.00 H new ATOM 611 N ILE A 39 3.613 3.703 -2.796 1.00 0.00 N ATOM 612 CA ILE A 39 3.294 3.507 -1.387 1.00 0.00 C ATOM 613 C ILE A 39 4.484 3.881 -0.501 1.00 0.00 C ATOM 614 O ILE A 39 5.631 3.574 -0.823 1.00 0.00 O ATOM 615 CB ILE A 39 2.883 2.038 -1.115 1.00 0.00 C ATOM 616 CG1 ILE A 39 1.654 1.677 -1.949 1.00 0.00 C ATOM 617 CG2 ILE A 39 2.592 1.810 0.365 1.00 0.00 C ATOM 618 CD1 ILE A 39 1.325 0.200 -1.932 1.00 0.00 C ATOM 0 H ILE A 39 4.503 3.299 -3.088 1.00 0.00 H new ATOM 0 HA ILE A 39 2.455 4.160 -1.144 1.00 0.00 H new ATOM 0 HB ILE A 39 3.716 1.396 -1.399 1.00 0.00 H new ATOM 0 HG12 ILE A 39 0.796 2.237 -1.577 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.818 1.993 -2.979 1.00 0.00 H new ATOM 0 HG21 ILE A 39 2.306 0.770 0.524 1.00 0.00 H new ATOM 0 HG22 ILE A 39 3.484 2.035 0.950 1.00 0.00 H new ATOM 0 HG23 ILE A 39 1.777 2.462 0.680 1.00 0.00 H new ATOM 0 HD11 ILE A 39 0.442 0.017 -2.544 1.00 0.00 H new ATOM 0 HD12 ILE A 39 2.167 -0.365 -2.331 1.00 0.00 H new ATOM 0 HD13 ILE A 39 1.128 -0.117 -0.908 1.00 0.00 H new ATOM 630 N GLU A 40 4.198 4.531 0.623 1.00 0.00 N ATOM 631 CA GLU A 40 5.244 4.927 1.559 1.00 0.00 C ATOM 632 C GLU A 40 4.874 4.509 2.980 1.00 0.00 C ATOM 633 O GLU A 40 3.769 4.782 3.449 1.00 0.00 O ATOM 634 CB GLU A 40 5.466 6.439 1.501 1.00 0.00 C ATOM 635 CG GLU A 40 6.116 6.908 0.209 1.00 0.00 C ATOM 636 CD GLU A 40 6.326 8.410 0.175 1.00 0.00 C ATOM 637 OE1 GLU A 40 5.354 9.138 -0.111 1.00 0.00 O ATOM 638 OE2 GLU A 40 7.463 8.856 0.436 1.00 0.00 O ATOM 0 H GLU A 40 3.254 4.794 0.907 1.00 0.00 H new ATOM 0 HA GLU A 40 6.168 4.424 1.274 1.00 0.00 H new ATOM 0 HB2 GLU A 40 4.507 6.944 1.620 1.00 0.00 H new ATOM 0 HB3 GLU A 40 6.091 6.739 2.342 1.00 0.00 H new ATOM 0 HG2 GLU A 40 7.077 6.407 0.087 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.493 6.612 -0.635 1.00 0.00 H new ATOM 646 N PHE A 41 5.804 3.843 3.656 1.00 0.00 N ATOM 647 CA PHE A 41 5.577 3.383 5.021 1.00 0.00 C ATOM 648 C PHE A 41 6.309 4.258 6.033 1.00 0.00 C ATOM 649 O PHE A 41 7.526 4.428 5.952 1.00 0.00 O ATOM 650 CB PHE A 41 6.030 1.930 5.170 1.00 0.00 C ATOM 651 CG PHE A 41 5.281 0.973 4.287 1.00 0.00 C ATOM 652 CD1 PHE A 41 5.738 0.688 3.010 1.00 0.00 C ATOM 653 CD2 PHE A 41 4.122 0.359 4.732 1.00 0.00 C ATOM 654 CE1 PHE A 41 5.053 -0.191 2.194 1.00 0.00 C ATOM 655 CE2 PHE A 41 3.432 -0.521 3.921 1.00 0.00 C ATOM 656 CZ PHE A 41 3.898 -0.797 2.650 1.00 0.00 C ATOM 0 H PHE A 41 6.723 3.610 3.280 1.00 0.00 H new ATOM 0 HA PHE A 41 4.508 3.453 5.222 1.00 0.00 H new ATOM 0 HB2 PHE A 41 7.094 1.865 4.942 1.00 0.00 H new ATOM 0 HB3 PHE A 41 5.907 1.625 6.209 1.00 0.00 H new ATOM 0 HD1 PHE A 41 6.640 1.159 2.649 1.00 0.00 H new ATOM 0 HD2 PHE A 41 3.753 0.571 5.725 1.00 0.00 H new ATOM 0 HE1 PHE A 41 5.420 -0.404 1.201 1.00 0.00 H new ATOM 0 HE2 PHE A 41 2.529 -0.993 4.280 1.00 0.00 H new ATOM 0 HZ PHE A 41 3.361 -1.485 2.014 1.00 0.00 H new ATOM 666 N LEU A 42 5.568 4.799 6.995 1.00 0.00 N ATOM 667 CA LEU A 42 6.161 5.641 8.031 1.00 0.00 C ATOM 668 C LEU A 42 6.371 4.860 9.326 1.00 0.00 C ATOM 669 O LEU A 42 6.677 5.429 10.372 1.00 0.00 O ATOM 670 CB LEU A 42 5.294 6.875 8.288 1.00 0.00 C ATOM 671 CG LEU A 42 5.277 7.903 7.156 1.00 0.00 C ATOM 672 CD1 LEU A 42 4.207 8.955 7.406 1.00 0.00 C ATOM 673 CD2 LEU A 42 6.643 8.553 7.007 1.00 0.00 C ATOM 0 H LEU A 42 4.560 4.671 7.080 1.00 0.00 H new ATOM 0 HA LEU A 42 7.136 5.970 7.672 1.00 0.00 H new ATOM 0 HB2 LEU A 42 4.271 6.548 8.477 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.645 7.364 9.197 1.00 0.00 H new ATOM 0 HG LEU A 42 5.039 7.387 6.226 1.00 0.00 H new ATOM 0 HD11 LEU A 42 4.210 9.678 6.590 1.00 0.00 H new ATOM 0 HD12 LEU A 42 3.230 8.474 7.462 1.00 0.00 H new ATOM 0 HD13 LEU A 42 4.413 9.468 8.346 1.00 0.00 H new ATOM 0 HD21 LEU A 42 6.613 9.282 6.197 1.00 0.00 H new ATOM 0 HD22 LEU A 42 6.910 9.055 7.937 1.00 0.00 H new ATOM 0 HD23 LEU A 42 7.387 7.789 6.780 1.00 0.00 H new ATOM 685 N GLU A 43 6.201 3.555 9.231 1.00 0.00 N ATOM 686 CA GLU A 43 6.363 2.656 10.370 1.00 0.00 C ATOM 687 C GLU A 43 7.462 1.631 10.096 1.00 0.00 C ATOM 688 O GLU A 43 7.829 1.404 8.943 1.00 0.00 O ATOM 689 CB GLU A 43 5.045 1.942 10.674 1.00 0.00 C ATOM 690 CG GLU A 43 3.950 2.870 11.169 1.00 0.00 C ATOM 691 CD GLU A 43 4.338 3.601 12.440 1.00 0.00 C ATOM 692 OE1 GLU A 43 3.835 4.723 12.657 1.00 0.00 O ATOM 693 OE2 GLU A 43 5.146 3.051 13.218 1.00 0.00 O ATOM 0 H GLU A 43 5.946 3.083 8.364 1.00 0.00 H new ATOM 0 HA GLU A 43 6.652 3.251 11.237 1.00 0.00 H new ATOM 0 HB2 GLU A 43 4.700 1.435 9.773 1.00 0.00 H new ATOM 0 HB3 GLU A 43 5.224 1.172 11.424 1.00 0.00 H new ATOM 0 HG2 GLU A 43 3.717 3.598 10.392 1.00 0.00 H new ATOM 0 HG3 GLU A 43 3.043 2.293 11.348 1.00 0.00 H new ATOM 701 N PRO A 44 8.043 1.027 11.153 1.00 0.00 N ATOM 702 CA PRO A 44 9.133 0.081 11.030 1.00 0.00 C ATOM 703 C PRO A 44 8.749 -1.325 11.495 1.00 0.00 C ATOM 704 O PRO A 44 7.624 -1.557 11.931 1.00 0.00 O ATOM 705 CB PRO A 44 10.093 0.689 12.044 1.00 0.00 C ATOM 706 CG PRO A 44 9.190 1.182 13.153 1.00 0.00 C ATOM 707 CD PRO A 44 7.786 1.285 12.569 1.00 0.00 C ATOM 0 HA PRO A 44 9.494 -0.048 10.010 1.00 0.00 H new ATOM 0 HB2 PRO A 44 10.808 -0.049 12.409 1.00 0.00 H new ATOM 0 HB3 PRO A 44 10.671 1.504 11.608 1.00 0.00 H new ATOM 0 HG2 PRO A 44 9.207 0.495 13.999 1.00 0.00 H new ATOM 0 HG3 PRO A 44 9.526 2.151 13.523 1.00 0.00 H new ATOM 0 HD2 PRO A 44 7.106 0.552 13.003 1.00 0.00 H new ATOM 0 HD3 PRO A 44 7.344 2.267 12.734 1.00 0.00 H new ATOM 715 N VAL A 45 9.697 -2.257 11.393 1.00 0.00 N ATOM 716 CA VAL A 45 9.462 -3.641 11.794 1.00 0.00 C ATOM 717 C VAL A 45 10.780 -4.384 11.976 1.00 0.00 C ATOM 718 O VAL A 45 11.854 -3.782 11.920 1.00 0.00 O ATOM 719 CB VAL A 45 8.611 -4.402 10.751 1.00 0.00 C ATOM 720 CG1 VAL A 45 7.141 -4.026 10.875 1.00 0.00 C ATOM 721 CG2 VAL A 45 9.118 -4.135 9.343 1.00 0.00 C ATOM 0 H VAL A 45 10.635 -2.077 11.036 1.00 0.00 H new ATOM 0 HA VAL A 45 8.920 -3.605 12.739 1.00 0.00 H new ATOM 0 HB VAL A 45 8.706 -5.469 10.950 1.00 0.00 H new ATOM 0 HG11 VAL A 45 6.561 -4.573 10.132 1.00 0.00 H new ATOM 0 HG12 VAL A 45 6.783 -4.280 11.873 1.00 0.00 H new ATOM 0 HG13 VAL A 45 7.024 -2.955 10.710 1.00 0.00 H new ATOM 0 HG21 VAL A 45 8.505 -4.680 8.626 1.00 0.00 H new ATOM 0 HG22 VAL A 45 9.060 -3.067 9.132 1.00 0.00 H new ATOM 0 HG23 VAL A 45 10.153 -4.466 9.260 1.00 0.00 H new ATOM 731 N ASP A 46 10.698 -5.695 12.191 1.00 0.00 N ATOM 732 CA ASP A 46 11.892 -6.511 12.366 1.00 0.00 C ATOM 733 C ASP A 46 12.149 -7.359 11.124 1.00 0.00 C ATOM 734 O ASP A 46 11.405 -8.293 10.832 1.00 0.00 O ATOM 735 CB ASP A 46 11.743 -7.414 13.594 1.00 0.00 C ATOM 736 CG ASP A 46 10.568 -8.364 13.475 1.00 0.00 C ATOM 737 OD1 ASP A 46 10.555 -9.383 14.197 1.00 0.00 O ATOM 738 OD2 ASP A 46 9.662 -8.092 12.660 1.00 0.00 O ATOM 0 H ASP A 46 9.820 -6.211 12.248 1.00 0.00 H new ATOM 0 HA ASP A 46 12.742 -5.846 12.516 1.00 0.00 H new ATOM 0 HB2 ASP A 46 12.659 -7.989 13.732 1.00 0.00 H new ATOM 0 HB3 ASP A 46 11.618 -6.796 14.483 1.00 0.00 H new ATOM 744 N LEU A 47 13.206 -7.018 10.392 1.00 0.00 N ATOM 745 CA LEU A 47 13.555 -7.746 9.173 1.00 0.00 C ATOM 746 C LEU A 47 14.835 -8.562 9.350 1.00 0.00 C ATOM 747 O LEU A 47 15.347 -9.141 8.391 1.00 0.00 O ATOM 748 CB LEU A 47 13.720 -6.765 8.011 1.00 0.00 C ATOM 749 CG LEU A 47 12.442 -6.024 7.614 1.00 0.00 C ATOM 750 CD1 LEU A 47 12.756 -4.912 6.627 1.00 0.00 C ATOM 751 CD2 LEU A 47 11.427 -6.992 7.024 1.00 0.00 C ATOM 0 H LEU A 47 13.834 -6.247 10.619 1.00 0.00 H new ATOM 0 HA LEU A 47 12.744 -8.441 8.955 1.00 0.00 H new ATOM 0 HB2 LEU A 47 14.481 -6.032 8.278 1.00 0.00 H new ATOM 0 HB3 LEU A 47 14.092 -7.310 7.143 1.00 0.00 H new ATOM 0 HG LEU A 47 12.010 -5.576 8.509 1.00 0.00 H new ATOM 0 HD11 LEU A 47 11.835 -4.396 6.356 1.00 0.00 H new ATOM 0 HD12 LEU A 47 13.448 -4.204 7.084 1.00 0.00 H new ATOM 0 HD13 LEU A 47 13.211 -5.337 5.732 1.00 0.00 H new ATOM 0 HD21 LEU A 47 10.524 -6.448 6.747 1.00 0.00 H new ATOM 0 HD22 LEU A 47 11.850 -7.468 6.139 1.00 0.00 H new ATOM 0 HD23 LEU A 47 11.179 -7.754 7.763 1.00 0.00 H new ATOM 763 N ALA A 48 15.342 -8.619 10.577 1.00 0.00 N ATOM 764 CA ALA A 48 16.558 -9.365 10.869 1.00 0.00 C ATOM 765 C ALA A 48 16.385 -10.847 10.538 1.00 0.00 C ATOM 766 O ALA A 48 17.305 -11.490 10.032 1.00 0.00 O ATOM 767 CB ALA A 48 16.943 -9.196 12.331 1.00 0.00 C ATOM 0 H ALA A 48 14.928 -8.156 11.386 1.00 0.00 H new ATOM 0 HA ALA A 48 17.357 -8.967 10.244 1.00 0.00 H new ATOM 0 HB1 ALA A 48 17.854 -9.759 12.535 1.00 0.00 H new ATOM 0 HB2 ALA A 48 17.114 -8.140 12.543 1.00 0.00 H new ATOM 0 HB3 ALA A 48 16.137 -9.567 12.965 1.00 0.00 H new ATOM 773 N GLY A 49 15.203 -11.382 10.832 1.00 0.00 N ATOM 774 CA GLY A 49 14.938 -12.785 10.565 1.00 0.00 C ATOM 775 C GLY A 49 15.079 -13.142 9.097 1.00 0.00 C ATOM 776 O GLY A 49 15.610 -14.199 8.760 1.00 0.00 O ATOM 0 H GLY A 49 14.426 -10.870 11.249 1.00 0.00 H new ATOM 0 HA2 GLY A 49 15.624 -13.397 11.150 1.00 0.00 H new ATOM 0 HA3 GLY A 49 13.929 -13.029 10.898 1.00 0.00 H new ATOM 780 N ILE A 50 14.606 -12.260 8.219 1.00 0.00 N ATOM 781 CA ILE A 50 14.691 -12.492 6.777 1.00 0.00 C ATOM 782 C ILE A 50 14.049 -13.836 6.390 1.00 0.00 C ATOM 783 O ILE A 50 14.714 -14.714 5.838 1.00 0.00 O ATOM 784 CB ILE A 50 16.163 -12.450 6.301 1.00 0.00 C ATOM 785 CG1 ILE A 50 16.792 -11.105 6.665 1.00 0.00 C ATOM 786 CG2 ILE A 50 16.265 -12.689 4.800 1.00 0.00 C ATOM 787 CD1 ILE A 50 18.280 -11.040 6.397 1.00 0.00 C ATOM 0 H ILE A 50 14.161 -11.380 8.479 1.00 0.00 H new ATOM 0 HA ILE A 50 14.138 -11.694 6.282 1.00 0.00 H new ATOM 0 HB ILE A 50 16.706 -13.249 6.806 1.00 0.00 H new ATOM 0 HG12 ILE A 50 16.295 -10.316 6.101 1.00 0.00 H new ATOM 0 HG13 ILE A 50 16.612 -10.903 7.721 1.00 0.00 H new ATOM 0 HG21 ILE A 50 17.311 -12.653 4.496 1.00 0.00 H new ATOM 0 HG22 ILE A 50 15.850 -13.668 4.558 1.00 0.00 H new ATOM 0 HG23 ILE A 50 15.707 -11.917 4.270 1.00 0.00 H new ATOM 0 HD11 ILE A 50 18.658 -10.057 6.679 1.00 0.00 H new ATOM 0 HD12 ILE A 50 18.789 -11.806 6.982 1.00 0.00 H new ATOM 0 HD13 ILE A 50 18.466 -11.210 5.337 1.00 0.00 H new ATOM 799 N PRO A 51 12.740 -14.015 6.674 1.00 0.00 N ATOM 800 CA PRO A 51 12.028 -15.256 6.351 1.00 0.00 C ATOM 801 C PRO A 51 11.698 -15.373 4.864 1.00 0.00 C ATOM 802 O PRO A 51 10.576 -15.719 4.494 1.00 0.00 O ATOM 803 CB PRO A 51 10.746 -15.143 7.175 1.00 0.00 C ATOM 804 CG PRO A 51 10.499 -13.680 7.285 1.00 0.00 C ATOM 805 CD PRO A 51 11.856 -13.029 7.334 1.00 0.00 C ATOM 0 HA PRO A 51 12.625 -16.140 6.575 1.00 0.00 H new ATOM 0 HB2 PRO A 51 9.914 -15.650 6.686 1.00 0.00 H new ATOM 0 HB3 PRO A 51 10.864 -15.600 8.157 1.00 0.00 H new ATOM 0 HG2 PRO A 51 9.923 -13.317 6.434 1.00 0.00 H new ATOM 0 HG3 PRO A 51 9.923 -13.448 8.181 1.00 0.00 H new ATOM 0 HD2 PRO A 51 11.861 -12.073 6.811 1.00 0.00 H new ATOM 0 HD3 PRO A 51 12.170 -12.833 8.359 1.00 0.00 H new ATOM 813 N LEU A 52 12.684 -15.091 4.018 1.00 0.00 N ATOM 814 CA LEU A 52 12.499 -15.166 2.572 1.00 0.00 C ATOM 815 C LEU A 52 12.110 -16.578 2.140 1.00 0.00 C ATOM 816 O LEU A 52 11.277 -16.755 1.252 1.00 0.00 O ATOM 817 CB LEU A 52 13.773 -14.732 1.845 1.00 0.00 C ATOM 818 CG LEU A 52 13.859 -13.239 1.530 1.00 0.00 C ATOM 819 CD1 LEU A 52 14.053 -12.435 2.803 1.00 0.00 C ATOM 820 CD2 LEU A 52 14.988 -12.965 0.545 1.00 0.00 C ATOM 0 H LEU A 52 13.620 -14.808 4.309 1.00 0.00 H new ATOM 0 HA LEU A 52 11.688 -14.488 2.305 1.00 0.00 H new ATOM 0 HB2 LEU A 52 14.633 -15.010 2.454 1.00 0.00 H new ATOM 0 HB3 LEU A 52 13.849 -15.290 0.912 1.00 0.00 H new ATOM 0 HG LEU A 52 12.920 -12.930 1.070 1.00 0.00 H new ATOM 0 HD11 LEU A 52 14.112 -11.375 2.558 1.00 0.00 H new ATOM 0 HD12 LEU A 52 13.211 -12.606 3.473 1.00 0.00 H new ATOM 0 HD13 LEU A 52 14.976 -12.746 3.293 1.00 0.00 H new ATOM 0 HD21 LEU A 52 15.034 -11.897 0.332 1.00 0.00 H new ATOM 0 HD22 LEU A 52 15.934 -13.290 0.977 1.00 0.00 H new ATOM 0 HD23 LEU A 52 14.804 -13.511 -0.380 1.00 0.00 H new ATOM 906 N ILE A 59 9.444 -10.601 -0.454 1.00 0.00 N ATOM 907 CA ILE A 59 8.572 -10.476 0.715 1.00 0.00 C ATOM 908 C ILE A 59 7.441 -9.478 0.463 1.00 0.00 C ATOM 909 O ILE A 59 6.441 -9.465 1.181 1.00 0.00 O ATOM 910 CB ILE A 59 9.360 -10.029 1.967 1.00 0.00 C ATOM 911 CG1 ILE A 59 10.601 -10.902 2.161 1.00 0.00 C ATOM 912 CG2 ILE A 59 8.473 -10.084 3.203 1.00 0.00 C ATOM 913 CD1 ILE A 59 11.656 -10.265 3.041 1.00 0.00 C ATOM 0 HA ILE A 59 8.149 -11.465 0.892 1.00 0.00 H new ATOM 0 HB ILE A 59 9.683 -8.999 1.819 1.00 0.00 H new ATOM 0 HG12 ILE A 59 10.301 -11.854 2.598 1.00 0.00 H new ATOM 0 HG13 ILE A 59 11.037 -11.122 1.186 1.00 0.00 H new ATOM 0 HG21 ILE A 59 9.044 -9.766 4.075 1.00 0.00 H new ATOM 0 HG22 ILE A 59 7.618 -9.421 3.067 1.00 0.00 H new ATOM 0 HG23 ILE A 59 8.120 -11.104 3.353 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.507 -10.939 3.135 1.00 0.00 H new ATOM 0 HD12 ILE A 59 11.984 -9.326 2.594 1.00 0.00 H new ATOM 0 HD13 ILE A 59 11.237 -10.070 4.028 1.00 0.00 H new ATOM 925 N ILE A 60 7.612 -8.640 -0.555 1.00 0.00 N ATOM 926 CA ILE A 60 6.613 -7.635 -0.897 1.00 0.00 C ATOM 927 C ILE A 60 6.137 -7.780 -2.342 1.00 0.00 C ATOM 928 O ILE A 60 6.947 -7.887 -3.262 1.00 0.00 O ATOM 929 CB ILE A 60 7.167 -6.211 -0.691 1.00 0.00 C ATOM 930 CG1 ILE A 60 8.399 -5.984 -1.573 1.00 0.00 C ATOM 931 CG2 ILE A 60 7.508 -5.983 0.774 1.00 0.00 C ATOM 932 CD1 ILE A 60 8.861 -4.545 -1.609 1.00 0.00 C ATOM 0 H ILE A 60 8.435 -8.638 -1.158 1.00 0.00 H new ATOM 0 HA ILE A 60 5.766 -7.796 -0.230 1.00 0.00 H new ATOM 0 HB ILE A 60 6.400 -5.494 -0.982 1.00 0.00 H new ATOM 0 HG12 ILE A 60 9.215 -6.610 -1.211 1.00 0.00 H new ATOM 0 HG13 ILE A 60 8.174 -6.310 -2.588 1.00 0.00 H new ATOM 0 HG21 ILE A 60 7.898 -4.973 0.904 1.00 0.00 H new ATOM 0 HG22 ILE A 60 6.610 -6.106 1.380 1.00 0.00 H new ATOM 0 HG23 ILE A 60 8.260 -6.706 1.089 1.00 0.00 H new ATOM 0 HD11 ILE A 60 9.737 -4.460 -2.252 1.00 0.00 H new ATOM 0 HD12 ILE A 60 8.061 -3.916 -2.000 1.00 0.00 H new ATOM 0 HD13 ILE A 60 9.119 -4.220 -0.601 1.00 0.00 H new ATOM 944 N THR A 61 4.822 -7.765 -2.535 1.00 0.00 N ATOM 945 CA THR A 61 4.247 -7.877 -3.871 1.00 0.00 C ATOM 946 C THR A 61 3.224 -6.773 -4.100 1.00 0.00 C ATOM 947 O THR A 61 2.460 -6.429 -3.198 1.00 0.00 O ATOM 948 CB THR A 61 3.596 -9.247 -4.059 1.00 0.00 C ATOM 949 OG1 THR A 61 2.710 -9.533 -2.991 1.00 0.00 O ATOM 950 CG2 THR A 61 4.599 -10.378 -4.142 1.00 0.00 C ATOM 0 H THR A 61 4.136 -7.677 -1.785 1.00 0.00 H new ATOM 0 HA THR A 61 5.048 -7.770 -4.602 1.00 0.00 H new ATOM 0 HB THR A 61 3.062 -9.186 -5.007 1.00 0.00 H new ATOM 0 HG1 THR A 61 2.517 -8.709 -2.497 1.00 0.00 H new ATOM 0 HG21 THR A 61 4.072 -11.323 -4.275 1.00 0.00 H new ATOM 0 HG22 THR A 61 5.266 -10.212 -4.988 1.00 0.00 H new ATOM 0 HG23 THR A 61 5.183 -10.415 -3.222 1.00 0.00 H new ATOM 958 N PHE A 62 3.215 -6.208 -5.304 1.00 0.00 N ATOM 959 CA PHE A 62 2.283 -5.135 -5.622 1.00 0.00 C ATOM 960 C PHE A 62 1.534 -5.412 -6.923 1.00 0.00 C ATOM 961 O PHE A 62 2.115 -5.386 -8.009 1.00 0.00 O ATOM 962 CB PHE A 62 3.032 -3.802 -5.729 1.00 0.00 C ATOM 963 CG PHE A 62 2.139 -2.627 -6.016 1.00 0.00 C ATOM 964 CD1 PHE A 62 1.864 -2.251 -7.321 1.00 0.00 C ATOM 965 CD2 PHE A 62 1.579 -1.896 -4.981 1.00 0.00 C ATOM 966 CE1 PHE A 62 1.047 -1.168 -7.589 1.00 0.00 C ATOM 967 CE2 PHE A 62 0.762 -0.811 -5.242 1.00 0.00 C ATOM 968 CZ PHE A 62 0.493 -0.447 -6.547 1.00 0.00 C ATOM 0 H PHE A 62 3.837 -6.473 -6.068 1.00 0.00 H new ATOM 0 HA PHE A 62 1.552 -5.079 -4.815 1.00 0.00 H new ATOM 0 HB2 PHE A 62 3.567 -3.621 -4.797 1.00 0.00 H new ATOM 0 HB3 PHE A 62 3.781 -3.879 -6.517 1.00 0.00 H new ATOM 0 HD1 PHE A 62 2.293 -2.811 -8.139 1.00 0.00 H new ATOM 0 HD2 PHE A 62 1.783 -2.177 -3.958 1.00 0.00 H new ATOM 0 HE1 PHE A 62 0.842 -0.886 -8.611 1.00 0.00 H new ATOM 0 HE2 PHE A 62 0.334 -0.248 -4.425 1.00 0.00 H new ATOM 0 HZ PHE A 62 -0.148 0.398 -6.753 1.00 0.00 H new ATOM 978 N GLU A 63 0.235 -5.646 -6.799 1.00 0.00 N ATOM 979 CA GLU A 63 -0.621 -5.893 -7.947 1.00 0.00 C ATOM 980 C GLU A 63 -0.807 -4.600 -8.729 1.00 0.00 C ATOM 981 O GLU A 63 -0.889 -3.529 -8.129 1.00 0.00 O ATOM 982 CB GLU A 63 -1.978 -6.441 -7.500 1.00 0.00 C ATOM 983 CG GLU A 63 -2.837 -6.948 -8.647 1.00 0.00 C ATOM 984 CD GLU A 63 -4.257 -7.258 -8.218 1.00 0.00 C ATOM 985 OE1 GLU A 63 -4.433 -8.069 -7.284 1.00 0.00 O ATOM 986 OE2 GLU A 63 -5.196 -6.690 -8.816 1.00 0.00 O ATOM 0 H GLU A 63 -0.252 -5.670 -5.903 1.00 0.00 H new ATOM 0 HA GLU A 63 -0.148 -6.638 -8.587 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -1.817 -7.253 -6.791 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -2.520 -5.658 -6.970 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -2.856 -6.200 -9.440 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -2.384 -7.846 -9.066 1.00 0.00 H new ATOM 994 N PRO A 64 -0.862 -4.660 -10.072 1.00 0.00 N ATOM 995 CA PRO A 64 -1.031 -3.457 -10.885 1.00 0.00 C ATOM 996 C PRO A 64 -2.429 -2.869 -10.759 1.00 0.00 C ATOM 997 O PRO A 64 -3.138 -2.677 -11.747 1.00 0.00 O ATOM 998 CB PRO A 64 -0.761 -3.942 -12.309 1.00 0.00 C ATOM 999 CG PRO A 64 -1.096 -5.395 -12.283 1.00 0.00 C ATOM 1000 CD PRO A 64 -0.759 -5.879 -10.898 1.00 0.00 C ATOM 0 HA PRO A 64 -0.364 -2.654 -10.573 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -1.375 -3.407 -13.033 1.00 0.00 H new ATOM 0 HB3 PRO A 64 0.279 -3.780 -12.592 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -2.151 -5.555 -12.505 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -0.525 -5.940 -13.035 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -1.452 -6.651 -10.563 1.00 0.00 H new ATOM 0 HD3 PRO A 64 0.242 -6.309 -10.856 1.00 0.00 H new ATOM 1008 N LYS A 65 -2.804 -2.588 -9.520 1.00 0.00 N ATOM 1009 CA LYS A 65 -4.101 -2.018 -9.187 1.00 0.00 C ATOM 1010 C LYS A 65 -4.248 -1.951 -7.668 1.00 0.00 C ATOM 1011 O LYS A 65 -4.923 -1.072 -7.131 1.00 0.00 O ATOM 1012 CB LYS A 65 -5.236 -2.857 -9.782 1.00 0.00 C ATOM 1013 CG LYS A 65 -6.619 -2.313 -9.468 1.00 0.00 C ATOM 1014 CD LYS A 65 -7.711 -3.175 -10.081 1.00 0.00 C ATOM 1015 CE LYS A 65 -9.094 -2.629 -9.766 1.00 0.00 C ATOM 1016 NZ LYS A 65 -9.385 -2.661 -8.307 1.00 0.00 N ATOM 0 H LYS A 65 -2.209 -2.751 -8.708 1.00 0.00 H new ATOM 0 HA LYS A 65 -4.161 -1.015 -9.609 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -5.111 -2.908 -10.864 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -5.161 -3.877 -9.404 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -6.755 -2.266 -8.388 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -6.704 -1.294 -9.845 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -7.575 -3.223 -11.161 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -7.626 -4.194 -9.704 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -9.171 -1.604 -10.129 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -9.845 -3.213 -10.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -10.396 -2.476 -8.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -9.141 -3.597 -7.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -8.821 -1.932 -7.824 1.00 0.00 H new ATOM 1030 N THR A 66 -3.600 -2.895 -6.986 1.00 0.00 N ATOM 1031 CA THR A 66 -3.639 -2.965 -5.527 1.00 0.00 C ATOM 1032 C THR A 66 -2.342 -3.552 -4.976 1.00 0.00 C ATOM 1033 O THR A 66 -1.701 -4.377 -5.626 1.00 0.00 O ATOM 1034 CB THR A 66 -4.830 -3.807 -5.068 1.00 0.00 C ATOM 1035 OG1 THR A 66 -6.031 -3.340 -5.657 1.00 0.00 O ATOM 1036 CG2 THR A 66 -5.022 -3.804 -3.568 1.00 0.00 C ATOM 0 H THR A 66 -3.039 -3.625 -7.424 1.00 0.00 H new ATOM 0 HA THR A 66 -3.750 -1.951 -5.142 1.00 0.00 H new ATOM 0 HB THR A 66 -4.604 -4.825 -5.386 1.00 0.00 H new ATOM 0 HG1 THR A 66 -6.781 -3.892 -5.352 1.00 0.00 H new ATOM 0 HG21 THR A 66 -5.883 -4.420 -3.310 1.00 0.00 H new ATOM 0 HG22 THR A 66 -4.131 -4.206 -3.086 1.00 0.00 H new ATOM 0 HG23 THR A 66 -5.190 -2.783 -3.225 1.00 0.00 H new ATOM 1044 N CYS A 67 -1.963 -3.132 -3.773 1.00 0.00 N ATOM 1045 CA CYS A 67 -0.743 -3.627 -3.140 1.00 0.00 C ATOM 1046 C CYS A 67 -1.070 -4.707 -2.111 1.00 0.00 C ATOM 1047 O CYS A 67 -1.804 -4.459 -1.155 1.00 0.00 O ATOM 1048 CB CYS A 67 0.010 -2.481 -2.465 1.00 0.00 C ATOM 1049 SG CYS A 67 1.579 -2.968 -1.713 1.00 0.00 S ATOM 0 H CYS A 67 -2.481 -2.452 -3.217 1.00 0.00 H new ATOM 0 HA CYS A 67 -0.111 -4.060 -3.915 1.00 0.00 H new ATOM 0 HB2 CYS A 67 0.200 -1.701 -3.203 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -0.628 -2.044 -1.697 1.00 0.00 H new ATOM 0 HG CYS A 67 1.827 -2.203 -0.692 1.00 0.00 H new ATOM 1055 N ILE A 68 -0.533 -5.908 -2.315 1.00 0.00 N ATOM 1056 CA ILE A 68 -0.788 -7.013 -1.400 1.00 0.00 C ATOM 1057 C ILE A 68 0.514 -7.534 -0.780 1.00 0.00 C ATOM 1058 O ILE A 68 1.432 -7.960 -1.488 1.00 0.00 O ATOM 1059 CB ILE A 68 -1.519 -8.173 -2.125 1.00 0.00 C ATOM 1060 CG1 ILE A 68 -2.855 -7.680 -2.681 1.00 0.00 C ATOM 1061 CG2 ILE A 68 -1.755 -9.352 -1.184 1.00 0.00 C ATOM 1062 CD1 ILE A 68 -3.529 -8.671 -3.606 1.00 0.00 C ATOM 0 H ILE A 68 0.076 -6.138 -3.100 1.00 0.00 H new ATOM 0 HA ILE A 68 -1.426 -6.633 -0.602 1.00 0.00 H new ATOM 0 HB ILE A 68 -0.885 -8.512 -2.944 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -3.525 -7.457 -1.850 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -2.693 -6.746 -3.219 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -2.269 -10.149 -1.721 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -0.798 -9.721 -0.816 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -2.367 -9.029 -0.342 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -4.471 -8.254 -3.962 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -2.878 -8.876 -4.456 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -3.723 -9.598 -3.067 1.00 0.00 H new ATOM 1074 N ILE A 69 0.592 -7.477 0.546 1.00 0.00 N ATOM 1075 CA ILE A 69 1.762 -7.953 1.277 1.00 0.00 C ATOM 1076 C ILE A 69 1.864 -9.476 1.203 1.00 0.00 C ATOM 1077 O ILE A 69 2.951 -10.036 1.074 1.00 0.00 O ATOM 1078 CB ILE A 69 1.718 -7.491 2.754 1.00 0.00 C ATOM 1079 CG1 ILE A 69 1.683 -5.965 2.831 1.00 0.00 C ATOM 1080 CG2 ILE A 69 2.913 -8.026 3.535 1.00 0.00 C ATOM 1081 CD1 ILE A 69 1.398 -5.435 4.220 1.00 0.00 C ATOM 0 H ILE A 69 -0.148 -7.103 1.140 1.00 0.00 H new ATOM 0 HA ILE A 69 2.647 -7.522 0.808 1.00 0.00 H new ATOM 0 HB ILE A 69 0.810 -7.893 3.204 1.00 0.00 H new ATOM 0 HG12 ILE A 69 2.640 -5.570 2.490 1.00 0.00 H new ATOM 0 HG13 ILE A 69 0.922 -5.592 2.146 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.854 -7.685 4.569 1.00 0.00 H new ATOM 0 HG22 ILE A 69 2.905 -9.116 3.511 1.00 0.00 H new ATOM 0 HG23 ILE A 69 3.836 -7.660 3.084 1.00 0.00 H new ATOM 0 HD11 ILE A 69 1.388 -4.345 4.199 1.00 0.00 H new ATOM 0 HD12 ILE A 69 0.428 -5.800 4.557 1.00 0.00 H new ATOM 0 HD13 ILE A 69 2.173 -5.778 4.906 1.00 0.00 H new ATOM 1093 N TYR A 70 0.714 -10.136 1.322 1.00 0.00 N ATOM 1094 CA TYR A 70 0.653 -11.596 1.279 1.00 0.00 C ATOM 1095 C TYR A 70 1.040 -12.135 -0.089 1.00 0.00 C ATOM 1096 O TYR A 70 1.563 -13.243 -0.205 1.00 0.00 O ATOM 1097 CB TYR A 70 -0.754 -12.076 1.648 1.00 0.00 C ATOM 1098 CG TYR A 70 -1.110 -11.868 3.102 1.00 0.00 C ATOM 1099 CD1 TYR A 70 -1.708 -10.691 3.528 1.00 0.00 C ATOM 1100 CD2 TYR A 70 -0.842 -12.850 4.050 1.00 0.00 C ATOM 1101 CE1 TYR A 70 -2.033 -10.495 4.857 1.00 0.00 C ATOM 1102 CE2 TYR A 70 -1.165 -12.662 5.380 1.00 0.00 C ATOM 1103 CZ TYR A 70 -1.759 -11.483 5.779 1.00 0.00 C ATOM 1104 OH TYR A 70 -2.082 -11.292 7.102 1.00 0.00 O ATOM 0 H TYR A 70 -0.190 -9.682 1.449 1.00 0.00 H new ATOM 0 HA TYR A 70 1.371 -11.978 2.005 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -1.481 -11.551 1.028 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -0.839 -13.137 1.411 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -1.923 -9.915 2.809 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -0.374 -13.773 3.742 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -2.499 -9.573 5.172 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -0.953 -13.435 6.104 1.00 0.00 H new ATOM 0 HH TYR A 70 -1.824 -12.083 7.619 1.00 0.00 H new ATOM 1114 N ALA A 71 0.772 -11.349 -1.132 1.00 0.00 N ATOM 1115 CA ALA A 71 1.080 -11.748 -2.507 1.00 0.00 C ATOM 1116 C ALA A 71 0.096 -12.800 -3.002 1.00 0.00 C ATOM 1117 O ALA A 71 0.488 -13.892 -3.422 1.00 0.00 O ATOM 1118 CB ALA A 71 2.519 -12.248 -2.627 1.00 0.00 C ATOM 0 H ALA A 71 0.340 -10.428 -1.051 1.00 0.00 H new ATOM 0 HA ALA A 71 0.979 -10.866 -3.140 1.00 0.00 H new ATOM 0 HB1 ALA A 71 2.719 -12.537 -3.659 1.00 0.00 H new ATOM 0 HB2 ALA A 71 3.206 -11.454 -2.333 1.00 0.00 H new ATOM 0 HB3 ALA A 71 2.660 -13.110 -1.975 1.00 0.00 H new ATOM 1124 N ASN A 72 -1.187 -12.464 -2.942 1.00 0.00 N ATOM 1125 CA ASN A 72 -2.243 -13.367 -3.381 1.00 0.00 C ATOM 1126 C ASN A 72 -2.238 -14.654 -2.562 1.00 0.00 C ATOM 1127 O ASN A 72 -2.690 -15.690 -3.040 1.00 0.00 O ATOM 1128 CB ASN A 72 -2.095 -13.686 -4.865 1.00 0.00 C ATOM 1129 CG ASN A 72 -2.424 -12.499 -5.749 1.00 0.00 C ATOM 1130 OD1 ASN A 72 -3.107 -11.566 -5.327 1.00 0.00 O ATOM 1131 ND2 ASN A 72 -1.930 -12.524 -6.983 1.00 0.00 N ATOM 0 H ASN A 72 -1.522 -11.567 -2.591 1.00 0.00 H new ATOM 0 HA ASN A 72 -3.198 -12.866 -3.225 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -1.074 -14.011 -5.064 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -2.750 -14.519 -5.122 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -2.112 -11.749 -7.621 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -1.369 -13.318 -7.292 1.00 0.00 H new ATOM 1138 N LEU A 73 -1.704 -14.573 -1.345 1.00 0.00 N ATOM 1139 CA LEU A 73 -1.625 -15.702 -0.407 1.00 0.00 C ATOM 1140 C LEU A 73 -3.005 -16.155 0.088 1.00 0.00 C ATOM 1141 O LEU A 73 -3.530 -15.581 1.046 1.00 0.00 O ATOM 1142 CB LEU A 73 -0.747 -15.323 0.789 1.00 0.00 C ATOM 1143 CG LEU A 73 -0.012 -16.476 1.478 1.00 0.00 C ATOM 1144 CD1 LEU A 73 -1.001 -17.507 2.003 1.00 0.00 C ATOM 1145 CD2 LEU A 73 0.979 -17.126 0.522 1.00 0.00 C ATOM 0 H LEU A 73 -1.307 -13.710 -0.973 1.00 0.00 H new ATOM 0 HA LEU A 73 -1.184 -16.539 -0.948 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -0.007 -14.596 0.455 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -1.372 -14.824 1.529 1.00 0.00 H new ATOM 0 HG LEU A 73 0.541 -16.070 2.325 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -0.458 -18.318 2.489 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -1.670 -17.036 2.723 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -1.584 -17.907 1.174 1.00 0.00 H new ATOM 0 HD21 LEU A 73 1.492 -17.943 1.030 1.00 0.00 H new ATOM 0 HD22 LEU A 73 0.446 -17.515 -0.345 1.00 0.00 H new ATOM 0 HD23 LEU A 73 1.710 -16.386 0.197 1.00 0.00 H new ATOM 1157 N PRO A 74 -3.651 -17.143 -0.569 1.00 0.00 N ATOM 1158 CA PRO A 74 -4.966 -17.623 -0.172 1.00 0.00 C ATOM 1159 C PRO A 74 -4.929 -18.818 0.766 1.00 0.00 C ATOM 1160 O PRO A 74 -5.738 -19.739 0.640 1.00 0.00 O ATOM 1161 CB PRO A 74 -5.568 -18.014 -1.518 1.00 0.00 C ATOM 1162 CG PRO A 74 -4.406 -18.519 -2.318 1.00 0.00 C ATOM 1163 CD PRO A 74 -3.150 -17.920 -1.718 1.00 0.00 C ATOM 0 HA PRO A 74 -5.525 -16.876 0.392 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -6.333 -18.781 -1.402 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -6.043 -17.161 -2.003 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -4.364 -19.608 -2.289 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -4.506 -18.232 -3.365 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.448 -18.692 -1.404 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -2.627 -17.286 -2.434 1.00 0.00 H new ATOM 1171 N ASN A 75 -3.974 -18.825 1.694 1.00 0.00 N ATOM 1172 CA ASN A 75 -3.855 -19.931 2.644 1.00 0.00 C ATOM 1173 C ASN A 75 -3.293 -19.463 3.983 1.00 0.00 C ATOM 1174 O ASN A 75 -4.040 -19.278 4.946 1.00 0.00 O ATOM 1175 CB ASN A 75 -2.968 -21.032 2.051 1.00 0.00 C ATOM 1176 CG ASN A 75 -1.674 -20.494 1.476 1.00 0.00 C ATOM 1177 OD1 ASN A 75 -0.645 -20.457 2.153 1.00 0.00 O ATOM 1178 ND2 ASN A 75 -1.716 -20.071 0.219 1.00 0.00 N ATOM 0 H ASN A 75 -3.279 -18.087 1.809 1.00 0.00 H new ATOM 0 HA ASN A 75 -4.853 -20.329 2.827 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -2.740 -21.765 2.825 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -3.519 -21.555 1.269 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -0.875 -19.698 -0.222 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -2.589 -20.119 -0.306 1.00 0.00 H new ATOM 1185 N ARG A 76 -1.974 -19.287 4.054 1.00 0.00 N ATOM 1186 CA ARG A 76 -1.317 -18.841 5.274 1.00 0.00 C ATOM 1187 C ARG A 76 0.198 -18.757 5.100 1.00 0.00 C ATOM 1188 O ARG A 76 0.803 -19.601 4.441 1.00 0.00 O ATOM 1189 CB ARG A 76 -1.620 -19.815 6.424 1.00 0.00 C ATOM 1190 CG ARG A 76 -1.144 -19.327 7.782 1.00 0.00 C ATOM 1191 CD ARG A 76 -1.628 -20.227 8.906 1.00 0.00 C ATOM 1192 NE ARG A 76 -0.746 -20.174 10.071 1.00 0.00 N ATOM 1193 CZ ARG A 76 -0.926 -20.900 11.178 1.00 0.00 C ATOM 1194 NH1 ARG A 76 -1.953 -21.735 11.274 1.00 0.00 N ATOM 1195 NH2 ARG A 76 -0.076 -20.787 12.189 1.00 0.00 N ATOM 0 H ARG A 76 -1.339 -19.449 3.273 1.00 0.00 H new ATOM 0 HA ARG A 76 -1.703 -17.848 5.503 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -2.695 -19.989 6.467 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -1.151 -20.775 6.208 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -0.055 -19.286 7.792 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -1.503 -18.311 7.949 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -2.635 -19.930 9.200 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -1.691 -21.254 8.546 1.00 0.00 H new ATOM 0 HE ARG A 76 0.056 -19.544 10.036 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -2.611 -21.825 10.500 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -2.084 -22.286 12.122 1.00 0.00 H new ATOM 0 HH21 ARG A 76 0.715 -20.146 12.121 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -0.213 -21.341 13.035 1.00 0.00 H new ATOM 1209 N PRO A 77 0.818 -17.658 5.564 1.00 0.00 N ATOM 1210 CA PRO A 77 2.239 -17.411 5.453 1.00 0.00 C ATOM 1211 C PRO A 77 3.020 -17.525 6.752 1.00 0.00 C ATOM 1212 O PRO A 77 3.320 -16.499 7.390 1.00 0.00 O ATOM 1213 CB PRO A 77 2.182 -15.959 4.983 1.00 0.00 C ATOM 1214 CG PRO A 77 1.045 -15.373 5.784 1.00 0.00 C ATOM 1215 CD PRO A 77 0.210 -16.541 6.296 1.00 0.00 C ATOM 0 HA PRO A 77 2.755 -18.130 4.817 1.00 0.00 H new ATOM 0 HB2 PRO A 77 3.119 -15.438 5.176 1.00 0.00 H new ATOM 0 HB3 PRO A 77 1.995 -15.891 3.911 1.00 0.00 H new ATOM 0 HG2 PRO A 77 1.425 -14.778 6.614 1.00 0.00 H new ATOM 0 HG3 PRO A 77 0.441 -14.709 5.166 1.00 0.00 H new ATOM 0 HD2 PRO A 77 0.290 -16.663 7.376 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -0.849 -16.424 6.066 1.00 0.00 H new ATOM 1223 N LYS A 78 3.280 -18.756 7.185 1.00 0.00 N ATOM 1224 CA LYS A 78 4.032 -19.014 8.414 1.00 0.00 C ATOM 1225 C LYS A 78 3.505 -18.160 9.580 1.00 0.00 C ATOM 1226 O LYS A 78 2.457 -17.525 9.475 1.00 0.00 O ATOM 1227 CB LYS A 78 5.523 -18.765 8.211 1.00 0.00 C ATOM 1228 CG LYS A 78 5.895 -17.301 8.018 1.00 0.00 C ATOM 1229 CD LYS A 78 7.341 -17.146 7.588 1.00 0.00 C ATOM 1230 CE LYS A 78 7.786 -15.694 7.636 1.00 0.00 C ATOM 1231 NZ LYS A 78 7.029 -14.851 6.668 1.00 0.00 N ATOM 0 H LYS A 78 2.978 -19.600 6.698 1.00 0.00 H new ATOM 0 HA LYS A 78 3.890 -20.065 8.666 1.00 0.00 H new ATOM 0 HB2 LYS A 78 6.065 -19.154 9.073 1.00 0.00 H new ATOM 0 HB3 LYS A 78 5.858 -19.330 7.342 1.00 0.00 H new ATOM 0 HG2 LYS A 78 5.242 -16.854 7.268 1.00 0.00 H new ATOM 0 HG3 LYS A 78 5.731 -16.757 8.948 1.00 0.00 H new ATOM 0 HD2 LYS A 78 7.980 -17.745 8.237 1.00 0.00 H new ATOM 0 HD3 LYS A 78 7.464 -17.532 6.576 1.00 0.00 H new ATOM 0 HE2 LYS A 78 7.646 -15.304 8.644 1.00 0.00 H new ATOM 0 HE3 LYS A 78 8.852 -15.633 7.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 7.396 -13.878 6.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 7.141 -15.238 5.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 6.021 -14.848 6.924 1.00 0.00 H new ATOM 1245 N ARG A 79 4.240 -18.170 10.692 1.00 0.00 N ATOM 1246 CA ARG A 79 3.850 -17.393 11.864 1.00 0.00 C ATOM 1247 C ARG A 79 3.818 -15.903 11.547 1.00 0.00 C ATOM 1248 O ARG A 79 2.925 -15.180 11.987 1.00 0.00 O ATOM 1249 CB ARG A 79 4.811 -17.662 13.026 1.00 0.00 C ATOM 1250 CG ARG A 79 4.692 -19.059 13.608 1.00 0.00 C ATOM 1251 CD ARG A 79 5.671 -19.272 14.751 1.00 0.00 C ATOM 1252 NE ARG A 79 5.402 -18.373 15.875 1.00 0.00 N ATOM 1253 CZ ARG A 79 5.945 -18.512 17.085 1.00 0.00 C ATOM 1254 NH1 ARG A 79 6.786 -19.509 17.334 1.00 0.00 N ATOM 1255 NH2 ARG A 79 5.646 -17.649 18.046 1.00 0.00 N ATOM 0 H ARG A 79 5.102 -18.704 10.804 1.00 0.00 H new ATOM 0 HA ARG A 79 2.846 -17.703 12.154 1.00 0.00 H new ATOM 0 HB2 ARG A 79 5.834 -17.507 12.683 1.00 0.00 H new ATOM 0 HB3 ARG A 79 4.626 -16.933 13.815 1.00 0.00 H new ATOM 0 HG2 ARG A 79 3.675 -19.220 13.964 1.00 0.00 H new ATOM 0 HG3 ARG A 79 4.877 -19.797 12.827 1.00 0.00 H new ATOM 0 HD2 ARG A 79 5.613 -20.306 15.091 1.00 0.00 H new ATOM 0 HD3 ARG A 79 6.688 -19.111 14.393 1.00 0.00 H new ATOM 0 HE ARG A 79 4.761 -17.594 15.723 1.00 0.00 H new ATOM 0 HH11 ARG A 79 7.020 -20.175 16.597 1.00 0.00 H new ATOM 0 HH12 ARG A 79 7.198 -19.609 18.262 1.00 0.00 H new ATOM 0 HH21 ARG A 79 5.002 -16.881 17.859 1.00 0.00 H new ATOM 0 HH22 ARG A 79 6.060 -17.753 18.972 1.00 0.00 H new ATOM 1269 N GLY A 80 4.799 -15.452 10.768 1.00 0.00 N ATOM 1270 CA GLY A 80 4.870 -14.051 10.396 1.00 0.00 C ATOM 1271 C GLY A 80 5.499 -13.188 11.471 1.00 0.00 C ATOM 1272 O GLY A 80 5.722 -13.644 12.592 1.00 0.00 O ATOM 0 H GLY A 80 5.546 -16.034 10.388 1.00 0.00 H new ATOM 0 HA2 GLY A 80 5.445 -13.953 9.475 1.00 0.00 H new ATOM 0 HA3 GLY A 80 3.865 -13.685 10.184 1.00 0.00 H new ATOM 1276 N GLU A 81 5.782 -11.936 11.127 1.00 0.00 N ATOM 1277 CA GLU A 81 6.385 -10.997 12.066 1.00 0.00 C ATOM 1278 C GLU A 81 5.429 -9.849 12.371 1.00 0.00 C ATOM 1279 O GLU A 81 4.646 -9.440 11.514 1.00 0.00 O ATOM 1280 CB GLU A 81 7.700 -10.453 11.505 1.00 0.00 C ATOM 1281 CG GLU A 81 8.812 -11.488 11.453 1.00 0.00 C ATOM 1282 CD GLU A 81 10.106 -10.928 10.894 1.00 0.00 C ATOM 1283 OE1 GLU A 81 11.004 -10.596 11.695 1.00 0.00 O ATOM 1284 OE2 GLU A 81 10.219 -10.824 9.656 1.00 0.00 O ATOM 0 H GLU A 81 5.603 -11.547 10.201 1.00 0.00 H new ATOM 0 HA GLU A 81 6.592 -11.529 12.994 1.00 0.00 H new ATOM 0 HB2 GLU A 81 7.525 -10.068 10.500 1.00 0.00 H new ATOM 0 HB3 GLU A 81 8.026 -9.612 12.116 1.00 0.00 H new ATOM 0 HG2 GLU A 81 8.991 -11.874 12.457 1.00 0.00 H new ATOM 0 HG3 GLU A 81 8.491 -12.330 10.840 1.00 0.00 H new ATOM 1292 N GLY A 82 5.498 -9.333 13.595 1.00 0.00 N ATOM 1293 CA GLY A 82 4.627 -8.238 13.986 1.00 0.00 C ATOM 1294 C GLY A 82 4.927 -6.961 13.225 1.00 0.00 C ATOM 1295 O GLY A 82 5.572 -6.054 13.751 1.00 0.00 O ATOM 0 H GLY A 82 6.139 -9.652 14.321 1.00 0.00 H new ATOM 0 HA2 GLY A 82 3.589 -8.524 13.815 1.00 0.00 H new ATOM 0 HA3 GLY A 82 4.736 -8.055 15.055 1.00 0.00 H new ATOM 1299 N ILE A 83 4.460 -6.891 11.984 1.00 0.00 N ATOM 1300 CA ILE A 83 4.679 -5.718 11.147 1.00 0.00 C ATOM 1301 C ILE A 83 3.446 -4.823 11.102 1.00 0.00 C ATOM 1302 O ILE A 83 2.345 -5.281 10.794 1.00 0.00 O ATOM 1303 CB ILE A 83 5.071 -6.118 9.711 1.00 0.00 C ATOM 1304 CG1 ILE A 83 3.962 -6.954 9.065 1.00 0.00 C ATOM 1305 CG2 ILE A 83 6.385 -6.883 9.713 1.00 0.00 C ATOM 1306 CD1 ILE A 83 4.162 -7.179 7.583 1.00 0.00 C ATOM 0 H ILE A 83 3.926 -7.635 11.534 1.00 0.00 H new ATOM 0 HA ILE A 83 5.501 -5.162 11.598 1.00 0.00 H new ATOM 0 HB ILE A 83 5.202 -5.210 9.123 1.00 0.00 H new ATOM 0 HG12 ILE A 83 3.907 -7.920 9.567 1.00 0.00 H new ATOM 0 HG13 ILE A 83 3.005 -6.457 9.223 1.00 0.00 H new ATOM 0 HG21 ILE A 83 6.647 -7.158 8.691 1.00 0.00 H new ATOM 0 HG22 ILE A 83 7.171 -6.255 10.133 1.00 0.00 H new ATOM 0 HG23 ILE A 83 6.280 -7.785 10.316 1.00 0.00 H new ATOM 0 HD11 ILE A 83 3.340 -7.778 7.192 1.00 0.00 H new ATOM 0 HD12 ILE A 83 4.187 -6.218 7.069 1.00 0.00 H new ATOM 0 HD13 ILE A 83 5.103 -7.703 7.418 1.00 0.00 H new ATOM 1318 N ASN A 84 3.638 -3.542 11.401 1.00 0.00 N ATOM 1319 CA ASN A 84 2.545 -2.580 11.386 1.00 0.00 C ATOM 1320 C ASN A 84 2.361 -2.000 9.988 1.00 0.00 C ATOM 1321 O ASN A 84 3.335 -1.718 9.290 1.00 0.00 O ATOM 1322 CB ASN A 84 2.811 -1.454 12.387 1.00 0.00 C ATOM 1323 CG ASN A 84 2.946 -1.963 13.808 1.00 0.00 C ATOM 1324 OD1 ASN A 84 2.105 -2.720 14.292 1.00 0.00 O ATOM 1325 ND2 ASN A 84 4.011 -1.549 14.485 1.00 0.00 N ATOM 0 H ASN A 84 4.543 -3.147 11.657 1.00 0.00 H new ATOM 0 HA ASN A 84 1.630 -3.099 11.673 1.00 0.00 H new ATOM 0 HB2 ASN A 84 3.723 -0.928 12.104 1.00 0.00 H new ATOM 0 HB3 ASN A 84 1.998 -0.730 12.339 1.00 0.00 H new ATOM 0 HD21 ASN A 84 4.157 -1.859 15.446 1.00 0.00 H new ATOM 0 HD22 ASN A 84 4.683 -0.921 14.044 1.00 0.00 H new ATOM 1332 N VAL A 85 1.107 -1.826 9.581 1.00 0.00 N ATOM 1333 CA VAL A 85 0.806 -1.282 8.263 1.00 0.00 C ATOM 1334 C VAL A 85 0.339 0.172 8.355 1.00 0.00 C ATOM 1335 O VAL A 85 -0.491 0.624 7.567 1.00 0.00 O ATOM 1336 CB VAL A 85 -0.258 -2.134 7.534 1.00 0.00 C ATOM 1337 CG1 VAL A 85 -1.590 -2.095 8.270 1.00 0.00 C ATOM 1338 CG2 VAL A 85 -0.420 -1.673 6.093 1.00 0.00 C ATOM 0 H VAL A 85 0.287 -2.053 10.143 1.00 0.00 H new ATOM 0 HA VAL A 85 1.729 -1.312 7.685 1.00 0.00 H new ATOM 0 HB VAL A 85 0.087 -3.168 7.525 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -2.319 -2.703 7.735 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -1.460 -2.488 9.278 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -1.945 -1.066 8.325 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -1.173 -2.285 5.598 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -0.734 -0.629 6.078 1.00 0.00 H new ATOM 0 HG23 VAL A 85 0.531 -1.774 5.570 1.00 0.00 H new ATOM 1348 N ARG A 86 0.885 0.901 9.325 1.00 0.00 N ATOM 1349 CA ARG A 86 0.542 2.305 9.513 1.00 0.00 C ATOM 1350 C ARG A 86 1.273 3.178 8.496 1.00 0.00 C ATOM 1351 O ARG A 86 2.116 4.002 8.853 1.00 0.00 O ATOM 1352 CB ARG A 86 0.880 2.750 10.939 1.00 0.00 C ATOM 1353 CG ARG A 86 -0.013 2.127 11.999 1.00 0.00 C ATOM 1354 CD ARG A 86 0.367 2.598 13.393 1.00 0.00 C ATOM 1355 NE ARG A 86 1.742 2.241 13.737 1.00 0.00 N ATOM 1356 CZ ARG A 86 2.295 2.471 14.928 1.00 0.00 C ATOM 1357 NH1 ARG A 86 1.598 3.056 15.894 1.00 0.00 N ATOM 1358 NH2 ARG A 86 3.552 2.110 15.153 1.00 0.00 N ATOM 0 H ARG A 86 1.567 0.541 9.993 1.00 0.00 H new ATOM 0 HA ARG A 86 -0.531 2.421 9.357 1.00 0.00 H new ATOM 0 HB2 ARG A 86 1.918 2.494 11.154 1.00 0.00 H new ATOM 0 HB3 ARG A 86 0.800 3.835 11.001 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -1.053 2.384 11.798 1.00 0.00 H new ATOM 0 HG3 ARG A 86 0.062 1.041 11.947 1.00 0.00 H new ATOM 0 HD2 ARG A 86 0.247 3.680 13.455 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -0.314 2.159 14.122 1.00 0.00 H new ATOM 0 HE ARG A 86 2.313 1.789 13.023 1.00 0.00 H new ATOM 0 HH11 ARG A 86 0.631 3.334 15.728 1.00 0.00 H new ATOM 0 HH12 ARG A 86 2.030 3.228 16.802 1.00 0.00 H new ATOM 0 HH21 ARG A 86 4.093 1.658 14.416 1.00 0.00 H new ATOM 0 HH22 ARG A 86 3.978 2.285 16.063 1.00 0.00 H new ATOM 1372 N ALA A 87 0.955 2.974 7.222 1.00 0.00 N ATOM 1373 CA ALA A 87 1.587 3.726 6.143 1.00 0.00 C ATOM 1374 C ALA A 87 0.553 4.231 5.143 1.00 0.00 C ATOM 1375 O ALA A 87 -0.603 3.810 5.165 1.00 0.00 O ATOM 1376 CB ALA A 87 2.624 2.864 5.441 1.00 0.00 C ATOM 0 H ALA A 87 0.262 2.293 6.911 1.00 0.00 H new ATOM 0 HA ALA A 87 2.083 4.593 6.580 1.00 0.00 H new ATOM 0 HB1 ALA A 87 3.089 3.436 4.638 1.00 0.00 H new ATOM 0 HB2 ALA A 87 3.387 2.557 6.157 1.00 0.00 H new ATOM 0 HB3 ALA A 87 2.141 1.980 5.025 1.00 0.00 H new ATOM 1382 N ARG A 88 0.976 5.138 4.269 1.00 0.00 N ATOM 1383 CA ARG A 88 0.083 5.700 3.264 1.00 0.00 C ATOM 1384 C ARG A 88 0.296 5.021 1.915 1.00 0.00 C ATOM 1385 O ARG A 88 1.396 5.039 1.363 1.00 0.00 O ATOM 1386 CB ARG A 88 0.323 7.206 3.123 1.00 0.00 C ATOM 1387 CG ARG A 88 -0.134 8.010 4.329 1.00 0.00 C ATOM 1388 CD ARG A 88 0.126 9.495 4.136 1.00 0.00 C ATOM 1389 NE ARG A 88 1.547 9.782 3.948 1.00 0.00 N ATOM 1390 CZ ARG A 88 2.170 9.715 2.769 1.00 0.00 C ATOM 1391 NH1 ARG A 88 1.502 9.371 1.675 1.00 0.00 N ATOM 1392 NH2 ARG A 88 3.464 9.992 2.689 1.00 0.00 N ATOM 0 H ARG A 88 1.930 5.499 4.237 1.00 0.00 H new ATOM 0 HA ARG A 88 -0.943 5.528 3.588 1.00 0.00 H new ATOM 0 HB2 ARG A 88 1.386 7.382 2.961 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -0.199 7.567 2.237 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -1.198 7.844 4.497 1.00 0.00 H new ATOM 0 HG3 ARG A 88 0.387 7.661 5.220 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -0.433 9.852 3.271 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -0.243 10.043 5.003 1.00 0.00 H new ATOM 0 HE ARG A 88 2.095 10.049 4.766 1.00 0.00 H new ATOM 0 HH11 ARG A 88 0.507 9.156 1.732 1.00 0.00 H new ATOM 0 HH12 ARG A 88 1.984 9.322 0.777 1.00 0.00 H new ATOM 0 HH21 ARG A 88 3.982 10.256 3.527 1.00 0.00 H new ATOM 0 HH22 ARG A 88 3.942 9.941 1.789 1.00 0.00 H new ATOM 1406 N ILE A 89 -0.764 4.409 1.399 1.00 0.00 N ATOM 1407 CA ILE A 89 -0.698 3.719 0.119 1.00 0.00 C ATOM 1408 C ILE A 89 -1.490 4.474 -0.946 1.00 0.00 C ATOM 1409 O ILE A 89 -2.651 4.826 -0.739 1.00 0.00 O ATOM 1410 CB ILE A 89 -1.239 2.272 0.247 1.00 0.00 C ATOM 1411 CG1 ILE A 89 -0.412 1.490 1.268 1.00 0.00 C ATOM 1412 CG2 ILE A 89 -1.222 1.554 -1.099 1.00 0.00 C ATOM 1413 CD1 ILE A 89 -1.012 0.150 1.634 1.00 0.00 C ATOM 0 H ILE A 89 -1.679 4.377 1.849 1.00 0.00 H new ATOM 0 HA ILE A 89 0.348 3.679 -0.184 1.00 0.00 H new ATOM 0 HB ILE A 89 -2.273 2.328 0.588 1.00 0.00 H new ATOM 0 HG12 ILE A 89 0.590 1.333 0.868 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -0.304 2.090 2.172 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -1.607 0.542 -0.976 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -1.847 2.096 -1.809 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -0.200 1.510 -1.475 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -0.372 -0.348 2.362 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -2.002 0.300 2.064 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -1.094 -0.468 0.740 1.00 0.00 H new ATOM 1425 N THR A 90 -0.855 4.710 -2.090 1.00 0.00 N ATOM 1426 CA THR A 90 -1.501 5.411 -3.192 1.00 0.00 C ATOM 1427 C THR A 90 -1.660 4.480 -4.389 1.00 0.00 C ATOM 1428 O THR A 90 -0.678 3.952 -4.909 1.00 0.00 O ATOM 1429 CB THR A 90 -0.687 6.643 -3.588 1.00 0.00 C ATOM 1430 OG1 THR A 90 -0.525 7.514 -2.482 1.00 0.00 O ATOM 1431 CG2 THR A 90 -1.316 7.442 -4.711 1.00 0.00 C ATOM 0 H THR A 90 0.107 4.426 -2.277 1.00 0.00 H new ATOM 0 HA THR A 90 -2.489 5.735 -2.866 1.00 0.00 H new ATOM 0 HB THR A 90 0.272 6.256 -3.931 1.00 0.00 H new ATOM 0 HG1 THR A 90 -0.143 8.363 -2.788 1.00 0.00 H new ATOM 0 HG21 THR A 90 -0.687 8.302 -4.942 1.00 0.00 H new ATOM 0 HG22 THR A 90 -1.410 6.813 -5.596 1.00 0.00 H new ATOM 0 HG23 THR A 90 -2.303 7.787 -4.404 1.00 0.00 H new ATOM 1439 N CYS A 91 -2.901 4.277 -4.817 1.00 0.00 N ATOM 1440 CA CYS A 91 -3.178 3.401 -5.951 1.00 0.00 C ATOM 1441 C CYS A 91 -3.909 4.142 -7.060 1.00 0.00 C ATOM 1442 O CYS A 91 -4.794 4.958 -6.802 1.00 0.00 O ATOM 1443 CB CYS A 91 -4.002 2.193 -5.505 1.00 0.00 C ATOM 1444 SG CYS A 91 -3.196 1.171 -4.250 1.00 0.00 S ATOM 0 H CYS A 91 -3.728 4.704 -4.399 1.00 0.00 H new ATOM 0 HA CYS A 91 -2.220 3.058 -6.343 1.00 0.00 H new ATOM 0 HB2 CYS A 91 -4.957 2.543 -5.114 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -4.221 1.575 -6.376 1.00 0.00 H new ATOM 0 HG CYS A 91 -3.972 0.176 -3.936 1.00 0.00 H new ATOM 1450 N PHE A 92 -3.528 3.851 -8.299 1.00 0.00 N ATOM 1451 CA PHE A 92 -4.141 4.486 -9.461 1.00 0.00 C ATOM 1452 C PHE A 92 -5.200 3.576 -10.089 1.00 0.00 C ATOM 1453 O PHE A 92 -5.304 2.401 -9.742 1.00 0.00 O ATOM 1454 CB PHE A 92 -3.064 4.834 -10.492 1.00 0.00 C ATOM 1455 CG PHE A 92 -2.402 3.631 -11.100 1.00 0.00 C ATOM 1456 CD1 PHE A 92 -1.519 2.861 -10.358 1.00 0.00 C ATOM 1457 CD2 PHE A 92 -2.658 3.274 -12.413 1.00 0.00 C ATOM 1458 CE1 PHE A 92 -0.905 1.757 -10.917 1.00 0.00 C ATOM 1459 CE2 PHE A 92 -2.048 2.170 -12.977 1.00 0.00 C ATOM 1460 CZ PHE A 92 -1.171 1.410 -12.229 1.00 0.00 C ATOM 0 H PHE A 92 -2.796 3.178 -8.525 1.00 0.00 H new ATOM 0 HA PHE A 92 -4.634 5.401 -9.133 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -3.512 5.431 -11.286 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -2.305 5.455 -10.016 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -1.309 3.127 -9.333 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -3.342 3.865 -13.003 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -0.218 1.165 -10.330 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -2.257 1.902 -14.002 1.00 0.00 H new ATOM 0 HZ PHE A 92 -0.694 0.546 -12.668 1.00 0.00 H new ATOM 1470 N ASN A 93 -5.984 4.134 -11.008 1.00 0.00 N ATOM 1471 CA ASN A 93 -7.033 3.369 -11.679 1.00 0.00 C ATOM 1472 C ASN A 93 -8.056 2.836 -10.678 1.00 0.00 C ATOM 1473 O ASN A 93 -8.421 1.658 -10.709 1.00 0.00 O ATOM 1474 CB ASN A 93 -6.425 2.215 -12.479 1.00 0.00 C ATOM 1475 CG ASN A 93 -5.652 2.691 -13.694 1.00 0.00 C ATOM 1476 OD1 ASN A 93 -4.588 2.159 -14.015 1.00 0.00 O ATOM 1477 ND2 ASN A 93 -6.182 3.698 -14.379 1.00 0.00 N ATOM 0 H ASN A 93 -5.914 5.108 -11.304 1.00 0.00 H new ATOM 0 HA ASN A 93 -7.549 4.041 -12.365 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -5.761 1.640 -11.833 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -7.220 1.542 -12.800 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -5.706 4.059 -15.205 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -7.065 4.110 -14.079 1.00 0.00 H new ATOM 1484 N CYS A 94 -8.509 3.703 -9.782 1.00 0.00 N ATOM 1485 CA CYS A 94 -9.487 3.335 -8.767 1.00 0.00 C ATOM 1486 C CYS A 94 -10.783 2.843 -9.411 1.00 0.00 C ATOM 1487 O CYS A 94 -11.393 1.904 -8.934 1.00 0.00 O ATOM 1488 CB CYS A 94 -9.777 4.516 -7.846 1.00 0.00 C ATOM 1489 SG CYS A 94 -8.404 4.952 -6.753 1.00 0.00 S ATOM 0 H CYS A 94 -8.210 4.677 -9.738 1.00 0.00 H new ATOM 0 HA CYS A 94 -9.065 2.523 -8.175 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -10.033 5.383 -8.454 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -10.652 4.283 -7.239 1.00 0.00 H new ATOM 0 HG CYS A 94 -8.767 4.790 -5.515 1.00 0.00 H new ATOM 1495 N TYR A 95 -11.175 3.519 -10.495 1.00 0.00 N ATOM 1496 CA TYR A 95 -12.390 3.209 -11.263 1.00 0.00 C ATOM 1497 C TYR A 95 -12.310 1.877 -12.016 1.00 0.00 C ATOM 1498 O TYR A 95 -11.806 1.835 -13.136 1.00 0.00 O ATOM 1499 CB TYR A 95 -12.664 4.332 -12.264 1.00 0.00 C ATOM 1500 CG TYR A 95 -14.004 5.003 -12.071 1.00 0.00 C ATOM 1501 CD1 TYR A 95 -15.185 4.344 -12.375 1.00 0.00 C ATOM 1502 CD2 TYR A 95 -14.079 6.300 -11.584 1.00 0.00 C ATOM 1503 CE1 TYR A 95 -16.409 4.962 -12.205 1.00 0.00 C ATOM 1504 CE2 TYR A 95 -15.297 6.923 -11.407 1.00 0.00 C ATOM 1505 CZ TYR A 95 -16.460 6.251 -11.721 1.00 0.00 C ATOM 1506 OH TYR A 95 -17.675 6.871 -11.548 1.00 0.00 O ATOM 0 H TYR A 95 -10.651 4.309 -10.871 1.00 0.00 H new ATOM 0 HA TYR A 95 -13.201 3.121 -10.540 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -11.877 5.081 -12.181 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -12.613 3.927 -13.275 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -15.148 3.332 -12.750 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -13.170 6.830 -11.340 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -17.321 4.438 -12.450 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -15.340 7.932 -11.024 1.00 0.00 H new ATOM 0 HH TYR A 95 -18.281 6.611 -12.273 1.00 0.00 H new ATOM 1766 N GLN A 111 -18.750 10.381 -13.410 1.00 0.00 N ATOM 1767 CA GLN A 111 -20.164 10.037 -13.393 1.00 0.00 C ATOM 1768 C GLN A 111 -20.563 9.364 -12.079 1.00 0.00 C ATOM 1769 O GLN A 111 -21.655 9.599 -11.561 1.00 0.00 O ATOM 1770 CB GLN A 111 -20.486 9.103 -14.571 1.00 0.00 C ATOM 1771 CG GLN A 111 -19.851 7.724 -14.461 1.00 0.00 C ATOM 1772 CD GLN A 111 -20.023 6.899 -15.723 1.00 0.00 C ATOM 1773 OE1 GLN A 111 -19.916 7.416 -16.836 1.00 0.00 O ATOM 1774 NE2 GLN A 111 -20.295 5.609 -15.555 1.00 0.00 N ATOM 0 HA GLN A 111 -20.735 10.961 -13.486 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -21.567 8.989 -14.645 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -20.151 9.573 -15.496 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -18.788 7.834 -14.245 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -20.293 7.191 -13.620 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -20.375 5.223 -14.614 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -20.424 5.005 -16.367 1.00 0.00 H new ATOM 1783 N LEU A 112 -19.675 8.533 -11.540 1.00 0.00 N ATOM 1784 CA LEU A 112 -19.957 7.821 -10.299 1.00 0.00 C ATOM 1785 C LEU A 112 -18.812 7.957 -9.292 1.00 0.00 C ATOM 1786 O LEU A 112 -18.651 7.113 -8.413 1.00 0.00 O ATOM 1787 CB LEU A 112 -20.196 6.343 -10.598 1.00 0.00 C ATOM 1788 CG LEU A 112 -20.651 5.499 -9.410 1.00 0.00 C ATOM 1789 CD1 LEU A 112 -22.142 5.677 -9.178 1.00 0.00 C ATOM 1790 CD2 LEU A 112 -20.308 4.037 -9.639 1.00 0.00 C ATOM 0 H LEU A 112 -18.758 8.337 -11.942 1.00 0.00 H new ATOM 0 HA LEU A 112 -20.849 8.265 -9.857 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -20.946 6.266 -11.385 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -19.274 5.916 -10.993 1.00 0.00 H new ATOM 0 HG LEU A 112 -20.125 5.836 -8.517 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -22.453 5.070 -8.328 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -22.356 6.726 -8.972 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -22.689 5.363 -10.067 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -20.638 3.447 -8.784 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -20.809 3.682 -10.540 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -19.230 3.931 -9.758 1.00 0.00 H new ATOM 1802 N VAL A 113 -18.022 9.018 -9.415 1.00 0.00 N ATOM 1803 CA VAL A 113 -16.892 9.229 -8.511 1.00 0.00 C ATOM 1804 C VAL A 113 -17.375 9.381 -7.064 1.00 0.00 C ATOM 1805 O VAL A 113 -16.765 8.837 -6.140 1.00 0.00 O ATOM 1806 CB VAL A 113 -16.074 10.477 -8.932 1.00 0.00 C ATOM 1807 CG1 VAL A 113 -15.008 10.839 -7.901 1.00 0.00 C ATOM 1808 CG2 VAL A 113 -15.435 10.245 -10.290 1.00 0.00 C ATOM 0 H VAL A 113 -18.140 9.741 -10.125 1.00 0.00 H new ATOM 0 HA VAL A 113 -16.246 8.353 -8.573 1.00 0.00 H new ATOM 0 HB VAL A 113 -16.764 11.318 -8.994 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -14.460 11.719 -8.238 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -15.485 11.053 -6.944 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -14.317 10.004 -7.784 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -14.862 11.127 -10.578 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -14.771 9.382 -10.237 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -16.213 10.059 -11.031 1.00 0.00 H new ATOM 1818 N LYS A 114 -18.461 10.120 -6.868 1.00 0.00 N ATOM 1819 CA LYS A 114 -19.005 10.344 -5.533 1.00 0.00 C ATOM 1820 C LYS A 114 -19.429 9.031 -4.873 1.00 0.00 C ATOM 1821 O LYS A 114 -19.226 8.834 -3.675 1.00 0.00 O ATOM 1822 CB LYS A 114 -20.196 11.296 -5.598 1.00 0.00 C ATOM 1823 CG LYS A 114 -19.813 12.726 -5.938 1.00 0.00 C ATOM 1824 CD LYS A 114 -21.033 13.629 -5.991 1.00 0.00 C ATOM 1825 CE LYS A 114 -21.616 13.854 -4.607 1.00 0.00 C ATOM 1826 NZ LYS A 114 -22.752 14.815 -4.630 1.00 0.00 N ATOM 0 H LYS A 114 -18.983 10.575 -7.617 1.00 0.00 H new ATOM 0 HA LYS A 114 -18.217 10.791 -4.927 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -20.902 10.931 -6.344 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -20.712 11.285 -4.638 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -19.111 13.103 -5.194 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -19.300 12.748 -6.900 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -20.759 14.587 -6.432 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -21.789 13.184 -6.638 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -21.954 12.902 -4.197 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -20.838 14.229 -3.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -23.121 14.940 -3.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -22.424 15.731 -4.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -23.506 14.446 -5.244 1.00 0.00 H new ATOM 1840 N ARG A 115 -20.044 8.149 -5.654 1.00 0.00 N ATOM 1841 CA ARG A 115 -20.503 6.865 -5.133 1.00 0.00 C ATOM 1842 C ARG A 115 -19.338 5.988 -4.692 1.00 0.00 C ATOM 1843 O ARG A 115 -19.409 5.319 -3.661 1.00 0.00 O ATOM 1844 CB ARG A 115 -21.343 6.141 -6.187 1.00 0.00 C ATOM 1845 CG ARG A 115 -22.681 6.807 -6.464 1.00 0.00 C ATOM 1846 CD ARG A 115 -23.672 6.573 -5.336 1.00 0.00 C ATOM 1847 NE ARG A 115 -24.960 7.212 -5.601 1.00 0.00 N ATOM 1848 CZ ARG A 115 -26.067 6.981 -4.895 1.00 0.00 C ATOM 1849 NH1 ARG A 115 -26.049 6.130 -3.877 1.00 0.00 N ATOM 1850 NH2 ARG A 115 -27.194 7.604 -5.210 1.00 0.00 N ATOM 0 H ARG A 115 -20.236 8.298 -6.645 1.00 0.00 H new ATOM 0 HA ARG A 115 -21.118 7.061 -4.255 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -20.775 6.085 -7.116 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -21.518 5.116 -5.859 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -22.532 7.878 -6.601 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -23.093 6.421 -7.396 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -23.820 5.502 -5.199 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -23.260 6.960 -4.404 1.00 0.00 H new ATOM 0 HE ARG A 115 -25.015 7.876 -6.374 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -25.185 5.648 -3.630 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -26.900 5.958 -3.341 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -27.213 8.259 -5.992 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -28.042 7.428 -4.671 1.00 0.00 H new ATOM 1864 N HIS A 116 -18.264 5.991 -5.476 1.00 0.00 N ATOM 1865 CA HIS A 116 -17.084 5.193 -5.158 1.00 0.00 C ATOM 1866 C HIS A 116 -16.451 5.637 -3.843 1.00 0.00 C ATOM 1867 O HIS A 116 -16.021 4.812 -3.040 1.00 0.00 O ATOM 1868 CB HIS A 116 -16.055 5.283 -6.286 1.00 0.00 C ATOM 1869 CG HIS A 116 -16.471 4.579 -7.539 1.00 0.00 C ATOM 1870 ND1 HIS A 116 -16.551 3.205 -7.637 1.00 0.00 N ATOM 1871 CD2 HIS A 116 -16.825 5.060 -8.754 1.00 0.00 C ATOM 1872 CE1 HIS A 116 -16.934 2.874 -8.857 1.00 0.00 C ATOM 1873 NE2 HIS A 116 -17.108 3.982 -9.554 1.00 0.00 N ATOM 0 H HIS A 116 -18.186 6.536 -6.335 1.00 0.00 H new ATOM 0 HA HIS A 116 -17.407 4.157 -5.050 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -15.870 6.333 -6.514 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -15.112 4.861 -5.939 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -16.875 6.100 -9.041 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -17.080 1.868 -9.222 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -17.405 4.029 -10.529 1.00 0.00 H new ATOM 1882 N ILE A 117 -16.405 6.948 -3.625 1.00 0.00 N ATOM 1883 CA ILE A 117 -15.819 7.504 -2.412 1.00 0.00 C ATOM 1884 C ILE A 117 -16.702 7.217 -1.193 1.00 0.00 C ATOM 1885 O ILE A 117 -16.212 7.142 -0.064 1.00 0.00 O ATOM 1886 CB ILE A 117 -15.565 9.023 -2.539 1.00 0.00 C ATOM 1887 CG1 ILE A 117 -14.709 9.508 -1.372 1.00 0.00 C ATOM 1888 CG2 ILE A 117 -16.866 9.808 -2.609 1.00 0.00 C ATOM 1889 CD1 ILE A 117 -13.283 9.012 -1.430 1.00 0.00 C ATOM 0 H ILE A 117 -16.768 7.646 -4.275 1.00 0.00 H new ATOM 0 HA ILE A 117 -14.856 7.014 -2.271 1.00 0.00 H new ATOM 0 HB ILE A 117 -15.030 9.197 -3.473 1.00 0.00 H new ATOM 0 HG12 ILE A 117 -14.707 10.598 -1.360 1.00 0.00 H new ATOM 0 HG13 ILE A 117 -15.163 9.180 -0.437 1.00 0.00 H new ATOM 0 HG21 ILE A 117 -16.645 10.872 -2.698 1.00 0.00 H new ATOM 0 HG22 ILE A 117 -17.441 9.483 -3.476 1.00 0.00 H new ATOM 0 HG23 ILE A 117 -17.446 9.632 -1.703 1.00 0.00 H new ATOM 0 HD11 ILE A 117 -12.730 9.393 -0.572 1.00 0.00 H new ATOM 0 HD12 ILE A 117 -13.276 7.922 -1.411 1.00 0.00 H new ATOM 0 HD13 ILE A 117 -12.813 9.362 -2.349 1.00 0.00 H new ATOM 1901 N GLU A 118 -18.002 7.097 -1.425 1.00 0.00 N ATOM 1902 CA GLU A 118 -18.960 6.830 -0.352 1.00 0.00 C ATOM 1903 C GLU A 118 -18.638 5.537 0.380 1.00 0.00 C ATOM 1904 O GLU A 118 -18.783 5.449 1.600 1.00 0.00 O ATOM 1905 CB GLU A 118 -20.379 6.781 -0.909 1.00 0.00 C ATOM 1906 CG GLU A 118 -20.897 8.121 -1.397 1.00 0.00 C ATOM 1907 CD GLU A 118 -22.306 8.035 -1.948 1.00 0.00 C ATOM 1908 OE1 GLU A 118 -22.454 7.696 -3.141 1.00 0.00 O ATOM 1909 OE2 GLU A 118 -23.260 8.302 -1.188 1.00 0.00 O ATOM 0 H GLU A 118 -18.423 7.180 -2.351 1.00 0.00 H new ATOM 0 HA GLU A 118 -18.886 7.646 0.367 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -20.410 6.069 -1.734 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -21.049 6.404 -0.136 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -20.875 8.836 -0.575 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -20.231 8.504 -2.170 1.00 0.00 H new ATOM 1917 N ARG A 119 -18.224 4.515 -0.367 1.00 0.00 N ATOM 1918 CA ARG A 119 -17.886 3.231 0.233 1.00 0.00 C ATOM 1919 C ARG A 119 -16.736 3.380 1.224 1.00 0.00 C ATOM 1920 O ARG A 119 -16.745 2.782 2.301 1.00 0.00 O ATOM 1921 CB ARG A 119 -17.540 2.205 -0.852 1.00 0.00 C ATOM 1922 CG ARG A 119 -16.238 2.495 -1.582 1.00 0.00 C ATOM 1923 CD ARG A 119 -15.952 1.445 -2.643 1.00 0.00 C ATOM 1924 NE ARG A 119 -15.832 0.104 -2.069 1.00 0.00 N ATOM 1925 CZ ARG A 119 -15.510 -0.979 -2.774 1.00 0.00 C ATOM 1926 NH1 ARG A 119 -15.273 -0.889 -4.077 1.00 0.00 N ATOM 1927 NH2 ARG A 119 -15.425 -2.158 -2.172 1.00 0.00 N ATOM 0 H ARG A 119 -18.116 4.552 -1.381 1.00 0.00 H new ATOM 0 HA ARG A 119 -18.757 2.870 0.780 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -17.477 1.217 -0.397 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -18.352 2.171 -1.578 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -16.291 3.479 -2.047 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -15.416 2.525 -0.866 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -16.751 1.452 -3.384 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -15.030 1.699 -3.166 1.00 0.00 H new ATOM 0 HE ARG A 119 -16.005 -0.008 -1.070 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -15.337 0.015 -4.546 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -15.027 -1.723 -4.609 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -15.606 -2.234 -1.171 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -15.179 -2.989 -2.710 1.00 0.00 H new ATOM 1941 N LEU A 120 -15.751 4.193 0.857 1.00 0.00 N ATOM 1942 CA LEU A 120 -14.592 4.440 1.711 1.00 0.00 C ATOM 1943 C LEU A 120 -15.035 5.082 3.025 1.00 0.00 C ATOM 1944 O LEU A 120 -14.525 4.753 4.096 1.00 0.00 O ATOM 1945 CB LEU A 120 -13.595 5.350 1.004 1.00 0.00 C ATOM 1946 CG LEU A 120 -13.040 4.795 -0.308 1.00 0.00 C ATOM 1947 CD1 LEU A 120 -12.062 5.775 -0.929 1.00 0.00 C ATOM 1948 CD2 LEU A 120 -12.378 3.445 -0.076 1.00 0.00 C ATOM 0 H LEU A 120 -15.731 4.695 -0.031 1.00 0.00 H new ATOM 0 HA LEU A 120 -14.109 3.486 1.923 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -14.077 6.307 0.803 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -12.763 5.548 1.679 1.00 0.00 H new ATOM 0 HG LEU A 120 -13.868 4.655 -1.003 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -11.677 5.363 -1.862 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -12.570 6.718 -1.131 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -11.235 5.949 -0.241 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -11.988 3.064 -1.020 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -11.560 3.558 0.635 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -13.111 2.744 0.323 1.00 0.00 H new ATOM 1960 N LYS A 121 -15.992 5.998 2.916 1.00 0.00 N ATOM 1961 CA LYS A 121 -16.522 6.702 4.079 1.00 0.00 C ATOM 1962 C LYS A 121 -17.164 5.730 5.063 1.00 0.00 C ATOM 1963 O LYS A 121 -17.068 5.906 6.278 1.00 0.00 O ATOM 1964 CB LYS A 121 -17.555 7.746 3.636 1.00 0.00 C ATOM 1965 CG LYS A 121 -16.941 8.928 2.901 1.00 0.00 C ATOM 1966 CD LYS A 121 -18.000 9.935 2.481 1.00 0.00 C ATOM 1967 CE LYS A 121 -17.384 11.112 1.739 1.00 0.00 C ATOM 1968 NZ LYS A 121 -17.590 12.399 2.463 1.00 0.00 N ATOM 0 H LYS A 121 -16.418 6.271 2.030 1.00 0.00 H new ATOM 0 HA LYS A 121 -15.692 7.201 4.579 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -18.290 7.267 2.989 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -18.091 8.111 4.512 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -16.208 9.416 3.543 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -16.406 8.572 2.020 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -18.736 9.446 1.843 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -18.531 10.296 3.362 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -16.316 10.938 1.606 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -17.822 11.182 0.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -17.155 13.174 1.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -18.609 12.579 2.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -17.150 12.342 3.404 1.00 0.00 H new ATOM 1982 N LYS A 122 -17.801 4.691 4.530 1.00 0.00 N ATOM 1983 CA LYS A 122 -18.471 3.688 5.355 1.00 0.00 C ATOM 1984 C LYS A 122 -17.462 2.900 6.206 1.00 0.00 C ATOM 1985 O LYS A 122 -17.834 1.930 6.865 1.00 0.00 O ATOM 1986 CB LYS A 122 -19.241 2.729 4.455 1.00 0.00 C ATOM 1987 CG LYS A 122 -20.324 3.419 3.642 1.00 0.00 C ATOM 1988 CD LYS A 122 -20.535 2.727 2.310 1.00 0.00 C ATOM 1989 CE LYS A 122 -21.748 3.279 1.582 1.00 0.00 C ATOM 1990 NZ LYS A 122 -21.631 4.742 1.336 1.00 0.00 N ATOM 0 H LYS A 122 -17.868 4.521 3.527 1.00 0.00 H new ATOM 0 HA LYS A 122 -19.156 4.200 6.031 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -18.544 2.236 3.777 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -19.695 1.950 5.067 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -21.258 3.423 4.205 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -20.049 4.460 3.474 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -19.648 2.853 1.689 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -20.662 1.656 2.471 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -21.868 2.760 0.631 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -22.645 3.080 2.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -22.224 5.257 2.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -20.640 5.035 1.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -21.948 4.958 0.369 1.00 0.00 H new ATOM 2004 N ASN A 123 -16.203 3.338 6.203 1.00 0.00 N ATOM 2005 CA ASN A 123 -15.137 2.696 6.977 1.00 0.00 C ATOM 2006 C ASN A 123 -15.180 1.170 6.882 1.00 0.00 C ATOM 2007 O ASN A 123 -15.658 0.494 7.800 1.00 0.00 O ATOM 2008 CB ASN A 123 -15.205 3.133 8.444 1.00 0.00 C ATOM 2009 CG ASN A 123 -16.521 2.774 9.106 1.00 0.00 C ATOM 2010 OD1 ASN A 123 -17.536 3.441 8.900 1.00 0.00 O ATOM 2011 ND2 ASN A 123 -16.510 1.719 9.915 1.00 0.00 N ATOM 0 H ASN A 123 -15.892 4.147 5.665 1.00 0.00 H new ATOM 0 HA ASN A 123 -14.191 3.020 6.543 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -14.388 2.667 8.995 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -15.056 4.211 8.504 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -17.365 1.434 10.393 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -15.647 1.194 10.057 1.00 0.00 H new ATOM 2018 N PRO A 124 -14.726 0.588 5.756 1.00 0.00 N ATOM 2019 CA PRO A 124 -14.752 -0.827 5.506 1.00 0.00 C ATOM 2020 C PRO A 124 -13.360 -1.465 5.433 1.00 0.00 C ATOM 2021 O PRO A 124 -12.796 -1.672 4.364 1.00 0.00 O ATOM 2022 CB PRO A 124 -15.382 -0.834 4.120 1.00 0.00 C ATOM 2023 CG PRO A 124 -14.779 0.383 3.444 1.00 0.00 C ATOM 2024 CD PRO A 124 -14.228 1.270 4.553 1.00 0.00 C ATOM 0 HA PRO A 124 -15.263 -1.389 6.288 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -15.147 -1.750 3.578 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -16.468 -0.765 4.174 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -13.988 0.090 2.753 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -15.531 0.914 2.861 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -13.139 1.322 4.533 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -14.597 2.293 4.480 1.00 0.00 H new ATOM 2032 N ASN A 125 -12.768 -1.675 6.611 1.00 0.00 N ATOM 2033 CA ASN A 125 -11.442 -2.282 6.712 1.00 0.00 C ATOM 2034 C ASN A 125 -10.399 -1.371 6.032 1.00 0.00 C ATOM 2035 O ASN A 125 -9.303 -1.830 5.698 1.00 0.00 O ATOM 2036 CB ASN A 125 -11.409 -3.664 6.083 1.00 0.00 C ATOM 2037 CG ASN A 125 -12.267 -4.656 6.847 1.00 0.00 C ATOM 2038 OD1 ASN A 125 -12.102 -4.683 8.168 1.00 0.00 O flip ATOM 2039 ND2 ASN A 125 -13.066 -5.386 6.264 1.00 0.00 N flip ATOM 0 H ASN A 125 -13.188 -1.433 7.508 1.00 0.00 H new ATOM 0 HA ASN A 125 -11.202 -2.392 7.770 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -11.757 -3.602 5.052 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -10.380 -4.023 6.051 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -13.160 -5.332 5.250 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -13.635 -6.046 6.794 1.00 0.00 H new ATOM 2046 N SER A 126 -10.742 -0.105 5.845 1.00 0.00 N ATOM 2047 CA SER A 126 -9.830 0.847 5.219 1.00 0.00 C ATOM 2048 C SER A 126 -9.964 2.229 5.854 1.00 0.00 C ATOM 2049 O SER A 126 -11.036 2.613 6.316 1.00 0.00 O ATOM 2050 CB SER A 126 -10.111 0.940 3.719 1.00 0.00 C ATOM 2051 OG SER A 126 -11.350 1.575 3.465 1.00 0.00 O ATOM 0 H SER A 126 -11.643 0.288 6.116 1.00 0.00 H new ATOM 0 HA SER A 126 -8.812 0.491 5.374 1.00 0.00 H new ATOM 0 HB2 SER A 126 -9.309 1.494 3.231 1.00 0.00 H new ATOM 0 HB3 SER A 126 -10.117 -0.060 3.286 1.00 0.00 H new ATOM 0 HG SER A 126 -11.502 1.622 2.498 1.00 0.00 H new ATOM 2057 N LYS A 127 -8.861 2.976 5.868 1.00 0.00 N ATOM 2058 CA LYS A 127 -8.858 4.320 6.434 1.00 0.00 C ATOM 2059 C LYS A 127 -8.701 5.369 5.340 1.00 0.00 C ATOM 2060 O LYS A 127 -7.719 5.365 4.598 1.00 0.00 O ATOM 2061 CB LYS A 127 -7.730 4.461 7.462 1.00 0.00 C ATOM 2062 CG LYS A 127 -7.711 5.808 8.164 1.00 0.00 C ATOM 2063 CD LYS A 127 -6.575 5.895 9.171 1.00 0.00 C ATOM 2064 CE LYS A 127 -6.558 7.243 9.875 1.00 0.00 C ATOM 2065 NZ LYS A 127 -7.275 7.197 11.180 1.00 0.00 N ATOM 0 H LYS A 127 -7.962 2.673 5.495 1.00 0.00 H new ATOM 0 HA LYS A 127 -9.814 4.481 6.931 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -7.830 3.673 8.209 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -6.773 4.308 6.963 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -7.606 6.603 7.426 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -8.662 5.968 8.672 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -6.679 5.099 9.909 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -5.624 5.736 8.663 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -5.526 7.554 10.038 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -7.020 7.994 9.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -7.241 8.135 11.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -8.266 6.925 11.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -6.819 6.499 11.802 1.00 0.00 H new ATOM 2079 N PHE A 128 -9.685 6.258 5.232 1.00 0.00 N ATOM 2080 CA PHE A 128 -9.651 7.309 4.217 1.00 0.00 C ATOM 2081 C PHE A 128 -8.938 8.555 4.733 1.00 0.00 C ATOM 2082 O PHE A 128 -9.359 9.166 5.716 1.00 0.00 O ATOM 2083 CB PHE A 128 -11.082 7.650 3.773 1.00 0.00 C ATOM 2084 CG PHE A 128 -11.167 8.815 2.823 1.00 0.00 C ATOM 2085 CD1 PHE A 128 -11.096 8.620 1.453 1.00 0.00 C ATOM 2086 CD2 PHE A 128 -11.321 10.105 3.305 1.00 0.00 C ATOM 2087 CE1 PHE A 128 -11.175 9.690 0.584 1.00 0.00 C ATOM 2088 CE2 PHE A 128 -11.402 11.179 2.441 1.00 0.00 C ATOM 2089 CZ PHE A 128 -11.329 10.970 1.078 1.00 0.00 C ATOM 0 H PHE A 128 -10.511 6.273 5.830 1.00 0.00 H new ATOM 0 HA PHE A 128 -9.089 6.940 3.359 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -11.522 6.774 3.297 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -11.683 7.869 4.656 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -10.978 7.621 1.061 1.00 0.00 H new ATOM 0 HD2 PHE A 128 -11.378 10.273 4.370 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -11.116 9.526 -0.482 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -11.522 12.179 2.830 1.00 0.00 H new ATOM 0 HZ PHE A 128 -11.392 11.807 0.399 1.00 0.00 H new ATOM 2099 N GLU A 129 -7.861 8.933 4.051 1.00 0.00 N ATOM 2100 CA GLU A 129 -7.090 10.113 4.424 1.00 0.00 C ATOM 2101 C GLU A 129 -7.415 11.287 3.504 1.00 0.00 C ATOM 2102 O GLU A 129 -8.141 12.206 3.885 1.00 0.00 O ATOM 2103 CB GLU A 129 -5.592 9.807 4.378 1.00 0.00 C ATOM 2104 CG GLU A 129 -5.129 8.864 5.474 1.00 0.00 C ATOM 2105 CD GLU A 129 -5.387 9.415 6.863 1.00 0.00 C ATOM 2106 OE1 GLU A 129 -4.851 10.499 7.179 1.00 0.00 O ATOM 2107 OE2 GLU A 129 -6.123 8.765 7.631 1.00 0.00 O ATOM 0 H GLU A 129 -7.502 8.437 3.235 1.00 0.00 H new ATOM 0 HA GLU A 129 -7.362 10.388 5.443 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -5.349 9.371 3.409 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -5.036 10.742 4.456 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -5.640 7.908 5.366 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -4.063 8.671 5.356 1.00 0.00 H new ATOM 2115 N SER A 130 -6.874 11.248 2.287 1.00 0.00 N ATOM 2116 CA SER A 130 -7.105 12.307 1.309 1.00 0.00 C ATOM 2117 C SER A 130 -7.541 11.730 -0.034 1.00 0.00 C ATOM 2118 O SER A 130 -6.977 10.744 -0.509 1.00 0.00 O ATOM 2119 CB SER A 130 -5.839 13.147 1.129 1.00 0.00 C ATOM 2120 OG SER A 130 -5.448 13.751 2.350 1.00 0.00 O ATOM 0 H SER A 130 -6.273 10.494 1.956 1.00 0.00 H new ATOM 0 HA SER A 130 -7.907 12.942 1.685 1.00 0.00 H new ATOM 0 HB2 SER A 130 -5.031 12.517 0.757 1.00 0.00 H new ATOM 0 HB3 SER A 130 -6.014 13.918 0.378 1.00 0.00 H new ATOM 0 HG SER A 130 -4.636 14.281 2.208 1.00 0.00 H new ATOM 2126 N TYR A 131 -8.540 12.355 -0.648 1.00 0.00 N ATOM 2127 CA TYR A 131 -9.042 11.905 -1.943 1.00 0.00 C ATOM 2128 C TYR A 131 -8.902 13.006 -2.991 1.00 0.00 C ATOM 2129 O TYR A 131 -9.225 14.166 -2.732 1.00 0.00 O ATOM 2130 CB TYR A 131 -10.509 11.478 -1.826 1.00 0.00 C ATOM 2131 CG TYR A 131 -11.111 10.997 -3.128 1.00 0.00 C ATOM 2132 CD1 TYR A 131 -11.739 11.881 -3.996 1.00 0.00 C ATOM 2133 CD2 TYR A 131 -11.050 9.656 -3.488 1.00 0.00 C ATOM 2134 CE1 TYR A 131 -12.289 11.444 -5.186 1.00 0.00 C ATOM 2135 CE2 TYR A 131 -11.597 9.211 -4.677 1.00 0.00 C ATOM 2136 CZ TYR A 131 -12.217 10.108 -5.521 1.00 0.00 C ATOM 2137 OH TYR A 131 -12.763 9.668 -6.705 1.00 0.00 O ATOM 0 H TYR A 131 -9.018 13.173 -0.271 1.00 0.00 H new ATOM 0 HA TYR A 131 -8.447 11.048 -2.259 1.00 0.00 H new ATOM 0 HB2 TYR A 131 -10.588 10.683 -1.084 1.00 0.00 H new ATOM 0 HB3 TYR A 131 -11.094 12.320 -1.455 1.00 0.00 H new ATOM 0 HD1 TYR A 131 -11.798 12.928 -3.736 1.00 0.00 H new ATOM 0 HD2 TYR A 131 -10.567 8.950 -2.828 1.00 0.00 H new ATOM 0 HE1 TYR A 131 -12.773 12.145 -5.850 1.00 0.00 H new ATOM 0 HE2 TYR A 131 -11.539 8.166 -4.944 1.00 0.00 H new ATOM 0 HH TYR A 131 -12.626 8.701 -6.789 1.00 0.00 H new ATOM 2147 N ASP A 132 -8.418 12.639 -4.175 1.00 0.00 N ATOM 2148 CA ASP A 132 -8.244 13.604 -5.256 1.00 0.00 C ATOM 2149 C ASP A 132 -9.256 13.352 -6.370 1.00 0.00 C ATOM 2150 O ASP A 132 -9.173 12.354 -7.084 1.00 0.00 O ATOM 2151 CB ASP A 132 -6.822 13.521 -5.813 1.00 0.00 C ATOM 2152 CG ASP A 132 -5.788 14.053 -4.839 1.00 0.00 C ATOM 2153 OD1 ASP A 132 -6.168 14.813 -3.924 1.00 0.00 O ATOM 2154 OD2 ASP A 132 -4.597 13.707 -4.991 1.00 0.00 O ATOM 0 H ASP A 132 -8.141 11.686 -4.409 1.00 0.00 H new ATOM 0 HA ASP A 132 -8.411 14.604 -4.855 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -6.589 12.484 -6.055 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -6.765 14.086 -6.743 1.00 0.00 H new ATOM 2160 N ALA A 133 -10.209 14.271 -6.513 1.00 0.00 N ATOM 2161 CA ALA A 133 -11.240 14.148 -7.536 1.00 0.00 C ATOM 2162 C ALA A 133 -10.676 14.365 -8.937 1.00 0.00 C ATOM 2163 O ALA A 133 -11.070 13.683 -9.884 1.00 0.00 O ATOM 2164 CB ALA A 133 -12.362 15.145 -7.270 1.00 0.00 C ATOM 0 H ALA A 133 -10.287 15.107 -5.933 1.00 0.00 H new ATOM 0 HA ALA A 133 -11.633 13.133 -7.488 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -13.127 15.045 -8.040 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -12.802 14.946 -6.293 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -11.960 16.158 -7.287 1.00 0.00 H new ATOM 2170 N ASP A 134 -9.756 15.313 -9.064 1.00 0.00 N ATOM 2171 CA ASP A 134 -9.153 15.622 -10.354 1.00 0.00 C ATOM 2172 C ASP A 134 -8.403 14.419 -10.922 1.00 0.00 C ATOM 2173 O ASP A 134 -8.465 14.148 -12.122 1.00 0.00 O ATOM 2174 CB ASP A 134 -8.196 16.810 -10.217 1.00 0.00 C ATOM 2175 CG ASP A 134 -8.928 18.116 -9.976 1.00 0.00 C ATOM 2176 OD1 ASP A 134 -8.291 19.070 -9.477 1.00 0.00 O ATOM 2177 OD2 ASP A 134 -10.134 18.189 -10.288 1.00 0.00 O ATOM 0 H ASP A 134 -9.411 15.881 -8.290 1.00 0.00 H new ATOM 0 HA ASP A 134 -9.957 15.879 -11.044 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -7.507 16.625 -9.393 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -7.595 16.895 -11.122 1.00 0.00 H new ATOM 2183 N SER A 135 -7.697 13.697 -10.057 1.00 0.00 N ATOM 2184 CA SER A 135 -6.938 12.527 -10.488 1.00 0.00 C ATOM 2185 C SER A 135 -7.690 11.230 -10.188 1.00 0.00 C ATOM 2186 O SER A 135 -7.280 10.153 -10.622 1.00 0.00 O ATOM 2187 CB SER A 135 -5.572 12.504 -9.803 1.00 0.00 C ATOM 2188 OG SER A 135 -5.700 12.229 -8.419 1.00 0.00 O ATOM 0 H SER A 135 -7.634 13.899 -9.059 1.00 0.00 H new ATOM 0 HA SER A 135 -6.802 12.598 -11.567 1.00 0.00 H new ATOM 0 HB2 SER A 135 -4.940 11.749 -10.270 1.00 0.00 H new ATOM 0 HB3 SER A 135 -5.076 13.465 -9.942 1.00 0.00 H new ATOM 0 HG SER A 135 -4.812 12.218 -8.004 1.00 0.00 H new ATOM 2194 N GLY A 136 -8.786 11.334 -9.440 1.00 0.00 N ATOM 2195 CA GLY A 136 -9.567 10.159 -9.094 1.00 0.00 C ATOM 2196 C GLY A 136 -8.855 9.262 -8.099 1.00 0.00 C ATOM 2197 O GLY A 136 -9.484 8.446 -7.425 1.00 0.00 O ATOM 0 H GLY A 136 -9.147 12.212 -9.067 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -10.524 10.472 -8.676 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -9.785 9.592 -9.999 1.00 0.00 H new ATOM 2201 N THR A 137 -7.538 9.417 -8.006 1.00 0.00 N ATOM 2202 CA THR A 137 -6.731 8.621 -7.088 1.00 0.00 C ATOM 2203 C THR A 137 -6.831 9.170 -5.669 1.00 0.00 C ATOM 2204 O THR A 137 -6.834 10.384 -5.461 1.00 0.00 O ATOM 2205 CB THR A 137 -5.270 8.607 -7.541 1.00 0.00 C ATOM 2206 OG1 THR A 137 -5.162 8.122 -8.868 1.00 0.00 O ATOM 2207 CG2 THR A 137 -4.380 7.750 -6.666 1.00 0.00 C ATOM 0 H THR A 137 -7.005 10.090 -8.558 1.00 0.00 H new ATOM 0 HA THR A 137 -7.114 7.600 -7.094 1.00 0.00 H new ATOM 0 HB THR A 137 -4.935 9.642 -7.469 1.00 0.00 H new ATOM 0 HG1 THR A 137 -4.221 8.122 -9.141 1.00 0.00 H new ATOM 0 HG21 THR A 137 -3.358 7.784 -7.043 1.00 0.00 H new ATOM 0 HG22 THR A 137 -4.403 8.127 -5.644 1.00 0.00 H new ATOM 0 HG23 THR A 137 -4.738 6.721 -6.681 1.00 0.00 H new ATOM 2215 N TYR A 138 -6.909 8.272 -4.693 1.00 0.00 N ATOM 2216 CA TYR A 138 -7.007 8.676 -3.296 1.00 0.00 C ATOM 2217 C TYR A 138 -5.935 7.978 -2.458 1.00 0.00 C ATOM 2218 O TYR A 138 -5.447 6.910 -2.827 1.00 0.00 O ATOM 2219 CB TYR A 138 -8.417 8.384 -2.748 1.00 0.00 C ATOM 2220 CG TYR A 138 -8.662 6.940 -2.346 1.00 0.00 C ATOM 2221 CD1 TYR A 138 -8.662 5.919 -3.287 1.00 0.00 C ATOM 2222 CD2 TYR A 138 -8.886 6.607 -1.016 1.00 0.00 C ATOM 2223 CE1 TYR A 138 -8.881 4.604 -2.913 1.00 0.00 C ATOM 2224 CE2 TYR A 138 -9.106 5.298 -0.634 1.00 0.00 C ATOM 2225 CZ TYR A 138 -9.102 4.300 -1.586 1.00 0.00 C ATOM 2226 OH TYR A 138 -9.322 2.995 -1.211 1.00 0.00 O ATOM 0 H TYR A 138 -6.906 7.263 -4.843 1.00 0.00 H new ATOM 0 HA TYR A 138 -6.836 9.751 -3.232 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -8.593 9.022 -1.882 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -9.150 8.664 -3.505 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -8.488 6.154 -4.327 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -8.888 7.385 -0.267 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -8.879 3.821 -3.656 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -9.280 5.057 0.404 1.00 0.00 H new ATOM 0 HH TYR A 138 -8.465 2.524 -1.148 1.00 0.00 H new ATOM 2236 N VAL A 139 -5.577 8.583 -1.334 1.00 0.00 N ATOM 2237 CA VAL A 139 -4.564 8.014 -0.456 1.00 0.00 C ATOM 2238 C VAL A 139 -5.204 7.508 0.836 1.00 0.00 C ATOM 2239 O VAL A 139 -5.821 8.271 1.579 1.00 0.00 O ATOM 2240 CB VAL A 139 -3.466 9.049 -0.124 1.00 0.00 C ATOM 2241 CG1 VAL A 139 -2.400 8.453 0.789 1.00 0.00 C ATOM 2242 CG2 VAL A 139 -2.839 9.585 -1.402 1.00 0.00 C ATOM 0 H VAL A 139 -5.972 9.466 -1.009 1.00 0.00 H new ATOM 0 HA VAL A 139 -4.101 7.178 -0.980 1.00 0.00 H new ATOM 0 HB VAL A 139 -3.934 9.877 0.409 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -1.642 9.206 1.004 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -2.861 8.126 1.721 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -1.934 7.600 0.296 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -2.067 10.313 -1.151 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -2.394 8.762 -1.962 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -3.606 10.064 -2.010 1.00 0.00 H new ATOM 2252 N PHE A 140 -5.049 6.214 1.092 1.00 0.00 N ATOM 2253 CA PHE A 140 -5.609 5.591 2.286 1.00 0.00 C ATOM 2254 C PHE A 140 -4.506 4.951 3.126 1.00 0.00 C ATOM 2255 O PHE A 140 -3.492 4.501 2.594 1.00 0.00 O ATOM 2256 CB PHE A 140 -6.664 4.545 1.910 1.00 0.00 C ATOM 2257 CG PHE A 140 -6.306 3.709 0.710 1.00 0.00 C ATOM 2258 CD1 PHE A 140 -6.294 4.266 -0.558 1.00 0.00 C ATOM 2259 CD2 PHE A 140 -5.989 2.366 0.850 1.00 0.00 C ATOM 2260 CE1 PHE A 140 -5.975 3.505 -1.663 1.00 0.00 C ATOM 2261 CE2 PHE A 140 -5.671 1.598 -0.255 1.00 0.00 C ATOM 2262 CZ PHE A 140 -5.664 2.170 -1.514 1.00 0.00 C ATOM 0 H PHE A 140 -4.538 5.573 0.485 1.00 0.00 H new ATOM 0 HA PHE A 140 -6.091 6.369 2.879 1.00 0.00 H new ATOM 0 HB2 PHE A 140 -6.825 3.886 2.763 1.00 0.00 H new ATOM 0 HB3 PHE A 140 -7.609 5.052 1.716 1.00 0.00 H new ATOM 0 HD1 PHE A 140 -6.538 5.311 -0.683 1.00 0.00 H new ATOM 0 HD2 PHE A 140 -5.991 1.916 1.832 1.00 0.00 H new ATOM 0 HE1 PHE A 140 -5.969 3.955 -2.645 1.00 0.00 H new ATOM 0 HE2 PHE A 140 -5.428 0.552 -0.135 1.00 0.00 H new ATOM 0 HZ PHE A 140 -5.415 1.572 -2.379 1.00 0.00 H new ATOM 2272 N ILE A 141 -4.707 4.925 4.441 1.00 0.00 N ATOM 2273 CA ILE A 141 -3.719 4.351 5.347 1.00 0.00 C ATOM 2274 C ILE A 141 -4.316 3.182 6.133 1.00 0.00 C ATOM 2275 O ILE A 141 -5.288 3.350 6.872 1.00 0.00 O ATOM 2276 CB ILE A 141 -3.198 5.420 6.341 1.00 0.00 C ATOM 2277 CG1 ILE A 141 -2.547 6.577 5.584 1.00 0.00 C ATOM 2278 CG2 ILE A 141 -2.200 4.815 7.326 1.00 0.00 C ATOM 2279 CD1 ILE A 141 -2.229 7.766 6.463 1.00 0.00 C ATOM 0 H ILE A 141 -5.540 5.293 4.900 1.00 0.00 H new ATOM 0 HA ILE A 141 -2.889 3.989 4.741 1.00 0.00 H new ATOM 0 HB ILE A 141 -4.051 5.797 6.905 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -1.628 6.224 5.116 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -3.211 6.896 4.781 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -1.851 5.588 8.011 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -2.684 4.020 7.892 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -1.351 4.405 6.778 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -1.769 8.550 5.862 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -3.148 8.144 6.911 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -1.540 7.462 7.251 1.00 0.00 H new ATOM 2291 N VAL A 142 -3.725 2.005 5.978 1.00 0.00 N ATOM 2292 CA VAL A 142 -4.184 0.817 6.686 1.00 0.00 C ATOM 2293 C VAL A 142 -3.875 0.924 8.178 1.00 0.00 C ATOM 2294 O VAL A 142 -3.009 0.216 8.698 1.00 0.00 O ATOM 2295 CB VAL A 142 -3.546 -0.463 6.117 1.00 0.00 C ATOM 2296 CG1 VAL A 142 -4.177 -1.699 6.739 1.00 0.00 C ATOM 2297 CG2 VAL A 142 -3.671 -0.497 4.602 1.00 0.00 C ATOM 0 H VAL A 142 -2.924 1.847 5.366 1.00 0.00 H new ATOM 0 HA VAL A 142 -5.263 0.755 6.546 1.00 0.00 H new ATOM 0 HB VAL A 142 -2.486 -0.459 6.370 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -3.712 -2.593 6.323 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -4.027 -1.680 7.818 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -5.245 -1.711 6.521 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -3.214 -1.410 4.220 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -4.725 -0.474 4.323 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -3.164 0.369 4.176 1.00 0.00 H new ATOM 2307 N ASN A 143 -4.577 1.818 8.862 1.00 0.00 N ATOM 2308 CA ASN A 143 -4.370 2.024 10.291 1.00 0.00 C ATOM 2309 C ASN A 143 -4.671 0.754 11.080 1.00 0.00 C ATOM 2310 O ASN A 143 -3.963 0.422 12.032 1.00 0.00 O ATOM 2311 CB ASN A 143 -5.249 3.170 10.795 1.00 0.00 C ATOM 2312 CG ASN A 143 -6.727 2.901 10.589 1.00 0.00 C ATOM 2313 OD1 ASN A 143 -7.110 2.067 9.770 1.00 0.00 O ATOM 2314 ND2 ASN A 143 -7.566 3.610 11.335 1.00 0.00 N ATOM 0 H ASN A 143 -5.296 2.413 8.450 1.00 0.00 H new ATOM 0 HA ASN A 143 -3.322 2.282 10.443 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -5.057 3.332 11.856 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -4.975 4.089 10.277 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -8.572 3.473 11.241 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -7.204 4.291 12.002 1.00 0.00 H new ATOM 2321 N HIS A 144 -5.723 0.048 10.684 1.00 0.00 N ATOM 2322 CA HIS A 144 -6.112 -1.183 11.363 1.00 0.00 C ATOM 2323 C HIS A 144 -5.289 -2.367 10.863 1.00 0.00 C ATOM 2324 O HIS A 144 -5.793 -3.236 10.150 1.00 0.00 O ATOM 2325 CB HIS A 144 -7.605 -1.451 11.154 1.00 0.00 C ATOM 2326 CG HIS A 144 -8.140 -2.564 12.001 1.00 0.00 C ATOM 2327 ND1 HIS A 144 -8.321 -3.847 11.532 1.00 0.00 N ATOM 2328 CD2 HIS A 144 -8.534 -2.580 13.297 1.00 0.00 C ATOM 2329 CE1 HIS A 144 -8.805 -4.604 12.501 1.00 0.00 C ATOM 2330 NE2 HIS A 144 -8.943 -3.859 13.581 1.00 0.00 N ATOM 0 H HIS A 144 -6.321 0.305 9.899 1.00 0.00 H new ATOM 0 HA HIS A 144 -5.918 -1.060 12.429 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -8.163 -0.540 11.372 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -7.779 -1.689 10.105 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -8.527 -1.743 13.979 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -9.046 -5.654 12.422 1.00 0.00 H new ATOM 0 HE2 HIS A 144 -9.297 -4.181 14.482 1.00 0.00 H new