USER MOD reduce.3.24.130724 H: found=0, std=0, add=893, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 895 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 74 GLN : amide:sc= -5.29! K(o=-5.3!,f=-0.91) USER MOD Set 1.2: A 103 TYR OH : rot 175:sc= 0.00125 USER MOD Single : A 8 ASN : amide:sc= 0.0334 X(o=0.033,f=0) USER MOD Single : A 10 SER OG : rot 180:sc= -0.103 USER MOD Single : A 16 THR OG1 : rot 72:sc= 1.18 USER MOD Single : A 22 TYR OH : rot 165:sc= -0.0456 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 74:sc= 0.307 USER MOD Single : A 46 ASN : amide:sc=-0.00278 K(o=-0.0028,f=1.2) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 154:sc= 0.545 (180deg=-0.97!) USER MOD Single : A 61 SER OG : rot 77:sc= 1.29 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot 180:sc= -0.0566 USER MOD Single : A 81 ASN : amide:sc= 0.208 X(o=0.21,f=0.15) USER MOD Single : A 82 TYR OH : rot 35:sc= 1.28 USER MOD Single : A 83 LYS NZ :NH3+ -167:sc= -0.0304 (180deg=-0.252) USER MOD Single : A 84 HIS : no HE2:sc= 0.253 K(o=0.25,f=-5.1!) USER MOD Single : A 91 TYR OH : rot 165:sc= 0.784 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 99 HIS : no HE2:sc= -1.01 K(o=0.33,f=-8.9!) USER MOD Single : A 105 ASN : amide:sc= 1.07 K(o=1.1,f=-0.43) USER MOD Single : A 114 SER OG : rot -108:sc= 1.29 USER MOD Single : A 115 TYR OH : rot 166:sc= 0.416 USER MOD Single : A 118 SER OG : rot -79:sc= 1.16 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 82:sc= 1.05 USER MOD Single : A 123 ASN : amide:sc= 0.539 K(o=0.54,f=-0.061) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 20 N PRO A 2 -7.230 5.162 -13.363 1.00 0.00 N ATOM 21 CA PRO A 2 -7.300 4.227 -12.231 1.00 0.00 C ATOM 22 C PRO A 2 -7.962 4.862 -11.013 1.00 0.00 C ATOM 23 O PRO A 2 -7.906 6.080 -10.845 1.00 0.00 O ATOM 24 CB PRO A 2 -5.836 3.915 -11.926 1.00 0.00 C ATOM 25 CG PRO A 2 -5.111 4.174 -13.200 1.00 0.00 C ATOM 26 CD PRO A 2 -5.859 5.275 -13.898 1.00 0.00 C ATOM 0 HA PRO A 2 -7.895 3.345 -12.468 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -5.458 4.546 -11.122 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -5.712 2.881 -11.605 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -4.079 4.467 -13.007 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -5.077 3.276 -13.817 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -5.425 6.252 -13.684 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -5.840 5.148 -14.980 1.00 0.00 H new ATOM 34 N VAL A 3 -8.571 4.032 -10.171 1.00 0.00 N ATOM 35 CA VAL A 3 -9.314 4.503 -9.000 1.00 0.00 C ATOM 36 C VAL A 3 -8.463 5.411 -8.112 1.00 0.00 C ATOM 37 O VAL A 3 -7.521 4.961 -7.455 1.00 0.00 O ATOM 38 CB VAL A 3 -9.839 3.320 -8.152 1.00 0.00 C ATOM 39 CG1 VAL A 3 -10.638 3.819 -6.958 1.00 0.00 C ATOM 40 CG2 VAL A 3 -10.686 2.380 -8.994 1.00 0.00 C ATOM 0 H VAL A 3 -8.565 3.018 -10.278 1.00 0.00 H new ATOM 0 HA VAL A 3 -10.158 5.076 -9.384 1.00 0.00 H new ATOM 0 HB VAL A 3 -8.974 2.768 -7.783 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -10.996 2.968 -6.378 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -10.003 4.444 -6.331 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -11.489 4.403 -7.308 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -11.042 1.557 -8.374 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -11.539 2.924 -9.400 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -10.085 1.983 -9.812 1.00 0.00 H new ATOM 50 N GLU A 4 -8.802 6.690 -8.110 1.00 0.00 N ATOM 51 CA GLU A 4 -8.116 7.665 -7.287 1.00 0.00 C ATOM 52 C GLU A 4 -9.099 8.326 -6.328 1.00 0.00 C ATOM 53 O GLU A 4 -10.306 8.344 -6.575 1.00 0.00 O ATOM 54 CB GLU A 4 -7.435 8.736 -8.153 1.00 0.00 C ATOM 55 CG GLU A 4 -8.395 9.626 -8.941 1.00 0.00 C ATOM 56 CD GLU A 4 -8.976 8.947 -10.169 1.00 0.00 C ATOM 57 OE1 GLU A 4 -9.990 8.226 -10.042 1.00 0.00 O ATOM 58 OE2 GLU A 4 -8.421 9.138 -11.273 1.00 0.00 O ATOM 0 H GLU A 4 -9.557 7.077 -8.677 1.00 0.00 H new ATOM 0 HA GLU A 4 -7.348 7.144 -6.715 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -6.821 9.367 -7.510 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -6.761 8.243 -8.853 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -9.210 9.937 -8.287 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -7.870 10.530 -9.249 1.00 0.00 H new ATOM 65 N LEU A 5 -8.585 8.857 -5.233 1.00 0.00 N ATOM 66 CA LEU A 5 -9.411 9.586 -4.289 1.00 0.00 C ATOM 67 C LEU A 5 -9.024 11.058 -4.300 1.00 0.00 C ATOM 68 O LEU A 5 -8.018 11.453 -3.711 1.00 0.00 O ATOM 69 CB LEU A 5 -9.265 9.002 -2.879 1.00 0.00 C ATOM 70 CG LEU A 5 -10.234 9.570 -1.837 1.00 0.00 C ATOM 71 CD1 LEU A 5 -11.671 9.236 -2.204 1.00 0.00 C ATOM 72 CD2 LEU A 5 -9.901 9.040 -0.449 1.00 0.00 C ATOM 0 H LEU A 5 -7.600 8.797 -4.976 1.00 0.00 H new ATOM 0 HA LEU A 5 -10.455 9.491 -4.587 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -9.406 7.923 -2.933 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -8.245 9.173 -2.535 1.00 0.00 H new ATOM 0 HG LEU A 5 -10.125 10.655 -1.826 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -12.344 9.648 -1.452 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -11.907 9.666 -3.177 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -11.794 8.154 -2.247 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -10.601 9.455 0.277 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -9.978 7.953 -0.446 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.885 9.332 -0.182 1.00 0.00 H new ATOM 84 N ARG A 6 -9.809 11.862 -4.999 1.00 0.00 N ATOM 85 CA ARG A 6 -9.525 13.285 -5.117 1.00 0.00 C ATOM 86 C ARG A 6 -10.006 14.022 -3.876 1.00 0.00 C ATOM 87 O ARG A 6 -10.882 13.537 -3.168 1.00 0.00 O ATOM 88 CB ARG A 6 -10.187 13.867 -6.367 1.00 0.00 C ATOM 89 CG ARG A 6 -9.807 13.142 -7.647 1.00 0.00 C ATOM 90 CD ARG A 6 -10.295 13.884 -8.879 1.00 0.00 C ATOM 91 NE ARG A 6 -10.009 13.147 -10.108 1.00 0.00 N ATOM 92 CZ ARG A 6 -8.796 13.034 -10.654 1.00 0.00 C ATOM 93 NH1 ARG A 6 -7.746 13.627 -10.099 1.00 0.00 N ATOM 94 NH2 ARG A 6 -8.637 12.344 -11.773 1.00 0.00 N ATOM 0 H ARG A 6 -10.647 11.555 -5.493 1.00 0.00 H new ATOM 0 HA ARG A 6 -8.446 13.414 -5.208 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -11.270 13.830 -6.246 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -9.912 14.918 -6.458 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -8.724 13.031 -7.694 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -10.230 12.138 -7.636 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -11.369 14.054 -8.799 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -9.820 14.864 -8.924 1.00 0.00 H new ATOM 0 HE ARG A 6 -10.788 12.688 -10.580 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -7.861 14.176 -9.247 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -6.824 13.534 -10.525 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -9.441 11.900 -12.217 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -7.711 12.257 -12.191 1.00 0.00 H new ATOM 108 N ALA A 7 -9.441 15.197 -3.628 1.00 0.00 N ATOM 109 CA ALA A 7 -9.782 15.995 -2.446 1.00 0.00 C ATOM 110 C ALA A 7 -11.136 16.686 -2.594 1.00 0.00 C ATOM 111 O ALA A 7 -11.326 17.812 -2.133 1.00 0.00 O ATOM 112 CB ALA A 7 -8.694 17.024 -2.181 1.00 0.00 C ATOM 0 H ALA A 7 -8.739 15.625 -4.232 1.00 0.00 H new ATOM 0 HA ALA A 7 -9.854 15.314 -1.598 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -8.956 17.612 -1.301 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -7.746 16.515 -2.008 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -8.599 17.684 -3.043 1.00 0.00 H new ATOM 118 N ASN A 8 -12.071 15.991 -3.219 1.00 0.00 N ATOM 119 CA ASN A 8 -13.423 16.484 -3.409 1.00 0.00 C ATOM 120 C ASN A 8 -14.279 15.341 -3.930 1.00 0.00 C ATOM 121 O ASN A 8 -14.552 15.235 -5.129 1.00 0.00 O ATOM 122 CB ASN A 8 -13.448 17.670 -4.376 1.00 0.00 C ATOM 123 CG ASN A 8 -14.798 18.357 -4.419 1.00 0.00 C ATOM 124 OD1 ASN A 8 -15.076 19.260 -3.629 1.00 0.00 O ATOM 125 ND2 ASN A 8 -15.637 17.953 -5.351 1.00 0.00 N ATOM 0 H ASN A 8 -11.912 15.063 -3.611 1.00 0.00 H new ATOM 0 HA ASN A 8 -13.820 16.841 -2.458 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -12.686 18.391 -4.080 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -13.188 17.324 -5.376 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -16.554 18.392 -5.437 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -15.370 17.202 -5.987 1.00 0.00 H new ATOM 132 N TRP A 9 -14.647 14.456 -3.025 1.00 0.00 N ATOM 133 CA TRP A 9 -15.350 13.234 -3.379 1.00 0.00 C ATOM 134 C TRP A 9 -16.724 13.172 -2.730 1.00 0.00 C ATOM 135 O TRP A 9 -17.055 13.989 -1.871 1.00 0.00 O ATOM 136 CB TRP A 9 -14.522 12.017 -2.948 1.00 0.00 C ATOM 137 CG TRP A 9 -14.002 12.113 -1.537 1.00 0.00 C ATOM 138 CD1 TRP A 9 -12.748 12.493 -1.158 1.00 0.00 C ATOM 139 CD2 TRP A 9 -14.716 11.839 -0.323 1.00 0.00 C ATOM 140 NE1 TRP A 9 -12.636 12.470 0.209 1.00 0.00 N ATOM 141 CE2 TRP A 9 -13.829 12.075 0.745 1.00 0.00 C ATOM 142 CE3 TRP A 9 -16.017 11.420 -0.034 1.00 0.00 C ATOM 143 CZ2 TRP A 9 -14.205 11.904 2.075 1.00 0.00 C ATOM 144 CZ3 TRP A 9 -16.387 11.251 1.285 1.00 0.00 C ATOM 145 CH2 TRP A 9 -15.485 11.494 2.324 1.00 0.00 C ATOM 0 H TRP A 9 -14.469 14.561 -2.026 1.00 0.00 H new ATOM 0 HA TRP A 9 -15.486 13.227 -4.460 1.00 0.00 H new ATOM 0 HB2 TRP A 9 -15.134 11.120 -3.041 1.00 0.00 H new ATOM 0 HB3 TRP A 9 -13.680 11.901 -3.630 1.00 0.00 H new ATOM 0 HD1 TRP A 9 -11.956 12.772 -1.837 1.00 0.00 H new ATOM 0 HE1 TRP A 9 -11.798 12.709 0.739 1.00 0.00 H new ATOM 0 HE3 TRP A 9 -16.722 11.231 -0.830 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 -13.510 12.089 2.881 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 -17.390 10.926 1.518 1.00 0.00 H new ATOM 0 HH2 TRP A 9 -15.806 11.355 3.346 1.00 0.00 H new ATOM 156 N SER A 10 -17.515 12.201 -3.157 1.00 0.00 N ATOM 157 CA SER A 10 -18.769 11.891 -2.500 1.00 0.00 C ATOM 158 C SER A 10 -18.671 10.494 -1.893 1.00 0.00 C ATOM 159 O SER A 10 -17.693 9.779 -2.130 1.00 0.00 O ATOM 160 CB SER A 10 -19.935 11.968 -3.491 1.00 0.00 C ATOM 161 OG SER A 10 -21.179 11.779 -2.834 1.00 0.00 O ATOM 0 H SER A 10 -17.306 11.611 -3.963 1.00 0.00 H new ATOM 0 HA SER A 10 -18.958 12.621 -1.713 1.00 0.00 H new ATOM 0 HB2 SER A 10 -19.928 12.937 -3.991 1.00 0.00 H new ATOM 0 HB3 SER A 10 -19.810 11.210 -4.264 1.00 0.00 H new ATOM 0 HG SER A 10 -21.906 11.835 -3.488 1.00 0.00 H new ATOM 167 N GLU A 11 -19.674 10.106 -1.120 1.00 0.00 N ATOM 168 CA GLU A 11 -19.661 8.812 -0.445 1.00 0.00 C ATOM 169 C GLU A 11 -19.637 7.665 -1.448 1.00 0.00 C ATOM 170 O GLU A 11 -19.021 6.631 -1.201 1.00 0.00 O ATOM 171 CB GLU A 11 -20.869 8.677 0.479 1.00 0.00 C ATOM 172 CG GLU A 11 -20.869 9.670 1.629 1.00 0.00 C ATOM 173 CD GLU A 11 -22.057 9.497 2.548 1.00 0.00 C ATOM 174 OE1 GLU A 11 -22.010 8.608 3.423 1.00 0.00 O ATOM 175 OE2 GLU A 11 -23.041 10.253 2.404 1.00 0.00 O ATOM 0 H GLU A 11 -20.508 10.666 -0.943 1.00 0.00 H new ATOM 0 HA GLU A 11 -18.751 8.759 0.153 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -21.779 8.810 -0.105 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -20.895 7.665 0.884 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -19.950 9.554 2.204 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -20.869 10.684 1.229 1.00 0.00 H new ATOM 182 N GLU A 12 -20.292 7.864 -2.587 1.00 0.00 N ATOM 183 CA GLU A 12 -20.331 6.856 -3.641 1.00 0.00 C ATOM 184 C GLU A 12 -18.916 6.612 -4.176 1.00 0.00 C ATOM 185 O GLU A 12 -18.492 5.468 -4.361 1.00 0.00 O ATOM 186 CB GLU A 12 -21.271 7.322 -4.760 1.00 0.00 C ATOM 187 CG GLU A 12 -22.019 6.199 -5.467 1.00 0.00 C ATOM 188 CD GLU A 12 -21.155 5.397 -6.416 1.00 0.00 C ATOM 189 OE1 GLU A 12 -20.733 5.953 -7.451 1.00 0.00 O ATOM 190 OE2 GLU A 12 -20.914 4.201 -6.148 1.00 0.00 O ATOM 0 H GLU A 12 -20.805 8.718 -2.805 1.00 0.00 H new ATOM 0 HA GLU A 12 -20.711 5.916 -3.240 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -21.998 8.017 -4.340 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -20.690 7.875 -5.498 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -22.441 5.528 -4.719 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -22.855 6.624 -6.022 1.00 0.00 H new ATOM 197 N ASP A 13 -18.179 7.698 -4.392 1.00 0.00 N ATOM 198 CA ASP A 13 -16.795 7.613 -4.850 1.00 0.00 C ATOM 199 C ASP A 13 -15.926 6.976 -3.777 1.00 0.00 C ATOM 200 O ASP A 13 -15.107 6.102 -4.063 1.00 0.00 O ATOM 201 CB ASP A 13 -16.236 8.998 -5.192 1.00 0.00 C ATOM 202 CG ASP A 13 -17.006 9.695 -6.291 1.00 0.00 C ATOM 203 OD1 ASP A 13 -16.684 9.481 -7.482 1.00 0.00 O ATOM 204 OD2 ASP A 13 -17.937 10.463 -5.969 1.00 0.00 O ATOM 0 H ASP A 13 -18.518 8.650 -4.257 1.00 0.00 H new ATOM 0 HA ASP A 13 -16.782 6.999 -5.750 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -16.250 9.620 -4.297 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -15.194 8.898 -5.495 1.00 0.00 H new ATOM 209 N LEU A 14 -16.122 7.416 -2.540 1.00 0.00 N ATOM 210 CA LEU A 14 -15.360 6.907 -1.409 1.00 0.00 C ATOM 211 C LEU A 14 -15.564 5.403 -1.249 1.00 0.00 C ATOM 212 O LEU A 14 -14.602 4.656 -1.074 1.00 0.00 O ATOM 213 CB LEU A 14 -15.774 7.629 -0.125 1.00 0.00 C ATOM 214 CG LEU A 14 -14.956 7.267 1.114 1.00 0.00 C ATOM 215 CD1 LEU A 14 -13.524 7.763 0.974 1.00 0.00 C ATOM 216 CD2 LEU A 14 -15.605 7.839 2.363 1.00 0.00 C ATOM 0 H LEU A 14 -16.808 8.130 -2.295 1.00 0.00 H new ATOM 0 HA LEU A 14 -14.303 7.094 -1.599 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -15.698 8.704 -0.290 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -16.823 7.410 0.074 1.00 0.00 H new ATOM 0 HG LEU A 14 -14.931 6.181 1.207 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -12.958 7.496 1.866 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -13.063 7.303 0.100 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -13.524 8.847 0.856 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -15.010 7.572 3.237 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -15.661 8.924 2.280 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -16.610 7.431 2.470 1.00 0.00 H new ATOM 228 N GLU A 15 -16.818 4.967 -1.325 1.00 0.00 N ATOM 229 CA GLU A 15 -17.160 3.555 -1.214 1.00 0.00 C ATOM 230 C GLU A 15 -16.451 2.749 -2.297 1.00 0.00 C ATOM 231 O GLU A 15 -15.998 1.627 -2.060 1.00 0.00 O ATOM 232 CB GLU A 15 -18.677 3.386 -1.329 1.00 0.00 C ATOM 233 CG GLU A 15 -19.153 1.955 -1.171 1.00 0.00 C ATOM 234 CD GLU A 15 -18.868 1.395 0.207 1.00 0.00 C ATOM 235 OE1 GLU A 15 -19.692 1.606 1.120 1.00 0.00 O ATOM 236 OE2 GLU A 15 -17.826 0.735 0.383 1.00 0.00 O ATOM 0 H GLU A 15 -17.621 5.580 -1.465 1.00 0.00 H new ATOM 0 HA GLU A 15 -16.832 3.183 -0.243 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -19.159 4.004 -0.572 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -19.001 3.761 -2.300 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -20.225 1.909 -1.363 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -18.668 1.330 -1.921 1.00 0.00 H new ATOM 243 N THR A 16 -16.345 3.338 -3.479 1.00 0.00 N ATOM 244 CA THR A 16 -15.658 2.707 -4.591 1.00 0.00 C ATOM 245 C THR A 16 -14.187 2.464 -4.246 1.00 0.00 C ATOM 246 O THR A 16 -13.649 1.390 -4.511 1.00 0.00 O ATOM 247 CB THR A 16 -15.762 3.574 -5.863 1.00 0.00 C ATOM 248 OG1 THR A 16 -17.138 3.871 -6.140 1.00 0.00 O ATOM 249 CG2 THR A 16 -15.142 2.872 -7.064 1.00 0.00 C ATOM 0 H THR A 16 -16.730 4.259 -3.691 1.00 0.00 H new ATOM 0 HA THR A 16 -16.139 1.748 -4.782 1.00 0.00 H new ATOM 0 HB THR A 16 -15.213 4.499 -5.685 1.00 0.00 H new ATOM 0 HG1 THR A 16 -17.471 4.519 -5.485 1.00 0.00 H new ATOM 0 HG21 THR A 16 -15.232 3.509 -7.944 1.00 0.00 H new ATOM 0 HG22 THR A 16 -14.089 2.673 -6.866 1.00 0.00 H new ATOM 0 HG23 THR A 16 -15.661 1.931 -7.243 1.00 0.00 H new ATOM 257 N VAL A 17 -13.560 3.458 -3.625 1.00 0.00 N ATOM 258 CA VAL A 17 -12.154 3.371 -3.249 1.00 0.00 C ATOM 259 C VAL A 17 -11.951 2.366 -2.116 1.00 0.00 C ATOM 260 O VAL A 17 -11.096 1.485 -2.205 1.00 0.00 O ATOM 261 CB VAL A 17 -11.605 4.749 -2.816 1.00 0.00 C ATOM 262 CG1 VAL A 17 -10.138 4.659 -2.423 1.00 0.00 C ATOM 263 CG2 VAL A 17 -11.799 5.772 -3.925 1.00 0.00 C ATOM 0 H VAL A 17 -14.007 4.339 -3.370 1.00 0.00 H new ATOM 0 HA VAL A 17 -11.606 3.033 -4.128 1.00 0.00 H new ATOM 0 HB VAL A 17 -12.167 5.074 -1.940 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -9.781 5.644 -2.123 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -10.026 3.964 -1.591 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -9.555 4.304 -3.273 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -11.407 6.737 -3.603 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -11.268 5.445 -4.819 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -12.861 5.869 -4.149 1.00 0.00 H new ATOM 273 N ILE A 18 -12.758 2.495 -1.064 1.00 0.00 N ATOM 274 CA ILE A 18 -12.638 1.639 0.118 1.00 0.00 C ATOM 275 C ILE A 18 -12.787 0.164 -0.248 1.00 0.00 C ATOM 276 O ILE A 18 -11.948 -0.663 0.120 1.00 0.00 O ATOM 277 CB ILE A 18 -13.688 2.007 1.195 1.00 0.00 C ATOM 278 CG1 ILE A 18 -13.491 3.453 1.658 1.00 0.00 C ATOM 279 CG2 ILE A 18 -13.602 1.057 2.385 1.00 0.00 C ATOM 280 CD1 ILE A 18 -14.518 3.919 2.669 1.00 0.00 C ATOM 0 H ILE A 18 -13.505 3.187 -1.005 1.00 0.00 H new ATOM 0 HA ILE A 18 -11.641 1.806 0.526 1.00 0.00 H new ATOM 0 HB ILE A 18 -14.679 1.911 0.751 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -12.496 3.553 2.093 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -13.526 4.110 0.789 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -14.349 1.336 3.128 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -13.787 0.036 2.050 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -12.608 1.119 2.829 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -14.311 4.952 2.948 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -15.514 3.853 2.232 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -14.468 3.287 3.556 1.00 0.00 H new ATOM 292 N ARG A 19 -13.843 -0.155 -0.986 1.00 0.00 N ATOM 293 CA ARG A 19 -14.123 -1.532 -1.375 1.00 0.00 C ATOM 294 C ARG A 19 -13.066 -2.067 -2.342 1.00 0.00 C ATOM 295 O ARG A 19 -12.759 -3.259 -2.341 1.00 0.00 O ATOM 296 CB ARG A 19 -15.515 -1.622 -2.006 1.00 0.00 C ATOM 297 CG ARG A 19 -15.827 -2.979 -2.614 1.00 0.00 C ATOM 298 CD ARG A 19 -17.182 -2.981 -3.298 1.00 0.00 C ATOM 299 NE ARG A 19 -17.372 -4.172 -4.126 1.00 0.00 N ATOM 300 CZ ARG A 19 -18.372 -4.324 -4.995 1.00 0.00 C ATOM 301 NH1 ARG A 19 -19.289 -3.373 -5.130 1.00 0.00 N ATOM 302 NH2 ARG A 19 -18.450 -5.425 -5.729 1.00 0.00 N ATOM 0 H ARG A 19 -14.522 0.524 -1.329 1.00 0.00 H new ATOM 0 HA ARG A 19 -14.093 -2.150 -0.478 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -16.263 -1.394 -1.247 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -15.603 -0.859 -2.779 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -15.053 -3.243 -3.335 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -15.810 -3.741 -1.835 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -17.969 -2.933 -2.545 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -17.278 -2.089 -3.917 1.00 0.00 H new ATOM 0 HE ARG A 19 -16.699 -4.932 -4.033 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -19.229 -2.524 -4.568 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -20.053 -3.492 -5.795 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -17.745 -6.156 -5.629 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -19.215 -5.542 -6.394 1.00 0.00 H new ATOM 316 N ALA A 20 -12.511 -1.185 -3.165 1.00 0.00 N ATOM 317 CA ALA A 20 -11.480 -1.582 -4.117 1.00 0.00 C ATOM 318 C ALA A 20 -10.229 -2.055 -3.391 1.00 0.00 C ATOM 319 O ALA A 20 -9.525 -2.951 -3.861 1.00 0.00 O ATOM 320 CB ALA A 20 -11.138 -0.434 -5.057 1.00 0.00 C ATOM 0 H ALA A 20 -12.756 -0.195 -3.193 1.00 0.00 H new ATOM 0 HA ALA A 20 -11.873 -2.409 -4.709 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -10.367 -0.755 -5.757 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -12.030 -0.138 -5.610 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -10.772 0.414 -4.478 1.00 0.00 H new ATOM 326 N VAL A 21 -9.961 -1.451 -2.242 1.00 0.00 N ATOM 327 CA VAL A 21 -8.798 -1.808 -1.448 1.00 0.00 C ATOM 328 C VAL A 21 -9.029 -3.115 -0.692 1.00 0.00 C ATOM 329 O VAL A 21 -8.238 -4.054 -0.804 1.00 0.00 O ATOM 330 CB VAL A 21 -8.437 -0.687 -0.445 1.00 0.00 C ATOM 331 CG1 VAL A 21 -7.224 -1.073 0.393 1.00 0.00 C ATOM 332 CG2 VAL A 21 -8.187 0.625 -1.178 1.00 0.00 C ATOM 0 H VAL A 21 -10.535 -0.710 -1.840 1.00 0.00 H new ATOM 0 HA VAL A 21 -7.966 -1.941 -2.139 1.00 0.00 H new ATOM 0 HB VAL A 21 -9.282 -0.551 0.229 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -6.992 -0.267 1.090 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -7.442 -1.984 0.951 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -6.369 -1.244 -0.261 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -7.934 1.402 -0.457 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -7.362 0.499 -1.879 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -9.085 0.914 -1.723 1.00 0.00 H new ATOM 342 N TYR A 22 -10.123 -3.186 0.057 1.00 0.00 N ATOM 343 CA TYR A 22 -10.394 -4.352 0.892 1.00 0.00 C ATOM 344 C TYR A 22 -11.888 -4.485 1.180 1.00 0.00 C ATOM 345 O TYR A 22 -12.701 -3.765 0.602 1.00 0.00 O ATOM 346 CB TYR A 22 -9.613 -4.252 2.211 1.00 0.00 C ATOM 347 CG TYR A 22 -10.203 -3.276 3.213 1.00 0.00 C ATOM 348 CD1 TYR A 22 -10.382 -1.934 2.896 1.00 0.00 C ATOM 349 CD2 TYR A 22 -10.592 -3.709 4.475 1.00 0.00 C ATOM 350 CE1 TYR A 22 -10.929 -1.053 3.809 1.00 0.00 C ATOM 351 CE2 TYR A 22 -11.143 -2.834 5.390 1.00 0.00 C ATOM 352 CZ TYR A 22 -11.308 -1.508 5.053 1.00 0.00 C ATOM 353 OH TYR A 22 -11.860 -0.636 5.961 1.00 0.00 O ATOM 0 H TYR A 22 -10.833 -2.455 0.104 1.00 0.00 H new ATOM 0 HA TYR A 22 -10.069 -5.240 0.349 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -9.566 -5.240 2.668 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -8.588 -3.954 1.991 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -10.089 -1.575 1.921 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -10.461 -4.747 4.744 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -11.059 -0.013 3.549 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -11.443 -3.187 6.365 1.00 0.00 H new ATOM 0 HH TYR A 22 -12.288 -1.143 6.683 1.00 0.00 H new ATOM 586 N LEU A 37 -11.771 -2.372 10.127 1.00 0.00 N ATOM 587 CA LEU A 37 -11.043 -1.109 10.253 1.00 0.00 C ATOM 588 C LEU A 37 -12.011 0.067 10.343 1.00 0.00 C ATOM 589 O LEU A 37 -11.803 1.113 9.728 1.00 0.00 O ATOM 590 CB LEU A 37 -10.091 -0.925 9.068 1.00 0.00 C ATOM 591 CG LEU A 37 -9.016 -2.004 8.928 1.00 0.00 C ATOM 592 CD1 LEU A 37 -8.182 -1.764 7.682 1.00 0.00 C ATOM 593 CD2 LEU A 37 -8.125 -2.040 10.163 1.00 0.00 C ATOM 0 HA LEU A 37 -10.458 -1.141 11.172 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -10.679 -0.898 8.150 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -9.601 0.044 9.162 1.00 0.00 H new ATOM 0 HG LEU A 37 -9.512 -2.970 8.834 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -7.422 -2.541 7.598 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.826 -1.789 6.803 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -7.699 -0.789 7.750 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.367 -2.814 10.043 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -7.639 -1.073 10.289 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -8.731 -2.259 11.042 1.00 0.00 H new ATOM 605 N VAL A 38 -13.052 -0.109 11.148 1.00 0.00 N ATOM 606 CA VAL A 38 -14.127 0.871 11.256 1.00 0.00 C ATOM 607 C VAL A 38 -13.618 2.224 11.747 1.00 0.00 C ATOM 608 O VAL A 38 -14.124 3.269 11.340 1.00 0.00 O ATOM 609 CB VAL A 38 -15.255 0.370 12.185 1.00 0.00 C ATOM 610 CG1 VAL A 38 -15.996 -0.793 11.546 1.00 0.00 C ATOM 611 CG2 VAL A 38 -14.705 -0.040 13.546 1.00 0.00 C ATOM 0 H VAL A 38 -13.175 -0.930 11.741 1.00 0.00 H new ATOM 0 HA VAL A 38 -14.530 1.001 10.251 1.00 0.00 H new ATOM 0 HB VAL A 38 -15.954 1.193 12.334 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -16.787 -1.132 12.215 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -16.434 -0.471 10.601 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -15.300 -1.611 11.363 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -15.522 -0.388 14.179 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -13.978 -0.842 13.418 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -14.222 0.816 14.016 1.00 0.00 H new ATOM 621 N SER A 39 -12.611 2.203 12.610 1.00 0.00 N ATOM 622 CA SER A 39 -12.012 3.431 13.113 1.00 0.00 C ATOM 623 C SER A 39 -11.287 4.167 11.987 1.00 0.00 C ATOM 624 O SER A 39 -11.395 5.387 11.852 1.00 0.00 O ATOM 625 CB SER A 39 -11.046 3.106 14.251 1.00 0.00 C ATOM 626 OG SER A 39 -11.666 2.268 15.215 1.00 0.00 O ATOM 0 H SER A 39 -12.192 1.348 12.976 1.00 0.00 H new ATOM 0 HA SER A 39 -12.799 4.081 13.495 1.00 0.00 H new ATOM 0 HB2 SER A 39 -10.159 2.614 13.852 1.00 0.00 H new ATOM 0 HB3 SER A 39 -10.712 4.029 14.726 1.00 0.00 H new ATOM 0 HG SER A 39 -11.030 2.070 15.934 1.00 0.00 H new ATOM 632 N ALA A 40 -10.578 3.405 11.159 1.00 0.00 N ATOM 633 CA ALA A 40 -9.844 3.972 10.035 1.00 0.00 C ATOM 634 C ALA A 40 -10.808 4.493 8.978 1.00 0.00 C ATOM 635 O ALA A 40 -10.556 5.522 8.349 1.00 0.00 O ATOM 636 CB ALA A 40 -8.905 2.935 9.438 1.00 0.00 C ATOM 0 H ALA A 40 -10.497 2.392 11.247 1.00 0.00 H new ATOM 0 HA ALA A 40 -9.247 4.809 10.397 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -8.364 3.374 8.600 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -8.194 2.608 10.197 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -9.483 2.079 9.089 1.00 0.00 H new ATOM 642 N GLU A 41 -11.917 3.782 8.801 1.00 0.00 N ATOM 643 CA GLU A 41 -12.946 4.188 7.855 1.00 0.00 C ATOM 644 C GLU A 41 -13.478 5.571 8.206 1.00 0.00 C ATOM 645 O GLU A 41 -13.559 6.446 7.349 1.00 0.00 O ATOM 646 CB GLU A 41 -14.099 3.183 7.841 1.00 0.00 C ATOM 647 CG GLU A 41 -15.208 3.554 6.871 1.00 0.00 C ATOM 648 CD GLU A 41 -16.415 2.651 6.991 1.00 0.00 C ATOM 649 OE1 GLU A 41 -17.290 2.935 7.836 1.00 0.00 O ATOM 650 OE2 GLU A 41 -16.497 1.662 6.246 1.00 0.00 O ATOM 0 H GLU A 41 -12.125 2.919 9.303 1.00 0.00 H new ATOM 0 HA GLU A 41 -12.495 4.220 6.863 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -13.711 2.199 7.579 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -14.515 3.104 8.845 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -15.512 4.585 7.050 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -14.824 3.507 5.852 1.00 0.00 H new ATOM 657 N SER A 42 -13.826 5.764 9.475 1.00 0.00 N ATOM 658 CA SER A 42 -14.337 7.046 9.943 1.00 0.00 C ATOM 659 C SER A 42 -13.322 8.161 9.683 1.00 0.00 C ATOM 660 O SER A 42 -13.678 9.245 9.224 1.00 0.00 O ATOM 661 CB SER A 42 -14.671 6.971 11.435 1.00 0.00 C ATOM 662 OG SER A 42 -15.609 5.939 11.696 1.00 0.00 O ATOM 0 H SER A 42 -13.763 5.047 10.198 1.00 0.00 H new ATOM 0 HA SER A 42 -15.248 7.275 9.390 1.00 0.00 H new ATOM 0 HB2 SER A 42 -13.760 6.792 12.006 1.00 0.00 H new ATOM 0 HB3 SER A 42 -15.074 7.927 11.769 1.00 0.00 H new ATOM 0 HG SER A 42 -15.166 5.068 11.622 1.00 0.00 H new ATOM 668 N LEU A 43 -12.051 7.878 9.951 1.00 0.00 N ATOM 669 CA LEU A 43 -10.991 8.859 9.749 1.00 0.00 C ATOM 670 C LEU A 43 -10.910 9.285 8.285 1.00 0.00 C ATOM 671 O LEU A 43 -10.696 10.459 7.986 1.00 0.00 O ATOM 672 CB LEU A 43 -9.645 8.296 10.207 1.00 0.00 C ATOM 673 CG LEU A 43 -9.550 7.972 11.700 1.00 0.00 C ATOM 674 CD1 LEU A 43 -8.194 7.369 12.031 1.00 0.00 C ATOM 675 CD2 LEU A 43 -9.796 9.219 12.536 1.00 0.00 C ATOM 0 H LEU A 43 -11.731 6.978 10.308 1.00 0.00 H new ATOM 0 HA LEU A 43 -11.229 9.737 10.349 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -9.437 7.388 9.640 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -8.864 9.014 9.957 1.00 0.00 H new ATOM 0 HG LEU A 43 -10.321 7.240 11.940 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -8.146 7.145 13.097 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -8.055 6.450 11.461 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -7.408 8.078 11.773 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -9.724 8.968 13.594 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -9.049 9.974 12.291 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -10.791 9.610 12.323 1.00 0.00 H new ATOM 687 N LEU A 44 -11.095 8.335 7.380 1.00 0.00 N ATOM 688 CA LEU A 44 -11.042 8.618 5.951 1.00 0.00 C ATOM 689 C LEU A 44 -12.341 9.271 5.478 1.00 0.00 C ATOM 690 O LEU A 44 -12.322 10.205 4.678 1.00 0.00 O ATOM 691 CB LEU A 44 -10.793 7.328 5.166 1.00 0.00 C ATOM 692 CG LEU A 44 -10.622 7.505 3.654 1.00 0.00 C ATOM 693 CD1 LEU A 44 -9.357 8.291 3.345 1.00 0.00 C ATOM 694 CD2 LEU A 44 -10.602 6.154 2.957 1.00 0.00 C ATOM 0 H LEU A 44 -11.284 7.359 7.609 1.00 0.00 H new ATOM 0 HA LEU A 44 -10.220 9.311 5.771 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -9.898 6.848 5.563 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -11.626 6.647 5.344 1.00 0.00 H new ATOM 0 HG LEU A 44 -11.473 8.071 3.276 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -9.254 8.406 2.266 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -9.417 9.275 3.810 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -8.492 7.757 3.737 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -10.480 6.300 1.884 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -9.772 5.560 3.339 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -11.540 5.632 3.148 1.00 0.00 H new ATOM 706 N ARG A 45 -13.461 8.781 5.998 1.00 0.00 N ATOM 707 CA ARG A 45 -14.782 9.236 5.574 1.00 0.00 C ATOM 708 C ARG A 45 -15.042 10.678 6.006 1.00 0.00 C ATOM 709 O ARG A 45 -15.715 11.430 5.303 1.00 0.00 O ATOM 710 CB ARG A 45 -15.860 8.303 6.135 1.00 0.00 C ATOM 711 CG ARG A 45 -17.264 8.597 5.626 1.00 0.00 C ATOM 712 CD ARG A 45 -18.260 7.581 6.157 1.00 0.00 C ATOM 713 NE ARG A 45 -19.626 7.852 5.715 1.00 0.00 N ATOM 714 CZ ARG A 45 -20.707 7.521 6.417 1.00 0.00 C ATOM 715 NH1 ARG A 45 -20.584 6.930 7.598 1.00 0.00 N ATOM 716 NH2 ARG A 45 -21.914 7.780 5.936 1.00 0.00 N ATOM 0 H ARG A 45 -13.480 8.062 6.721 1.00 0.00 H new ATOM 0 HA ARG A 45 -14.818 9.209 4.485 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -15.602 7.274 5.883 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -15.857 8.375 7.223 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -17.563 9.599 5.933 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -17.270 8.582 4.536 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -17.967 6.584 5.829 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -18.228 7.580 7.247 1.00 0.00 H new ATOM 0 HE ARG A 45 -19.758 8.321 4.819 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -19.657 6.727 7.973 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -21.416 6.679 8.132 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -22.015 8.233 5.028 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -22.743 7.526 6.474 1.00 0.00 H new ATOM 730 N ASN A 46 -14.520 11.067 7.160 1.00 0.00 N ATOM 731 CA ASN A 46 -14.660 12.446 7.615 1.00 0.00 C ATOM 732 C ASN A 46 -13.562 13.319 7.020 1.00 0.00 C ATOM 733 O ASN A 46 -13.725 14.532 6.884 1.00 0.00 O ATOM 734 CB ASN A 46 -14.637 12.535 9.141 1.00 0.00 C ATOM 735 CG ASN A 46 -15.861 11.914 9.782 1.00 0.00 C ATOM 736 OD1 ASN A 46 -15.876 10.727 10.090 1.00 0.00 O ATOM 737 ND2 ASN A 46 -16.897 12.711 9.985 1.00 0.00 N ATOM 0 H ASN A 46 -14.002 10.458 7.793 1.00 0.00 H new ATOM 0 HA ASN A 46 -15.628 12.811 7.271 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -13.743 12.037 9.516 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -14.567 13.581 9.439 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -17.747 12.343 10.412 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -16.845 13.693 9.715 1.00 0.00 H new ATOM 744 N GLY A 47 -12.447 12.696 6.660 1.00 0.00 N ATOM 745 CA GLY A 47 -11.366 13.415 6.011 1.00 0.00 C ATOM 746 C GLY A 47 -10.305 13.897 6.982 1.00 0.00 C ATOM 747 O GLY A 47 -9.918 15.065 6.955 1.00 0.00 O ATOM 0 H GLY A 47 -12.271 11.702 6.806 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -10.902 12.767 5.267 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -11.777 14.271 5.476 1.00 0.00 H new ATOM 751 N LYS A 48 -9.837 13.006 7.846 1.00 0.00 N ATOM 752 CA LYS A 48 -8.763 13.339 8.775 1.00 0.00 C ATOM 753 C LYS A 48 -7.423 12.846 8.243 1.00 0.00 C ATOM 754 O LYS A 48 -6.443 13.589 8.223 1.00 0.00 O ATOM 755 CB LYS A 48 -9.005 12.728 10.162 1.00 0.00 C ATOM 756 CG LYS A 48 -10.030 13.464 11.014 1.00 0.00 C ATOM 757 CD LYS A 48 -11.448 13.259 10.512 1.00 0.00 C ATOM 758 CE LYS A 48 -12.469 13.863 11.464 1.00 0.00 C ATOM 759 NZ LYS A 48 -12.409 15.348 11.498 1.00 0.00 N ATOM 0 H LYS A 48 -10.182 12.049 7.924 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.746 14.425 8.869 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -9.332 11.696 10.037 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -8.058 12.700 10.701 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -9.958 13.118 12.045 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -9.799 14.529 11.018 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -11.555 13.712 9.526 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -11.643 12.193 10.396 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -13.469 13.550 11.165 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -12.300 13.473 12.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -13.124 15.709 12.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -11.464 15.650 11.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -12.597 15.725 10.547 1.00 0.00 H new ATOM 773 N ILE A 49 -7.391 11.595 7.804 1.00 0.00 N ATOM 774 CA ILE A 49 -6.150 10.973 7.360 1.00 0.00 C ATOM 775 C ILE A 49 -6.003 11.056 5.848 1.00 0.00 C ATOM 776 O ILE A 49 -6.921 11.482 5.145 1.00 0.00 O ATOM 777 CB ILE A 49 -6.070 9.491 7.791 1.00 0.00 C ATOM 778 CG1 ILE A 49 -7.224 8.688 7.176 1.00 0.00 C ATOM 779 CG2 ILE A 49 -6.086 9.381 9.310 1.00 0.00 C ATOM 780 CD1 ILE A 49 -7.148 7.201 7.450 1.00 0.00 C ATOM 0 H ILE A 49 -8.210 10.990 7.746 1.00 0.00 H new ATOM 0 HA ILE A 49 -5.338 11.525 7.834 1.00 0.00 H new ATOM 0 HB ILE A 49 -5.132 9.073 7.425 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -8.168 9.072 7.563 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -7.233 8.849 6.098 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -6.029 8.332 9.599 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -5.232 9.918 9.723 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -7.008 9.814 9.696 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -7.997 6.701 6.984 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -6.221 6.802 7.038 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -7.171 7.028 8.526 1.00 0.00 H new ATOM 792 N THR A 50 -4.843 10.655 5.354 1.00 0.00 N ATOM 793 CA THR A 50 -4.604 10.606 3.925 1.00 0.00 C ATOM 794 C THR A 50 -4.696 9.171 3.423 1.00 0.00 C ATOM 795 O THR A 50 -4.730 8.226 4.219 1.00 0.00 O ATOM 796 CB THR A 50 -3.222 11.189 3.565 1.00 0.00 C ATOM 797 OG1 THR A 50 -2.198 10.536 4.329 1.00 0.00 O ATOM 798 CG2 THR A 50 -3.182 12.690 3.819 1.00 0.00 C ATOM 0 H THR A 50 -4.052 10.358 5.925 1.00 0.00 H new ATOM 0 HA THR A 50 -5.370 11.212 3.442 1.00 0.00 H new ATOM 0 HB THR A 50 -3.044 11.015 2.504 1.00 0.00 H new ATOM 0 HG1 THR A 50 -1.324 10.911 4.093 1.00 0.00 H new ATOM 0 HG21 THR A 50 -2.197 13.077 3.557 1.00 0.00 H new ATOM 0 HG22 THR A 50 -3.939 13.183 3.209 1.00 0.00 H new ATOM 0 HG23 THR A 50 -3.381 12.886 4.873 1.00 0.00 H new ATOM 806 N VAL A 51 -4.732 9.005 2.106 1.00 0.00 N ATOM 807 CA VAL A 51 -4.791 7.678 1.507 1.00 0.00 C ATOM 808 C VAL A 51 -3.515 6.902 1.824 1.00 0.00 C ATOM 809 O VAL A 51 -3.530 5.676 1.922 1.00 0.00 O ATOM 810 CB VAL A 51 -5.000 7.754 -0.022 1.00 0.00 C ATOM 811 CG1 VAL A 51 -5.116 6.365 -0.631 1.00 0.00 C ATOM 812 CG2 VAL A 51 -6.234 8.578 -0.347 1.00 0.00 C ATOM 0 H VAL A 51 -4.721 9.772 1.434 1.00 0.00 H new ATOM 0 HA VAL A 51 -5.647 7.156 1.935 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.127 8.241 -0.457 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -5.262 6.451 -1.708 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -4.203 5.803 -0.433 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -5.966 5.844 -0.190 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -6.368 8.622 -1.428 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.110 8.116 0.108 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.111 9.588 0.045 1.00 0.00 H new ATOM 822 N ARG A 52 -2.421 7.635 2.014 1.00 0.00 N ATOM 823 CA ARG A 52 -1.146 7.039 2.388 1.00 0.00 C ATOM 824 C ARG A 52 -1.301 6.205 3.656 1.00 0.00 C ATOM 825 O ARG A 52 -0.810 5.081 3.741 1.00 0.00 O ATOM 826 CB ARG A 52 -0.093 8.130 2.621 1.00 0.00 C ATOM 827 CG ARG A 52 1.337 7.628 2.497 1.00 0.00 C ATOM 828 CD ARG A 52 1.832 7.688 1.057 1.00 0.00 C ATOM 829 NE ARG A 52 0.823 7.231 0.097 1.00 0.00 N ATOM 830 CZ ARG A 52 1.019 6.258 -0.791 1.00 0.00 C ATOM 831 NH1 ARG A 52 2.198 5.652 -0.869 1.00 0.00 N ATOM 832 NH2 ARG A 52 0.043 5.907 -1.621 1.00 0.00 N ATOM 0 H ARG A 52 -2.395 8.650 1.914 1.00 0.00 H new ATOM 0 HA ARG A 52 -0.819 6.394 1.572 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -0.251 8.935 1.904 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -0.236 8.556 3.614 1.00 0.00 H new ATOM 0 HG2 ARG A 52 1.990 8.228 3.132 1.00 0.00 H new ATOM 0 HG3 ARG A 52 1.395 6.602 2.859 1.00 0.00 H new ATOM 0 HD2 ARG A 52 2.119 8.712 0.817 1.00 0.00 H new ATOM 0 HD3 ARG A 52 2.727 7.074 0.958 1.00 0.00 H new ATOM 0 HE ARG A 52 -0.089 7.688 0.110 1.00 0.00 H new ATOM 0 HH11 ARG A 52 2.957 5.931 -0.248 1.00 0.00 H new ATOM 0 HH12 ARG A 52 2.345 4.907 -1.550 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -0.858 6.383 -1.579 1.00 0.00 H new ATOM 0 HH22 ARG A 52 0.195 5.162 -2.301 1.00 0.00 H new ATOM 846 N GLU A 53 -2.008 6.761 4.634 1.00 0.00 N ATOM 847 CA GLU A 53 -2.213 6.085 5.909 1.00 0.00 C ATOM 848 C GLU A 53 -3.254 4.982 5.777 1.00 0.00 C ATOM 849 O GLU A 53 -3.155 3.945 6.435 1.00 0.00 O ATOM 850 CB GLU A 53 -2.647 7.080 6.979 1.00 0.00 C ATOM 851 CG GLU A 53 -1.647 8.195 7.207 1.00 0.00 C ATOM 852 CD GLU A 53 -2.049 9.105 8.343 1.00 0.00 C ATOM 853 OE1 GLU A 53 -2.860 10.028 8.114 1.00 0.00 O ATOM 854 OE2 GLU A 53 -1.551 8.907 9.470 1.00 0.00 O ATOM 0 H GLU A 53 -2.449 7.678 4.568 1.00 0.00 H new ATOM 0 HA GLU A 53 -1.265 5.636 6.206 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -3.605 7.514 6.693 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -2.806 6.547 7.917 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -0.668 7.764 7.419 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -1.546 8.781 6.294 1.00 0.00 H new ATOM 861 N PHE A 54 -4.252 5.216 4.933 1.00 0.00 N ATOM 862 CA PHE A 54 -5.278 4.218 4.668 1.00 0.00 C ATOM 863 C PHE A 54 -4.639 2.968 4.072 1.00 0.00 C ATOM 864 O PHE A 54 -4.903 1.850 4.516 1.00 0.00 O ATOM 865 CB PHE A 54 -6.341 4.785 3.721 1.00 0.00 C ATOM 866 CG PHE A 54 -7.497 3.855 3.481 1.00 0.00 C ATOM 867 CD1 PHE A 54 -8.426 3.615 4.481 1.00 0.00 C ATOM 868 CD2 PHE A 54 -7.656 3.222 2.257 1.00 0.00 C ATOM 869 CE1 PHE A 54 -9.490 2.762 4.265 1.00 0.00 C ATOM 870 CE2 PHE A 54 -8.718 2.370 2.036 1.00 0.00 C ATOM 871 CZ PHE A 54 -9.636 2.139 3.041 1.00 0.00 C ATOM 0 H PHE A 54 -4.371 6.090 4.420 1.00 0.00 H new ATOM 0 HA PHE A 54 -5.766 3.950 5.605 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -6.719 5.721 4.133 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -5.873 5.023 2.765 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -8.317 4.100 5.440 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -6.940 3.398 1.468 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -10.207 2.582 5.052 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -8.831 1.884 1.078 1.00 0.00 H new ATOM 0 HZ PHE A 54 -10.468 1.472 2.870 1.00 0.00 H new ATOM 881 N VAL A 55 -3.781 3.170 3.076 1.00 0.00 N ATOM 882 CA VAL A 55 -3.027 2.073 2.488 1.00 0.00 C ATOM 883 C VAL A 55 -2.119 1.442 3.537 1.00 0.00 C ATOM 884 O VAL A 55 -2.073 0.223 3.664 1.00 0.00 O ATOM 885 CB VAL A 55 -2.183 2.531 1.275 1.00 0.00 C ATOM 886 CG1 VAL A 55 -1.301 1.400 0.760 1.00 0.00 C ATOM 887 CG2 VAL A 55 -3.084 3.039 0.160 1.00 0.00 C ATOM 0 H VAL A 55 -3.592 4.083 2.661 1.00 0.00 H new ATOM 0 HA VAL A 55 -3.748 1.337 2.131 1.00 0.00 H new ATOM 0 HB VAL A 55 -1.537 3.344 1.606 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -0.720 1.751 -0.092 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -0.625 1.076 1.552 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -1.927 0.562 0.452 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -2.473 3.357 -0.685 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -3.755 2.241 -0.157 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -3.670 3.884 0.522 1.00 0.00 H new ATOM 897 N ARG A 56 -1.417 2.285 4.298 1.00 0.00 N ATOM 898 CA ARG A 56 -0.533 1.821 5.369 1.00 0.00 C ATOM 899 C ARG A 56 -1.238 0.814 6.278 1.00 0.00 C ATOM 900 O ARG A 56 -0.734 -0.289 6.506 1.00 0.00 O ATOM 901 CB ARG A 56 -0.042 3.012 6.204 1.00 0.00 C ATOM 902 CG ARG A 56 0.677 2.612 7.486 1.00 0.00 C ATOM 903 CD ARG A 56 1.023 3.821 8.343 1.00 0.00 C ATOM 904 NE ARG A 56 2.145 4.586 7.800 1.00 0.00 N ATOM 905 CZ ARG A 56 2.228 5.917 7.830 1.00 0.00 C ATOM 906 NH1 ARG A 56 1.244 6.643 8.347 1.00 0.00 N ATOM 907 NH2 ARG A 56 3.304 6.523 7.353 1.00 0.00 N ATOM 0 H ARG A 56 -1.445 3.299 4.191 1.00 0.00 H new ATOM 0 HA ARG A 56 0.319 1.325 4.904 1.00 0.00 H new ATOM 0 HB2 ARG A 56 0.630 3.617 5.596 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -0.895 3.641 6.458 1.00 0.00 H new ATOM 0 HG2 ARG A 56 0.048 1.930 8.058 1.00 0.00 H new ATOM 0 HG3 ARG A 56 1.590 2.070 7.237 1.00 0.00 H new ATOM 0 HD2 ARG A 56 0.150 4.469 8.423 1.00 0.00 H new ATOM 0 HD3 ARG A 56 1.267 3.490 9.352 1.00 0.00 H new ATOM 0 HE ARG A 56 2.913 4.069 7.371 1.00 0.00 H new ATOM 0 HH11 ARG A 56 0.416 6.183 8.726 1.00 0.00 H new ATOM 0 HH12 ARG A 56 1.316 7.660 8.366 1.00 0.00 H new ATOM 0 HH21 ARG A 56 4.069 5.972 6.963 1.00 0.00 H new ATOM 0 HH22 ARG A 56 3.368 7.541 7.376 1.00 0.00 H new ATOM 921 N ALA A 57 -2.408 1.202 6.773 1.00 0.00 N ATOM 922 CA ALA A 57 -3.159 0.391 7.721 1.00 0.00 C ATOM 923 C ALA A 57 -3.524 -0.969 7.134 1.00 0.00 C ATOM 924 O ALA A 57 -3.326 -2.001 7.774 1.00 0.00 O ATOM 925 CB ALA A 57 -4.413 1.131 8.162 1.00 0.00 C ATOM 0 H ALA A 57 -2.860 2.083 6.529 1.00 0.00 H new ATOM 0 HA ALA A 57 -2.522 0.214 8.588 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -4.968 0.516 8.871 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -4.133 2.070 8.638 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -5.038 1.337 7.293 1.00 0.00 H new ATOM 931 N VAL A 58 -4.042 -0.968 5.915 1.00 0.00 N ATOM 932 CA VAL A 58 -4.493 -2.204 5.282 1.00 0.00 C ATOM 933 C VAL A 58 -3.306 -3.058 4.836 1.00 0.00 C ATOM 934 O VAL A 58 -3.308 -4.277 5.016 1.00 0.00 O ATOM 935 CB VAL A 58 -5.406 -1.920 4.066 1.00 0.00 C ATOM 936 CG1 VAL A 58 -5.994 -3.212 3.522 1.00 0.00 C ATOM 937 CG2 VAL A 58 -6.512 -0.945 4.435 1.00 0.00 C ATOM 0 H VAL A 58 -4.161 -0.131 5.344 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.067 -2.751 6.030 1.00 0.00 H new ATOM 0 HB VAL A 58 -4.796 -1.464 3.286 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -6.633 -2.989 2.667 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.188 -3.875 3.209 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -6.584 -3.699 4.299 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -7.141 -0.761 3.564 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -7.118 -1.368 5.237 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -6.072 -0.006 4.770 1.00 0.00 H new ATOM 947 N ALA A 59 -2.288 -2.398 4.291 1.00 0.00 N ATOM 948 CA ALA A 59 -1.127 -3.074 3.714 1.00 0.00 C ATOM 949 C ALA A 59 -0.443 -4.001 4.710 1.00 0.00 C ATOM 950 O ALA A 59 -0.228 -5.176 4.424 1.00 0.00 O ATOM 951 CB ALA A 59 -0.129 -2.051 3.196 1.00 0.00 C ATOM 0 H ALA A 59 -2.243 -1.380 4.236 1.00 0.00 H new ATOM 0 HA ALA A 59 -1.490 -3.687 2.889 1.00 0.00 H new ATOM 0 HB1 ALA A 59 0.731 -2.566 2.769 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -0.602 -1.437 2.430 1.00 0.00 H new ATOM 0 HB3 ALA A 59 0.200 -1.415 4.018 1.00 0.00 H new ATOM 957 N LYS A 60 -0.108 -3.475 5.881 1.00 0.00 N ATOM 958 CA LYS A 60 0.612 -4.260 6.878 1.00 0.00 C ATOM 959 C LYS A 60 -0.336 -5.092 7.740 1.00 0.00 C ATOM 960 O LYS A 60 0.042 -5.572 8.807 1.00 0.00 O ATOM 961 CB LYS A 60 1.489 -3.358 7.753 1.00 0.00 C ATOM 962 CG LYS A 60 0.745 -2.215 8.430 1.00 0.00 C ATOM 963 CD LYS A 60 1.674 -1.403 9.319 1.00 0.00 C ATOM 964 CE LYS A 60 2.849 -0.824 8.538 1.00 0.00 C ATOM 965 NZ LYS A 60 3.878 -0.232 9.437 1.00 0.00 N ATOM 0 H LYS A 60 -0.320 -2.518 6.163 1.00 0.00 H new ATOM 0 HA LYS A 60 1.258 -4.954 6.339 1.00 0.00 H new ATOM 0 HB2 LYS A 60 1.965 -3.969 8.520 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.286 -2.941 7.138 1.00 0.00 H new ATOM 0 HG2 LYS A 60 0.303 -1.567 7.673 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -0.076 -2.614 9.026 1.00 0.00 H new ATOM 0 HD2 LYS A 60 1.114 -0.592 9.785 1.00 0.00 H new ATOM 0 HD3 LYS A 60 2.050 -2.035 10.124 1.00 0.00 H new ATOM 0 HE2 LYS A 60 3.304 -1.608 7.933 1.00 0.00 H new ATOM 0 HE3 LYS A 60 2.486 -0.061 7.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 4.805 -0.254 8.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 3.624 0.753 9.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 3.925 -0.781 10.319 1.00 0.00 H new ATOM 979 N SER A 61 -1.567 -5.261 7.279 1.00 0.00 N ATOM 980 CA SER A 61 -2.523 -6.088 7.991 1.00 0.00 C ATOM 981 C SER A 61 -2.799 -7.387 7.235 1.00 0.00 C ATOM 982 O SER A 61 -2.085 -8.373 7.418 1.00 0.00 O ATOM 983 CB SER A 61 -3.822 -5.320 8.248 1.00 0.00 C ATOM 984 OG SER A 61 -3.595 -4.224 9.116 1.00 0.00 O ATOM 0 H SER A 61 -1.923 -4.839 6.421 1.00 0.00 H new ATOM 0 HA SER A 61 -2.086 -6.349 8.955 1.00 0.00 H new ATOM 0 HB2 SER A 61 -4.231 -4.963 7.303 1.00 0.00 H new ATOM 0 HB3 SER A 61 -4.564 -5.988 8.685 1.00 0.00 H new ATOM 0 HG SER A 61 -3.173 -3.494 8.617 1.00 0.00 H new ATOM 990 N GLU A 62 -3.821 -7.373 6.377 1.00 0.00 N ATOM 991 CA GLU A 62 -4.270 -8.570 5.653 1.00 0.00 C ATOM 992 C GLU A 62 -4.446 -9.774 6.589 1.00 0.00 C ATOM 993 O GLU A 62 -4.240 -10.916 6.182 1.00 0.00 O ATOM 994 CB GLU A 62 -3.308 -8.918 4.507 1.00 0.00 C ATOM 995 CG GLU A 62 -3.282 -7.877 3.395 1.00 0.00 C ATOM 996 CD GLU A 62 -2.906 -8.471 2.050 1.00 0.00 C ATOM 997 OE1 GLU A 62 -3.769 -9.131 1.433 1.00 0.00 O ATOM 998 OE2 GLU A 62 -1.763 -8.271 1.589 1.00 0.00 O ATOM 0 H GLU A 62 -4.361 -6.535 6.163 1.00 0.00 H new ATOM 0 HA GLU A 62 -5.246 -8.336 5.227 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -2.302 -9.032 4.910 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -3.593 -9.882 4.085 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -4.262 -7.407 3.319 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -2.571 -7.092 3.653 1.00 0.00 H new ATOM 1005 N LEU A 63 -4.851 -9.496 7.836 1.00 0.00 N ATOM 1006 CA LEU A 63 -5.074 -10.526 8.866 1.00 0.00 C ATOM 1007 C LEU A 63 -3.768 -11.166 9.339 1.00 0.00 C ATOM 1008 O LEU A 63 -3.792 -12.114 10.126 1.00 0.00 O ATOM 1009 CB LEU A 63 -6.041 -11.610 8.376 1.00 0.00 C ATOM 1010 CG LEU A 63 -7.499 -11.170 8.245 1.00 0.00 C ATOM 1011 CD1 LEU A 63 -8.348 -12.305 7.694 1.00 0.00 C ATOM 1012 CD2 LEU A 63 -8.039 -10.706 9.591 1.00 0.00 C ATOM 0 H LEU A 63 -5.035 -8.547 8.162 1.00 0.00 H new ATOM 0 HA LEU A 63 -5.523 -10.014 9.717 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.698 -11.969 7.406 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -5.993 -12.455 9.063 1.00 0.00 H new ATOM 0 HG LEU A 63 -7.546 -10.333 7.548 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -9.383 -11.976 7.607 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -7.975 -12.594 6.711 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -8.295 -13.160 8.368 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -9.078 -10.396 9.479 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -7.979 -11.524 10.309 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -7.446 -9.865 9.950 1.00 0.00 H new ATOM 1024 N TYR A 64 -2.644 -10.626 8.868 1.00 0.00 N ATOM 1025 CA TYR A 64 -1.304 -11.088 9.243 1.00 0.00 C ATOM 1026 C TYR A 64 -1.010 -12.473 8.677 1.00 0.00 C ATOM 1027 O TYR A 64 -0.168 -12.620 7.793 1.00 0.00 O ATOM 1028 CB TYR A 64 -1.115 -11.079 10.763 1.00 0.00 C ATOM 1029 CG TYR A 64 -1.275 -9.708 11.381 1.00 0.00 C ATOM 1030 CD1 TYR A 64 -0.272 -8.756 11.266 1.00 0.00 C ATOM 1031 CD2 TYR A 64 -2.429 -9.368 12.075 1.00 0.00 C ATOM 1032 CE1 TYR A 64 -0.414 -7.501 11.826 1.00 0.00 C ATOM 1033 CE2 TYR A 64 -2.578 -8.116 12.637 1.00 0.00 C ATOM 1034 CZ TYR A 64 -1.568 -7.187 12.510 1.00 0.00 C ATOM 1035 OH TYR A 64 -1.714 -5.939 13.066 1.00 0.00 O ATOM 0 H TYR A 64 -2.636 -9.848 8.209 1.00 0.00 H new ATOM 0 HA TYR A 64 -0.591 -10.388 8.807 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -1.836 -11.759 11.215 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -0.123 -11.463 11.000 1.00 0.00 H new ATOM 0 HD1 TYR A 64 0.634 -9.000 10.730 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -3.222 -10.094 12.177 1.00 0.00 H new ATOM 0 HE1 TYR A 64 0.375 -6.770 11.728 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -3.481 -7.866 13.173 1.00 0.00 H new ATOM 0 HH TYR A 64 -2.585 -5.879 13.512 1.00 0.00 H new ATOM 1045 N LYS A 65 -1.696 -13.485 9.183 1.00 0.00 N ATOM 1046 CA LYS A 65 -1.518 -14.835 8.685 1.00 0.00 C ATOM 1047 C LYS A 65 -2.814 -15.632 8.818 1.00 0.00 C ATOM 1048 O LYS A 65 -3.316 -15.862 9.918 1.00 0.00 O ATOM 1049 CB LYS A 65 -0.350 -15.557 9.391 1.00 0.00 C ATOM 1050 CG LYS A 65 -0.607 -15.977 10.841 1.00 0.00 C ATOM 1051 CD LYS A 65 -0.547 -14.811 11.816 1.00 0.00 C ATOM 1052 CE LYS A 65 0.851 -14.225 11.901 1.00 0.00 C ATOM 1053 NZ LYS A 65 1.011 -13.339 13.084 1.00 0.00 N ATOM 0 H LYS A 65 -2.379 -13.396 9.936 1.00 0.00 H new ATOM 0 HA LYS A 65 -1.262 -14.765 7.628 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -0.095 -16.446 8.814 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.522 -14.903 9.371 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.587 -16.450 10.908 1.00 0.00 H new ATOM 0 HG3 LYS A 65 0.129 -16.726 11.133 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -1.248 -14.037 11.503 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -0.863 -15.146 12.804 1.00 0.00 H new ATOM 0 HE2 LYS A 65 1.581 -15.033 11.952 1.00 0.00 H new ATOM 0 HE3 LYS A 65 1.063 -13.660 10.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 1.979 -12.960 13.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 0.332 -12.553 13.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 0.834 -13.884 13.952 1.00 0.00 H new ATOM 1185 N PHE A 73 7.521 -20.487 1.351 1.00 0.00 N ATOM 1186 CA PHE A 73 8.695 -19.667 1.108 1.00 0.00 C ATOM 1187 C PHE A 73 8.434 -18.229 1.533 1.00 0.00 C ATOM 1188 O PHE A 73 7.422 -17.630 1.159 1.00 0.00 O ATOM 1189 CB PHE A 73 9.087 -19.723 -0.371 1.00 0.00 C ATOM 1190 CG PHE A 73 9.466 -21.101 -0.834 1.00 0.00 C ATOM 1191 CD1 PHE A 73 8.505 -21.973 -1.321 1.00 0.00 C ATOM 1192 CD2 PHE A 73 10.782 -21.527 -0.777 1.00 0.00 C ATOM 1193 CE1 PHE A 73 8.850 -23.242 -1.741 1.00 0.00 C ATOM 1194 CE2 PHE A 73 11.133 -22.796 -1.198 1.00 0.00 C ATOM 1195 CZ PHE A 73 10.166 -23.654 -1.679 1.00 0.00 C ATOM 0 HA PHE A 73 9.521 -20.059 1.701 1.00 0.00 H new ATOM 0 HB2 PHE A 73 8.255 -19.361 -0.974 1.00 0.00 H new ATOM 0 HB3 PHE A 73 9.924 -19.046 -0.544 1.00 0.00 H new ATOM 0 HD1 PHE A 73 7.474 -21.656 -1.373 1.00 0.00 H new ATOM 0 HD2 PHE A 73 11.543 -20.860 -0.399 1.00 0.00 H new ATOM 0 HE1 PHE A 73 8.091 -23.912 -2.118 1.00 0.00 H new ATOM 0 HE2 PHE A 73 12.164 -23.115 -1.150 1.00 0.00 H new ATOM 0 HZ PHE A 73 10.438 -24.647 -2.007 1.00 0.00 H new ATOM 1205 N GLN A 74 9.356 -17.680 2.314 1.00 0.00 N ATOM 1206 CA GLN A 74 9.229 -16.319 2.815 1.00 0.00 C ATOM 1207 C GLN A 74 9.269 -15.316 1.666 1.00 0.00 C ATOM 1208 O GLN A 74 8.707 -14.225 1.764 1.00 0.00 O ATOM 1209 CB GLN A 74 10.338 -16.018 3.828 1.00 0.00 C ATOM 1210 CG GLN A 74 10.331 -16.940 5.045 1.00 0.00 C ATOM 1211 CD GLN A 74 9.211 -16.651 6.035 1.00 0.00 C ATOM 1212 OE1 GLN A 74 9.362 -16.874 7.235 1.00 0.00 O ATOM 1213 NE2 GLN A 74 8.079 -16.160 5.554 1.00 0.00 N ATOM 0 H GLN A 74 10.204 -18.160 2.615 1.00 0.00 H new ATOM 0 HA GLN A 74 8.266 -16.226 3.316 1.00 0.00 H new ATOM 0 HB2 GLN A 74 11.304 -16.098 3.329 1.00 0.00 H new ATOM 0 HB3 GLN A 74 10.238 -14.986 4.165 1.00 0.00 H new ATOM 0 HG2 GLN A 74 10.244 -17.972 4.705 1.00 0.00 H new ATOM 0 HG3 GLN A 74 11.288 -16.853 5.559 1.00 0.00 H new ATOM 0 HE21 GLN A 74 7.983 -15.985 4.554 1.00 0.00 H new ATOM 0 HE22 GLN A 74 7.303 -15.956 6.184 1.00 0.00 H new ATOM 1222 N THR A 75 9.925 -15.703 0.579 1.00 0.00 N ATOM 1223 CA THR A 75 9.993 -14.874 -0.615 1.00 0.00 C ATOM 1224 C THR A 75 8.598 -14.639 -1.182 1.00 0.00 C ATOM 1225 O THR A 75 8.219 -13.510 -1.493 1.00 0.00 O ATOM 1226 CB THR A 75 10.871 -15.536 -1.697 1.00 0.00 C ATOM 1227 OG1 THR A 75 10.376 -16.850 -1.995 1.00 0.00 O ATOM 1228 CG2 THR A 75 12.318 -15.635 -1.243 1.00 0.00 C ATOM 0 H THR A 75 10.420 -16.592 0.501 1.00 0.00 H new ATOM 0 HA THR A 75 10.437 -13.920 -0.329 1.00 0.00 H new ATOM 0 HB THR A 75 10.828 -14.914 -2.591 1.00 0.00 H new ATOM 0 HG1 THR A 75 10.938 -17.263 -2.684 1.00 0.00 H new ATOM 0 HG21 THR A 75 12.913 -16.106 -2.025 1.00 0.00 H new ATOM 0 HG22 THR A 75 12.706 -14.636 -1.043 1.00 0.00 H new ATOM 0 HG23 THR A 75 12.374 -16.234 -0.334 1.00 0.00 H new ATOM 1236 N ARG A 76 7.832 -15.718 -1.273 1.00 0.00 N ATOM 1237 CA ARG A 76 6.507 -15.679 -1.875 1.00 0.00 C ATOM 1238 C ARG A 76 5.532 -14.884 -1.028 1.00 0.00 C ATOM 1239 O ARG A 76 4.586 -14.307 -1.553 1.00 0.00 O ATOM 1240 CB ARG A 76 5.980 -17.094 -2.096 1.00 0.00 C ATOM 1241 CG ARG A 76 6.816 -17.887 -3.079 1.00 0.00 C ATOM 1242 CD ARG A 76 6.233 -19.261 -3.335 1.00 0.00 C ATOM 1243 NE ARG A 76 7.014 -19.999 -4.322 1.00 0.00 N ATOM 1244 CZ ARG A 76 6.944 -21.311 -4.499 1.00 0.00 C ATOM 1245 NH1 ARG A 76 6.122 -22.040 -3.752 1.00 0.00 N ATOM 1246 NH2 ARG A 76 7.699 -21.894 -5.420 1.00 0.00 N ATOM 0 H ARG A 76 8.110 -16.639 -0.934 1.00 0.00 H new ATOM 0 HA ARG A 76 6.598 -15.178 -2.839 1.00 0.00 H new ATOM 0 HB2 ARG A 76 5.954 -17.620 -1.142 1.00 0.00 H new ATOM 0 HB3 ARG A 76 4.954 -17.042 -2.459 1.00 0.00 H new ATOM 0 HG2 ARG A 76 6.886 -17.341 -4.020 1.00 0.00 H new ATOM 0 HG3 ARG A 76 7.831 -17.989 -2.694 1.00 0.00 H new ATOM 0 HD2 ARG A 76 6.200 -19.823 -2.402 1.00 0.00 H new ATOM 0 HD3 ARG A 76 5.205 -19.162 -3.684 1.00 0.00 H new ATOM 0 HE ARG A 76 7.655 -19.471 -4.914 1.00 0.00 H new ATOM 0 HH11 ARG A 76 5.544 -21.590 -3.042 1.00 0.00 H new ATOM 0 HH12 ARG A 76 6.069 -23.049 -3.889 1.00 0.00 H new ATOM 0 HH21 ARG A 76 8.332 -21.333 -5.990 1.00 0.00 H new ATOM 0 HH22 ARG A 76 7.647 -22.903 -5.558 1.00 0.00 H new ATOM 1260 N VAL A 77 5.758 -14.859 0.281 1.00 0.00 N ATOM 1261 CA VAL A 77 4.942 -14.041 1.167 1.00 0.00 C ATOM 1262 C VAL A 77 5.045 -12.582 0.747 1.00 0.00 C ATOM 1263 O VAL A 77 4.035 -11.913 0.535 1.00 0.00 O ATOM 1264 CB VAL A 77 5.367 -14.181 2.646 1.00 0.00 C ATOM 1265 CG1 VAL A 77 4.478 -13.325 3.542 1.00 0.00 C ATOM 1266 CG2 VAL A 77 5.328 -15.639 3.082 1.00 0.00 C ATOM 0 H VAL A 77 6.493 -15.391 0.748 1.00 0.00 H new ATOM 0 HA VAL A 77 3.913 -14.390 1.084 1.00 0.00 H new ATOM 0 HB VAL A 77 6.393 -13.826 2.743 1.00 0.00 H new ATOM 0 HG11 VAL A 77 4.792 -13.437 4.580 1.00 0.00 H new ATOM 0 HG12 VAL A 77 4.564 -12.279 3.247 1.00 0.00 H new ATOM 0 HG13 VAL A 77 3.442 -13.647 3.440 1.00 0.00 H new ATOM 0 HG21 VAL A 77 5.631 -15.715 4.126 1.00 0.00 H new ATOM 0 HG22 VAL A 77 4.315 -16.026 2.969 1.00 0.00 H new ATOM 0 HG23 VAL A 77 6.010 -16.222 2.463 1.00 0.00 H new ATOM 1276 N ILE A 78 6.277 -12.120 0.583 1.00 0.00 N ATOM 1277 CA ILE A 78 6.536 -10.758 0.141 1.00 0.00 C ATOM 1278 C ILE A 78 5.926 -10.524 -1.238 1.00 0.00 C ATOM 1279 O ILE A 78 5.308 -9.488 -1.480 1.00 0.00 O ATOM 1280 CB ILE A 78 8.052 -10.464 0.100 1.00 0.00 C ATOM 1281 CG1 ILE A 78 8.669 -10.704 1.482 1.00 0.00 C ATOM 1282 CG2 ILE A 78 8.310 -9.034 -0.359 1.00 0.00 C ATOM 1283 CD1 ILE A 78 10.174 -10.543 1.519 1.00 0.00 C ATOM 0 H ILE A 78 7.117 -12.673 0.751 1.00 0.00 H new ATOM 0 HA ILE A 78 6.074 -10.080 0.858 1.00 0.00 H new ATOM 0 HB ILE A 78 8.520 -11.140 -0.616 1.00 0.00 H new ATOM 0 HG12 ILE A 78 8.222 -10.010 2.194 1.00 0.00 H new ATOM 0 HG13 ILE A 78 8.413 -11.710 1.813 1.00 0.00 H new ATOM 0 HG21 ILE A 78 9.384 -8.847 -0.381 1.00 0.00 H new ATOM 0 HG22 ILE A 78 7.896 -8.892 -1.357 1.00 0.00 H new ATOM 0 HG23 ILE A 78 7.835 -8.338 0.333 1.00 0.00 H new ATOM 0 HD11 ILE A 78 10.535 -10.729 2.531 1.00 0.00 H new ATOM 0 HD12 ILE A 78 10.633 -11.255 0.833 1.00 0.00 H new ATOM 0 HD13 ILE A 78 10.439 -9.529 1.220 1.00 0.00 H new ATOM 1295 N GLU A 79 6.082 -11.505 -2.126 1.00 0.00 N ATOM 1296 CA GLU A 79 5.522 -11.422 -3.475 1.00 0.00 C ATOM 1297 C GLU A 79 4.005 -11.244 -3.427 1.00 0.00 C ATOM 1298 O GLU A 79 3.436 -10.494 -4.222 1.00 0.00 O ATOM 1299 CB GLU A 79 5.863 -12.675 -4.291 1.00 0.00 C ATOM 1300 CG GLU A 79 7.353 -12.893 -4.496 1.00 0.00 C ATOM 1301 CD GLU A 79 7.652 -14.100 -5.364 1.00 0.00 C ATOM 1302 OE1 GLU A 79 7.552 -15.241 -4.863 1.00 0.00 O ATOM 1303 OE2 GLU A 79 8.000 -13.916 -6.549 1.00 0.00 O ATOM 0 H GLU A 79 6.592 -12.368 -1.936 1.00 0.00 H new ATOM 0 HA GLU A 79 5.967 -10.553 -3.959 1.00 0.00 H new ATOM 0 HB2 GLU A 79 5.444 -13.548 -3.790 1.00 0.00 H new ATOM 0 HB3 GLU A 79 5.379 -12.604 -5.265 1.00 0.00 H new ATOM 0 HG2 GLU A 79 7.787 -12.004 -4.954 1.00 0.00 H new ATOM 0 HG3 GLU A 79 7.835 -13.019 -3.526 1.00 0.00 H new ATOM 1310 N LEU A 80 3.360 -11.931 -2.488 1.00 0.00 N ATOM 1311 CA LEU A 80 1.913 -11.844 -2.328 1.00 0.00 C ATOM 1312 C LEU A 80 1.484 -10.422 -1.993 1.00 0.00 C ATOM 1313 O LEU A 80 0.678 -9.825 -2.708 1.00 0.00 O ATOM 1314 CB LEU A 80 1.423 -12.801 -1.235 1.00 0.00 C ATOM 1315 CG LEU A 80 1.584 -14.290 -1.546 1.00 0.00 C ATOM 1316 CD1 LEU A 80 1.111 -15.133 -0.373 1.00 0.00 C ATOM 1317 CD2 LEU A 80 0.821 -14.659 -2.810 1.00 0.00 C ATOM 0 H LEU A 80 3.819 -12.556 -1.825 1.00 0.00 H new ATOM 0 HA LEU A 80 1.462 -12.132 -3.278 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.962 -12.579 -0.314 1.00 0.00 H new ATOM 0 HB3 LEU A 80 0.369 -12.599 -1.045 1.00 0.00 H new ATOM 0 HG LEU A 80 2.642 -14.493 -1.713 1.00 0.00 H new ATOM 0 HD11 LEU A 80 1.233 -16.190 -0.612 1.00 0.00 H new ATOM 0 HD12 LEU A 80 1.701 -14.890 0.511 1.00 0.00 H new ATOM 0 HD13 LEU A 80 0.059 -14.924 -0.176 1.00 0.00 H new ATOM 0 HD21 LEU A 80 0.948 -15.722 -3.014 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -0.238 -14.440 -2.673 1.00 0.00 H new ATOM 0 HD23 LEU A 80 1.206 -14.080 -3.649 1.00 0.00 H new ATOM 1329 N ASN A 81 2.034 -9.874 -0.916 1.00 0.00 N ATOM 1330 CA ASN A 81 1.671 -8.530 -0.477 1.00 0.00 C ATOM 1331 C ASN A 81 2.108 -7.498 -1.514 1.00 0.00 C ATOM 1332 O ASN A 81 1.413 -6.511 -1.754 1.00 0.00 O ATOM 1333 CB ASN A 81 2.295 -8.208 0.886 1.00 0.00 C ATOM 1334 CG ASN A 81 1.942 -9.232 1.952 1.00 0.00 C ATOM 1335 OD1 ASN A 81 2.687 -10.177 2.190 1.00 0.00 O ATOM 1336 ND2 ASN A 81 0.794 -9.069 2.586 1.00 0.00 N ATOM 0 H ASN A 81 2.730 -10.337 -0.332 1.00 0.00 H new ATOM 0 HA ASN A 81 0.587 -8.490 -0.372 1.00 0.00 H new ATOM 0 HB2 ASN A 81 3.379 -8.158 0.782 1.00 0.00 H new ATOM 0 HB3 ASN A 81 1.960 -7.223 1.210 1.00 0.00 H new ATOM 0 HD21 ASN A 81 0.504 -9.740 3.297 1.00 0.00 H new ATOM 0 HD22 ASN A 81 0.198 -8.272 2.364 1.00 0.00 H new ATOM 1343 N TYR A 82 3.257 -7.752 -2.135 1.00 0.00 N ATOM 1344 CA TYR A 82 3.780 -6.908 -3.207 1.00 0.00 C ATOM 1345 C TYR A 82 2.744 -6.786 -4.323 1.00 0.00 C ATOM 1346 O TYR A 82 2.411 -5.686 -4.769 1.00 0.00 O ATOM 1347 CB TYR A 82 5.064 -7.539 -3.762 1.00 0.00 C ATOM 1348 CG TYR A 82 6.050 -6.573 -4.387 1.00 0.00 C ATOM 1349 CD1 TYR A 82 7.036 -5.973 -3.615 1.00 0.00 C ATOM 1350 CD2 TYR A 82 6.019 -6.289 -5.745 1.00 0.00 C ATOM 1351 CE1 TYR A 82 7.963 -5.119 -4.178 1.00 0.00 C ATOM 1352 CE2 TYR A 82 6.939 -5.430 -6.317 1.00 0.00 C ATOM 1353 CZ TYR A 82 7.910 -4.848 -5.529 1.00 0.00 C ATOM 1354 OH TYR A 82 8.841 -4.004 -6.095 1.00 0.00 O ATOM 0 H TYR A 82 3.852 -8.549 -1.909 1.00 0.00 H new ATOM 0 HA TYR A 82 3.998 -5.915 -2.815 1.00 0.00 H new ATOM 0 HB2 TYR A 82 5.566 -8.070 -2.953 1.00 0.00 H new ATOM 0 HB3 TYR A 82 4.788 -8.283 -4.509 1.00 0.00 H new ATOM 0 HD1 TYR A 82 7.078 -6.178 -2.555 1.00 0.00 H new ATOM 0 HD2 TYR A 82 5.263 -6.747 -6.366 1.00 0.00 H new ATOM 0 HE1 TYR A 82 8.726 -4.665 -3.563 1.00 0.00 H new ATOM 0 HE2 TYR A 82 6.898 -5.216 -7.375 1.00 0.00 H new ATOM 0 HH TYR A 82 9.706 -4.126 -5.650 1.00 0.00 H new ATOM 1364 N LYS A 83 2.227 -7.935 -4.741 1.00 0.00 N ATOM 1365 CA LYS A 83 1.232 -8.008 -5.801 1.00 0.00 C ATOM 1366 C LYS A 83 -0.083 -7.359 -5.367 1.00 0.00 C ATOM 1367 O LYS A 83 -0.730 -6.666 -6.149 1.00 0.00 O ATOM 1368 CB LYS A 83 0.989 -9.474 -6.171 1.00 0.00 C ATOM 1369 CG LYS A 83 0.117 -9.675 -7.399 1.00 0.00 C ATOM 1370 CD LYS A 83 -0.299 -11.130 -7.539 1.00 0.00 C ATOM 1371 CE LYS A 83 -1.062 -11.379 -8.828 1.00 0.00 C ATOM 1372 NZ LYS A 83 -2.149 -10.389 -9.034 1.00 0.00 N ATOM 0 H LYS A 83 2.487 -8.842 -4.354 1.00 0.00 H new ATOM 0 HA LYS A 83 1.609 -7.465 -6.668 1.00 0.00 H new ATOM 0 HB2 LYS A 83 1.951 -9.958 -6.340 1.00 0.00 H new ATOM 0 HB3 LYS A 83 0.524 -9.978 -5.324 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -0.769 -9.045 -7.327 1.00 0.00 H new ATOM 0 HG3 LYS A 83 0.660 -9.361 -8.290 1.00 0.00 H new ATOM 0 HD2 LYS A 83 0.587 -11.765 -7.513 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -0.920 -11.414 -6.689 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -0.372 -11.339 -9.671 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -1.486 -12.383 -8.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -2.777 -10.717 -9.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -2.695 -10.285 -8.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -1.737 -9.471 -9.296 1.00 0.00 H new ATOM 1386 N HIS A 84 -0.467 -7.588 -4.113 1.00 0.00 N ATOM 1387 CA HIS A 84 -1.723 -7.055 -3.579 1.00 0.00 C ATOM 1388 C HIS A 84 -1.718 -5.532 -3.576 1.00 0.00 C ATOM 1389 O HIS A 84 -2.719 -4.897 -3.907 1.00 0.00 O ATOM 1390 CB HIS A 84 -1.970 -7.542 -2.144 1.00 0.00 C ATOM 1391 CG HIS A 84 -2.179 -9.018 -2.005 1.00 0.00 C ATOM 1392 ND1 HIS A 84 -2.113 -9.670 -0.794 1.00 0.00 N ATOM 1393 CD2 HIS A 84 -2.452 -9.972 -2.928 1.00 0.00 C ATOM 1394 CE1 HIS A 84 -2.329 -10.958 -0.976 1.00 0.00 C ATOM 1395 NE2 HIS A 84 -2.540 -11.170 -2.261 1.00 0.00 N ATOM 0 H HIS A 84 0.073 -8.139 -3.446 1.00 0.00 H new ATOM 0 HA HIS A 84 -2.519 -7.418 -4.230 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -1.121 -7.251 -1.526 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -2.845 -7.027 -1.747 1.00 0.00 H new ATOM 0 HD1 HIS A 84 -1.926 -9.225 0.105 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -2.577 -9.819 -3.990 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -2.333 -11.712 -0.203 1.00 0.00 H new ATOM 1404 N LEU A 85 -0.589 -4.955 -3.197 1.00 0.00 N ATOM 1405 CA LEU A 85 -0.496 -3.517 -3.019 1.00 0.00 C ATOM 1406 C LEU A 85 -0.215 -2.791 -4.323 1.00 0.00 C ATOM 1407 O LEU A 85 -0.905 -1.839 -4.661 1.00 0.00 O ATOM 1408 CB LEU A 85 0.599 -3.181 -2.006 1.00 0.00 C ATOM 1409 CG LEU A 85 0.360 -3.710 -0.592 1.00 0.00 C ATOM 1410 CD1 LEU A 85 1.518 -3.337 0.319 1.00 0.00 C ATOM 1411 CD2 LEU A 85 -0.952 -3.176 -0.040 1.00 0.00 C ATOM 0 H LEU A 85 0.276 -5.462 -3.007 1.00 0.00 H new ATOM 0 HA LEU A 85 -1.464 -3.179 -2.650 1.00 0.00 H new ATOM 0 HB2 LEU A 85 1.545 -3.580 -2.371 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.708 -2.097 -1.958 1.00 0.00 H new ATOM 0 HG LEU A 85 0.296 -4.797 -0.635 1.00 0.00 H new ATOM 0 HD11 LEU A 85 1.331 -3.722 1.322 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.440 -3.769 -0.069 1.00 0.00 H new ATOM 0 HD13 LEU A 85 1.615 -2.252 0.359 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -1.107 -3.562 0.967 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -0.918 -2.087 -0.010 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -1.773 -3.495 -0.681 1.00 0.00 H new ATOM 1423 N LEU A 86 0.795 -3.238 -5.051 1.00 0.00 N ATOM 1424 CA LEU A 86 1.290 -2.478 -6.191 1.00 0.00 C ATOM 1425 C LEU A 86 0.704 -2.958 -7.510 1.00 0.00 C ATOM 1426 O LEU A 86 0.888 -2.304 -8.537 1.00 0.00 O ATOM 1427 CB LEU A 86 2.815 -2.559 -6.253 1.00 0.00 C ATOM 1428 CG LEU A 86 3.546 -2.044 -5.010 1.00 0.00 C ATOM 1429 CD1 LEU A 86 5.052 -2.169 -5.184 1.00 0.00 C ATOM 1430 CD2 LEU A 86 3.155 -0.602 -4.725 1.00 0.00 C ATOM 0 H LEU A 86 1.286 -4.115 -4.877 1.00 0.00 H new ATOM 0 HA LEU A 86 0.974 -1.445 -6.046 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.101 -3.598 -6.419 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.158 -1.991 -7.118 1.00 0.00 H new ATOM 0 HG LEU A 86 3.251 -2.655 -4.157 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.554 -1.798 -4.290 1.00 0.00 H new ATOM 0 HD12 LEU A 86 5.315 -3.215 -5.339 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.368 -1.583 -6.047 1.00 0.00 H new ATOM 0 HD21 LEU A 86 3.683 -0.250 -3.839 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.421 0.023 -5.578 1.00 0.00 H new ATOM 0 HD23 LEU A 86 2.080 -0.543 -4.554 1.00 0.00 H new ATOM 1442 N GLY A 87 0.019 -4.099 -7.491 1.00 0.00 N ATOM 1443 CA GLY A 87 -0.478 -4.686 -8.728 1.00 0.00 C ATOM 1444 C GLY A 87 0.660 -5.001 -9.678 1.00 0.00 C ATOM 1445 O GLY A 87 0.502 -4.984 -10.904 1.00 0.00 O ATOM 0 H GLY A 87 -0.201 -4.627 -6.646 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -1.032 -5.598 -8.505 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -1.175 -3.998 -9.206 1.00 0.00 H new ATOM 1449 N ARG A 88 1.806 -5.300 -9.090 1.00 0.00 N ATOM 1450 CA ARG A 88 3.045 -5.459 -9.822 1.00 0.00 C ATOM 1451 C ARG A 88 3.862 -6.569 -9.178 1.00 0.00 C ATOM 1452 O ARG A 88 3.879 -6.696 -7.955 1.00 0.00 O ATOM 1453 CB ARG A 88 3.813 -4.133 -9.776 1.00 0.00 C ATOM 1454 CG ARG A 88 5.019 -4.055 -10.697 1.00 0.00 C ATOM 1455 CD ARG A 88 5.731 -2.723 -10.520 1.00 0.00 C ATOM 1456 NE ARG A 88 6.769 -2.490 -11.523 1.00 0.00 N ATOM 1457 CZ ARG A 88 7.614 -1.459 -11.481 1.00 0.00 C ATOM 1458 NH1 ARG A 88 7.560 -0.593 -10.474 1.00 0.00 N ATOM 1459 NH2 ARG A 88 8.514 -1.298 -12.443 1.00 0.00 N ATOM 0 H ARG A 88 1.900 -5.440 -8.084 1.00 0.00 H new ATOM 0 HA ARG A 88 2.848 -5.724 -10.861 1.00 0.00 H new ATOM 0 HB2 ARG A 88 3.128 -3.325 -10.031 1.00 0.00 H new ATOM 0 HB3 ARG A 88 4.145 -3.958 -8.753 1.00 0.00 H new ATOM 0 HG2 ARG A 88 5.705 -4.874 -10.480 1.00 0.00 H new ATOM 0 HG3 ARG A 88 4.702 -4.171 -11.733 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.999 -1.917 -10.569 1.00 0.00 H new ATOM 0 HD3 ARG A 88 6.179 -2.686 -9.527 1.00 0.00 H new ATOM 0 HE ARG A 88 6.851 -3.151 -12.296 1.00 0.00 H new ATOM 0 HH11 ARG A 88 6.871 -0.716 -9.732 1.00 0.00 H new ATOM 0 HH12 ARG A 88 8.207 0.195 -10.444 1.00 0.00 H new ATOM 0 HH21 ARG A 88 8.560 -1.963 -13.215 1.00 0.00 H new ATOM 0 HH22 ARG A 88 9.160 -0.509 -12.410 1.00 0.00 H new ATOM 1473 N ALA A 89 4.518 -7.378 -9.991 1.00 0.00 N ATOM 1474 CA ALA A 89 5.332 -8.468 -9.479 1.00 0.00 C ATOM 1475 C ALA A 89 6.813 -8.180 -9.698 1.00 0.00 C ATOM 1476 O ALA A 89 7.185 -7.515 -10.669 1.00 0.00 O ATOM 1477 CB ALA A 89 4.933 -9.779 -10.142 1.00 0.00 C ATOM 0 H ALA A 89 4.504 -7.302 -11.008 1.00 0.00 H new ATOM 0 HA ALA A 89 5.160 -8.557 -8.406 1.00 0.00 H new ATOM 0 HB1 ALA A 89 5.550 -10.588 -9.750 1.00 0.00 H new ATOM 0 HB2 ALA A 89 3.884 -9.988 -9.932 1.00 0.00 H new ATOM 0 HB3 ALA A 89 5.079 -9.701 -11.219 1.00 0.00 H new ATOM 1483 N PRO A 90 7.675 -8.661 -8.784 1.00 0.00 N ATOM 1484 CA PRO A 90 9.126 -8.493 -8.900 1.00 0.00 C ATOM 1485 C PRO A 90 9.670 -9.137 -10.172 1.00 0.00 C ATOM 1486 O PRO A 90 9.380 -10.301 -10.471 1.00 0.00 O ATOM 1487 CB PRO A 90 9.681 -9.198 -7.656 1.00 0.00 C ATOM 1488 CG PRO A 90 8.582 -10.088 -7.186 1.00 0.00 C ATOM 1489 CD PRO A 90 7.305 -9.399 -7.566 1.00 0.00 C ATOM 0 HA PRO A 90 9.413 -7.443 -8.960 1.00 0.00 H new ATOM 0 HB2 PRO A 90 10.576 -9.771 -7.895 1.00 0.00 H new ATOM 0 HB3 PRO A 90 9.960 -8.478 -6.887 1.00 0.00 H new ATOM 0 HG2 PRO A 90 8.649 -11.071 -7.652 1.00 0.00 H new ATOM 0 HG3 PRO A 90 8.637 -10.242 -6.108 1.00 0.00 H new ATOM 0 HD2 PRO A 90 6.503 -10.112 -7.755 1.00 0.00 H new ATOM 0 HD3 PRO A 90 6.958 -8.730 -6.779 1.00 0.00 H new ATOM 1497 N TYR A 91 10.449 -8.370 -10.921 1.00 0.00 N ATOM 1498 CA TYR A 91 10.978 -8.823 -12.199 1.00 0.00 C ATOM 1499 C TYR A 91 12.207 -9.697 -11.998 1.00 0.00 C ATOM 1500 O TYR A 91 12.360 -10.728 -12.652 1.00 0.00 O ATOM 1501 CB TYR A 91 11.339 -7.624 -13.079 1.00 0.00 C ATOM 1502 CG TYR A 91 10.191 -6.668 -13.312 1.00 0.00 C ATOM 1503 CD1 TYR A 91 9.916 -5.656 -12.404 1.00 0.00 C ATOM 1504 CD2 TYR A 91 9.386 -6.776 -14.439 1.00 0.00 C ATOM 1505 CE1 TYR A 91 8.872 -4.779 -12.609 1.00 0.00 C ATOM 1506 CE2 TYR A 91 8.339 -5.900 -14.653 1.00 0.00 C ATOM 1507 CZ TYR A 91 8.086 -4.903 -13.734 1.00 0.00 C ATOM 1508 OH TYR A 91 7.041 -4.027 -13.937 1.00 0.00 O ATOM 0 H TYR A 91 10.730 -7.424 -10.663 1.00 0.00 H new ATOM 0 HA TYR A 91 10.206 -9.413 -12.693 1.00 0.00 H new ATOM 0 HB2 TYR A 91 12.163 -7.081 -12.616 1.00 0.00 H new ATOM 0 HB3 TYR A 91 11.698 -7.987 -14.042 1.00 0.00 H new ATOM 0 HD1 TYR A 91 10.530 -5.553 -11.522 1.00 0.00 H new ATOM 0 HD2 TYR A 91 9.582 -7.557 -15.159 1.00 0.00 H new ATOM 0 HE1 TYR A 91 8.671 -3.998 -11.891 1.00 0.00 H new ATOM 0 HE2 TYR A 91 7.722 -5.995 -15.535 1.00 0.00 H new ATOM 0 HH TYR A 91 6.738 -4.089 -14.867 1.00 0.00 H new ATOM 1518 N ASP A 92 13.077 -9.283 -11.090 1.00 0.00 N ATOM 1519 CA ASP A 92 14.315 -10.005 -10.840 1.00 0.00 C ATOM 1520 C ASP A 92 14.365 -10.522 -9.409 1.00 0.00 C ATOM 1521 O ASP A 92 13.460 -10.267 -8.611 1.00 0.00 O ATOM 1522 CB ASP A 92 15.533 -9.115 -11.117 1.00 0.00 C ATOM 1523 CG ASP A 92 15.560 -7.864 -10.262 1.00 0.00 C ATOM 1524 OD1 ASP A 92 15.907 -7.960 -9.068 1.00 0.00 O ATOM 1525 OD2 ASP A 92 15.247 -6.774 -10.789 1.00 0.00 O ATOM 0 H ASP A 92 12.949 -8.451 -10.514 1.00 0.00 H new ATOM 0 HA ASP A 92 14.343 -10.857 -11.519 1.00 0.00 H new ATOM 0 HB2 ASP A 92 16.443 -9.689 -10.940 1.00 0.00 H new ATOM 0 HB3 ASP A 92 15.536 -8.829 -12.169 1.00 0.00 H new ATOM 1530 N GLU A 93 15.433 -11.240 -9.090 1.00 0.00 N ATOM 1531 CA GLU A 93 15.584 -11.862 -7.785 1.00 0.00 C ATOM 1532 C GLU A 93 16.220 -10.887 -6.798 1.00 0.00 C ATOM 1533 O GLU A 93 15.961 -10.952 -5.595 1.00 0.00 O ATOM 1534 CB GLU A 93 16.447 -13.123 -7.908 1.00 0.00 C ATOM 1535 CG GLU A 93 16.547 -13.932 -6.625 1.00 0.00 C ATOM 1536 CD GLU A 93 17.523 -15.084 -6.742 1.00 0.00 C ATOM 1537 OE1 GLU A 93 17.140 -16.147 -7.277 1.00 0.00 O ATOM 1538 OE2 GLU A 93 18.685 -14.929 -6.313 1.00 0.00 O ATOM 0 H GLU A 93 16.214 -11.406 -9.725 1.00 0.00 H new ATOM 0 HA GLU A 93 14.598 -12.137 -7.412 1.00 0.00 H new ATOM 0 HB2 GLU A 93 16.036 -13.757 -8.694 1.00 0.00 H new ATOM 0 HB3 GLU A 93 17.450 -12.835 -8.223 1.00 0.00 H new ATOM 0 HG2 GLU A 93 16.857 -13.278 -5.810 1.00 0.00 H new ATOM 0 HG3 GLU A 93 15.562 -14.319 -6.365 1.00 0.00 H new ATOM 1545 N SER A 94 17.027 -9.970 -7.317 1.00 0.00 N ATOM 1546 CA SER A 94 17.781 -9.044 -6.480 1.00 0.00 C ATOM 1547 C SER A 94 16.837 -8.142 -5.689 1.00 0.00 C ATOM 1548 O SER A 94 17.097 -7.831 -4.525 1.00 0.00 O ATOM 1549 CB SER A 94 18.731 -8.205 -7.340 1.00 0.00 C ATOM 1550 OG SER A 94 19.620 -7.446 -6.537 1.00 0.00 O ATOM 0 H SER A 94 17.177 -9.847 -8.318 1.00 0.00 H new ATOM 0 HA SER A 94 18.373 -9.623 -5.771 1.00 0.00 H new ATOM 0 HB2 SER A 94 19.302 -8.859 -7.999 1.00 0.00 H new ATOM 0 HB3 SER A 94 18.153 -7.536 -7.978 1.00 0.00 H new ATOM 0 HG SER A 94 20.215 -6.922 -7.113 1.00 0.00 H new ATOM 1556 N GLU A 95 15.745 -7.732 -6.325 1.00 0.00 N ATOM 1557 CA GLU A 95 14.710 -6.958 -5.655 1.00 0.00 C ATOM 1558 C GLU A 95 14.190 -7.738 -4.450 1.00 0.00 C ATOM 1559 O GLU A 95 14.095 -7.212 -3.342 1.00 0.00 O ATOM 1560 CB GLU A 95 13.562 -6.656 -6.628 1.00 0.00 C ATOM 1561 CG GLU A 95 13.101 -5.201 -6.625 1.00 0.00 C ATOM 1562 CD GLU A 95 12.480 -4.767 -5.310 1.00 0.00 C ATOM 1563 OE1 GLU A 95 13.233 -4.398 -4.390 1.00 0.00 O ATOM 1564 OE2 GLU A 95 11.234 -4.787 -5.195 1.00 0.00 O ATOM 0 H GLU A 95 15.555 -7.925 -7.308 1.00 0.00 H new ATOM 0 HA GLU A 95 15.132 -6.013 -5.314 1.00 0.00 H new ATOM 0 HB2 GLU A 95 13.877 -6.923 -7.637 1.00 0.00 H new ATOM 0 HB3 GLU A 95 12.714 -7.294 -6.380 1.00 0.00 H new ATOM 0 HG2 GLU A 95 13.953 -4.558 -6.846 1.00 0.00 H new ATOM 0 HG3 GLU A 95 12.376 -5.056 -7.426 1.00 0.00 H new ATOM 1571 N VAL A 96 13.905 -9.017 -4.670 1.00 0.00 N ATOM 1572 CA VAL A 96 13.385 -9.882 -3.617 1.00 0.00 C ATOM 1573 C VAL A 96 14.409 -10.060 -2.498 1.00 0.00 C ATOM 1574 O VAL A 96 14.057 -10.030 -1.321 1.00 0.00 O ATOM 1575 CB VAL A 96 12.993 -11.271 -4.168 1.00 0.00 C ATOM 1576 CG1 VAL A 96 12.352 -12.125 -3.084 1.00 0.00 C ATOM 1577 CG2 VAL A 96 12.059 -11.132 -5.360 1.00 0.00 C ATOM 0 H VAL A 96 14.026 -9.479 -5.571 1.00 0.00 H new ATOM 0 HA VAL A 96 12.495 -9.395 -3.219 1.00 0.00 H new ATOM 0 HB VAL A 96 13.903 -11.771 -4.500 1.00 0.00 H new ATOM 0 HG11 VAL A 96 12.085 -13.098 -3.497 1.00 0.00 H new ATOM 0 HG12 VAL A 96 13.056 -12.260 -2.263 1.00 0.00 H new ATOM 0 HG13 VAL A 96 11.454 -11.630 -2.714 1.00 0.00 H new ATOM 0 HG21 VAL A 96 11.795 -12.122 -5.733 1.00 0.00 H new ATOM 0 HG22 VAL A 96 11.154 -10.606 -5.054 1.00 0.00 H new ATOM 0 HG23 VAL A 96 12.557 -10.568 -6.149 1.00 0.00 H new ATOM 1587 N ILE A 97 15.673 -10.229 -2.873 1.00 0.00 N ATOM 1588 CA ILE A 97 16.752 -10.413 -1.902 1.00 0.00 C ATOM 1589 C ILE A 97 16.841 -9.219 -0.952 1.00 0.00 C ATOM 1590 O ILE A 97 17.056 -9.382 0.252 1.00 0.00 O ATOM 1591 CB ILE A 97 18.116 -10.609 -2.602 1.00 0.00 C ATOM 1592 CG1 ILE A 97 18.075 -11.822 -3.539 1.00 0.00 C ATOM 1593 CG2 ILE A 97 19.228 -10.772 -1.574 1.00 0.00 C ATOM 1594 CD1 ILE A 97 17.737 -13.124 -2.845 1.00 0.00 C ATOM 0 H ILE A 97 15.979 -10.243 -3.846 1.00 0.00 H new ATOM 0 HA ILE A 97 16.518 -11.312 -1.332 1.00 0.00 H new ATOM 0 HB ILE A 97 18.323 -9.720 -3.198 1.00 0.00 H new ATOM 0 HG12 ILE A 97 17.340 -11.638 -4.323 1.00 0.00 H new ATOM 0 HG13 ILE A 97 19.044 -11.924 -4.028 1.00 0.00 H new ATOM 0 HG21 ILE A 97 20.180 -10.909 -2.087 1.00 0.00 H new ATOM 0 HG22 ILE A 97 19.278 -9.881 -0.948 1.00 0.00 H new ATOM 0 HG23 ILE A 97 19.023 -11.643 -0.951 1.00 0.00 H new ATOM 0 HD11 ILE A 97 17.728 -13.934 -3.575 1.00 0.00 H new ATOM 0 HD12 ILE A 97 18.485 -13.333 -2.080 1.00 0.00 H new ATOM 0 HD13 ILE A 97 16.755 -13.044 -2.380 1.00 0.00 H new ATOM 1606 N PHE A 98 16.660 -8.020 -1.498 1.00 0.00 N ATOM 1607 CA PHE A 98 16.676 -6.806 -0.692 1.00 0.00 C ATOM 1608 C PHE A 98 15.529 -6.826 0.315 1.00 0.00 C ATOM 1609 O PHE A 98 15.702 -6.459 1.479 1.00 0.00 O ATOM 1610 CB PHE A 98 16.576 -5.567 -1.586 1.00 0.00 C ATOM 1611 CG PHE A 98 16.607 -4.269 -0.827 1.00 0.00 C ATOM 1612 CD1 PHE A 98 17.796 -3.778 -0.317 1.00 0.00 C ATOM 1613 CD2 PHE A 98 15.444 -3.544 -0.626 1.00 0.00 C ATOM 1614 CE1 PHE A 98 17.826 -2.584 0.381 1.00 0.00 C ATOM 1615 CE2 PHE A 98 15.467 -2.351 0.071 1.00 0.00 C ATOM 1616 CZ PHE A 98 16.659 -1.871 0.573 1.00 0.00 C ATOM 0 H PHE A 98 16.501 -7.864 -2.493 1.00 0.00 H new ATOM 0 HA PHE A 98 17.620 -6.764 -0.148 1.00 0.00 H new ATOM 0 HB2 PHE A 98 17.398 -5.579 -2.301 1.00 0.00 H new ATOM 0 HB3 PHE A 98 15.652 -5.619 -2.162 1.00 0.00 H new ATOM 0 HD1 PHE A 98 18.711 -4.333 -0.466 1.00 0.00 H new ATOM 0 HD2 PHE A 98 14.509 -3.915 -1.018 1.00 0.00 H new ATOM 0 HE1 PHE A 98 18.760 -2.210 0.775 1.00 0.00 H new ATOM 0 HE2 PHE A 98 14.553 -1.795 0.222 1.00 0.00 H new ATOM 0 HZ PHE A 98 16.679 -0.938 1.116 1.00 0.00 H new ATOM 1626 N HIS A 99 14.362 -7.272 -0.139 1.00 0.00 N ATOM 1627 CA HIS A 99 13.195 -7.372 0.732 1.00 0.00 C ATOM 1628 C HIS A 99 13.412 -8.436 1.801 1.00 0.00 C ATOM 1629 O HIS A 99 13.017 -8.256 2.949 1.00 0.00 O ATOM 1630 CB HIS A 99 11.932 -7.694 -0.072 1.00 0.00 C ATOM 1631 CG HIS A 99 11.439 -6.554 -0.902 1.00 0.00 C ATOM 1632 ND1 HIS A 99 10.737 -5.496 -0.379 1.00 0.00 N ATOM 1633 CD2 HIS A 99 11.557 -6.309 -2.223 1.00 0.00 C ATOM 1634 CE1 HIS A 99 10.443 -4.646 -1.342 1.00 0.00 C ATOM 1635 NE2 HIS A 99 10.932 -5.116 -2.475 1.00 0.00 N ATOM 0 H HIS A 99 14.199 -7.569 -1.101 1.00 0.00 H new ATOM 0 HA HIS A 99 13.060 -6.405 1.216 1.00 0.00 H new ATOM 0 HB2 HIS A 99 12.134 -8.545 -0.723 1.00 0.00 H new ATOM 0 HB3 HIS A 99 11.143 -7.999 0.615 1.00 0.00 H new ATOM 0 HD1 HIS A 99 10.483 -5.385 0.603 1.00 0.00 H new ATOM 0 HD2 HIS A 99 12.053 -6.937 -2.948 1.00 0.00 H new ATOM 0 HE1 HIS A 99 9.896 -3.722 -1.225 1.00 0.00 H new ATOM 1644 N LEU A 100 14.049 -9.538 1.416 1.00 0.00 N ATOM 1645 CA LEU A 100 14.332 -10.630 2.345 1.00 0.00 C ATOM 1646 C LEU A 100 15.160 -10.147 3.526 1.00 0.00 C ATOM 1647 O LEU A 100 14.830 -10.423 4.679 1.00 0.00 O ATOM 1648 CB LEU A 100 15.063 -11.769 1.635 1.00 0.00 C ATOM 1649 CG LEU A 100 14.238 -12.512 0.586 1.00 0.00 C ATOM 1650 CD1 LEU A 100 15.078 -13.584 -0.082 1.00 0.00 C ATOM 1651 CD2 LEU A 100 12.996 -13.123 1.221 1.00 0.00 C ATOM 0 H LEU A 100 14.380 -9.700 0.465 1.00 0.00 H new ATOM 0 HA LEU A 100 13.376 -10.998 2.718 1.00 0.00 H new ATOM 0 HB2 LEU A 100 15.954 -11.365 1.155 1.00 0.00 H new ATOM 0 HB3 LEU A 100 15.401 -12.486 2.383 1.00 0.00 H new ATOM 0 HG LEU A 100 13.919 -11.799 -0.175 1.00 0.00 H new ATOM 0 HD11 LEU A 100 14.477 -14.105 -0.827 1.00 0.00 H new ATOM 0 HD12 LEU A 100 15.938 -13.123 -0.567 1.00 0.00 H new ATOM 0 HD13 LEU A 100 15.423 -14.296 0.668 1.00 0.00 H new ATOM 0 HD21 LEU A 100 12.419 -13.649 0.460 1.00 0.00 H new ATOM 0 HD22 LEU A 100 13.293 -13.825 2.000 1.00 0.00 H new ATOM 0 HD23 LEU A 100 12.385 -12.333 1.658 1.00 0.00 H new ATOM 1663 N ASP A 101 16.229 -9.414 3.234 1.00 0.00 N ATOM 1664 CA ASP A 101 17.085 -8.880 4.283 1.00 0.00 C ATOM 1665 C ASP A 101 16.297 -7.950 5.190 1.00 0.00 C ATOM 1666 O ASP A 101 16.347 -8.082 6.402 1.00 0.00 O ATOM 1667 CB ASP A 101 18.289 -8.141 3.702 1.00 0.00 C ATOM 1668 CG ASP A 101 19.251 -7.697 4.787 1.00 0.00 C ATOM 1669 OD1 ASP A 101 20.142 -8.496 5.165 1.00 0.00 O ATOM 1670 OD2 ASP A 101 19.125 -6.556 5.272 1.00 0.00 O ATOM 0 H ASP A 101 16.521 -9.178 2.286 1.00 0.00 H new ATOM 0 HA ASP A 101 17.454 -9.724 4.866 1.00 0.00 H new ATOM 0 HB2 ASP A 101 18.809 -8.790 2.998 1.00 0.00 H new ATOM 0 HB3 ASP A 101 17.946 -7.271 3.141 1.00 0.00 H new ATOM 1675 N LEU A 102 15.540 -7.039 4.593 1.00 0.00 N ATOM 1676 CA LEU A 102 14.743 -6.081 5.356 1.00 0.00 C ATOM 1677 C LEU A 102 13.709 -6.799 6.229 1.00 0.00 C ATOM 1678 O LEU A 102 13.555 -6.488 7.416 1.00 0.00 O ATOM 1679 CB LEU A 102 14.053 -5.104 4.400 1.00 0.00 C ATOM 1680 CG LEU A 102 13.209 -4.015 5.065 1.00 0.00 C ATOM 1681 CD1 LEU A 102 14.046 -3.193 6.031 1.00 0.00 C ATOM 1682 CD2 LEU A 102 12.591 -3.112 4.010 1.00 0.00 C ATOM 0 H LEU A 102 15.459 -6.941 3.581 1.00 0.00 H new ATOM 0 HA LEU A 102 15.408 -5.524 6.017 1.00 0.00 H new ATOM 0 HB2 LEU A 102 14.815 -4.624 3.787 1.00 0.00 H new ATOM 0 HB3 LEU A 102 13.413 -5.674 3.726 1.00 0.00 H new ATOM 0 HG LEU A 102 12.412 -4.499 5.630 1.00 0.00 H new ATOM 0 HD11 LEU A 102 13.423 -2.426 6.490 1.00 0.00 H new ATOM 0 HD12 LEU A 102 14.451 -3.844 6.806 1.00 0.00 H new ATOM 0 HD13 LEU A 102 14.865 -2.719 5.490 1.00 0.00 H new ATOM 0 HD21 LEU A 102 11.993 -2.341 4.496 1.00 0.00 H new ATOM 0 HD22 LEU A 102 13.382 -2.643 3.425 1.00 0.00 H new ATOM 0 HD23 LEU A 102 11.955 -3.704 3.352 1.00 0.00 H new ATOM 1694 N TYR A 103 13.028 -7.772 5.634 1.00 0.00 N ATOM 1695 CA TYR A 103 12.020 -8.570 6.326 1.00 0.00 C ATOM 1696 C TYR A 103 12.610 -9.298 7.536 1.00 0.00 C ATOM 1697 O TYR A 103 11.995 -9.347 8.602 1.00 0.00 O ATOM 1698 CB TYR A 103 11.399 -9.579 5.347 1.00 0.00 C ATOM 1699 CG TYR A 103 10.609 -10.689 6.008 1.00 0.00 C ATOM 1700 CD1 TYR A 103 9.354 -10.453 6.553 1.00 0.00 C ATOM 1701 CD2 TYR A 103 11.130 -11.974 6.091 1.00 0.00 C ATOM 1702 CE1 TYR A 103 8.640 -11.467 7.161 1.00 0.00 C ATOM 1703 CE2 TYR A 103 10.423 -12.992 6.699 1.00 0.00 C ATOM 1704 CZ TYR A 103 9.180 -12.733 7.232 1.00 0.00 C ATOM 1705 OH TYR A 103 8.477 -13.745 7.847 1.00 0.00 O ATOM 0 H TYR A 103 13.159 -8.031 4.656 1.00 0.00 H new ATOM 0 HA TYR A 103 11.247 -7.896 6.695 1.00 0.00 H new ATOM 0 HB2 TYR A 103 10.744 -9.044 4.660 1.00 0.00 H new ATOM 0 HB3 TYR A 103 12.195 -10.023 4.749 1.00 0.00 H new ATOM 0 HD1 TYR A 103 8.930 -9.461 6.501 1.00 0.00 H new ATOM 0 HD2 TYR A 103 12.104 -12.180 5.673 1.00 0.00 H new ATOM 0 HE1 TYR A 103 7.664 -11.269 7.579 1.00 0.00 H new ATOM 0 HE2 TYR A 103 10.842 -13.986 6.756 1.00 0.00 H new ATOM 0 HH TYR A 103 8.961 -14.591 7.741 1.00 0.00 H new ATOM 1715 N GLU A 104 13.801 -9.854 7.379 1.00 0.00 N ATOM 1716 CA GLU A 104 14.416 -10.628 8.449 1.00 0.00 C ATOM 1717 C GLU A 104 15.228 -9.741 9.392 1.00 0.00 C ATOM 1718 O GLU A 104 15.538 -10.139 10.516 1.00 0.00 O ATOM 1719 CB GLU A 104 15.301 -11.731 7.869 1.00 0.00 C ATOM 1720 CG GLU A 104 14.548 -12.708 6.981 1.00 0.00 C ATOM 1721 CD GLU A 104 15.360 -13.941 6.654 1.00 0.00 C ATOM 1722 OE1 GLU A 104 16.139 -13.907 5.683 1.00 0.00 O ATOM 1723 OE2 GLU A 104 15.226 -14.953 7.381 1.00 0.00 O ATOM 0 H GLU A 104 14.359 -9.785 6.528 1.00 0.00 H new ATOM 0 HA GLU A 104 13.613 -11.083 9.029 1.00 0.00 H new ATOM 0 HB2 GLU A 104 16.106 -11.275 7.293 1.00 0.00 H new ATOM 0 HB3 GLU A 104 15.766 -12.280 8.687 1.00 0.00 H new ATOM 0 HG2 GLU A 104 13.625 -13.007 7.477 1.00 0.00 H new ATOM 0 HG3 GLU A 104 14.265 -12.208 6.055 1.00 0.00 H new ATOM 1730 N ASN A 105 15.571 -8.548 8.933 1.00 0.00 N ATOM 1731 CA ASN A 105 16.388 -7.628 9.719 1.00 0.00 C ATOM 1732 C ASN A 105 15.534 -6.808 10.669 1.00 0.00 C ATOM 1733 O ASN A 105 15.730 -6.845 11.883 1.00 0.00 O ATOM 1734 CB ASN A 105 17.164 -6.686 8.798 1.00 0.00 C ATOM 1735 CG ASN A 105 18.653 -6.712 9.054 1.00 0.00 C ATOM 1736 OD1 ASN A 105 19.104 -6.871 10.190 1.00 0.00 O ATOM 1737 ND2 ASN A 105 19.429 -6.570 7.994 1.00 0.00 N ATOM 0 H ASN A 105 15.297 -8.190 8.018 1.00 0.00 H new ATOM 0 HA ASN A 105 17.087 -8.226 10.304 1.00 0.00 H new ATOM 0 HB2 ASN A 105 16.973 -6.961 7.761 1.00 0.00 H new ATOM 0 HB3 ASN A 105 16.795 -5.669 8.931 1.00 0.00 H new ATOM 0 HD21 ASN A 105 20.443 -6.590 8.098 1.00 0.00 H new ATOM 0 HD22 ASN A 105 19.014 -6.441 7.071 1.00 0.00 H new ATOM 1744 N GLU A 106 14.580 -6.075 10.117 1.00 0.00 N ATOM 1745 CA GLU A 106 13.762 -5.177 10.917 1.00 0.00 C ATOM 1746 C GLU A 106 12.359 -5.737 11.117 1.00 0.00 C ATOM 1747 O GLU A 106 11.749 -5.535 12.168 1.00 0.00 O ATOM 1748 CB GLU A 106 13.716 -3.788 10.276 1.00 0.00 C ATOM 1749 CG GLU A 106 15.074 -3.103 10.245 1.00 0.00 C ATOM 1750 CD GLU A 106 15.015 -1.688 9.712 1.00 0.00 C ATOM 1751 OE1 GLU A 106 14.419 -0.821 10.384 1.00 0.00 O ATOM 1752 OE2 GLU A 106 15.590 -1.427 8.633 1.00 0.00 O ATOM 0 H GLU A 106 14.354 -6.084 9.122 1.00 0.00 H new ATOM 0 HA GLU A 106 14.219 -5.086 11.902 1.00 0.00 H new ATOM 0 HB2 GLU A 106 13.336 -3.876 9.258 1.00 0.00 H new ATOM 0 HB3 GLU A 106 13.012 -3.163 10.826 1.00 0.00 H new ATOM 0 HG2 GLU A 106 15.489 -3.088 11.253 1.00 0.00 H new ATOM 0 HG3 GLU A 106 15.755 -3.689 9.628 1.00 0.00 H new ATOM 1759 N GLY A 107 11.848 -6.449 10.120 1.00 0.00 N ATOM 1760 CA GLY A 107 10.565 -7.102 10.278 1.00 0.00 C ATOM 1761 C GLY A 107 9.684 -6.998 9.049 1.00 0.00 C ATOM 1762 O GLY A 107 10.000 -6.275 8.101 1.00 0.00 O ATOM 0 H GLY A 107 12.295 -6.585 9.213 1.00 0.00 H new ATOM 0 HA2 GLY A 107 10.727 -8.154 10.512 1.00 0.00 H new ATOM 0 HA3 GLY A 107 10.044 -6.663 11.128 1.00 0.00 H new ATOM 1766 N PHE A 108 8.565 -7.714 9.086 1.00 0.00 N ATOM 1767 CA PHE A 108 7.598 -7.708 7.994 1.00 0.00 C ATOM 1768 C PHE A 108 6.944 -6.339 7.895 1.00 0.00 C ATOM 1769 O PHE A 108 6.695 -5.828 6.803 1.00 0.00 O ATOM 1770 CB PHE A 108 6.538 -8.790 8.236 1.00 0.00 C ATOM 1771 CG PHE A 108 5.472 -8.857 7.179 1.00 0.00 C ATOM 1772 CD1 PHE A 108 5.750 -9.382 5.926 1.00 0.00 C ATOM 1773 CD2 PHE A 108 4.188 -8.405 7.444 1.00 0.00 C ATOM 1774 CE1 PHE A 108 4.768 -9.452 4.957 1.00 0.00 C ATOM 1775 CE2 PHE A 108 3.203 -8.472 6.477 1.00 0.00 C ATOM 1776 CZ PHE A 108 3.493 -8.998 5.233 1.00 0.00 C ATOM 0 H PHE A 108 8.304 -8.312 9.870 1.00 0.00 H new ATOM 0 HA PHE A 108 8.109 -7.921 7.055 1.00 0.00 H new ATOM 0 HB2 PHE A 108 7.033 -9.759 8.299 1.00 0.00 H new ATOM 0 HB3 PHE A 108 6.065 -8.610 9.202 1.00 0.00 H new ATOM 0 HD1 PHE A 108 6.745 -9.740 5.705 1.00 0.00 H new ATOM 0 HD2 PHE A 108 3.955 -7.996 8.416 1.00 0.00 H new ATOM 0 HE1 PHE A 108 4.997 -9.861 3.984 1.00 0.00 H new ATOM 0 HE2 PHE A 108 2.208 -8.114 6.694 1.00 0.00 H new ATOM 0 HZ PHE A 108 2.724 -9.054 4.477 1.00 0.00 H new ATOM 1786 N ASP A 109 6.683 -5.752 9.056 1.00 0.00 N ATOM 1787 CA ASP A 109 6.117 -4.413 9.141 1.00 0.00 C ATOM 1788 C ASP A 109 6.995 -3.412 8.397 1.00 0.00 C ATOM 1789 O ASP A 109 6.499 -2.537 7.688 1.00 0.00 O ATOM 1790 CB ASP A 109 5.984 -3.997 10.609 1.00 0.00 C ATOM 1791 CG ASP A 109 5.396 -2.610 10.775 1.00 0.00 C ATOM 1792 OD1 ASP A 109 6.157 -1.623 10.765 1.00 0.00 O ATOM 1793 OD2 ASP A 109 4.164 -2.498 10.916 1.00 0.00 O ATOM 0 H ASP A 109 6.857 -6.189 9.961 1.00 0.00 H new ATOM 0 HA ASP A 109 5.131 -4.422 8.677 1.00 0.00 H new ATOM 0 HB2 ASP A 109 5.355 -4.718 11.131 1.00 0.00 H new ATOM 0 HB3 ASP A 109 6.966 -4.030 11.082 1.00 0.00 H new ATOM 1798 N ALA A 110 8.306 -3.576 8.542 1.00 0.00 N ATOM 1799 CA ALA A 110 9.269 -2.662 7.946 1.00 0.00 C ATOM 1800 C ALA A 110 9.312 -2.797 6.429 1.00 0.00 C ATOM 1801 O ALA A 110 9.407 -1.798 5.716 1.00 0.00 O ATOM 1802 CB ALA A 110 10.647 -2.900 8.537 1.00 0.00 C ATOM 0 H ALA A 110 8.726 -4.340 9.071 1.00 0.00 H new ATOM 0 HA ALA A 110 8.950 -1.645 8.175 1.00 0.00 H new ATOM 0 HB1 ALA A 110 11.361 -2.211 8.085 1.00 0.00 H new ATOM 0 HB2 ALA A 110 10.615 -2.734 9.614 1.00 0.00 H new ATOM 0 HB3 ALA A 110 10.956 -3.926 8.337 1.00 0.00 H new ATOM 1808 N ASP A 111 9.234 -4.025 5.935 1.00 0.00 N ATOM 1809 CA ASP A 111 9.283 -4.251 4.494 1.00 0.00 C ATOM 1810 C ASP A 111 8.031 -3.701 3.823 1.00 0.00 C ATOM 1811 O ASP A 111 8.104 -3.086 2.761 1.00 0.00 O ATOM 1812 CB ASP A 111 9.453 -5.732 4.166 1.00 0.00 C ATOM 1813 CG ASP A 111 9.706 -5.945 2.687 1.00 0.00 C ATOM 1814 OD1 ASP A 111 10.791 -5.551 2.210 1.00 0.00 O ATOM 1815 OD2 ASP A 111 8.826 -6.488 1.994 1.00 0.00 O ATOM 0 H ASP A 111 9.138 -4.869 6.499 1.00 0.00 H new ATOM 0 HA ASP A 111 10.152 -3.720 4.106 1.00 0.00 H new ATOM 0 HB2 ASP A 111 10.284 -6.141 4.741 1.00 0.00 H new ATOM 0 HB3 ASP A 111 8.558 -6.278 4.466 1.00 0.00 H new ATOM 1820 N ILE A 112 6.885 -3.896 4.461 1.00 0.00 N ATOM 1821 CA ILE A 112 5.631 -3.334 3.972 1.00 0.00 C ATOM 1822 C ILE A 112 5.683 -1.807 4.011 1.00 0.00 C ATOM 1823 O ILE A 112 5.144 -1.123 3.137 1.00 0.00 O ATOM 1824 CB ILE A 112 4.433 -3.822 4.822 1.00 0.00 C ATOM 1825 CG1 ILE A 112 4.257 -5.336 4.682 1.00 0.00 C ATOM 1826 CG2 ILE A 112 3.155 -3.095 4.429 1.00 0.00 C ATOM 1827 CD1 ILE A 112 3.870 -5.776 3.288 1.00 0.00 C ATOM 0 H ILE A 112 6.797 -4.440 5.320 1.00 0.00 H new ATOM 0 HA ILE A 112 5.496 -3.671 2.944 1.00 0.00 H new ATOM 0 HB ILE A 112 4.643 -3.594 5.867 1.00 0.00 H new ATOM 0 HG12 ILE A 112 5.188 -5.829 4.964 1.00 0.00 H new ATOM 0 HG13 ILE A 112 3.494 -5.671 5.384 1.00 0.00 H new ATOM 0 HG21 ILE A 112 2.328 -3.456 5.041 1.00 0.00 H new ATOM 0 HG22 ILE A 112 3.282 -2.024 4.587 1.00 0.00 H new ATOM 0 HG23 ILE A 112 2.938 -3.284 3.378 1.00 0.00 H new ATOM 0 HD11 ILE A 112 3.763 -6.861 3.265 1.00 0.00 H new ATOM 0 HD12 ILE A 112 2.924 -5.312 3.010 1.00 0.00 H new ATOM 0 HD13 ILE A 112 4.644 -5.473 2.583 1.00 0.00 H new ATOM 1839 N ASP A 113 6.370 -1.289 5.015 1.00 0.00 N ATOM 1840 CA ASP A 113 6.432 0.145 5.259 1.00 0.00 C ATOM 1841 C ASP A 113 7.257 0.858 4.189 1.00 0.00 C ATOM 1842 O ASP A 113 7.117 2.062 4.000 1.00 0.00 O ATOM 1843 CB ASP A 113 7.024 0.420 6.645 1.00 0.00 C ATOM 1844 CG ASP A 113 6.732 1.823 7.136 1.00 0.00 C ATOM 1845 OD1 ASP A 113 5.584 2.075 7.568 1.00 0.00 O ATOM 1846 OD2 ASP A 113 7.647 2.675 7.111 1.00 0.00 O ATOM 0 H ASP A 113 6.900 -1.848 5.684 1.00 0.00 H new ATOM 0 HA ASP A 113 5.415 0.535 5.217 1.00 0.00 H new ATOM 0 HB2 ASP A 113 6.622 -0.301 7.357 1.00 0.00 H new ATOM 0 HB3 ASP A 113 8.103 0.268 6.612 1.00 0.00 H new ATOM 1851 N SER A 114 8.107 0.107 3.488 1.00 0.00 N ATOM 1852 CA SER A 114 9.003 0.680 2.479 1.00 0.00 C ATOM 1853 C SER A 114 8.237 1.502 1.438 1.00 0.00 C ATOM 1854 O SER A 114 8.629 2.623 1.116 1.00 0.00 O ATOM 1855 CB SER A 114 9.802 -0.425 1.782 1.00 0.00 C ATOM 1856 OG SER A 114 8.947 -1.320 1.091 1.00 0.00 O ATOM 0 H SER A 114 8.195 -0.903 3.600 1.00 0.00 H new ATOM 0 HA SER A 114 9.689 1.350 2.998 1.00 0.00 H new ATOM 0 HB2 SER A 114 10.508 0.020 1.082 1.00 0.00 H new ATOM 0 HB3 SER A 114 10.387 -0.974 2.519 1.00 0.00 H new ATOM 0 HG SER A 114 8.923 -2.179 1.562 1.00 0.00 H new ATOM 1862 N TYR A 115 7.139 0.948 0.926 1.00 0.00 N ATOM 1863 CA TYR A 115 6.319 1.635 -0.072 1.00 0.00 C ATOM 1864 C TYR A 115 5.730 2.929 0.493 1.00 0.00 C ATOM 1865 O TYR A 115 5.503 3.897 -0.235 1.00 0.00 O ATOM 1866 CB TYR A 115 5.194 0.707 -0.566 1.00 0.00 C ATOM 1867 CG TYR A 115 4.067 1.433 -1.274 1.00 0.00 C ATOM 1868 CD1 TYR A 115 4.267 2.040 -2.507 1.00 0.00 C ATOM 1869 CD2 TYR A 115 2.809 1.531 -0.692 1.00 0.00 C ATOM 1870 CE1 TYR A 115 3.247 2.725 -3.138 1.00 0.00 C ATOM 1871 CE2 TYR A 115 1.784 2.210 -1.321 1.00 0.00 C ATOM 1872 CZ TYR A 115 2.008 2.807 -2.541 1.00 0.00 C ATOM 1873 OH TYR A 115 0.995 3.503 -3.158 1.00 0.00 O ATOM 0 H TYR A 115 6.796 0.023 1.186 1.00 0.00 H new ATOM 0 HA TYR A 115 6.959 1.896 -0.915 1.00 0.00 H new ATOM 0 HB2 TYR A 115 5.618 -0.034 -1.244 1.00 0.00 H new ATOM 0 HB3 TYR A 115 4.785 0.163 0.285 1.00 0.00 H new ATOM 0 HD1 TYR A 115 5.236 1.975 -2.980 1.00 0.00 H new ATOM 0 HD2 TYR A 115 2.630 1.069 0.268 1.00 0.00 H new ATOM 0 HE1 TYR A 115 3.420 3.194 -4.095 1.00 0.00 H new ATOM 0 HE2 TYR A 115 0.810 2.272 -0.858 1.00 0.00 H new ATOM 0 HH TYR A 115 0.140 3.281 -2.734 1.00 0.00 H new ATOM 1883 N ILE A 116 5.500 2.941 1.794 1.00 0.00 N ATOM 1884 CA ILE A 116 4.868 4.072 2.448 1.00 0.00 C ATOM 1885 C ILE A 116 5.908 5.132 2.803 1.00 0.00 C ATOM 1886 O ILE A 116 5.637 6.333 2.754 1.00 0.00 O ATOM 1887 CB ILE A 116 4.145 3.615 3.732 1.00 0.00 C ATOM 1888 CG1 ILE A 116 3.387 2.306 3.473 1.00 0.00 C ATOM 1889 CG2 ILE A 116 3.188 4.698 4.213 1.00 0.00 C ATOM 1890 CD1 ILE A 116 2.942 1.602 4.735 1.00 0.00 C ATOM 0 H ILE A 116 5.743 2.175 2.422 1.00 0.00 H new ATOM 0 HA ILE A 116 4.140 4.500 1.758 1.00 0.00 H new ATOM 0 HB ILE A 116 4.888 3.440 4.510 1.00 0.00 H new ATOM 0 HG12 ILE A 116 2.512 2.518 2.858 1.00 0.00 H new ATOM 0 HG13 ILE A 116 4.025 1.634 2.898 1.00 0.00 H new ATOM 0 HG21 ILE A 116 2.685 4.362 5.120 1.00 0.00 H new ATOM 0 HG22 ILE A 116 3.747 5.610 4.425 1.00 0.00 H new ATOM 0 HG23 ILE A 116 2.447 4.898 3.439 1.00 0.00 H new ATOM 0 HD11 ILE A 116 2.413 0.685 4.473 1.00 0.00 H new ATOM 0 HD12 ILE A 116 3.814 1.357 5.342 1.00 0.00 H new ATOM 0 HD13 ILE A 116 2.278 2.255 5.301 1.00 0.00 H new ATOM 1902 N ASP A 117 7.105 4.670 3.138 1.00 0.00 N ATOM 1903 CA ASP A 117 8.180 5.548 3.581 1.00 0.00 C ATOM 1904 C ASP A 117 8.910 6.179 2.400 1.00 0.00 C ATOM 1905 O ASP A 117 9.404 7.301 2.496 1.00 0.00 O ATOM 1906 CB ASP A 117 9.174 4.767 4.445 1.00 0.00 C ATOM 1907 CG ASP A 117 10.240 5.656 5.054 1.00 0.00 C ATOM 1908 OD1 ASP A 117 9.945 6.332 6.064 1.00 0.00 O ATOM 1909 OD2 ASP A 117 11.374 5.674 4.541 1.00 0.00 O ATOM 0 H ASP A 117 7.358 3.682 3.111 1.00 0.00 H new ATOM 0 HA ASP A 117 7.733 6.349 4.170 1.00 0.00 H new ATOM 0 HB2 ASP A 117 8.634 4.256 5.242 1.00 0.00 H new ATOM 0 HB3 ASP A 117 9.651 3.997 3.838 1.00 0.00 H new ATOM 1914 N SER A 118 8.965 5.469 1.283 1.00 0.00 N ATOM 1915 CA SER A 118 9.667 5.971 0.111 1.00 0.00 C ATOM 1916 C SER A 118 8.767 6.875 -0.729 1.00 0.00 C ATOM 1917 O SER A 118 7.705 6.454 -1.206 1.00 0.00 O ATOM 1918 CB SER A 118 10.202 4.811 -0.735 1.00 0.00 C ATOM 1919 OG SER A 118 9.159 3.930 -1.114 1.00 0.00 O ATOM 0 H SER A 118 8.536 4.551 1.163 1.00 0.00 H new ATOM 0 HA SER A 118 10.511 6.567 0.458 1.00 0.00 H new ATOM 0 HB2 SER A 118 10.692 5.203 -1.626 1.00 0.00 H new ATOM 0 HB3 SER A 118 10.957 4.264 -0.171 1.00 0.00 H new ATOM 0 HG SER A 118 8.944 3.337 -0.364 1.00 0.00 H new ATOM 1925 N PRO A 119 9.178 8.138 -0.928 1.00 0.00 N ATOM 1926 CA PRO A 119 8.435 9.080 -1.764 1.00 0.00 C ATOM 1927 C PRO A 119 8.434 8.644 -3.225 1.00 0.00 C ATOM 1928 O PRO A 119 7.521 8.972 -3.981 1.00 0.00 O ATOM 1929 CB PRO A 119 9.192 10.402 -1.590 1.00 0.00 C ATOM 1930 CG PRO A 119 10.559 10.013 -1.139 1.00 0.00 C ATOM 1931 CD PRO A 119 10.393 8.746 -0.349 1.00 0.00 C ATOM 0 HA PRO A 119 7.386 9.151 -1.478 1.00 0.00 H new ATOM 0 HB2 PRO A 119 9.230 10.960 -2.525 1.00 0.00 H new ATOM 0 HB3 PRO A 119 8.703 11.042 -0.856 1.00 0.00 H new ATOM 0 HG2 PRO A 119 11.221 9.857 -1.991 1.00 0.00 H new ATOM 0 HG3 PRO A 119 11.006 10.797 -0.528 1.00 0.00 H new ATOM 0 HD2 PRO A 119 11.258 8.091 -0.453 1.00 0.00 H new ATOM 0 HD3 PRO A 119 10.273 8.949 0.715 1.00 0.00 H new ATOM 1939 N GLU A 120 9.456 7.879 -3.599 1.00 0.00 N ATOM 1940 CA GLU A 120 9.595 7.375 -4.960 1.00 0.00 C ATOM 1941 C GLU A 120 8.409 6.491 -5.334 1.00 0.00 C ATOM 1942 O GLU A 120 7.694 6.773 -6.296 1.00 0.00 O ATOM 1943 CB GLU A 120 10.899 6.588 -5.092 1.00 0.00 C ATOM 1944 CG GLU A 120 11.170 6.078 -6.495 1.00 0.00 C ATOM 1945 CD GLU A 120 12.395 5.194 -6.555 1.00 0.00 C ATOM 1946 OE1 GLU A 120 12.265 3.978 -6.317 1.00 0.00 O ATOM 1947 OE2 GLU A 120 13.498 5.711 -6.831 1.00 0.00 O ATOM 0 H GLU A 120 10.207 7.593 -2.970 1.00 0.00 H new ATOM 0 HA GLU A 120 9.617 8.224 -5.643 1.00 0.00 H new ATOM 0 HB2 GLU A 120 11.728 7.223 -4.780 1.00 0.00 H new ATOM 0 HB3 GLU A 120 10.871 5.741 -4.407 1.00 0.00 H new ATOM 0 HG2 GLU A 120 10.304 5.520 -6.850 1.00 0.00 H new ATOM 0 HG3 GLU A 120 11.302 6.925 -7.168 1.00 0.00 H new ATOM 1954 N TYR A 121 8.197 5.433 -4.556 1.00 0.00 N ATOM 1955 CA TYR A 121 7.087 4.517 -4.790 1.00 0.00 C ATOM 1956 C TYR A 121 5.753 5.229 -4.610 1.00 0.00 C ATOM 1957 O TYR A 121 4.808 4.995 -5.365 1.00 0.00 O ATOM 1958 CB TYR A 121 7.165 3.320 -3.842 1.00 0.00 C ATOM 1959 CG TYR A 121 8.179 2.272 -4.242 1.00 0.00 C ATOM 1960 CD1 TYR A 121 9.531 2.439 -3.975 1.00 0.00 C ATOM 1961 CD2 TYR A 121 7.775 1.106 -4.878 1.00 0.00 C ATOM 1962 CE1 TYR A 121 10.452 1.474 -4.334 1.00 0.00 C ATOM 1963 CE2 TYR A 121 8.689 0.138 -5.239 1.00 0.00 C ATOM 1964 CZ TYR A 121 10.026 0.325 -4.965 1.00 0.00 C ATOM 1965 OH TYR A 121 10.936 -0.639 -5.322 1.00 0.00 O ATOM 0 H TYR A 121 8.781 5.189 -3.756 1.00 0.00 H new ATOM 0 HA TYR A 121 7.160 4.159 -5.817 1.00 0.00 H new ATOM 0 HB2 TYR A 121 7.407 3.679 -2.842 1.00 0.00 H new ATOM 0 HB3 TYR A 121 6.182 2.853 -3.784 1.00 0.00 H new ATOM 0 HD1 TYR A 121 9.868 3.337 -3.479 1.00 0.00 H new ATOM 0 HD2 TYR A 121 6.728 0.954 -5.094 1.00 0.00 H new ATOM 0 HE1 TYR A 121 11.501 1.619 -4.121 1.00 0.00 H new ATOM 0 HE2 TYR A 121 8.358 -0.763 -5.734 1.00 0.00 H new ATOM 0 HH TYR A 121 10.470 -1.384 -5.756 1.00 0.00 H new ATOM 1975 N THR A 122 5.693 6.100 -3.610 1.00 0.00 N ATOM 1976 CA THR A 122 4.498 6.881 -3.340 1.00 0.00 C ATOM 1977 C THR A 122 4.080 7.700 -4.565 1.00 0.00 C ATOM 1978 O THR A 122 2.943 7.615 -5.020 1.00 0.00 O ATOM 1979 CB THR A 122 4.723 7.821 -2.138 1.00 0.00 C ATOM 1980 OG1 THR A 122 4.974 7.045 -0.958 1.00 0.00 O ATOM 1981 CG2 THR A 122 3.522 8.727 -1.905 1.00 0.00 C ATOM 0 H THR A 122 6.466 6.282 -2.970 1.00 0.00 H new ATOM 0 HA THR A 122 3.696 6.182 -3.102 1.00 0.00 H new ATOM 0 HB THR A 122 5.584 8.451 -2.361 1.00 0.00 H new ATOM 0 HG1 THR A 122 5.916 6.776 -0.938 1.00 0.00 H new ATOM 0 HG21 THR A 122 3.716 9.375 -1.051 1.00 0.00 H new ATOM 0 HG22 THR A 122 3.349 9.337 -2.792 1.00 0.00 H new ATOM 0 HG23 THR A 122 2.640 8.118 -1.706 1.00 0.00 H new ATOM 1989 N ASN A 123 5.015 8.463 -5.115 1.00 0.00 N ATOM 1990 CA ASN A 123 4.721 9.337 -6.247 1.00 0.00 C ATOM 1991 C ASN A 123 4.607 8.529 -7.542 1.00 0.00 C ATOM 1992 O ASN A 123 4.014 8.984 -8.519 1.00 0.00 O ATOM 1993 CB ASN A 123 5.814 10.404 -6.385 1.00 0.00 C ATOM 1994 CG ASN A 123 5.323 11.698 -7.018 1.00 0.00 C ATOM 1995 OD1 ASN A 123 5.840 12.774 -6.718 1.00 0.00 O ATOM 1996 ND2 ASN A 123 4.330 11.614 -7.887 1.00 0.00 N ATOM 0 H ASN A 123 5.984 8.496 -4.797 1.00 0.00 H new ATOM 0 HA ASN A 123 3.765 9.828 -6.064 1.00 0.00 H new ATOM 0 HB2 ASN A 123 6.223 10.624 -5.399 1.00 0.00 H new ATOM 0 HB3 ASN A 123 6.630 10.002 -6.986 1.00 0.00 H new ATOM 0 HD21 ASN A 123 3.969 12.458 -8.332 1.00 0.00 H new ATOM 0 HD22 ASN A 123 3.925 10.705 -8.112 1.00 0.00 H new ATOM 2003 N SER A 124 5.185 7.331 -7.542 1.00 0.00 N ATOM 2004 CA SER A 124 5.172 6.466 -8.717 1.00 0.00 C ATOM 2005 C SER A 124 3.742 6.057 -9.070 1.00 0.00 C ATOM 2006 O SER A 124 3.308 6.192 -10.218 1.00 0.00 O ATOM 2007 CB SER A 124 6.040 5.223 -8.463 1.00 0.00 C ATOM 2008 OG SER A 124 6.224 4.456 -9.640 1.00 0.00 O ATOM 0 H SER A 124 5.671 6.936 -6.737 1.00 0.00 H new ATOM 0 HA SER A 124 5.585 7.018 -9.561 1.00 0.00 H new ATOM 0 HB2 SER A 124 7.011 5.532 -8.076 1.00 0.00 H new ATOM 0 HB3 SER A 124 5.573 4.605 -7.696 1.00 0.00 H new ATOM 0 HG SER A 124 6.782 3.676 -9.438 1.00 0.00 H new ATOM 2014 N PHE A 125 3.004 5.583 -8.074 1.00 0.00 N ATOM 2015 CA PHE A 125 1.633 5.136 -8.289 1.00 0.00 C ATOM 2016 C PHE A 125 0.639 6.232 -7.926 1.00 0.00 C ATOM 2017 O PHE A 125 -0.407 6.373 -8.560 1.00 0.00 O ATOM 2018 CB PHE A 125 1.346 3.874 -7.472 1.00 0.00 C ATOM 2019 CG PHE A 125 2.192 2.695 -7.870 1.00 0.00 C ATOM 2020 CD1 PHE A 125 1.771 1.828 -8.866 1.00 0.00 C ATOM 2021 CD2 PHE A 125 3.409 2.457 -7.250 1.00 0.00 C ATOM 2022 CE1 PHE A 125 2.549 0.744 -9.236 1.00 0.00 C ATOM 2023 CE2 PHE A 125 4.190 1.376 -7.615 1.00 0.00 C ATOM 2024 CZ PHE A 125 3.759 0.518 -8.608 1.00 0.00 C ATOM 0 H PHE A 125 3.331 5.498 -7.111 1.00 0.00 H new ATOM 0 HA PHE A 125 1.517 4.904 -9.348 1.00 0.00 H new ATOM 0 HB2 PHE A 125 1.511 4.089 -6.416 1.00 0.00 H new ATOM 0 HB3 PHE A 125 0.294 3.610 -7.583 1.00 0.00 H new ATOM 0 HD1 PHE A 125 0.826 2.000 -9.359 1.00 0.00 H new ATOM 0 HD2 PHE A 125 3.751 3.124 -6.473 1.00 0.00 H new ATOM 0 HE1 PHE A 125 2.211 0.076 -10.014 1.00 0.00 H new ATOM 0 HE2 PHE A 125 5.136 1.203 -7.124 1.00 0.00 H new ATOM 0 HZ PHE A 125 4.367 -0.328 -8.893 1.00 0.00 H new ATOM 2034 N GLY A 126 0.977 7.009 -6.907 1.00 0.00 N ATOM 2035 CA GLY A 126 0.100 8.062 -6.446 1.00 0.00 C ATOM 2036 C GLY A 126 -0.205 7.926 -4.969 1.00 0.00 C ATOM 2037 O GLY A 126 -0.473 6.824 -4.488 1.00 0.00 O ATOM 0 H GLY A 126 1.851 6.926 -6.388 1.00 0.00 H new ATOM 0 HA2 GLY A 126 0.563 9.031 -6.635 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -0.830 8.037 -7.014 1.00 0.00 H new ATOM 2041 N ASP A 127 -0.146 9.034 -4.244 1.00 0.00 N ATOM 2042 CA ASP A 127 -0.447 9.033 -2.814 1.00 0.00 C ATOM 2043 C ASP A 127 -1.933 8.775 -2.606 1.00 0.00 C ATOM 2044 O ASP A 127 -2.325 7.882 -1.854 1.00 0.00 O ATOM 2045 CB ASP A 127 -0.063 10.380 -2.189 1.00 0.00 C ATOM 2046 CG ASP A 127 -0.133 10.396 -0.667 1.00 0.00 C ATOM 2047 OD1 ASP A 127 -0.827 9.546 -0.072 1.00 0.00 O ATOM 2048 OD2 ASP A 127 0.511 11.280 -0.059 1.00 0.00 O ATOM 0 H ASP A 127 0.108 9.948 -4.620 1.00 0.00 H new ATOM 0 HA ASP A 127 0.130 8.245 -2.331 1.00 0.00 H new ATOM 0 HB2 ASP A 127 0.950 10.638 -2.499 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -0.723 11.153 -2.582 1.00 0.00 H new ATOM 2053 N TRP A 128 -2.747 9.544 -3.317 1.00 0.00 N ATOM 2054 CA TRP A 128 -4.196 9.462 -3.198 1.00 0.00 C ATOM 2055 C TRP A 128 -4.779 8.545 -4.269 1.00 0.00 C ATOM 2056 O TRP A 128 -5.988 8.522 -4.488 1.00 0.00 O ATOM 2057 CB TRP A 128 -4.811 10.860 -3.314 1.00 0.00 C ATOM 2058 CG TRP A 128 -4.411 11.782 -2.202 1.00 0.00 C ATOM 2059 CD1 TRP A 128 -3.186 12.350 -2.009 1.00 0.00 C ATOM 2060 CD2 TRP A 128 -5.243 12.247 -1.132 1.00 0.00 C ATOM 2061 NE1 TRP A 128 -3.202 13.136 -0.884 1.00 0.00 N ATOM 2062 CE2 TRP A 128 -4.454 13.092 -0.329 1.00 0.00 C ATOM 2063 CE3 TRP A 128 -6.578 12.036 -0.779 1.00 0.00 C ATOM 2064 CZ2 TRP A 128 -4.956 13.716 0.810 1.00 0.00 C ATOM 2065 CZ3 TRP A 128 -7.075 12.657 0.351 1.00 0.00 C ATOM 2066 CH2 TRP A 128 -6.267 13.492 1.131 1.00 0.00 C ATOM 0 H TRP A 128 -2.423 10.239 -3.989 1.00 0.00 H new ATOM 0 HA TRP A 128 -4.436 9.044 -2.221 1.00 0.00 H new ATOM 0 HB2 TRP A 128 -4.515 11.301 -4.266 1.00 0.00 H new ATOM 0 HB3 TRP A 128 -5.897 10.771 -3.329 1.00 0.00 H new ATOM 0 HD1 TRP A 128 -2.328 12.203 -2.648 1.00 0.00 H new ATOM 0 HE1 TRP A 128 -2.411 13.667 -0.520 1.00 0.00 H new ATOM 0 HE3 TRP A 128 -7.211 11.399 -1.379 1.00 0.00 H new ATOM 0 HZ2 TRP A 128 -4.333 14.354 1.419 1.00 0.00 H new ATOM 0 HZ3 TRP A 128 -8.104 12.495 0.637 1.00 0.00 H new ATOM 0 HH2 TRP A 128 -6.687 13.969 2.004 1.00 0.00 H new ATOM 2077 N VAL A 129 -3.918 7.789 -4.929 1.00 0.00 N ATOM 2078 CA VAL A 129 -4.349 6.874 -5.977 1.00 0.00 C ATOM 2079 C VAL A 129 -4.122 5.434 -5.541 1.00 0.00 C ATOM 2080 O VAL A 129 -3.082 5.114 -4.963 1.00 0.00 O ATOM 2081 CB VAL A 129 -3.594 7.124 -7.304 1.00 0.00 C ATOM 2082 CG1 VAL A 129 -4.099 6.203 -8.405 1.00 0.00 C ATOM 2083 CG2 VAL A 129 -3.718 8.575 -7.734 1.00 0.00 C ATOM 0 H VAL A 129 -2.912 7.790 -4.758 1.00 0.00 H new ATOM 0 HA VAL A 129 -5.411 7.052 -6.146 1.00 0.00 H new ATOM 0 HB VAL A 129 -2.541 6.904 -7.130 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -3.550 6.401 -9.326 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -3.948 5.165 -8.109 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -5.161 6.382 -8.570 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -3.179 8.725 -8.669 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -4.770 8.823 -7.878 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -3.295 9.220 -6.964 1.00 0.00 H new ATOM 2093 N VAL A 130 -5.096 4.576 -5.803 1.00 0.00 N ATOM 2094 CA VAL A 130 -4.954 3.160 -5.515 1.00 0.00 C ATOM 2095 C VAL A 130 -4.116 2.514 -6.610 1.00 0.00 C ATOM 2096 O VAL A 130 -4.491 2.557 -7.783 1.00 0.00 O ATOM 2097 CB VAL A 130 -6.327 2.455 -5.416 1.00 0.00 C ATOM 2098 CG1 VAL A 130 -6.165 1.001 -4.993 1.00 0.00 C ATOM 2099 CG2 VAL A 130 -7.235 3.195 -4.444 1.00 0.00 C ATOM 0 H VAL A 130 -5.992 4.837 -6.214 1.00 0.00 H new ATOM 0 HA VAL A 130 -4.461 3.052 -4.549 1.00 0.00 H new ATOM 0 HB VAL A 130 -6.788 2.470 -6.404 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -7.145 0.529 -4.931 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -5.554 0.475 -5.726 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -5.679 0.958 -4.018 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -8.197 2.686 -4.386 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -6.774 3.213 -3.457 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -7.385 4.217 -4.793 1.00 0.00 H new ATOM 2109 N PRO A 131 -2.948 1.953 -6.244 1.00 0.00 N ATOM 2110 CA PRO A 131 -2.018 1.352 -7.203 1.00 0.00 C ATOM 2111 C PRO A 131 -2.700 0.352 -8.130 1.00 0.00 C ATOM 2112 O PRO A 131 -3.276 -0.645 -7.688 1.00 0.00 O ATOM 2113 CB PRO A 131 -0.983 0.663 -6.314 1.00 0.00 C ATOM 2114 CG PRO A 131 -1.019 1.428 -5.038 1.00 0.00 C ATOM 2115 CD PRO A 131 -2.446 1.862 -4.860 1.00 0.00 C ATOM 0 HA PRO A 131 -1.586 2.095 -7.873 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -1.232 -0.386 -6.155 1.00 0.00 H new ATOM 0 HB3 PRO A 131 0.009 0.690 -6.765 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -0.691 0.810 -4.202 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -0.351 2.288 -5.079 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -3.015 1.142 -4.272 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -2.514 2.820 -4.344 1.00 0.00 H new ATOM 2123 N TYR A 132 -2.635 0.644 -9.418 1.00 0.00 N ATOM 2124 CA TYR A 132 -3.312 -0.150 -10.426 1.00 0.00 C ATOM 2125 C TYR A 132 -2.440 -1.307 -10.888 1.00 0.00 C ATOM 2126 O TYR A 132 -1.221 -1.290 -10.711 1.00 0.00 O ATOM 2127 CB TYR A 132 -3.685 0.732 -11.623 1.00 0.00 C ATOM 2128 CG TYR A 132 -2.514 1.498 -12.211 1.00 0.00 C ATOM 2129 CD1 TYR A 132 -1.718 0.937 -13.205 1.00 0.00 C ATOM 2130 CD2 TYR A 132 -2.208 2.781 -11.774 1.00 0.00 C ATOM 2131 CE1 TYR A 132 -0.653 1.632 -13.743 1.00 0.00 C ATOM 2132 CE2 TYR A 132 -1.145 3.482 -12.308 1.00 0.00 C ATOM 2133 CZ TYR A 132 -0.372 2.905 -13.291 1.00 0.00 C ATOM 2134 OH TYR A 132 0.690 3.601 -13.824 1.00 0.00 O ATOM 0 H TYR A 132 -2.113 1.436 -9.792 1.00 0.00 H new ATOM 0 HA TYR A 132 -4.219 -0.562 -9.982 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -4.124 0.106 -12.400 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -4.452 1.442 -11.314 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -1.937 -0.059 -13.562 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -2.812 3.238 -11.004 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -0.044 1.182 -14.513 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -0.921 4.478 -11.956 1.00 0.00 H new ATOM 0 HH TYR A 132 0.751 4.482 -13.398 1.00 0.00 H new ATOM 2144 N TYR A 133 -3.075 -2.302 -11.487 1.00 0.00 N ATOM 2145 CA TYR A 133 -2.362 -3.439 -12.037 1.00 0.00 C ATOM 2146 C TYR A 133 -1.736 -3.066 -13.371 1.00 0.00 C ATOM 2147 O TYR A 133 -2.365 -2.406 -14.200 1.00 0.00 O ATOM 2148 CB TYR A 133 -3.307 -4.631 -12.221 1.00 0.00 C ATOM 2149 CG TYR A 133 -3.732 -5.290 -10.927 1.00 0.00 C ATOM 2150 CD1 TYR A 133 -4.669 -4.700 -10.089 1.00 0.00 C ATOM 2151 CD2 TYR A 133 -3.188 -6.511 -10.543 1.00 0.00 C ATOM 2152 CE1 TYR A 133 -5.052 -5.306 -8.906 1.00 0.00 C ATOM 2153 CE2 TYR A 133 -3.565 -7.121 -9.364 1.00 0.00 C ATOM 2154 CZ TYR A 133 -4.496 -6.517 -8.551 1.00 0.00 C ATOM 2155 OH TYR A 133 -4.870 -7.124 -7.373 1.00 0.00 O ATOM 0 H TYR A 133 -4.087 -2.343 -11.604 1.00 0.00 H new ATOM 0 HA TYR A 133 -1.575 -3.723 -11.338 1.00 0.00 H new ATOM 0 HB2 TYR A 133 -4.197 -4.296 -12.755 1.00 0.00 H new ATOM 0 HB3 TYR A 133 -2.818 -5.374 -12.851 1.00 0.00 H new ATOM 0 HD1 TYR A 133 -5.106 -3.752 -10.366 1.00 0.00 H new ATOM 0 HD2 TYR A 133 -2.458 -6.990 -11.179 1.00 0.00 H new ATOM 0 HE1 TYR A 133 -5.782 -4.834 -8.265 1.00 0.00 H new ATOM 0 HE2 TYR A 133 -3.131 -8.069 -9.081 1.00 0.00 H new ATOM 0 HH TYR A 133 -4.386 -7.970 -7.273 1.00 0.00 H new ATOM 2165 N ARG A 134 -0.498 -3.486 -13.577 1.00 0.00 N ATOM 2166 CA ARG A 134 0.204 -3.207 -14.824 1.00 0.00 C ATOM 2167 C ARG A 134 -0.290 -4.123 -15.942 1.00 0.00 C ATOM 2168 O ARG A 134 0.042 -3.928 -17.114 1.00 0.00 O ATOM 2169 CB ARG A 134 1.712 -3.379 -14.641 1.00 0.00 C ATOM 2170 CG ARG A 134 2.110 -4.758 -14.142 1.00 0.00 C ATOM 2171 CD ARG A 134 3.617 -4.904 -14.045 1.00 0.00 C ATOM 2172 NE ARG A 134 4.268 -4.827 -15.352 1.00 0.00 N ATOM 2173 CZ ARG A 134 4.956 -5.828 -15.902 1.00 0.00 C ATOM 2174 NH1 ARG A 134 5.071 -6.988 -15.266 1.00 0.00 N ATOM 2175 NH2 ARG A 134 5.529 -5.669 -17.087 1.00 0.00 N ATOM 0 H ARG A 134 0.043 -4.021 -12.898 1.00 0.00 H new ATOM 0 HA ARG A 134 -0.004 -2.174 -15.102 1.00 0.00 H new ATOM 0 HB2 ARG A 134 2.209 -3.188 -15.592 1.00 0.00 H new ATOM 0 HB3 ARG A 134 2.072 -2.629 -13.937 1.00 0.00 H new ATOM 0 HG2 ARG A 134 1.663 -4.934 -13.164 1.00 0.00 H new ATOM 0 HG3 ARG A 134 1.713 -5.518 -14.815 1.00 0.00 H new ATOM 0 HD2 ARG A 134 4.014 -4.123 -13.397 1.00 0.00 H new ATOM 0 HD3 ARG A 134 3.858 -5.859 -13.577 1.00 0.00 H new ATOM 0 HE ARG A 134 4.191 -3.955 -15.875 1.00 0.00 H new ATOM 0 HH11 ARG A 134 4.632 -7.115 -14.354 1.00 0.00 H new ATOM 0 HH12 ARG A 134 5.598 -7.752 -15.690 1.00 0.00 H new ATOM 0 HH21 ARG A 134 5.444 -4.780 -17.579 1.00 0.00 H new ATOM 0 HH22 ARG A 134 6.055 -6.436 -17.506 1.00 0.00 H new