USER MOD reduce.3.24.130724 H: found=0, std=0, add=1160, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1160 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 49 LYS NZ :NH3+ -164:sc= 3.12 (180deg=1.13!) USER MOD Set 1.2: A 50 SER OG : rot -68:sc= 2.25 USER MOD Single : A 1 MET CE :methyl 160:sc= -0.146 (180deg=-0.664) USER MOD Single : A 1 MET N :NH3+ -171:sc= 0 (180deg=-0.119) USER MOD Single : A 3 HIS : no HD1:sc= -0.0081 X(o=-0.0081,f=0) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= -0.03 X(o=-0.03,f=-0.027) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 9 SER OG : rot 46:sc= 0.17 USER MOD Single : A 10 HIS : no HD1:sc= -0.0582 X(o=-0.058,f=-0.046) USER MOD Single : A 11 MET CE :methyl -162:sc= -0.0655 (180deg=-0.472) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 ASN :FLIP amide:sc= -0.16 F(o=-2.7!,f=-0.16) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 HIS : no HD1:sc= -0.316 X(o=-0.32,f=0.065) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 HIS : no HD1:sc=-0.00536 X(o=-0.0054,f=0) USER MOD Single : A 37 GLN : amide:sc= 0.654 K(o=0.65,f=-0.6) USER MOD Single : A 40 TYR OH : rot 30:sc= -0.306 USER MOD Single : A 51 HIS : no HD1:sc= 0 X(o=0,f=-0.00032) USER MOD Single : A 54 GLN : amide:sc= 0.0605 K(o=0.061,f=-2.4!) USER MOD Single : A 59 GLN :FLIP amide:sc= -1.85 F(o=-3!,f=-1.8) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= -1.64 K(o=-1.6,f=-7.1!) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl -174:sc= 0 (180deg=-0.0634) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot -89:sc= 0.0156 USER MOD Single : A 91 GLN : amide:sc= 0.79 K(o=0.79,f=-0.23) USER MOD Single : A 94 LYS NZ :NH3+ -177:sc= 1.25 (180deg=1.19) USER MOD Single : A 97 ASN : amide:sc= 1.19 K(o=1.2,f=-0.058) USER MOD Single : A 100 GLN : amide:sc= 0.143 K(o=0.14,f=-8.6!) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 ASN : amide:sc=-0.00623 X(o=-0.0062,f=0) USER MOD Single : A 112 ASN : amide:sc= -0.147 K(o=-0.15,f=-0.76) USER MOD Single : A 113 SER OG : rot 89:sc= 0.188 USER MOD Single : A 115 LYS NZ :NH3+ -112:sc= 0.955 (180deg=0.632) USER MOD Single : A 122 SER OG : rot 139:sc= 0.942 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.0115 USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 THR OG1 : rot -90:sc= 0.0279 USER MOD Single : A 139 MET CE :methyl 143:sc= 0 (180deg=-2.23!) USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 142 CYS SG : rot 180:sc= -0.42 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 28.225 20.324 54.051 1.00 0.00 N ATOM 2 CA MET A 1 27.179 20.703 53.077 1.00 0.00 C ATOM 3 C MET A 1 27.588 20.272 51.677 1.00 0.00 C ATOM 4 O MET A 1 28.738 20.464 51.272 1.00 0.00 O ATOM 5 CB MET A 1 26.943 22.217 53.106 1.00 0.00 C ATOM 6 CG MET A 1 26.418 22.737 54.436 1.00 0.00 C ATOM 7 SD MET A 1 26.113 24.518 54.421 1.00 0.00 S ATOM 8 CE MET A 1 24.802 24.615 53.203 1.00 0.00 C ATOM 0 H1 MET A 1 27.874 20.483 55.017 1.00 0.00 H new ATOM 0 H2 MET A 1 28.464 19.319 53.930 1.00 0.00 H new ATOM 0 H3 MET A 1 29.074 20.903 53.892 1.00 0.00 H new ATOM 0 HA MET A 1 26.253 20.198 53.351 1.00 0.00 H new ATOM 0 HB2 MET A 1 27.879 22.725 52.873 1.00 0.00 H new ATOM 0 HB3 MET A 1 26.234 22.479 52.320 1.00 0.00 H new ATOM 0 HG2 MET A 1 25.493 22.217 54.685 1.00 0.00 H new ATOM 0 HG3 MET A 1 27.136 22.503 55.222 1.00 0.00 H new ATOM 0 HE1 MET A 1 24.262 25.554 53.324 1.00 0.00 H new ATOM 0 HE2 MET A 1 25.231 24.569 52.202 1.00 0.00 H new ATOM 0 HE3 MET A 1 24.114 23.781 53.341 1.00 0.00 H new ATOM 20 N GLY A 2 26.657 19.682 50.943 1.00 0.00 N ATOM 21 CA GLY A 2 26.961 19.223 49.605 1.00 0.00 C ATOM 22 C GLY A 2 25.787 18.536 48.941 1.00 0.00 C ATOM 23 O GLY A 2 25.916 17.423 48.436 1.00 0.00 O ATOM 0 H GLY A 2 25.699 19.513 51.249 1.00 0.00 H new ATOM 0 HA2 GLY A 2 27.271 20.072 48.996 1.00 0.00 H new ATOM 0 HA3 GLY A 2 27.805 18.534 49.645 1.00 0.00 H new ATOM 27 N HIS A 3 24.634 19.191 48.951 1.00 0.00 N ATOM 28 CA HIS A 3 23.459 18.668 48.262 1.00 0.00 C ATOM 29 C HIS A 3 23.281 19.415 46.953 1.00 0.00 C ATOM 30 O HIS A 3 22.649 20.471 46.909 1.00 0.00 O ATOM 31 CB HIS A 3 22.193 18.803 49.121 1.00 0.00 C ATOM 32 CG HIS A 3 22.224 18.009 50.389 1.00 0.00 C ATOM 33 ND1 HIS A 3 21.258 18.116 51.365 1.00 0.00 N ATOM 34 CD2 HIS A 3 23.113 17.097 50.845 1.00 0.00 C ATOM 35 CE1 HIS A 3 21.553 17.308 52.363 1.00 0.00 C ATOM 36 NE2 HIS A 3 22.674 16.677 52.075 1.00 0.00 N ATOM 0 H HIS A 3 24.486 20.081 49.426 1.00 0.00 H new ATOM 0 HA HIS A 3 23.613 17.606 48.071 1.00 0.00 H new ATOM 0 HB2 HIS A 3 22.045 19.854 49.368 1.00 0.00 H new ATOM 0 HB3 HIS A 3 21.332 18.490 48.531 1.00 0.00 H new ATOM 0 HD2 HIS A 3 24.004 16.761 50.335 1.00 0.00 H new ATOM 0 HE1 HIS A 3 20.973 17.183 53.266 1.00 0.00 H new ATOM 0 HE2 HIS A 3 23.138 15.990 52.669 1.00 0.00 H new ATOM 45 N HIS A 4 23.856 18.872 45.891 1.00 0.00 N ATOM 46 CA HIS A 4 23.914 19.573 44.619 1.00 0.00 C ATOM 47 C HIS A 4 23.262 18.747 43.521 1.00 0.00 C ATOM 48 O HIS A 4 23.837 17.773 43.039 1.00 0.00 O ATOM 49 CB HIS A 4 25.372 19.873 44.255 1.00 0.00 C ATOM 50 CG HIS A 4 25.540 20.985 43.265 1.00 0.00 C ATOM 51 ND1 HIS A 4 25.576 20.795 41.900 1.00 0.00 N ATOM 52 CD2 HIS A 4 25.696 22.315 43.459 1.00 0.00 C ATOM 53 CE1 HIS A 4 25.748 21.960 41.301 1.00 0.00 C ATOM 54 NE2 HIS A 4 25.824 22.897 42.226 1.00 0.00 N ATOM 0 H HIS A 4 24.289 17.948 45.885 1.00 0.00 H new ATOM 0 HA HIS A 4 23.368 20.511 44.714 1.00 0.00 H new ATOM 0 HB2 HIS A 4 25.918 20.125 45.164 1.00 0.00 H new ATOM 0 HB3 HIS A 4 25.827 18.969 43.850 1.00 0.00 H new ATOM 0 HD2 HIS A 4 25.716 22.824 44.411 1.00 0.00 H new ATOM 0 HE1 HIS A 4 25.815 22.118 40.235 1.00 0.00 H new ATOM 0 HE2 HIS A 4 25.957 23.893 42.051 1.00 0.00 H new ATOM 63 N HIS A 5 22.052 19.127 43.150 1.00 0.00 N ATOM 64 CA HIS A 5 21.338 18.473 42.065 1.00 0.00 C ATOM 65 C HIS A 5 20.500 19.496 41.312 1.00 0.00 C ATOM 66 O HIS A 5 19.643 20.162 41.894 1.00 0.00 O ATOM 67 CB HIS A 5 20.455 17.336 42.599 1.00 0.00 C ATOM 68 CG HIS A 5 19.683 16.606 41.535 1.00 0.00 C ATOM 69 ND1 HIS A 5 20.173 15.510 40.858 1.00 0.00 N ATOM 70 CD2 HIS A 5 18.445 16.826 41.031 1.00 0.00 C ATOM 71 CE1 HIS A 5 19.274 15.092 39.988 1.00 0.00 C ATOM 72 NE2 HIS A 5 18.214 15.871 40.073 1.00 0.00 N ATOM 0 H HIS A 5 21.539 19.892 43.588 1.00 0.00 H new ATOM 0 HA HIS A 5 22.064 18.036 41.379 1.00 0.00 H new ATOM 0 HB2 HIS A 5 21.083 16.622 43.131 1.00 0.00 H new ATOM 0 HB3 HIS A 5 19.753 17.746 43.325 1.00 0.00 H new ATOM 0 HD2 HIS A 5 17.764 17.610 41.329 1.00 0.00 H new ATOM 0 HE1 HIS A 5 19.387 14.252 39.318 1.00 0.00 H new ATOM 0 HE2 HIS A 5 17.363 15.779 39.518 1.00 0.00 H new ATOM 81 N HIS A 6 20.757 19.620 40.024 1.00 0.00 N ATOM 82 CA HIS A 6 20.034 20.564 39.189 1.00 0.00 C ATOM 83 C HIS A 6 19.089 19.802 38.265 1.00 0.00 C ATOM 84 O HIS A 6 19.505 19.277 37.233 1.00 0.00 O ATOM 85 CB HIS A 6 21.016 21.422 38.381 1.00 0.00 C ATOM 86 CG HIS A 6 20.399 22.640 37.769 1.00 0.00 C ATOM 87 ND1 HIS A 6 20.331 22.850 36.410 1.00 0.00 N ATOM 88 CD2 HIS A 6 19.840 23.731 38.344 1.00 0.00 C ATOM 89 CE1 HIS A 6 19.759 24.016 36.174 1.00 0.00 C ATOM 90 NE2 HIS A 6 19.452 24.569 37.331 1.00 0.00 N ATOM 0 H HIS A 6 21.465 19.076 39.530 1.00 0.00 H new ATOM 0 HA HIS A 6 19.447 21.232 39.820 1.00 0.00 H new ATOM 0 HB2 HIS A 6 21.834 21.730 39.032 1.00 0.00 H new ATOM 0 HB3 HIS A 6 21.451 20.811 37.590 1.00 0.00 H new ATOM 0 HD2 HIS A 6 19.722 23.908 39.403 1.00 0.00 H new ATOM 0 HE1 HIS A 6 19.574 24.444 35.200 1.00 0.00 H new ATOM 0 HE2 HIS A 6 18.999 25.475 37.453 1.00 0.00 H new ATOM 99 N HIS A 7 17.822 19.738 38.653 1.00 0.00 N ATOM 100 CA HIS A 7 16.845 18.885 37.971 1.00 0.00 C ATOM 101 C HIS A 7 16.438 19.443 36.614 1.00 0.00 C ATOM 102 O HIS A 7 16.630 20.623 36.325 1.00 0.00 O ATOM 103 CB HIS A 7 15.595 18.684 38.842 1.00 0.00 C ATOM 104 CG HIS A 7 14.833 19.944 39.148 1.00 0.00 C ATOM 105 ND1 HIS A 7 14.973 20.624 40.334 1.00 0.00 N ATOM 106 CD2 HIS A 7 13.916 20.637 38.426 1.00 0.00 C ATOM 107 CE1 HIS A 7 14.180 21.676 40.335 1.00 0.00 C ATOM 108 NE2 HIS A 7 13.527 21.710 39.190 1.00 0.00 N ATOM 0 H HIS A 7 17.442 20.266 39.438 1.00 0.00 H new ATOM 0 HA HIS A 7 17.332 17.924 37.805 1.00 0.00 H new ATOM 0 HB2 HIS A 7 14.927 17.985 38.339 1.00 0.00 H new ATOM 0 HB3 HIS A 7 15.894 18.219 39.781 1.00 0.00 H new ATOM 0 HD2 HIS A 7 13.559 20.391 37.437 1.00 0.00 H new ATOM 0 HE1 HIS A 7 14.081 22.391 41.139 1.00 0.00 H new ATOM 0 HE2 HIS A 7 12.845 22.417 38.916 1.00 0.00 H new ATOM 117 N HIS A 8 15.870 18.570 35.794 1.00 0.00 N ATOM 118 CA HIS A 8 15.313 18.945 34.505 1.00 0.00 C ATOM 119 C HIS A 8 13.846 18.550 34.464 1.00 0.00 C ATOM 120 O HIS A 8 13.446 17.577 35.106 1.00 0.00 O ATOM 121 CB HIS A 8 16.052 18.247 33.358 1.00 0.00 C ATOM 122 CG HIS A 8 17.482 18.660 33.198 1.00 0.00 C ATOM 123 ND1 HIS A 8 18.541 17.868 33.586 1.00 0.00 N ATOM 124 CD2 HIS A 8 18.026 19.772 32.650 1.00 0.00 C ATOM 125 CE1 HIS A 8 19.672 18.474 33.285 1.00 0.00 C ATOM 126 NE2 HIS A 8 19.388 19.629 32.717 1.00 0.00 N ATOM 0 H HIS A 8 15.783 17.576 36.007 1.00 0.00 H new ATOM 0 HA HIS A 8 15.424 20.022 34.382 1.00 0.00 H new ATOM 0 HB2 HIS A 8 16.014 17.170 33.521 1.00 0.00 H new ATOM 0 HB3 HIS A 8 15.523 18.448 32.426 1.00 0.00 H new ATOM 0 HD2 HIS A 8 17.488 20.613 32.238 1.00 0.00 H new ATOM 0 HE1 HIS A 8 20.664 18.089 33.472 1.00 0.00 H new ATOM 0 HE2 HIS A 8 20.072 20.307 32.381 1.00 0.00 H new ATOM 135 N SER A 9 13.049 19.309 33.731 1.00 0.00 N ATOM 136 CA SER A 9 11.637 19.002 33.575 1.00 0.00 C ATOM 137 C SER A 9 11.063 19.714 32.352 1.00 0.00 C ATOM 138 O SER A 9 10.829 20.925 32.378 1.00 0.00 O ATOM 139 CB SER A 9 10.866 19.395 34.841 1.00 0.00 C ATOM 140 OG SER A 9 11.205 20.709 35.259 1.00 0.00 O ATOM 0 H SER A 9 13.357 20.144 33.233 1.00 0.00 H new ATOM 0 HA SER A 9 11.530 17.928 33.423 1.00 0.00 H new ATOM 0 HB2 SER A 9 9.794 19.336 34.651 1.00 0.00 H new ATOM 0 HB3 SER A 9 11.088 18.687 35.640 1.00 0.00 H new ATOM 0 HG SER A 9 11.204 21.309 34.484 1.00 0.00 H new ATOM 146 N HIS A 10 10.877 18.967 31.270 1.00 0.00 N ATOM 147 CA HIS A 10 10.260 19.510 30.067 1.00 0.00 C ATOM 148 C HIS A 10 9.217 18.537 29.524 1.00 0.00 C ATOM 149 O HIS A 10 9.488 17.348 29.359 1.00 0.00 O ATOM 150 CB HIS A 10 11.321 19.835 28.995 1.00 0.00 C ATOM 151 CG HIS A 10 11.914 18.643 28.299 1.00 0.00 C ATOM 152 ND1 HIS A 10 13.030 17.974 28.753 1.00 0.00 N ATOM 153 CD2 HIS A 10 11.540 18.014 27.160 1.00 0.00 C ATOM 154 CE1 HIS A 10 13.314 16.988 27.921 1.00 0.00 C ATOM 155 NE2 HIS A 10 12.425 16.991 26.949 1.00 0.00 N ATOM 0 H HIS A 10 11.144 17.985 31.202 1.00 0.00 H new ATOM 0 HA HIS A 10 9.761 20.443 30.329 1.00 0.00 H new ATOM 0 HB2 HIS A 10 10.870 20.486 28.246 1.00 0.00 H new ATOM 0 HB3 HIS A 10 12.127 20.400 29.464 1.00 0.00 H new ATOM 0 HD2 HIS A 10 10.699 18.272 26.534 1.00 0.00 H new ATOM 0 HE1 HIS A 10 14.137 16.296 28.021 1.00 0.00 H new ATOM 0 HE2 HIS A 10 12.400 16.337 26.166 1.00 0.00 H new ATOM 164 N MET A 11 8.020 19.046 29.273 1.00 0.00 N ATOM 165 CA MET A 11 6.944 18.244 28.703 1.00 0.00 C ATOM 166 C MET A 11 5.816 19.145 28.211 1.00 0.00 C ATOM 167 O MET A 11 5.547 20.198 28.802 1.00 0.00 O ATOM 168 CB MET A 11 6.407 17.234 29.724 1.00 0.00 C ATOM 169 CG MET A 11 5.871 17.865 30.999 1.00 0.00 C ATOM 170 SD MET A 11 5.176 16.647 32.131 1.00 0.00 S ATOM 171 CE MET A 11 3.725 16.118 31.221 1.00 0.00 C ATOM 0 H MET A 11 7.767 20.017 29.456 1.00 0.00 H new ATOM 0 HA MET A 11 7.349 17.689 27.857 1.00 0.00 H new ATOM 0 HB2 MET A 11 5.613 16.651 29.258 1.00 0.00 H new ATOM 0 HB3 MET A 11 7.204 16.537 29.984 1.00 0.00 H new ATOM 0 HG2 MET A 11 6.675 18.405 31.500 1.00 0.00 H new ATOM 0 HG3 MET A 11 5.106 18.598 30.744 1.00 0.00 H new ATOM 0 HE1 MET A 11 3.031 15.622 31.899 1.00 0.00 H new ATOM 0 HE2 MET A 11 3.239 16.986 30.775 1.00 0.00 H new ATOM 0 HE3 MET A 11 4.022 15.424 30.435 1.00 0.00 H new ATOM 181 N ASP A 12 5.173 18.724 27.128 1.00 0.00 N ATOM 182 CA ASP A 12 4.096 19.489 26.507 1.00 0.00 C ATOM 183 C ASP A 12 3.501 18.695 25.351 1.00 0.00 C ATOM 184 O ASP A 12 4.214 17.985 24.641 1.00 0.00 O ATOM 185 CB ASP A 12 4.595 20.849 25.994 1.00 0.00 C ATOM 186 CG ASP A 12 5.510 20.726 24.793 1.00 0.00 C ATOM 187 OD1 ASP A 12 6.690 20.349 24.973 1.00 0.00 O ATOM 188 OD2 ASP A 12 5.054 21.002 23.663 1.00 0.00 O ATOM 0 H ASP A 12 5.382 17.845 26.656 1.00 0.00 H new ATOM 0 HA ASP A 12 3.333 19.671 27.264 1.00 0.00 H new ATOM 0 HB2 ASP A 12 3.738 21.469 25.730 1.00 0.00 H new ATOM 0 HB3 ASP A 12 5.124 21.363 26.797 1.00 0.00 H new ATOM 193 N TYR A 13 2.194 18.802 25.183 1.00 0.00 N ATOM 194 CA TYR A 13 1.495 18.121 24.103 1.00 0.00 C ATOM 195 C TYR A 13 0.332 18.974 23.596 1.00 0.00 C ATOM 196 O TYR A 13 -0.804 18.843 24.052 1.00 0.00 O ATOM 197 CB TYR A 13 1.011 16.728 24.553 1.00 0.00 C ATOM 198 CG TYR A 13 0.628 16.640 26.016 1.00 0.00 C ATOM 199 CD1 TYR A 13 1.575 16.305 26.976 1.00 0.00 C ATOM 200 CD2 TYR A 13 -0.671 16.889 26.439 1.00 0.00 C ATOM 201 CE1 TYR A 13 1.242 16.226 28.311 1.00 0.00 C ATOM 202 CE2 TYR A 13 -1.014 16.811 27.775 1.00 0.00 C ATOM 203 CZ TYR A 13 -0.051 16.480 28.708 1.00 0.00 C ATOM 204 OH TYR A 13 -0.380 16.414 30.044 1.00 0.00 O ATOM 0 H TYR A 13 1.589 19.359 25.786 1.00 0.00 H new ATOM 0 HA TYR A 13 2.193 17.977 23.278 1.00 0.00 H new ATOM 0 HB2 TYR A 13 0.151 16.443 23.947 1.00 0.00 H new ATOM 0 HB3 TYR A 13 1.798 16.001 24.352 1.00 0.00 H new ATOM 0 HD1 TYR A 13 2.591 16.103 26.670 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -1.426 17.148 25.711 1.00 0.00 H new ATOM 0 HE1 TYR A 13 1.993 15.966 29.043 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -2.029 17.008 28.088 1.00 0.00 H new ATOM 0 HH TYR A 13 -1.331 16.621 30.157 1.00 0.00 H new ATOM 214 N PRO A 14 0.615 19.883 22.650 1.00 0.00 N ATOM 215 CA PRO A 14 -0.384 20.795 22.101 1.00 0.00 C ATOM 216 C PRO A 14 -1.325 20.091 21.132 1.00 0.00 C ATOM 217 O PRO A 14 -0.936 19.740 20.019 1.00 0.00 O ATOM 218 CB PRO A 14 0.443 21.859 21.360 1.00 0.00 C ATOM 219 CG PRO A 14 1.880 21.536 21.632 1.00 0.00 C ATOM 220 CD PRO A 14 1.927 20.090 22.030 1.00 0.00 C ATOM 0 HA PRO A 14 -1.020 21.211 22.882 1.00 0.00 H new ATOM 0 HB2 PRO A 14 0.235 21.838 20.290 1.00 0.00 H new ATOM 0 HB3 PRO A 14 0.195 22.860 21.713 1.00 0.00 H new ATOM 0 HG2 PRO A 14 2.491 21.714 20.747 1.00 0.00 H new ATOM 0 HG3 PRO A 14 2.276 22.169 22.426 1.00 0.00 H new ATOM 0 HD2 PRO A 14 2.075 19.438 21.169 1.00 0.00 H new ATOM 0 HD3 PRO A 14 2.740 19.888 22.727 1.00 0.00 H new ATOM 228 N SER A 15 -2.557 19.868 21.559 1.00 0.00 N ATOM 229 CA SER A 15 -3.541 19.220 20.710 1.00 0.00 C ATOM 230 C SER A 15 -4.672 20.187 20.386 1.00 0.00 C ATOM 231 O SER A 15 -5.666 20.270 21.110 1.00 0.00 O ATOM 232 CB SER A 15 -4.075 17.961 21.390 1.00 0.00 C ATOM 233 OG SER A 15 -3.007 17.096 21.755 1.00 0.00 O ATOM 0 H SER A 15 -2.898 20.125 22.485 1.00 0.00 H new ATOM 0 HA SER A 15 -3.066 18.926 19.774 1.00 0.00 H new ATOM 0 HB2 SER A 15 -4.647 18.235 22.277 1.00 0.00 H new ATOM 0 HB3 SER A 15 -4.758 17.441 20.718 1.00 0.00 H new ATOM 0 HG SER A 15 -3.368 16.296 22.191 1.00 0.00 H new ATOM 239 N PHE A 16 -4.508 20.936 19.306 1.00 0.00 N ATOM 240 CA PHE A 16 -5.466 21.969 18.947 1.00 0.00 C ATOM 241 C PHE A 16 -5.790 21.913 17.459 1.00 0.00 C ATOM 242 O PHE A 16 -4.900 22.016 16.613 1.00 0.00 O ATOM 243 CB PHE A 16 -4.921 23.351 19.324 1.00 0.00 C ATOM 244 CG PHE A 16 -5.882 24.477 19.070 1.00 0.00 C ATOM 245 CD1 PHE A 16 -7.013 24.631 19.854 1.00 0.00 C ATOM 246 CD2 PHE A 16 -5.649 25.384 18.049 1.00 0.00 C ATOM 247 CE1 PHE A 16 -7.892 25.671 19.628 1.00 0.00 C ATOM 248 CE2 PHE A 16 -6.524 26.424 17.817 1.00 0.00 C ATOM 249 CZ PHE A 16 -7.648 26.567 18.606 1.00 0.00 C ATOM 0 H PHE A 16 -3.721 20.847 18.664 1.00 0.00 H new ATOM 0 HA PHE A 16 -6.387 21.792 19.502 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -4.652 23.348 20.380 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -4.005 23.535 18.762 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -7.210 23.929 20.651 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -4.772 25.275 17.428 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -8.768 25.784 20.249 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -6.330 27.126 17.019 1.00 0.00 H new ATOM 0 HZ PHE A 16 -8.336 27.379 18.424 1.00 0.00 H new ATOM 259 N ASP A 17 -7.070 21.735 17.160 1.00 0.00 N ATOM 260 CA ASP A 17 -7.563 21.668 15.788 1.00 0.00 C ATOM 261 C ASP A 17 -9.084 21.778 15.812 1.00 0.00 C ATOM 262 O ASP A 17 -9.764 20.854 16.255 1.00 0.00 O ATOM 263 CB ASP A 17 -7.130 20.348 15.131 1.00 0.00 C ATOM 264 CG ASP A 17 -7.389 20.305 13.636 1.00 0.00 C ATOM 265 OD1 ASP A 17 -6.515 20.767 12.867 1.00 0.00 O ATOM 266 OD2 ASP A 17 -8.443 19.784 13.221 1.00 0.00 O ATOM 0 H ASP A 17 -7.800 21.632 17.865 1.00 0.00 H new ATOM 0 HA ASP A 17 -7.145 22.488 15.204 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -6.067 20.192 15.313 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -7.659 19.523 15.608 1.00 0.00 H new ATOM 271 N LYS A 18 -9.620 22.916 15.381 1.00 0.00 N ATOM 272 CA LYS A 18 -11.053 23.163 15.512 1.00 0.00 C ATOM 273 C LYS A 18 -11.836 22.538 14.362 1.00 0.00 C ATOM 274 O LYS A 18 -11.258 22.126 13.353 1.00 0.00 O ATOM 275 CB LYS A 18 -11.363 24.662 15.632 1.00 0.00 C ATOM 276 CG LYS A 18 -10.919 25.509 14.451 1.00 0.00 C ATOM 277 CD LYS A 18 -11.540 26.898 14.526 1.00 0.00 C ATOM 278 CE LYS A 18 -11.049 27.811 13.413 1.00 0.00 C ATOM 279 NZ LYS A 18 -9.645 28.254 13.623 1.00 0.00 N ATOM 0 H LYS A 18 -9.093 23.672 14.944 1.00 0.00 H new ATOM 0 HA LYS A 18 -11.374 22.683 16.436 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -12.438 24.785 15.764 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -10.885 25.045 16.534 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -9.832 25.590 14.443 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -11.210 25.024 13.519 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -12.625 26.812 14.470 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -11.305 27.347 15.491 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -11.124 27.289 12.459 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -11.698 28.685 13.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -9.356 28.874 12.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -9.576 28.775 14.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -9.020 27.423 13.656 1.00 0.00 H new ATOM 293 N PHE A 19 -13.156 22.497 14.523 1.00 0.00 N ATOM 294 CA PHE A 19 -14.038 21.778 13.635 1.00 0.00 C ATOM 295 C PHE A 19 -15.436 22.037 14.133 1.00 0.00 C ATOM 296 O PHE A 19 -15.952 21.232 14.910 1.00 0.00 O ATOM 297 CB PHE A 19 -13.727 20.275 13.694 1.00 0.00 C ATOM 298 CG PHE A 19 -14.397 19.411 12.651 1.00 0.00 C ATOM 299 CD1 PHE A 19 -15.776 19.406 12.491 1.00 0.00 C ATOM 300 CD2 PHE A 19 -13.636 18.571 11.855 1.00 0.00 C ATOM 301 CE1 PHE A 19 -16.378 18.591 11.551 1.00 0.00 C ATOM 302 CE2 PHE A 19 -14.233 17.755 10.911 1.00 0.00 C ATOM 303 CZ PHE A 19 -15.605 17.763 10.761 1.00 0.00 C ATOM 0 H PHE A 19 -13.640 22.971 15.286 1.00 0.00 H new ATOM 0 HA PHE A 19 -13.918 22.102 12.601 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -12.648 20.145 13.604 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -14.012 19.905 14.679 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -16.386 20.047 13.109 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -12.563 18.553 11.973 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -17.452 18.602 11.434 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -13.626 17.112 10.291 1.00 0.00 H new ATOM 0 HZ PHE A 19 -16.073 17.123 10.027 1.00 0.00 H new ATOM 313 N LEU A 20 -16.078 23.161 13.787 1.00 0.00 N ATOM 314 CA LEU A 20 -15.712 24.158 12.753 1.00 0.00 C ATOM 315 C LEU A 20 -14.740 23.706 11.662 1.00 0.00 C ATOM 316 O LEU A 20 -13.528 23.891 11.777 1.00 0.00 O ATOM 317 CB LEU A 20 -15.204 25.436 13.410 1.00 0.00 C ATOM 318 CG LEU A 20 -16.269 26.256 14.146 1.00 0.00 C ATOM 319 CD1 LEU A 20 -15.695 27.584 14.609 1.00 0.00 C ATOM 320 CD2 LEU A 20 -17.483 26.483 13.254 1.00 0.00 C ATOM 0 H LEU A 20 -16.942 23.425 14.260 1.00 0.00 H new ATOM 0 HA LEU A 20 -16.646 24.326 12.216 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -14.416 25.175 14.117 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -14.749 26.064 12.644 1.00 0.00 H new ATOM 0 HG LEU A 20 -16.587 25.693 15.023 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -16.466 28.152 15.129 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -14.859 27.403 15.285 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -15.347 28.151 13.745 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -18.228 27.067 13.795 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -17.180 27.023 12.357 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -17.911 25.522 12.971 1.00 0.00 H new ATOM 332 N GLY A 21 -15.284 23.161 10.587 1.00 0.00 N ATOM 333 CA GLY A 21 -14.465 22.759 9.460 1.00 0.00 C ATOM 334 C GLY A 21 -14.887 21.420 8.907 1.00 0.00 C ATOM 335 O GLY A 21 -14.444 20.383 9.382 1.00 0.00 O ATOM 0 H GLY A 21 -16.283 22.988 10.472 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -14.532 23.513 8.676 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -13.421 22.711 9.769 1.00 0.00 H new ATOM 339 N THR A 22 -15.738 21.439 7.898 1.00 0.00 N ATOM 340 CA THR A 22 -16.291 20.210 7.366 1.00 0.00 C ATOM 341 C THR A 22 -16.421 20.263 5.850 1.00 0.00 C ATOM 342 O THR A 22 -17.065 21.151 5.287 1.00 0.00 O ATOM 343 CB THR A 22 -17.660 19.886 8.008 1.00 0.00 C ATOM 344 OG1 THR A 22 -18.277 18.771 7.352 1.00 0.00 O ATOM 345 CG2 THR A 22 -18.593 21.088 7.969 1.00 0.00 C ATOM 0 H THR A 22 -16.059 22.288 7.433 1.00 0.00 H new ATOM 0 HA THR A 22 -15.593 19.412 7.619 1.00 0.00 H new ATOM 0 HB THR A 22 -17.476 19.629 9.051 1.00 0.00 H new ATOM 0 HG1 THR A 22 -19.141 18.581 7.773 1.00 0.00 H new ATOM 0 HG21 THR A 22 -19.546 20.824 8.429 1.00 0.00 H new ATOM 0 HG22 THR A 22 -18.143 21.916 8.517 1.00 0.00 H new ATOM 0 HG23 THR A 22 -18.760 21.386 6.934 1.00 0.00 H new ATOM 353 N GLU A 23 -15.771 19.314 5.202 1.00 0.00 N ATOM 354 CA GLU A 23 -15.864 19.157 3.764 1.00 0.00 C ATOM 355 C GLU A 23 -15.624 17.699 3.406 1.00 0.00 C ATOM 356 O GLU A 23 -14.530 17.173 3.584 1.00 0.00 O ATOM 357 CB GLU A 23 -14.868 20.066 3.044 1.00 0.00 C ATOM 358 CG GLU A 23 -15.034 20.052 1.535 1.00 0.00 C ATOM 359 CD GLU A 23 -14.252 21.149 0.848 1.00 0.00 C ATOM 360 OE1 GLU A 23 -14.655 22.327 0.961 1.00 0.00 O ATOM 361 OE2 GLU A 23 -13.248 20.837 0.177 1.00 0.00 O ATOM 0 H GLU A 23 -15.165 18.632 5.658 1.00 0.00 H new ATOM 0 HA GLU A 23 -16.862 19.449 3.438 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -14.988 21.087 3.407 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -13.854 19.755 3.295 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -14.712 19.085 1.148 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -16.091 20.157 1.290 1.00 0.00 H new ATOM 368 N ASN A 24 -16.660 17.052 2.903 1.00 0.00 N ATOM 369 CA ASN A 24 -16.628 15.614 2.658 1.00 0.00 C ATOM 370 C ASN A 24 -16.112 15.332 1.255 1.00 0.00 C ATOM 371 O ASN A 24 -16.012 14.177 0.834 1.00 0.00 O ATOM 372 CB ASN A 24 -18.026 15.003 2.840 1.00 0.00 C ATOM 373 CG ASN A 24 -18.518 15.014 4.284 1.00 0.00 C ATOM 374 OD1 ASN A 24 -18.127 16.021 5.053 1.00 0.00 O flip ATOM 375 ND2 ASN A 24 -19.260 14.123 4.704 1.00 0.00 N flip ATOM 0 H ASN A 24 -17.542 17.500 2.653 1.00 0.00 H new ATOM 0 HA ASN A 24 -15.954 15.156 3.382 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -18.736 15.551 2.220 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -18.013 13.975 2.478 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -19.543 13.362 4.087 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -19.591 14.147 5.668 1.00 0.00 H new ATOM 382 N ALA A 25 -15.781 16.402 0.542 1.00 0.00 N ATOM 383 CA ALA A 25 -15.277 16.303 -0.822 1.00 0.00 C ATOM 384 C ALA A 25 -13.880 15.695 -0.857 1.00 0.00 C ATOM 385 O ALA A 25 -13.457 15.162 -1.885 1.00 0.00 O ATOM 386 CB ALA A 25 -15.274 17.673 -1.484 1.00 0.00 C ATOM 0 H ALA A 25 -15.854 17.358 0.891 1.00 0.00 H new ATOM 0 HA ALA A 25 -15.942 15.642 -1.377 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -14.895 17.584 -2.502 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -16.290 18.068 -1.508 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -14.635 18.350 -0.917 1.00 0.00 H new ATOM 392 N GLU A 26 -13.173 15.766 0.272 1.00 0.00 N ATOM 393 CA GLU A 26 -11.814 15.232 0.365 1.00 0.00 C ATOM 394 C GLU A 26 -11.771 13.783 -0.102 1.00 0.00 C ATOM 395 O GLU A 26 -10.952 13.413 -0.938 1.00 0.00 O ATOM 396 CB GLU A 26 -11.286 15.321 1.802 1.00 0.00 C ATOM 397 CG GLU A 26 -11.237 16.734 2.360 1.00 0.00 C ATOM 398 CD GLU A 26 -10.576 16.796 3.724 1.00 0.00 C ATOM 399 OE1 GLU A 26 -11.188 16.344 4.712 1.00 0.00 O ATOM 400 OE2 GLU A 26 -9.433 17.292 3.815 1.00 0.00 O ATOM 0 H GLU A 26 -13.519 16.188 1.134 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.178 15.836 -0.283 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -11.916 14.709 2.447 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.284 14.894 1.836 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -10.694 17.377 1.667 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -12.251 17.128 2.433 1.00 0.00 H new ATOM 407 N LEU A 27 -12.692 12.987 0.416 1.00 0.00 N ATOM 408 CA LEU A 27 -12.740 11.566 0.139 1.00 0.00 C ATOM 409 C LEU A 27 -13.004 11.301 -1.345 1.00 0.00 C ATOM 410 O LEU A 27 -12.461 10.361 -1.926 1.00 0.00 O ATOM 411 CB LEU A 27 -13.837 10.932 0.994 1.00 0.00 C ATOM 412 CG LEU A 27 -13.966 9.426 0.852 1.00 0.00 C ATOM 413 CD1 LEU A 27 -12.759 8.727 1.460 1.00 0.00 C ATOM 414 CD2 LEU A 27 -15.258 8.932 1.488 1.00 0.00 C ATOM 0 H LEU A 27 -13.429 13.312 1.042 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.775 11.123 0.386 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.645 11.169 2.040 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -14.791 11.390 0.734 1.00 0.00 H new ATOM 0 HG LEU A 27 -14.001 9.183 -0.210 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -12.869 7.648 1.349 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -11.854 9.054 0.949 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -12.689 8.977 2.519 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -15.329 7.850 1.374 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -15.262 9.186 2.548 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -16.109 9.405 0.998 1.00 0.00 H new ATOM 426 N VAL A 28 -13.823 12.151 -1.956 1.00 0.00 N ATOM 427 CA VAL A 28 -14.194 11.995 -3.359 1.00 0.00 C ATOM 428 C VAL A 28 -13.017 12.343 -4.267 1.00 0.00 C ATOM 429 O VAL A 28 -12.833 11.755 -5.335 1.00 0.00 O ATOM 430 CB VAL A 28 -15.399 12.890 -3.718 1.00 0.00 C ATOM 431 CG1 VAL A 28 -15.863 12.637 -5.144 1.00 0.00 C ATOM 432 CG2 VAL A 28 -16.536 12.669 -2.735 1.00 0.00 C ATOM 0 H VAL A 28 -14.245 12.959 -1.499 1.00 0.00 H new ATOM 0 HA VAL A 28 -14.473 10.952 -3.512 1.00 0.00 H new ATOM 0 HB VAL A 28 -15.081 13.930 -3.650 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -16.713 13.281 -5.370 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -15.049 12.855 -5.836 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -16.160 11.594 -5.250 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -17.378 13.308 -3.003 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -16.848 11.625 -2.768 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -16.199 12.915 -1.728 1.00 0.00 H new ATOM 442 N TYR A 29 -12.222 13.301 -3.829 1.00 0.00 N ATOM 443 CA TYR A 29 -11.042 13.717 -4.572 1.00 0.00 C ATOM 444 C TYR A 29 -9.935 12.669 -4.448 1.00 0.00 C ATOM 445 O TYR A 29 -9.046 12.578 -5.298 1.00 0.00 O ATOM 446 CB TYR A 29 -10.565 15.081 -4.052 1.00 0.00 C ATOM 447 CG TYR A 29 -9.479 15.726 -4.882 1.00 0.00 C ATOM 448 CD1 TYR A 29 -9.777 16.346 -6.088 1.00 0.00 C ATOM 449 CD2 TYR A 29 -8.160 15.723 -4.455 1.00 0.00 C ATOM 450 CE1 TYR A 29 -8.789 16.942 -6.845 1.00 0.00 C ATOM 451 CE2 TYR A 29 -7.167 16.319 -5.206 1.00 0.00 C ATOM 452 CZ TYR A 29 -7.487 16.926 -6.401 1.00 0.00 C ATOM 453 OH TYR A 29 -6.500 17.524 -7.151 1.00 0.00 O ATOM 0 H TYR A 29 -12.371 13.810 -2.958 1.00 0.00 H new ATOM 0 HA TYR A 29 -11.296 13.811 -5.628 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -11.419 15.757 -4.007 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -10.200 14.959 -3.032 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -10.798 16.362 -6.439 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -7.905 15.247 -3.520 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -9.037 17.419 -7.782 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -6.144 16.310 -4.859 1.00 0.00 H new ATOM 0 HH TYR A 29 -5.638 17.424 -6.696 1.00 0.00 H new ATOM 463 N VAL A 30 -10.007 11.878 -3.387 1.00 0.00 N ATOM 464 CA VAL A 30 -8.983 10.888 -3.089 1.00 0.00 C ATOM 465 C VAL A 30 -9.072 9.645 -3.980 1.00 0.00 C ATOM 466 O VAL A 30 -8.077 9.250 -4.587 1.00 0.00 O ATOM 467 CB VAL A 30 -9.039 10.459 -1.604 1.00 0.00 C ATOM 468 CG1 VAL A 30 -8.178 9.230 -1.354 1.00 0.00 C ATOM 469 CG2 VAL A 30 -8.589 11.598 -0.701 1.00 0.00 C ATOM 0 H VAL A 30 -10.772 11.904 -2.713 1.00 0.00 H new ATOM 0 HA VAL A 30 -8.030 11.376 -3.296 1.00 0.00 H new ATOM 0 HB VAL A 30 -10.074 10.208 -1.371 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -8.237 8.952 -0.302 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -8.536 8.404 -1.968 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -7.143 9.452 -1.613 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -8.635 11.277 0.340 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -7.565 11.877 -0.950 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -9.244 12.457 -0.845 1.00 0.00 H new ATOM 479 N LEU A 31 -10.252 9.033 -4.071 1.00 0.00 N ATOM 480 CA LEU A 31 -10.352 7.694 -4.656 1.00 0.00 C ATOM 481 C LEU A 31 -10.175 7.699 -6.172 1.00 0.00 C ATOM 482 O LEU A 31 -10.517 8.665 -6.860 1.00 0.00 O ATOM 483 CB LEU A 31 -11.670 6.997 -4.285 1.00 0.00 C ATOM 484 CG LEU A 31 -12.917 7.411 -5.075 1.00 0.00 C ATOM 485 CD1 LEU A 31 -14.022 6.389 -4.865 1.00 0.00 C ATOM 486 CD2 LEU A 31 -13.400 8.786 -4.651 1.00 0.00 C ATOM 0 H LEU A 31 -11.136 9.432 -3.755 1.00 0.00 H new ATOM 0 HA LEU A 31 -9.528 7.126 -4.225 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -11.532 5.923 -4.406 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -11.863 7.176 -3.227 1.00 0.00 H new ATOM 0 HG LEU A 31 -12.654 7.452 -6.132 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -14.906 6.688 -5.428 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -13.684 5.412 -5.211 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -14.269 6.333 -3.805 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -14.285 9.054 -5.227 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -13.648 8.773 -3.590 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -12.614 9.519 -4.831 1.00 0.00 H new ATOM 498 N ARG A 32 -9.634 6.592 -6.672 1.00 0.00 N ATOM 499 CA ARG A 32 -9.416 6.395 -8.098 1.00 0.00 C ATOM 500 C ARG A 32 -10.033 5.078 -8.558 1.00 0.00 C ATOM 501 O ARG A 32 -11.172 5.042 -9.014 1.00 0.00 O ATOM 502 CB ARG A 32 -7.921 6.392 -8.418 1.00 0.00 C ATOM 503 CG ARG A 32 -7.371 7.728 -8.884 1.00 0.00 C ATOM 504 CD ARG A 32 -7.930 8.109 -10.244 1.00 0.00 C ATOM 505 NE ARG A 32 -7.048 9.025 -10.963 1.00 0.00 N ATOM 506 CZ ARG A 32 -7.137 9.267 -12.271 1.00 0.00 C ATOM 507 NH1 ARG A 32 -8.109 8.715 -12.988 1.00 0.00 N ATOM 508 NH2 ARG A 32 -6.259 10.070 -12.856 1.00 0.00 N ATOM 0 H ARG A 32 -9.334 5.805 -6.096 1.00 0.00 H new ATOM 0 HA ARG A 32 -9.894 7.219 -8.627 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -7.373 6.079 -7.529 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -7.730 5.646 -9.190 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -7.620 8.500 -8.156 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -6.283 7.678 -8.936 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -8.080 7.208 -10.839 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -8.908 8.573 -10.117 1.00 0.00 H new ATOM 0 HE ARG A 32 -6.322 9.507 -10.434 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -8.790 8.104 -12.538 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -8.174 8.902 -13.989 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -5.517 10.502 -12.305 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -6.326 10.256 -13.857 1.00 0.00 H new ATOM 522 N HIS A 33 -9.277 3.995 -8.405 1.00 0.00 N ATOM 523 CA HIS A 33 -9.698 2.675 -8.864 1.00 0.00 C ATOM 524 C HIS A 33 -9.054 1.588 -8.005 1.00 0.00 C ATOM 525 O HIS A 33 -8.540 1.869 -6.924 1.00 0.00 O ATOM 526 CB HIS A 33 -9.313 2.473 -10.335 1.00 0.00 C ATOM 527 CG HIS A 33 -10.478 2.531 -11.280 1.00 0.00 C ATOM 528 ND1 HIS A 33 -10.887 1.452 -12.033 1.00 0.00 N ATOM 529 CD2 HIS A 33 -11.321 3.542 -11.587 1.00 0.00 C ATOM 530 CE1 HIS A 33 -11.935 1.798 -12.758 1.00 0.00 C ATOM 531 NE2 HIS A 33 -12.218 3.061 -12.505 1.00 0.00 N ATOM 0 H HIS A 33 -8.359 4.007 -7.961 1.00 0.00 H new ATOM 0 HA HIS A 33 -10.782 2.606 -8.771 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -8.588 3.236 -10.619 1.00 0.00 H new ATOM 0 HB3 HIS A 33 -8.818 1.508 -10.442 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -11.293 4.543 -11.184 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -12.470 1.156 -13.442 1.00 0.00 H new ATOM 0 HE2 HIS A 33 -12.980 3.593 -12.924 1.00 0.00 H new ATOM 540 N LYS A 34 -9.091 0.354 -8.489 1.00 0.00 N ATOM 541 CA LYS A 34 -8.481 -0.770 -7.790 1.00 0.00 C ATOM 542 C LYS A 34 -7.406 -1.390 -8.676 1.00 0.00 C ATOM 543 O LYS A 34 -7.075 -0.832 -9.719 1.00 0.00 O ATOM 544 CB LYS A 34 -9.549 -1.809 -7.428 1.00 0.00 C ATOM 545 CG LYS A 34 -10.154 -2.519 -8.632 1.00 0.00 C ATOM 546 CD LYS A 34 -11.317 -3.414 -8.238 1.00 0.00 C ATOM 547 CE LYS A 34 -12.542 -2.601 -7.859 1.00 0.00 C ATOM 548 NZ LYS A 34 -13.707 -3.462 -7.519 1.00 0.00 N ATOM 0 H LYS A 34 -9.541 0.104 -9.370 1.00 0.00 H new ATOM 0 HA LYS A 34 -8.021 -0.419 -6.866 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -9.108 -2.553 -6.764 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -10.346 -1.317 -6.871 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -10.495 -1.779 -9.356 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -9.387 -3.117 -9.124 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -11.562 -4.079 -9.066 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -11.024 -4.045 -7.399 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -12.303 -1.963 -7.008 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -12.808 -1.942 -8.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -14.519 -2.863 -7.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -13.953 -4.052 -8.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -13.464 -4.073 -6.713 1.00 0.00 H new ATOM 562 N HIS A 35 -6.860 -2.535 -8.276 1.00 0.00 N ATOM 563 CA HIS A 35 -5.850 -3.194 -9.097 1.00 0.00 C ATOM 564 C HIS A 35 -5.844 -4.705 -8.869 1.00 0.00 C ATOM 565 O HIS A 35 -5.610 -5.475 -9.796 1.00 0.00 O ATOM 566 CB HIS A 35 -4.459 -2.612 -8.814 1.00 0.00 C ATOM 567 CG HIS A 35 -3.524 -2.711 -9.984 1.00 0.00 C ATOM 568 ND1 HIS A 35 -2.842 -1.628 -10.495 1.00 0.00 N ATOM 569 CD2 HIS A 35 -3.159 -3.770 -10.747 1.00 0.00 C ATOM 570 CE1 HIS A 35 -2.108 -2.017 -11.518 1.00 0.00 C ATOM 571 NE2 HIS A 35 -2.277 -3.312 -11.696 1.00 0.00 N ATOM 0 H HIS A 35 -7.093 -3.017 -7.408 1.00 0.00 H new ATOM 0 HA HIS A 35 -6.104 -3.010 -10.141 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -4.562 -1.565 -8.528 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -4.021 -3.133 -7.963 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -3.499 -4.788 -10.630 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -1.472 -1.379 -12.113 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -1.829 -3.878 -12.416 1.00 0.00 H new ATOM 580 N GLY A 36 -6.089 -5.126 -7.635 1.00 0.00 N ATOM 581 CA GLY A 36 -6.116 -6.547 -7.337 1.00 0.00 C ATOM 582 C GLY A 36 -6.368 -6.822 -5.871 1.00 0.00 C ATOM 583 O GLY A 36 -6.870 -5.957 -5.154 1.00 0.00 O ATOM 0 H GLY A 36 -6.269 -4.514 -6.839 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.893 -7.026 -7.933 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -5.167 -6.996 -7.631 1.00 0.00 H new ATOM 587 N GLN A 37 -6.009 -8.021 -5.432 1.00 0.00 N ATOM 588 CA GLN A 37 -6.211 -8.431 -4.048 1.00 0.00 C ATOM 589 C GLN A 37 -4.924 -8.275 -3.248 1.00 0.00 C ATOM 590 O GLN A 37 -4.928 -7.717 -2.153 1.00 0.00 O ATOM 591 CB GLN A 37 -6.699 -9.882 -3.991 1.00 0.00 C ATOM 592 CG GLN A 37 -6.847 -10.419 -2.575 1.00 0.00 C ATOM 593 CD GLN A 37 -7.303 -11.863 -2.535 1.00 0.00 C ATOM 594 OE1 GLN A 37 -7.025 -12.648 -3.444 1.00 0.00 O ATOM 595 NE2 GLN A 37 -7.988 -12.228 -1.464 1.00 0.00 N ATOM 0 H GLN A 37 -5.573 -8.732 -6.019 1.00 0.00 H new ATOM 0 HA GLN A 37 -6.971 -7.787 -3.605 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -7.660 -9.954 -4.500 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -6.000 -10.514 -4.539 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -5.892 -10.331 -2.057 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -7.563 -9.802 -2.031 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -8.196 -11.546 -0.735 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -8.308 -13.192 -1.367 1.00 0.00 H new ATOM 604 N PHE A 38 -3.830 -8.782 -3.798 1.00 0.00 N ATOM 605 CA PHE A 38 -2.521 -8.636 -3.180 1.00 0.00 C ATOM 606 C PHE A 38 -1.573 -7.970 -4.164 1.00 0.00 C ATOM 607 O PHE A 38 -0.956 -8.640 -4.995 1.00 0.00 O ATOM 608 CB PHE A 38 -1.956 -9.995 -2.751 1.00 0.00 C ATOM 609 CG PHE A 38 -2.739 -10.671 -1.665 1.00 0.00 C ATOM 610 CD1 PHE A 38 -2.709 -10.185 -0.370 1.00 0.00 C ATOM 611 CD2 PHE A 38 -3.503 -11.792 -1.941 1.00 0.00 C ATOM 612 CE1 PHE A 38 -3.424 -10.807 0.632 1.00 0.00 C ATOM 613 CE2 PHE A 38 -4.219 -12.419 -0.941 1.00 0.00 C ATOM 614 CZ PHE A 38 -4.182 -11.925 0.346 1.00 0.00 C ATOM 0 H PHE A 38 -3.824 -9.301 -4.676 1.00 0.00 H new ATOM 0 HA PHE A 38 -2.625 -8.018 -2.288 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.920 -10.652 -3.620 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -0.929 -9.858 -2.412 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -2.120 -9.309 -0.141 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -3.539 -12.180 -2.948 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -3.391 -10.420 1.640 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -4.808 -13.296 -1.166 1.00 0.00 H new ATOM 0 HZ PHE A 38 -4.745 -12.412 1.129 1.00 0.00 H new ATOM 624 N ILE A 39 -1.479 -6.652 -4.098 1.00 0.00 N ATOM 625 CA ILE A 39 -0.695 -5.907 -5.066 1.00 0.00 C ATOM 626 C ILE A 39 0.393 -5.089 -4.385 1.00 0.00 C ATOM 627 O ILE A 39 0.124 -4.301 -3.475 1.00 0.00 O ATOM 628 CB ILE A 39 -1.588 -4.969 -5.916 1.00 0.00 C ATOM 629 CG1 ILE A 39 -2.680 -5.769 -6.639 1.00 0.00 C ATOM 630 CG2 ILE A 39 -0.746 -4.189 -6.919 1.00 0.00 C ATOM 631 CD1 ILE A 39 -2.141 -6.784 -7.623 1.00 0.00 C ATOM 0 H ILE A 39 -1.934 -6.079 -3.387 1.00 0.00 H new ATOM 0 HA ILE A 39 -0.228 -6.640 -5.724 1.00 0.00 H new ATOM 0 HB ILE A 39 -2.070 -4.258 -5.245 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -3.291 -6.284 -5.898 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -3.335 -5.077 -7.167 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.392 -3.536 -7.506 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -0.010 -3.587 -6.386 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -0.234 -4.885 -7.583 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -2.971 -7.310 -8.094 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -1.554 -6.274 -8.387 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -1.509 -7.500 -7.098 1.00 0.00 H new ATOM 643 N TYR A 40 1.624 -5.304 -4.818 1.00 0.00 N ATOM 644 CA TYR A 40 2.749 -4.501 -4.379 1.00 0.00 C ATOM 645 C TYR A 40 3.194 -3.599 -5.526 1.00 0.00 C ATOM 646 O TYR A 40 3.642 -4.081 -6.572 1.00 0.00 O ATOM 647 CB TYR A 40 3.905 -5.401 -3.928 1.00 0.00 C ATOM 648 CG TYR A 40 5.055 -4.650 -3.289 1.00 0.00 C ATOM 649 CD1 TYR A 40 6.045 -4.051 -4.062 1.00 0.00 C ATOM 650 CD2 TYR A 40 5.152 -4.543 -1.910 1.00 0.00 C ATOM 651 CE1 TYR A 40 7.094 -3.368 -3.476 1.00 0.00 C ATOM 652 CE2 TYR A 40 6.197 -3.862 -1.316 1.00 0.00 C ATOM 653 CZ TYR A 40 7.165 -3.276 -2.101 1.00 0.00 C ATOM 654 OH TYR A 40 8.207 -2.599 -1.510 1.00 0.00 O ATOM 0 H TYR A 40 1.870 -6.038 -5.482 1.00 0.00 H new ATOM 0 HA TYR A 40 2.447 -3.887 -3.530 1.00 0.00 H new ATOM 0 HB2 TYR A 40 3.525 -6.136 -3.218 1.00 0.00 H new ATOM 0 HB3 TYR A 40 4.279 -5.954 -4.789 1.00 0.00 H new ATOM 0 HD1 TYR A 40 5.993 -4.121 -5.138 1.00 0.00 H new ATOM 0 HD2 TYR A 40 4.396 -5.001 -1.289 1.00 0.00 H new ATOM 0 HE1 TYR A 40 7.854 -2.909 -4.091 1.00 0.00 H new ATOM 0 HE2 TYR A 40 6.255 -3.789 -0.240 1.00 0.00 H new ATOM 0 HH TYR A 40 8.511 -1.883 -2.105 1.00 0.00 H new ATOM 664 N VAL A 41 3.050 -2.301 -5.339 1.00 0.00 N ATOM 665 CA VAL A 41 3.399 -1.342 -6.376 1.00 0.00 C ATOM 666 C VAL A 41 4.410 -0.329 -5.862 1.00 0.00 C ATOM 667 O VAL A 41 4.065 0.589 -5.120 1.00 0.00 O ATOM 668 CB VAL A 41 2.150 -0.610 -6.923 1.00 0.00 C ATOM 669 CG1 VAL A 41 1.399 -1.500 -7.894 1.00 0.00 C ATOM 670 CG2 VAL A 41 1.226 -0.172 -5.790 1.00 0.00 C ATOM 0 H VAL A 41 2.694 -1.884 -4.479 1.00 0.00 H new ATOM 0 HA VAL A 41 3.847 -1.905 -7.194 1.00 0.00 H new ATOM 0 HB VAL A 41 2.489 0.283 -7.449 1.00 0.00 H new ATOM 0 HG11 VAL A 41 0.523 -0.971 -8.270 1.00 0.00 H new ATOM 0 HG12 VAL A 41 2.051 -1.760 -8.728 1.00 0.00 H new ATOM 0 HG13 VAL A 41 1.082 -2.409 -7.383 1.00 0.00 H new ATOM 0 HG21 VAL A 41 0.358 0.339 -6.206 1.00 0.00 H new ATOM 0 HG22 VAL A 41 0.898 -1.047 -5.229 1.00 0.00 H new ATOM 0 HG23 VAL A 41 1.762 0.505 -5.125 1.00 0.00 H new ATOM 680 N TRP A 42 5.662 -0.510 -6.248 1.00 0.00 N ATOM 681 CA TRP A 42 6.722 0.376 -5.803 1.00 0.00 C ATOM 682 C TRP A 42 6.821 1.592 -6.718 1.00 0.00 C ATOM 683 O TRP A 42 7.062 1.471 -7.925 1.00 0.00 O ATOM 684 CB TRP A 42 8.063 -0.373 -5.703 1.00 0.00 C ATOM 685 CG TRP A 42 8.504 -1.074 -6.956 1.00 0.00 C ATOM 686 CD1 TRP A 42 7.946 -2.185 -7.520 1.00 0.00 C ATOM 687 CD2 TRP A 42 9.624 -0.726 -7.778 1.00 0.00 C ATOM 688 NE1 TRP A 42 8.639 -2.537 -8.653 1.00 0.00 N ATOM 689 CE2 TRP A 42 9.676 -1.659 -8.829 1.00 0.00 C ATOM 690 CE3 TRP A 42 10.583 0.288 -7.730 1.00 0.00 C ATOM 691 CZ2 TRP A 42 10.650 -1.609 -9.822 1.00 0.00 C ATOM 692 CZ3 TRP A 42 11.552 0.335 -8.714 1.00 0.00 C ATOM 693 CH2 TRP A 42 11.578 -0.608 -9.748 1.00 0.00 C ATOM 0 H TRP A 42 5.968 -1.261 -6.867 1.00 0.00 H new ATOM 0 HA TRP A 42 6.477 0.732 -4.802 1.00 0.00 H new ATOM 0 HB2 TRP A 42 8.836 0.338 -5.413 1.00 0.00 H new ATOM 0 HB3 TRP A 42 7.990 -1.108 -4.902 1.00 0.00 H new ATOM 0 HD1 TRP A 42 7.086 -2.710 -7.132 1.00 0.00 H new ATOM 0 HE1 TRP A 42 8.418 -3.324 -9.263 1.00 0.00 H new ATOM 0 HE3 TRP A 42 10.568 1.022 -6.938 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 10.672 -2.335 -10.622 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 12.302 1.112 -8.685 1.00 0.00 H new ATOM 0 HH2 TRP A 42 12.347 -0.543 -10.503 1.00 0.00 H new ATOM 704 N GLY A 43 6.598 2.761 -6.135 1.00 0.00 N ATOM 705 CA GLY A 43 6.624 3.991 -6.888 1.00 0.00 C ATOM 706 C GLY A 43 6.325 5.187 -6.008 1.00 0.00 C ATOM 707 O GLY A 43 6.286 5.055 -4.783 1.00 0.00 O ATOM 0 H GLY A 43 6.398 2.876 -5.142 1.00 0.00 H new ATOM 0 HA2 GLY A 43 7.603 4.115 -7.351 1.00 0.00 H new ATOM 0 HA3 GLY A 43 5.893 3.940 -7.695 1.00 0.00 H new ATOM 711 N GLU A 44 6.099 6.340 -6.636 1.00 0.00 N ATOM 712 CA GLU A 44 5.833 7.592 -5.920 1.00 0.00 C ATOM 713 C GLU A 44 7.004 7.970 -5.014 1.00 0.00 C ATOM 714 O GLU A 44 8.109 7.445 -5.165 1.00 0.00 O ATOM 715 CB GLU A 44 4.536 7.506 -5.106 1.00 0.00 C ATOM 716 CG GLU A 44 3.285 7.410 -5.967 1.00 0.00 C ATOM 717 CD GLU A 44 2.004 7.567 -5.168 1.00 0.00 C ATOM 718 OE1 GLU A 44 2.074 7.942 -3.976 1.00 0.00 O ATOM 719 OE2 GLU A 44 0.915 7.339 -5.737 1.00 0.00 O ATOM 0 H GLU A 44 6.095 6.435 -7.652 1.00 0.00 H new ATOM 0 HA GLU A 44 5.713 8.374 -6.670 1.00 0.00 H new ATOM 0 HB2 GLU A 44 4.584 6.636 -4.451 1.00 0.00 H new ATOM 0 HB3 GLU A 44 4.460 8.384 -4.465 1.00 0.00 H new ATOM 0 HG2 GLU A 44 3.322 8.178 -6.739 1.00 0.00 H new ATOM 0 HG3 GLU A 44 3.274 6.446 -6.476 1.00 0.00 H new ATOM 726 N GLU A 45 6.768 8.903 -4.095 1.00 0.00 N ATOM 727 CA GLU A 45 7.808 9.347 -3.175 1.00 0.00 C ATOM 728 C GLU A 45 7.216 10.176 -2.037 1.00 0.00 C ATOM 729 O GLU A 45 6.941 9.660 -0.954 1.00 0.00 O ATOM 730 CB GLU A 45 8.869 10.169 -3.913 1.00 0.00 C ATOM 731 CG GLU A 45 10.070 10.526 -3.055 1.00 0.00 C ATOM 732 CD GLU A 45 10.973 11.539 -3.722 1.00 0.00 C ATOM 733 OE1 GLU A 45 11.729 11.160 -4.643 1.00 0.00 O ATOM 734 OE2 GLU A 45 10.928 12.723 -3.330 1.00 0.00 O ATOM 0 H GLU A 45 5.867 9.365 -3.969 1.00 0.00 H new ATOM 0 HA GLU A 45 8.277 8.458 -2.753 1.00 0.00 H new ATOM 0 HB2 GLU A 45 9.209 9.609 -4.784 1.00 0.00 H new ATOM 0 HB3 GLU A 45 8.412 11.087 -4.283 1.00 0.00 H new ATOM 0 HG2 GLU A 45 9.726 10.923 -2.100 1.00 0.00 H new ATOM 0 HG3 GLU A 45 10.640 9.622 -2.838 1.00 0.00 H new ATOM 741 N GLY A 46 7.012 11.461 -2.296 1.00 0.00 N ATOM 742 CA GLY A 46 6.509 12.355 -1.275 1.00 0.00 C ATOM 743 C GLY A 46 5.609 13.426 -1.850 1.00 0.00 C ATOM 744 O GLY A 46 5.067 13.251 -2.944 1.00 0.00 O ATOM 0 H GLY A 46 7.187 11.900 -3.200 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.958 11.781 -0.530 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.347 12.824 -0.760 1.00 0.00 H new ATOM 748 N ALA A 47 5.465 14.533 -1.113 1.00 0.00 N ATOM 749 CA ALA A 47 4.558 15.631 -1.470 1.00 0.00 C ATOM 750 C ALA A 47 3.106 15.168 -1.397 1.00 0.00 C ATOM 751 O ALA A 47 2.383 15.498 -0.460 1.00 0.00 O ATOM 752 CB ALA A 47 4.886 16.203 -2.848 1.00 0.00 C ATOM 0 H ALA A 47 5.978 14.694 -0.246 1.00 0.00 H new ATOM 0 HA ALA A 47 4.699 16.433 -0.746 1.00 0.00 H new ATOM 0 HB1 ALA A 47 4.195 17.013 -3.079 1.00 0.00 H new ATOM 0 HB2 ALA A 47 5.907 16.585 -2.850 1.00 0.00 H new ATOM 0 HB3 ALA A 47 4.791 15.419 -3.599 1.00 0.00 H new ATOM 758 N GLY A 48 2.697 14.393 -2.383 1.00 0.00 N ATOM 759 CA GLY A 48 1.400 13.760 -2.354 1.00 0.00 C ATOM 760 C GLY A 48 1.555 12.265 -2.202 1.00 0.00 C ATOM 761 O GLY A 48 1.012 11.493 -2.987 1.00 0.00 O ATOM 0 H GLY A 48 3.249 14.188 -3.216 1.00 0.00 H new ATOM 0 HA2 GLY A 48 0.811 14.158 -1.528 1.00 0.00 H new ATOM 0 HA3 GLY A 48 0.856 13.986 -3.271 1.00 0.00 H new ATOM 765 N LYS A 49 2.319 11.869 -1.186 1.00 0.00 N ATOM 766 CA LYS A 49 2.700 10.473 -0.986 1.00 0.00 C ATOM 767 C LYS A 49 1.486 9.582 -0.758 1.00 0.00 C ATOM 768 O LYS A 49 0.453 10.035 -0.243 1.00 0.00 O ATOM 769 CB LYS A 49 3.663 10.345 0.200 1.00 0.00 C ATOM 770 CG LYS A 49 3.041 10.703 1.541 1.00 0.00 C ATOM 771 CD LYS A 49 4.009 10.474 2.690 1.00 0.00 C ATOM 772 CE LYS A 49 4.460 9.020 2.775 1.00 0.00 C ATOM 773 NZ LYS A 49 3.331 8.092 3.053 1.00 0.00 N ATOM 0 H LYS A 49 2.690 12.505 -0.480 1.00 0.00 H new ATOM 0 HA LYS A 49 3.198 10.140 -1.897 1.00 0.00 H new ATOM 0 HB2 LYS A 49 4.035 9.321 0.245 1.00 0.00 H new ATOM 0 HB3 LYS A 49 4.525 10.990 0.027 1.00 0.00 H new ATOM 0 HG2 LYS A 49 2.730 11.748 1.530 1.00 0.00 H new ATOM 0 HG3 LYS A 49 2.143 10.105 1.697 1.00 0.00 H new ATOM 0 HD2 LYS A 49 4.880 11.117 2.564 1.00 0.00 H new ATOM 0 HD3 LYS A 49 3.533 10.762 3.628 1.00 0.00 H new ATOM 0 HE2 LYS A 49 4.939 8.735 1.838 1.00 0.00 H new ATOM 0 HE3 LYS A 49 5.210 8.920 3.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 3.705 7.174 3.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 2.727 8.494 3.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 2.770 7.959 2.187 1.00 0.00 H new ATOM 787 N SER A 50 1.625 8.318 -1.149 1.00 0.00 N ATOM 788 CA SER A 50 0.576 7.323 -0.975 1.00 0.00 C ATOM 789 C SER A 50 -0.651 7.725 -1.785 1.00 0.00 C ATOM 790 O SER A 50 -1.786 7.456 -1.398 1.00 0.00 O ATOM 791 CB SER A 50 0.222 7.192 0.510 1.00 0.00 C ATOM 792 OG SER A 50 1.395 7.172 1.312 1.00 0.00 O ATOM 0 H SER A 50 2.468 7.957 -1.595 1.00 0.00 H new ATOM 0 HA SER A 50 0.930 6.356 -1.332 1.00 0.00 H new ATOM 0 HB2 SER A 50 -0.415 8.024 0.811 1.00 0.00 H new ATOM 0 HB3 SER A 50 -0.350 6.278 0.672 1.00 0.00 H new ATOM 0 HG SER A 50 1.887 6.340 1.151 1.00 0.00 H new ATOM 798 N HIS A 51 -0.398 8.346 -2.927 1.00 0.00 N ATOM 799 CA HIS A 51 -1.446 8.928 -3.750 1.00 0.00 C ATOM 800 C HIS A 51 -2.315 7.842 -4.371 1.00 0.00 C ATOM 801 O HIS A 51 -3.536 7.852 -4.225 1.00 0.00 O ATOM 802 CB HIS A 51 -0.816 9.801 -4.834 1.00 0.00 C ATOM 803 CG HIS A 51 -1.783 10.692 -5.547 1.00 0.00 C ATOM 804 ND1 HIS A 51 -1.867 10.770 -6.916 1.00 0.00 N ATOM 805 CD2 HIS A 51 -2.689 11.572 -5.066 1.00 0.00 C ATOM 806 CE1 HIS A 51 -2.781 11.663 -7.248 1.00 0.00 C ATOM 807 NE2 HIS A 51 -3.297 12.166 -6.142 1.00 0.00 N ATOM 0 H HIS A 51 0.541 8.460 -3.309 1.00 0.00 H new ATOM 0 HA HIS A 51 -2.087 9.546 -3.121 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -0.038 10.417 -4.382 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -0.327 9.156 -5.565 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -2.896 11.771 -4.025 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -3.060 11.936 -8.255 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -4.026 12.878 -6.096 1.00 0.00 H new ATOM 816 N LEU A 52 -1.685 6.899 -5.055 1.00 0.00 N ATOM 817 CA LEU A 52 -2.407 5.771 -5.630 1.00 0.00 C ATOM 818 C LEU A 52 -2.891 4.831 -4.531 1.00 0.00 C ATOM 819 O LEU A 52 -3.890 4.132 -4.693 1.00 0.00 O ATOM 820 CB LEU A 52 -1.524 5.010 -6.621 1.00 0.00 C ATOM 821 CG LEU A 52 -1.064 5.814 -7.841 1.00 0.00 C ATOM 822 CD1 LEU A 52 -0.168 4.968 -8.733 1.00 0.00 C ATOM 823 CD2 LEU A 52 -2.261 6.333 -8.631 1.00 0.00 C ATOM 0 H LEU A 52 -0.679 6.891 -5.226 1.00 0.00 H new ATOM 0 HA LEU A 52 -3.273 6.161 -6.166 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -0.642 4.647 -6.092 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -2.070 4.133 -6.969 1.00 0.00 H new ATOM 0 HG LEU A 52 -0.491 6.670 -7.485 1.00 0.00 H new ATOM 0 HD11 LEU A 52 0.148 5.557 -9.594 1.00 0.00 H new ATOM 0 HD12 LEU A 52 0.709 4.649 -8.170 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -0.718 4.092 -9.075 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -1.910 6.901 -9.493 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -2.864 5.492 -8.972 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -2.866 6.978 -7.993 1.00 0.00 H new ATOM 835 N LEU A 53 -2.175 4.832 -3.411 1.00 0.00 N ATOM 836 CA LEU A 53 -2.510 3.980 -2.276 1.00 0.00 C ATOM 837 C LEU A 53 -3.838 4.408 -1.645 1.00 0.00 C ATOM 838 O LEU A 53 -4.741 3.592 -1.452 1.00 0.00 O ATOM 839 CB LEU A 53 -1.390 4.041 -1.231 1.00 0.00 C ATOM 840 CG LEU A 53 -1.548 3.097 -0.036 1.00 0.00 C ATOM 841 CD1 LEU A 53 -1.393 1.648 -0.468 1.00 0.00 C ATOM 842 CD2 LEU A 53 -0.540 3.439 1.049 1.00 0.00 C ATOM 0 H LEU A 53 -1.353 5.418 -3.265 1.00 0.00 H new ATOM 0 HA LEU A 53 -2.616 2.956 -2.634 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -0.444 3.818 -1.725 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.321 5.063 -0.857 1.00 0.00 H new ATOM 0 HG LEU A 53 -2.551 3.226 0.369 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -1.509 0.996 0.398 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -2.154 1.406 -1.209 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -0.404 1.502 -0.902 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -0.666 2.758 1.891 1.00 0.00 H new ATOM 0 HD22 LEU A 53 0.470 3.341 0.651 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.700 4.464 1.384 1.00 0.00 H new ATOM 854 N GLN A 54 -3.953 5.695 -1.337 1.00 0.00 N ATOM 855 CA GLN A 54 -5.159 6.237 -0.712 1.00 0.00 C ATOM 856 C GLN A 54 -6.339 6.154 -1.667 1.00 0.00 C ATOM 857 O GLN A 54 -7.482 5.935 -1.255 1.00 0.00 O ATOM 858 CB GLN A 54 -4.926 7.690 -0.282 1.00 0.00 C ATOM 859 CG GLN A 54 -4.629 8.638 -1.431 1.00 0.00 C ATOM 860 CD GLN A 54 -4.283 10.037 -0.964 1.00 0.00 C ATOM 861 OE1 GLN A 54 -5.154 10.892 -0.825 1.00 0.00 O ATOM 862 NE2 GLN A 54 -3.005 10.279 -0.724 1.00 0.00 N ATOM 0 H GLN A 54 -3.224 6.387 -1.510 1.00 0.00 H new ATOM 0 HA GLN A 54 -5.388 5.641 0.172 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -5.809 8.046 0.249 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -4.095 7.720 0.423 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -3.801 8.241 -2.019 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -5.495 8.684 -2.091 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -2.313 9.540 -0.852 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -2.711 11.204 -0.411 1.00 0.00 H new ATOM 871 N ALA A 55 -6.035 6.317 -2.944 1.00 0.00 N ATOM 872 CA ALA A 55 -7.033 6.250 -4.005 1.00 0.00 C ATOM 873 C ALA A 55 -7.742 4.897 -4.029 1.00 0.00 C ATOM 874 O ALA A 55 -8.909 4.800 -4.412 1.00 0.00 O ATOM 875 CB ALA A 55 -6.373 6.524 -5.344 1.00 0.00 C ATOM 0 H ALA A 55 -5.089 6.500 -3.277 1.00 0.00 H new ATOM 0 HA ALA A 55 -7.789 7.010 -3.809 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -7.121 6.473 -6.135 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -5.924 7.517 -5.332 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.599 5.778 -5.528 1.00 0.00 H new ATOM 881 N TRP A 56 -7.027 3.859 -3.619 1.00 0.00 N ATOM 882 CA TRP A 56 -7.578 2.513 -3.564 1.00 0.00 C ATOM 883 C TRP A 56 -8.423 2.335 -2.308 1.00 0.00 C ATOM 884 O TRP A 56 -9.505 1.745 -2.350 1.00 0.00 O ATOM 885 CB TRP A 56 -6.436 1.495 -3.596 1.00 0.00 C ATOM 886 CG TRP A 56 -6.861 0.065 -3.431 1.00 0.00 C ATOM 887 CD1 TRP A 56 -7.451 -0.737 -4.365 1.00 0.00 C ATOM 888 CD2 TRP A 56 -6.717 -0.735 -2.250 1.00 0.00 C ATOM 889 NE1 TRP A 56 -7.680 -1.987 -3.839 1.00 0.00 N ATOM 890 CE2 TRP A 56 -7.235 -2.010 -2.544 1.00 0.00 C ATOM 891 CE3 TRP A 56 -6.196 -0.499 -0.976 1.00 0.00 C ATOM 892 CZ2 TRP A 56 -7.247 -3.042 -1.609 1.00 0.00 C ATOM 893 CZ3 TRP A 56 -6.209 -1.523 -0.049 1.00 0.00 C ATOM 894 CH2 TRP A 56 -6.729 -2.781 -0.370 1.00 0.00 C ATOM 0 H TRP A 56 -6.055 3.925 -3.317 1.00 0.00 H new ATOM 0 HA TRP A 56 -8.222 2.352 -4.428 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -5.906 1.595 -4.543 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -5.726 1.742 -2.806 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -7.702 -0.434 -5.371 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -8.111 -2.769 -4.333 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -5.790 0.468 -0.720 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -7.651 -4.013 -1.853 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -5.811 -1.349 0.940 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -6.721 -3.562 0.375 1.00 0.00 H new ATOM 905 N VAL A 57 -7.925 2.864 -1.197 1.00 0.00 N ATOM 906 CA VAL A 57 -8.607 2.761 0.089 1.00 0.00 C ATOM 907 C VAL A 57 -9.990 3.405 0.031 1.00 0.00 C ATOM 908 O VAL A 57 -10.991 2.782 0.387 1.00 0.00 O ATOM 909 CB VAL A 57 -7.788 3.431 1.210 1.00 0.00 C ATOM 910 CG1 VAL A 57 -8.460 3.249 2.564 1.00 0.00 C ATOM 911 CG2 VAL A 57 -6.375 2.878 1.236 1.00 0.00 C ATOM 0 H VAL A 57 -7.042 3.374 -1.161 1.00 0.00 H new ATOM 0 HA VAL A 57 -8.713 1.699 0.309 1.00 0.00 H new ATOM 0 HB VAL A 57 -7.740 4.500 1.001 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -7.860 3.732 3.336 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -9.452 3.699 2.541 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -8.549 2.186 2.786 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -5.810 3.361 2.033 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -6.408 1.803 1.415 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -5.891 3.072 0.279 1.00 0.00 H new ATOM 921 N ALA A 58 -10.036 4.648 -0.443 1.00 0.00 N ATOM 922 CA ALA A 58 -11.287 5.395 -0.526 1.00 0.00 C ATOM 923 C ALA A 58 -12.254 4.734 -1.504 1.00 0.00 C ATOM 924 O ALA A 58 -13.473 4.809 -1.336 1.00 0.00 O ATOM 925 CB ALA A 58 -11.016 6.835 -0.933 1.00 0.00 C ATOM 0 H ALA A 58 -9.219 5.159 -0.776 1.00 0.00 H new ATOM 0 HA ALA A 58 -11.752 5.393 0.460 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -11.958 7.380 -0.991 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -10.369 7.306 -0.193 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -10.527 6.852 -1.907 1.00 0.00 H new ATOM 931 N GLN A 59 -11.696 4.074 -2.515 1.00 0.00 N ATOM 932 CA GLN A 59 -12.489 3.360 -3.508 1.00 0.00 C ATOM 933 C GLN A 59 -13.239 2.205 -2.848 1.00 0.00 C ATOM 934 O GLN A 59 -14.414 1.968 -3.134 1.00 0.00 O ATOM 935 CB GLN A 59 -11.571 2.865 -4.642 1.00 0.00 C ATOM 936 CG GLN A 59 -12.267 2.033 -5.710 1.00 0.00 C ATOM 937 CD GLN A 59 -12.355 0.558 -5.355 1.00 0.00 C ATOM 938 OE1 GLN A 59 -11.392 0.067 -4.588 1.00 0.00 O flip ATOM 939 NE2 GLN A 59 -13.283 -0.136 -5.766 1.00 0.00 N flip ATOM 0 H GLN A 59 -10.689 4.020 -2.668 1.00 0.00 H new ATOM 0 HA GLN A 59 -13.231 4.032 -3.940 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -11.108 3.729 -5.119 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -10.767 2.272 -4.207 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -13.273 2.423 -5.868 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -11.731 2.142 -6.653 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -14.007 0.277 -6.355 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -13.329 -1.124 -5.518 1.00 0.00 H new ATOM 948 N ALA A 60 -12.560 1.518 -1.943 1.00 0.00 N ATOM 949 CA ALA A 60 -13.145 0.387 -1.237 1.00 0.00 C ATOM 950 C ALA A 60 -14.151 0.859 -0.195 1.00 0.00 C ATOM 951 O ALA A 60 -15.117 0.159 0.117 1.00 0.00 O ATOM 952 CB ALA A 60 -12.056 -0.445 -0.582 1.00 0.00 C ATOM 0 H ALA A 60 -11.597 1.725 -1.678 1.00 0.00 H new ATOM 0 HA ALA A 60 -13.672 -0.233 -1.962 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -12.507 -1.287 -0.058 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -11.373 -0.817 -1.346 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -11.505 0.171 0.128 1.00 0.00 H new ATOM 958 N LEU A 61 -13.923 2.055 0.328 1.00 0.00 N ATOM 959 CA LEU A 61 -14.813 2.639 1.321 1.00 0.00 C ATOM 960 C LEU A 61 -16.196 2.888 0.740 1.00 0.00 C ATOM 961 O LEU A 61 -17.200 2.489 1.327 1.00 0.00 O ATOM 962 CB LEU A 61 -14.220 3.943 1.864 1.00 0.00 C ATOM 963 CG LEU A 61 -12.963 3.776 2.720 1.00 0.00 C ATOM 964 CD1 LEU A 61 -12.405 5.131 3.127 1.00 0.00 C ATOM 965 CD2 LEU A 61 -13.265 2.939 3.952 1.00 0.00 C ATOM 0 H LEU A 61 -13.126 2.642 0.080 1.00 0.00 H new ATOM 0 HA LEU A 61 -14.916 1.929 2.142 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -13.984 4.595 1.023 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -14.980 4.451 2.457 1.00 0.00 H new ATOM 0 HG LEU A 61 -12.211 3.259 2.123 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -11.512 4.989 3.735 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -12.149 5.702 2.235 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -13.154 5.674 3.704 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -12.360 2.831 4.549 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -14.035 3.431 4.546 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -13.617 1.954 3.645 1.00 0.00 H new ATOM 977 N GLU A 62 -16.257 3.522 -0.426 1.00 0.00 N ATOM 978 CA GLU A 62 -17.543 3.811 -1.051 1.00 0.00 C ATOM 979 C GLU A 62 -18.128 2.568 -1.697 1.00 0.00 C ATOM 980 O GLU A 62 -19.299 2.540 -2.076 1.00 0.00 O ATOM 981 CB GLU A 62 -17.429 4.924 -2.074 1.00 0.00 C ATOM 982 CG GLU A 62 -17.000 6.228 -1.451 1.00 0.00 C ATOM 983 CD GLU A 62 -17.363 7.421 -2.303 1.00 0.00 C ATOM 984 OE1 GLU A 62 -16.749 7.619 -3.369 1.00 0.00 O ATOM 985 OE2 GLU A 62 -18.291 8.158 -1.911 1.00 0.00 O ATOM 0 H GLU A 62 -15.443 3.842 -0.952 1.00 0.00 H new ATOM 0 HA GLU A 62 -18.215 4.144 -0.260 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -16.711 4.637 -2.842 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -18.390 5.059 -2.570 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -17.466 6.330 -0.471 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -15.922 6.214 -1.291 1.00 0.00 H new ATOM 992 N ALA A 63 -17.299 1.543 -1.822 1.00 0.00 N ATOM 993 CA ALA A 63 -17.750 0.248 -2.311 1.00 0.00 C ATOM 994 C ALA A 63 -18.541 -0.486 -1.231 1.00 0.00 C ATOM 995 O ALA A 63 -19.117 -1.544 -1.479 1.00 0.00 O ATOM 996 CB ALA A 63 -16.570 -0.593 -2.771 1.00 0.00 C ATOM 0 H ALA A 63 -16.306 1.583 -1.591 1.00 0.00 H new ATOM 0 HA ALA A 63 -18.405 0.415 -3.166 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -16.929 -1.557 -3.133 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -16.046 -0.076 -3.575 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -15.888 -0.750 -1.936 1.00 0.00 H new ATOM 1002 N GLY A 64 -18.549 0.079 -0.026 1.00 0.00 N ATOM 1003 CA GLY A 64 -19.327 -0.490 1.059 1.00 0.00 C ATOM 1004 C GLY A 64 -18.515 -1.441 1.910 1.00 0.00 C ATOM 1005 O GLY A 64 -19.055 -2.124 2.783 1.00 0.00 O ATOM 0 H GLY A 64 -18.029 0.922 0.217 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -19.715 0.313 1.685 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -20.188 -1.018 0.648 1.00 0.00 H new ATOM 1009 N LYS A 65 -17.213 -1.469 1.673 1.00 0.00 N ATOM 1010 CA LYS A 65 -16.327 -2.380 2.371 1.00 0.00 C ATOM 1011 C LYS A 65 -15.693 -1.672 3.561 1.00 0.00 C ATOM 1012 O LYS A 65 -15.951 -0.493 3.807 1.00 0.00 O ATOM 1013 CB LYS A 65 -15.223 -2.867 1.426 1.00 0.00 C ATOM 1014 CG LYS A 65 -15.713 -3.303 0.052 1.00 0.00 C ATOM 1015 CD LYS A 65 -16.587 -4.543 0.120 1.00 0.00 C ATOM 1016 CE LYS A 65 -17.070 -4.948 -1.264 1.00 0.00 C ATOM 1017 NZ LYS A 65 -17.946 -6.145 -1.219 1.00 0.00 N ATOM 0 H LYS A 65 -16.746 -0.865 0.997 1.00 0.00 H new ATOM 0 HA LYS A 65 -16.906 -3.235 2.720 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -14.492 -2.068 1.300 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -14.704 -3.703 1.895 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -16.275 -2.489 -0.406 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -14.856 -3.500 -0.592 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -16.026 -5.363 0.567 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -17.444 -4.353 0.767 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -17.613 -4.118 -1.716 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -16.211 -5.152 -1.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -18.253 -6.387 -2.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -17.420 -6.945 -0.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -18.780 -5.943 -0.631 1.00 0.00 H new ATOM 1031 N ASN A 66 -14.866 -2.391 4.296 1.00 0.00 N ATOM 1032 CA ASN A 66 -14.086 -1.790 5.370 1.00 0.00 C ATOM 1033 C ASN A 66 -12.644 -1.669 4.907 1.00 0.00 C ATOM 1034 O ASN A 66 -12.078 -2.624 4.370 1.00 0.00 O ATOM 1035 CB ASN A 66 -14.156 -2.639 6.649 1.00 0.00 C ATOM 1036 CG ASN A 66 -13.628 -1.911 7.881 1.00 0.00 C ATOM 1037 OD1 ASN A 66 -12.797 -1.009 7.786 1.00 0.00 O ATOM 1038 ND2 ASN A 66 -14.089 -2.319 9.053 1.00 0.00 N ATOM 0 H ASN A 66 -14.714 -3.392 4.172 1.00 0.00 H new ATOM 0 HA ASN A 66 -14.495 -0.807 5.603 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -15.190 -2.935 6.825 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -13.583 -3.554 6.502 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -13.755 -1.883 9.912 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -14.778 -3.070 9.097 1.00 0.00 H new ATOM 1045 N ALA A 67 -12.053 -0.512 5.122 1.00 0.00 N ATOM 1046 CA ALA A 67 -10.702 -0.255 4.661 1.00 0.00 C ATOM 1047 C ALA A 67 -9.972 0.653 5.632 1.00 0.00 C ATOM 1048 O ALA A 67 -10.564 1.574 6.200 1.00 0.00 O ATOM 1049 CB ALA A 67 -10.725 0.359 3.266 1.00 0.00 C ATOM 0 H ALA A 67 -12.488 0.268 5.615 1.00 0.00 H new ATOM 0 HA ALA A 67 -10.167 -1.203 4.612 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -9.704 0.546 2.934 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -11.211 -0.328 2.574 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -11.276 1.299 3.291 1.00 0.00 H new ATOM 1055 N ALA A 68 -8.695 0.379 5.831 1.00 0.00 N ATOM 1056 CA ALA A 68 -7.872 1.173 6.724 1.00 0.00 C ATOM 1057 C ALA A 68 -6.511 1.444 6.099 1.00 0.00 C ATOM 1058 O ALA A 68 -5.841 0.527 5.615 1.00 0.00 O ATOM 1059 CB ALA A 68 -7.709 0.476 8.066 1.00 0.00 C ATOM 0 H ALA A 68 -8.203 -0.394 5.382 1.00 0.00 H new ATOM 0 HA ALA A 68 -8.373 2.127 6.890 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -7.089 1.088 8.721 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -8.688 0.333 8.523 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -7.233 -0.493 7.917 1.00 0.00 H new ATOM 1065 N TYR A 69 -6.116 2.706 6.103 1.00 0.00 N ATOM 1066 CA TYR A 69 -4.826 3.106 5.574 1.00 0.00 C ATOM 1067 C TYR A 69 -3.916 3.536 6.714 1.00 0.00 C ATOM 1068 O TYR A 69 -4.302 4.347 7.560 1.00 0.00 O ATOM 1069 CB TYR A 69 -4.979 4.230 4.536 1.00 0.00 C ATOM 1070 CG TYR A 69 -5.610 5.509 5.056 1.00 0.00 C ATOM 1071 CD1 TYR A 69 -6.991 5.650 5.128 1.00 0.00 C ATOM 1072 CD2 TYR A 69 -4.819 6.580 5.464 1.00 0.00 C ATOM 1073 CE1 TYR A 69 -7.567 6.822 5.589 1.00 0.00 C ATOM 1074 CE2 TYR A 69 -5.387 7.751 5.928 1.00 0.00 C ATOM 1075 CZ TYR A 69 -6.761 7.868 5.990 1.00 0.00 C ATOM 1076 OH TYR A 69 -7.327 9.036 6.453 1.00 0.00 O ATOM 0 H TYR A 69 -6.676 3.475 6.470 1.00 0.00 H new ATOM 0 HA TYR A 69 -4.375 2.253 5.066 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -3.994 4.467 4.133 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -5.581 3.858 3.707 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -7.625 4.832 4.819 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -3.743 6.494 5.417 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -8.642 6.917 5.634 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -4.758 8.572 6.241 1.00 0.00 H new ATOM 0 HH TYR A 69 -6.619 9.669 6.695 1.00 0.00 H new ATOM 1086 N ILE A 70 -2.724 2.966 6.755 1.00 0.00 N ATOM 1087 CA ILE A 70 -1.782 3.258 7.823 1.00 0.00 C ATOM 1088 C ILE A 70 -0.438 3.715 7.261 1.00 0.00 C ATOM 1089 O ILE A 70 0.160 3.048 6.416 1.00 0.00 O ATOM 1090 CB ILE A 70 -1.590 2.032 8.749 1.00 0.00 C ATOM 1091 CG1 ILE A 70 -2.932 1.664 9.399 1.00 0.00 C ATOM 1092 CG2 ILE A 70 -0.532 2.317 9.811 1.00 0.00 C ATOM 1093 CD1 ILE A 70 -2.863 0.464 10.310 1.00 0.00 C ATOM 0 H ILE A 70 -2.385 2.299 6.062 1.00 0.00 H new ATOM 0 HA ILE A 70 -2.200 4.072 8.415 1.00 0.00 H new ATOM 0 HB ILE A 70 -1.242 1.188 8.154 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -3.295 2.520 9.969 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -3.663 1.470 8.614 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -0.413 1.442 10.450 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.418 2.544 9.327 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -0.844 3.169 10.416 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -3.850 0.269 10.730 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -2.532 -0.405 9.742 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.158 0.660 11.118 1.00 0.00 H new ATOM 1105 N ASP A 71 0.019 4.861 7.741 1.00 0.00 N ATOM 1106 CA ASP A 71 1.280 5.448 7.302 1.00 0.00 C ATOM 1107 C ASP A 71 2.332 5.162 8.357 1.00 0.00 C ATOM 1108 O ASP A 71 2.304 5.758 9.425 1.00 0.00 O ATOM 1109 CB ASP A 71 1.110 6.965 7.119 1.00 0.00 C ATOM 1110 CG ASP A 71 2.320 7.649 6.500 1.00 0.00 C ATOM 1111 OD1 ASP A 71 3.396 7.674 7.136 1.00 0.00 O ATOM 1112 OD2 ASP A 71 2.182 8.205 5.388 1.00 0.00 O ATOM 0 H ASP A 71 -0.472 5.412 8.445 1.00 0.00 H new ATOM 0 HA ASP A 71 1.586 5.018 6.348 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.239 7.150 6.491 1.00 0.00 H new ATOM 0 HB3 ASP A 71 0.905 7.418 8.089 1.00 0.00 H new ATOM 1117 N ALA A 72 3.242 4.243 8.067 1.00 0.00 N ATOM 1118 CA ALA A 72 4.201 3.767 9.064 1.00 0.00 C ATOM 1119 C ALA A 72 5.073 4.883 9.625 1.00 0.00 C ATOM 1120 O ALA A 72 5.585 4.778 10.742 1.00 0.00 O ATOM 1121 CB ALA A 72 5.074 2.671 8.482 1.00 0.00 C ATOM 0 H ALA A 72 3.340 3.809 7.149 1.00 0.00 H new ATOM 0 HA ALA A 72 3.616 3.368 9.892 1.00 0.00 H new ATOM 0 HB1 ALA A 72 5.781 2.329 9.238 1.00 0.00 H new ATOM 0 HB2 ALA A 72 4.448 1.836 8.167 1.00 0.00 H new ATOM 0 HB3 ALA A 72 5.621 3.059 7.623 1.00 0.00 H new ATOM 1127 N ALA A 73 5.239 5.954 8.866 1.00 0.00 N ATOM 1128 CA ALA A 73 6.059 7.069 9.316 1.00 0.00 C ATOM 1129 C ALA A 73 5.214 8.141 9.995 1.00 0.00 C ATOM 1130 O ALA A 73 5.683 9.252 10.235 1.00 0.00 O ATOM 1131 CB ALA A 73 6.839 7.663 8.154 1.00 0.00 C ATOM 0 H ALA A 73 4.821 6.076 7.943 1.00 0.00 H new ATOM 0 HA ALA A 73 6.767 6.685 10.051 1.00 0.00 H new ATOM 0 HB1 ALA A 73 7.446 8.495 8.511 1.00 0.00 H new ATOM 0 HB2 ALA A 73 7.487 6.900 7.723 1.00 0.00 H new ATOM 0 HB3 ALA A 73 6.144 8.020 7.394 1.00 0.00 H new ATOM 1137 N SER A 74 3.967 7.811 10.285 1.00 0.00 N ATOM 1138 CA SER A 74 3.073 8.720 10.992 1.00 0.00 C ATOM 1139 C SER A 74 2.316 7.970 12.089 1.00 0.00 C ATOM 1140 O SER A 74 2.090 8.492 13.183 1.00 0.00 O ATOM 1141 CB SER A 74 2.088 9.362 10.004 1.00 0.00 C ATOM 1142 OG SER A 74 1.307 10.371 10.626 1.00 0.00 O ATOM 0 H SER A 74 3.546 6.915 10.041 1.00 0.00 H new ATOM 0 HA SER A 74 3.665 9.508 11.457 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.639 9.792 9.167 1.00 0.00 H new ATOM 0 HB3 SER A 74 1.432 8.595 9.593 1.00 0.00 H new ATOM 0 HG SER A 74 0.692 10.760 9.969 1.00 0.00 H new ATOM 1148 N MET A 75 1.942 6.737 11.785 1.00 0.00 N ATOM 1149 CA MET A 75 1.153 5.910 12.684 1.00 0.00 C ATOM 1150 C MET A 75 1.670 4.478 12.682 1.00 0.00 C ATOM 1151 O MET A 75 2.097 3.970 11.649 1.00 0.00 O ATOM 1152 CB MET A 75 -0.321 5.915 12.255 1.00 0.00 C ATOM 1153 CG MET A 75 -1.043 7.213 12.572 1.00 0.00 C ATOM 1154 SD MET A 75 -2.840 7.056 12.467 1.00 0.00 S ATOM 1155 CE MET A 75 -3.057 6.680 10.728 1.00 0.00 C ATOM 0 H MET A 75 2.178 6.280 10.904 1.00 0.00 H new ATOM 0 HA MET A 75 1.240 6.322 13.689 1.00 0.00 H new ATOM 0 HB2 MET A 75 -0.379 5.730 11.182 1.00 0.00 H new ATOM 0 HB3 MET A 75 -0.837 5.092 12.749 1.00 0.00 H new ATOM 0 HG2 MET A 75 -0.769 7.541 13.575 1.00 0.00 H new ATOM 0 HG3 MET A 75 -0.709 7.987 11.881 1.00 0.00 H new ATOM 0 HE1 MET A 75 -4.120 6.661 10.490 1.00 0.00 H new ATOM 0 HE2 MET A 75 -2.564 7.444 10.126 1.00 0.00 H new ATOM 0 HE3 MET A 75 -2.618 5.706 10.509 1.00 0.00 H new ATOM 1165 N PRO A 76 1.637 3.807 13.838 1.00 0.00 N ATOM 1166 CA PRO A 76 2.020 2.404 13.936 1.00 0.00 C ATOM 1167 C PRO A 76 0.881 1.479 13.519 1.00 0.00 C ATOM 1168 O PRO A 76 -0.284 1.888 13.487 1.00 0.00 O ATOM 1169 CB PRO A 76 2.331 2.237 15.420 1.00 0.00 C ATOM 1170 CG PRO A 76 1.450 3.226 16.109 1.00 0.00 C ATOM 1171 CD PRO A 76 1.237 4.367 15.145 1.00 0.00 C ATOM 0 HA PRO A 76 2.854 2.149 13.282 1.00 0.00 H new ATOM 0 HB2 PRO A 76 2.123 1.221 15.756 1.00 0.00 H new ATOM 0 HB3 PRO A 76 3.383 2.432 15.628 1.00 0.00 H new ATOM 0 HG2 PRO A 76 0.499 2.770 16.385 1.00 0.00 H new ATOM 0 HG3 PRO A 76 1.913 3.580 17.030 1.00 0.00 H new ATOM 0 HD2 PRO A 76 0.198 4.695 15.138 1.00 0.00 H new ATOM 0 HD3 PRO A 76 1.843 5.233 15.411 1.00 0.00 H new ATOM 1179 N LEU A 77 1.216 0.241 13.193 1.00 0.00 N ATOM 1180 CA LEU A 77 0.205 -0.741 12.835 1.00 0.00 C ATOM 1181 C LEU A 77 -0.538 -1.172 14.093 1.00 0.00 C ATOM 1182 O LEU A 77 0.065 -1.304 15.159 1.00 0.00 O ATOM 1183 CB LEU A 77 0.861 -1.941 12.146 1.00 0.00 C ATOM 1184 CG LEU A 77 -0.100 -3.010 11.622 1.00 0.00 C ATOM 1185 CD1 LEU A 77 -1.050 -2.427 10.587 1.00 0.00 C ATOM 1186 CD2 LEU A 77 0.679 -4.162 11.026 1.00 0.00 C ATOM 0 H LEU A 77 2.175 -0.107 13.169 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.508 -0.302 12.137 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.459 -1.575 11.311 1.00 0.00 H new ATOM 0 HB3 LEU A 77 1.549 -2.410 12.850 1.00 0.00 H new ATOM 0 HG LEU A 77 -0.693 -3.377 12.460 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.723 -3.207 10.230 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.633 -1.624 11.039 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -0.476 -2.031 9.749 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -0.014 -4.917 10.656 1.00 0.00 H new ATOM 0 HD22 LEU A 77 1.293 -3.798 10.202 1.00 0.00 H new ATOM 0 HD23 LEU A 77 1.320 -4.601 11.790 1.00 0.00 H new ATOM 1198 N THR A 78 -1.837 -1.397 13.974 1.00 0.00 N ATOM 1199 CA THR A 78 -2.661 -1.664 15.134 1.00 0.00 C ATOM 1200 C THR A 78 -3.522 -2.905 14.945 1.00 0.00 C ATOM 1201 O THR A 78 -3.762 -3.355 13.822 1.00 0.00 O ATOM 1202 CB THR A 78 -3.568 -0.459 15.453 1.00 0.00 C ATOM 1203 OG1 THR A 78 -4.205 0.000 14.254 1.00 0.00 O ATOM 1204 CG2 THR A 78 -2.770 0.675 16.081 1.00 0.00 C ATOM 0 H THR A 78 -2.339 -1.399 13.086 1.00 0.00 H new ATOM 0 HA THR A 78 -1.982 -1.839 15.968 1.00 0.00 H new ATOM 0 HB THR A 78 -4.325 -0.780 16.168 1.00 0.00 H new ATOM 0 HG1 THR A 78 -4.782 0.765 14.462 1.00 0.00 H new ATOM 0 HG21 THR A 78 -3.434 1.512 16.296 1.00 0.00 H new ATOM 0 HG22 THR A 78 -2.312 0.328 17.007 1.00 0.00 H new ATOM 0 HG23 THR A 78 -1.991 0.998 15.390 1.00 0.00 H new ATOM 1212 N ASP A 79 -3.976 -3.440 16.067 1.00 0.00 N ATOM 1213 CA ASP A 79 -4.853 -4.610 16.105 1.00 0.00 C ATOM 1214 C ASP A 79 -6.189 -4.326 15.415 1.00 0.00 C ATOM 1215 O ASP A 79 -6.872 -5.240 14.954 1.00 0.00 O ATOM 1216 CB ASP A 79 -5.079 -5.006 17.566 1.00 0.00 C ATOM 1217 CG ASP A 79 -5.981 -6.211 17.741 1.00 0.00 C ATOM 1218 OD1 ASP A 79 -5.474 -7.352 17.679 1.00 0.00 O ATOM 1219 OD2 ASP A 79 -7.187 -6.017 17.998 1.00 0.00 O ATOM 0 H ASP A 79 -3.746 -3.073 16.990 1.00 0.00 H new ATOM 0 HA ASP A 79 -4.378 -5.430 15.566 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -4.115 -5.215 18.029 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -5.512 -4.160 18.099 1.00 0.00 H new ATOM 1224 N ALA A 80 -6.537 -3.047 15.328 1.00 0.00 N ATOM 1225 CA ALA A 80 -7.778 -2.617 14.692 1.00 0.00 C ATOM 1226 C ALA A 80 -7.832 -3.042 13.226 1.00 0.00 C ATOM 1227 O ALA A 80 -8.912 -3.205 12.658 1.00 0.00 O ATOM 1228 CB ALA A 80 -7.931 -1.109 14.811 1.00 0.00 C ATOM 0 H ALA A 80 -5.970 -2.282 15.694 1.00 0.00 H new ATOM 0 HA ALA A 80 -8.606 -3.102 15.209 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -8.860 -0.799 14.333 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -7.953 -0.827 15.864 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -7.090 -0.618 14.321 1.00 0.00 H new ATOM 1234 N ALA A 81 -6.659 -3.233 12.624 1.00 0.00 N ATOM 1235 CA ALA A 81 -6.551 -3.591 11.212 1.00 0.00 C ATOM 1236 C ALA A 81 -7.248 -4.915 10.893 1.00 0.00 C ATOM 1237 O ALA A 81 -7.552 -5.196 9.734 1.00 0.00 O ATOM 1238 CB ALA A 81 -5.087 -3.658 10.800 1.00 0.00 C ATOM 0 H ALA A 81 -5.761 -3.144 13.099 1.00 0.00 H new ATOM 0 HA ALA A 81 -7.057 -2.813 10.641 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -5.018 -3.926 9.746 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -4.619 -2.686 10.959 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.574 -4.410 11.400 1.00 0.00 H new ATOM 1244 N PHE A 82 -7.509 -5.719 11.917 1.00 0.00 N ATOM 1245 CA PHE A 82 -8.168 -7.004 11.722 1.00 0.00 C ATOM 1246 C PHE A 82 -9.662 -6.834 11.463 1.00 0.00 C ATOM 1247 O PHE A 82 -10.334 -7.771 11.034 1.00 0.00 O ATOM 1248 CB PHE A 82 -7.941 -7.919 12.924 1.00 0.00 C ATOM 1249 CG PHE A 82 -6.591 -8.577 12.925 1.00 0.00 C ATOM 1250 CD1 PHE A 82 -6.376 -9.729 12.186 1.00 0.00 C ATOM 1251 CD2 PHE A 82 -5.540 -8.049 13.657 1.00 0.00 C ATOM 1252 CE1 PHE A 82 -5.138 -10.340 12.174 1.00 0.00 C ATOM 1253 CE2 PHE A 82 -4.300 -8.659 13.651 1.00 0.00 C ATOM 1254 CZ PHE A 82 -4.099 -9.806 12.909 1.00 0.00 C ATOM 0 H PHE A 82 -7.275 -5.505 12.887 1.00 0.00 H new ATOM 0 HA PHE A 82 -7.724 -7.467 10.841 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -8.055 -7.339 13.840 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -8.712 -8.689 12.936 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -7.186 -10.154 11.613 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -5.691 -7.151 14.238 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -4.983 -11.235 11.590 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -3.488 -8.239 14.226 1.00 0.00 H new ATOM 0 HZ PHE A 82 -3.131 -10.284 12.904 1.00 0.00 H new ATOM 1264 N GLU A 83 -10.183 -5.645 11.725 1.00 0.00 N ATOM 1265 CA GLU A 83 -11.585 -5.367 11.467 1.00 0.00 C ATOM 1266 C GLU A 83 -11.793 -4.956 10.016 1.00 0.00 C ATOM 1267 O GLU A 83 -12.883 -5.101 9.465 1.00 0.00 O ATOM 1268 CB GLU A 83 -12.090 -4.278 12.399 1.00 0.00 C ATOM 1269 CG GLU A 83 -11.942 -4.637 13.865 1.00 0.00 C ATOM 1270 CD GLU A 83 -12.613 -3.643 14.789 1.00 0.00 C ATOM 1271 OE1 GLU A 83 -12.091 -2.521 14.949 1.00 0.00 O ATOM 1272 OE2 GLU A 83 -13.658 -3.990 15.381 1.00 0.00 O ATOM 0 H GLU A 83 -9.658 -4.862 12.114 1.00 0.00 H new ATOM 0 HA GLU A 83 -12.154 -6.278 11.653 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.545 -3.355 12.200 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -13.140 -4.081 12.183 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -12.366 -5.627 14.035 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -10.882 -4.697 14.113 1.00 0.00 H new ATOM 1279 N ALA A 84 -10.736 -4.452 9.405 1.00 0.00 N ATOM 1280 CA ALA A 84 -10.786 -4.002 8.026 1.00 0.00 C ATOM 1281 C ALA A 84 -10.578 -5.164 7.069 1.00 0.00 C ATOM 1282 O ALA A 84 -9.778 -6.066 7.326 1.00 0.00 O ATOM 1283 CB ALA A 84 -9.744 -2.922 7.786 1.00 0.00 C ATOM 0 H ALA A 84 -9.824 -4.344 9.848 1.00 0.00 H new ATOM 0 HA ALA A 84 -11.774 -3.582 7.839 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -9.793 -2.594 6.748 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.940 -2.075 8.444 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -8.751 -3.321 7.994 1.00 0.00 H new ATOM 1289 N GLU A 85 -11.320 -5.140 5.979 1.00 0.00 N ATOM 1290 CA GLU A 85 -11.188 -6.147 4.936 1.00 0.00 C ATOM 1291 C GLU A 85 -10.083 -5.735 3.971 1.00 0.00 C ATOM 1292 O GLU A 85 -9.318 -6.564 3.478 1.00 0.00 O ATOM 1293 CB GLU A 85 -12.516 -6.299 4.186 1.00 0.00 C ATOM 1294 CG GLU A 85 -12.579 -7.507 3.260 1.00 0.00 C ATOM 1295 CD GLU A 85 -12.563 -8.827 4.009 1.00 0.00 C ATOM 1296 OE1 GLU A 85 -12.944 -8.851 5.200 1.00 0.00 O ATOM 1297 OE2 GLU A 85 -12.207 -9.856 3.398 1.00 0.00 O ATOM 0 H GLU A 85 -12.027 -4.429 5.789 1.00 0.00 H new ATOM 0 HA GLU A 85 -10.930 -7.105 5.387 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -13.324 -6.371 4.914 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -12.694 -5.397 3.600 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -13.485 -7.449 2.656 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -11.734 -7.475 2.572 1.00 0.00 H new ATOM 1304 N TYR A 86 -10.008 -4.436 3.720 1.00 0.00 N ATOM 1305 CA TYR A 86 -9.013 -3.875 2.817 1.00 0.00 C ATOM 1306 C TYR A 86 -7.950 -3.123 3.612 1.00 0.00 C ATOM 1307 O TYR A 86 -8.242 -2.105 4.245 1.00 0.00 O ATOM 1308 CB TYR A 86 -9.673 -2.922 1.811 1.00 0.00 C ATOM 1309 CG TYR A 86 -10.616 -3.587 0.824 1.00 0.00 C ATOM 1310 CD1 TYR A 86 -11.785 -4.207 1.246 1.00 0.00 C ATOM 1311 CD2 TYR A 86 -10.342 -3.575 -0.538 1.00 0.00 C ATOM 1312 CE1 TYR A 86 -12.648 -4.798 0.341 1.00 0.00 C ATOM 1313 CE2 TYR A 86 -11.199 -4.163 -1.448 1.00 0.00 C ATOM 1314 CZ TYR A 86 -12.349 -4.772 -1.004 1.00 0.00 C ATOM 1315 OH TYR A 86 -13.205 -5.359 -1.907 1.00 0.00 O ATOM 0 H TYR A 86 -10.632 -3.744 4.134 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.545 -4.694 2.271 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -10.225 -2.161 2.362 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -8.891 -2.407 1.253 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -12.024 -4.228 2.299 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -9.441 -3.096 -0.892 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -13.552 -5.278 0.687 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.967 -4.144 -2.503 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.956 -6.299 -2.030 1.00 0.00 H new ATOM 1325 N LEU A 87 -6.726 -3.622 3.591 1.00 0.00 N ATOM 1326 CA LEU A 87 -5.642 -2.990 4.327 1.00 0.00 C ATOM 1327 C LEU A 87 -4.629 -2.354 3.382 1.00 0.00 C ATOM 1328 O LEU A 87 -4.212 -2.961 2.395 1.00 0.00 O ATOM 1329 CB LEU A 87 -4.928 -3.995 5.242 1.00 0.00 C ATOM 1330 CG LEU A 87 -5.659 -4.359 6.540 1.00 0.00 C ATOM 1331 CD1 LEU A 87 -6.082 -3.101 7.285 1.00 0.00 C ATOM 1332 CD2 LEU A 87 -6.855 -5.259 6.263 1.00 0.00 C ATOM 0 H LEU A 87 -6.457 -4.460 3.075 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.089 -2.209 4.943 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.754 -4.911 4.677 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.950 -3.590 5.501 1.00 0.00 H new ATOM 0 HG LEU A 87 -4.968 -4.915 7.174 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -6.599 -3.379 8.203 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -5.200 -2.509 7.530 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -6.750 -2.513 6.656 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -7.354 -5.501 7.202 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -7.553 -4.744 5.603 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.516 -6.178 5.785 1.00 0.00 H new ATOM 1344 N ALA A 88 -4.241 -1.127 3.689 1.00 0.00 N ATOM 1345 CA ALA A 88 -3.217 -0.434 2.927 1.00 0.00 C ATOM 1346 C ALA A 88 -2.120 0.059 3.858 1.00 0.00 C ATOM 1347 O ALA A 88 -2.353 0.924 4.707 1.00 0.00 O ATOM 1348 CB ALA A 88 -3.820 0.722 2.149 1.00 0.00 C ATOM 0 H ALA A 88 -4.623 -0.588 4.466 1.00 0.00 H new ATOM 0 HA ALA A 88 -2.781 -1.131 2.212 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -3.037 1.229 1.585 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -4.576 0.343 1.461 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -4.281 1.426 2.842 1.00 0.00 H new ATOM 1354 N VAL A 89 -0.933 -0.507 3.712 1.00 0.00 N ATOM 1355 CA VAL A 89 0.190 -0.153 4.567 1.00 0.00 C ATOM 1356 C VAL A 89 1.247 0.600 3.770 1.00 0.00 C ATOM 1357 O VAL A 89 1.683 0.145 2.709 1.00 0.00 O ATOM 1358 CB VAL A 89 0.825 -1.402 5.220 1.00 0.00 C ATOM 1359 CG1 VAL A 89 1.961 -1.006 6.154 1.00 0.00 C ATOM 1360 CG2 VAL A 89 -0.228 -2.206 5.970 1.00 0.00 C ATOM 0 H VAL A 89 -0.721 -1.215 3.009 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.194 0.489 5.360 1.00 0.00 H new ATOM 0 HB VAL A 89 1.238 -2.027 4.428 1.00 0.00 H new ATOM 0 HG11 VAL A 89 2.393 -1.901 6.602 1.00 0.00 H new ATOM 0 HG12 VAL A 89 2.729 -0.477 5.589 1.00 0.00 H new ATOM 0 HG13 VAL A 89 1.576 -0.356 6.940 1.00 0.00 H new ATOM 0 HG21 VAL A 89 0.237 -3.081 6.423 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -0.672 -1.587 6.749 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -1.004 -2.526 5.275 1.00 0.00 H new ATOM 1370 N ASP A 90 1.637 1.757 4.276 1.00 0.00 N ATOM 1371 CA ASP A 90 2.630 2.591 3.615 1.00 0.00 C ATOM 1372 C ASP A 90 3.954 2.538 4.364 1.00 0.00 C ATOM 1373 O ASP A 90 3.986 2.793 5.568 1.00 0.00 O ATOM 1374 CB ASP A 90 2.128 4.032 3.548 1.00 0.00 C ATOM 1375 CG ASP A 90 3.077 4.956 2.816 1.00 0.00 C ATOM 1376 OD1 ASP A 90 2.945 5.087 1.583 1.00 0.00 O ATOM 1377 OD2 ASP A 90 3.935 5.580 3.475 1.00 0.00 O ATOM 0 H ASP A 90 1.279 2.144 5.149 1.00 0.00 H new ATOM 0 HA ASP A 90 2.788 2.215 2.604 1.00 0.00 H new ATOM 0 HB2 ASP A 90 1.158 4.050 3.052 1.00 0.00 H new ATOM 0 HB3 ASP A 90 1.975 4.405 4.561 1.00 0.00 H new ATOM 1382 N GLN A 91 5.029 2.202 3.640 1.00 0.00 N ATOM 1383 CA GLN A 91 6.381 2.123 4.205 1.00 0.00 C ATOM 1384 C GLN A 91 6.543 0.899 5.104 1.00 0.00 C ATOM 1385 O GLN A 91 5.988 0.830 6.199 1.00 0.00 O ATOM 1386 CB GLN A 91 6.738 3.406 4.965 1.00 0.00 C ATOM 1387 CG GLN A 91 6.960 4.607 4.061 1.00 0.00 C ATOM 1388 CD GLN A 91 7.053 5.902 4.835 1.00 0.00 C ATOM 1389 OE1 GLN A 91 8.135 6.326 5.247 1.00 0.00 O ATOM 1390 NE2 GLN A 91 5.912 6.539 5.040 1.00 0.00 N ATOM 0 H GLN A 91 4.985 1.977 2.646 1.00 0.00 H new ATOM 0 HA GLN A 91 7.075 2.017 3.371 1.00 0.00 H new ATOM 0 HB2 GLN A 91 5.939 3.635 5.670 1.00 0.00 H new ATOM 0 HB3 GLN A 91 7.640 3.232 5.552 1.00 0.00 H new ATOM 0 HG2 GLN A 91 7.876 4.463 3.488 1.00 0.00 H new ATOM 0 HG3 GLN A 91 6.143 4.674 3.343 1.00 0.00 H new ATOM 0 HE21 GLN A 91 5.040 6.151 4.681 1.00 0.00 H new ATOM 0 HE22 GLN A 91 5.904 7.418 5.557 1.00 0.00 H new ATOM 1399 N VAL A 92 7.315 -0.064 4.630 1.00 0.00 N ATOM 1400 CA VAL A 92 7.547 -1.296 5.373 1.00 0.00 C ATOM 1401 C VAL A 92 8.850 -1.198 6.162 1.00 0.00 C ATOM 1402 O VAL A 92 8.996 -1.808 7.221 1.00 0.00 O ATOM 1403 CB VAL A 92 7.599 -2.523 4.436 1.00 0.00 C ATOM 1404 CG1 VAL A 92 7.802 -3.811 5.226 1.00 0.00 C ATOM 1405 CG2 VAL A 92 6.333 -2.607 3.598 1.00 0.00 C ATOM 0 H VAL A 92 7.794 -0.018 3.731 1.00 0.00 H new ATOM 0 HA VAL A 92 6.712 -1.428 6.061 1.00 0.00 H new ATOM 0 HB VAL A 92 8.452 -2.400 3.769 1.00 0.00 H new ATOM 0 HG11 VAL A 92 7.835 -4.657 4.540 1.00 0.00 H new ATOM 0 HG12 VAL A 92 8.740 -3.755 5.778 1.00 0.00 H new ATOM 0 HG13 VAL A 92 6.977 -3.943 5.926 1.00 0.00 H new ATOM 0 HG21 VAL A 92 6.387 -3.477 2.944 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.468 -2.699 4.254 1.00 0.00 H new ATOM 0 HG23 VAL A 92 6.236 -1.705 2.994 1.00 0.00 H new ATOM 1415 N GLU A 93 9.783 -0.399 5.650 1.00 0.00 N ATOM 1416 CA GLU A 93 11.079 -0.205 6.299 1.00 0.00 C ATOM 1417 C GLU A 93 10.908 0.440 7.672 1.00 0.00 C ATOM 1418 O GLU A 93 11.722 0.237 8.572 1.00 0.00 O ATOM 1419 CB GLU A 93 11.983 0.661 5.405 1.00 0.00 C ATOM 1420 CG GLU A 93 13.378 0.925 5.967 1.00 0.00 C ATOM 1421 CD GLU A 93 13.546 2.337 6.513 1.00 0.00 C ATOM 1422 OE1 GLU A 93 13.848 3.254 5.717 1.00 0.00 O ATOM 1423 OE2 GLU A 93 13.395 2.535 7.737 1.00 0.00 O ATOM 0 H GLU A 93 9.666 0.127 4.784 1.00 0.00 H new ATOM 0 HA GLU A 93 11.548 -1.179 6.442 1.00 0.00 H new ATOM 0 HB2 GLU A 93 12.084 0.174 4.435 1.00 0.00 H new ATOM 0 HB3 GLU A 93 11.490 1.617 5.232 1.00 0.00 H new ATOM 0 HG2 GLU A 93 13.585 0.208 6.761 1.00 0.00 H new ATOM 0 HG3 GLU A 93 14.117 0.755 5.184 1.00 0.00 H new ATOM 1430 N LYS A 94 9.827 1.191 7.835 1.00 0.00 N ATOM 1431 CA LYS A 94 9.619 1.966 9.045 1.00 0.00 C ATOM 1432 C LYS A 94 9.053 1.115 10.174 1.00 0.00 C ATOM 1433 O LYS A 94 8.966 1.568 11.314 1.00 0.00 O ATOM 1434 CB LYS A 94 8.685 3.144 8.776 1.00 0.00 C ATOM 1435 CG LYS A 94 9.095 4.003 7.591 1.00 0.00 C ATOM 1436 CD LYS A 94 10.603 4.189 7.522 1.00 0.00 C ATOM 1437 CE LYS A 94 11.169 4.844 8.769 1.00 0.00 C ATOM 1438 NZ LYS A 94 12.651 4.929 8.706 1.00 0.00 N ATOM 0 H LYS A 94 9.082 1.278 7.143 1.00 0.00 H new ATOM 0 HA LYS A 94 10.595 2.339 9.356 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.678 2.764 8.604 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.641 3.770 9.667 1.00 0.00 H new ATOM 0 HG2 LYS A 94 8.743 3.541 6.668 1.00 0.00 H new ATOM 0 HG3 LYS A 94 8.612 4.977 7.664 1.00 0.00 H new ATOM 0 HD2 LYS A 94 11.079 3.219 7.378 1.00 0.00 H new ATOM 0 HD3 LYS A 94 10.851 4.798 6.652 1.00 0.00 H new ATOM 0 HE2 LYS A 94 10.749 5.844 8.880 1.00 0.00 H new ATOM 0 HE3 LYS A 94 10.872 4.274 9.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 13.013 5.334 9.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 13.048 3.977 8.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 12.930 5.535 7.909 1.00 0.00 H new ATOM 1452 N LEU A 95 8.673 -0.116 9.859 1.00 0.00 N ATOM 1453 CA LEU A 95 8.053 -0.991 10.841 1.00 0.00 C ATOM 1454 C LEU A 95 9.086 -1.516 11.833 1.00 0.00 C ATOM 1455 O LEU A 95 10.176 -1.938 11.445 1.00 0.00 O ATOM 1456 CB LEU A 95 7.352 -2.157 10.143 1.00 0.00 C ATOM 1457 CG LEU A 95 6.250 -1.762 9.160 1.00 0.00 C ATOM 1458 CD1 LEU A 95 5.650 -2.998 8.512 1.00 0.00 C ATOM 1459 CD2 LEU A 95 5.170 -0.953 9.860 1.00 0.00 C ATOM 0 H LEU A 95 8.783 -0.529 8.933 1.00 0.00 H new ATOM 0 HA LEU A 95 7.313 -0.412 11.393 1.00 0.00 H new ATOM 0 HB2 LEU A 95 8.100 -2.742 9.609 1.00 0.00 H new ATOM 0 HB3 LEU A 95 6.922 -2.809 10.903 1.00 0.00 H new ATOM 0 HG LEU A 95 6.692 -1.141 8.381 1.00 0.00 H new ATOM 0 HD11 LEU A 95 4.867 -2.700 7.815 1.00 0.00 H new ATOM 0 HD12 LEU A 95 6.427 -3.540 7.974 1.00 0.00 H new ATOM 0 HD13 LEU A 95 5.225 -3.642 9.282 1.00 0.00 H new ATOM 0 HD21 LEU A 95 4.396 -0.682 9.142 1.00 0.00 H new ATOM 0 HD22 LEU A 95 4.731 -1.548 10.660 1.00 0.00 H new ATOM 0 HD23 LEU A 95 5.608 -0.048 10.280 1.00 0.00 H new ATOM 1471 N GLY A 96 8.739 -1.478 13.114 1.00 0.00 N ATOM 1472 CA GLY A 96 9.632 -1.967 14.142 1.00 0.00 C ATOM 1473 C GLY A 96 9.495 -3.461 14.353 1.00 0.00 C ATOM 1474 O GLY A 96 9.724 -4.242 13.436 1.00 0.00 O ATOM 0 H GLY A 96 7.850 -1.115 13.458 1.00 0.00 H new ATOM 0 HA2 GLY A 96 10.661 -1.733 13.869 1.00 0.00 H new ATOM 0 HA3 GLY A 96 9.425 -1.449 15.078 1.00 0.00 H new ATOM 1478 N ASN A 97 9.101 -3.861 15.550 1.00 0.00 N ATOM 1479 CA ASN A 97 8.990 -5.278 15.875 1.00 0.00 C ATOM 1480 C ASN A 97 7.529 -5.711 15.936 1.00 0.00 C ATOM 1481 O ASN A 97 7.118 -6.637 15.232 1.00 0.00 O ATOM 1482 CB ASN A 97 9.698 -5.580 17.201 1.00 0.00 C ATOM 1483 CG ASN A 97 9.534 -7.025 17.639 1.00 0.00 C ATOM 1484 OD1 ASN A 97 10.277 -7.906 17.204 1.00 0.00 O ATOM 1485 ND2 ASN A 97 8.588 -7.273 18.533 1.00 0.00 N ATOM 0 H ASN A 97 8.853 -3.230 16.312 1.00 0.00 H new ATOM 0 HA ASN A 97 9.477 -5.848 15.084 1.00 0.00 H new ATOM 0 HB2 ASN A 97 10.760 -5.354 17.101 1.00 0.00 H new ATOM 0 HB3 ASN A 97 9.304 -4.923 17.976 1.00 0.00 H new ATOM 0 HD21 ASN A 97 8.455 -8.221 18.885 1.00 0.00 H new ATOM 0 HD22 ASN A 97 7.993 -6.516 18.869 1.00 0.00 H new ATOM 1492 N GLU A 98 6.742 -5.026 16.759 1.00 0.00 N ATOM 1493 CA GLU A 98 5.336 -5.372 16.950 1.00 0.00 C ATOM 1494 C GLU A 98 4.567 -5.249 15.643 1.00 0.00 C ATOM 1495 O GLU A 98 3.755 -6.110 15.309 1.00 0.00 O ATOM 1496 CB GLU A 98 4.679 -4.481 18.011 1.00 0.00 C ATOM 1497 CG GLU A 98 5.196 -4.701 19.426 1.00 0.00 C ATOM 1498 CD GLU A 98 6.607 -4.199 19.625 1.00 0.00 C ATOM 1499 OE1 GLU A 98 6.790 -2.966 19.740 1.00 0.00 O ATOM 1500 OE2 GLU A 98 7.535 -5.029 19.670 1.00 0.00 O ATOM 0 H GLU A 98 7.055 -4.225 17.307 1.00 0.00 H new ATOM 0 HA GLU A 98 5.303 -6.406 17.293 1.00 0.00 H new ATOM 0 HB2 GLU A 98 4.835 -3.437 17.739 1.00 0.00 H new ATOM 0 HB3 GLU A 98 3.603 -4.656 17.999 1.00 0.00 H new ATOM 0 HG2 GLU A 98 4.534 -4.197 20.131 1.00 0.00 H new ATOM 0 HG3 GLU A 98 5.159 -5.765 19.659 1.00 0.00 H new ATOM 1507 N GLU A 99 4.841 -4.184 14.904 1.00 0.00 N ATOM 1508 CA GLU A 99 4.163 -3.931 13.640 1.00 0.00 C ATOM 1509 C GLU A 99 4.395 -5.070 12.654 1.00 0.00 C ATOM 1510 O GLU A 99 3.469 -5.505 11.977 1.00 0.00 O ATOM 1511 CB GLU A 99 4.626 -2.609 13.021 1.00 0.00 C ATOM 1512 CG GLU A 99 4.470 -1.401 13.937 1.00 0.00 C ATOM 1513 CD GLU A 99 5.623 -1.251 14.905 1.00 0.00 C ATOM 1514 OE1 GLU A 99 6.628 -0.627 14.529 1.00 0.00 O ATOM 1515 OE2 GLU A 99 5.538 -1.772 16.038 1.00 0.00 O ATOM 0 H GLU A 99 5.531 -3.478 15.159 1.00 0.00 H new ATOM 0 HA GLU A 99 3.096 -3.864 13.853 1.00 0.00 H new ATOM 0 HB2 GLU A 99 5.674 -2.702 12.736 1.00 0.00 H new ATOM 0 HB3 GLU A 99 4.061 -2.432 12.106 1.00 0.00 H new ATOM 0 HG2 GLU A 99 4.390 -0.498 13.331 1.00 0.00 H new ATOM 0 HG3 GLU A 99 3.540 -1.493 14.497 1.00 0.00 H new ATOM 1522 N GLN A 100 5.626 -5.564 12.583 1.00 0.00 N ATOM 1523 CA GLN A 100 5.947 -6.664 11.682 1.00 0.00 C ATOM 1524 C GLN A 100 5.260 -7.951 12.128 1.00 0.00 C ATOM 1525 O GLN A 100 4.804 -8.736 11.302 1.00 0.00 O ATOM 1526 CB GLN A 100 7.464 -6.874 11.577 1.00 0.00 C ATOM 1527 CG GLN A 100 8.173 -5.806 10.758 1.00 0.00 C ATOM 1528 CD GLN A 100 9.628 -6.147 10.491 1.00 0.00 C ATOM 1529 OE1 GLN A 100 9.956 -6.804 9.503 1.00 0.00 O ATOM 1530 NE2 GLN A 100 10.509 -5.696 11.364 1.00 0.00 N ATOM 0 H GLN A 100 6.413 -5.223 13.135 1.00 0.00 H new ATOM 0 HA GLN A 100 5.574 -6.399 10.693 1.00 0.00 H new ATOM 0 HB2 GLN A 100 7.890 -6.893 12.580 1.00 0.00 H new ATOM 0 HB3 GLN A 100 7.657 -7.850 11.131 1.00 0.00 H new ATOM 0 HG2 GLN A 100 7.654 -5.677 9.808 1.00 0.00 H new ATOM 0 HG3 GLN A 100 8.117 -4.853 11.284 1.00 0.00 H new ATOM 0 HE21 GLN A 100 10.197 -5.155 12.170 1.00 0.00 H new ATOM 0 HE22 GLN A 100 11.502 -5.889 11.232 1.00 0.00 H new ATOM 1539 N ALA A 101 5.173 -8.154 13.433 1.00 0.00 N ATOM 1540 CA ALA A 101 4.491 -9.323 13.974 1.00 0.00 C ATOM 1541 C ALA A 101 2.990 -9.249 13.706 1.00 0.00 C ATOM 1542 O ALA A 101 2.346 -10.256 13.411 1.00 0.00 O ATOM 1543 CB ALA A 101 4.762 -9.444 15.463 1.00 0.00 C ATOM 0 H ALA A 101 5.564 -7.528 14.137 1.00 0.00 H new ATOM 0 HA ALA A 101 4.879 -10.211 13.474 1.00 0.00 H new ATOM 0 HB1 ALA A 101 4.248 -10.321 15.856 1.00 0.00 H new ATOM 0 HB2 ALA A 101 5.834 -9.547 15.631 1.00 0.00 H new ATOM 0 HB3 ALA A 101 4.399 -8.551 15.973 1.00 0.00 H new ATOM 1549 N LEU A 102 2.444 -8.047 13.815 1.00 0.00 N ATOM 1550 CA LEU A 102 1.036 -7.809 13.531 1.00 0.00 C ATOM 1551 C LEU A 102 0.775 -8.034 12.040 1.00 0.00 C ATOM 1552 O LEU A 102 -0.147 -8.754 11.659 1.00 0.00 O ATOM 1553 CB LEU A 102 0.669 -6.372 13.944 1.00 0.00 C ATOM 1554 CG LEU A 102 -0.809 -6.100 14.272 1.00 0.00 C ATOM 1555 CD1 LEU A 102 -1.694 -6.239 13.045 1.00 0.00 C ATOM 1556 CD2 LEU A 102 -1.287 -7.025 15.377 1.00 0.00 C ATOM 0 H LEU A 102 2.960 -7.215 14.101 1.00 0.00 H new ATOM 0 HA LEU A 102 0.415 -8.502 14.099 1.00 0.00 H new ATOM 0 HB2 LEU A 102 1.265 -6.107 14.817 1.00 0.00 H new ATOM 0 HB3 LEU A 102 0.967 -5.701 13.139 1.00 0.00 H new ATOM 0 HG LEU A 102 -0.884 -5.069 14.616 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -2.730 -6.039 13.319 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -1.376 -5.526 12.284 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -1.612 -7.252 12.650 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -2.335 -6.819 15.596 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -1.181 -8.061 15.056 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -0.689 -6.860 16.274 1.00 0.00 H new ATOM 1568 N LEU A 103 1.615 -7.424 11.211 1.00 0.00 N ATOM 1569 CA LEU A 103 1.531 -7.564 9.757 1.00 0.00 C ATOM 1570 C LEU A 103 1.611 -9.043 9.363 1.00 0.00 C ATOM 1571 O LEU A 103 0.840 -9.523 8.530 1.00 0.00 O ATOM 1572 CB LEU A 103 2.673 -6.769 9.104 1.00 0.00 C ATOM 1573 CG LEU A 103 2.429 -6.257 7.676 1.00 0.00 C ATOM 1574 CD1 LEU A 103 2.332 -7.400 6.681 1.00 0.00 C ATOM 1575 CD2 LEU A 103 1.176 -5.394 7.622 1.00 0.00 C ATOM 0 H LEU A 103 2.373 -6.819 11.525 1.00 0.00 H new ATOM 0 HA LEU A 103 0.577 -7.170 9.408 1.00 0.00 H new ATOM 0 HB2 LEU A 103 2.897 -5.912 9.739 1.00 0.00 H new ATOM 0 HB3 LEU A 103 3.563 -7.399 9.092 1.00 0.00 H new ATOM 0 HG LEU A 103 3.287 -5.646 7.395 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.159 -6.999 5.682 1.00 0.00 H new ATOM 0 HD12 LEU A 103 3.262 -7.968 6.688 1.00 0.00 H new ATOM 0 HD13 LEU A 103 1.505 -8.054 6.958 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.021 -5.041 6.602 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.315 -5.983 7.937 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.294 -4.539 8.288 1.00 0.00 H new ATOM 1587 N PHE A 104 2.549 -9.751 9.977 1.00 0.00 N ATOM 1588 CA PHE A 104 2.707 -11.191 9.777 1.00 0.00 C ATOM 1589 C PHE A 104 1.390 -11.923 10.027 1.00 0.00 C ATOM 1590 O PHE A 104 0.991 -12.799 9.257 1.00 0.00 O ATOM 1591 CB PHE A 104 3.785 -11.723 10.725 1.00 0.00 C ATOM 1592 CG PHE A 104 4.073 -13.191 10.583 1.00 0.00 C ATOM 1593 CD1 PHE A 104 4.956 -13.646 9.618 1.00 0.00 C ATOM 1594 CD2 PHE A 104 3.472 -14.117 11.424 1.00 0.00 C ATOM 1595 CE1 PHE A 104 5.232 -14.992 9.493 1.00 0.00 C ATOM 1596 CE2 PHE A 104 3.743 -15.467 11.302 1.00 0.00 C ATOM 1597 CZ PHE A 104 4.626 -15.903 10.335 1.00 0.00 C ATOM 0 H PHE A 104 3.223 -9.347 10.628 1.00 0.00 H new ATOM 0 HA PHE A 104 3.006 -11.368 8.744 1.00 0.00 H new ATOM 0 HB2 PHE A 104 4.707 -11.167 10.554 1.00 0.00 H new ATOM 0 HB3 PHE A 104 3.478 -11.524 11.752 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.434 -12.939 8.956 1.00 0.00 H new ATOM 0 HD2 PHE A 104 2.783 -13.778 12.184 1.00 0.00 H new ATOM 0 HE1 PHE A 104 5.923 -15.333 8.736 1.00 0.00 H new ATOM 0 HE2 PHE A 104 3.266 -16.178 11.961 1.00 0.00 H new ATOM 0 HZ PHE A 104 4.843 -16.956 10.237 1.00 0.00 H new ATOM 1607 N SER A 105 0.717 -11.547 11.107 1.00 0.00 N ATOM 1608 CA SER A 105 -0.550 -12.165 11.476 1.00 0.00 C ATOM 1609 C SER A 105 -1.637 -11.796 10.459 1.00 0.00 C ATOM 1610 O SER A 105 -2.546 -12.587 10.185 1.00 0.00 O ATOM 1611 CB SER A 105 -0.959 -11.718 12.885 1.00 0.00 C ATOM 1612 OG SER A 105 -1.825 -12.660 13.497 1.00 0.00 O ATOM 0 H SER A 105 1.029 -10.815 11.745 1.00 0.00 H new ATOM 0 HA SER A 105 -0.430 -13.248 11.473 1.00 0.00 H new ATOM 0 HB2 SER A 105 -0.068 -11.588 13.500 1.00 0.00 H new ATOM 0 HB3 SER A 105 -1.454 -10.748 12.831 1.00 0.00 H new ATOM 0 HG SER A 105 -2.067 -12.348 14.394 1.00 0.00 H new ATOM 1618 N ILE A 106 -1.535 -10.593 9.897 1.00 0.00 N ATOM 1619 CA ILE A 106 -2.451 -10.150 8.853 1.00 0.00 C ATOM 1620 C ILE A 106 -2.320 -11.042 7.617 1.00 0.00 C ATOM 1621 O ILE A 106 -3.324 -11.486 7.053 1.00 0.00 O ATOM 1622 CB ILE A 106 -2.205 -8.670 8.468 1.00 0.00 C ATOM 1623 CG1 ILE A 106 -2.474 -7.762 9.672 1.00 0.00 C ATOM 1624 CG2 ILE A 106 -3.084 -8.259 7.294 1.00 0.00 C ATOM 1625 CD1 ILE A 106 -2.227 -6.292 9.402 1.00 0.00 C ATOM 0 H ILE A 106 -0.824 -9.907 10.150 1.00 0.00 H new ATOM 0 HA ILE A 106 -3.464 -10.230 9.248 1.00 0.00 H new ATOM 0 HB ILE A 106 -1.163 -8.564 8.166 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -3.508 -7.894 9.990 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -1.843 -8.080 10.502 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -2.892 -7.216 7.044 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -2.857 -8.887 6.432 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -4.133 -8.380 7.565 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -2.440 -5.716 10.303 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -1.186 -6.145 9.115 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -2.877 -5.956 8.594 1.00 0.00 H new ATOM 1637 N PHE A 107 -1.078 -11.321 7.218 1.00 0.00 N ATOM 1638 CA PHE A 107 -0.821 -12.233 6.109 1.00 0.00 C ATOM 1639 C PHE A 107 -1.389 -13.614 6.409 1.00 0.00 C ATOM 1640 O PHE A 107 -1.952 -14.266 5.530 1.00 0.00 O ATOM 1641 CB PHE A 107 0.679 -12.343 5.821 1.00 0.00 C ATOM 1642 CG PHE A 107 1.167 -11.412 4.746 1.00 0.00 C ATOM 1643 CD1 PHE A 107 0.660 -11.497 3.459 1.00 0.00 C ATOM 1644 CD2 PHE A 107 2.146 -10.470 5.013 1.00 0.00 C ATOM 1645 CE1 PHE A 107 1.118 -10.658 2.461 1.00 0.00 C ATOM 1646 CE2 PHE A 107 2.606 -9.626 4.019 1.00 0.00 C ATOM 1647 CZ PHE A 107 2.092 -9.722 2.741 1.00 0.00 C ATOM 0 H PHE A 107 -0.239 -10.929 7.646 1.00 0.00 H new ATOM 0 HA PHE A 107 -1.315 -11.827 5.226 1.00 0.00 H new ATOM 0 HB2 PHE A 107 1.230 -12.141 6.739 1.00 0.00 H new ATOM 0 HB3 PHE A 107 0.908 -13.368 5.530 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -0.102 -12.228 3.233 1.00 0.00 H new ATOM 0 HD2 PHE A 107 2.555 -10.394 6.010 1.00 0.00 H new ATOM 0 HE1 PHE A 107 0.714 -10.735 1.462 1.00 0.00 H new ATOM 0 HE2 PHE A 107 3.367 -8.892 4.242 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.452 -9.066 1.962 1.00 0.00 H new ATOM 1657 N ASN A 108 -1.240 -14.052 7.655 1.00 0.00 N ATOM 1658 CA ASN A 108 -1.784 -15.336 8.086 1.00 0.00 C ATOM 1659 C ASN A 108 -3.297 -15.378 7.884 1.00 0.00 C ATOM 1660 O ASN A 108 -3.825 -16.334 7.321 1.00 0.00 O ATOM 1661 CB ASN A 108 -1.433 -15.615 9.554 1.00 0.00 C ATOM 1662 CG ASN A 108 -2.159 -16.831 10.114 1.00 0.00 C ATOM 1663 OD1 ASN A 108 -1.736 -17.969 9.917 1.00 0.00 O ATOM 1664 ND2 ASN A 108 -3.246 -16.596 10.835 1.00 0.00 N ATOM 0 H ASN A 108 -0.747 -13.537 8.385 1.00 0.00 H new ATOM 0 HA ASN A 108 -1.332 -16.115 7.472 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -0.357 -15.767 9.643 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -1.682 -14.740 10.155 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -3.762 -17.373 11.248 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -3.567 -15.638 10.977 1.00 0.00 H new ATOM 1671 N ARG A 109 -3.984 -14.330 8.324 1.00 0.00 N ATOM 1672 CA ARG A 109 -5.436 -14.255 8.186 1.00 0.00 C ATOM 1673 C ARG A 109 -5.841 -14.311 6.716 1.00 0.00 C ATOM 1674 O ARG A 109 -6.736 -15.069 6.337 1.00 0.00 O ATOM 1675 CB ARG A 109 -5.980 -12.971 8.826 1.00 0.00 C ATOM 1676 CG ARG A 109 -7.498 -12.876 8.791 1.00 0.00 C ATOM 1677 CD ARG A 109 -8.014 -11.603 9.453 1.00 0.00 C ATOM 1678 NE ARG A 109 -7.725 -10.398 8.668 1.00 0.00 N ATOM 1679 CZ ARG A 109 -8.640 -9.459 8.384 1.00 0.00 C ATOM 1680 NH1 ARG A 109 -9.902 -9.622 8.767 1.00 0.00 N ATOM 1681 NH2 ARG A 109 -8.296 -8.361 7.715 1.00 0.00 N ATOM 0 H ARG A 109 -3.561 -13.521 8.779 1.00 0.00 H new ATOM 0 HA ARG A 109 -5.865 -15.113 8.704 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -5.644 -12.919 9.862 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -5.557 -12.109 8.310 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -7.838 -12.908 7.756 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -7.926 -13.743 9.294 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -9.091 -11.686 9.600 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -7.564 -11.504 10.441 1.00 0.00 H new ATOM 0 HE ARG A 109 -6.776 -10.267 8.319 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -10.176 -10.462 9.277 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -10.597 -8.907 8.551 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -7.330 -8.229 7.414 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -8.998 -7.652 7.503 1.00 0.00 H new ATOM 1695 N PHE A 110 -5.158 -13.522 5.896 1.00 0.00 N ATOM 1696 CA PHE A 110 -5.470 -13.433 4.476 1.00 0.00 C ATOM 1697 C PHE A 110 -5.193 -14.751 3.757 1.00 0.00 C ATOM 1698 O PHE A 110 -6.047 -15.260 3.033 1.00 0.00 O ATOM 1699 CB PHE A 110 -4.662 -12.314 3.817 1.00 0.00 C ATOM 1700 CG PHE A 110 -5.107 -10.922 4.182 1.00 0.00 C ATOM 1701 CD1 PHE A 110 -6.306 -10.706 4.844 1.00 0.00 C ATOM 1702 CD2 PHE A 110 -4.327 -9.826 3.846 1.00 0.00 C ATOM 1703 CE1 PHE A 110 -6.712 -9.426 5.167 1.00 0.00 C ATOM 1704 CE2 PHE A 110 -4.730 -8.545 4.166 1.00 0.00 C ATOM 1705 CZ PHE A 110 -5.925 -8.346 4.825 1.00 0.00 C ATOM 0 H PHE A 110 -4.381 -12.932 6.193 1.00 0.00 H new ATOM 0 HA PHE A 110 -6.534 -13.211 4.392 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -3.614 -12.430 4.092 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -4.722 -12.429 2.735 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -6.929 -11.547 5.110 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -3.392 -9.976 3.327 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -7.646 -9.271 5.687 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -4.111 -7.701 3.901 1.00 0.00 H new ATOM 0 HZ PHE A 110 -6.245 -7.345 5.073 1.00 0.00 H new ATOM 1715 N ARG A 111 -4.006 -15.302 3.964 1.00 0.00 N ATOM 1716 CA ARG A 111 -3.592 -16.510 3.260 1.00 0.00 C ATOM 1717 C ARG A 111 -4.402 -17.721 3.717 1.00 0.00 C ATOM 1718 O ARG A 111 -4.720 -18.601 2.920 1.00 0.00 O ATOM 1719 CB ARG A 111 -2.097 -16.767 3.476 1.00 0.00 C ATOM 1720 CG ARG A 111 -1.511 -17.845 2.578 1.00 0.00 C ATOM 1721 CD ARG A 111 -1.483 -17.417 1.118 1.00 0.00 C ATOM 1722 NE ARG A 111 -2.794 -17.523 0.473 1.00 0.00 N ATOM 1723 CZ ARG A 111 -3.301 -16.609 -0.356 1.00 0.00 C ATOM 1724 NH1 ARG A 111 -2.624 -15.494 -0.611 1.00 0.00 N ATOM 1725 NH2 ARG A 111 -4.487 -16.807 -0.921 1.00 0.00 N ATOM 0 H ARG A 111 -3.311 -14.933 4.613 1.00 0.00 H new ATOM 0 HA ARG A 111 -3.778 -16.358 2.197 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -1.553 -15.837 3.310 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -1.936 -17.050 4.516 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -0.499 -18.080 2.907 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -2.098 -18.758 2.677 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -1.132 -16.387 1.052 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -0.765 -18.033 0.577 1.00 0.00 H new ATOM 0 HE ARG A 111 -3.357 -18.351 0.671 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -1.716 -15.337 -0.173 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -3.012 -14.795 -1.245 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -5.011 -17.659 -0.721 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -4.873 -16.107 -1.555 1.00 0.00 H new ATOM 1739 N ASN A 112 -4.746 -17.752 4.998 1.00 0.00 N ATOM 1740 CA ASN A 112 -5.488 -18.877 5.564 1.00 0.00 C ATOM 1741 C ASN A 112 -6.931 -18.882 5.079 1.00 0.00 C ATOM 1742 O ASN A 112 -7.483 -19.933 4.751 1.00 0.00 O ATOM 1743 CB ASN A 112 -5.455 -18.823 7.094 1.00 0.00 C ATOM 1744 CG ASN A 112 -4.835 -20.067 7.708 1.00 0.00 C ATOM 1745 OD1 ASN A 112 -4.930 -21.165 7.158 1.00 0.00 O ATOM 1746 ND2 ASN A 112 -4.183 -19.901 8.848 1.00 0.00 N ATOM 0 H ASN A 112 -4.525 -17.014 5.666 1.00 0.00 H new ATOM 0 HA ASN A 112 -5.008 -19.796 5.228 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -4.891 -17.946 7.411 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -6.470 -18.703 7.472 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -3.737 -20.699 9.301 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -4.126 -18.975 9.273 1.00 0.00 H new ATOM 1753 N SER A 113 -7.535 -17.705 5.022 1.00 0.00 N ATOM 1754 CA SER A 113 -8.931 -17.585 4.630 1.00 0.00 C ATOM 1755 C SER A 113 -9.085 -17.509 3.113 1.00 0.00 C ATOM 1756 O SER A 113 -10.153 -17.809 2.576 1.00 0.00 O ATOM 1757 CB SER A 113 -9.542 -16.343 5.275 1.00 0.00 C ATOM 1758 OG SER A 113 -9.434 -16.403 6.687 1.00 0.00 O ATOM 0 H SER A 113 -7.080 -16.819 5.242 1.00 0.00 H new ATOM 0 HA SER A 113 -9.455 -18.477 4.975 1.00 0.00 H new ATOM 0 HB2 SER A 113 -9.038 -15.450 4.905 1.00 0.00 H new ATOM 0 HB3 SER A 113 -10.591 -16.258 4.989 1.00 0.00 H new ATOM 0 HG SER A 113 -8.579 -16.013 6.967 1.00 0.00 H new ATOM 1764 N GLY A 114 -8.020 -17.104 2.429 1.00 0.00 N ATOM 1765 CA GLY A 114 -8.097 -16.885 0.997 1.00 0.00 C ATOM 1766 C GLY A 114 -8.880 -15.630 0.681 1.00 0.00 C ATOM 1767 O GLY A 114 -9.344 -15.429 -0.441 1.00 0.00 O ATOM 0 H GLY A 114 -7.105 -16.924 2.841 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -7.092 -16.804 0.583 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -8.570 -17.743 0.519 1.00 0.00 H new ATOM 1771 N LYS A 115 -9.003 -14.775 1.682 1.00 0.00 N ATOM 1772 CA LYS A 115 -9.816 -13.591 1.594 1.00 0.00 C ATOM 1773 C LYS A 115 -9.041 -12.412 2.165 1.00 0.00 C ATOM 1774 O LYS A 115 -7.950 -12.589 2.706 1.00 0.00 O ATOM 1775 CB LYS A 115 -11.113 -13.825 2.369 1.00 0.00 C ATOM 1776 CG LYS A 115 -12.210 -12.836 2.055 1.00 0.00 C ATOM 1777 CD LYS A 115 -13.537 -13.270 2.657 1.00 0.00 C ATOM 1778 CE LYS A 115 -14.669 -12.351 2.235 1.00 0.00 C ATOM 1779 NZ LYS A 115 -14.522 -10.988 2.801 1.00 0.00 N ATOM 0 H LYS A 115 -8.535 -14.891 2.581 1.00 0.00 H new ATOM 0 HA LYS A 115 -10.065 -13.370 0.556 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -11.474 -14.831 2.155 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -10.897 -13.784 3.437 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -11.938 -11.854 2.441 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -12.314 -12.737 0.975 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -13.761 -14.291 2.347 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -13.459 -13.277 3.744 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -14.699 -12.290 1.147 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -15.620 -12.776 2.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -15.275 -10.818 3.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -13.595 -10.903 3.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -14.592 -10.286 2.037 1.00 0.00 H new ATOM 1793 N GLY A 116 -9.605 -11.226 2.059 1.00 0.00 N ATOM 1794 CA GLY A 116 -8.922 -10.033 2.512 1.00 0.00 C ATOM 1795 C GLY A 116 -8.149 -9.380 1.388 1.00 0.00 C ATOM 1796 O GLY A 116 -7.740 -10.054 0.440 1.00 0.00 O ATOM 0 H GLY A 116 -10.531 -11.063 1.664 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -9.648 -9.327 2.915 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -8.241 -10.288 3.324 1.00 0.00 H new ATOM 1800 N PHE A 117 -7.966 -8.074 1.476 1.00 0.00 N ATOM 1801 CA PHE A 117 -7.270 -7.328 0.437 1.00 0.00 C ATOM 1802 C PHE A 117 -6.122 -6.528 1.030 1.00 0.00 C ATOM 1803 O PHE A 117 -6.244 -5.961 2.118 1.00 0.00 O ATOM 1804 CB PHE A 117 -8.238 -6.389 -0.286 1.00 0.00 C ATOM 1805 CG PHE A 117 -9.263 -7.098 -1.122 1.00 0.00 C ATOM 1806 CD1 PHE A 117 -10.384 -7.665 -0.540 1.00 0.00 C ATOM 1807 CD2 PHE A 117 -9.106 -7.187 -2.495 1.00 0.00 C ATOM 1808 CE1 PHE A 117 -11.329 -8.312 -1.313 1.00 0.00 C ATOM 1809 CE2 PHE A 117 -10.045 -7.832 -3.273 1.00 0.00 C ATOM 1810 CZ PHE A 117 -11.159 -8.395 -2.682 1.00 0.00 C ATOM 0 H PHE A 117 -8.290 -7.505 2.258 1.00 0.00 H new ATOM 0 HA PHE A 117 -6.866 -8.042 -0.281 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -8.750 -5.772 0.452 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -7.666 -5.715 -0.924 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -10.521 -7.601 0.529 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -8.238 -6.746 -2.962 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -12.199 -8.752 -0.848 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -9.909 -7.897 -4.342 1.00 0.00 H new ATOM 0 HZ PHE A 117 -11.896 -8.899 -3.289 1.00 0.00 H new ATOM 1820 N LEU A 118 -5.011 -6.488 0.316 1.00 0.00 N ATOM 1821 CA LEU A 118 -3.840 -5.762 0.768 1.00 0.00 C ATOM 1822 C LEU A 118 -3.189 -5.031 -0.394 1.00 0.00 C ATOM 1823 O LEU A 118 -3.075 -5.561 -1.502 1.00 0.00 O ATOM 1824 CB LEU A 118 -2.825 -6.714 1.399 1.00 0.00 C ATOM 1825 CG LEU A 118 -1.658 -6.051 2.137 1.00 0.00 C ATOM 1826 CD1 LEU A 118 -2.152 -5.285 3.352 1.00 0.00 C ATOM 1827 CD2 LEU A 118 -0.627 -7.091 2.546 1.00 0.00 C ATOM 0 H LEU A 118 -4.896 -6.953 -0.584 1.00 0.00 H new ATOM 0 HA LEU A 118 -4.162 -5.037 1.516 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -3.351 -7.363 2.099 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -2.418 -7.353 0.615 1.00 0.00 H new ATOM 0 HG LEU A 118 -1.185 -5.342 1.458 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -1.305 -4.823 3.860 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -2.851 -4.511 3.035 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -2.654 -5.970 4.035 1.00 0.00 H new ATOM 0 HD21 LEU A 118 0.195 -6.602 3.069 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -1.092 -7.824 3.205 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -0.244 -7.593 1.657 1.00 0.00 H new ATOM 1839 N LEU A 119 -2.753 -3.822 -0.125 1.00 0.00 N ATOM 1840 CA LEU A 119 -2.049 -3.021 -1.109 1.00 0.00 C ATOM 1841 C LEU A 119 -0.829 -2.392 -0.461 1.00 0.00 C ATOM 1842 O LEU A 119 -0.937 -1.707 0.556 1.00 0.00 O ATOM 1843 CB LEU A 119 -2.959 -1.937 -1.695 1.00 0.00 C ATOM 1844 CG LEU A 119 -2.321 -1.082 -2.797 1.00 0.00 C ATOM 1845 CD1 LEU A 119 -1.995 -1.929 -4.016 1.00 0.00 C ATOM 1846 CD2 LEU A 119 -3.237 0.068 -3.182 1.00 0.00 C ATOM 0 H LEU A 119 -2.874 -3.364 0.778 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.736 -3.668 -1.929 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.853 -2.413 -2.097 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -3.283 -1.280 -0.888 1.00 0.00 H new ATOM 0 HG LEU A 119 -1.391 -0.668 -2.407 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -1.543 -1.302 -4.785 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -1.297 -2.718 -3.735 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -2.910 -2.376 -4.404 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -2.766 0.662 -3.965 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -4.184 -0.328 -3.548 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -3.419 0.696 -2.310 1.00 0.00 H new ATOM 1858 N LEU A 120 0.331 -2.647 -1.034 1.00 0.00 N ATOM 1859 CA LEU A 120 1.571 -2.147 -0.472 1.00 0.00 C ATOM 1860 C LEU A 120 2.326 -1.307 -1.489 1.00 0.00 C ATOM 1861 O LEU A 120 2.784 -1.817 -2.513 1.00 0.00 O ATOM 1862 CB LEU A 120 2.452 -3.306 -0.003 1.00 0.00 C ATOM 1863 CG LEU A 120 1.837 -4.203 1.075 1.00 0.00 C ATOM 1864 CD1 LEU A 120 2.757 -5.373 1.382 1.00 0.00 C ATOM 1865 CD2 LEU A 120 1.558 -3.405 2.340 1.00 0.00 C ATOM 0 H LEU A 120 0.441 -3.196 -1.886 1.00 0.00 H new ATOM 0 HA LEU A 120 1.322 -1.520 0.384 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.702 -3.923 -0.866 1.00 0.00 H new ATOM 0 HB3 LEU A 120 3.388 -2.898 0.378 1.00 0.00 H new ATOM 0 HG LEU A 120 0.892 -4.593 0.697 1.00 0.00 H new ATOM 0 HD11 LEU A 120 2.304 -6.000 2.150 1.00 0.00 H new ATOM 0 HD12 LEU A 120 2.911 -5.962 0.478 1.00 0.00 H new ATOM 0 HD13 LEU A 120 3.716 -4.998 1.739 1.00 0.00 H new ATOM 0 HD21 LEU A 120 1.121 -4.060 3.094 1.00 0.00 H new ATOM 0 HD22 LEU A 120 2.490 -2.986 2.719 1.00 0.00 H new ATOM 0 HD23 LEU A 120 0.862 -2.597 2.114 1.00 0.00 H new ATOM 1877 N GLY A 121 2.435 -0.017 -1.210 1.00 0.00 N ATOM 1878 CA GLY A 121 3.245 0.854 -2.040 1.00 0.00 C ATOM 1879 C GLY A 121 4.689 0.813 -1.599 1.00 0.00 C ATOM 1880 O GLY A 121 5.586 0.534 -2.392 1.00 0.00 O ATOM 0 H GLY A 121 1.977 0.444 -0.424 1.00 0.00 H new ATOM 0 HA2 GLY A 121 3.168 0.547 -3.083 1.00 0.00 H new ATOM 0 HA3 GLY A 121 2.869 1.875 -1.980 1.00 0.00 H new ATOM 1884 N SER A 122 4.889 1.078 -0.311 1.00 0.00 N ATOM 1885 CA SER A 122 6.196 0.954 0.326 1.00 0.00 C ATOM 1886 C SER A 122 7.201 1.964 -0.229 1.00 0.00 C ATOM 1887 O SER A 122 6.822 2.993 -0.788 1.00 0.00 O ATOM 1888 CB SER A 122 6.716 -0.473 0.171 1.00 0.00 C ATOM 1889 OG SER A 122 5.743 -1.410 0.603 1.00 0.00 O ATOM 0 H SER A 122 4.149 1.385 0.320 1.00 0.00 H new ATOM 0 HA SER A 122 6.076 1.177 1.386 1.00 0.00 H new ATOM 0 HB2 SER A 122 6.972 -0.661 -0.872 1.00 0.00 H new ATOM 0 HB3 SER A 122 7.631 -0.597 0.751 1.00 0.00 H new ATOM 0 HG SER A 122 5.728 -2.173 -0.012 1.00 0.00 H new ATOM 1895 N GLU A 123 8.481 1.674 -0.050 1.00 0.00 N ATOM 1896 CA GLU A 123 9.533 2.621 -0.375 1.00 0.00 C ATOM 1897 C GLU A 123 10.539 2.056 -1.380 1.00 0.00 C ATOM 1898 O GLU A 123 11.093 2.807 -2.183 1.00 0.00 O ATOM 1899 CB GLU A 123 10.249 3.072 0.910 1.00 0.00 C ATOM 1900 CG GLU A 123 10.929 1.949 1.698 1.00 0.00 C ATOM 1901 CD GLU A 123 9.966 0.891 2.209 1.00 0.00 C ATOM 1902 OE1 GLU A 123 9.700 -0.076 1.465 1.00 0.00 O ATOM 1903 OE2 GLU A 123 9.463 1.029 3.343 1.00 0.00 O ATOM 0 H GLU A 123 8.816 0.785 0.321 1.00 0.00 H new ATOM 0 HA GLU A 123 9.062 3.482 -0.850 1.00 0.00 H new ATOM 0 HB2 GLU A 123 10.999 3.818 0.648 1.00 0.00 H new ATOM 0 HB3 GLU A 123 9.524 3.564 1.559 1.00 0.00 H new ATOM 0 HG2 GLU A 123 11.675 1.472 1.063 1.00 0.00 H new ATOM 0 HG3 GLU A 123 11.461 2.382 2.545 1.00 0.00 H new ATOM 1910 N TYR A 124 10.792 0.747 -1.344 1.00 0.00 N ATOM 1911 CA TYR A 124 11.748 0.144 -2.277 1.00 0.00 C ATOM 1912 C TYR A 124 11.213 -1.140 -2.915 1.00 0.00 C ATOM 1913 O TYR A 124 10.619 -1.098 -3.988 1.00 0.00 O ATOM 1914 CB TYR A 124 13.092 -0.127 -1.585 1.00 0.00 C ATOM 1915 CG TYR A 124 13.845 1.131 -1.202 1.00 0.00 C ATOM 1916 CD1 TYR A 124 14.530 1.866 -2.161 1.00 0.00 C ATOM 1917 CD2 TYR A 124 13.862 1.587 0.110 1.00 0.00 C ATOM 1918 CE1 TYR A 124 15.212 3.019 -1.823 1.00 0.00 C ATOM 1919 CE2 TYR A 124 14.544 2.741 0.455 1.00 0.00 C ATOM 1920 CZ TYR A 124 15.215 3.453 -0.514 1.00 0.00 C ATOM 1921 OH TYR A 124 15.890 4.605 -0.172 1.00 0.00 O ATOM 0 H TYR A 124 10.358 0.093 -0.692 1.00 0.00 H new ATOM 0 HA TYR A 124 11.900 0.867 -3.079 1.00 0.00 H new ATOM 0 HB2 TYR A 124 12.916 -0.721 -0.688 1.00 0.00 H new ATOM 0 HB3 TYR A 124 13.717 -0.727 -2.247 1.00 0.00 H new ATOM 0 HD1 TYR A 124 14.530 1.531 -3.188 1.00 0.00 H new ATOM 0 HD2 TYR A 124 13.335 1.033 0.873 1.00 0.00 H new ATOM 0 HE1 TYR A 124 15.741 3.578 -2.581 1.00 0.00 H new ATOM 0 HE2 TYR A 124 14.550 3.082 1.480 1.00 0.00 H new ATOM 0 HH TYR A 124 15.791 4.769 0.789 1.00 0.00 H new ATOM 1931 N THR A 125 11.419 -2.274 -2.247 1.00 0.00 N ATOM 1932 CA THR A 125 10.989 -3.577 -2.764 1.00 0.00 C ATOM 1933 C THR A 125 10.976 -4.615 -1.645 1.00 0.00 C ATOM 1934 O THR A 125 11.737 -4.505 -0.685 1.00 0.00 O ATOM 1935 CB THR A 125 11.908 -4.085 -3.901 1.00 0.00 C ATOM 1936 OG1 THR A 125 13.238 -3.585 -3.720 1.00 0.00 O ATOM 1937 CG2 THR A 125 11.380 -3.683 -5.271 1.00 0.00 C ATOM 0 H THR A 125 11.884 -2.319 -1.340 1.00 0.00 H new ATOM 0 HA THR A 125 9.985 -3.440 -3.165 1.00 0.00 H new ATOM 0 HB THR A 125 11.922 -5.174 -3.856 1.00 0.00 H new ATOM 0 HG1 THR A 125 13.812 -3.913 -4.443 1.00 0.00 H new ATOM 0 HG21 THR A 125 12.051 -4.057 -6.044 1.00 0.00 H new ATOM 0 HG22 THR A 125 10.387 -4.107 -5.417 1.00 0.00 H new ATOM 0 HG23 THR A 125 11.323 -2.596 -5.335 1.00 0.00 H new ATOM 1945 N PRO A 126 10.143 -5.662 -1.769 1.00 0.00 N ATOM 1946 CA PRO A 126 9.962 -6.659 -0.710 1.00 0.00 C ATOM 1947 C PRO A 126 11.209 -7.507 -0.483 1.00 0.00 C ATOM 1948 O PRO A 126 11.467 -7.971 0.628 1.00 0.00 O ATOM 1949 CB PRO A 126 8.818 -7.545 -1.223 1.00 0.00 C ATOM 1950 CG PRO A 126 8.221 -6.817 -2.380 1.00 0.00 C ATOM 1951 CD PRO A 126 9.316 -5.965 -2.947 1.00 0.00 C ATOM 0 HA PRO A 126 9.755 -6.181 0.248 1.00 0.00 H new ATOM 0 HB2 PRO A 126 9.189 -8.524 -1.527 1.00 0.00 H new ATOM 0 HB3 PRO A 126 8.075 -7.714 -0.443 1.00 0.00 H new ATOM 0 HG2 PRO A 126 7.845 -7.516 -3.127 1.00 0.00 H new ATOM 0 HG3 PRO A 126 7.377 -6.205 -2.062 1.00 0.00 H new ATOM 0 HD2 PRO A 126 9.883 -6.494 -3.713 1.00 0.00 H new ATOM 0 HD3 PRO A 126 8.924 -5.059 -3.409 1.00 0.00 H new ATOM 1959 N GLN A 127 11.982 -7.692 -1.541 1.00 0.00 N ATOM 1960 CA GLN A 127 13.141 -8.571 -1.490 1.00 0.00 C ATOM 1961 C GLN A 127 14.407 -7.812 -1.111 1.00 0.00 C ATOM 1962 O GLN A 127 15.406 -8.421 -0.737 1.00 0.00 O ATOM 1963 CB GLN A 127 13.347 -9.264 -2.836 1.00 0.00 C ATOM 1964 CG GLN A 127 12.201 -10.172 -3.244 1.00 0.00 C ATOM 1965 CD GLN A 127 12.466 -10.868 -4.562 1.00 0.00 C ATOM 1966 OE1 GLN A 127 13.026 -11.961 -4.598 1.00 0.00 O ATOM 1967 NE2 GLN A 127 12.051 -10.245 -5.653 1.00 0.00 N ATOM 0 H GLN A 127 11.829 -7.246 -2.445 1.00 0.00 H new ATOM 0 HA GLN A 127 12.946 -9.318 -0.721 1.00 0.00 H new ATOM 0 HB2 GLN A 127 13.488 -8.505 -3.606 1.00 0.00 H new ATOM 0 HB3 GLN A 127 14.265 -9.850 -2.795 1.00 0.00 H new ATOM 0 HG2 GLN A 127 12.037 -10.919 -2.467 1.00 0.00 H new ATOM 0 HG3 GLN A 127 11.285 -9.586 -3.322 1.00 0.00 H new ATOM 0 HE21 GLN A 127 11.590 -9.338 -5.578 1.00 0.00 H new ATOM 0 HE22 GLN A 127 12.192 -10.672 -6.569 1.00 0.00 H new ATOM 1976 N GLN A 128 14.371 -6.491 -1.205 1.00 0.00 N ATOM 1977 CA GLN A 128 15.562 -5.695 -0.945 1.00 0.00 C ATOM 1978 C GLN A 128 15.505 -5.044 0.432 1.00 0.00 C ATOM 1979 O GLN A 128 16.540 -4.694 1.004 1.00 0.00 O ATOM 1980 CB GLN A 128 15.744 -4.627 -2.024 1.00 0.00 C ATOM 1981 CG GLN A 128 17.117 -3.974 -1.998 1.00 0.00 C ATOM 1982 CD GLN A 128 17.305 -2.949 -3.098 1.00 0.00 C ATOM 1983 OE1 GLN A 128 17.721 -3.284 -4.207 1.00 0.00 O ATOM 1984 NE2 GLN A 128 17.026 -1.691 -2.792 1.00 0.00 N ATOM 0 H GLN A 128 13.542 -5.953 -1.456 1.00 0.00 H new ATOM 0 HA GLN A 128 16.419 -6.368 -0.967 1.00 0.00 H new ATOM 0 HB2 GLN A 128 15.582 -5.078 -3.003 1.00 0.00 H new ATOM 0 HB3 GLN A 128 14.981 -3.859 -1.897 1.00 0.00 H new ATOM 0 HG2 GLN A 128 17.267 -3.493 -1.031 1.00 0.00 H new ATOM 0 HG3 GLN A 128 17.882 -4.745 -2.092 1.00 0.00 H new ATOM 0 HE21 GLN A 128 16.683 -1.457 -1.860 1.00 0.00 H new ATOM 0 HE22 GLN A 128 17.154 -0.956 -3.488 1.00 0.00 H new ATOM 1993 N LEU A 129 14.297 -4.876 0.960 1.00 0.00 N ATOM 1994 CA LEU A 129 14.123 -4.267 2.272 1.00 0.00 C ATOM 1995 C LEU A 129 14.823 -5.080 3.347 1.00 0.00 C ATOM 1996 O LEU A 129 14.701 -6.306 3.394 1.00 0.00 O ATOM 1997 CB LEU A 129 12.640 -4.133 2.615 1.00 0.00 C ATOM 1998 CG LEU A 129 11.886 -3.049 1.848 1.00 0.00 C ATOM 1999 CD1 LEU A 129 10.417 -3.053 2.245 1.00 0.00 C ATOM 2000 CD2 LEU A 129 12.510 -1.686 2.109 1.00 0.00 C ATOM 0 H LEU A 129 13.429 -5.152 0.502 1.00 0.00 H new ATOM 0 HA LEU A 129 14.571 -3.274 2.236 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.154 -5.091 2.430 1.00 0.00 H new ATOM 0 HB3 LEU A 129 12.548 -3.930 3.682 1.00 0.00 H new ATOM 0 HG LEU A 129 11.956 -3.258 0.781 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.889 -2.276 1.692 1.00 0.00 H new ATOM 0 HD12 LEU A 129 9.980 -4.024 2.013 1.00 0.00 H new ATOM 0 HD13 LEU A 129 10.329 -2.861 3.314 1.00 0.00 H new ATOM 0 HD21 LEU A 129 11.962 -0.923 1.556 1.00 0.00 H new ATOM 0 HD22 LEU A 129 12.465 -1.464 3.175 1.00 0.00 H new ATOM 0 HD23 LEU A 129 13.550 -1.694 1.783 1.00 0.00 H new ATOM 2012 N VAL A 130 15.551 -4.393 4.210 1.00 0.00 N ATOM 2013 CA VAL A 130 16.236 -5.052 5.304 1.00 0.00 C ATOM 2014 C VAL A 130 15.328 -5.086 6.526 1.00 0.00 C ATOM 2015 O VAL A 130 15.445 -4.270 7.444 1.00 0.00 O ATOM 2016 CB VAL A 130 17.576 -4.366 5.646 1.00 0.00 C ATOM 2017 CG1 VAL A 130 18.346 -5.170 6.685 1.00 0.00 C ATOM 2018 CG2 VAL A 130 18.412 -4.178 4.386 1.00 0.00 C ATOM 0 H VAL A 130 15.682 -3.382 4.173 1.00 0.00 H new ATOM 0 HA VAL A 130 16.469 -6.070 4.992 1.00 0.00 H new ATOM 0 HB VAL A 130 17.361 -3.385 6.069 1.00 0.00 H new ATOM 0 HG11 VAL A 130 19.287 -4.667 6.910 1.00 0.00 H new ATOM 0 HG12 VAL A 130 17.752 -5.252 7.595 1.00 0.00 H new ATOM 0 HG13 VAL A 130 18.552 -6.167 6.295 1.00 0.00 H new ATOM 0 HG21 VAL A 130 19.354 -3.693 4.643 1.00 0.00 H new ATOM 0 HG22 VAL A 130 18.615 -5.150 3.936 1.00 0.00 H new ATOM 0 HG23 VAL A 130 17.866 -3.556 3.676 1.00 0.00 H new ATOM 2028 N ILE A 131 14.381 -6.004 6.484 1.00 0.00 N ATOM 2029 CA ILE A 131 13.417 -6.192 7.555 1.00 0.00 C ATOM 2030 C ILE A 131 13.553 -7.597 8.117 1.00 0.00 C ATOM 2031 O ILE A 131 14.488 -8.319 7.759 1.00 0.00 O ATOM 2032 CB ILE A 131 11.967 -5.968 7.069 1.00 0.00 C ATOM 2033 CG1 ILE A 131 11.659 -6.867 5.867 1.00 0.00 C ATOM 2034 CG2 ILE A 131 11.745 -4.504 6.719 1.00 0.00 C ATOM 2035 CD1 ILE A 131 10.232 -6.756 5.372 1.00 0.00 C ATOM 0 H ILE A 131 14.257 -6.646 5.701 1.00 0.00 H new ATOM 0 HA ILE A 131 13.627 -5.454 8.329 1.00 0.00 H new ATOM 0 HB ILE A 131 11.285 -6.234 7.877 1.00 0.00 H new ATOM 0 HG12 ILE A 131 12.337 -6.614 5.052 1.00 0.00 H new ATOM 0 HG13 ILE A 131 11.860 -7.903 6.139 1.00 0.00 H new ATOM 0 HG21 ILE A 131 10.719 -4.363 6.378 1.00 0.00 H new ATOM 0 HG22 ILE A 131 11.923 -3.888 7.601 1.00 0.00 H new ATOM 0 HG23 ILE A 131 12.434 -4.211 5.927 1.00 0.00 H new ATOM 0 HD11 ILE A 131 10.090 -7.421 4.520 1.00 0.00 H new ATOM 0 HD12 ILE A 131 9.547 -7.038 6.171 1.00 0.00 H new ATOM 0 HD13 ILE A 131 10.031 -5.729 5.068 1.00 0.00 H new ATOM 2047 N ARG A 132 12.649 -7.977 9.008 1.00 0.00 N ATOM 2048 CA ARG A 132 12.682 -9.305 9.605 1.00 0.00 C ATOM 2049 C ARG A 132 12.514 -10.373 8.527 1.00 0.00 C ATOM 2050 O ARG A 132 11.628 -10.273 7.669 1.00 0.00 O ATOM 2051 CB ARG A 132 11.585 -9.448 10.661 1.00 0.00 C ATOM 2052 CG ARG A 132 11.756 -10.660 11.563 1.00 0.00 C ATOM 2053 CD ARG A 132 12.938 -10.486 12.503 1.00 0.00 C ATOM 2054 NE ARG A 132 13.236 -11.710 13.241 1.00 0.00 N ATOM 2055 CZ ARG A 132 13.840 -11.737 14.427 1.00 0.00 C ATOM 2056 NH1 ARG A 132 14.155 -10.607 15.049 1.00 0.00 N ATOM 2057 NH2 ARG A 132 14.122 -12.901 14.996 1.00 0.00 N ATOM 0 H ARG A 132 11.884 -7.386 9.334 1.00 0.00 H new ATOM 0 HA ARG A 132 13.649 -9.440 10.089 1.00 0.00 H new ATOM 0 HB2 ARG A 132 11.566 -8.548 11.276 1.00 0.00 H new ATOM 0 HB3 ARG A 132 10.619 -9.512 10.161 1.00 0.00 H new ATOM 0 HG2 ARG A 132 10.847 -10.815 12.144 1.00 0.00 H new ATOM 0 HG3 ARG A 132 11.901 -11.552 10.954 1.00 0.00 H new ATOM 0 HD2 ARG A 132 13.815 -10.186 11.930 1.00 0.00 H new ATOM 0 HD3 ARG A 132 12.726 -9.681 13.207 1.00 0.00 H new ATOM 0 HE ARG A 132 12.965 -12.599 12.822 1.00 0.00 H new ATOM 0 HH11 ARG A 132 13.934 -9.709 14.618 1.00 0.00 H new ATOM 0 HH12 ARG A 132 14.618 -10.637 15.958 1.00 0.00 H new ATOM 0 HH21 ARG A 132 13.876 -13.772 14.525 1.00 0.00 H new ATOM 0 HH22 ARG A 132 14.585 -12.926 15.905 1.00 0.00 H new ATOM 2071 N GLU A 133 13.365 -11.389 8.586 1.00 0.00 N ATOM 2072 CA GLU A 133 13.365 -12.474 7.602 1.00 0.00 C ATOM 2073 C GLU A 133 12.013 -13.179 7.547 1.00 0.00 C ATOM 2074 O GLU A 133 11.649 -13.774 6.532 1.00 0.00 O ATOM 2075 CB GLU A 133 14.456 -13.492 7.940 1.00 0.00 C ATOM 2076 CG GLU A 133 15.871 -12.943 7.849 1.00 0.00 C ATOM 2077 CD GLU A 133 16.274 -12.591 6.432 1.00 0.00 C ATOM 2078 OE1 GLU A 133 16.700 -13.499 5.690 1.00 0.00 O ATOM 2079 OE2 GLU A 133 16.176 -11.407 6.051 1.00 0.00 O ATOM 0 H GLU A 133 14.074 -11.488 9.313 1.00 0.00 H new ATOM 0 HA GLU A 133 13.562 -12.033 6.625 1.00 0.00 H new ATOM 0 HB2 GLU A 133 14.288 -13.866 8.950 1.00 0.00 H new ATOM 0 HB3 GLU A 133 14.365 -14.343 7.265 1.00 0.00 H new ATOM 0 HG2 GLU A 133 15.952 -12.055 8.476 1.00 0.00 H new ATOM 0 HG3 GLU A 133 16.568 -13.680 8.248 1.00 0.00 H new ATOM 2086 N ASP A 134 11.272 -13.104 8.641 1.00 0.00 N ATOM 2087 CA ASP A 134 9.984 -13.773 8.742 1.00 0.00 C ATOM 2088 C ASP A 134 8.927 -13.060 7.903 1.00 0.00 C ATOM 2089 O ASP A 134 8.039 -13.699 7.338 1.00 0.00 O ATOM 2090 CB ASP A 134 9.527 -13.840 10.202 1.00 0.00 C ATOM 2091 CG ASP A 134 10.549 -14.506 11.104 1.00 0.00 C ATOM 2092 OD1 ASP A 134 10.672 -15.747 11.060 1.00 0.00 O ATOM 2093 OD2 ASP A 134 11.232 -13.789 11.862 1.00 0.00 O ATOM 0 H ASP A 134 11.542 -12.584 9.476 1.00 0.00 H new ATOM 0 HA ASP A 134 10.105 -14.786 8.359 1.00 0.00 H new ATOM 0 HB2 ASP A 134 9.331 -12.831 10.564 1.00 0.00 H new ATOM 0 HB3 ASP A 134 8.586 -14.387 10.259 1.00 0.00 H new ATOM 2098 N LEU A 135 9.029 -11.736 7.820 1.00 0.00 N ATOM 2099 CA LEU A 135 8.027 -10.934 7.123 1.00 0.00 C ATOM 2100 C LEU A 135 8.274 -10.894 5.615 1.00 0.00 C ATOM 2101 O LEU A 135 7.356 -11.104 4.821 1.00 0.00 O ATOM 2102 CB LEU A 135 7.998 -9.508 7.679 1.00 0.00 C ATOM 2103 CG LEU A 135 6.878 -8.623 7.125 1.00 0.00 C ATOM 2104 CD1 LEU A 135 5.515 -9.199 7.483 1.00 0.00 C ATOM 2105 CD2 LEU A 135 7.014 -7.202 7.648 1.00 0.00 C ATOM 0 H LEU A 135 9.794 -11.197 8.226 1.00 0.00 H new ATOM 0 HA LEU A 135 7.061 -11.410 7.293 1.00 0.00 H new ATOM 0 HB2 LEU A 135 7.899 -9.558 8.763 1.00 0.00 H new ATOM 0 HB3 LEU A 135 8.956 -9.032 7.468 1.00 0.00 H new ATOM 0 HG LEU A 135 6.964 -8.598 6.039 1.00 0.00 H new ATOM 0 HD11 LEU A 135 4.732 -8.557 7.081 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.419 -10.198 7.058 1.00 0.00 H new ATOM 0 HD13 LEU A 135 5.417 -9.255 8.567 1.00 0.00 H new ATOM 0 HD21 LEU A 135 6.210 -6.587 7.244 1.00 0.00 H new ATOM 0 HD22 LEU A 135 6.955 -7.208 8.736 1.00 0.00 H new ATOM 0 HD23 LEU A 135 7.975 -6.791 7.339 1.00 0.00 H new ATOM 2117 N ARG A 136 9.520 -10.634 5.224 1.00 0.00 N ATOM 2118 CA ARG A 136 9.870 -10.417 3.822 1.00 0.00 C ATOM 2119 C ARG A 136 9.568 -11.635 2.950 1.00 0.00 C ATOM 2120 O ARG A 136 9.378 -11.505 1.739 1.00 0.00 O ATOM 2121 CB ARG A 136 11.344 -10.031 3.706 1.00 0.00 C ATOM 2122 CG ARG A 136 12.298 -11.056 4.290 1.00 0.00 C ATOM 2123 CD ARG A 136 13.738 -10.568 4.257 1.00 0.00 C ATOM 2124 NE ARG A 136 14.232 -10.353 2.898 1.00 0.00 N ATOM 2125 CZ ARG A 136 15.471 -10.660 2.507 1.00 0.00 C ATOM 2126 NH1 ARG A 136 16.325 -11.209 3.361 1.00 0.00 N ATOM 2127 NH2 ARG A 136 15.859 -10.409 1.264 1.00 0.00 N ATOM 0 H ARG A 136 10.310 -10.568 5.865 1.00 0.00 H new ATOM 0 HA ARG A 136 9.249 -9.601 3.453 1.00 0.00 H new ATOM 0 HB2 ARG A 136 11.588 -9.881 2.654 1.00 0.00 H new ATOM 0 HB3 ARG A 136 11.500 -9.077 4.209 1.00 0.00 H new ATOM 0 HG2 ARG A 136 12.012 -11.275 5.319 1.00 0.00 H new ATOM 0 HG3 ARG A 136 12.217 -11.988 3.731 1.00 0.00 H new ATOM 0 HD2 ARG A 136 13.814 -9.637 4.818 1.00 0.00 H new ATOM 0 HD3 ARG A 136 14.375 -11.296 4.759 1.00 0.00 H new ATOM 0 HE ARG A 136 13.596 -9.947 2.212 1.00 0.00 H new ATOM 0 HH11 ARG A 136 16.036 -11.398 4.321 1.00 0.00 H new ATOM 0 HH12 ARG A 136 17.271 -11.442 3.058 1.00 0.00 H new ATOM 0 HH21 ARG A 136 15.210 -9.980 0.604 1.00 0.00 H new ATOM 0 HH22 ARG A 136 16.806 -10.645 0.968 1.00 0.00 H new ATOM 2141 N THR A 137 9.509 -12.810 3.556 1.00 0.00 N ATOM 2142 CA THR A 137 9.198 -14.025 2.818 1.00 0.00 C ATOM 2143 C THR A 137 7.706 -14.099 2.489 1.00 0.00 C ATOM 2144 O THR A 137 7.307 -14.690 1.483 1.00 0.00 O ATOM 2145 CB THR A 137 9.617 -15.275 3.610 1.00 0.00 C ATOM 2146 OG1 THR A 137 9.129 -15.181 4.953 1.00 0.00 O ATOM 2147 CG2 THR A 137 11.133 -15.427 3.617 1.00 0.00 C ATOM 0 H THR A 137 9.672 -12.949 4.553 1.00 0.00 H new ATOM 0 HA THR A 137 9.763 -13.995 1.886 1.00 0.00 H new ATOM 0 HB THR A 137 9.187 -16.153 3.128 1.00 0.00 H new ATOM 0 HG1 THR A 137 9.800 -14.741 5.515 1.00 0.00 H new ATOM 0 HG21 THR A 137 11.407 -16.318 4.183 1.00 0.00 H new ATOM 0 HG22 THR A 137 11.494 -15.523 2.593 1.00 0.00 H new ATOM 0 HG23 THR A 137 11.584 -14.550 4.080 1.00 0.00 H new ATOM 2155 N ARG A 138 6.886 -13.484 3.336 1.00 0.00 N ATOM 2156 CA ARG A 138 5.441 -13.476 3.145 1.00 0.00 C ATOM 2157 C ARG A 138 5.048 -12.466 2.074 1.00 0.00 C ATOM 2158 O ARG A 138 3.951 -12.509 1.526 1.00 0.00 O ATOM 2159 CB ARG A 138 4.740 -13.142 4.462 1.00 0.00 C ATOM 2160 CG ARG A 138 5.372 -13.822 5.662 1.00 0.00 C ATOM 2161 CD ARG A 138 5.343 -15.335 5.536 1.00 0.00 C ATOM 2162 NE ARG A 138 6.225 -15.971 6.508 1.00 0.00 N ATOM 2163 CZ ARG A 138 6.142 -17.249 6.873 1.00 0.00 C ATOM 2164 NH1 ARG A 138 5.206 -18.038 6.357 1.00 0.00 N ATOM 2165 NH2 ARG A 138 6.996 -17.744 7.758 1.00 0.00 N ATOM 0 H ARG A 138 7.201 -12.982 4.166 1.00 0.00 H new ATOM 0 HA ARG A 138 5.130 -14.468 2.817 1.00 0.00 H new ATOM 0 HB2 ARG A 138 4.758 -12.063 4.613 1.00 0.00 H new ATOM 0 HB3 ARG A 138 3.693 -13.437 4.394 1.00 0.00 H new ATOM 0 HG2 ARG A 138 6.404 -13.486 5.768 1.00 0.00 H new ATOM 0 HG3 ARG A 138 4.845 -13.523 6.568 1.00 0.00 H new ATOM 0 HD2 ARG A 138 4.324 -15.693 5.680 1.00 0.00 H new ATOM 0 HD3 ARG A 138 5.643 -15.623 4.528 1.00 0.00 H new ATOM 0 HE ARG A 138 6.953 -15.399 6.936 1.00 0.00 H new ATOM 0 HH11 ARG A 138 4.544 -17.666 5.676 1.00 0.00 H new ATOM 0 HH12 ARG A 138 5.149 -19.016 6.642 1.00 0.00 H new ATOM 0 HH21 ARG A 138 7.718 -17.146 8.160 1.00 0.00 H new ATOM 0 HH22 ARG A 138 6.931 -18.723 8.037 1.00 0.00 H new ATOM 2179 N MET A 139 5.973 -11.569 1.770 1.00 0.00 N ATOM 2180 CA MET A 139 5.750 -10.534 0.770 1.00 0.00 C ATOM 2181 C MET A 139 5.641 -11.146 -0.625 1.00 0.00 C ATOM 2182 O MET A 139 5.101 -10.535 -1.547 1.00 0.00 O ATOM 2183 CB MET A 139 6.893 -9.521 0.815 1.00 0.00 C ATOM 2184 CG MET A 139 6.967 -8.738 2.116 1.00 0.00 C ATOM 2185 SD MET A 139 5.547 -7.652 2.350 1.00 0.00 S ATOM 2186 CE MET A 139 5.964 -6.878 3.910 1.00 0.00 C ATOM 0 H MET A 139 6.895 -11.537 2.206 1.00 0.00 H new ATOM 0 HA MET A 139 4.811 -10.027 0.993 1.00 0.00 H new ATOM 0 HB2 MET A 139 7.837 -10.045 0.663 1.00 0.00 H new ATOM 0 HB3 MET A 139 6.779 -8.822 -0.013 1.00 0.00 H new ATOM 0 HG2 MET A 139 7.029 -9.434 2.952 1.00 0.00 H new ATOM 0 HG3 MET A 139 7.881 -8.144 2.127 1.00 0.00 H new ATOM 0 HE1 MET A 139 5.649 -5.835 3.894 1.00 0.00 H new ATOM 0 HE2 MET A 139 5.456 -7.399 4.722 1.00 0.00 H new ATOM 0 HE3 MET A 139 7.042 -6.929 4.065 1.00 0.00 H new ATOM 2196 N ALA A 140 6.134 -12.373 -0.760 1.00 0.00 N ATOM 2197 CA ALA A 140 6.138 -13.068 -2.041 1.00 0.00 C ATOM 2198 C ALA A 140 4.731 -13.480 -2.470 1.00 0.00 C ATOM 2199 O ALA A 140 4.514 -13.861 -3.620 1.00 0.00 O ATOM 2200 CB ALA A 140 7.038 -14.288 -1.971 1.00 0.00 C ATOM 0 H ALA A 140 6.538 -12.909 0.008 1.00 0.00 H new ATOM 0 HA ALA A 140 6.522 -12.375 -2.789 1.00 0.00 H new ATOM 0 HB1 ALA A 140 7.033 -14.799 -2.934 1.00 0.00 H new ATOM 0 HB2 ALA A 140 8.055 -13.977 -1.730 1.00 0.00 H new ATOM 0 HB3 ALA A 140 6.673 -14.965 -1.199 1.00 0.00 H new ATOM 2206 N TYR A 141 3.774 -13.398 -1.550 1.00 0.00 N ATOM 2207 CA TYR A 141 2.399 -13.783 -1.842 1.00 0.00 C ATOM 2208 C TYR A 141 1.657 -12.657 -2.560 1.00 0.00 C ATOM 2209 O TYR A 141 0.490 -12.802 -2.918 1.00 0.00 O ATOM 2210 CB TYR A 141 1.659 -14.160 -0.555 1.00 0.00 C ATOM 2211 CG TYR A 141 2.243 -15.359 0.161 1.00 0.00 C ATOM 2212 CD1 TYR A 141 2.265 -16.610 -0.439 1.00 0.00 C ATOM 2213 CD2 TYR A 141 2.770 -15.237 1.439 1.00 0.00 C ATOM 2214 CE1 TYR A 141 2.800 -17.705 0.215 1.00 0.00 C ATOM 2215 CE2 TYR A 141 3.308 -16.324 2.098 1.00 0.00 C ATOM 2216 CZ TYR A 141 3.319 -17.556 1.483 1.00 0.00 C ATOM 2217 OH TYR A 141 3.856 -18.640 2.136 1.00 0.00 O ATOM 0 H TYR A 141 3.926 -13.068 -0.597 1.00 0.00 H new ATOM 0 HA TYR A 141 2.428 -14.652 -2.499 1.00 0.00 H new ATOM 0 HB2 TYR A 141 1.669 -13.305 0.121 1.00 0.00 H new ATOM 0 HB3 TYR A 141 0.616 -14.365 -0.795 1.00 0.00 H new ATOM 0 HD1 TYR A 141 1.858 -16.731 -1.432 1.00 0.00 H new ATOM 0 HD2 TYR A 141 2.759 -14.274 1.927 1.00 0.00 H new ATOM 0 HE1 TYR A 141 2.811 -18.672 -0.266 1.00 0.00 H new ATOM 0 HE2 TYR A 141 3.718 -16.209 3.090 1.00 0.00 H new ATOM 0 HH TYR A 141 4.179 -18.363 3.019 1.00 0.00 H new ATOM 2227 N CYS A 142 2.343 -11.543 -2.775 1.00 0.00 N ATOM 2228 CA CYS A 142 1.759 -10.404 -3.449 1.00 0.00 C ATOM 2229 C CYS A 142 2.366 -10.258 -4.834 1.00 0.00 C ATOM 2230 O CYS A 142 3.498 -10.683 -5.080 1.00 0.00 O ATOM 2231 CB CYS A 142 1.991 -9.131 -2.632 1.00 0.00 C ATOM 2232 SG CYS A 142 1.325 -9.204 -0.952 1.00 0.00 S ATOM 0 H CYS A 142 3.312 -11.409 -2.488 1.00 0.00 H new ATOM 0 HA CYS A 142 0.685 -10.562 -3.548 1.00 0.00 H new ATOM 0 HB2 CYS A 142 3.062 -8.936 -2.579 1.00 0.00 H new ATOM 0 HB3 CYS A 142 1.539 -8.288 -3.155 1.00 0.00 H new ATOM 0 HG CYS A 142 1.571 -8.085 -0.339 1.00 0.00 H new ATOM 2238 N LEU A 143 1.595 -9.694 -5.745 1.00 0.00 N ATOM 2239 CA LEU A 143 2.072 -9.426 -7.097 1.00 0.00 C ATOM 2240 C LEU A 143 2.901 -8.150 -7.102 1.00 0.00 C ATOM 2241 O LEU A 143 2.708 -7.284 -6.255 1.00 0.00 O ATOM 2242 CB LEU A 143 0.906 -9.295 -8.087 1.00 0.00 C ATOM 2243 CG LEU A 143 0.150 -10.584 -8.411 1.00 0.00 C ATOM 2244 CD1 LEU A 143 -0.770 -10.995 -7.270 1.00 0.00 C ATOM 2245 CD2 LEU A 143 -0.644 -10.424 -9.698 1.00 0.00 C ATOM 0 H LEU A 143 0.630 -9.410 -5.576 1.00 0.00 H new ATOM 0 HA LEU A 143 2.688 -10.268 -7.414 1.00 0.00 H new ATOM 0 HB2 LEU A 143 0.195 -8.572 -7.686 1.00 0.00 H new ATOM 0 HB3 LEU A 143 1.292 -8.880 -9.018 1.00 0.00 H new ATOM 0 HG LEU A 143 0.887 -11.375 -8.545 1.00 0.00 H new ATOM 0 HD11 LEU A 143 -1.291 -11.915 -7.536 1.00 0.00 H new ATOM 0 HD12 LEU A 143 -0.180 -11.159 -6.368 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -1.499 -10.205 -7.088 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -1.176 -11.350 -9.915 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -1.361 -9.611 -9.584 1.00 0.00 H new ATOM 0 HD23 LEU A 143 0.036 -10.196 -10.519 1.00 0.00 H new ATOM 2257 N VAL A 144 3.809 -8.028 -8.057 1.00 0.00 N ATOM 2258 CA VAL A 144 4.717 -6.894 -8.094 1.00 0.00 C ATOM 2259 C VAL A 144 4.612 -6.166 -9.427 1.00 0.00 C ATOM 2260 O VAL A 144 4.769 -6.768 -10.489 1.00 0.00 O ATOM 2261 CB VAL A 144 6.184 -7.327 -7.861 1.00 0.00 C ATOM 2262 CG1 VAL A 144 7.113 -6.119 -7.869 1.00 0.00 C ATOM 2263 CG2 VAL A 144 6.318 -8.102 -6.555 1.00 0.00 C ATOM 0 H VAL A 144 3.936 -8.699 -8.815 1.00 0.00 H new ATOM 0 HA VAL A 144 4.424 -6.223 -7.287 1.00 0.00 H new ATOM 0 HB VAL A 144 6.477 -7.985 -8.679 1.00 0.00 H new ATOM 0 HG11 VAL A 144 8.139 -6.448 -7.703 1.00 0.00 H new ATOM 0 HG12 VAL A 144 7.045 -5.614 -8.833 1.00 0.00 H new ATOM 0 HG13 VAL A 144 6.821 -5.430 -7.077 1.00 0.00 H new ATOM 0 HG21 VAL A 144 7.358 -8.396 -6.412 1.00 0.00 H new ATOM 0 HG22 VAL A 144 6.001 -7.472 -5.724 1.00 0.00 H new ATOM 0 HG23 VAL A 144 5.691 -8.993 -6.594 1.00 0.00 H new ATOM 2273 N TYR A 145 4.318 -4.882 -9.357 1.00 0.00 N ATOM 2274 CA TYR A 145 4.269 -4.032 -10.541 1.00 0.00 C ATOM 2275 C TYR A 145 5.166 -2.817 -10.339 1.00 0.00 C ATOM 2276 O TYR A 145 5.169 -2.217 -9.263 1.00 0.00 O ATOM 2277 CB TYR A 145 2.834 -3.570 -10.826 1.00 0.00 C ATOM 2278 CG TYR A 145 1.878 -4.687 -11.191 1.00 0.00 C ATOM 2279 CD1 TYR A 145 1.767 -5.131 -12.502 1.00 0.00 C ATOM 2280 CD2 TYR A 145 1.084 -5.292 -10.226 1.00 0.00 C ATOM 2281 CE1 TYR A 145 0.887 -6.141 -12.841 1.00 0.00 C ATOM 2282 CE2 TYR A 145 0.202 -6.305 -10.557 1.00 0.00 C ATOM 2283 CZ TYR A 145 0.109 -6.729 -11.865 1.00 0.00 C ATOM 2284 OH TYR A 145 -0.768 -7.734 -12.203 1.00 0.00 O ATOM 0 H TYR A 145 4.107 -4.397 -8.485 1.00 0.00 H new ATOM 0 HA TYR A 145 4.621 -4.612 -11.394 1.00 0.00 H new ATOM 0 HB2 TYR A 145 2.450 -3.053 -9.947 1.00 0.00 H new ATOM 0 HB3 TYR A 145 2.854 -2.845 -11.639 1.00 0.00 H new ATOM 0 HD1 TYR A 145 2.378 -4.680 -13.269 1.00 0.00 H new ATOM 0 HD2 TYR A 145 1.156 -4.966 -9.199 1.00 0.00 H new ATOM 0 HE1 TYR A 145 0.808 -6.469 -13.867 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -0.411 -6.762 -9.794 1.00 0.00 H new ATOM 0 HH TYR A 145 -1.239 -8.041 -11.400 1.00 0.00 H new ATOM 2294 N GLU A 146 5.939 -2.466 -11.360 1.00 0.00 N ATOM 2295 CA GLU A 146 6.806 -1.299 -11.280 1.00 0.00 C ATOM 2296 C GLU A 146 6.021 -0.037 -11.620 1.00 0.00 C ATOM 2297 O GLU A 146 5.306 0.010 -12.627 1.00 0.00 O ATOM 2298 CB GLU A 146 8.023 -1.451 -12.206 1.00 0.00 C ATOM 2299 CG GLU A 146 7.692 -1.455 -13.692 1.00 0.00 C ATOM 2300 CD GLU A 146 8.903 -1.702 -14.567 1.00 0.00 C ATOM 2301 OE1 GLU A 146 9.742 -0.787 -14.710 1.00 0.00 O ATOM 2302 OE2 GLU A 146 9.017 -2.811 -15.127 1.00 0.00 O ATOM 0 H GLU A 146 5.983 -2.969 -12.246 1.00 0.00 H new ATOM 0 HA GLU A 146 7.176 -1.215 -10.258 1.00 0.00 H new ATOM 0 HB2 GLU A 146 8.720 -0.638 -12.005 1.00 0.00 H new ATOM 0 HB3 GLU A 146 8.537 -2.380 -11.959 1.00 0.00 H new ATOM 0 HG2 GLU A 146 6.945 -2.223 -13.890 1.00 0.00 H new ATOM 0 HG3 GLU A 146 7.245 -0.498 -13.962 1.00 0.00 H new ATOM 2309 N VAL A 147 6.131 0.973 -10.772 1.00 0.00 N ATOM 2310 CA VAL A 147 5.404 2.212 -10.982 1.00 0.00 C ATOM 2311 C VAL A 147 6.355 3.351 -11.332 1.00 0.00 C ATOM 2312 O VAL A 147 6.912 4.003 -10.449 1.00 0.00 O ATOM 2313 CB VAL A 147 4.566 2.602 -9.743 1.00 0.00 C ATOM 2314 CG1 VAL A 147 3.760 3.868 -10.000 1.00 0.00 C ATOM 2315 CG2 VAL A 147 3.649 1.458 -9.333 1.00 0.00 C ATOM 0 H VAL A 147 6.714 0.959 -9.935 1.00 0.00 H new ATOM 0 HA VAL A 147 4.725 2.042 -11.817 1.00 0.00 H new ATOM 0 HB VAL A 147 5.255 2.803 -8.923 1.00 0.00 H new ATOM 0 HG11 VAL A 147 3.181 4.117 -9.111 1.00 0.00 H new ATOM 0 HG12 VAL A 147 4.437 4.689 -10.234 1.00 0.00 H new ATOM 0 HG13 VAL A 147 3.084 3.705 -10.839 1.00 0.00 H new ATOM 0 HG21 VAL A 147 3.068 1.753 -8.459 1.00 0.00 H new ATOM 0 HG22 VAL A 147 2.973 1.221 -10.155 1.00 0.00 H new ATOM 0 HG23 VAL A 147 4.248 0.580 -9.091 1.00 0.00 H new ATOM 2325 N LYS A 148 6.560 3.561 -12.624 1.00 0.00 N ATOM 2326 CA LYS A 148 7.357 4.683 -13.100 1.00 0.00 C ATOM 2327 C LYS A 148 6.882 5.115 -14.484 1.00 0.00 C ATOM 2328 O LYS A 148 7.361 4.611 -15.502 1.00 0.00 O ATOM 2329 CB LYS A 148 8.848 4.332 -13.147 1.00 0.00 C ATOM 2330 CG LYS A 148 9.729 5.519 -13.506 1.00 0.00 C ATOM 2331 CD LYS A 148 11.158 5.098 -13.806 1.00 0.00 C ATOM 2332 CE LYS A 148 12.012 6.296 -14.186 1.00 0.00 C ATOM 2333 NZ LYS A 148 13.328 5.892 -14.747 1.00 0.00 N ATOM 0 H LYS A 148 6.184 2.968 -13.364 1.00 0.00 H new ATOM 0 HA LYS A 148 7.226 5.506 -12.398 1.00 0.00 H new ATOM 0 HB2 LYS A 148 9.154 3.940 -12.177 1.00 0.00 H new ATOM 0 HB3 LYS A 148 9.005 3.537 -13.876 1.00 0.00 H new ATOM 0 HG2 LYS A 148 9.312 6.030 -14.374 1.00 0.00 H new ATOM 0 HG3 LYS A 148 9.727 6.234 -12.683 1.00 0.00 H new ATOM 0 HD2 LYS A 148 11.586 4.604 -12.933 1.00 0.00 H new ATOM 0 HD3 LYS A 148 11.164 4.371 -14.618 1.00 0.00 H new ATOM 0 HE2 LYS A 148 11.478 6.903 -14.917 1.00 0.00 H new ATOM 0 HE3 LYS A 148 12.170 6.921 -13.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 13.876 6.741 -14.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 13.850 5.334 -14.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 13.180 5.317 -15.601 1.00 0.00 H new ATOM 2347 N PRO A 149 5.886 6.007 -14.534 1.00 0.00 N ATOM 2348 CA PRO A 149 5.377 6.562 -15.777 1.00 0.00 C ATOM 2349 C PRO A 149 6.203 7.759 -16.245 1.00 0.00 C ATOM 2350 O PRO A 149 7.162 7.560 -17.021 1.00 0.00 O ATOM 2351 CB PRO A 149 3.944 6.999 -15.420 1.00 0.00 C ATOM 2352 CG PRO A 149 3.771 6.714 -13.956 1.00 0.00 C ATOM 2353 CD PRO A 149 5.149 6.533 -13.388 1.00 0.00 C ATOM 2354 OXT PRO A 149 5.885 8.900 -15.836 1.00 0.00 O ATOM 0 HA PRO A 149 5.418 5.843 -16.596 1.00 0.00 H new ATOM 0 HB2 PRO A 149 3.796 8.058 -15.630 1.00 0.00 H new ATOM 0 HB3 PRO A 149 3.211 6.451 -16.012 1.00 0.00 H new ATOM 0 HG2 PRO A 149 3.252 7.535 -13.460 1.00 0.00 H new ATOM 0 HG3 PRO A 149 3.169 5.818 -13.804 1.00 0.00 H new ATOM 0 HD2 PRO A 149 5.569 7.473 -13.030 1.00 0.00 H new ATOM 0 HD3 PRO A 149 5.155 5.840 -12.547 1.00 0.00 H new TER 2362 PRO A 149