USER MOD reduce.3.24.130724 H: found=0, std=0, add=1001, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 999 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 74 SER OG : rot -169:sc= -0.0919 USER MOD Set 1.2: A 88 GLN : amide:sc= -1.48! X(o=-1.6!,f=-1.2) USER MOD Set 2.1: A 34 HIS : no HD1:sc= -0.0346 K(o=-0.33,f=-10!) USER MOD Set 2.2: A 121 SER OG : rot 164:sc= -0.299 USER MOD Single : A 1 MET CE :methyl -163:sc= -0.122 (180deg=-0.644) USER MOD Single : A 1 MET N :NH3+ 166:sc= -0.0324 (180deg=-0.368) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 5 HIS : no HD1:sc= -0.0896 X(o=-0.09,f=0) USER MOD Single : A 12 HIS : no HE2:sc= 0.983 K(o=0.98,f=-4.4!) USER MOD Single : A 20 SER OG : rot 99:sc= -0.142 USER MOD Single : A 24 GLN : amide:sc= 0.882 K(o=0.88,f=-7!) USER MOD Single : A 37 SER OG : rot 4:sc= 0.094 USER MOD Single : A 39 HIS : no HD1:sc= -5.18! C(o=-5.2!,f=-5.7!) USER MOD Single : A 45 GLN : amide:sc= -0.2 K(o=-0.2,f=-1.2) USER MOD Single : A 47 GLN : amide:sc= 0 K(o=0,f=-0.75) USER MOD Single : A 50 ASN : amide:sc= 0.235! C(o=0.24!,f=-12!) USER MOD Single : A 54 GLN : amide:sc= -2.31! K(o=-2.3!,f=-0.46) USER MOD Single : A 62 TYR OH : rot -125:sc= 1.74 USER MOD Single : A 71 MET CE :methyl -141:sc= -0.107 (180deg=-0.722) USER MOD Single : A 87 CYS SG : rot 28:sc= -1.37 USER MOD Single : A 89 HIS : no HD1:sc= -0.109 K(o=-0.11,f=-1.7) USER MOD Single : A 94 SER OG : rot -162:sc= 0.0924 USER MOD Single : A 96 SER OG : rot 61:sc= 1.23 USER MOD Single : A 97 HIS : no HD1:sc= -0.0908 K(o=-0.091,f=-2.1) USER MOD Single : A 105 ASN : amide:sc= 1.09 K(o=1.1,f=0) USER MOD Single : A 123 HIS : no HD1:sc=-0.000321 X(o=-0.00032,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.397 14.083 -40.804 1.00 0.00 N ATOM 2 CA MET A 1 1.050 14.349 -39.498 1.00 0.00 C ATOM 3 C MET A 1 0.443 13.469 -38.406 1.00 0.00 C ATOM 4 O MET A 1 0.443 13.828 -37.229 1.00 0.00 O ATOM 5 CB MET A 1 0.915 15.832 -39.127 1.00 0.00 C ATOM 6 CG MET A 1 -0.522 16.300 -38.950 1.00 0.00 C ATOM 7 SD MET A 1 -0.640 18.058 -38.560 1.00 0.00 S ATOM 8 CE MET A 1 0.258 18.127 -37.008 1.00 0.00 C ATOM 0 H1 MET A 1 0.644 14.838 -41.476 1.00 0.00 H new ATOM 0 H2 MET A 1 0.724 13.168 -41.176 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.635 14.056 -40.677 1.00 0.00 H new ATOM 0 HA MET A 1 2.109 14.107 -39.585 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.462 16.015 -38.202 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.389 16.434 -39.902 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.081 16.097 -39.863 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.992 15.723 -38.153 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.023 19.058 -36.493 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.032 17.283 -36.382 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.329 18.081 -37.205 1.00 0.00 H new ATOM 18 N SER A 2 -0.045 12.301 -38.803 1.00 0.00 N ATOM 19 CA SER A 2 -0.705 11.389 -37.880 1.00 0.00 C ATOM 20 C SER A 2 0.308 10.411 -37.281 1.00 0.00 C ATOM 21 O SER A 2 1.519 10.614 -37.406 1.00 0.00 O ATOM 22 CB SER A 2 -1.800 10.628 -38.625 1.00 0.00 C ATOM 23 OG SER A 2 -2.594 11.516 -39.397 1.00 0.00 O ATOM 0 H SER A 2 0.005 11.962 -39.764 1.00 0.00 H new ATOM 0 HA SER A 2 -1.150 11.959 -37.065 1.00 0.00 H new ATOM 0 HB2 SER A 2 -1.350 9.877 -39.274 1.00 0.00 H new ATOM 0 HB3 SER A 2 -2.430 10.096 -37.912 1.00 0.00 H new ATOM 0 HG SER A 2 -3.288 11.009 -39.868 1.00 0.00 H new ATOM 29 N ASP A 3 -0.192 9.361 -36.626 1.00 0.00 N ATOM 30 CA ASP A 3 0.665 8.309 -36.075 1.00 0.00 C ATOM 31 C ASP A 3 1.508 7.687 -37.176 1.00 0.00 C ATOM 32 O ASP A 3 1.017 6.873 -37.963 1.00 0.00 O ATOM 33 CB ASP A 3 -0.166 7.222 -35.386 1.00 0.00 C ATOM 34 CG ASP A 3 -0.757 7.679 -34.070 1.00 0.00 C ATOM 35 OD1 ASP A 3 -1.666 8.533 -34.088 1.00 0.00 O ATOM 36 OD2 ASP A 3 -0.327 7.177 -33.011 1.00 0.00 O ATOM 0 H ASP A 3 -1.189 9.216 -36.464 1.00 0.00 H new ATOM 0 HA ASP A 3 1.319 8.766 -35.332 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -0.971 6.910 -36.052 1.00 0.00 H new ATOM 0 HB3 ASP A 3 0.461 6.347 -35.213 1.00 0.00 H new ATOM 41 N GLN A 4 2.776 8.081 -37.212 1.00 0.00 N ATOM 42 CA GLN A 4 3.689 7.722 -38.292 1.00 0.00 C ATOM 43 C GLN A 4 4.950 8.569 -38.195 1.00 0.00 C ATOM 44 O GLN A 4 6.062 8.086 -38.394 1.00 0.00 O ATOM 45 CB GLN A 4 3.037 7.964 -39.658 1.00 0.00 C ATOM 46 CG GLN A 4 3.811 7.375 -40.824 1.00 0.00 C ATOM 47 CD GLN A 4 3.164 7.684 -42.158 1.00 0.00 C ATOM 48 OE1 GLN A 4 3.494 8.680 -42.804 1.00 0.00 O ATOM 49 NE2 GLN A 4 2.216 6.855 -42.564 1.00 0.00 N ATOM 0 H GLN A 4 3.202 8.661 -36.489 1.00 0.00 H new ATOM 0 HA GLN A 4 3.934 6.664 -38.196 1.00 0.00 H new ATOM 0 HB2 GLN A 4 2.033 7.540 -39.650 1.00 0.00 H new ATOM 0 HB3 GLN A 4 2.928 9.038 -39.812 1.00 0.00 H new ATOM 0 HG2 GLN A 4 4.828 7.766 -40.817 1.00 0.00 H new ATOM 0 HG3 GLN A 4 3.884 6.295 -40.700 1.00 0.00 H new ATOM 0 HE21 GLN A 4 1.973 6.041 -41.999 1.00 0.00 H new ATOM 0 HE22 GLN A 4 1.728 7.029 -43.442 1.00 0.00 H new ATOM 58 N HIS A 5 4.758 9.845 -37.885 1.00 0.00 N ATOM 59 CA HIS A 5 5.861 10.797 -37.834 1.00 0.00 C ATOM 60 C HIS A 5 5.963 11.401 -36.434 1.00 0.00 C ATOM 61 O HIS A 5 6.592 12.436 -36.222 1.00 0.00 O ATOM 62 CB HIS A 5 5.644 11.891 -38.883 1.00 0.00 C ATOM 63 CG HIS A 5 6.906 12.563 -39.332 1.00 0.00 C ATOM 64 ND1 HIS A 5 7.595 12.181 -40.460 1.00 0.00 N ATOM 65 CD2 HIS A 5 7.599 13.599 -38.805 1.00 0.00 C ATOM 66 CE1 HIS A 5 8.658 12.948 -40.604 1.00 0.00 C ATOM 67 NE2 HIS A 5 8.684 13.819 -39.613 1.00 0.00 N ATOM 0 H HIS A 5 3.846 10.246 -37.664 1.00 0.00 H new ATOM 0 HA HIS A 5 6.797 10.283 -38.055 1.00 0.00 H new ATOM 0 HB2 HIS A 5 5.148 11.455 -39.750 1.00 0.00 H new ATOM 0 HB3 HIS A 5 4.969 12.643 -38.474 1.00 0.00 H new ATOM 0 HD2 HIS A 5 7.344 14.151 -37.912 1.00 0.00 H new ATOM 0 HE1 HIS A 5 9.385 12.876 -41.399 1.00 0.00 H new ATOM 0 HE2 HIS A 5 9.394 14.537 -39.472 1.00 0.00 H new ATOM 76 N ASP A 6 5.361 10.713 -35.478 1.00 0.00 N ATOM 77 CA ASP A 6 5.326 11.149 -34.082 1.00 0.00 C ATOM 78 C ASP A 6 6.619 10.785 -33.355 1.00 0.00 C ATOM 79 O ASP A 6 6.711 10.905 -32.136 1.00 0.00 O ATOM 80 CB ASP A 6 4.146 10.484 -33.376 1.00 0.00 C ATOM 81 CG ASP A 6 4.147 8.982 -33.577 1.00 0.00 C ATOM 82 OD1 ASP A 6 3.656 8.527 -34.637 1.00 0.00 O ATOM 83 OD2 ASP A 6 4.664 8.252 -32.704 1.00 0.00 O ATOM 0 H ASP A 6 4.878 9.830 -35.644 1.00 0.00 H new ATOM 0 HA ASP A 6 5.217 12.233 -34.064 1.00 0.00 H new ATOM 0 HB2 ASP A 6 4.186 10.709 -32.310 1.00 0.00 H new ATOM 0 HB3 ASP A 6 3.213 10.901 -33.755 1.00 0.00 H new ATOM 88 N GLU A 7 7.617 10.385 -34.130 1.00 0.00 N ATOM 89 CA GLU A 7 8.878 9.859 -33.608 1.00 0.00 C ATOM 90 C GLU A 7 9.527 10.781 -32.571 1.00 0.00 C ATOM 91 O GLU A 7 10.160 10.313 -31.628 1.00 0.00 O ATOM 92 CB GLU A 7 9.855 9.651 -34.767 1.00 0.00 C ATOM 93 CG GLU A 7 9.288 8.825 -35.910 1.00 0.00 C ATOM 94 CD GLU A 7 9.058 7.377 -35.533 1.00 0.00 C ATOM 95 OE1 GLU A 7 9.869 6.522 -35.942 1.00 0.00 O ATOM 96 OE2 GLU A 7 8.065 7.085 -34.838 1.00 0.00 O ATOM 0 H GLU A 7 7.577 10.415 -35.149 1.00 0.00 H new ATOM 0 HA GLU A 7 8.650 8.917 -33.109 1.00 0.00 H new ATOM 0 HB2 GLU A 7 10.160 10.624 -35.151 1.00 0.00 H new ATOM 0 HB3 GLU A 7 10.753 9.162 -34.389 1.00 0.00 H new ATOM 0 HG2 GLU A 7 8.345 9.264 -36.236 1.00 0.00 H new ATOM 0 HG3 GLU A 7 9.971 8.870 -36.758 1.00 0.00 H new ATOM 103 N ARG A 8 9.363 12.089 -32.740 1.00 0.00 N ATOM 104 CA ARG A 8 10.115 13.051 -31.942 1.00 0.00 C ATOM 105 C ARG A 8 9.292 13.633 -30.793 1.00 0.00 C ATOM 106 O ARG A 8 9.699 14.620 -30.182 1.00 0.00 O ATOM 107 CB ARG A 8 10.623 14.194 -32.828 1.00 0.00 C ATOM 108 CG ARG A 8 11.360 13.732 -34.077 1.00 0.00 C ATOM 109 CD ARG A 8 12.487 12.762 -33.751 1.00 0.00 C ATOM 110 NE ARG A 8 13.520 13.361 -32.909 1.00 0.00 N ATOM 111 CZ ARG A 8 14.803 13.000 -32.944 1.00 0.00 C ATOM 112 NH1 ARG A 8 15.216 12.078 -33.809 1.00 0.00 N ATOM 113 NH2 ARG A 8 15.668 13.571 -32.116 1.00 0.00 N ATOM 0 H ARG A 8 8.722 12.505 -33.416 1.00 0.00 H new ATOM 0 HA ARG A 8 10.955 12.508 -31.508 1.00 0.00 H new ATOM 0 HB2 ARG A 8 9.776 14.812 -33.127 1.00 0.00 H new ATOM 0 HB3 ARG A 8 11.288 14.827 -32.240 1.00 0.00 H new ATOM 0 HG2 ARG A 8 10.655 13.253 -34.757 1.00 0.00 H new ATOM 0 HG3 ARG A 8 11.767 14.598 -34.598 1.00 0.00 H new ATOM 0 HD2 ARG A 8 12.074 11.888 -33.247 1.00 0.00 H new ATOM 0 HD3 ARG A 8 12.939 12.411 -34.679 1.00 0.00 H new ATOM 0 HE ARG A 8 13.244 14.096 -32.258 1.00 0.00 H new ATOM 0 HH11 ARG A 8 14.550 11.644 -34.449 1.00 0.00 H new ATOM 0 HH12 ARG A 8 16.198 11.805 -33.833 1.00 0.00 H new ATOM 0 HH21 ARG A 8 15.350 14.282 -31.457 1.00 0.00 H new ATOM 0 HH22 ARG A 8 16.651 13.299 -32.138 1.00 0.00 H new ATOM 127 N ARG A 9 8.150 13.035 -30.481 1.00 0.00 N ATOM 128 CA ARG A 9 7.307 13.564 -29.415 1.00 0.00 C ATOM 129 C ARG A 9 6.599 12.441 -28.664 1.00 0.00 C ATOM 130 O ARG A 9 6.162 11.464 -29.265 1.00 0.00 O ATOM 131 CB ARG A 9 6.273 14.539 -29.989 1.00 0.00 C ATOM 132 CG ARG A 9 5.600 15.403 -28.932 1.00 0.00 C ATOM 133 CD ARG A 9 6.604 16.327 -28.262 1.00 0.00 C ATOM 134 NE ARG A 9 6.009 17.119 -27.187 1.00 0.00 N ATOM 135 CZ ARG A 9 6.634 18.132 -26.579 1.00 0.00 C ATOM 136 NH1 ARG A 9 7.836 18.522 -26.992 1.00 0.00 N ATOM 137 NH2 ARG A 9 6.046 18.762 -25.573 1.00 0.00 N ATOM 0 H ARG A 9 7.790 12.199 -30.941 1.00 0.00 H new ATOM 0 HA ARG A 9 7.950 14.094 -28.712 1.00 0.00 H new ATOM 0 HB2 ARG A 9 6.761 15.186 -30.718 1.00 0.00 H new ATOM 0 HB3 ARG A 9 5.510 13.974 -30.524 1.00 0.00 H new ATOM 0 HG2 ARG A 9 4.807 15.994 -29.391 1.00 0.00 H new ATOM 0 HG3 ARG A 9 5.130 14.766 -28.182 1.00 0.00 H new ATOM 0 HD2 ARG A 9 7.425 15.734 -27.860 1.00 0.00 H new ATOM 0 HD3 ARG A 9 7.030 16.997 -29.009 1.00 0.00 H new ATOM 0 HE ARG A 9 5.064 16.885 -26.884 1.00 0.00 H new ATOM 0 HH11 ARG A 9 8.285 18.048 -27.776 1.00 0.00 H new ATOM 0 HH12 ARG A 9 8.309 19.296 -26.525 1.00 0.00 H new ATOM 0 HH21 ARG A 9 5.118 18.474 -25.264 1.00 0.00 H new ATOM 0 HH22 ARG A 9 6.521 19.535 -25.108 1.00 0.00 H new ATOM 151 N ARG A 10 6.495 12.585 -27.348 1.00 0.00 N ATOM 152 CA ARG A 10 5.747 11.637 -26.537 1.00 0.00 C ATOM 153 C ARG A 10 4.623 12.360 -25.800 1.00 0.00 C ATOM 154 O ARG A 10 4.699 13.568 -25.575 1.00 0.00 O ATOM 155 CB ARG A 10 6.661 10.917 -25.534 1.00 0.00 C ATOM 156 CG ARG A 10 7.268 11.829 -24.477 1.00 0.00 C ATOM 157 CD ARG A 10 7.924 11.031 -23.357 1.00 0.00 C ATOM 158 NE ARG A 10 9.149 10.350 -23.787 1.00 0.00 N ATOM 159 CZ ARG A 10 9.245 9.031 -23.987 1.00 0.00 C ATOM 160 NH1 ARG A 10 8.173 8.255 -23.872 1.00 0.00 N ATOM 161 NH2 ARG A 10 10.412 8.486 -24.306 1.00 0.00 N ATOM 0 H ARG A 10 6.919 13.349 -26.822 1.00 0.00 H new ATOM 0 HA ARG A 10 5.320 10.884 -27.200 1.00 0.00 H new ATOM 0 HB2 ARG A 10 6.090 10.133 -25.037 1.00 0.00 H new ATOM 0 HB3 ARG A 10 7.466 10.427 -26.081 1.00 0.00 H new ATOM 0 HG2 ARG A 10 8.007 12.482 -24.940 1.00 0.00 H new ATOM 0 HG3 ARG A 10 6.492 12.471 -24.061 1.00 0.00 H new ATOM 0 HD2 ARG A 10 8.157 11.700 -22.529 1.00 0.00 H new ATOM 0 HD3 ARG A 10 7.216 10.293 -22.980 1.00 0.00 H new ATOM 0 HE ARG A 10 9.981 10.918 -23.944 1.00 0.00 H new ATOM 0 HH11 ARG A 10 7.271 8.664 -23.630 1.00 0.00 H new ATOM 0 HH12 ARG A 10 8.252 7.250 -24.026 1.00 0.00 H new ATOM 0 HH21 ARG A 10 11.241 9.073 -24.400 1.00 0.00 H new ATOM 0 HH22 ARG A 10 10.480 7.480 -24.458 1.00 0.00 H new ATOM 175 N PHE A 11 3.583 11.623 -25.435 1.00 0.00 N ATOM 176 CA PHE A 11 2.445 12.204 -24.732 1.00 0.00 C ATOM 177 C PHE A 11 2.535 11.921 -23.238 1.00 0.00 C ATOM 178 O PHE A 11 3.242 11.006 -22.812 1.00 0.00 O ATOM 179 CB PHE A 11 1.131 11.657 -25.293 1.00 0.00 C ATOM 180 CG PHE A 11 0.905 11.995 -26.740 1.00 0.00 C ATOM 181 CD1 PHE A 11 1.116 11.047 -27.730 1.00 0.00 C ATOM 182 CD2 PHE A 11 0.484 13.262 -27.110 1.00 0.00 C ATOM 183 CE1 PHE A 11 0.910 11.359 -29.060 1.00 0.00 C ATOM 184 CE2 PHE A 11 0.278 13.578 -28.440 1.00 0.00 C ATOM 185 CZ PHE A 11 0.491 12.626 -29.416 1.00 0.00 C ATOM 0 H PHE A 11 3.503 10.622 -25.613 1.00 0.00 H new ATOM 0 HA PHE A 11 2.467 13.283 -24.883 1.00 0.00 H new ATOM 0 HB2 PHE A 11 1.119 10.573 -25.176 1.00 0.00 H new ATOM 0 HB3 PHE A 11 0.303 12.050 -24.703 1.00 0.00 H new ATOM 0 HD1 PHE A 11 1.445 10.055 -27.458 1.00 0.00 H new ATOM 0 HD2 PHE A 11 0.315 14.011 -26.351 1.00 0.00 H new ATOM 0 HE1 PHE A 11 1.077 10.612 -29.822 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -0.050 14.570 -28.715 1.00 0.00 H new ATOM 0 HZ PHE A 11 0.330 12.871 -30.456 1.00 0.00 H new ATOM 195 N HIS A 12 1.817 12.704 -22.447 1.00 0.00 N ATOM 196 CA HIS A 12 1.844 12.554 -20.999 1.00 0.00 C ATOM 197 C HIS A 12 0.661 11.730 -20.514 1.00 0.00 C ATOM 198 O HIS A 12 -0.445 12.243 -20.334 1.00 0.00 O ATOM 199 CB HIS A 12 1.867 13.923 -20.306 1.00 0.00 C ATOM 200 CG HIS A 12 3.186 14.626 -20.420 1.00 0.00 C ATOM 201 ND1 HIS A 12 3.693 15.453 -19.441 1.00 0.00 N ATOM 202 CD2 HIS A 12 4.113 14.608 -21.407 1.00 0.00 C ATOM 203 CE1 HIS A 12 4.872 15.910 -19.819 1.00 0.00 C ATOM 204 NE2 HIS A 12 5.149 15.408 -21.007 1.00 0.00 N ATOM 0 H HIS A 12 1.208 13.450 -22.783 1.00 0.00 H new ATOM 0 HA HIS A 12 2.759 12.023 -20.737 1.00 0.00 H new ATOM 0 HB2 HIS A 12 1.089 14.553 -20.737 1.00 0.00 H new ATOM 0 HB3 HIS A 12 1.623 13.792 -19.252 1.00 0.00 H new ATOM 0 HD1 HIS A 12 3.229 15.677 -18.561 1.00 0.00 H new ATOM 0 HD2 HIS A 12 4.047 14.063 -22.337 1.00 0.00 H new ATOM 0 HE1 HIS A 12 5.502 16.580 -19.253 1.00 0.00 H new ATOM 213 N ARG A 13 0.898 10.438 -20.340 1.00 0.00 N ATOM 214 CA ARG A 13 -0.110 9.529 -19.813 1.00 0.00 C ATOM 215 C ARG A 13 0.519 8.710 -18.689 1.00 0.00 C ATOM 216 O ARG A 13 1.734 8.507 -18.684 1.00 0.00 O ATOM 217 CB ARG A 13 -0.637 8.594 -20.910 1.00 0.00 C ATOM 218 CG ARG A 13 -0.884 9.269 -22.256 1.00 0.00 C ATOM 219 CD ARG A 13 -1.655 8.351 -23.191 1.00 0.00 C ATOM 220 NE ARG A 13 -1.521 8.717 -24.606 1.00 0.00 N ATOM 221 CZ ARG A 13 -2.555 8.818 -25.448 1.00 0.00 C ATOM 222 NH1 ARG A 13 -3.796 8.779 -24.985 1.00 0.00 N ATOM 223 NH2 ARG A 13 -2.351 8.982 -26.750 1.00 0.00 N ATOM 0 H ARG A 13 1.789 9.992 -20.559 1.00 0.00 H new ATOM 0 HA ARG A 13 -0.954 10.107 -19.436 1.00 0.00 H new ATOM 0 HB2 ARG A 13 0.077 7.782 -21.051 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -1.569 8.143 -20.568 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -1.442 10.194 -22.107 1.00 0.00 H new ATOM 0 HG3 ARG A 13 0.068 9.541 -22.711 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -1.306 7.328 -23.053 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -2.710 8.368 -22.917 1.00 0.00 H new ATOM 0 HE ARG A 13 -0.586 8.905 -24.968 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -3.964 8.672 -23.985 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -4.583 8.856 -25.629 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -1.400 9.032 -27.115 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -3.146 9.058 -27.385 1.00 0.00 H new ATOM 237 N ILE A 14 -0.286 8.237 -17.749 1.00 0.00 N ATOM 238 CA ILE A 14 0.251 7.523 -16.596 1.00 0.00 C ATOM 239 C ILE A 14 0.325 6.022 -16.856 1.00 0.00 C ATOM 240 O ILE A 14 -0.664 5.303 -16.735 1.00 0.00 O ATOM 241 CB ILE A 14 -0.570 7.793 -15.314 1.00 0.00 C ATOM 242 CG1 ILE A 14 -0.548 9.286 -14.967 1.00 0.00 C ATOM 243 CG2 ILE A 14 -0.032 6.973 -14.149 1.00 0.00 C ATOM 244 CD1 ILE A 14 0.839 9.826 -14.677 1.00 0.00 C ATOM 0 H ILE A 14 -1.302 8.332 -17.759 1.00 0.00 H new ATOM 0 HA ILE A 14 1.261 7.903 -16.440 1.00 0.00 H new ATOM 0 HB ILE A 14 -1.601 7.494 -15.500 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -0.981 9.848 -15.794 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -1.183 9.457 -14.098 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -0.623 7.177 -13.256 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -0.095 5.912 -14.391 1.00 0.00 H new ATOM 0 HG23 ILE A 14 1.008 7.242 -13.965 1.00 0.00 H new ATOM 0 HD11 ILE A 14 0.774 10.888 -14.440 1.00 0.00 H new ATOM 0 HD12 ILE A 14 1.268 9.291 -13.830 1.00 0.00 H new ATOM 0 HD13 ILE A 14 1.474 9.688 -15.552 1.00 0.00 H new ATOM 256 N ALA A 15 1.504 5.563 -17.243 1.00 0.00 N ATOM 257 CA ALA A 15 1.753 4.144 -17.438 1.00 0.00 C ATOM 258 C ALA A 15 3.235 3.850 -17.255 1.00 0.00 C ATOM 259 O ALA A 15 4.072 4.323 -18.022 1.00 0.00 O ATOM 260 CB ALA A 15 1.279 3.694 -18.813 1.00 0.00 C ATOM 0 H ALA A 15 2.310 6.159 -17.430 1.00 0.00 H new ATOM 0 HA ALA A 15 1.189 3.584 -16.692 1.00 0.00 H new ATOM 0 HB1 ALA A 15 1.476 2.629 -18.935 1.00 0.00 H new ATOM 0 HB2 ALA A 15 0.209 3.878 -18.907 1.00 0.00 H new ATOM 0 HB3 ALA A 15 1.812 4.252 -19.582 1.00 0.00 H new ATOM 266 N PHE A 16 3.554 3.091 -16.219 1.00 0.00 N ATOM 267 CA PHE A 16 4.940 2.775 -15.907 1.00 0.00 C ATOM 268 C PHE A 16 5.248 1.337 -16.296 1.00 0.00 C ATOM 269 O PHE A 16 4.359 0.593 -16.708 1.00 0.00 O ATOM 270 CB PHE A 16 5.213 2.962 -14.411 1.00 0.00 C ATOM 271 CG PHE A 16 4.696 4.253 -13.840 1.00 0.00 C ATOM 272 CD1 PHE A 16 3.639 4.244 -12.945 1.00 0.00 C ATOM 273 CD2 PHE A 16 5.264 5.468 -14.188 1.00 0.00 C ATOM 274 CE1 PHE A 16 3.156 5.420 -12.407 1.00 0.00 C ATOM 275 CE2 PHE A 16 4.783 6.651 -13.655 1.00 0.00 C ATOM 276 CZ PHE A 16 3.729 6.626 -12.762 1.00 0.00 C ATOM 0 H PHE A 16 2.873 2.682 -15.580 1.00 0.00 H new ATOM 0 HA PHE A 16 5.579 3.453 -16.473 1.00 0.00 H new ATOM 0 HB2 PHE A 16 4.763 2.132 -13.866 1.00 0.00 H new ATOM 0 HB3 PHE A 16 6.288 2.909 -14.241 1.00 0.00 H new ATOM 0 HD1 PHE A 16 3.187 3.304 -12.664 1.00 0.00 H new ATOM 0 HD2 PHE A 16 6.091 5.492 -14.882 1.00 0.00 H new ATOM 0 HE1 PHE A 16 2.332 5.397 -11.710 1.00 0.00 H new ATOM 0 HE2 PHE A 16 5.231 7.593 -13.937 1.00 0.00 H new ATOM 0 HZ PHE A 16 3.354 7.548 -12.342 1.00 0.00 H new ATOM 286 N ASP A 17 6.502 0.946 -16.138 1.00 0.00 N ATOM 287 CA ASP A 17 6.917 -0.431 -16.379 1.00 0.00 C ATOM 288 C ASP A 17 6.940 -1.187 -15.062 1.00 0.00 C ATOM 289 O ASP A 17 7.711 -2.132 -14.877 1.00 0.00 O ATOM 290 CB ASP A 17 8.299 -0.478 -17.033 1.00 0.00 C ATOM 291 CG ASP A 17 8.277 -0.051 -18.484 1.00 0.00 C ATOM 292 OD1 ASP A 17 8.470 1.153 -18.760 1.00 0.00 O ATOM 293 OD2 ASP A 17 8.080 -0.922 -19.358 1.00 0.00 O ATOM 0 H ASP A 17 7.256 1.565 -15.842 1.00 0.00 H new ATOM 0 HA ASP A 17 6.204 -0.898 -17.059 1.00 0.00 H new ATOM 0 HB2 ASP A 17 8.980 0.168 -16.479 1.00 0.00 H new ATOM 0 HB3 ASP A 17 8.694 -1.491 -16.963 1.00 0.00 H new ATOM 298 N ALA A 18 6.091 -0.753 -14.145 1.00 0.00 N ATOM 299 CA ALA A 18 5.999 -1.359 -12.829 1.00 0.00 C ATOM 300 C ALA A 18 5.217 -2.659 -12.893 1.00 0.00 C ATOM 301 O ALA A 18 4.157 -2.727 -13.520 1.00 0.00 O ATOM 302 CB ALA A 18 5.340 -0.397 -11.849 1.00 0.00 C ATOM 0 H ALA A 18 5.449 0.026 -14.292 1.00 0.00 H new ATOM 0 HA ALA A 18 7.008 -1.579 -12.481 1.00 0.00 H new ATOM 0 HB1 ALA A 18 5.278 -0.865 -10.866 1.00 0.00 H new ATOM 0 HB2 ALA A 18 5.933 0.515 -11.780 1.00 0.00 H new ATOM 0 HB3 ALA A 18 4.337 -0.152 -12.198 1.00 0.00 H new ATOM 308 N ASP A 19 5.743 -3.691 -12.254 1.00 0.00 N ATOM 309 CA ASP A 19 5.051 -4.968 -12.180 1.00 0.00 C ATOM 310 C ASP A 19 3.853 -4.825 -11.251 1.00 0.00 C ATOM 311 O ASP A 19 3.990 -4.346 -10.126 1.00 0.00 O ATOM 312 CB ASP A 19 6.000 -6.063 -11.688 1.00 0.00 C ATOM 313 CG ASP A 19 5.393 -7.448 -11.784 1.00 0.00 C ATOM 314 OD1 ASP A 19 5.406 -8.031 -12.893 1.00 0.00 O ATOM 315 OD2 ASP A 19 4.929 -7.969 -10.754 1.00 0.00 O ATOM 0 H ASP A 19 6.646 -3.670 -11.780 1.00 0.00 H new ATOM 0 HA ASP A 19 4.703 -5.257 -13.172 1.00 0.00 H new ATOM 0 HB2 ASP A 19 6.919 -6.032 -12.273 1.00 0.00 H new ATOM 0 HB3 ASP A 19 6.275 -5.862 -10.653 1.00 0.00 H new ATOM 320 N SER A 20 2.680 -5.199 -11.734 1.00 0.00 N ATOM 321 CA SER A 20 1.448 -4.969 -10.995 1.00 0.00 C ATOM 322 C SER A 20 0.694 -6.271 -10.742 1.00 0.00 C ATOM 323 O SER A 20 0.310 -6.975 -11.679 1.00 0.00 O ATOM 324 CB SER A 20 0.561 -4.003 -11.779 1.00 0.00 C ATOM 325 OG SER A 20 1.288 -2.850 -12.169 1.00 0.00 O ATOM 0 H SER A 20 2.554 -5.663 -12.634 1.00 0.00 H new ATOM 0 HA SER A 20 1.706 -4.540 -10.027 1.00 0.00 H new ATOM 0 HB2 SER A 20 0.164 -4.503 -12.662 1.00 0.00 H new ATOM 0 HB3 SER A 20 -0.293 -3.710 -11.168 1.00 0.00 H new ATOM 0 HG SER A 20 1.577 -2.945 -13.101 1.00 0.00 H new ATOM 331 N GLU A 21 0.484 -6.591 -9.473 1.00 0.00 N ATOM 332 CA GLU A 21 -0.320 -7.746 -9.104 1.00 0.00 C ATOM 333 C GLU A 21 -1.550 -7.311 -8.317 1.00 0.00 C ATOM 334 O GLU A 21 -1.432 -6.688 -7.259 1.00 0.00 O ATOM 335 CB GLU A 21 0.487 -8.747 -8.269 1.00 0.00 C ATOM 336 CG GLU A 21 1.712 -9.304 -8.972 1.00 0.00 C ATOM 337 CD GLU A 21 2.380 -10.414 -8.180 1.00 0.00 C ATOM 338 OE1 GLU A 21 1.988 -11.588 -8.343 1.00 0.00 O ATOM 339 OE2 GLU A 21 3.303 -10.119 -7.388 1.00 0.00 O ATOM 0 H GLU A 21 0.859 -6.067 -8.682 1.00 0.00 H new ATOM 0 HA GLU A 21 -0.631 -8.234 -10.028 1.00 0.00 H new ATOM 0 HB2 GLU A 21 0.802 -8.261 -7.346 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -0.164 -9.575 -7.987 1.00 0.00 H new ATOM 0 HG2 GLU A 21 1.424 -9.684 -9.952 1.00 0.00 H new ATOM 0 HG3 GLU A 21 2.428 -8.500 -9.140 1.00 0.00 H new ATOM 346 N ILE A 22 -2.722 -7.613 -8.858 1.00 0.00 N ATOM 347 CA ILE A 22 -3.976 -7.425 -8.139 1.00 0.00 C ATOM 348 C ILE A 22 -4.460 -8.784 -7.653 1.00 0.00 C ATOM 349 O ILE A 22 -4.661 -9.696 -8.447 1.00 0.00 O ATOM 350 CB ILE A 22 -5.062 -6.735 -9.015 1.00 0.00 C ATOM 351 CG1 ILE A 22 -4.913 -5.206 -8.975 1.00 0.00 C ATOM 352 CG2 ILE A 22 -6.465 -7.128 -8.567 1.00 0.00 C ATOM 353 CD1 ILE A 22 -3.610 -4.686 -9.543 1.00 0.00 C ATOM 0 H ILE A 22 -2.831 -7.992 -9.799 1.00 0.00 H new ATOM 0 HA ILE A 22 -3.798 -6.761 -7.293 1.00 0.00 H new ATOM 0 HB ILE A 22 -4.916 -7.076 -10.040 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -5.739 -4.759 -9.527 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -5.003 -4.872 -7.941 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -7.201 -6.630 -9.198 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -6.585 -8.208 -8.652 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -6.613 -6.827 -7.530 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -3.591 -3.598 -9.474 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -2.775 -5.100 -8.977 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -3.524 -4.985 -10.588 1.00 0.00 H new ATOM 365 N LEU A 23 -4.606 -8.939 -6.350 1.00 0.00 N ATOM 366 CA LEU A 23 -4.848 -10.258 -5.784 1.00 0.00 C ATOM 367 C LEU A 23 -5.890 -10.223 -4.682 1.00 0.00 C ATOM 368 O LEU A 23 -6.296 -9.159 -4.229 1.00 0.00 O ATOM 369 CB LEU A 23 -3.542 -10.834 -5.221 1.00 0.00 C ATOM 370 CG LEU A 23 -2.270 -10.073 -5.603 1.00 0.00 C ATOM 371 CD1 LEU A 23 -1.993 -8.942 -4.622 1.00 0.00 C ATOM 372 CD2 LEU A 23 -1.087 -11.019 -5.683 1.00 0.00 C ATOM 0 H LEU A 23 -4.562 -8.181 -5.669 1.00 0.00 H new ATOM 0 HA LEU A 23 -5.225 -10.890 -6.588 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -3.616 -10.862 -4.134 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -3.444 -11.865 -5.560 1.00 0.00 H new ATOM 0 HG LEU A 23 -2.423 -9.631 -6.587 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -1.084 -8.419 -4.918 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -2.831 -8.244 -4.625 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -1.866 -9.352 -3.620 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -0.192 -10.460 -5.956 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -0.936 -11.496 -4.714 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -1.282 -11.782 -6.436 1.00 0.00 H new ATOM 384 N GLN A 24 -6.321 -11.403 -4.272 1.00 0.00 N ATOM 385 CA GLN A 24 -7.176 -11.549 -3.105 1.00 0.00 C ATOM 386 C GLN A 24 -6.579 -12.612 -2.187 1.00 0.00 C ATOM 387 O GLN A 24 -7.283 -13.458 -1.631 1.00 0.00 O ATOM 388 CB GLN A 24 -8.608 -11.921 -3.513 1.00 0.00 C ATOM 389 CG GLN A 24 -8.727 -13.263 -4.218 1.00 0.00 C ATOM 390 CD GLN A 24 -10.167 -13.699 -4.383 1.00 0.00 C ATOM 391 OE1 GLN A 24 -10.803 -13.421 -5.397 1.00 0.00 O ATOM 392 NE2 GLN A 24 -10.701 -14.370 -3.371 1.00 0.00 N ATOM 0 H GLN A 24 -6.091 -12.282 -4.735 1.00 0.00 H new ATOM 0 HA GLN A 24 -7.228 -10.598 -2.575 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -9.236 -11.935 -2.622 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -9.001 -11.143 -4.168 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -8.254 -13.199 -5.198 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -8.184 -14.019 -3.651 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -10.139 -14.581 -2.546 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -11.673 -14.675 -3.418 1.00 0.00 H new ATOM 401 N GLY A 25 -5.269 -12.532 -2.012 1.00 0.00 N ATOM 402 CA GLY A 25 -4.549 -13.529 -1.247 1.00 0.00 C ATOM 403 C GLY A 25 -4.150 -14.734 -2.081 1.00 0.00 C ATOM 404 O GLY A 25 -3.184 -14.671 -2.842 1.00 0.00 O ATOM 0 H GLY A 25 -4.686 -11.786 -2.391 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -3.654 -13.076 -0.819 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -5.169 -13.859 -0.413 1.00 0.00 H new ATOM 408 N GLU A 26 -4.913 -15.815 -1.972 1.00 0.00 N ATOM 409 CA GLU A 26 -4.561 -17.089 -2.611 1.00 0.00 C ATOM 410 C GLU A 26 -4.945 -17.116 -4.090 1.00 0.00 C ATOM 411 O GLU A 26 -5.016 -18.180 -4.714 1.00 0.00 O ATOM 412 CB GLU A 26 -5.224 -18.256 -1.871 1.00 0.00 C ATOM 413 CG GLU A 26 -4.611 -18.554 -0.508 1.00 0.00 C ATOM 414 CD GLU A 26 -4.661 -17.373 0.438 1.00 0.00 C ATOM 415 OE1 GLU A 26 -3.587 -16.903 0.876 1.00 0.00 O ATOM 416 OE2 GLU A 26 -5.777 -16.900 0.739 1.00 0.00 O ATOM 0 H GLU A 26 -5.786 -15.840 -1.445 1.00 0.00 H new ATOM 0 HA GLU A 26 -3.478 -17.193 -2.553 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -6.284 -18.035 -1.741 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -5.158 -19.150 -2.491 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -5.136 -19.396 -0.057 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -3.574 -18.860 -0.642 1.00 0.00 H new ATOM 423 N ARG A 27 -5.169 -15.940 -4.648 1.00 0.00 N ATOM 424 CA ARG A 27 -5.471 -15.798 -6.061 1.00 0.00 C ATOM 425 C ARG A 27 -4.831 -14.522 -6.587 1.00 0.00 C ATOM 426 O ARG A 27 -5.331 -13.423 -6.346 1.00 0.00 O ATOM 427 CB ARG A 27 -6.985 -15.773 -6.289 1.00 0.00 C ATOM 428 CG ARG A 27 -7.407 -15.543 -7.737 1.00 0.00 C ATOM 429 CD ARG A 27 -6.951 -16.661 -8.666 1.00 0.00 C ATOM 430 NE ARG A 27 -5.615 -16.428 -9.220 1.00 0.00 N ATOM 431 CZ ARG A 27 -4.862 -17.384 -9.767 1.00 0.00 C ATOM 432 NH1 ARG A 27 -5.300 -18.638 -9.807 1.00 0.00 N ATOM 433 NH2 ARG A 27 -3.676 -17.078 -10.286 1.00 0.00 N ATOM 0 H ARG A 27 -5.147 -15.058 -4.136 1.00 0.00 H new ATOM 0 HA ARG A 27 -5.065 -16.653 -6.601 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -7.406 -16.719 -5.948 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -7.419 -14.989 -5.669 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -8.492 -15.456 -7.785 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -6.995 -14.596 -8.085 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -6.954 -17.605 -8.120 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -7.666 -16.763 -9.483 1.00 0.00 H new ATOM 0 HE ARG A 27 -5.239 -15.481 -9.186 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -6.214 -18.872 -9.419 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -4.722 -19.367 -10.226 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -3.344 -16.114 -10.265 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -3.099 -17.808 -10.705 1.00 0.00 H new ATOM 447 N ARG A 28 -3.707 -14.672 -7.266 1.00 0.00 N ATOM 448 CA ARG A 28 -3.005 -13.531 -7.826 1.00 0.00 C ATOM 449 C ARG A 28 -3.438 -13.296 -9.266 1.00 0.00 C ATOM 450 O ARG A 28 -3.606 -14.241 -10.040 1.00 0.00 O ATOM 451 CB ARG A 28 -1.483 -13.744 -7.764 1.00 0.00 C ATOM 452 CG ARG A 28 -0.968 -14.842 -8.685 1.00 0.00 C ATOM 453 CD ARG A 28 0.549 -14.948 -8.646 1.00 0.00 C ATOM 454 NE ARG A 28 1.033 -15.484 -7.375 1.00 0.00 N ATOM 455 CZ ARG A 28 2.200 -15.159 -6.821 1.00 0.00 C ATOM 456 NH1 ARG A 28 3.001 -14.278 -7.409 1.00 0.00 N ATOM 457 NH2 ARG A 28 2.561 -15.728 -5.678 1.00 0.00 N ATOM 0 H ARG A 28 -3.261 -15.572 -7.443 1.00 0.00 H new ATOM 0 HA ARG A 28 -3.258 -12.652 -7.232 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -0.986 -12.808 -8.019 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -1.203 -13.984 -6.738 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -1.406 -15.796 -8.393 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -1.292 -14.641 -9.706 1.00 0.00 H new ATOM 0 HD2 ARG A 28 0.888 -15.588 -9.461 1.00 0.00 H new ATOM 0 HD3 ARG A 28 0.985 -13.963 -8.812 1.00 0.00 H new ATOM 0 HE ARG A 28 0.439 -16.150 -6.881 1.00 0.00 H new ATOM 0 HH11 ARG A 28 2.724 -13.846 -8.290 1.00 0.00 H new ATOM 0 HH12 ARG A 28 3.893 -14.034 -6.979 1.00 0.00 H new ATOM 0 HH21 ARG A 28 1.947 -16.408 -5.231 1.00 0.00 H new ATOM 0 HH22 ARG A 28 3.453 -15.485 -5.247 1.00 0.00 H new ATOM 471 N TRP A 29 -3.664 -12.040 -9.603 1.00 0.00 N ATOM 472 CA TRP A 29 -3.884 -11.646 -10.981 1.00 0.00 C ATOM 473 C TRP A 29 -2.772 -10.710 -11.424 1.00 0.00 C ATOM 474 O TRP A 29 -2.814 -9.506 -11.157 1.00 0.00 O ATOM 475 CB TRP A 29 -5.242 -10.963 -11.168 1.00 0.00 C ATOM 476 CG TRP A 29 -6.413 -11.899 -11.126 1.00 0.00 C ATOM 477 CD1 TRP A 29 -6.799 -12.767 -12.107 1.00 0.00 C ATOM 478 CD2 TRP A 29 -7.363 -12.042 -10.065 1.00 0.00 C ATOM 479 NE1 TRP A 29 -7.928 -13.446 -11.719 1.00 0.00 N ATOM 480 CE2 TRP A 29 -8.295 -13.019 -10.469 1.00 0.00 C ATOM 481 CE3 TRP A 29 -7.518 -11.443 -8.812 1.00 0.00 C ATOM 482 CZ2 TRP A 29 -9.363 -13.406 -9.666 1.00 0.00 C ATOM 483 CZ3 TRP A 29 -8.577 -11.831 -8.014 1.00 0.00 C ATOM 484 CH2 TRP A 29 -9.489 -12.803 -8.444 1.00 0.00 C ATOM 0 H TRP A 29 -3.700 -11.270 -8.935 1.00 0.00 H new ATOM 0 HA TRP A 29 -3.880 -12.548 -11.593 1.00 0.00 H new ATOM 0 HB2 TRP A 29 -5.366 -10.209 -10.391 1.00 0.00 H new ATOM 0 HB3 TRP A 29 -5.244 -10.439 -12.124 1.00 0.00 H new ATOM 0 HD1 TRP A 29 -6.291 -12.900 -13.050 1.00 0.00 H new ATOM 0 HE1 TRP A 29 -8.414 -14.153 -12.271 1.00 0.00 H new ATOM 0 HE3 TRP A 29 -6.822 -10.690 -8.473 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 -10.067 -14.155 -9.995 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 -8.704 -11.377 -7.042 1.00 0.00 H new ATOM 0 HH2 TRP A 29 -10.308 -13.082 -7.798 1.00 0.00 H new ATOM 495 N GLU A 30 -1.754 -11.279 -12.047 1.00 0.00 N ATOM 496 CA GLU A 30 -0.667 -10.495 -12.603 1.00 0.00 C ATOM 497 C GLU A 30 -1.205 -9.676 -13.772 1.00 0.00 C ATOM 498 O GLU A 30 -1.469 -10.211 -14.853 1.00 0.00 O ATOM 499 CB GLU A 30 0.462 -11.422 -13.050 1.00 0.00 C ATOM 500 CG GLU A 30 1.812 -10.741 -13.159 1.00 0.00 C ATOM 501 CD GLU A 30 2.913 -11.711 -13.525 1.00 0.00 C ATOM 502 OE1 GLU A 30 3.235 -12.594 -12.699 1.00 0.00 O ATOM 503 OE2 GLU A 30 3.461 -11.595 -14.639 1.00 0.00 O ATOM 0 H GLU A 30 -1.659 -12.286 -12.180 1.00 0.00 H new ATOM 0 HA GLU A 30 -0.264 -9.816 -11.851 1.00 0.00 H new ATOM 0 HB2 GLU A 30 0.540 -12.249 -12.345 1.00 0.00 H new ATOM 0 HB3 GLU A 30 0.204 -11.852 -14.018 1.00 0.00 H new ATOM 0 HG2 GLU A 30 1.760 -9.953 -13.910 1.00 0.00 H new ATOM 0 HG3 GLU A 30 2.053 -10.262 -12.210 1.00 0.00 H new ATOM 510 N VAL A 31 -1.385 -8.386 -13.541 1.00 0.00 N ATOM 511 CA VAL A 31 -2.134 -7.544 -14.458 1.00 0.00 C ATOM 512 C VAL A 31 -1.258 -6.427 -15.028 1.00 0.00 C ATOM 513 O VAL A 31 -0.161 -6.170 -14.533 1.00 0.00 O ATOM 514 CB VAL A 31 -3.367 -6.948 -13.735 1.00 0.00 C ATOM 515 CG1 VAL A 31 -2.950 -5.887 -12.732 1.00 0.00 C ATOM 516 CG2 VAL A 31 -4.380 -6.396 -14.722 1.00 0.00 C ATOM 0 H VAL A 31 -1.021 -7.898 -12.723 1.00 0.00 H new ATOM 0 HA VAL A 31 -2.470 -8.160 -15.292 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.850 -7.758 -13.189 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -3.835 -5.485 -12.239 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -2.289 -6.330 -11.987 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.426 -5.083 -13.249 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.231 -5.986 -14.179 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -3.917 -5.609 -15.317 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -4.720 -7.196 -15.380 1.00 0.00 H new ATOM 526 N LEU A 32 -1.743 -5.780 -16.078 1.00 0.00 N ATOM 527 CA LEU A 32 -1.022 -4.686 -16.710 1.00 0.00 C ATOM 528 C LEU A 32 -1.511 -3.341 -16.189 1.00 0.00 C ATOM 529 O LEU A 32 -2.712 -3.062 -16.203 1.00 0.00 O ATOM 530 CB LEU A 32 -1.204 -4.743 -18.228 1.00 0.00 C ATOM 531 CG LEU A 32 -0.600 -5.970 -18.910 1.00 0.00 C ATOM 532 CD1 LEU A 32 -0.924 -5.966 -20.395 1.00 0.00 C ATOM 533 CD2 LEU A 32 0.903 -6.007 -18.692 1.00 0.00 C ATOM 0 H LEU A 32 -2.640 -5.997 -16.513 1.00 0.00 H new ATOM 0 HA LEU A 32 0.035 -4.792 -16.466 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -2.270 -4.711 -18.451 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -0.760 -3.849 -18.665 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.036 -6.865 -18.466 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -0.486 -6.847 -20.865 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -2.005 -5.981 -20.532 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -0.513 -5.067 -20.855 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.320 -6.886 -19.183 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.354 -5.108 -19.112 1.00 0.00 H new ATOM 0 HD23 LEU A 32 1.115 -6.053 -17.624 1.00 0.00 H new ATOM 545 N LEU A 33 -0.580 -2.518 -15.724 1.00 0.00 N ATOM 546 CA LEU A 33 -0.902 -1.163 -15.300 1.00 0.00 C ATOM 547 C LEU A 33 -1.334 -0.340 -16.510 1.00 0.00 C ATOM 548 O LEU A 33 -0.758 -0.465 -17.590 1.00 0.00 O ATOM 549 CB LEU A 33 0.308 -0.517 -14.619 1.00 0.00 C ATOM 550 CG LEU A 33 0.087 0.909 -14.104 1.00 0.00 C ATOM 551 CD1 LEU A 33 -0.994 0.934 -13.036 1.00 0.00 C ATOM 552 CD2 LEU A 33 1.386 1.481 -13.562 1.00 0.00 C ATOM 0 H LEU A 33 0.405 -2.766 -15.631 1.00 0.00 H new ATOM 0 HA LEU A 33 -1.721 -1.197 -14.581 1.00 0.00 H new ATOM 0 HB2 LEU A 33 0.611 -1.145 -13.781 1.00 0.00 H new ATOM 0 HB3 LEU A 33 1.138 -0.506 -15.325 1.00 0.00 H new ATOM 0 HG LEU A 33 -0.245 1.528 -14.937 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -1.135 1.956 -12.684 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -1.929 0.563 -13.456 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -0.695 0.301 -12.201 1.00 0.00 H new ATOM 0 HD21 LEU A 33 1.214 2.495 -13.200 1.00 0.00 H new ATOM 0 HD22 LEU A 33 1.744 0.858 -12.742 1.00 0.00 H new ATOM 0 HD23 LEU A 33 2.134 1.501 -14.355 1.00 0.00 H new ATOM 564 N HIS A 34 -2.357 0.481 -16.342 1.00 0.00 N ATOM 565 CA HIS A 34 -2.891 1.248 -17.458 1.00 0.00 C ATOM 566 C HIS A 34 -3.053 2.724 -17.115 1.00 0.00 C ATOM 567 O HIS A 34 -3.010 3.570 -18.011 1.00 0.00 O ATOM 568 CB HIS A 34 -4.214 0.646 -17.928 1.00 0.00 C ATOM 569 CG HIS A 34 -4.038 -0.362 -19.026 1.00 0.00 C ATOM 570 ND1 HIS A 34 -4.222 -0.055 -20.352 1.00 0.00 N ATOM 571 CD2 HIS A 34 -3.662 -1.663 -18.998 1.00 0.00 C ATOM 572 CE1 HIS A 34 -3.963 -1.110 -21.092 1.00 0.00 C ATOM 573 NE2 HIS A 34 -3.623 -2.105 -20.297 1.00 0.00 N ATOM 0 H HIS A 34 -2.832 0.634 -15.452 1.00 0.00 H new ATOM 0 HA HIS A 34 -2.170 1.191 -18.273 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -4.713 0.172 -17.083 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -4.868 1.445 -18.276 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -3.435 -2.245 -18.117 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -4.019 -1.154 -22.170 1.00 0.00 H new ATOM 0 HE2 HIS A 34 -3.372 -3.047 -20.597 1.00 0.00 H new ATOM 582 N ASP A 35 -3.285 3.010 -15.834 1.00 0.00 N ATOM 583 CA ASP A 35 -3.243 4.373 -15.294 1.00 0.00 C ATOM 584 C ASP A 35 -3.528 4.307 -13.791 1.00 0.00 C ATOM 585 O ASP A 35 -3.922 3.250 -13.287 1.00 0.00 O ATOM 586 CB ASP A 35 -4.251 5.300 -15.995 1.00 0.00 C ATOM 587 CG ASP A 35 -3.819 6.759 -15.949 1.00 0.00 C ATOM 588 OD1 ASP A 35 -3.826 7.348 -14.852 1.00 0.00 O ATOM 589 OD2 ASP A 35 -3.472 7.325 -17.009 1.00 0.00 O ATOM 0 H ASP A 35 -3.509 2.300 -15.136 1.00 0.00 H new ATOM 0 HA ASP A 35 -2.254 4.794 -15.473 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -4.366 4.990 -17.033 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -5.227 5.197 -15.521 1.00 0.00 H new ATOM 594 N VAL A 36 -3.340 5.407 -13.074 1.00 0.00 N ATOM 595 CA VAL A 36 -3.505 5.404 -11.623 1.00 0.00 C ATOM 596 C VAL A 36 -3.609 6.829 -11.071 1.00 0.00 C ATOM 597 O VAL A 36 -3.022 7.766 -11.611 1.00 0.00 O ATOM 598 CB VAL A 36 -2.341 4.650 -10.924 1.00 0.00 C ATOM 599 CG1 VAL A 36 -1.013 5.365 -11.130 1.00 0.00 C ATOM 600 CG2 VAL A 36 -2.621 4.457 -9.440 1.00 0.00 C ATOM 0 H VAL A 36 -3.075 6.309 -13.469 1.00 0.00 H new ATOM 0 HA VAL A 36 -4.436 4.880 -11.408 1.00 0.00 H new ATOM 0 HB VAL A 36 -2.269 3.666 -11.387 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -0.220 4.811 -10.628 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -0.794 5.426 -12.196 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -1.073 6.371 -10.714 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -1.788 3.926 -8.979 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -2.740 5.430 -8.963 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -3.535 3.877 -9.315 1.00 0.00 H new ATOM 610 N SER A 37 -4.370 6.983 -9.994 1.00 0.00 N ATOM 611 CA SER A 37 -4.519 8.268 -9.332 1.00 0.00 C ATOM 612 C SER A 37 -4.501 8.077 -7.822 1.00 0.00 C ATOM 613 O SER A 37 -4.269 6.976 -7.327 1.00 0.00 O ATOM 614 CB SER A 37 -5.832 8.945 -9.749 1.00 0.00 C ATOM 615 OG SER A 37 -6.935 8.067 -9.581 1.00 0.00 O ATOM 0 H SER A 37 -4.897 6.225 -9.560 1.00 0.00 H new ATOM 0 HA SER A 37 -3.687 8.906 -9.629 1.00 0.00 H new ATOM 0 HB2 SER A 37 -5.986 9.845 -9.154 1.00 0.00 H new ATOM 0 HB3 SER A 37 -5.768 9.259 -10.791 1.00 0.00 H new ATOM 0 HG SER A 37 -6.629 7.233 -9.167 1.00 0.00 H new ATOM 621 N LEU A 38 -4.771 9.148 -7.096 1.00 0.00 N ATOM 622 CA LEU A 38 -4.866 9.083 -5.642 1.00 0.00 C ATOM 623 C LEU A 38 -6.308 8.778 -5.238 1.00 0.00 C ATOM 624 O LEU A 38 -6.677 8.847 -4.071 1.00 0.00 O ATOM 625 CB LEU A 38 -4.396 10.409 -5.028 1.00 0.00 C ATOM 626 CG LEU A 38 -4.256 10.420 -3.501 1.00 0.00 C ATOM 627 CD1 LEU A 38 -3.250 9.373 -3.048 1.00 0.00 C ATOM 628 CD2 LEU A 38 -3.847 11.802 -3.012 1.00 0.00 C ATOM 0 H LEU A 38 -4.929 10.076 -7.488 1.00 0.00 H new ATOM 0 HA LEU A 38 -4.223 8.286 -5.268 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -3.432 10.669 -5.465 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.098 11.191 -5.316 1.00 0.00 H new ATOM 0 HG LEU A 38 -5.225 10.175 -3.066 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -3.165 9.396 -1.962 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -3.585 8.385 -3.364 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -2.278 9.586 -3.493 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.753 11.791 -1.926 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -2.890 12.077 -3.457 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.605 12.530 -3.303 1.00 0.00 H new ATOM 640 N HIS A 39 -7.123 8.443 -6.232 1.00 0.00 N ATOM 641 CA HIS A 39 -8.540 8.157 -6.012 1.00 0.00 C ATOM 642 C HIS A 39 -8.804 6.696 -6.303 1.00 0.00 C ATOM 643 O HIS A 39 -9.900 6.181 -6.093 1.00 0.00 O ATOM 644 CB HIS A 39 -9.410 9.015 -6.931 1.00 0.00 C ATOM 645 CG HIS A 39 -8.945 10.429 -7.025 1.00 0.00 C ATOM 646 ND1 HIS A 39 -8.918 11.136 -8.198 1.00 0.00 N ATOM 647 CD2 HIS A 39 -8.455 11.248 -6.080 1.00 0.00 C ATOM 648 CE1 HIS A 39 -8.424 12.333 -7.970 1.00 0.00 C ATOM 649 NE2 HIS A 39 -8.136 12.437 -6.689 1.00 0.00 N ATOM 0 H HIS A 39 -6.826 8.362 -7.205 1.00 0.00 H new ATOM 0 HA HIS A 39 -8.788 8.386 -4.976 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -9.419 8.575 -7.928 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -10.437 9.000 -6.567 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -8.334 11.014 -5.033 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -8.278 13.104 -8.712 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -7.744 13.258 -6.229 1.00 0.00 H new ATOM 658 N GLY A 40 -7.770 6.044 -6.782 1.00 0.00 N ATOM 659 CA GLY A 40 -7.884 4.666 -7.196 1.00 0.00 C ATOM 660 C GLY A 40 -6.946 4.336 -8.336 1.00 0.00 C ATOM 661 O GLY A 40 -6.123 5.163 -8.732 1.00 0.00 O ATOM 0 H GLY A 40 -6.840 6.447 -6.894 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -7.668 4.014 -6.349 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -8.911 4.463 -7.501 1.00 0.00 H new ATOM 665 N ILE A 41 -7.093 3.145 -8.886 1.00 0.00 N ATOM 666 CA ILE A 41 -6.171 2.650 -9.900 1.00 0.00 C ATOM 667 C ILE A 41 -6.944 2.026 -11.060 1.00 0.00 C ATOM 668 O ILE A 41 -8.063 1.539 -10.874 1.00 0.00 O ATOM 669 CB ILE A 41 -5.183 1.622 -9.290 1.00 0.00 C ATOM 670 CG1 ILE A 41 -4.144 1.172 -10.324 1.00 0.00 C ATOM 671 CG2 ILE A 41 -5.936 0.421 -8.734 1.00 0.00 C ATOM 672 CD1 ILE A 41 -3.095 0.233 -9.767 1.00 0.00 C ATOM 0 H ILE A 41 -7.844 2.498 -8.648 1.00 0.00 H new ATOM 0 HA ILE A 41 -5.593 3.493 -10.280 1.00 0.00 H new ATOM 0 HB ILE A 41 -4.654 2.110 -8.472 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -4.657 0.680 -11.150 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -3.649 2.052 -10.735 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -5.226 -0.289 -8.310 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -6.626 0.752 -7.957 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -6.496 -0.060 -9.536 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -2.396 -0.041 -10.557 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -2.555 0.728 -8.960 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -3.578 -0.665 -9.382 1.00 0.00 H new ATOM 684 N LEU A 42 -6.356 2.059 -12.251 1.00 0.00 N ATOM 685 CA LEU A 42 -7.004 1.534 -13.440 1.00 0.00 C ATOM 686 C LEU A 42 -6.057 0.594 -14.180 1.00 0.00 C ATOM 687 O LEU A 42 -5.083 1.029 -14.800 1.00 0.00 O ATOM 688 CB LEU A 42 -7.428 2.694 -14.345 1.00 0.00 C ATOM 689 CG LEU A 42 -8.297 2.314 -15.539 1.00 0.00 C ATOM 690 CD1 LEU A 42 -9.643 1.780 -15.074 1.00 0.00 C ATOM 691 CD2 LEU A 42 -8.486 3.509 -16.454 1.00 0.00 C ATOM 0 H LEU A 42 -5.427 2.447 -12.415 1.00 0.00 H new ATOM 0 HA LEU A 42 -7.891 0.969 -13.151 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -7.969 3.423 -13.742 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -6.530 3.190 -14.715 1.00 0.00 H new ATOM 0 HG LEU A 42 -7.792 1.526 -16.097 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -10.248 1.515 -15.941 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -9.490 0.897 -14.454 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -10.157 2.546 -14.493 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -9.108 3.223 -17.302 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -8.971 4.315 -15.904 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -7.515 3.848 -16.815 1.00 0.00 H new ATOM 703 N VAL A 43 -6.327 -0.699 -14.097 1.00 0.00 N ATOM 704 CA VAL A 43 -5.478 -1.696 -14.737 1.00 0.00 C ATOM 705 C VAL A 43 -6.217 -2.394 -15.872 1.00 0.00 C ATOM 706 O VAL A 43 -7.428 -2.240 -16.017 1.00 0.00 O ATOM 707 CB VAL A 43 -4.969 -2.749 -13.730 1.00 0.00 C ATOM 708 CG1 VAL A 43 -4.038 -2.110 -12.711 1.00 0.00 C ATOM 709 CG2 VAL A 43 -6.129 -3.437 -13.032 1.00 0.00 C ATOM 0 H VAL A 43 -7.126 -1.084 -13.594 1.00 0.00 H new ATOM 0 HA VAL A 43 -4.617 -1.164 -15.141 1.00 0.00 H new ATOM 0 HB VAL A 43 -4.410 -3.503 -14.284 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -3.690 -2.869 -12.010 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -3.183 -1.671 -13.225 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -4.573 -1.332 -12.167 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.744 -4.174 -12.328 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.721 -2.696 -12.495 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -6.755 -3.935 -13.772 1.00 0.00 H new ATOM 719 N GLY A 44 -5.481 -3.157 -16.671 1.00 0.00 N ATOM 720 CA GLY A 44 -6.074 -3.824 -17.814 1.00 0.00 C ATOM 721 C GLY A 44 -5.993 -5.334 -17.717 1.00 0.00 C ATOM 722 O GLY A 44 -4.908 -5.914 -17.801 1.00 0.00 O ATOM 0 H GLY A 44 -4.483 -3.326 -16.547 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -7.119 -3.525 -17.902 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -5.571 -3.495 -18.723 1.00 0.00 H new ATOM 726 N GLN A 45 -7.147 -5.958 -17.548 1.00 0.00 N ATOM 727 CA GLN A 45 -7.244 -7.403 -17.411 1.00 0.00 C ATOM 728 C GLN A 45 -7.367 -8.047 -18.790 1.00 0.00 C ATOM 729 O GLN A 45 -8.129 -7.566 -19.630 1.00 0.00 O ATOM 730 CB GLN A 45 -8.470 -7.750 -16.555 1.00 0.00 C ATOM 731 CG GLN A 45 -8.497 -9.181 -16.041 1.00 0.00 C ATOM 732 CD GLN A 45 -7.342 -9.485 -15.107 1.00 0.00 C ATOM 733 OE1 GLN A 45 -6.814 -8.598 -14.444 1.00 0.00 O ATOM 734 NE2 GLN A 45 -6.967 -10.750 -15.023 1.00 0.00 N ATOM 0 H GLN A 45 -8.045 -5.477 -17.502 1.00 0.00 H new ATOM 0 HA GLN A 45 -6.346 -7.785 -16.925 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -8.506 -7.071 -15.703 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -9.370 -7.572 -17.143 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -9.438 -9.359 -15.520 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -8.466 -9.868 -16.887 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -7.431 -11.458 -15.591 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -6.213 -11.018 -14.390 1.00 0.00 H new ATOM 743 N PRO A 46 -6.598 -9.117 -19.055 1.00 0.00 N ATOM 744 CA PRO A 46 -6.668 -9.841 -20.330 1.00 0.00 C ATOM 745 C PRO A 46 -8.078 -10.356 -20.627 1.00 0.00 C ATOM 746 O PRO A 46 -8.766 -9.833 -21.504 1.00 0.00 O ATOM 747 CB PRO A 46 -5.695 -11.010 -20.139 1.00 0.00 C ATOM 748 CG PRO A 46 -4.770 -10.566 -19.057 1.00 0.00 C ATOM 749 CD PRO A 46 -5.589 -9.694 -18.149 1.00 0.00 C ATOM 0 HA PRO A 46 -6.415 -9.200 -21.175 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -6.223 -11.922 -19.858 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -5.152 -11.226 -21.059 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -4.363 -11.420 -18.516 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -3.923 -10.016 -19.468 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -6.051 -10.270 -17.347 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -4.982 -8.921 -17.678 1.00 0.00 H new ATOM 757 N GLN A 47 -8.513 -11.369 -19.888 1.00 0.00 N ATOM 758 CA GLN A 47 -9.852 -11.916 -20.069 1.00 0.00 C ATOM 759 C GLN A 47 -10.374 -12.507 -18.765 1.00 0.00 C ATOM 760 O GLN A 47 -11.462 -12.158 -18.307 1.00 0.00 O ATOM 761 CB GLN A 47 -9.848 -12.987 -21.165 1.00 0.00 C ATOM 762 CG GLN A 47 -11.220 -13.588 -21.434 1.00 0.00 C ATOM 763 CD GLN A 47 -11.180 -14.697 -22.467 1.00 0.00 C ATOM 764 OE1 GLN A 47 -10.177 -15.397 -22.609 1.00 0.00 O ATOM 765 NE2 GLN A 47 -12.275 -14.877 -23.186 1.00 0.00 N ATOM 0 H GLN A 47 -7.962 -11.826 -19.162 1.00 0.00 H new ATOM 0 HA GLN A 47 -10.513 -11.104 -20.371 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -9.465 -12.550 -22.087 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -9.161 -13.784 -20.880 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -11.630 -13.979 -20.503 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -11.895 -12.803 -21.775 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -13.086 -14.276 -23.039 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -12.309 -15.617 -23.888 1.00 0.00 H new ATOM 774 N ASP A 48 -9.583 -13.397 -18.175 1.00 0.00 N ATOM 775 CA ASP A 48 -9.968 -14.087 -16.944 1.00 0.00 C ATOM 776 C ASP A 48 -10.121 -13.106 -15.793 1.00 0.00 C ATOM 777 O ASP A 48 -9.151 -12.476 -15.371 1.00 0.00 O ATOM 778 CB ASP A 48 -8.931 -15.151 -16.573 1.00 0.00 C ATOM 779 CG ASP A 48 -8.873 -16.288 -17.570 1.00 0.00 C ATOM 780 OD1 ASP A 48 -8.148 -16.164 -18.581 1.00 0.00 O ATOM 781 OD2 ASP A 48 -9.543 -17.317 -17.342 1.00 0.00 O ATOM 0 H ASP A 48 -8.664 -13.660 -18.531 1.00 0.00 H new ATOM 0 HA ASP A 48 -10.928 -14.570 -17.125 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -7.948 -14.685 -16.503 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -9.165 -15.551 -15.586 1.00 0.00 H new ATOM 786 N TRP A 49 -11.342 -12.981 -15.294 1.00 0.00 N ATOM 787 CA TRP A 49 -11.642 -12.080 -14.195 1.00 0.00 C ATOM 788 C TRP A 49 -12.942 -12.506 -13.522 1.00 0.00 C ATOM 789 O TRP A 49 -13.823 -13.070 -14.170 1.00 0.00 O ATOM 790 CB TRP A 49 -11.750 -10.640 -14.712 1.00 0.00 C ATOM 791 CG TRP A 49 -11.940 -9.617 -13.632 1.00 0.00 C ATOM 792 CD1 TRP A 49 -13.049 -8.852 -13.412 1.00 0.00 C ATOM 793 CD2 TRP A 49 -10.991 -9.249 -12.623 1.00 0.00 C ATOM 794 NE1 TRP A 49 -12.849 -8.032 -12.328 1.00 0.00 N ATOM 795 CE2 TRP A 49 -11.592 -8.255 -11.828 1.00 0.00 C ATOM 796 CE3 TRP A 49 -9.691 -9.661 -12.315 1.00 0.00 C ATOM 797 CZ2 TRP A 49 -10.941 -7.672 -10.745 1.00 0.00 C ATOM 798 CZ3 TRP A 49 -9.044 -9.078 -11.241 1.00 0.00 C ATOM 799 CH2 TRP A 49 -9.669 -8.093 -10.468 1.00 0.00 C ATOM 0 H TRP A 49 -12.149 -13.500 -15.639 1.00 0.00 H new ATOM 0 HA TRP A 49 -10.837 -12.124 -13.462 1.00 0.00 H new ATOM 0 HB2 TRP A 49 -10.848 -10.398 -15.273 1.00 0.00 H new ATOM 0 HB3 TRP A 49 -12.585 -10.577 -15.409 1.00 0.00 H new ATOM 0 HD1 TRP A 49 -13.952 -8.886 -14.004 1.00 0.00 H new ATOM 0 HE1 TRP A 49 -13.526 -7.366 -11.956 1.00 0.00 H new ATOM 0 HE3 TRP A 49 -9.201 -10.421 -12.905 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 -11.423 -6.914 -10.145 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 -8.039 -9.388 -10.995 1.00 0.00 H new ATOM 0 HH2 TRP A 49 -9.137 -7.656 -9.636 1.00 0.00 H new ATOM 810 N ASN A 50 -13.048 -12.253 -12.223 1.00 0.00 N ATOM 811 CA ASN A 50 -14.247 -12.603 -11.468 1.00 0.00 C ATOM 812 C ASN A 50 -15.391 -11.629 -11.777 1.00 0.00 C ATOM 813 O ASN A 50 -16.374 -12.011 -12.412 1.00 0.00 O ATOM 814 CB ASN A 50 -13.922 -12.674 -9.966 1.00 0.00 C ATOM 815 CG ASN A 50 -15.093 -12.313 -9.076 1.00 0.00 C ATOM 816 OD1 ASN A 50 -15.180 -11.184 -8.602 1.00 0.00 O ATOM 817 ND2 ASN A 50 -16.000 -13.248 -8.855 1.00 0.00 N ATOM 0 H ASN A 50 -12.317 -11.806 -11.669 1.00 0.00 H new ATOM 0 HA ASN A 50 -14.589 -13.591 -11.775 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -13.588 -13.682 -9.722 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -13.091 -12.002 -9.750 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -16.811 -13.044 -8.271 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -15.889 -14.174 -9.268 1.00 0.00 H new ATOM 824 N GLY A 51 -15.270 -10.376 -11.342 1.00 0.00 N ATOM 825 CA GLY A 51 -16.227 -9.367 -11.760 1.00 0.00 C ATOM 826 C GLY A 51 -17.140 -8.874 -10.649 1.00 0.00 C ATOM 827 O GLY A 51 -18.084 -8.132 -10.917 1.00 0.00 O ATOM 0 H GLY A 51 -14.536 -10.045 -10.716 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -15.684 -8.517 -12.173 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -16.840 -9.775 -12.564 1.00 0.00 H new ATOM 831 N ASP A 52 -16.869 -9.275 -9.412 1.00 0.00 N ATOM 832 CA ASP A 52 -17.642 -8.809 -8.269 1.00 0.00 C ATOM 833 C ASP A 52 -17.013 -7.569 -7.665 1.00 0.00 C ATOM 834 O ASP A 52 -15.941 -7.635 -7.064 1.00 0.00 O ATOM 835 CB ASP A 52 -17.741 -9.878 -7.175 1.00 0.00 C ATOM 836 CG ASP A 52 -18.707 -10.994 -7.497 1.00 0.00 C ATOM 837 OD1 ASP A 52 -18.246 -12.112 -7.810 1.00 0.00 O ATOM 838 OD2 ASP A 52 -19.928 -10.762 -7.417 1.00 0.00 O ATOM 0 H ASP A 52 -16.118 -9.923 -9.176 1.00 0.00 H new ATOM 0 HA ASP A 52 -18.642 -8.583 -8.640 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -16.752 -10.304 -7.006 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -18.047 -9.403 -6.243 1.00 0.00 H new ATOM 843 N PRO A 53 -17.671 -6.418 -7.814 1.00 0.00 N ATOM 844 CA PRO A 53 -17.271 -5.178 -7.140 1.00 0.00 C ATOM 845 C PRO A 53 -17.376 -5.308 -5.620 1.00 0.00 C ATOM 846 O PRO A 53 -16.899 -4.456 -4.872 1.00 0.00 O ATOM 847 CB PRO A 53 -18.276 -4.137 -7.652 1.00 0.00 C ATOM 848 CG PRO A 53 -18.895 -4.739 -8.868 1.00 0.00 C ATOM 849 CD PRO A 53 -18.843 -6.227 -8.675 1.00 0.00 C ATOM 0 HA PRO A 53 -16.234 -4.916 -7.349 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -19.030 -3.916 -6.897 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -17.779 -3.197 -7.890 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -19.923 -4.399 -8.990 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -18.353 -4.444 -9.767 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -19.752 -6.603 -8.205 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -18.734 -6.752 -9.624 1.00 0.00 H new ATOM 857 N GLN A 54 -18.008 -6.385 -5.172 1.00 0.00 N ATOM 858 CA GLN A 54 -18.179 -6.639 -3.749 1.00 0.00 C ATOM 859 C GLN A 54 -16.950 -7.331 -3.174 1.00 0.00 C ATOM 860 O GLN A 54 -16.784 -7.413 -1.959 1.00 0.00 O ATOM 861 CB GLN A 54 -19.431 -7.484 -3.486 1.00 0.00 C ATOM 862 CG GLN A 54 -20.738 -6.763 -3.788 1.00 0.00 C ATOM 863 CD GLN A 54 -21.041 -6.658 -5.274 1.00 0.00 C ATOM 864 OE1 GLN A 54 -21.622 -5.675 -5.731 1.00 0.00 O ATOM 865 NE2 GLN A 54 -20.685 -7.685 -6.034 1.00 0.00 N ATOM 0 H GLN A 54 -18.412 -7.099 -5.778 1.00 0.00 H new ATOM 0 HA GLN A 54 -18.304 -5.677 -3.253 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -19.379 -8.390 -4.090 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -19.433 -7.797 -2.442 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -21.556 -7.288 -3.294 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -20.698 -5.761 -3.361 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -20.204 -8.484 -5.620 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -20.892 -7.676 -7.033 1.00 0.00 H new ATOM 874 N ARG A 55 -16.086 -7.821 -4.050 1.00 0.00 N ATOM 875 CA ARG A 55 -14.879 -8.512 -3.623 1.00 0.00 C ATOM 876 C ARG A 55 -13.703 -7.545 -3.582 1.00 0.00 C ATOM 877 O ARG A 55 -13.442 -6.835 -4.552 1.00 0.00 O ATOM 878 CB ARG A 55 -14.588 -9.699 -4.550 1.00 0.00 C ATOM 879 CG ARG A 55 -15.617 -10.812 -4.421 1.00 0.00 C ATOM 880 CD ARG A 55 -15.499 -11.852 -5.524 1.00 0.00 C ATOM 881 NE ARG A 55 -14.296 -12.676 -5.420 1.00 0.00 N ATOM 882 CZ ARG A 55 -14.310 -14.008 -5.500 1.00 0.00 C ATOM 883 NH1 ARG A 55 -15.463 -14.654 -5.630 1.00 0.00 N ATOM 884 NH2 ARG A 55 -13.174 -14.694 -5.462 1.00 0.00 N ATOM 0 H ARG A 55 -16.198 -7.753 -5.061 1.00 0.00 H new ATOM 0 HA ARG A 55 -15.032 -8.900 -2.616 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -14.563 -9.351 -5.583 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -13.599 -10.097 -4.324 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -15.499 -11.300 -3.453 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -16.618 -10.380 -4.440 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -16.376 -12.498 -5.499 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -15.502 -11.348 -6.490 1.00 0.00 H new ATOM 0 HE ARG A 55 -13.400 -12.209 -5.279 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -16.338 -14.132 -5.669 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -15.473 -15.672 -5.691 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -12.285 -14.203 -5.371 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -13.191 -15.712 -5.524 1.00 0.00 H new ATOM 898 N PRO A 56 -13.006 -7.477 -2.437 1.00 0.00 N ATOM 899 CA PRO A 56 -11.847 -6.599 -2.269 1.00 0.00 C ATOM 900 C PRO A 56 -10.624 -7.116 -3.019 1.00 0.00 C ATOM 901 O PRO A 56 -10.460 -8.325 -3.204 1.00 0.00 O ATOM 902 CB PRO A 56 -11.605 -6.617 -0.759 1.00 0.00 C ATOM 903 CG PRO A 56 -12.137 -7.934 -0.309 1.00 0.00 C ATOM 904 CD PRO A 56 -13.295 -8.250 -1.216 1.00 0.00 C ATOM 0 HA PRO A 56 -12.024 -5.601 -2.669 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -10.545 -6.517 -0.526 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -12.119 -5.792 -0.265 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -11.370 -8.706 -0.373 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -12.458 -7.889 0.732 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -13.360 -9.318 -1.425 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -14.245 -7.954 -0.770 1.00 0.00 H new ATOM 912 N PHE A 57 -9.768 -6.200 -3.444 1.00 0.00 N ATOM 913 CA PHE A 57 -8.594 -6.554 -4.222 1.00 0.00 C ATOM 914 C PHE A 57 -7.372 -5.793 -3.710 1.00 0.00 C ATOM 915 O PHE A 57 -7.490 -4.677 -3.208 1.00 0.00 O ATOM 916 CB PHE A 57 -8.848 -6.268 -5.711 1.00 0.00 C ATOM 917 CG PHE A 57 -9.909 -7.156 -6.320 1.00 0.00 C ATOM 918 CD1 PHE A 57 -9.689 -8.520 -6.435 1.00 0.00 C ATOM 919 CD2 PHE A 57 -11.122 -6.639 -6.773 1.00 0.00 C ATOM 920 CE1 PHE A 57 -10.650 -9.351 -6.980 1.00 0.00 C ATOM 921 CE2 PHE A 57 -12.081 -7.470 -7.322 1.00 0.00 C ATOM 922 CZ PHE A 57 -11.845 -8.825 -7.426 1.00 0.00 C ATOM 0 H PHE A 57 -9.866 -5.201 -3.261 1.00 0.00 H new ATOM 0 HA PHE A 57 -8.394 -7.620 -4.110 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -9.146 -5.226 -5.828 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -7.917 -6.397 -6.262 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -8.754 -8.939 -6.094 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -11.314 -5.579 -6.694 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -10.465 -10.412 -7.057 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -13.016 -7.057 -7.670 1.00 0.00 H new ATOM 0 HZ PHE A 57 -12.594 -9.473 -7.856 1.00 0.00 H new ATOM 932 N GLU A 58 -6.204 -6.403 -3.805 1.00 0.00 N ATOM 933 CA GLU A 58 -4.980 -5.775 -3.337 1.00 0.00 C ATOM 934 C GLU A 58 -4.073 -5.470 -4.515 1.00 0.00 C ATOM 935 O GLU A 58 -3.884 -6.313 -5.386 1.00 0.00 O ATOM 936 CB GLU A 58 -4.252 -6.686 -2.347 1.00 0.00 C ATOM 937 CG GLU A 58 -5.128 -7.177 -1.208 1.00 0.00 C ATOM 938 CD GLU A 58 -4.355 -7.988 -0.192 1.00 0.00 C ATOM 939 OE1 GLU A 58 -4.181 -7.508 0.946 1.00 0.00 O ATOM 940 OE2 GLU A 58 -3.913 -9.108 -0.519 1.00 0.00 O ATOM 0 H GLU A 58 -6.077 -7.334 -4.202 1.00 0.00 H new ATOM 0 HA GLU A 58 -5.240 -4.846 -2.830 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -3.855 -7.547 -2.884 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -3.400 -6.148 -1.932 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -5.587 -6.322 -0.712 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -5.938 -7.784 -1.612 1.00 0.00 H new ATOM 947 N ALA A 59 -3.527 -4.266 -4.548 1.00 0.00 N ATOM 948 CA ALA A 59 -2.634 -3.872 -5.624 1.00 0.00 C ATOM 949 C ALA A 59 -1.213 -3.689 -5.111 1.00 0.00 C ATOM 950 O ALA A 59 -0.962 -2.870 -4.224 1.00 0.00 O ATOM 951 CB ALA A 59 -3.127 -2.594 -6.284 1.00 0.00 C ATOM 0 H ALA A 59 -3.686 -3.546 -3.843 1.00 0.00 H new ATOM 0 HA ALA A 59 -2.628 -4.669 -6.368 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -2.446 -2.314 -7.088 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -4.124 -2.757 -6.693 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -3.165 -1.794 -5.545 1.00 0.00 H new ATOM 957 N ARG A 60 -0.294 -4.473 -5.652 1.00 0.00 N ATOM 958 CA ARG A 60 1.118 -4.327 -5.334 1.00 0.00 C ATOM 959 C ARG A 60 1.893 -3.886 -6.569 1.00 0.00 C ATOM 960 O ARG A 60 1.990 -4.627 -7.548 1.00 0.00 O ATOM 961 CB ARG A 60 1.693 -5.636 -4.781 1.00 0.00 C ATOM 962 CG ARG A 60 1.323 -5.905 -3.330 1.00 0.00 C ATOM 963 CD ARG A 60 2.030 -7.142 -2.798 1.00 0.00 C ATOM 964 NE ARG A 60 1.130 -8.286 -2.652 1.00 0.00 N ATOM 965 CZ ARG A 60 1.362 -9.491 -3.174 1.00 0.00 C ATOM 966 NH1 ARG A 60 2.405 -9.696 -3.964 1.00 0.00 N ATOM 967 NH2 ARG A 60 0.534 -10.493 -2.921 1.00 0.00 N ATOM 0 H ARG A 60 -0.501 -5.219 -6.316 1.00 0.00 H new ATOM 0 HA ARG A 60 1.218 -3.562 -4.564 1.00 0.00 H new ATOM 0 HB2 ARG A 60 1.341 -6.465 -5.395 1.00 0.00 H new ATOM 0 HB3 ARG A 60 2.779 -5.611 -4.871 1.00 0.00 H new ATOM 0 HG2 ARG A 60 1.588 -5.042 -2.719 1.00 0.00 H new ATOM 0 HG3 ARG A 60 0.244 -6.036 -3.246 1.00 0.00 H new ATOM 0 HD2 ARG A 60 2.844 -7.409 -3.472 1.00 0.00 H new ATOM 0 HD3 ARG A 60 2.479 -6.912 -1.832 1.00 0.00 H new ATOM 0 HE ARG A 60 0.271 -8.154 -2.118 1.00 0.00 H new ATOM 0 HH11 ARG A 60 3.041 -8.928 -4.179 1.00 0.00 H new ATOM 0 HH12 ARG A 60 2.572 -10.622 -4.358 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -0.281 -10.343 -2.327 1.00 0.00 H new ATOM 0 HH22 ARG A 60 0.712 -11.415 -3.320 1.00 0.00 H new ATOM 981 N LEU A 61 2.412 -2.667 -6.525 1.00 0.00 N ATOM 982 CA LEU A 61 3.195 -2.122 -7.626 1.00 0.00 C ATOM 983 C LEU A 61 4.682 -2.217 -7.309 1.00 0.00 C ATOM 984 O LEU A 61 5.168 -1.588 -6.367 1.00 0.00 O ATOM 985 CB LEU A 61 2.809 -0.662 -7.883 1.00 0.00 C ATOM 986 CG LEU A 61 1.317 -0.407 -8.111 1.00 0.00 C ATOM 987 CD1 LEU A 61 1.059 1.076 -8.317 1.00 0.00 C ATOM 988 CD2 LEU A 61 0.808 -1.204 -9.301 1.00 0.00 C ATOM 0 H LEU A 61 2.304 -2.033 -5.733 1.00 0.00 H new ATOM 0 HA LEU A 61 2.985 -2.704 -8.523 1.00 0.00 H new ATOM 0 HB2 LEU A 61 3.137 -0.062 -7.034 1.00 0.00 H new ATOM 0 HB3 LEU A 61 3.358 -0.307 -8.755 1.00 0.00 H new ATOM 0 HG LEU A 61 0.775 -0.736 -7.224 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -0.006 1.241 -8.478 1.00 0.00 H new ATOM 0 HD12 LEU A 61 1.382 1.628 -7.434 1.00 0.00 H new ATOM 0 HD13 LEU A 61 1.616 1.425 -9.187 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -0.254 -1.007 -9.443 1.00 0.00 H new ATOM 0 HD22 LEU A 61 1.355 -0.910 -10.197 1.00 0.00 H new ATOM 0 HD23 LEU A 61 0.958 -2.268 -9.117 1.00 0.00 H new ATOM 1000 N TYR A 62 5.399 -3.009 -8.086 1.00 0.00 N ATOM 1001 CA TYR A 62 6.822 -3.222 -7.859 1.00 0.00 C ATOM 1002 C TYR A 62 7.657 -2.209 -8.630 1.00 0.00 C ATOM 1003 O TYR A 62 7.664 -2.205 -9.862 1.00 0.00 O ATOM 1004 CB TYR A 62 7.225 -4.641 -8.269 1.00 0.00 C ATOM 1005 CG TYR A 62 6.494 -5.725 -7.511 1.00 0.00 C ATOM 1006 CD1 TYR A 62 7.093 -6.382 -6.445 1.00 0.00 C ATOM 1007 CD2 TYR A 62 5.203 -6.090 -7.863 1.00 0.00 C ATOM 1008 CE1 TYR A 62 6.423 -7.371 -5.752 1.00 0.00 C ATOM 1009 CE2 TYR A 62 4.526 -7.074 -7.177 1.00 0.00 C ATOM 1010 CZ TYR A 62 5.139 -7.713 -6.124 1.00 0.00 C ATOM 1011 OH TYR A 62 4.463 -8.695 -5.445 1.00 0.00 O ATOM 0 H TYR A 62 5.019 -3.519 -8.884 1.00 0.00 H new ATOM 0 HA TYR A 62 7.011 -3.090 -6.794 1.00 0.00 H new ATOM 0 HB2 TYR A 62 7.039 -4.768 -9.336 1.00 0.00 H new ATOM 0 HB3 TYR A 62 8.297 -4.763 -8.116 1.00 0.00 H new ATOM 0 HD1 TYR A 62 8.098 -6.116 -6.153 1.00 0.00 H new ATOM 0 HD2 TYR A 62 4.719 -5.593 -8.691 1.00 0.00 H new ATOM 0 HE1 TYR A 62 6.901 -7.874 -4.924 1.00 0.00 H new ATOM 0 HE2 TYR A 62 3.520 -7.342 -7.464 1.00 0.00 H new ATOM 0 HH TYR A 62 4.160 -9.381 -6.077 1.00 0.00 H new ATOM 1021 N LEU A 63 8.350 -1.346 -7.898 1.00 0.00 N ATOM 1022 CA LEU A 63 9.259 -0.378 -8.506 1.00 0.00 C ATOM 1023 C LEU A 63 10.694 -0.707 -8.119 1.00 0.00 C ATOM 1024 O LEU A 63 11.634 -0.005 -8.491 1.00 0.00 O ATOM 1025 CB LEU A 63 8.917 1.056 -8.074 1.00 0.00 C ATOM 1026 CG LEU A 63 7.758 1.730 -8.824 1.00 0.00 C ATOM 1027 CD1 LEU A 63 8.023 1.736 -10.322 1.00 0.00 C ATOM 1028 CD2 LEU A 63 6.431 1.053 -8.516 1.00 0.00 C ATOM 0 H LEU A 63 8.301 -1.295 -6.880 1.00 0.00 H new ATOM 0 HA LEU A 63 9.148 -0.440 -9.589 1.00 0.00 H new ATOM 0 HB2 LEU A 63 8.678 1.046 -7.011 1.00 0.00 H new ATOM 0 HB3 LEU A 63 9.808 1.672 -8.194 1.00 0.00 H new ATOM 0 HG LEU A 63 7.692 2.762 -8.479 1.00 0.00 H new ATOM 0 HD11 LEU A 63 7.191 2.217 -10.837 1.00 0.00 H new ATOM 0 HD12 LEU A 63 8.943 2.284 -10.527 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.125 0.711 -10.678 1.00 0.00 H new ATOM 0 HD21 LEU A 63 5.632 1.554 -9.062 1.00 0.00 H new ATOM 0 HD22 LEU A 63 6.477 0.007 -8.819 1.00 0.00 H new ATOM 0 HD23 LEU A 63 6.232 1.113 -7.446 1.00 0.00 H new ATOM 1040 N GLY A 64 10.843 -1.784 -7.364 1.00 0.00 N ATOM 1041 CA GLY A 64 12.145 -2.224 -6.919 1.00 0.00 C ATOM 1042 C GLY A 64 12.024 -3.428 -6.016 1.00 0.00 C ATOM 1043 O GLY A 64 10.960 -4.046 -5.955 1.00 0.00 O ATOM 0 H GLY A 64 10.070 -2.369 -7.048 1.00 0.00 H new ATOM 0 HA2 GLY A 64 12.765 -2.471 -7.781 1.00 0.00 H new ATOM 0 HA3 GLY A 64 12.646 -1.414 -6.388 1.00 0.00 H new ATOM 1047 N LEU A 65 13.092 -3.764 -5.310 1.00 0.00 N ATOM 1048 CA LEU A 65 13.056 -4.887 -4.382 1.00 0.00 C ATOM 1049 C LEU A 65 12.473 -4.447 -3.048 1.00 0.00 C ATOM 1050 O LEU A 65 11.706 -5.178 -2.420 1.00 0.00 O ATOM 1051 CB LEU A 65 14.453 -5.478 -4.181 1.00 0.00 C ATOM 1052 CG LEU A 65 15.085 -6.095 -5.431 1.00 0.00 C ATOM 1053 CD1 LEU A 65 16.432 -6.711 -5.094 1.00 0.00 C ATOM 1054 CD2 LEU A 65 14.160 -7.138 -6.042 1.00 0.00 C ATOM 0 H LEU A 65 13.989 -3.281 -5.360 1.00 0.00 H new ATOM 0 HA LEU A 65 12.419 -5.661 -4.809 1.00 0.00 H new ATOM 0 HB2 LEU A 65 15.112 -4.693 -3.810 1.00 0.00 H new ATOM 0 HB3 LEU A 65 14.399 -6.242 -3.406 1.00 0.00 H new ATOM 0 HG LEU A 65 15.239 -5.303 -6.164 1.00 0.00 H new ATOM 0 HD11 LEU A 65 16.869 -7.146 -5.993 1.00 0.00 H new ATOM 0 HD12 LEU A 65 17.097 -5.941 -4.704 1.00 0.00 H new ATOM 0 HD13 LEU A 65 16.298 -7.490 -4.343 1.00 0.00 H new ATOM 0 HD21 LEU A 65 14.628 -7.564 -6.929 1.00 0.00 H new ATOM 0 HD22 LEU A 65 13.973 -7.929 -5.315 1.00 0.00 H new ATOM 0 HD23 LEU A 65 13.216 -6.669 -6.320 1.00 0.00 H new ATOM 1066 N ASP A 66 12.842 -3.248 -2.620 1.00 0.00 N ATOM 1067 CA ASP A 66 12.301 -2.680 -1.390 1.00 0.00 C ATOM 1068 C ASP A 66 11.144 -1.746 -1.708 1.00 0.00 C ATOM 1069 O ASP A 66 10.217 -1.589 -0.911 1.00 0.00 O ATOM 1070 CB ASP A 66 13.385 -1.919 -0.618 1.00 0.00 C ATOM 1071 CG ASP A 66 12.877 -1.362 0.701 1.00 0.00 C ATOM 1072 OD1 ASP A 66 12.385 -0.214 0.725 1.00 0.00 O ATOM 1073 OD2 ASP A 66 12.967 -2.074 1.724 1.00 0.00 O ATOM 0 H ASP A 66 13.512 -2.650 -3.104 1.00 0.00 H new ATOM 0 HA ASP A 66 11.941 -3.499 -0.767 1.00 0.00 H new ATOM 0 HB2 ASP A 66 14.226 -2.585 -0.427 1.00 0.00 H new ATOM 0 HB3 ASP A 66 13.759 -1.101 -1.234 1.00 0.00 H new ATOM 1078 N VAL A 67 11.196 -1.141 -2.888 1.00 0.00 N ATOM 1079 CA VAL A 67 10.194 -0.166 -3.286 1.00 0.00 C ATOM 1080 C VAL A 67 8.935 -0.864 -3.786 1.00 0.00 C ATOM 1081 O VAL A 67 8.810 -1.187 -4.970 1.00 0.00 O ATOM 1082 CB VAL A 67 10.722 0.788 -4.378 1.00 0.00 C ATOM 1083 CG1 VAL A 67 9.736 1.921 -4.627 1.00 0.00 C ATOM 1084 CG2 VAL A 67 12.087 1.337 -3.994 1.00 0.00 C ATOM 0 H VAL A 67 11.922 -1.310 -3.584 1.00 0.00 H new ATOM 0 HA VAL A 67 9.956 0.426 -2.402 1.00 0.00 H new ATOM 0 HB VAL A 67 10.829 0.222 -5.303 1.00 0.00 H new ATOM 0 HG11 VAL A 67 10.128 2.581 -5.400 1.00 0.00 H new ATOM 0 HG12 VAL A 67 8.781 1.508 -4.953 1.00 0.00 H new ATOM 0 HG13 VAL A 67 9.591 2.486 -3.706 1.00 0.00 H new ATOM 0 HG21 VAL A 67 12.443 2.008 -4.776 1.00 0.00 H new ATOM 0 HG22 VAL A 67 12.008 1.885 -3.055 1.00 0.00 H new ATOM 0 HG23 VAL A 67 12.790 0.513 -3.875 1.00 0.00 H new ATOM 1094 N LEU A 68 8.023 -1.120 -2.865 1.00 0.00 N ATOM 1095 CA LEU A 68 6.756 -1.746 -3.192 1.00 0.00 C ATOM 1096 C LEU A 68 5.607 -0.804 -2.858 1.00 0.00 C ATOM 1097 O LEU A 68 5.352 -0.508 -1.691 1.00 0.00 O ATOM 1098 CB LEU A 68 6.596 -3.062 -2.423 1.00 0.00 C ATOM 1099 CG LEU A 68 5.275 -3.801 -2.657 1.00 0.00 C ATOM 1100 CD1 LEU A 68 5.151 -4.234 -4.109 1.00 0.00 C ATOM 1101 CD2 LEU A 68 5.168 -5.001 -1.729 1.00 0.00 C ATOM 0 H LEU A 68 8.139 -0.901 -1.876 1.00 0.00 H new ATOM 0 HA LEU A 68 6.740 -1.962 -4.260 1.00 0.00 H new ATOM 0 HB2 LEU A 68 7.417 -3.725 -2.695 1.00 0.00 H new ATOM 0 HB3 LEU A 68 6.694 -2.855 -1.357 1.00 0.00 H new ATOM 0 HG LEU A 68 4.455 -3.118 -2.435 1.00 0.00 H new ATOM 0 HD11 LEU A 68 4.206 -4.757 -4.253 1.00 0.00 H new ATOM 0 HD12 LEU A 68 5.182 -3.356 -4.754 1.00 0.00 H new ATOM 0 HD13 LEU A 68 5.976 -4.900 -4.362 1.00 0.00 H new ATOM 0 HD21 LEU A 68 4.224 -5.516 -1.907 1.00 0.00 H new ATOM 0 HD22 LEU A 68 5.996 -5.684 -1.921 1.00 0.00 H new ATOM 0 HD23 LEU A 68 5.208 -4.664 -0.693 1.00 0.00 H new ATOM 1113 N ILE A 69 4.931 -0.320 -3.883 1.00 0.00 N ATOM 1114 CA ILE A 69 3.789 0.552 -3.688 1.00 0.00 C ATOM 1115 C ILE A 69 2.534 -0.289 -3.513 1.00 0.00 C ATOM 1116 O ILE A 69 1.974 -0.798 -4.485 1.00 0.00 O ATOM 1117 CB ILE A 69 3.597 1.530 -4.870 1.00 0.00 C ATOM 1118 CG1 ILE A 69 4.868 2.358 -5.088 1.00 0.00 C ATOM 1119 CG2 ILE A 69 2.403 2.443 -4.615 1.00 0.00 C ATOM 1120 CD1 ILE A 69 4.768 3.341 -6.237 1.00 0.00 C ATOM 0 H ILE A 69 5.153 -0.516 -4.859 1.00 0.00 H new ATOM 0 HA ILE A 69 3.974 1.147 -2.794 1.00 0.00 H new ATOM 0 HB ILE A 69 3.402 0.951 -5.773 1.00 0.00 H new ATOM 0 HG12 ILE A 69 5.096 2.905 -4.173 1.00 0.00 H new ATOM 0 HG13 ILE A 69 5.703 1.682 -5.272 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.281 3.126 -5.456 1.00 0.00 H new ATOM 0 HG22 ILE A 69 1.502 1.840 -4.503 1.00 0.00 H new ATOM 0 HG23 ILE A 69 2.572 3.017 -3.704 1.00 0.00 H new ATOM 0 HD11 ILE A 69 5.705 3.890 -6.329 1.00 0.00 H new ATOM 0 HD12 ILE A 69 4.572 2.800 -7.163 1.00 0.00 H new ATOM 0 HD13 ILE A 69 3.955 4.041 -6.047 1.00 0.00 H new ATOM 1132 N ARG A 70 2.124 -0.477 -2.270 1.00 0.00 N ATOM 1133 CA ARG A 70 0.927 -1.247 -1.987 1.00 0.00 C ATOM 1134 C ARG A 70 -0.254 -0.314 -1.764 1.00 0.00 C ATOM 1135 O ARG A 70 -0.108 0.766 -1.184 1.00 0.00 O ATOM 1136 CB ARG A 70 1.117 -2.143 -0.756 1.00 0.00 C ATOM 1137 CG ARG A 70 1.211 -1.373 0.549 1.00 0.00 C ATOM 1138 CD ARG A 70 1.033 -2.274 1.760 1.00 0.00 C ATOM 1139 NE ARG A 70 0.892 -1.486 2.981 1.00 0.00 N ATOM 1140 CZ ARG A 70 0.535 -1.976 4.166 1.00 0.00 C ATOM 1141 NH1 ARG A 70 0.241 -3.264 4.309 1.00 0.00 N ATOM 1142 NH2 ARG A 70 0.449 -1.161 5.208 1.00 0.00 N ATOM 0 H ARG A 70 2.600 -0.109 -1.446 1.00 0.00 H new ATOM 0 HA ARG A 70 0.730 -1.886 -2.848 1.00 0.00 H new ATOM 0 HB2 ARG A 70 0.284 -2.844 -0.695 1.00 0.00 H new ATOM 0 HB3 ARG A 70 2.023 -2.735 -0.885 1.00 0.00 H new ATOM 0 HG2 ARG A 70 2.179 -0.876 0.607 1.00 0.00 H new ATOM 0 HG3 ARG A 70 0.451 -0.592 0.564 1.00 0.00 H new ATOM 0 HD2 ARG A 70 0.153 -2.902 1.624 1.00 0.00 H new ATOM 0 HD3 ARG A 70 1.890 -2.942 1.850 1.00 0.00 H new ATOM 0 HE ARG A 70 1.081 -0.485 2.922 1.00 0.00 H new ATOM 0 HH11 ARG A 70 0.288 -3.890 3.505 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -0.031 -3.627 5.223 1.00 0.00 H new ATOM 0 HH21 ARG A 70 0.656 -0.168 5.097 1.00 0.00 H new ATOM 0 HH22 ARG A 70 0.176 -1.527 6.120 1.00 0.00 H new ATOM 1156 N MET A 71 -1.414 -0.727 -2.241 1.00 0.00 N ATOM 1157 CA MET A 71 -2.642 0.009 -2.007 1.00 0.00 C ATOM 1158 C MET A 71 -3.816 -0.959 -1.953 1.00 0.00 C ATOM 1159 O MET A 71 -3.956 -1.834 -2.809 1.00 0.00 O ATOM 1160 CB MET A 71 -2.857 1.078 -3.088 1.00 0.00 C ATOM 1161 CG MET A 71 -2.952 0.526 -4.502 1.00 0.00 C ATOM 1162 SD MET A 71 -3.026 1.823 -5.759 1.00 0.00 S ATOM 1163 CE MET A 71 -4.472 2.738 -5.234 1.00 0.00 C ATOM 0 H MET A 71 -1.531 -1.574 -2.797 1.00 0.00 H new ATOM 0 HA MET A 71 -2.567 0.525 -1.050 1.00 0.00 H new ATOM 0 HB2 MET A 71 -3.771 1.628 -2.863 1.00 0.00 H new ATOM 0 HB3 MET A 71 -2.036 1.793 -3.044 1.00 0.00 H new ATOM 0 HG2 MET A 71 -2.090 -0.113 -4.696 1.00 0.00 H new ATOM 0 HG3 MET A 71 -3.839 -0.102 -4.583 1.00 0.00 H new ATOM 0 HE1 MET A 71 -5.044 3.048 -6.109 1.00 0.00 H new ATOM 0 HE2 MET A 71 -5.093 2.105 -4.601 1.00 0.00 H new ATOM 0 HE3 MET A 71 -4.161 3.619 -4.673 1.00 0.00 H new ATOM 1173 N GLU A 72 -4.635 -0.822 -0.924 1.00 0.00 N ATOM 1174 CA GLU A 72 -5.786 -1.693 -0.753 1.00 0.00 C ATOM 1175 C GLU A 72 -6.999 -1.069 -1.421 1.00 0.00 C ATOM 1176 O GLU A 72 -7.364 0.075 -1.129 1.00 0.00 O ATOM 1177 CB GLU A 72 -6.050 -1.948 0.727 1.00 0.00 C ATOM 1178 CG GLU A 72 -4.838 -2.492 1.465 1.00 0.00 C ATOM 1179 CD GLU A 72 -5.166 -2.948 2.869 1.00 0.00 C ATOM 1180 OE1 GLU A 72 -5.447 -2.089 3.729 1.00 0.00 O ATOM 1181 OE2 GLU A 72 -5.133 -4.166 3.121 1.00 0.00 O ATOM 0 H GLU A 72 -4.525 -0.117 -0.195 1.00 0.00 H new ATOM 0 HA GLU A 72 -5.581 -2.654 -1.224 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.367 -1.018 1.199 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -6.875 -2.654 0.826 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -4.421 -3.328 0.904 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -4.068 -1.722 1.508 1.00 0.00 H new ATOM 1188 N ILE A 73 -7.615 -1.819 -2.319 1.00 0.00 N ATOM 1189 CA ILE A 73 -8.642 -1.279 -3.191 1.00 0.00 C ATOM 1190 C ILE A 73 -9.866 -2.187 -3.259 1.00 0.00 C ATOM 1191 O ILE A 73 -9.806 -3.368 -2.920 1.00 0.00 O ATOM 1192 CB ILE A 73 -8.087 -1.077 -4.622 1.00 0.00 C ATOM 1193 CG1 ILE A 73 -7.366 -2.348 -5.090 1.00 0.00 C ATOM 1194 CG2 ILE A 73 -7.155 0.127 -4.675 1.00 0.00 C ATOM 1195 CD1 ILE A 73 -6.724 -2.238 -6.456 1.00 0.00 C ATOM 0 H ILE A 73 -7.419 -2.810 -2.463 1.00 0.00 H new ATOM 0 HA ILE A 73 -8.944 -0.320 -2.769 1.00 0.00 H new ATOM 0 HB ILE A 73 -8.921 -0.883 -5.296 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -6.597 -2.604 -4.361 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -8.080 -3.172 -5.103 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -6.777 0.250 -5.690 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -7.701 1.023 -4.380 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -6.319 -0.029 -3.993 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -6.238 -3.181 -6.706 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -7.488 -2.015 -7.200 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -5.983 -1.439 -6.446 1.00 0.00 H new ATOM 1207 N SER A 74 -10.977 -1.616 -3.677 1.00 0.00 N ATOM 1208 CA SER A 74 -12.170 -2.391 -3.965 1.00 0.00 C ATOM 1209 C SER A 74 -12.639 -2.108 -5.383 1.00 0.00 C ATOM 1210 O SER A 74 -12.615 -0.960 -5.837 1.00 0.00 O ATOM 1211 CB SER A 74 -13.281 -2.079 -2.960 1.00 0.00 C ATOM 1212 OG SER A 74 -12.936 -2.541 -1.668 1.00 0.00 O ATOM 0 H SER A 74 -11.080 -0.612 -3.826 1.00 0.00 H new ATOM 0 HA SER A 74 -11.926 -3.450 -3.876 1.00 0.00 H new ATOM 0 HB2 SER A 74 -13.459 -1.004 -2.931 1.00 0.00 H new ATOM 0 HB3 SER A 74 -14.211 -2.548 -3.282 1.00 0.00 H new ATOM 0 HG SER A 74 -13.720 -2.491 -1.082 1.00 0.00 H new ATOM 1218 N LEU A 75 -13.035 -3.159 -6.084 1.00 0.00 N ATOM 1219 CA LEU A 75 -13.486 -3.035 -7.459 1.00 0.00 C ATOM 1220 C LEU A 75 -14.763 -2.204 -7.524 1.00 0.00 C ATOM 1221 O LEU A 75 -15.734 -2.487 -6.827 1.00 0.00 O ATOM 1222 CB LEU A 75 -13.712 -4.426 -8.061 1.00 0.00 C ATOM 1223 CG LEU A 75 -14.170 -4.443 -9.518 1.00 0.00 C ATOM 1224 CD1 LEU A 75 -13.127 -3.803 -10.422 1.00 0.00 C ATOM 1225 CD2 LEU A 75 -14.469 -5.864 -9.967 1.00 0.00 C ATOM 0 H LEU A 75 -13.053 -4.112 -5.720 1.00 0.00 H new ATOM 0 HA LEU A 75 -12.718 -2.525 -8.041 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -12.784 -4.992 -7.983 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -14.455 -4.948 -7.458 1.00 0.00 H new ATOM 0 HG LEU A 75 -15.087 -3.858 -9.593 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -13.476 -3.827 -11.454 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -12.967 -2.769 -10.117 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -12.190 -4.354 -10.343 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -14.794 -5.856 -11.007 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -13.570 -6.472 -9.872 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -15.258 -6.284 -9.344 1.00 0.00 H new ATOM 1237 N ALA A 76 -14.747 -1.165 -8.341 1.00 0.00 N ATOM 1238 CA ALA A 76 -15.903 -0.296 -8.483 1.00 0.00 C ATOM 1239 C ALA A 76 -16.641 -0.590 -9.779 1.00 0.00 C ATOM 1240 O ALA A 76 -17.861 -0.751 -9.790 1.00 0.00 O ATOM 1241 CB ALA A 76 -15.476 1.159 -8.429 1.00 0.00 C ATOM 0 H ALA A 76 -13.947 -0.902 -8.916 1.00 0.00 H new ATOM 0 HA ALA A 76 -16.584 -0.489 -7.654 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -16.351 1.799 -8.537 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -14.994 1.361 -7.473 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -14.776 1.363 -9.239 1.00 0.00 H new ATOM 1247 N TRP A 77 -15.889 -0.667 -10.868 1.00 0.00 N ATOM 1248 CA TRP A 77 -16.460 -0.929 -12.177 1.00 0.00 C ATOM 1249 C TRP A 77 -15.447 -1.630 -13.070 1.00 0.00 C ATOM 1250 O TRP A 77 -14.240 -1.413 -12.947 1.00 0.00 O ATOM 1251 CB TRP A 77 -16.945 0.375 -12.829 1.00 0.00 C ATOM 1252 CG TRP A 77 -15.929 1.482 -12.825 1.00 0.00 C ATOM 1253 CD1 TRP A 77 -15.672 2.350 -11.802 1.00 0.00 C ATOM 1254 CD2 TRP A 77 -15.051 1.853 -13.896 1.00 0.00 C ATOM 1255 NE1 TRP A 77 -14.687 3.232 -12.168 1.00 0.00 N ATOM 1256 CE2 TRP A 77 -14.287 2.950 -13.447 1.00 0.00 C ATOM 1257 CE3 TRP A 77 -14.830 1.364 -15.186 1.00 0.00 C ATOM 1258 CZ2 TRP A 77 -13.323 3.562 -14.243 1.00 0.00 C ATOM 1259 CZ3 TRP A 77 -13.876 1.976 -15.976 1.00 0.00 C ATOM 1260 CH2 TRP A 77 -13.131 3.064 -15.502 1.00 0.00 C ATOM 0 H TRP A 77 -14.876 -0.551 -10.868 1.00 0.00 H new ATOM 0 HA TRP A 77 -17.320 -1.587 -12.050 1.00 0.00 H new ATOM 0 HB2 TRP A 77 -17.235 0.167 -13.859 1.00 0.00 H new ATOM 0 HB3 TRP A 77 -17.840 0.717 -12.309 1.00 0.00 H new ATOM 0 HD1 TRP A 77 -16.172 2.343 -10.844 1.00 0.00 H new ATOM 0 HE1 TRP A 77 -14.313 3.978 -11.582 1.00 0.00 H new ATOM 0 HE3 TRP A 77 -15.395 0.522 -15.559 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 -12.747 4.400 -13.879 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 -13.701 1.609 -16.977 1.00 0.00 H new ATOM 0 HH2 TRP A 77 -12.391 3.518 -16.144 1.00 0.00 H new ATOM 1271 N ALA A 78 -15.941 -2.486 -13.947 1.00 0.00 N ATOM 1272 CA ALA A 78 -15.088 -3.219 -14.870 1.00 0.00 C ATOM 1273 C ALA A 78 -15.717 -3.252 -16.255 1.00 0.00 C ATOM 1274 O ALA A 78 -16.805 -3.805 -16.438 1.00 0.00 O ATOM 1275 CB ALA A 78 -14.854 -4.632 -14.356 1.00 0.00 C ATOM 0 H ALA A 78 -16.935 -2.693 -14.041 1.00 0.00 H new ATOM 0 HA ALA A 78 -14.126 -2.711 -14.940 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -14.214 -5.172 -15.054 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -14.370 -4.589 -13.380 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -15.809 -5.149 -14.265 1.00 0.00 H new ATOM 1281 N ARG A 79 -15.041 -2.657 -17.225 1.00 0.00 N ATOM 1282 CA ARG A 79 -15.559 -2.599 -18.582 1.00 0.00 C ATOM 1283 C ARG A 79 -14.494 -3.023 -19.584 1.00 0.00 C ATOM 1284 O ARG A 79 -13.407 -2.441 -19.634 1.00 0.00 O ATOM 1285 CB ARG A 79 -16.071 -1.192 -18.906 1.00 0.00 C ATOM 1286 CG ARG A 79 -16.673 -1.067 -20.299 1.00 0.00 C ATOM 1287 CD ARG A 79 -17.779 -2.087 -20.528 1.00 0.00 C ATOM 1288 NE ARG A 79 -18.876 -1.946 -19.571 1.00 0.00 N ATOM 1289 CZ ARG A 79 -19.568 -2.971 -19.070 1.00 0.00 C ATOM 1290 NH1 ARG A 79 -19.268 -4.216 -19.422 1.00 0.00 N ATOM 1291 NH2 ARG A 79 -20.548 -2.750 -18.203 1.00 0.00 N ATOM 0 H ARG A 79 -14.134 -2.208 -17.098 1.00 0.00 H new ATOM 0 HA ARG A 79 -16.395 -3.294 -18.656 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -16.822 -0.909 -18.168 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -15.248 -0.484 -18.810 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -17.072 -0.062 -20.434 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -15.892 -1.203 -21.047 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -18.167 -1.976 -21.540 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -17.363 -3.092 -20.454 1.00 0.00 H new ATOM 0 HE ARG A 79 -19.128 -1.005 -19.268 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -18.506 -4.391 -20.077 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -19.799 -4.997 -19.037 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -20.773 -1.796 -17.919 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -21.077 -3.534 -17.820 1.00 0.00 H new ATOM 1305 N ASP A 80 -14.826 -4.046 -20.367 1.00 0.00 N ATOM 1306 CA ASP A 80 -13.936 -4.604 -21.386 1.00 0.00 C ATOM 1307 C ASP A 80 -12.674 -5.177 -20.756 1.00 0.00 C ATOM 1308 O ASP A 80 -12.632 -6.356 -20.403 1.00 0.00 O ATOM 1309 CB ASP A 80 -13.579 -3.567 -22.461 1.00 0.00 C ATOM 1310 CG ASP A 80 -14.760 -3.215 -23.341 1.00 0.00 C ATOM 1311 OD1 ASP A 80 -15.203 -4.081 -24.125 1.00 0.00 O ATOM 1312 OD2 ASP A 80 -15.250 -2.071 -23.266 1.00 0.00 O ATOM 0 H ASP A 80 -15.729 -4.517 -20.313 1.00 0.00 H new ATOM 0 HA ASP A 80 -14.476 -5.415 -21.875 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -13.206 -2.663 -21.980 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -12.771 -3.954 -23.081 1.00 0.00 H new ATOM 1317 N GLY A 81 -11.665 -4.339 -20.593 1.00 0.00 N ATOM 1318 CA GLY A 81 -10.431 -4.779 -19.988 1.00 0.00 C ATOM 1319 C GLY A 81 -9.991 -3.875 -18.857 1.00 0.00 C ATOM 1320 O GLY A 81 -9.143 -4.250 -18.053 1.00 0.00 O ATOM 0 H GLY A 81 -11.680 -3.358 -20.871 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -10.556 -5.794 -19.611 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -9.649 -4.814 -20.747 1.00 0.00 H new ATOM 1324 N LEU A 82 -10.576 -2.689 -18.776 1.00 0.00 N ATOM 1325 CA LEU A 82 -10.168 -1.720 -17.773 1.00 0.00 C ATOM 1326 C LEU A 82 -10.922 -1.929 -16.469 1.00 0.00 C ATOM 1327 O LEU A 82 -12.155 -1.908 -16.431 1.00 0.00 O ATOM 1328 CB LEU A 82 -10.351 -0.285 -18.278 1.00 0.00 C ATOM 1329 CG LEU A 82 -9.148 0.301 -19.029 1.00 0.00 C ATOM 1330 CD1 LEU A 82 -7.904 0.250 -18.161 1.00 0.00 C ATOM 1331 CD2 LEU A 82 -8.897 -0.432 -20.333 1.00 0.00 C ATOM 0 H LEU A 82 -11.329 -2.377 -19.389 1.00 0.00 H new ATOM 0 HA LEU A 82 -9.107 -1.877 -17.581 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -11.219 -0.256 -18.936 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -10.575 0.357 -17.426 1.00 0.00 H new ATOM 0 HG LEU A 82 -9.381 1.340 -19.262 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -7.060 0.669 -18.709 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -8.070 0.829 -17.252 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -7.687 -0.785 -17.897 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -8.038 0.009 -20.839 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -8.696 -1.483 -20.127 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -9.776 -0.349 -20.972 1.00 0.00 H new ATOM 1343 N LEU A 83 -10.162 -2.147 -15.411 1.00 0.00 N ATOM 1344 CA LEU A 83 -10.720 -2.374 -14.090 1.00 0.00 C ATOM 1345 C LEU A 83 -10.505 -1.147 -13.210 1.00 0.00 C ATOM 1346 O LEU A 83 -9.365 -0.782 -12.916 1.00 0.00 O ATOM 1347 CB LEU A 83 -10.052 -3.588 -13.441 1.00 0.00 C ATOM 1348 CG LEU A 83 -10.002 -4.854 -14.297 1.00 0.00 C ATOM 1349 CD1 LEU A 83 -9.203 -5.935 -13.590 1.00 0.00 C ATOM 1350 CD2 LEU A 83 -11.404 -5.351 -14.608 1.00 0.00 C ATOM 0 H LEU A 83 -9.143 -2.172 -15.443 1.00 0.00 H new ATOM 0 HA LEU A 83 -11.789 -2.560 -14.191 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -9.032 -3.316 -13.168 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -10.579 -3.818 -12.515 1.00 0.00 H new ATOM 0 HG LEU A 83 -9.509 -4.612 -15.239 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -9.175 -6.831 -14.210 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -8.186 -5.582 -13.417 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -9.673 -6.169 -12.635 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -11.344 -6.252 -15.218 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -11.925 -5.577 -13.677 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -11.951 -4.581 -15.152 1.00 0.00 H new ATOM 1362 N GLY A 84 -11.596 -0.515 -12.801 1.00 0.00 N ATOM 1363 CA GLY A 84 -11.503 0.654 -11.952 1.00 0.00 C ATOM 1364 C GLY A 84 -11.692 0.306 -10.493 1.00 0.00 C ATOM 1365 O GLY A 84 -12.742 -0.210 -10.099 1.00 0.00 O ATOM 0 H GLY A 84 -12.547 -0.793 -13.043 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -10.530 1.127 -12.090 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -12.257 1.382 -12.252 1.00 0.00 H new ATOM 1369 N PHE A 85 -10.671 0.568 -9.693 1.00 0.00 N ATOM 1370 CA PHE A 85 -10.717 0.253 -8.273 1.00 0.00 C ATOM 1371 C PHE A 85 -10.693 1.522 -7.434 1.00 0.00 C ATOM 1372 O PHE A 85 -9.919 2.438 -7.712 1.00 0.00 O ATOM 1373 CB PHE A 85 -9.524 -0.617 -7.876 1.00 0.00 C ATOM 1374 CG PHE A 85 -9.436 -1.928 -8.602 1.00 0.00 C ATOM 1375 CD1 PHE A 85 -8.663 -2.050 -9.744 1.00 0.00 C ATOM 1376 CD2 PHE A 85 -10.109 -3.042 -8.131 1.00 0.00 C ATOM 1377 CE1 PHE A 85 -8.566 -3.258 -10.402 1.00 0.00 C ATOM 1378 CE2 PHE A 85 -10.017 -4.251 -8.790 1.00 0.00 C ATOM 1379 CZ PHE A 85 -9.244 -4.361 -9.925 1.00 0.00 C ATOM 0 H PHE A 85 -9.799 0.998 -10.002 1.00 0.00 H new ATOM 0 HA PHE A 85 -11.646 -0.287 -8.088 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -8.607 -0.056 -8.055 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -9.575 -0.813 -6.805 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -8.131 -1.190 -10.123 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -10.712 -2.964 -7.239 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -7.959 -3.341 -11.291 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -10.551 -5.112 -8.416 1.00 0.00 H new ATOM 0 HZ PHE A 85 -9.169 -5.307 -10.440 1.00 0.00 H new ATOM 1389 N GLU A 86 -11.533 1.569 -6.410 1.00 0.00 N ATOM 1390 CA GLU A 86 -11.505 2.663 -5.451 1.00 0.00 C ATOM 1391 C GLU A 86 -10.478 2.364 -4.375 1.00 0.00 C ATOM 1392 O GLU A 86 -10.413 1.245 -3.862 1.00 0.00 O ATOM 1393 CB GLU A 86 -12.871 2.873 -4.798 1.00 0.00 C ATOM 1394 CG GLU A 86 -13.950 3.359 -5.745 1.00 0.00 C ATOM 1395 CD GLU A 86 -15.262 3.620 -5.035 1.00 0.00 C ATOM 1396 OE1 GLU A 86 -15.946 2.646 -4.656 1.00 0.00 O ATOM 1397 OE2 GLU A 86 -15.615 4.805 -4.848 1.00 0.00 O ATOM 0 H GLU A 86 -12.243 0.861 -6.222 1.00 0.00 H new ATOM 0 HA GLU A 86 -11.240 3.574 -5.987 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -13.194 1.933 -4.350 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -12.765 3.593 -3.987 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -13.616 4.274 -6.234 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -14.104 2.617 -6.528 1.00 0.00 H new ATOM 1404 N CYS A 87 -9.674 3.355 -4.036 1.00 0.00 N ATOM 1405 CA CYS A 87 -8.647 3.178 -3.028 1.00 0.00 C ATOM 1406 C CYS A 87 -9.245 3.300 -1.629 1.00 0.00 C ATOM 1407 O CYS A 87 -9.962 4.256 -1.335 1.00 0.00 O ATOM 1408 CB CYS A 87 -7.537 4.211 -3.232 1.00 0.00 C ATOM 1409 SG CYS A 87 -8.107 5.924 -3.156 1.00 0.00 S ATOM 0 H CYS A 87 -9.713 4.289 -4.444 1.00 0.00 H new ATOM 0 HA CYS A 87 -8.221 2.180 -3.128 1.00 0.00 H new ATOM 0 HB2 CYS A 87 -6.770 4.060 -2.473 1.00 0.00 H new ATOM 0 HB3 CYS A 87 -7.066 4.038 -4.200 1.00 0.00 H new ATOM 0 HG CYS A 87 -9.162 5.997 -2.400 1.00 0.00 H new ATOM 1415 N GLN A 88 -8.972 2.316 -0.785 1.00 0.00 N ATOM 1416 CA GLN A 88 -9.458 2.327 0.589 1.00 0.00 C ATOM 1417 C GLN A 88 -8.332 2.659 1.554 1.00 0.00 C ATOM 1418 O GLN A 88 -8.489 3.490 2.448 1.00 0.00 O ATOM 1419 CB GLN A 88 -10.069 0.975 0.949 1.00 0.00 C ATOM 1420 CG GLN A 88 -11.377 0.694 0.235 1.00 0.00 C ATOM 1421 CD GLN A 88 -11.897 -0.702 0.497 1.00 0.00 C ATOM 1422 OE1 GLN A 88 -13.107 -0.929 0.532 1.00 0.00 O ATOM 1423 NE2 GLN A 88 -10.991 -1.653 0.668 1.00 0.00 N ATOM 0 H GLN A 88 -8.415 1.497 -1.028 1.00 0.00 H new ATOM 0 HA GLN A 88 -10.226 3.096 0.671 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -9.356 0.187 0.708 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -10.236 0.935 2.025 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -12.124 1.421 0.554 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -11.237 0.830 -0.837 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -9.998 -1.424 0.632 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -11.287 -2.615 0.836 1.00 0.00 H new ATOM 1432 N HIS A 89 -7.198 2.001 1.371 1.00 0.00 N ATOM 1433 CA HIS A 89 -6.028 2.255 2.196 1.00 0.00 C ATOM 1434 C HIS A 89 -4.829 2.580 1.324 1.00 0.00 C ATOM 1435 O HIS A 89 -4.356 1.736 0.560 1.00 0.00 O ATOM 1436 CB HIS A 89 -5.715 1.053 3.097 1.00 0.00 C ATOM 1437 CG HIS A 89 -4.392 1.153 3.807 1.00 0.00 C ATOM 1438 ND1 HIS A 89 -4.077 2.169 4.679 1.00 0.00 N ATOM 1439 CD2 HIS A 89 -3.292 0.366 3.742 1.00 0.00 C ATOM 1440 CE1 HIS A 89 -2.845 2.004 5.119 1.00 0.00 C ATOM 1441 NE2 HIS A 89 -2.341 0.918 4.567 1.00 0.00 N ATOM 0 H HIS A 89 -7.063 1.285 0.657 1.00 0.00 H new ATOM 0 HA HIS A 89 -6.246 3.111 2.834 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -6.508 0.951 3.838 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -5.725 0.146 2.493 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -3.182 -0.531 3.150 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -2.334 2.651 5.816 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -1.403 0.549 4.725 1.00 0.00 H new ATOM 1450 N ILE A 90 -4.352 3.807 1.437 1.00 0.00 N ATOM 1451 CA ILE A 90 -3.164 4.230 0.720 1.00 0.00 C ATOM 1452 C ILE A 90 -2.127 4.709 1.722 1.00 0.00 C ATOM 1453 O ILE A 90 -2.281 5.775 2.321 1.00 0.00 O ATOM 1454 CB ILE A 90 -3.436 5.368 -0.298 1.00 0.00 C ATOM 1455 CG1 ILE A 90 -4.766 5.172 -1.035 1.00 0.00 C ATOM 1456 CG2 ILE A 90 -2.295 5.446 -1.303 1.00 0.00 C ATOM 1457 CD1 ILE A 90 -5.969 5.705 -0.282 1.00 0.00 C ATOM 0 H ILE A 90 -4.772 4.530 2.021 1.00 0.00 H new ATOM 0 HA ILE A 90 -2.809 3.368 0.154 1.00 0.00 H new ATOM 0 HB ILE A 90 -3.502 6.302 0.260 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -4.709 5.666 -2.005 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -4.911 4.109 -1.226 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -2.492 6.247 -2.015 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -1.361 5.648 -0.778 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.214 4.499 -1.836 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -6.872 5.529 -0.867 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -6.053 5.194 0.677 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -5.848 6.775 -0.114 1.00 0.00 H new ATOM 1469 N ASP A 91 -1.098 3.902 1.927 1.00 0.00 N ATOM 1470 CA ASP A 91 -0.041 4.230 2.875 1.00 0.00 C ATOM 1471 C ASP A 91 0.636 5.534 2.489 1.00 0.00 C ATOM 1472 O ASP A 91 0.811 5.820 1.302 1.00 0.00 O ATOM 1473 CB ASP A 91 1.003 3.114 2.927 1.00 0.00 C ATOM 1474 CG ASP A 91 0.429 1.796 3.394 1.00 0.00 C ATOM 1475 OD1 ASP A 91 0.600 1.450 4.582 1.00 0.00 O ATOM 1476 OD2 ASP A 91 -0.198 1.096 2.579 1.00 0.00 O ATOM 0 H ASP A 91 -0.971 3.011 1.448 1.00 0.00 H new ATOM 0 HA ASP A 91 -0.497 4.339 3.859 1.00 0.00 H new ATOM 0 HB2 ASP A 91 1.439 2.984 1.937 1.00 0.00 H new ATOM 0 HB3 ASP A 91 1.812 3.410 3.595 1.00 0.00 H new ATOM 1481 N LEU A 92 1.027 6.315 3.489 1.00 0.00 N ATOM 1482 CA LEU A 92 1.707 7.578 3.246 1.00 0.00 C ATOM 1483 C LEU A 92 3.019 7.324 2.519 1.00 0.00 C ATOM 1484 O LEU A 92 3.440 8.112 1.673 1.00 0.00 O ATOM 1485 CB LEU A 92 1.963 8.320 4.561 1.00 0.00 C ATOM 1486 CG LEU A 92 0.707 8.689 5.355 1.00 0.00 C ATOM 1487 CD1 LEU A 92 1.081 9.433 6.626 1.00 0.00 C ATOM 1488 CD2 LEU A 92 -0.237 9.528 4.508 1.00 0.00 C ATOM 0 H LEU A 92 0.884 6.095 4.475 1.00 0.00 H new ATOM 0 HA LEU A 92 1.068 8.204 2.623 1.00 0.00 H new ATOM 0 HB2 LEU A 92 2.603 7.701 5.190 1.00 0.00 H new ATOM 0 HB3 LEU A 92 2.517 9.233 4.343 1.00 0.00 H new ATOM 0 HG LEU A 92 0.194 7.768 5.630 1.00 0.00 H new ATOM 0 HD11 LEU A 92 0.176 9.688 7.178 1.00 0.00 H new ATOM 0 HD12 LEU A 92 1.717 8.800 7.244 1.00 0.00 H new ATOM 0 HD13 LEU A 92 1.618 10.346 6.369 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -1.123 9.779 5.091 1.00 0.00 H new ATOM 0 HD22 LEU A 92 0.267 10.444 4.201 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -0.533 8.963 3.624 1.00 0.00 H new ATOM 1500 N ASP A 93 3.649 6.204 2.850 1.00 0.00 N ATOM 1501 CA ASP A 93 4.857 5.767 2.165 1.00 0.00 C ATOM 1502 C ASP A 93 4.569 5.489 0.691 1.00 0.00 C ATOM 1503 O ASP A 93 5.313 5.922 -0.189 1.00 0.00 O ATOM 1504 CB ASP A 93 5.423 4.515 2.839 1.00 0.00 C ATOM 1505 CG ASP A 93 6.530 3.868 2.032 1.00 0.00 C ATOM 1506 OD1 ASP A 93 7.646 4.417 1.987 1.00 0.00 O ATOM 1507 OD2 ASP A 93 6.286 2.797 1.439 1.00 0.00 O ATOM 0 H ASP A 93 3.340 5.578 3.594 1.00 0.00 H new ATOM 0 HA ASP A 93 5.597 6.565 2.227 1.00 0.00 H new ATOM 0 HB2 ASP A 93 5.804 4.779 3.825 1.00 0.00 H new ATOM 0 HB3 ASP A 93 4.620 3.794 2.990 1.00 0.00 H new ATOM 1512 N SER A 94 3.473 4.786 0.427 1.00 0.00 N ATOM 1513 CA SER A 94 3.060 4.489 -0.939 1.00 0.00 C ATOM 1514 C SER A 94 2.792 5.778 -1.717 1.00 0.00 C ATOM 1515 O SER A 94 3.215 5.917 -2.868 1.00 0.00 O ATOM 1516 CB SER A 94 1.812 3.603 -0.930 1.00 0.00 C ATOM 1517 OG SER A 94 2.042 2.408 -0.199 1.00 0.00 O ATOM 0 H SER A 94 2.853 4.410 1.144 1.00 0.00 H new ATOM 0 HA SER A 94 3.869 3.954 -1.436 1.00 0.00 H new ATOM 0 HB2 SER A 94 0.978 4.148 -0.489 1.00 0.00 H new ATOM 0 HB3 SER A 94 1.528 3.359 -1.953 1.00 0.00 H new ATOM 0 HG SER A 94 1.365 1.742 -0.439 1.00 0.00 H new ATOM 1523 N ILE A 95 2.103 6.720 -1.075 1.00 0.00 N ATOM 1524 CA ILE A 95 1.830 8.022 -1.675 1.00 0.00 C ATOM 1525 C ILE A 95 3.136 8.741 -2.001 1.00 0.00 C ATOM 1526 O ILE A 95 3.302 9.291 -3.092 1.00 0.00 O ATOM 1527 CB ILE A 95 0.982 8.915 -0.738 1.00 0.00 C ATOM 1528 CG1 ILE A 95 -0.348 8.232 -0.411 1.00 0.00 C ATOM 1529 CG2 ILE A 95 0.738 10.279 -1.374 1.00 0.00 C ATOM 1530 CD1 ILE A 95 -1.203 8.998 0.578 1.00 0.00 C ATOM 0 H ILE A 95 1.723 6.604 -0.136 1.00 0.00 H new ATOM 0 HA ILE A 95 1.266 7.844 -2.591 1.00 0.00 H new ATOM 0 HB ILE A 95 1.534 9.063 0.190 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -0.912 8.095 -1.334 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -0.146 7.239 -0.010 1.00 0.00 H new ATOM 0 HG21 ILE A 95 0.140 10.893 -0.700 1.00 0.00 H new ATOM 0 HG22 ILE A 95 1.693 10.770 -1.560 1.00 0.00 H new ATOM 0 HG23 ILE A 95 0.206 10.151 -2.317 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -2.128 8.451 0.759 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -0.660 9.113 1.516 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -1.437 9.982 0.171 1.00 0.00 H new ATOM 1542 N SER A 96 4.064 8.711 -1.047 1.00 0.00 N ATOM 1543 CA SER A 96 5.369 9.332 -1.223 1.00 0.00 C ATOM 1544 C SER A 96 6.082 8.758 -2.444 1.00 0.00 C ATOM 1545 O SER A 96 6.530 9.508 -3.310 1.00 0.00 O ATOM 1546 CB SER A 96 6.222 9.140 0.035 1.00 0.00 C ATOM 1547 OG SER A 96 5.586 9.702 1.174 1.00 0.00 O ATOM 0 H SER A 96 3.933 8.260 -0.141 1.00 0.00 H new ATOM 0 HA SER A 96 5.222 10.400 -1.386 1.00 0.00 H new ATOM 0 HB2 SER A 96 6.398 8.077 0.200 1.00 0.00 H new ATOM 0 HB3 SER A 96 7.197 9.606 -0.108 1.00 0.00 H new ATOM 0 HG SER A 96 4.723 9.260 1.318 1.00 0.00 H new ATOM 1553 N HIS A 97 6.158 7.428 -2.524 1.00 0.00 N ATOM 1554 CA HIS A 97 6.816 6.762 -3.650 1.00 0.00 C ATOM 1555 C HIS A 97 6.242 7.238 -4.980 1.00 0.00 C ATOM 1556 O HIS A 97 6.983 7.636 -5.879 1.00 0.00 O ATOM 1557 CB HIS A 97 6.667 5.237 -3.577 1.00 0.00 C ATOM 1558 CG HIS A 97 7.390 4.582 -2.442 1.00 0.00 C ATOM 1559 ND1 HIS A 97 8.721 4.790 -2.163 1.00 0.00 N ATOM 1560 CD2 HIS A 97 6.951 3.696 -1.520 1.00 0.00 C ATOM 1561 CE1 HIS A 97 9.066 4.059 -1.120 1.00 0.00 C ATOM 1562 NE2 HIS A 97 8.011 3.386 -0.706 1.00 0.00 N ATOM 0 H HIS A 97 5.773 6.793 -1.825 1.00 0.00 H new ATOM 0 HA HIS A 97 7.873 7.022 -3.586 1.00 0.00 H new ATOM 0 HB2 HIS A 97 5.607 4.994 -3.501 1.00 0.00 H new ATOM 0 HB3 HIS A 97 7.026 4.807 -4.512 1.00 0.00 H new ATOM 0 HD2 HIS A 97 5.948 3.304 -1.439 1.00 0.00 H new ATOM 0 HE1 HIS A 97 10.051 4.019 -0.678 1.00 0.00 H new ATOM 0 HE2 HIS A 97 7.987 2.743 0.086 1.00 0.00 H new ATOM 1571 N LEU A 98 4.919 7.201 -5.088 1.00 0.00 N ATOM 1572 CA LEU A 98 4.241 7.543 -6.329 1.00 0.00 C ATOM 1573 C LEU A 98 4.475 9.003 -6.705 1.00 0.00 C ATOM 1574 O LEU A 98 4.873 9.303 -7.831 1.00 0.00 O ATOM 1575 CB LEU A 98 2.739 7.270 -6.209 1.00 0.00 C ATOM 1576 CG LEU A 98 1.932 7.500 -7.490 1.00 0.00 C ATOM 1577 CD1 LEU A 98 2.381 6.541 -8.585 1.00 0.00 C ATOM 1578 CD2 LEU A 98 0.445 7.346 -7.221 1.00 0.00 C ATOM 0 H LEU A 98 4.294 6.936 -4.327 1.00 0.00 H new ATOM 0 HA LEU A 98 4.657 6.917 -7.118 1.00 0.00 H new ATOM 0 HB2 LEU A 98 2.598 6.237 -5.890 1.00 0.00 H new ATOM 0 HB3 LEU A 98 2.332 7.905 -5.423 1.00 0.00 H new ATOM 0 HG LEU A 98 2.114 8.519 -7.831 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.796 6.720 -9.487 1.00 0.00 H new ATOM 0 HD12 LEU A 98 3.437 6.702 -8.799 1.00 0.00 H new ATOM 0 HD13 LEU A 98 2.231 5.514 -8.253 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -0.111 7.513 -8.144 1.00 0.00 H new ATOM 0 HD22 LEU A 98 0.244 6.340 -6.854 1.00 0.00 H new ATOM 0 HD23 LEU A 98 0.133 8.074 -6.472 1.00 0.00 H new ATOM 1590 N ARG A 99 4.249 9.909 -5.759 1.00 0.00 N ATOM 1591 CA ARG A 99 4.344 11.331 -6.052 1.00 0.00 C ATOM 1592 C ARG A 99 5.774 11.737 -6.394 1.00 0.00 C ATOM 1593 O ARG A 99 5.993 12.508 -7.330 1.00 0.00 O ATOM 1594 CB ARG A 99 3.818 12.181 -4.893 1.00 0.00 C ATOM 1595 CG ARG A 99 3.852 13.665 -5.208 1.00 0.00 C ATOM 1596 CD ARG A 99 3.082 14.498 -4.201 1.00 0.00 C ATOM 1597 NE ARG A 99 3.044 15.899 -4.616 1.00 0.00 N ATOM 1598 CZ ARG A 99 1.984 16.486 -5.168 1.00 0.00 C ATOM 1599 NH1 ARG A 99 0.826 15.842 -5.250 1.00 0.00 N ATOM 1600 NH2 ARG A 99 2.083 17.726 -5.627 1.00 0.00 N ATOM 0 H ARG A 99 4.002 9.686 -4.795 1.00 0.00 H new ATOM 0 HA ARG A 99 3.717 11.516 -6.924 1.00 0.00 H new ATOM 0 HB2 ARG A 99 2.795 11.884 -4.662 1.00 0.00 H new ATOM 0 HB3 ARG A 99 4.415 11.987 -4.002 1.00 0.00 H new ATOM 0 HG2 ARG A 99 4.888 14.002 -5.235 1.00 0.00 H new ATOM 0 HG3 ARG A 99 3.437 13.830 -6.202 1.00 0.00 H new ATOM 0 HD2 ARG A 99 2.067 14.114 -4.104 1.00 0.00 H new ATOM 0 HD3 ARG A 99 3.549 14.416 -3.220 1.00 0.00 H new ATOM 0 HE ARG A 99 3.882 16.462 -4.474 1.00 0.00 H new ATOM 0 HH11 ARG A 99 0.744 14.892 -4.889 1.00 0.00 H new ATOM 0 HH12 ARG A 99 0.018 16.298 -5.674 1.00 0.00 H new ATOM 0 HH21 ARG A 99 2.969 18.227 -5.557 1.00 0.00 H new ATOM 0 HH22 ARG A 99 1.273 18.179 -6.051 1.00 0.00 H new ATOM 1614 N ARG A 100 6.746 11.218 -5.651 1.00 0.00 N ATOM 1615 CA ARG A 100 8.144 11.538 -5.918 1.00 0.00 C ATOM 1616 C ARG A 100 8.541 11.029 -7.300 1.00 0.00 C ATOM 1617 O ARG A 100 9.240 11.711 -8.045 1.00 0.00 O ATOM 1618 CB ARG A 100 9.071 10.943 -4.848 1.00 0.00 C ATOM 1619 CG ARG A 100 8.795 11.443 -3.436 1.00 0.00 C ATOM 1620 CD ARG A 100 8.919 12.955 -3.328 1.00 0.00 C ATOM 1621 NE ARG A 100 10.276 13.424 -3.595 1.00 0.00 N ATOM 1622 CZ ARG A 100 10.561 14.639 -4.056 1.00 0.00 C ATOM 1623 NH1 ARG A 100 9.585 15.504 -4.296 1.00 0.00 N ATOM 1624 NH2 ARG A 100 11.820 14.995 -4.277 1.00 0.00 N ATOM 0 H ARG A 100 6.595 10.582 -4.868 1.00 0.00 H new ATOM 0 HA ARG A 100 8.253 12.622 -5.888 1.00 0.00 H new ATOM 0 HB2 ARG A 100 8.975 9.857 -4.862 1.00 0.00 H new ATOM 0 HB3 ARG A 100 10.104 11.175 -5.108 1.00 0.00 H new ATOM 0 HG2 ARG A 100 7.792 11.140 -3.134 1.00 0.00 H new ATOM 0 HG3 ARG A 100 9.492 10.972 -2.743 1.00 0.00 H new ATOM 0 HD2 ARG A 100 8.231 13.424 -4.031 1.00 0.00 H new ATOM 0 HD3 ARG A 100 8.619 13.271 -2.329 1.00 0.00 H new ATOM 0 HE ARG A 100 11.050 12.783 -3.418 1.00 0.00 H new ATOM 0 HH11 ARG A 100 8.615 15.238 -4.127 1.00 0.00 H new ATOM 0 HH12 ARG A 100 9.804 16.435 -4.649 1.00 0.00 H new ATOM 0 HH21 ARG A 100 12.576 14.336 -4.093 1.00 0.00 H new ATOM 0 HH22 ARG A 100 12.032 15.928 -4.631 1.00 0.00 H new ATOM 1638 N LEU A 101 8.060 9.839 -7.647 1.00 0.00 N ATOM 1639 CA LEU A 101 8.350 9.237 -8.943 1.00 0.00 C ATOM 1640 C LEU A 101 7.834 10.121 -10.077 1.00 0.00 C ATOM 1641 O LEU A 101 8.550 10.386 -11.046 1.00 0.00 O ATOM 1642 CB LEU A 101 7.714 7.846 -9.032 1.00 0.00 C ATOM 1643 CG LEU A 101 7.984 7.080 -10.330 1.00 0.00 C ATOM 1644 CD1 LEU A 101 9.468 6.776 -10.474 1.00 0.00 C ATOM 1645 CD2 LEU A 101 7.168 5.796 -10.369 1.00 0.00 C ATOM 0 H LEU A 101 7.465 9.270 -7.045 1.00 0.00 H new ATOM 0 HA LEU A 101 9.431 9.142 -9.043 1.00 0.00 H new ATOM 0 HB2 LEU A 101 8.074 7.247 -8.195 1.00 0.00 H new ATOM 0 HB3 LEU A 101 6.636 7.950 -8.909 1.00 0.00 H new ATOM 0 HG LEU A 101 7.681 7.706 -11.169 1.00 0.00 H new ATOM 0 HD11 LEU A 101 9.639 6.231 -11.402 1.00 0.00 H new ATOM 0 HD12 LEU A 101 10.031 7.709 -10.492 1.00 0.00 H new ATOM 0 HD13 LEU A 101 9.799 6.169 -9.631 1.00 0.00 H new ATOM 0 HD21 LEU A 101 7.372 5.264 -11.298 1.00 0.00 H new ATOM 0 HD22 LEU A 101 7.441 5.166 -9.522 1.00 0.00 H new ATOM 0 HD23 LEU A 101 6.107 6.038 -10.314 1.00 0.00 H new ATOM 1657 N VAL A 102 6.598 10.585 -9.943 1.00 0.00 N ATOM 1658 CA VAL A 102 5.980 11.425 -10.962 1.00 0.00 C ATOM 1659 C VAL A 102 6.674 12.785 -11.056 1.00 0.00 C ATOM 1660 O VAL A 102 6.887 13.306 -12.153 1.00 0.00 O ATOM 1661 CB VAL A 102 4.471 11.628 -10.686 1.00 0.00 C ATOM 1662 CG1 VAL A 102 3.840 12.537 -11.732 1.00 0.00 C ATOM 1663 CG2 VAL A 102 3.753 10.289 -10.652 1.00 0.00 C ATOM 0 H VAL A 102 6.003 10.394 -9.137 1.00 0.00 H new ATOM 0 HA VAL A 102 6.094 10.907 -11.914 1.00 0.00 H new ATOM 0 HB VAL A 102 4.369 12.108 -9.713 1.00 0.00 H new ATOM 0 HG11 VAL A 102 2.780 12.662 -11.513 1.00 0.00 H new ATOM 0 HG12 VAL A 102 4.332 13.510 -11.713 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.957 12.091 -12.720 1.00 0.00 H new ATOM 0 HG21 VAL A 102 2.693 10.450 -10.457 1.00 0.00 H new ATOM 0 HG22 VAL A 102 3.873 9.787 -11.612 1.00 0.00 H new ATOM 0 HG23 VAL A 102 4.177 9.669 -9.863 1.00 0.00 H new ATOM 1673 N GLU A 103 7.043 13.344 -9.908 1.00 0.00 N ATOM 1674 CA GLU A 103 7.695 14.649 -9.869 1.00 0.00 C ATOM 1675 C GLU A 103 9.082 14.582 -10.508 1.00 0.00 C ATOM 1676 O GLU A 103 9.445 15.434 -11.318 1.00 0.00 O ATOM 1677 CB GLU A 103 7.808 15.151 -8.427 1.00 0.00 C ATOM 1678 CG GLU A 103 8.292 16.589 -8.323 1.00 0.00 C ATOM 1679 CD GLU A 103 8.487 17.045 -6.893 1.00 0.00 C ATOM 1680 OE1 GLU A 103 9.654 17.251 -6.485 1.00 0.00 O ATOM 1681 OE2 GLU A 103 7.481 17.199 -6.168 1.00 0.00 O ATOM 0 H GLU A 103 6.902 12.915 -8.993 1.00 0.00 H new ATOM 0 HA GLU A 103 7.083 15.348 -10.439 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.834 15.068 -7.944 1.00 0.00 H new ATOM 0 HB3 GLU A 103 8.493 14.505 -7.878 1.00 0.00 H new ATOM 0 HG2 GLU A 103 9.234 16.689 -8.862 1.00 0.00 H new ATOM 0 HG3 GLU A 103 7.573 17.245 -8.813 1.00 0.00 H new ATOM 1688 N LEU A 104 9.842 13.545 -10.160 1.00 0.00 N ATOM 1689 CA LEU A 104 11.208 13.382 -10.663 1.00 0.00 C ATOM 1690 C LEU A 104 11.229 13.031 -12.150 1.00 0.00 C ATOM 1691 O LEU A 104 12.289 13.028 -12.779 1.00 0.00 O ATOM 1692 CB LEU A 104 11.963 12.313 -9.862 1.00 0.00 C ATOM 1693 CG LEU A 104 12.688 12.812 -8.605 1.00 0.00 C ATOM 1694 CD1 LEU A 104 11.720 13.455 -7.626 1.00 0.00 C ATOM 1695 CD2 LEU A 104 13.431 11.666 -7.939 1.00 0.00 C ATOM 0 H LEU A 104 9.536 12.803 -9.531 1.00 0.00 H new ATOM 0 HA LEU A 104 11.710 14.341 -10.536 1.00 0.00 H new ATOM 0 HB2 LEU A 104 11.255 11.538 -9.567 1.00 0.00 H new ATOM 0 HB3 LEU A 104 12.695 11.843 -10.519 1.00 0.00 H new ATOM 0 HG LEU A 104 13.407 13.572 -8.910 1.00 0.00 H new ATOM 0 HD11 LEU A 104 12.266 13.798 -6.747 1.00 0.00 H new ATOM 0 HD12 LEU A 104 11.230 14.304 -8.103 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.968 12.725 -7.325 1.00 0.00 H new ATOM 0 HD21 LEU A 104 13.942 12.032 -7.048 1.00 0.00 H new ATOM 0 HD22 LEU A 104 12.722 10.888 -7.657 1.00 0.00 H new ATOM 0 HD23 LEU A 104 14.163 11.255 -8.634 1.00 0.00 H new ATOM 1707 N ASN A 105 10.064 12.729 -12.707 1.00 0.00 N ATOM 1708 CA ASN A 105 9.956 12.446 -14.135 1.00 0.00 C ATOM 1709 C ASN A 105 9.196 13.550 -14.854 1.00 0.00 C ATOM 1710 O ASN A 105 9.097 13.539 -16.082 1.00 0.00 O ATOM 1711 CB ASN A 105 9.274 11.097 -14.381 1.00 0.00 C ATOM 1712 CG ASN A 105 10.228 9.929 -14.229 1.00 0.00 C ATOM 1713 OD1 ASN A 105 10.889 9.528 -15.186 1.00 0.00 O ATOM 1714 ND2 ASN A 105 10.300 9.372 -13.032 1.00 0.00 N ATOM 0 H ASN A 105 9.183 12.673 -12.196 1.00 0.00 H new ATOM 0 HA ASN A 105 10.969 12.401 -14.536 1.00 0.00 H new ATOM 0 HB2 ASN A 105 8.446 10.979 -13.682 1.00 0.00 H new ATOM 0 HB3 ASN A 105 8.848 11.086 -15.384 1.00 0.00 H new ATOM 0 HD21 ASN A 105 10.921 8.578 -12.875 1.00 0.00 H new ATOM 0 HD22 ASN A 105 9.734 9.736 -12.265 1.00 0.00 H new ATOM 1721 N LEU A 106 8.671 14.502 -14.080 1.00 0.00 N ATOM 1722 CA LEU A 106 7.925 15.638 -14.623 1.00 0.00 C ATOM 1723 C LEU A 106 6.697 15.154 -15.403 1.00 0.00 C ATOM 1724 O LEU A 106 6.375 15.669 -16.475 1.00 0.00 O ATOM 1725 CB LEU A 106 8.843 16.485 -15.516 1.00 0.00 C ATOM 1726 CG LEU A 106 8.319 17.880 -15.864 1.00 0.00 C ATOM 1727 CD1 LEU A 106 8.160 18.719 -14.606 1.00 0.00 C ATOM 1728 CD2 LEU A 106 9.255 18.565 -16.847 1.00 0.00 C ATOM 0 H LEU A 106 8.751 14.507 -13.063 1.00 0.00 H new ATOM 0 HA LEU A 106 7.573 16.258 -13.798 1.00 0.00 H new ATOM 0 HB2 LEU A 106 9.807 16.592 -15.019 1.00 0.00 H new ATOM 0 HB3 LEU A 106 9.021 15.941 -16.444 1.00 0.00 H new ATOM 0 HG LEU A 106 7.340 17.776 -16.332 1.00 0.00 H new ATOM 0 HD11 LEU A 106 7.787 19.708 -14.873 1.00 0.00 H new ATOM 0 HD12 LEU A 106 7.454 18.234 -13.932 1.00 0.00 H new ATOM 0 HD13 LEU A 106 9.126 18.818 -14.110 1.00 0.00 H new ATOM 0 HD21 LEU A 106 8.870 19.556 -17.086 1.00 0.00 H new ATOM 0 HD22 LEU A 106 10.246 18.658 -16.402 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.322 17.972 -17.759 1.00 0.00 H new ATOM 1740 N GLY A 107 5.997 14.177 -14.837 1.00 0.00 N ATOM 1741 CA GLY A 107 4.863 13.576 -15.521 1.00 0.00 C ATOM 1742 C GLY A 107 3.542 14.250 -15.202 1.00 0.00 C ATOM 1743 O GLY A 107 2.485 13.679 -15.460 1.00 0.00 O ATOM 0 H GLY A 107 6.194 13.789 -13.915 1.00 0.00 H new ATOM 0 HA2 GLY A 107 5.033 13.617 -16.597 1.00 0.00 H new ATOM 0 HA3 GLY A 107 4.800 12.522 -15.249 1.00 0.00 H new ATOM 1747 N ASP A 108 3.612 15.464 -14.647 1.00 0.00 N ATOM 1748 CA ASP A 108 2.422 16.254 -14.295 1.00 0.00 C ATOM 1749 C ASP A 108 1.646 15.639 -13.130 1.00 0.00 C ATOM 1750 O ASP A 108 1.102 14.541 -13.229 1.00 0.00 O ATOM 1751 CB ASP A 108 1.486 16.441 -15.498 1.00 0.00 C ATOM 1752 CG ASP A 108 2.043 17.394 -16.536 1.00 0.00 C ATOM 1753 OD1 ASP A 108 1.920 18.620 -16.346 1.00 0.00 O ATOM 1754 OD2 ASP A 108 2.600 16.925 -17.552 1.00 0.00 O ATOM 0 H ASP A 108 4.493 15.929 -14.428 1.00 0.00 H new ATOM 0 HA ASP A 108 2.790 17.231 -13.983 1.00 0.00 H new ATOM 0 HB2 ASP A 108 1.302 15.472 -15.963 1.00 0.00 H new ATOM 0 HB3 ASP A 108 0.524 16.815 -15.148 1.00 0.00 H new ATOM 1759 N GLU A 109 1.579 16.375 -12.025 1.00 0.00 N ATOM 1760 CA GLU A 109 0.865 15.920 -10.833 1.00 0.00 C ATOM 1761 C GLU A 109 -0.647 15.959 -11.057 1.00 0.00 C ATOM 1762 O GLU A 109 -1.405 15.278 -10.370 1.00 0.00 O ATOM 1763 CB GLU A 109 1.229 16.794 -9.629 1.00 0.00 C ATOM 1764 CG GLU A 109 0.799 18.247 -9.783 1.00 0.00 C ATOM 1765 CD GLU A 109 1.108 19.088 -8.563 1.00 0.00 C ATOM 1766 OE1 GLU A 109 0.495 18.857 -7.502 1.00 0.00 O ATOM 1767 OE2 GLU A 109 1.950 20.000 -8.665 1.00 0.00 O ATOM 0 H GLU A 109 2.012 17.293 -11.929 1.00 0.00 H new ATOM 0 HA GLU A 109 1.163 14.891 -10.634 1.00 0.00 H new ATOM 0 HB2 GLU A 109 0.765 16.379 -8.735 1.00 0.00 H new ATOM 0 HB3 GLU A 109 2.307 16.757 -9.475 1.00 0.00 H new ATOM 0 HG2 GLU A 109 1.299 18.678 -10.651 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -0.272 18.284 -9.981 1.00 0.00 H new ATOM 1774 N GLU A 110 -1.065 16.754 -12.035 1.00 0.00 N ATOM 1775 CA GLU A 110 -2.480 16.974 -12.323 1.00 0.00 C ATOM 1776 C GLU A 110 -3.176 15.658 -12.671 1.00 0.00 C ATOM 1777 O GLU A 110 -4.328 15.429 -12.301 1.00 0.00 O ATOM 1778 CB GLU A 110 -2.601 17.978 -13.477 1.00 0.00 C ATOM 1779 CG GLU A 110 -3.916 18.742 -13.528 1.00 0.00 C ATOM 1780 CD GLU A 110 -5.069 17.932 -14.086 1.00 0.00 C ATOM 1781 OE1 GLU A 110 -6.043 17.694 -13.345 1.00 0.00 O ATOM 1782 OE2 GLU A 110 -5.017 17.553 -15.277 1.00 0.00 O ATOM 0 H GLU A 110 -0.433 17.265 -12.652 1.00 0.00 H new ATOM 0 HA GLU A 110 -2.972 17.378 -11.438 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -1.784 18.695 -13.402 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -2.471 17.444 -14.418 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -4.171 19.076 -12.522 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -3.783 19.636 -14.137 1.00 0.00 H new ATOM 1789 N LEU A 111 -2.447 14.781 -13.350 1.00 0.00 N ATOM 1790 CA LEU A 111 -2.994 13.508 -13.803 1.00 0.00 C ATOM 1791 C LEU A 111 -3.351 12.606 -12.622 1.00 0.00 C ATOM 1792 O LEU A 111 -4.254 11.774 -12.711 1.00 0.00 O ATOM 1793 CB LEU A 111 -1.988 12.800 -14.714 1.00 0.00 C ATOM 1794 CG LEU A 111 -1.529 13.613 -15.928 1.00 0.00 C ATOM 1795 CD1 LEU A 111 -0.567 12.799 -16.780 1.00 0.00 C ATOM 1796 CD2 LEU A 111 -2.724 14.068 -16.756 1.00 0.00 C ATOM 0 H LEU A 111 -1.469 14.930 -13.600 1.00 0.00 H new ATOM 0 HA LEU A 111 -3.907 13.713 -14.361 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -1.112 12.532 -14.123 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -2.432 11.869 -15.066 1.00 0.00 H new ATOM 0 HG LEU A 111 -1.007 14.500 -15.569 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.251 13.392 -17.638 1.00 0.00 H new ATOM 0 HD12 LEU A 111 0.305 12.527 -16.185 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -1.065 11.894 -17.128 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -2.375 14.644 -17.613 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -3.278 13.196 -17.105 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -3.376 14.690 -16.143 1.00 0.00 H new ATOM 1808 N LEU A 112 -2.661 12.800 -11.508 1.00 0.00 N ATOM 1809 CA LEU A 112 -2.863 11.972 -10.325 1.00 0.00 C ATOM 1810 C LEU A 112 -4.131 12.380 -9.580 1.00 0.00 C ATOM 1811 O LEU A 112 -4.611 11.654 -8.703 1.00 0.00 O ATOM 1812 CB LEU A 112 -1.658 12.084 -9.385 1.00 0.00 C ATOM 1813 CG LEU A 112 -0.313 11.666 -9.986 1.00 0.00 C ATOM 1814 CD1 LEU A 112 0.810 11.905 -8.987 1.00 0.00 C ATOM 1815 CD2 LEU A 112 -0.348 10.205 -10.413 1.00 0.00 C ATOM 0 H LEU A 112 -1.953 13.526 -11.397 1.00 0.00 H new ATOM 0 HA LEU A 112 -2.970 10.939 -10.655 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -1.579 13.117 -9.045 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -1.849 11.472 -8.504 1.00 0.00 H new ATOM 0 HG LEU A 112 -0.125 12.275 -10.870 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.760 11.603 -9.428 1.00 0.00 H new ATOM 0 HD12 LEU A 112 0.849 12.964 -8.730 1.00 0.00 H new ATOM 0 HD13 LEU A 112 0.626 11.320 -8.086 1.00 0.00 H new ATOM 0 HD21 LEU A 112 0.617 9.927 -10.838 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -0.558 9.578 -9.547 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -1.128 10.063 -11.161 1.00 0.00 H new ATOM 1827 N GLU A 113 -4.684 13.530 -9.938 1.00 0.00 N ATOM 1828 CA GLU A 113 -5.828 14.069 -9.224 1.00 0.00 C ATOM 1829 C GLU A 113 -6.968 14.417 -10.170 1.00 0.00 C ATOM 1830 O GLU A 113 -7.655 15.422 -9.989 1.00 0.00 O ATOM 1831 CB GLU A 113 -5.434 15.287 -8.389 1.00 0.00 C ATOM 1832 CG GLU A 113 -4.571 14.938 -7.187 1.00 0.00 C ATOM 1833 CD GLU A 113 -4.749 15.913 -6.045 1.00 0.00 C ATOM 1834 OE1 GLU A 113 -5.811 15.862 -5.384 1.00 0.00 O ATOM 1835 OE2 GLU A 113 -3.834 16.722 -5.792 1.00 0.00 O ATOM 0 H GLU A 113 -4.359 14.104 -10.716 1.00 0.00 H new ATOM 0 HA GLU A 113 -6.181 13.290 -8.549 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -4.896 15.994 -9.021 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -6.337 15.791 -8.045 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -4.819 13.933 -6.845 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -3.523 14.923 -7.488 1.00 0.00 H new ATOM 1842 N ARG A 114 -7.165 13.581 -11.182 1.00 0.00 N ATOM 1843 CA ARG A 114 -8.377 13.654 -11.988 1.00 0.00 C ATOM 1844 C ARG A 114 -9.559 13.173 -11.132 1.00 0.00 C ATOM 1845 O ARG A 114 -10.065 13.899 -10.283 1.00 0.00 O ATOM 1846 CB ARG A 114 -8.274 12.773 -13.244 1.00 0.00 C ATOM 1847 CG ARG A 114 -6.956 12.858 -14.005 1.00 0.00 C ATOM 1848 CD ARG A 114 -6.888 11.764 -15.064 1.00 0.00 C ATOM 1849 NE ARG A 114 -5.602 11.701 -15.763 1.00 0.00 N ATOM 1850 CZ ARG A 114 -4.854 10.596 -15.839 1.00 0.00 C ATOM 1851 NH1 ARG A 114 -5.135 9.564 -15.074 1.00 0.00 N ATOM 1852 NH2 ARG A 114 -3.806 10.533 -16.650 1.00 0.00 N ATOM 0 H ARG A 114 -6.509 12.852 -11.462 1.00 0.00 H new ATOM 0 HA ARG A 114 -8.520 14.685 -12.311 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -8.437 11.736 -12.952 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -9.082 13.044 -13.923 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -6.862 13.836 -14.476 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -6.121 12.756 -13.312 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -7.083 10.801 -14.592 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -7.681 11.927 -15.794 1.00 0.00 H new ATOM 0 HE ARG A 114 -5.258 12.547 -16.217 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -5.921 9.609 -14.426 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -4.567 8.719 -15.129 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -3.560 11.336 -17.229 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -3.246 9.681 -16.695 1.00 0.00 H new ATOM 1866 N GLU A 115 -9.959 11.924 -11.353 1.00 0.00 N ATOM 1867 CA GLU A 115 -10.948 11.227 -10.530 1.00 0.00 C ATOM 1868 C GLU A 115 -11.097 9.833 -11.110 1.00 0.00 C ATOM 1869 O GLU A 115 -10.857 9.665 -12.294 1.00 0.00 O ATOM 1870 CB GLU A 115 -12.299 11.953 -10.548 1.00 0.00 C ATOM 1871 CG GLU A 115 -13.350 11.303 -9.667 1.00 0.00 C ATOM 1872 CD GLU A 115 -12.910 11.228 -8.224 1.00 0.00 C ATOM 1873 OE1 GLU A 115 -13.303 12.112 -7.436 1.00 0.00 O ATOM 1874 OE2 GLU A 115 -12.153 10.296 -7.884 1.00 0.00 O ATOM 0 H GLU A 115 -9.600 11.357 -12.121 1.00 0.00 H new ATOM 0 HA GLU A 115 -10.619 11.194 -9.491 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -12.153 12.984 -10.224 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -12.668 11.990 -11.573 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -14.279 11.868 -9.734 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -13.561 10.299 -10.035 1.00 0.00 H new ATOM 1881 N LEU A 116 -11.471 8.836 -10.318 1.00 0.00 N ATOM 1882 CA LEU A 116 -11.578 7.475 -10.854 1.00 0.00 C ATOM 1883 C LEU A 116 -12.559 7.446 -12.029 1.00 0.00 C ATOM 1884 O LEU A 116 -12.307 6.802 -13.044 1.00 0.00 O ATOM 1885 CB LEU A 116 -11.997 6.465 -9.778 1.00 0.00 C ATOM 1886 CG LEU A 116 -12.122 5.019 -10.272 1.00 0.00 C ATOM 1887 CD1 LEU A 116 -10.778 4.501 -10.763 1.00 0.00 C ATOM 1888 CD2 LEU A 116 -12.671 4.119 -9.176 1.00 0.00 C ATOM 0 H LEU A 116 -11.701 8.933 -9.329 1.00 0.00 H new ATOM 0 HA LEU A 116 -10.589 7.180 -11.206 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -11.270 6.496 -8.967 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -12.954 6.776 -9.360 1.00 0.00 H new ATOM 0 HG LEU A 116 -12.822 5.006 -11.107 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -10.889 3.473 -11.109 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -10.426 5.125 -11.585 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -10.056 4.533 -9.947 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -12.751 3.098 -9.550 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -11.999 4.140 -8.318 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -13.657 4.473 -8.874 1.00 0.00 H new ATOM 1900 N ALA A 117 -13.648 8.196 -11.903 1.00 0.00 N ATOM 1901 CA ALA A 117 -14.633 8.304 -12.972 1.00 0.00 C ATOM 1902 C ALA A 117 -14.125 9.194 -14.111 1.00 0.00 C ATOM 1903 O ALA A 117 -14.760 9.303 -15.159 1.00 0.00 O ATOM 1904 CB ALA A 117 -15.944 8.845 -12.425 1.00 0.00 C ATOM 0 H ALA A 117 -13.871 8.739 -11.069 1.00 0.00 H new ATOM 0 HA ALA A 117 -14.801 7.306 -13.377 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -16.672 8.921 -13.233 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -16.324 8.171 -11.657 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -15.778 9.831 -11.992 1.00 0.00 H new ATOM 1910 N LEU A 118 -12.981 9.831 -13.892 1.00 0.00 N ATOM 1911 CA LEU A 118 -12.366 10.684 -14.903 1.00 0.00 C ATOM 1912 C LEU A 118 -11.152 10.005 -15.519 1.00 0.00 C ATOM 1913 O LEU A 118 -10.599 10.489 -16.508 1.00 0.00 O ATOM 1914 CB LEU A 118 -11.920 12.021 -14.305 1.00 0.00 C ATOM 1915 CG LEU A 118 -13.026 12.930 -13.772 1.00 0.00 C ATOM 1916 CD1 LEU A 118 -12.418 14.213 -13.225 1.00 0.00 C ATOM 1917 CD2 LEU A 118 -14.039 13.241 -14.864 1.00 0.00 C ATOM 0 H LEU A 118 -12.458 9.773 -13.018 1.00 0.00 H new ATOM 0 HA LEU A 118 -13.120 10.862 -15.670 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -11.225 11.816 -13.491 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -11.366 12.568 -15.068 1.00 0.00 H new ATOM 0 HG LEU A 118 -13.548 12.414 -12.966 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -13.210 14.858 -12.846 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -11.728 13.973 -12.416 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -11.880 14.728 -14.020 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -14.818 13.890 -14.464 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -13.539 13.743 -15.692 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -14.487 12.313 -15.220 1.00 0.00 H new ATOM 1929 N LEU A 119 -10.723 8.896 -14.930 1.00 0.00 N ATOM 1930 CA LEU A 119 -9.494 8.258 -15.361 1.00 0.00 C ATOM 1931 C LEU A 119 -9.742 7.233 -16.448 1.00 0.00 C ATOM 1932 O LEU A 119 -10.342 6.184 -16.219 1.00 0.00 O ATOM 1933 CB LEU A 119 -8.740 7.614 -14.191 1.00 0.00 C ATOM 1934 CG LEU A 119 -7.561 8.439 -13.665 1.00 0.00 C ATOM 1935 CD1 LEU A 119 -8.003 9.447 -12.630 1.00 0.00 C ATOM 1936 CD2 LEU A 119 -6.475 7.554 -13.096 1.00 0.00 C ATOM 0 H LEU A 119 -11.204 8.427 -14.162 1.00 0.00 H new ATOM 0 HA LEU A 119 -8.868 9.049 -15.773 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -9.441 7.443 -13.374 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -8.372 6.637 -14.506 1.00 0.00 H new ATOM 0 HG LEU A 119 -7.153 8.981 -14.518 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -7.139 10.013 -12.281 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -8.729 10.129 -13.073 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -8.461 8.927 -11.788 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -5.655 8.173 -12.732 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -6.879 6.966 -12.272 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -6.107 6.884 -13.873 1.00 0.00 H new ATOM 1948 N VAL A 120 -9.287 7.570 -17.638 1.00 0.00 N ATOM 1949 CA VAL A 120 -9.240 6.635 -18.739 1.00 0.00 C ATOM 1950 C VAL A 120 -7.800 6.177 -18.886 1.00 0.00 C ATOM 1951 O VAL A 120 -6.877 6.911 -18.529 1.00 0.00 O ATOM 1952 CB VAL A 120 -9.737 7.264 -20.064 1.00 0.00 C ATOM 1953 CG1 VAL A 120 -9.769 6.232 -21.185 1.00 0.00 C ATOM 1954 CG2 VAL A 120 -11.112 7.891 -19.876 1.00 0.00 C ATOM 0 H VAL A 120 -8.940 8.501 -17.867 1.00 0.00 H new ATOM 0 HA VAL A 120 -9.904 5.797 -18.526 1.00 0.00 H new ATOM 0 HB VAL A 120 -9.034 8.047 -20.348 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -10.122 6.702 -22.103 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -8.766 5.835 -21.343 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -10.442 5.419 -20.912 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -11.445 8.328 -20.818 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -11.821 7.125 -19.561 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -11.056 8.669 -19.115 1.00 0.00 H new ATOM 1964 N SER A 121 -7.609 4.971 -19.381 1.00 0.00 N ATOM 1965 CA SER A 121 -6.285 4.395 -19.496 1.00 0.00 C ATOM 1966 C SER A 121 -5.391 5.220 -20.414 1.00 0.00 C ATOM 1967 O SER A 121 -5.874 6.066 -21.176 1.00 0.00 O ATOM 1968 CB SER A 121 -6.390 2.972 -20.038 1.00 0.00 C ATOM 1969 OG SER A 121 -5.107 2.404 -20.225 1.00 0.00 O ATOM 0 H SER A 121 -8.361 4.367 -19.713 1.00 0.00 H new ATOM 0 HA SER A 121 -5.837 4.387 -18.503 1.00 0.00 H new ATOM 0 HB2 SER A 121 -6.966 2.357 -19.347 1.00 0.00 H new ATOM 0 HB3 SER A 121 -6.930 2.979 -20.985 1.00 0.00 H new ATOM 0 HG SER A 121 -5.191 1.433 -20.324 1.00 0.00 H new ATOM 1975 N ALA A 122 -4.080 4.983 -20.316 1.00 0.00 N ATOM 1976 CA ALA A 122 -3.130 5.458 -21.308 1.00 0.00 C ATOM 1977 C ALA A 122 -3.678 5.229 -22.711 1.00 0.00 C ATOM 1978 O ALA A 122 -3.529 6.066 -23.597 1.00 0.00 O ATOM 1979 CB ALA A 122 -1.802 4.732 -21.142 1.00 0.00 C ATOM 0 H ALA A 122 -3.656 4.460 -19.550 1.00 0.00 H new ATOM 0 HA ALA A 122 -2.972 6.527 -21.163 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -1.094 5.093 -21.889 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -1.406 4.922 -20.145 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -1.954 3.661 -21.274 1.00 0.00 H new ATOM 1985 N HIS A 123 -4.332 4.092 -22.896 1.00 0.00 N ATOM 1986 CA HIS A 123 -5.001 3.804 -24.149 1.00 0.00 C ATOM 1987 C HIS A 123 -6.385 4.445 -24.168 1.00 0.00 C ATOM 1988 O HIS A 123 -7.373 3.843 -23.750 1.00 0.00 O ATOM 1989 CB HIS A 123 -5.102 2.293 -24.379 1.00 0.00 C ATOM 1990 CG HIS A 123 -5.854 1.919 -25.623 1.00 0.00 C ATOM 1991 ND1 HIS A 123 -5.286 1.913 -26.873 1.00 0.00 N ATOM 1992 CD2 HIS A 123 -7.141 1.537 -25.793 1.00 0.00 C ATOM 1993 CE1 HIS A 123 -6.188 1.542 -27.763 1.00 0.00 C ATOM 1994 NE2 HIS A 123 -7.324 1.306 -27.135 1.00 0.00 N ATOM 0 H HIS A 123 -4.412 3.357 -22.194 1.00 0.00 H new ATOM 0 HA HIS A 123 -4.410 4.229 -24.960 1.00 0.00 H new ATOM 0 HB2 HIS A 123 -4.097 1.875 -24.434 1.00 0.00 H new ATOM 0 HB3 HIS A 123 -5.591 1.836 -23.519 1.00 0.00 H new ATOM 0 HD2 HIS A 123 -7.886 1.433 -25.018 1.00 0.00 H new ATOM 0 HE1 HIS A 123 -6.024 1.448 -28.826 1.00 0.00 H new ATOM 0 HE2 HIS A 123 -8.194 1.002 -27.573 1.00 0.00 H new ATOM 2003 N ASP A 124 -6.429 5.690 -24.604 1.00 0.00 N ATOM 2004 CA ASP A 124 -7.689 6.386 -24.838 1.00 0.00 C ATOM 2005 C ASP A 124 -7.901 6.519 -26.337 1.00 0.00 C ATOM 2006 O ASP A 124 -9.022 6.677 -26.824 1.00 0.00 O ATOM 2007 CB ASP A 124 -7.668 7.769 -24.172 1.00 0.00 C ATOM 2008 CG ASP A 124 -8.899 8.603 -24.485 1.00 0.00 C ATOM 2009 OD1 ASP A 124 -8.788 9.559 -25.283 1.00 0.00 O ATOM 2010 OD2 ASP A 124 -9.980 8.322 -23.927 1.00 0.00 O ATOM 0 H ASP A 124 -5.600 6.248 -24.806 1.00 0.00 H new ATOM 0 HA ASP A 124 -8.510 5.817 -24.402 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -7.587 7.644 -23.092 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -6.779 8.309 -24.498 1.00 0.00 H new ATOM 2015 N ASP A 125 -6.801 6.404 -27.059 1.00 0.00 N ATOM 2016 CA ASP A 125 -6.782 6.575 -28.497 1.00 0.00 C ATOM 2017 C ASP A 125 -5.684 5.713 -29.093 1.00 0.00 C ATOM 2018 O ASP A 125 -5.873 5.196 -30.211 1.00 0.00 O ATOM 2019 CB ASP A 125 -6.567 8.049 -28.865 1.00 0.00 C ATOM 2020 CG ASP A 125 -5.353 8.661 -28.188 1.00 0.00 C ATOM 2021 OD1 ASP A 125 -5.447 9.008 -26.992 1.00 0.00 O ATOM 2022 OD2 ASP A 125 -4.310 8.827 -28.852 1.00 0.00 O ATOM 0 H ASP A 125 -5.888 6.187 -26.658 1.00 0.00 H new ATOM 0 HA ASP A 125 -7.744 6.264 -28.905 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -6.455 8.135 -29.946 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -7.455 8.619 -28.591 1.00 0.00 H new TER 2027 ASP A 125