USER MOD reduce.3.24.130724 H: found=0, std=0, add=1006, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 1000 hydrogens (45 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 72 HIS : no HD1:sc= -2.62! C(o=-2.6!,f=-2.9!) USER MOD Set 1.2: A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -128:sc= 0.0603 (180deg=-0.49) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 HIS : no HD1:sc= -0.419 X(o=-0.42,f=-0.42) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= -0.221 K(o=-0.22,f=-2.1!) USER MOD Single : A 54 GLN : amide:sc= 0.2! C(o=0.2!,f=-7.5!) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= -0.143 X(o=-0.14,f=-0.33) USER MOD Single : A 73 MET CE :methyl 152:sc= -0.0952 (180deg=-0.989) USER MOD Single : A 75 ASN :FLIP amide:sc= -4.23! C(o=-5!,f=-4.2!) USER MOD Single : A 92 HIS : no HE2:sc= -1.17! C(o=-1.2!,f=-12!) USER MOD Single : A 99 GLN : amide:sc= -0.0387 K(o=-0.039,f=-0.88) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot -44:sc= 0.372 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 113 ASN : amide:sc= -2.75! C(o=-2.8!,f=-6.1!) USER MOD Single : A 121 THR OG1 : rot 130:sc= -2.48 USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 76.878 24.857 -21.805 1.00 1.00 N ATOM 2 CA MET A 1 77.312 23.459 -22.090 1.00 1.00 C ATOM 3 C MET A 1 76.123 22.518 -21.893 1.00 1.00 C ATOM 4 O MET A 1 75.103 22.913 -21.330 1.00 1.00 O ATOM 5 CB MET A 1 78.444 23.075 -21.134 1.00 1.00 C ATOM 6 CG MET A 1 79.686 23.925 -21.427 1.00 1.00 C ATOM 7 SD MET A 1 80.974 23.531 -20.215 1.00 1.00 S ATOM 8 CE MET A 1 82.060 24.937 -20.560 1.00 1.00 C ATOM 0 H1 MET A 1 77.139 25.471 -22.603 1.00 1.00 H new ATOM 0 H2 MET A 1 75.847 24.880 -21.673 1.00 1.00 H new ATOM 0 H3 MET A 1 77.345 25.196 -20.940 1.00 1.00 H new ATOM 0 HA MET A 1 77.670 23.382 -23.117 1.00 1.00 H new ATOM 0 HB2 MET A 1 78.126 23.224 -20.102 1.00 1.00 H new ATOM 0 HB3 MET A 1 78.682 22.017 -21.245 1.00 1.00 H new ATOM 0 HG2 MET A 1 80.047 23.728 -22.437 1.00 1.00 H new ATOM 0 HG3 MET A 1 79.436 24.985 -21.379 1.00 1.00 H new ATOM 0 HE1 MET A 1 82.934 24.890 -19.910 1.00 1.00 H new ATOM 0 HE2 MET A 1 82.380 24.903 -21.602 1.00 1.00 H new ATOM 0 HE3 MET A 1 81.521 25.867 -20.376 1.00 1.00 H new ATOM 18 N SER A 2 76.257 21.278 -22.371 1.00 1.00 N ATOM 19 CA SER A 2 75.196 20.271 -22.263 1.00 1.00 C ATOM 20 C SER A 2 75.526 19.244 -21.179 1.00 1.00 C ATOM 21 O SER A 2 74.835 18.236 -21.049 1.00 1.00 O ATOM 22 CB SER A 2 75.019 19.558 -23.605 1.00 1.00 C ATOM 23 OG SER A 2 76.261 18.994 -24.006 1.00 1.00 O ATOM 0 H SER A 2 77.098 20.944 -22.841 1.00 1.00 H new ATOM 0 HA SER A 2 74.270 20.778 -21.991 1.00 1.00 H new ATOM 0 HB2 SER A 2 74.263 18.777 -23.518 1.00 1.00 H new ATOM 0 HB3 SER A 2 74.666 20.261 -24.359 1.00 1.00 H new ATOM 0 HG SER A 2 76.150 18.535 -24.865 1.00 1.00 H new ATOM 29 N ASP A 3 76.573 19.522 -20.401 1.00 1.00 N ATOM 30 CA ASP A 3 76.986 18.629 -19.314 1.00 1.00 C ATOM 31 C ASP A 3 78.386 18.994 -18.811 1.00 1.00 C ATOM 32 O ASP A 3 79.387 18.605 -19.413 1.00 1.00 O ATOM 33 CB ASP A 3 76.942 17.157 -19.791 1.00 1.00 C ATOM 34 CG ASP A 3 77.873 16.267 -18.963 1.00 1.00 C ATOM 35 OD1 ASP A 3 77.697 16.219 -17.757 1.00 1.00 O ATOM 36 OD2 ASP A 3 78.743 15.647 -19.552 1.00 1.00 O ATOM 0 H ASP A 3 77.151 20.357 -20.502 1.00 1.00 H new ATOM 0 HA ASP A 3 76.290 18.748 -18.483 1.00 1.00 H new ATOM 0 HB2 ASP A 3 75.921 16.782 -19.720 1.00 1.00 H new ATOM 0 HB3 ASP A 3 77.228 17.106 -20.841 1.00 1.00 H new ATOM 41 N PHE A 4 78.448 19.733 -17.700 1.00 1.00 N ATOM 42 CA PHE A 4 79.729 20.132 -17.120 1.00 1.00 C ATOM 43 C PHE A 4 79.596 20.275 -15.606 1.00 1.00 C ATOM 44 O PHE A 4 78.554 20.702 -15.105 1.00 1.00 O ATOM 45 CB PHE A 4 80.185 21.464 -17.716 1.00 1.00 C ATOM 46 CG PHE A 4 81.588 21.774 -17.247 1.00 1.00 C ATOM 47 CD1 PHE A 4 82.682 21.173 -17.881 1.00 1.00 C ATOM 48 CD2 PHE A 4 81.797 22.660 -16.181 1.00 1.00 C ATOM 49 CE1 PHE A 4 83.984 21.456 -17.452 1.00 1.00 C ATOM 50 CE2 PHE A 4 83.100 22.942 -15.752 1.00 1.00 C ATOM 51 CZ PHE A 4 84.194 22.341 -16.388 1.00 1.00 C ATOM 0 H PHE A 4 77.630 20.064 -17.188 1.00 1.00 H new ATOM 0 HA PHE A 4 80.468 19.364 -17.348 1.00 1.00 H new ATOM 0 HB2 PHE A 4 80.157 21.416 -18.805 1.00 1.00 H new ATOM 0 HB3 PHE A 4 79.505 22.261 -17.414 1.00 1.00 H new ATOM 0 HD1 PHE A 4 82.521 20.490 -18.702 1.00 1.00 H new ATOM 0 HD2 PHE A 4 80.954 23.125 -15.691 1.00 1.00 H new ATOM 0 HE1 PHE A 4 84.827 20.991 -17.942 1.00 1.00 H new ATOM 0 HE2 PHE A 4 83.262 23.624 -14.930 1.00 1.00 H new ATOM 0 HZ PHE A 4 85.199 22.560 -16.058 1.00 1.00 H new ATOM 61 N ASP A 5 80.653 19.917 -14.881 1.00 1.00 N ATOM 62 CA ASP A 5 80.649 20.007 -13.422 1.00 1.00 C ATOM 63 C ASP A 5 82.070 20.224 -12.911 1.00 1.00 C ATOM 64 O ASP A 5 83.028 19.741 -13.514 1.00 1.00 O ATOM 65 CB ASP A 5 80.090 18.714 -12.829 1.00 1.00 C ATOM 66 CG ASP A 5 78.603 18.584 -13.146 1.00 1.00 C ATOM 67 OD1 ASP A 5 77.842 19.415 -12.677 1.00 1.00 O ATOM 68 OD2 ASP A 5 78.249 17.657 -13.856 1.00 1.00 O ATOM 0 H ASP A 5 81.523 19.562 -15.279 1.00 1.00 H new ATOM 0 HA ASP A 5 80.025 20.848 -13.120 1.00 1.00 H new ATOM 0 HB2 ASP A 5 80.631 17.858 -13.232 1.00 1.00 H new ATOM 0 HB3 ASP A 5 80.240 18.706 -11.749 1.00 1.00 H new ATOM 73 N THR A 6 82.214 20.948 -11.802 1.00 1.00 N ATOM 74 CA THR A 6 83.545 21.198 -11.256 1.00 1.00 C ATOM 75 C THR A 6 84.137 19.892 -10.705 1.00 1.00 C ATOM 76 O THR A 6 83.495 18.862 -10.719 1.00 1.00 O ATOM 77 CB THR A 6 83.486 22.293 -10.165 1.00 1.00 C ATOM 78 OG1 THR A 6 82.760 23.411 -10.656 1.00 1.00 O ATOM 79 CG2 THR A 6 84.899 22.748 -9.770 1.00 1.00 C ATOM 0 H THR A 6 81.445 21.363 -11.275 1.00 1.00 H new ATOM 0 HA THR A 6 84.196 21.560 -12.052 1.00 1.00 H new ATOM 0 HB THR A 6 82.992 21.878 -9.287 1.00 1.00 H new ATOM 0 HG1 THR A 6 82.721 24.105 -9.965 1.00 1.00 H new ATOM 0 HG21 THR A 6 84.832 23.518 -9.002 1.00 1.00 H new ATOM 0 HG22 THR A 6 85.460 21.897 -9.383 1.00 1.00 H new ATOM 0 HG23 THR A 6 85.409 23.152 -10.645 1.00 1.00 H new ATOM 87 N GLU A 7 85.380 19.961 -10.283 1.00 1.00 N ATOM 88 CA GLU A 7 86.107 18.789 -9.767 1.00 1.00 C ATOM 89 C GLU A 7 85.391 18.234 -8.540 1.00 1.00 C ATOM 90 O GLU A 7 85.089 17.056 -8.450 1.00 1.00 O ATOM 91 CB GLU A 7 87.528 19.228 -9.394 1.00 1.00 C ATOM 92 CG GLU A 7 88.395 18.020 -9.035 1.00 1.00 C ATOM 93 CD GLU A 7 89.804 18.492 -8.689 1.00 1.00 C ATOM 94 OE1 GLU A 7 89.974 19.682 -8.480 1.00 1.00 O ATOM 95 OE2 GLU A 7 90.694 17.658 -8.642 1.00 1.00 O ATOM 0 H GLU A 7 85.927 20.822 -10.282 1.00 1.00 H new ATOM 0 HA GLU A 7 86.147 18.007 -10.526 1.00 1.00 H new ATOM 0 HB2 GLU A 7 87.977 19.768 -10.228 1.00 1.00 H new ATOM 0 HB3 GLU A 7 87.491 19.918 -8.551 1.00 1.00 H new ATOM 0 HG2 GLU A 7 87.961 17.485 -8.190 1.00 1.00 H new ATOM 0 HG3 GLU A 7 88.429 17.321 -9.871 1.00 1.00 H new ATOM 102 N ARG A 8 85.167 19.102 -7.586 1.00 1.00 N ATOM 103 CA ARG A 8 84.514 18.653 -6.352 1.00 1.00 C ATOM 104 C ARG A 8 83.209 17.934 -6.731 1.00 1.00 C ATOM 105 O ARG A 8 82.998 16.767 -6.412 1.00 1.00 O ATOM 106 CB ARG A 8 84.173 19.851 -5.463 1.00 1.00 C ATOM 107 CG ARG A 8 83.737 19.362 -4.062 1.00 1.00 C ATOM 108 CD ARG A 8 82.695 20.318 -3.473 1.00 1.00 C ATOM 109 NE ARG A 8 83.176 21.704 -3.530 1.00 1.00 N ATOM 110 CZ ARG A 8 82.600 22.635 -4.307 1.00 1.00 C ATOM 111 NH1 ARG A 8 81.627 22.323 -5.123 1.00 1.00 N ATOM 112 NH2 ARG A 8 83.030 23.867 -4.266 1.00 1.00 N ATOM 0 H ARG A 8 85.411 20.092 -7.621 1.00 1.00 H new ATOM 0 HA ARG A 8 85.185 17.987 -5.809 1.00 1.00 H new ATOM 0 HB2 ARG A 8 85.039 20.507 -5.375 1.00 1.00 H new ATOM 0 HB3 ARG A 8 83.374 20.436 -5.918 1.00 1.00 H new ATOM 0 HG2 ARG A 8 83.322 18.357 -4.132 1.00 1.00 H new ATOM 0 HG3 ARG A 8 84.603 19.304 -3.402 1.00 1.00 H new ATOM 0 HD2 ARG A 8 81.759 20.229 -4.024 1.00 1.00 H new ATOM 0 HD3 ARG A 8 82.484 20.043 -2.440 1.00 1.00 H new ATOM 0 HE ARG A 8 83.978 21.969 -2.958 1.00 1.00 H new ATOM 0 HH11 ARG A 8 81.295 21.360 -5.176 1.00 1.00 H new ATOM 0 HH12 ARG A 8 81.200 23.043 -5.707 1.00 1.00 H new ATOM 0 HH21 ARG A 8 83.800 24.118 -3.646 1.00 1.00 H new ATOM 0 HH22 ARG A 8 82.596 24.578 -4.854 1.00 1.00 H new ATOM 126 N VAL A 9 82.374 18.676 -7.432 1.00 1.00 N ATOM 127 CA VAL A 9 81.088 18.123 -7.873 1.00 1.00 C ATOM 128 C VAL A 9 81.318 16.971 -8.878 1.00 1.00 C ATOM 129 O VAL A 9 80.739 15.913 -8.736 1.00 1.00 O ATOM 130 CB VAL A 9 80.125 19.207 -8.420 1.00 1.00 C ATOM 131 CG1 VAL A 9 79.197 19.688 -7.292 1.00 1.00 C ATOM 132 CG2 VAL A 9 80.921 20.399 -8.937 1.00 1.00 C ATOM 0 H VAL A 9 82.547 19.642 -7.708 1.00 1.00 H new ATOM 0 HA VAL A 9 80.585 17.711 -6.998 1.00 1.00 H new ATOM 0 HB VAL A 9 79.538 18.777 -9.232 1.00 1.00 H new ATOM 0 HG11 VAL A 9 78.520 20.450 -7.678 1.00 1.00 H new ATOM 0 HG12 VAL A 9 78.617 18.846 -6.914 1.00 1.00 H new ATOM 0 HG13 VAL A 9 79.795 20.109 -6.484 1.00 1.00 H new ATOM 0 HG21 VAL A 9 80.236 21.156 -9.319 1.00 1.00 H new ATOM 0 HG22 VAL A 9 81.512 20.822 -8.125 1.00 1.00 H new ATOM 0 HG23 VAL A 9 81.585 20.073 -9.737 1.00 1.00 H new ATOM 142 N SER A 10 82.176 17.185 -9.865 1.00 1.00 N ATOM 143 CA SER A 10 82.438 16.113 -10.846 1.00 1.00 C ATOM 144 C SER A 10 83.066 14.913 -10.120 1.00 1.00 C ATOM 145 O SER A 10 82.538 13.816 -10.189 1.00 1.00 O ATOM 146 CB SER A 10 83.383 16.568 -11.965 1.00 1.00 C ATOM 147 OG SER A 10 83.533 15.507 -12.903 1.00 1.00 O ATOM 0 H SER A 10 82.691 18.052 -10.016 1.00 1.00 H new ATOM 0 HA SER A 10 81.487 15.842 -11.303 1.00 1.00 H new ATOM 0 HB2 SER A 10 82.983 17.454 -12.459 1.00 1.00 H new ATOM 0 HB3 SER A 10 84.352 16.844 -11.550 1.00 1.00 H new ATOM 0 HG SER A 10 84.135 15.790 -13.623 1.00 1.00 H new ATOM 153 N ARG A 11 84.216 15.127 -9.492 1.00 1.00 N ATOM 154 CA ARG A 11 84.944 14.047 -8.802 1.00 1.00 C ATOM 155 C ARG A 11 84.132 13.504 -7.611 1.00 1.00 C ATOM 156 O ARG A 11 83.869 12.320 -7.525 1.00 1.00 O ATOM 157 CB ARG A 11 86.289 14.606 -8.313 1.00 1.00 C ATOM 158 CG ARG A 11 87.284 13.468 -8.023 1.00 1.00 C ATOM 159 CD ARG A 11 87.695 12.744 -9.325 1.00 1.00 C ATOM 160 NE ARG A 11 89.128 12.440 -9.296 1.00 1.00 N ATOM 161 CZ ARG A 11 89.810 12.195 -10.413 1.00 1.00 C ATOM 162 NH1 ARG A 11 89.200 12.201 -11.568 1.00 1.00 N ATOM 163 NH2 ARG A 11 91.092 11.944 -10.355 1.00 1.00 N ATOM 0 H ARG A 11 84.673 16.038 -9.441 1.00 1.00 H new ATOM 0 HA ARG A 11 85.106 13.221 -9.494 1.00 1.00 H new ATOM 0 HB2 ARG A 11 86.705 15.275 -9.066 1.00 1.00 H new ATOM 0 HB3 ARG A 11 86.135 15.198 -7.411 1.00 1.00 H new ATOM 0 HG2 ARG A 11 88.170 13.871 -7.532 1.00 1.00 H new ATOM 0 HG3 ARG A 11 86.834 12.754 -7.333 1.00 1.00 H new ATOM 0 HD2 ARG A 11 87.121 11.824 -9.436 1.00 1.00 H new ATOM 0 HD3 ARG A 11 87.465 13.369 -10.187 1.00 1.00 H new ATOM 0 HE ARG A 11 89.614 12.415 -8.400 1.00 1.00 H new ATOM 0 HH11 ARG A 11 88.199 12.394 -11.615 1.00 1.00 H new ATOM 0 HH12 ARG A 11 89.724 12.013 -12.423 1.00 1.00 H new ATOM 0 HH21 ARG A 11 91.570 11.936 -9.454 1.00 1.00 H new ATOM 0 HH22 ARG A 11 91.614 11.756 -11.211 1.00 1.00 H new ATOM 177 N ALA A 12 83.755 14.379 -6.692 1.00 1.00 N ATOM 178 CA ALA A 12 82.991 13.880 -5.520 1.00 1.00 C ATOM 179 C ALA A 12 81.824 13.057 -6.073 1.00 1.00 C ATOM 180 O ALA A 12 81.617 11.902 -5.705 1.00 1.00 O ATOM 181 CB ALA A 12 82.445 14.983 -4.603 1.00 1.00 C ATOM 0 H ALA A 12 83.942 15.382 -6.711 1.00 1.00 H new ATOM 0 HA ALA A 12 83.670 13.298 -4.898 1.00 1.00 H new ATOM 0 HB1 ALA A 12 81.901 14.531 -3.774 1.00 1.00 H new ATOM 0 HB2 ALA A 12 83.273 15.575 -4.214 1.00 1.00 H new ATOM 0 HB3 ALA A 12 81.773 15.627 -5.169 1.00 1.00 H new ATOM 187 N VAL A 13 81.101 13.662 -6.992 1.00 1.00 N ATOM 188 CA VAL A 13 79.996 12.929 -7.601 1.00 1.00 C ATOM 189 C VAL A 13 80.565 11.698 -8.322 1.00 1.00 C ATOM 190 O VAL A 13 80.112 10.609 -8.089 1.00 1.00 O ATOM 191 CB VAL A 13 79.133 13.758 -8.572 1.00 1.00 C ATOM 192 CG1 VAL A 13 78.022 12.860 -9.132 1.00 1.00 C ATOM 193 CG2 VAL A 13 78.480 14.942 -7.834 1.00 1.00 C ATOM 0 H VAL A 13 81.242 14.615 -7.327 1.00 1.00 H new ATOM 0 HA VAL A 13 79.323 12.646 -6.792 1.00 1.00 H new ATOM 0 HB VAL A 13 79.766 14.140 -9.373 1.00 1.00 H new ATOM 0 HG11 VAL A 13 77.403 13.434 -9.821 1.00 1.00 H new ATOM 0 HG12 VAL A 13 78.467 12.017 -9.660 1.00 1.00 H new ATOM 0 HG13 VAL A 13 77.406 12.490 -8.313 1.00 1.00 H new ATOM 0 HG21 VAL A 13 77.874 15.517 -8.534 1.00 1.00 H new ATOM 0 HG22 VAL A 13 77.847 14.565 -7.030 1.00 1.00 H new ATOM 0 HG23 VAL A 13 79.256 15.582 -7.415 1.00 1.00 H new ATOM 203 N ALA A 14 81.587 11.848 -9.162 1.00 1.00 N ATOM 204 CA ALA A 14 82.120 10.652 -9.831 1.00 1.00 C ATOM 205 C ALA A 14 82.589 9.643 -8.778 1.00 1.00 C ATOM 206 O ALA A 14 82.101 8.532 -8.736 1.00 1.00 O ATOM 207 CB ALA A 14 83.279 11.002 -10.775 1.00 1.00 C ATOM 0 H ALA A 14 82.045 12.730 -9.391 1.00 1.00 H new ATOM 0 HA ALA A 14 81.323 10.215 -10.433 1.00 1.00 H new ATOM 0 HB1 ALA A 14 83.647 10.093 -11.251 1.00 1.00 H new ATOM 0 HB2 ALA A 14 82.929 11.696 -11.539 1.00 1.00 H new ATOM 0 HB3 ALA A 14 84.085 11.465 -10.206 1.00 1.00 H new ATOM 213 N ALA A 15 83.555 10.031 -7.964 1.00 1.00 N ATOM 214 CA ALA A 15 84.100 9.126 -6.940 1.00 1.00 C ATOM 215 C ALA A 15 82.976 8.556 -6.077 1.00 1.00 C ATOM 216 O ALA A 15 82.811 7.349 -5.949 1.00 1.00 O ATOM 217 CB ALA A 15 85.048 9.911 -6.030 1.00 1.00 C ATOM 0 H ALA A 15 83.982 10.957 -7.983 1.00 1.00 H new ATOM 0 HA ALA A 15 84.625 8.312 -7.440 1.00 1.00 H new ATOM 0 HB1 ALA A 15 85.455 9.246 -5.269 1.00 1.00 H new ATOM 0 HB2 ALA A 15 85.863 10.325 -6.624 1.00 1.00 H new ATOM 0 HB3 ALA A 15 84.502 10.722 -5.548 1.00 1.00 H new ATOM 223 N ALA A 16 82.233 9.456 -5.483 1.00 1.00 N ATOM 224 CA ALA A 16 81.139 9.038 -4.615 1.00 1.00 C ATOM 225 C ALA A 16 80.118 8.247 -5.455 1.00 1.00 C ATOM 226 O ALA A 16 79.711 7.140 -5.106 1.00 1.00 O ATOM 227 CB ALA A 16 80.489 10.264 -3.953 1.00 1.00 C ATOM 0 H ALA A 16 82.354 10.465 -5.575 1.00 1.00 H new ATOM 0 HA ALA A 16 81.515 8.397 -3.818 1.00 1.00 H new ATOM 0 HB1 ALA A 16 79.673 9.939 -3.307 1.00 1.00 H new ATOM 0 HB2 ALA A 16 81.233 10.794 -3.359 1.00 1.00 H new ATOM 0 HB3 ALA A 16 80.099 10.929 -4.723 1.00 1.00 H new ATOM 233 N LEU A 17 79.698 8.877 -6.534 1.00 1.00 N ATOM 234 CA LEU A 17 78.683 8.230 -7.387 1.00 1.00 C ATOM 235 C LEU A 17 79.217 6.861 -7.843 1.00 1.00 C ATOM 236 O LEU A 17 78.546 5.849 -7.656 1.00 1.00 O ATOM 237 CB LEU A 17 78.253 9.041 -8.626 1.00 1.00 C ATOM 238 CG LEU A 17 77.019 8.369 -9.280 1.00 1.00 C ATOM 239 CD1 LEU A 17 75.729 8.910 -8.654 1.00 1.00 C ATOM 240 CD2 LEU A 17 77.008 8.653 -10.786 1.00 1.00 C ATOM 0 H LEU A 17 80.017 9.795 -6.844 1.00 1.00 H new ATOM 0 HA LEU A 17 77.789 8.142 -6.770 1.00 1.00 H new ATOM 0 HB2 LEU A 17 78.013 10.065 -8.339 1.00 1.00 H new ATOM 0 HB3 LEU A 17 79.073 9.094 -9.342 1.00 1.00 H new ATOM 0 HG LEU A 17 77.077 7.294 -9.112 1.00 1.00 H new ATOM 0 HD11 LEU A 17 74.869 8.431 -9.121 1.00 1.00 H new ATOM 0 HD12 LEU A 17 75.726 8.697 -7.585 1.00 1.00 H new ATOM 0 HD13 LEU A 17 75.673 9.987 -8.810 1.00 1.00 H new ATOM 0 HD21 LEU A 17 76.138 8.178 -11.240 1.00 1.00 H new ATOM 0 HD22 LEU A 17 76.962 9.729 -10.953 1.00 1.00 H new ATOM 0 HD23 LEU A 17 77.916 8.254 -11.238 1.00 1.00 H new ATOM 252 N VAL A 18 80.420 6.821 -8.425 1.00 1.00 N ATOM 253 CA VAL A 18 80.971 5.531 -8.858 1.00 1.00 C ATOM 254 C VAL A 18 81.311 4.673 -7.627 1.00 1.00 C ATOM 255 O VAL A 18 80.840 3.542 -7.508 1.00 1.00 O ATOM 256 CB VAL A 18 82.197 5.685 -9.807 1.00 1.00 C ATOM 257 CG1 VAL A 18 81.927 6.771 -10.891 1.00 1.00 C ATOM 258 CG2 VAL A 18 83.488 6.021 -9.024 1.00 1.00 C ATOM 0 H VAL A 18 81.012 7.632 -8.603 1.00 1.00 H new ATOM 0 HA VAL A 18 80.206 5.023 -9.446 1.00 1.00 H new ATOM 0 HB VAL A 18 82.345 4.725 -10.301 1.00 1.00 H new ATOM 0 HG11 VAL A 18 82.797 6.860 -11.541 1.00 1.00 H new ATOM 0 HG12 VAL A 18 81.058 6.485 -11.484 1.00 1.00 H new ATOM 0 HG13 VAL A 18 81.736 7.729 -10.407 1.00 1.00 H new ATOM 0 HG21 VAL A 18 84.321 6.120 -9.721 1.00 1.00 H new ATOM 0 HG22 VAL A 18 83.353 6.958 -8.484 1.00 1.00 H new ATOM 0 HG23 VAL A 18 83.702 5.221 -8.315 1.00 1.00 H new ATOM 268 N GLY A 19 82.144 5.206 -6.728 1.00 1.00 N ATOM 269 CA GLY A 19 82.560 4.483 -5.530 1.00 1.00 C ATOM 270 C GLY A 19 81.387 4.188 -4.601 1.00 1.00 C ATOM 271 O GLY A 19 80.233 4.351 -4.981 1.00 1.00 O ATOM 0 H GLY A 19 82.543 6.141 -6.811 1.00 1.00 H new ATOM 0 HA2 GLY A 19 83.037 3.547 -5.820 1.00 1.00 H new ATOM 0 HA3 GLY A 19 83.307 5.069 -4.995 1.00 1.00 H new ATOM 275 N PRO A 20 81.661 3.733 -3.402 1.00 1.00 N ATOM 276 CA PRO A 20 80.609 3.388 -2.408 1.00 1.00 C ATOM 277 C PRO A 20 80.033 4.621 -1.690 1.00 1.00 C ATOM 278 O PRO A 20 78.942 4.564 -1.144 1.00 1.00 O ATOM 279 CB PRO A 20 81.329 2.434 -1.416 1.00 1.00 C ATOM 280 CG PRO A 20 82.774 2.368 -1.853 1.00 1.00 C ATOM 281 CD PRO A 20 82.996 3.515 -2.842 1.00 1.00 C ATOM 0 HA PRO A 20 79.741 2.931 -2.884 1.00 1.00 H new ATOM 0 HB2 PRO A 20 81.250 2.806 -0.394 1.00 1.00 H new ATOM 0 HB3 PRO A 20 80.874 1.444 -1.431 1.00 1.00 H new ATOM 0 HG2 PRO A 20 83.441 2.463 -0.996 1.00 1.00 H new ATOM 0 HG3 PRO A 20 82.992 1.408 -2.321 1.00 1.00 H new ATOM 0 HD2 PRO A 20 83.376 4.408 -2.345 1.00 1.00 H new ATOM 0 HD3 PRO A 20 83.718 3.248 -3.614 1.00 1.00 H new ATOM 289 N GLY A 21 80.805 5.704 -1.641 1.00 1.00 N ATOM 290 CA GLY A 21 80.347 6.898 -0.905 1.00 1.00 C ATOM 291 C GLY A 21 79.029 7.446 -1.468 1.00 1.00 C ATOM 292 O GLY A 21 78.041 7.584 -0.746 1.00 1.00 O ATOM 0 H GLY A 21 81.721 5.789 -2.083 1.00 1.00 H new ATOM 0 HA2 GLY A 21 80.216 6.648 0.148 1.00 1.00 H new ATOM 0 HA3 GLY A 21 81.113 7.672 -0.956 1.00 1.00 H new ATOM 296 N GLY A 22 79.049 7.792 -2.739 1.00 1.00 N ATOM 297 CA GLY A 22 77.844 8.367 -3.348 1.00 1.00 C ATOM 298 C GLY A 22 76.756 7.342 -3.212 1.00 1.00 C ATOM 299 O GLY A 22 75.658 7.623 -2.733 1.00 1.00 O ATOM 0 H GLY A 22 79.851 7.694 -3.361 1.00 1.00 H new ATOM 0 HA2 GLY A 22 77.565 9.295 -2.850 1.00 1.00 H new ATOM 0 HA3 GLY A 22 78.019 8.608 -4.397 1.00 1.00 H new ATOM 303 N VAL A 23 77.084 6.150 -3.652 1.00 1.00 N ATOM 304 CA VAL A 23 76.135 5.061 -3.591 1.00 1.00 C ATOM 305 C VAL A 23 75.711 4.852 -2.134 1.00 1.00 C ATOM 306 O VAL A 23 74.560 4.535 -1.858 1.00 1.00 O ATOM 307 CB VAL A 23 76.721 3.779 -4.188 1.00 1.00 C ATOM 308 CG1 VAL A 23 75.628 2.711 -4.239 1.00 1.00 C ATOM 309 CG2 VAL A 23 77.212 4.053 -5.614 1.00 1.00 C ATOM 0 H VAL A 23 77.991 5.910 -4.052 1.00 1.00 H new ATOM 0 HA VAL A 23 75.259 5.315 -4.188 1.00 1.00 H new ATOM 0 HB VAL A 23 77.554 3.438 -3.573 1.00 1.00 H new ATOM 0 HG11 VAL A 23 76.036 1.793 -4.663 1.00 1.00 H new ATOM 0 HG12 VAL A 23 75.264 2.514 -3.231 1.00 1.00 H new ATOM 0 HG13 VAL A 23 74.804 3.063 -4.860 1.00 1.00 H new ATOM 0 HG21 VAL A 23 77.629 3.139 -6.037 1.00 1.00 H new ATOM 0 HG22 VAL A 23 76.377 4.389 -6.228 1.00 1.00 H new ATOM 0 HG23 VAL A 23 77.980 4.826 -5.592 1.00 1.00 H new ATOM 319 N ALA A 24 76.652 5.045 -1.208 1.00 1.00 N ATOM 320 CA ALA A 24 76.297 4.856 0.199 1.00 1.00 C ATOM 321 C ALA A 24 75.203 5.853 0.610 1.00 1.00 C ATOM 322 O ALA A 24 74.139 5.427 1.054 1.00 1.00 O ATOM 323 CB ALA A 24 77.500 4.994 1.144 1.00 1.00 C ATOM 0 H ALA A 24 77.618 5.318 -1.391 1.00 1.00 H new ATOM 0 HA ALA A 24 75.928 3.835 0.292 1.00 1.00 H new ATOM 0 HB1 ALA A 24 77.173 4.844 2.173 1.00 1.00 H new ATOM 0 HB2 ALA A 24 78.251 4.246 0.889 1.00 1.00 H new ATOM 0 HB3 ALA A 24 77.930 5.990 1.042 1.00 1.00 H new ATOM 329 N LEU A 25 75.449 7.171 0.522 1.00 1.00 N ATOM 330 CA LEU A 25 74.434 8.125 0.958 1.00 1.00 C ATOM 331 C LEU A 25 73.177 8.068 0.100 1.00 1.00 C ATOM 332 O LEU A 25 72.075 8.118 0.639 1.00 1.00 O ATOM 333 CB LEU A 25 74.997 9.562 0.951 1.00 1.00 C ATOM 334 CG LEU A 25 75.862 9.788 2.200 1.00 1.00 C ATOM 335 CD1 LEU A 25 77.131 8.931 2.106 1.00 1.00 C ATOM 336 CD2 LEU A 25 76.250 11.267 2.310 1.00 1.00 C ATOM 0 H LEU A 25 76.311 7.583 0.165 1.00 1.00 H new ATOM 0 HA LEU A 25 74.159 7.843 1.974 1.00 1.00 H new ATOM 0 HB2 LEU A 25 75.591 9.725 0.052 1.00 1.00 H new ATOM 0 HB3 LEU A 25 74.179 10.283 0.928 1.00 1.00 H new ATOM 0 HG LEU A 25 75.292 9.503 3.084 1.00 1.00 H new ATOM 0 HD11 LEU A 25 77.745 9.091 2.992 1.00 1.00 H new ATOM 0 HD12 LEU A 25 76.855 7.878 2.041 1.00 1.00 H new ATOM 0 HD13 LEU A 25 77.696 9.213 1.218 1.00 1.00 H new ATOM 0 HD21 LEU A 25 76.863 11.417 3.199 1.00 1.00 H new ATOM 0 HD22 LEU A 25 76.815 11.562 1.425 1.00 1.00 H new ATOM 0 HD23 LEU A 25 75.348 11.875 2.384 1.00 1.00 H new ATOM 348 N VAL A 26 73.318 8.017 -1.224 1.00 1.00 N ATOM 349 CA VAL A 26 72.127 8.022 -2.056 1.00 1.00 C ATOM 350 C VAL A 26 71.273 6.787 -1.766 1.00 1.00 C ATOM 351 O VAL A 26 70.097 6.917 -1.436 1.00 1.00 O ATOM 352 CB VAL A 26 72.537 8.070 -3.533 1.00 1.00 C ATOM 353 CG1 VAL A 26 71.293 8.022 -4.419 1.00 1.00 C ATOM 354 CG2 VAL A 26 73.299 9.375 -3.798 1.00 1.00 C ATOM 0 H VAL A 26 74.207 7.974 -1.722 1.00 1.00 H new ATOM 0 HA VAL A 26 71.529 8.904 -1.829 1.00 1.00 H new ATOM 0 HB VAL A 26 73.172 7.214 -3.762 1.00 1.00 H new ATOM 0 HG11 VAL A 26 71.591 8.056 -5.467 1.00 1.00 H new ATOM 0 HG12 VAL A 26 70.745 7.099 -4.228 1.00 1.00 H new ATOM 0 HG13 VAL A 26 70.654 8.876 -4.195 1.00 1.00 H new ATOM 0 HG21 VAL A 26 73.594 9.417 -4.846 1.00 1.00 H new ATOM 0 HG22 VAL A 26 72.656 10.225 -3.567 1.00 1.00 H new ATOM 0 HG23 VAL A 26 74.188 9.411 -3.169 1.00 1.00 H new ATOM 364 N VAL A 27 71.821 5.593 -1.943 1.00 1.00 N ATOM 365 CA VAL A 27 71.041 4.375 -1.736 1.00 1.00 C ATOM 366 C VAL A 27 70.513 4.261 -0.305 1.00 1.00 C ATOM 367 O VAL A 27 69.420 3.743 -0.073 1.00 1.00 O ATOM 368 CB VAL A 27 71.917 3.153 -2.099 1.00 1.00 C ATOM 369 CG1 VAL A 27 72.784 2.717 -0.900 1.00 1.00 C ATOM 370 CG2 VAL A 27 71.034 1.977 -2.537 1.00 1.00 C ATOM 0 H VAL A 27 72.789 5.439 -2.226 1.00 1.00 H new ATOM 0 HA VAL A 27 70.166 4.411 -2.384 1.00 1.00 H new ATOM 0 HB VAL A 27 72.572 3.446 -2.920 1.00 1.00 H new ATOM 0 HG11 VAL A 27 73.390 1.856 -1.183 1.00 1.00 H new ATOM 0 HG12 VAL A 27 73.437 3.539 -0.605 1.00 1.00 H new ATOM 0 HG13 VAL A 27 72.139 2.448 -0.064 1.00 1.00 H new ATOM 0 HG21 VAL A 27 71.663 1.124 -2.790 1.00 1.00 H new ATOM 0 HG22 VAL A 27 70.362 1.704 -1.723 1.00 1.00 H new ATOM 0 HG23 VAL A 27 70.449 2.267 -3.410 1.00 1.00 H new ATOM 380 N LYS A 28 71.304 4.726 0.641 1.00 1.00 N ATOM 381 CA LYS A 28 70.903 4.635 2.044 1.00 1.00 C ATOM 382 C LYS A 28 69.716 5.545 2.307 1.00 1.00 C ATOM 383 O LYS A 28 68.690 5.124 2.840 1.00 1.00 O ATOM 384 CB LYS A 28 72.100 4.992 2.942 1.00 1.00 C ATOM 385 CG LYS A 28 71.715 4.946 4.447 1.00 1.00 C ATOM 386 CD LYS A 28 71.547 6.369 5.003 1.00 1.00 C ATOM 387 CE LYS A 28 71.187 6.305 6.489 1.00 1.00 C ATOM 388 NZ LYS A 28 71.096 7.689 7.037 1.00 1.00 N ATOM 0 H LYS A 28 72.211 5.163 0.477 1.00 1.00 H new ATOM 0 HA LYS A 28 70.594 3.616 2.275 1.00 1.00 H new ATOM 0 HB2 LYS A 28 72.918 4.297 2.753 1.00 1.00 H new ATOM 0 HB3 LYS A 28 72.463 5.988 2.688 1.00 1.00 H new ATOM 0 HG2 LYS A 28 70.788 4.388 4.574 1.00 1.00 H new ATOM 0 HG3 LYS A 28 72.485 4.418 5.010 1.00 1.00 H new ATOM 0 HD2 LYS A 28 72.469 6.934 4.867 1.00 1.00 H new ATOM 0 HD3 LYS A 28 70.767 6.895 4.453 1.00 1.00 H new ATOM 0 HE2 LYS A 28 70.238 5.786 6.622 1.00 1.00 H new ATOM 0 HE3 LYS A 28 71.941 5.736 7.033 1.00 1.00 H new ATOM 0 HZ1 LYS A 28 70.851 7.647 8.047 1.00 1.00 H new ATOM 0 HZ2 LYS A 28 72.012 8.169 6.922 1.00 1.00 H new ATOM 0 HZ3 LYS A 28 70.361 8.218 6.525 1.00 1.00 H new ATOM 402 N VAL A 29 69.889 6.804 1.962 1.00 1.00 N ATOM 403 CA VAL A 29 68.820 7.766 2.208 1.00 1.00 C ATOM 404 C VAL A 29 67.577 7.401 1.403 1.00 1.00 C ATOM 405 O VAL A 29 66.467 7.433 1.933 1.00 1.00 O ATOM 406 CB VAL A 29 69.223 9.223 1.934 1.00 1.00 C ATOM 407 CG1 VAL A 29 69.367 9.482 0.436 1.00 1.00 C ATOM 408 CG2 VAL A 29 68.130 10.139 2.497 1.00 1.00 C ATOM 0 H VAL A 29 70.729 7.183 1.524 1.00 1.00 H new ATOM 0 HA VAL A 29 68.601 7.705 3.274 1.00 1.00 H new ATOM 0 HB VAL A 29 70.184 9.421 2.409 1.00 1.00 H new ATOM 0 HG11 VAL A 29 69.653 10.521 0.272 1.00 1.00 H new ATOM 0 HG12 VAL A 29 70.134 8.826 0.025 1.00 1.00 H new ATOM 0 HG13 VAL A 29 68.417 9.285 -0.060 1.00 1.00 H new ATOM 0 HG21 VAL A 29 68.397 11.180 2.313 1.00 1.00 H new ATOM 0 HG22 VAL A 29 67.181 9.916 2.009 1.00 1.00 H new ATOM 0 HG23 VAL A 29 68.034 9.974 3.570 1.00 1.00 H new ATOM 418 N CYS A 30 67.742 7.061 0.123 1.00 1.00 N ATOM 419 CA CYS A 30 66.572 6.715 -0.676 1.00 1.00 C ATOM 420 C CYS A 30 65.944 5.420 -0.152 1.00 1.00 C ATOM 421 O CYS A 30 64.766 5.411 0.204 1.00 1.00 O ATOM 422 CB CYS A 30 66.981 6.580 -2.163 1.00 1.00 C ATOM 423 SG CYS A 30 65.785 5.572 -3.090 1.00 1.00 S ATOM 0 H CYS A 30 68.637 7.019 -0.364 1.00 1.00 H new ATOM 0 HA CYS A 30 65.826 7.506 -0.596 1.00 1.00 H new ATOM 0 HB2 CYS A 30 67.052 7.570 -2.614 1.00 1.00 H new ATOM 0 HB3 CYS A 30 67.970 6.127 -2.230 1.00 1.00 H new ATOM 428 N ALA A 31 66.689 4.315 -0.171 1.00 1.00 N ATOM 429 CA ALA A 31 66.154 3.022 0.235 1.00 1.00 C ATOM 430 C ALA A 31 65.771 2.976 1.696 1.00 1.00 C ATOM 431 O ALA A 31 64.667 2.557 2.037 1.00 1.00 O ATOM 432 CB ALA A 31 67.205 1.930 -0.037 1.00 1.00 C ATOM 0 H ALA A 31 67.666 4.293 -0.464 1.00 1.00 H new ATOM 0 HA ALA A 31 65.248 2.854 -0.347 1.00 1.00 H new ATOM 0 HB1 ALA A 31 66.809 0.961 0.265 1.00 1.00 H new ATOM 0 HB2 ALA A 31 67.442 1.910 -1.101 1.00 1.00 H new ATOM 0 HB3 ALA A 31 68.109 2.146 0.532 1.00 1.00 H new ATOM 438 N GLY A 32 66.699 3.347 2.566 1.00 1.00 N ATOM 439 CA GLY A 32 66.442 3.279 3.992 1.00 1.00 C ATOM 440 C GLY A 32 66.749 1.869 4.489 1.00 1.00 C ATOM 441 O GLY A 32 65.830 1.101 4.747 1.00 1.00 O ATOM 0 H GLY A 32 67.624 3.693 2.312 1.00 1.00 H new ATOM 0 HA2 GLY A 32 67.059 4.006 4.520 1.00 1.00 H new ATOM 0 HA3 GLY A 32 65.402 3.532 4.199 1.00 1.00 H new ATOM 445 N LEU A 33 68.055 1.549 4.593 1.00 1.00 N ATOM 446 CA LEU A 33 68.542 0.226 5.039 1.00 1.00 C ATOM 447 C LEU A 33 68.623 -0.754 3.843 1.00 1.00 C ATOM 448 O LEU A 33 67.610 -1.346 3.470 1.00 1.00 O ATOM 449 CB LEU A 33 67.658 -0.371 6.151 1.00 1.00 C ATOM 450 CG LEU A 33 67.524 0.630 7.319 1.00 1.00 C ATOM 451 CD1 LEU A 33 66.362 0.207 8.218 1.00 1.00 C ATOM 452 CD2 LEU A 33 68.825 0.665 8.141 1.00 1.00 C ATOM 0 H LEU A 33 68.805 2.203 4.369 1.00 1.00 H new ATOM 0 HA LEU A 33 69.540 0.373 5.452 1.00 1.00 H new ATOM 0 HB2 LEU A 33 66.672 -0.611 5.753 1.00 1.00 H new ATOM 0 HB3 LEU A 33 68.092 -1.304 6.510 1.00 1.00 H new ATOM 0 HG LEU A 33 67.334 1.625 6.916 1.00 1.00 H new ATOM 0 HD11 LEU A 33 66.265 0.912 9.044 1.00 1.00 H new ATOM 0 HD12 LEU A 33 65.439 0.197 7.639 1.00 1.00 H new ATOM 0 HD13 LEU A 33 66.552 -0.791 8.614 1.00 1.00 H new ATOM 0 HD21 LEU A 33 68.718 1.374 8.962 1.00 1.00 H new ATOM 0 HD22 LEU A 33 69.028 -0.327 8.543 1.00 1.00 H new ATOM 0 HD23 LEU A 33 69.652 0.973 7.501 1.00 1.00 H new ATOM 464 N PRO A 34 69.784 -0.915 3.205 1.00 1.00 N ATOM 465 CA PRO A 34 69.923 -1.815 2.005 1.00 1.00 C ATOM 466 C PRO A 34 69.773 -3.322 2.297 1.00 1.00 C ATOM 467 O PRO A 34 69.384 -4.078 1.409 1.00 1.00 O ATOM 468 CB PRO A 34 71.326 -1.486 1.452 1.00 1.00 C ATOM 469 CG PRO A 34 72.095 -0.957 2.620 1.00 1.00 C ATOM 470 CD PRO A 34 71.080 -0.272 3.541 1.00 1.00 C ATOM 0 HA PRO A 34 69.114 -1.628 1.299 1.00 1.00 H new ATOM 0 HB2 PRO A 34 71.803 -2.373 1.036 1.00 1.00 H new ATOM 0 HB3 PRO A 34 71.270 -0.749 0.651 1.00 1.00 H new ATOM 0 HG2 PRO A 34 72.609 -1.764 3.143 1.00 1.00 H new ATOM 0 HG3 PRO A 34 72.859 -0.251 2.293 1.00 1.00 H new ATOM 0 HD2 PRO A 34 71.335 -0.417 4.591 1.00 1.00 H new ATOM 0 HD3 PRO A 34 71.047 0.803 3.366 1.00 1.00 H new ATOM 478 N GLY A 35 70.096 -3.764 3.509 1.00 1.00 N ATOM 479 CA GLY A 35 69.981 -5.203 3.777 1.00 1.00 C ATOM 480 C GLY A 35 68.521 -5.634 3.619 1.00 1.00 C ATOM 481 O GLY A 35 68.211 -6.470 2.769 1.00 1.00 O ATOM 0 H GLY A 35 70.422 -3.188 4.285 1.00 1.00 H new ATOM 0 HA2 GLY A 35 70.614 -5.764 3.089 1.00 1.00 H new ATOM 0 HA3 GLY A 35 70.330 -5.426 4.785 1.00 1.00 H new ATOM 485 N VAL A 36 67.613 -5.035 4.393 1.00 1.00 N ATOM 486 CA VAL A 36 66.185 -5.349 4.259 1.00 1.00 C ATOM 487 C VAL A 36 65.638 -4.397 3.213 1.00 1.00 C ATOM 488 O VAL A 36 66.304 -3.407 2.939 1.00 1.00 O ATOM 489 CB VAL A 36 65.443 -5.165 5.594 1.00 1.00 C ATOM 490 CG1 VAL A 36 65.531 -3.712 6.060 1.00 1.00 C ATOM 491 CG2 VAL A 36 63.970 -5.550 5.420 1.00 1.00 C ATOM 0 H VAL A 36 67.833 -4.341 5.108 1.00 1.00 H new ATOM 0 HA VAL A 36 66.045 -6.390 3.967 1.00 1.00 H new ATOM 0 HB VAL A 36 65.909 -5.806 6.342 1.00 1.00 H new ATOM 0 HG11 VAL A 36 65.001 -3.600 7.006 1.00 1.00 H new ATOM 0 HG12 VAL A 36 66.577 -3.436 6.196 1.00 1.00 H new ATOM 0 HG13 VAL A 36 65.078 -3.062 5.311 1.00 1.00 H new ATOM 0 HG21 VAL A 36 63.445 -5.419 6.367 1.00 1.00 H new ATOM 0 HG22 VAL A 36 63.515 -4.913 4.662 1.00 1.00 H new ATOM 0 HG23 VAL A 36 63.901 -6.592 5.108 1.00 1.00 H new ATOM 501 N ILE A 37 64.459 -4.701 2.633 1.00 1.00 N ATOM 502 CA ILE A 37 63.809 -3.883 1.590 1.00 1.00 C ATOM 503 C ILE A 37 63.674 -4.724 0.332 1.00 1.00 C ATOM 504 O ILE A 37 64.670 -5.175 -0.238 1.00 1.00 O ATOM 505 CB ILE A 37 64.534 -2.549 1.259 1.00 1.00 C ATOM 506 CG1 ILE A 37 63.547 -1.550 0.560 1.00 1.00 C ATOM 507 CG2 ILE A 37 65.789 -2.801 0.380 1.00 1.00 C ATOM 508 CD1 ILE A 37 63.477 -1.731 -0.968 1.00 1.00 C ATOM 0 H ILE A 37 63.924 -5.534 2.880 1.00 1.00 H new ATOM 0 HA ILE A 37 62.838 -3.587 1.987 1.00 1.00 H new ATOM 0 HB ILE A 37 64.870 -2.100 2.193 1.00 1.00 H new ATOM 0 HG12 ILE A 37 62.550 -1.681 0.980 1.00 1.00 H new ATOM 0 HG13 ILE A 37 63.855 -0.529 0.784 1.00 1.00 H new ATOM 0 HG21 ILE A 37 66.278 -1.851 0.163 1.00 1.00 H new ATOM 0 HG22 ILE A 37 66.482 -3.452 0.913 1.00 1.00 H new ATOM 0 HG23 ILE A 37 65.490 -3.277 -0.554 1.00 1.00 H new ATOM 0 HD11 ILE A 37 62.777 -1.009 -1.388 1.00 1.00 H new ATOM 0 HD12 ILE A 37 64.465 -1.571 -1.399 1.00 1.00 H new ATOM 0 HD13 ILE A 37 63.139 -2.741 -1.200 1.00 1.00 H new ATOM 520 N HIS A 38 62.434 -4.919 -0.115 1.00 1.00 N ATOM 521 CA HIS A 38 62.159 -5.689 -1.322 1.00 1.00 C ATOM 522 C HIS A 38 61.007 -5.021 -2.068 1.00 1.00 C ATOM 523 O HIS A 38 59.999 -4.654 -1.465 1.00 1.00 O ATOM 524 CB HIS A 38 61.773 -7.126 -0.958 1.00 1.00 C ATOM 525 CG HIS A 38 62.838 -7.733 -0.090 1.00 1.00 C ATOM 526 ND1 HIS A 38 62.670 -7.898 1.274 1.00 1.00 N ATOM 527 CD2 HIS A 38 64.089 -8.221 -0.375 1.00 1.00 C ATOM 528 CE1 HIS A 38 63.790 -8.465 1.758 1.00 1.00 C ATOM 529 NE2 HIS A 38 64.689 -8.683 0.793 1.00 1.00 N ATOM 0 H HIS A 38 61.601 -4.551 0.345 1.00 1.00 H new ATOM 0 HA HIS A 38 63.049 -5.719 -1.950 1.00 1.00 H new ATOM 0 HB2 HIS A 38 60.816 -7.134 -0.436 1.00 1.00 H new ATOM 0 HB3 HIS A 38 61.647 -7.719 -1.864 1.00 1.00 H new ATOM 0 HD2 HIS A 38 64.539 -8.243 -1.356 1.00 1.00 H new ATOM 0 HE1 HIS A 38 63.944 -8.713 2.798 1.00 1.00 H new ATOM 0 HE2 HIS A 38 65.615 -9.098 0.891 1.00 1.00 H new ATOM 537 N THR A 39 61.165 -4.860 -3.374 1.00 1.00 N ATOM 538 CA THR A 39 60.137 -4.227 -4.207 1.00 1.00 C ATOM 539 C THR A 39 59.516 -5.301 -5.112 1.00 1.00 C ATOM 540 O THR A 39 60.249 -6.108 -5.682 1.00 1.00 O ATOM 541 CB THR A 39 60.804 -3.105 -5.044 1.00 1.00 C ATOM 542 OG1 THR A 39 62.063 -2.796 -4.463 1.00 1.00 O ATOM 543 CG2 THR A 39 59.946 -1.830 -5.067 1.00 1.00 C ATOM 0 H THR A 39 61.995 -5.158 -3.886 1.00 1.00 H new ATOM 0 HA THR A 39 59.348 -3.785 -3.598 1.00 1.00 H new ATOM 0 HB THR A 39 60.916 -3.460 -6.068 1.00 1.00 H new ATOM 0 HG1 THR A 39 62.498 -2.088 -4.983 1.00 1.00 H new ATOM 0 HG21 THR A 39 60.445 -1.066 -5.663 1.00 1.00 H new ATOM 0 HG22 THR A 39 58.973 -2.054 -5.505 1.00 1.00 H new ATOM 0 HG23 THR A 39 59.810 -1.465 -4.049 1.00 1.00 H new ATOM 551 N PRO A 40 58.210 -5.364 -5.257 1.00 1.00 N ATOM 552 CA PRO A 40 57.587 -6.412 -6.114 1.00 1.00 C ATOM 553 C PRO A 40 57.945 -6.217 -7.583 1.00 1.00 C ATOM 554 O PRO A 40 58.881 -6.825 -8.100 1.00 1.00 O ATOM 555 CB PRO A 40 56.073 -6.243 -5.877 1.00 1.00 C ATOM 556 CG PRO A 40 55.905 -4.833 -5.403 1.00 1.00 C ATOM 557 CD PRO A 40 57.194 -4.475 -4.652 1.00 1.00 C ATOM 0 HA PRO A 40 57.937 -7.413 -5.864 1.00 1.00 H new ATOM 0 HB2 PRO A 40 55.509 -6.420 -6.793 1.00 1.00 H new ATOM 0 HB3 PRO A 40 55.709 -6.954 -5.135 1.00 1.00 H new ATOM 0 HG2 PRO A 40 55.744 -4.157 -6.243 1.00 1.00 H new ATOM 0 HG3 PRO A 40 55.037 -4.743 -4.750 1.00 1.00 H new ATOM 0 HD2 PRO A 40 57.454 -3.424 -4.780 1.00 1.00 H new ATOM 0 HD3 PRO A 40 57.095 -4.650 -3.581 1.00 1.00 H new ATOM 565 N ALA A 41 57.165 -5.383 -8.240 1.00 1.00 N ATOM 566 CA ALA A 41 57.348 -5.103 -9.655 1.00 1.00 C ATOM 567 C ALA A 41 58.652 -4.385 -9.881 1.00 1.00 C ATOM 568 O ALA A 41 58.879 -3.299 -9.345 1.00 1.00 O ATOM 569 CB ALA A 41 56.207 -4.225 -10.168 1.00 1.00 C ATOM 0 H ALA A 41 56.388 -4.880 -7.812 1.00 1.00 H new ATOM 0 HA ALA A 41 57.355 -6.051 -10.193 1.00 1.00 H new ATOM 0 HB1 ALA A 41 56.353 -4.021 -11.229 1.00 1.00 H new ATOM 0 HB2 ALA A 41 55.258 -4.742 -10.026 1.00 1.00 H new ATOM 0 HB3 ALA A 41 56.195 -3.285 -9.616 1.00 1.00 H new ATOM 575 N ARG A 42 59.498 -4.974 -10.694 1.00 1.00 N ATOM 576 CA ARG A 42 60.764 -4.376 -11.002 1.00 1.00 C ATOM 577 C ARG A 42 61.405 -5.132 -12.157 1.00 1.00 C ATOM 578 O ARG A 42 60.964 -6.223 -12.523 1.00 1.00 O ATOM 579 CB ARG A 42 61.666 -4.393 -9.766 1.00 1.00 C ATOM 580 CG ARG A 42 61.888 -5.832 -9.310 1.00 1.00 C ATOM 581 CD ARG A 42 62.718 -5.831 -8.027 1.00 1.00 C ATOM 582 NE ARG A 42 62.963 -7.195 -7.583 1.00 1.00 N ATOM 583 CZ ARG A 42 63.359 -7.450 -6.341 1.00 1.00 C ATOM 584 NH1 ARG A 42 63.513 -6.471 -5.493 1.00 1.00 N ATOM 585 NH2 ARG A 42 63.589 -8.677 -5.969 1.00 1.00 N ATOM 0 H ARG A 42 59.326 -5.869 -11.152 1.00 1.00 H new ATOM 0 HA ARG A 42 60.621 -3.337 -11.298 1.00 1.00 H new ATOM 0 HB2 ARG A 42 62.622 -3.923 -9.995 1.00 1.00 H new ATOM 0 HB3 ARG A 42 61.210 -3.813 -8.963 1.00 1.00 H new ATOM 0 HG2 ARG A 42 60.930 -6.323 -9.137 1.00 1.00 H new ATOM 0 HG3 ARG A 42 62.400 -6.398 -10.088 1.00 1.00 H new ATOM 0 HD2 ARG A 42 63.666 -5.322 -8.200 1.00 1.00 H new ATOM 0 HD3 ARG A 42 62.195 -5.276 -7.248 1.00 1.00 H new ATOM 0 HE ARG A 42 62.829 -7.967 -8.236 1.00 1.00 H new ATOM 0 HH11 ARG A 42 63.329 -5.511 -5.784 1.00 1.00 H new ATOM 0 HH12 ARG A 42 63.817 -6.666 -4.539 1.00 1.00 H new ATOM 0 HH21 ARG A 42 63.465 -9.443 -6.632 1.00 1.00 H new ATOM 0 HH22 ARG A 42 63.893 -8.872 -5.015 1.00 1.00 H new ATOM 599 N ARG A 43 62.421 -4.536 -12.733 1.00 1.00 N ATOM 600 CA ARG A 43 63.095 -5.167 -13.865 1.00 1.00 C ATOM 601 C ARG A 43 63.787 -6.473 -13.415 1.00 1.00 C ATOM 602 O ARG A 43 64.742 -6.929 -14.042 1.00 1.00 O ATOM 603 CB ARG A 43 64.060 -4.158 -14.567 1.00 1.00 C ATOM 604 CG ARG A 43 65.541 -4.373 -14.164 1.00 1.00 C ATOM 605 CD ARG A 43 66.315 -5.240 -15.190 1.00 1.00 C ATOM 606 NE ARG A 43 67.255 -4.406 -15.947 1.00 1.00 N ATOM 607 CZ ARG A 43 68.530 -4.259 -15.570 1.00 1.00 C ATOM 608 NH1 ARG A 43 68.981 -4.872 -14.510 1.00 1.00 N ATOM 609 NH2 ARG A 43 69.333 -3.496 -16.266 1.00 1.00 N ATOM 0 H ARG A 43 62.801 -3.632 -12.451 1.00 1.00 H new ATOM 0 HA ARG A 43 62.359 -5.450 -14.617 1.00 1.00 H new ATOM 0 HB2 ARG A 43 63.963 -4.260 -15.648 1.00 1.00 H new ATOM 0 HB3 ARG A 43 63.762 -3.140 -14.314 1.00 1.00 H new ATOM 0 HG2 ARG A 43 66.032 -3.405 -14.067 1.00 1.00 H new ATOM 0 HG3 ARG A 43 65.582 -4.851 -13.185 1.00 1.00 H new ATOM 0 HD2 ARG A 43 66.855 -6.033 -14.673 1.00 1.00 H new ATOM 0 HD3 ARG A 43 65.615 -5.723 -15.872 1.00 1.00 H new ATOM 0 HE ARG A 43 66.927 -3.925 -16.784 1.00 1.00 H new ATOM 0 HH11 ARG A 43 68.360 -5.468 -13.963 1.00 1.00 H new ATOM 0 HH12 ARG A 43 69.954 -4.755 -14.229 1.00 1.00 H new ATOM 0 HH21 ARG A 43 68.987 -3.014 -17.095 1.00 1.00 H new ATOM 0 HH22 ARG A 43 70.305 -3.383 -15.979 1.00 1.00 H new ATOM 623 N GLY A 44 63.274 -7.079 -12.329 1.00 1.00 N ATOM 624 CA GLY A 44 63.820 -8.330 -11.802 1.00 1.00 C ATOM 625 C GLY A 44 65.121 -8.103 -11.028 1.00 1.00 C ATOM 626 O GLY A 44 65.484 -8.906 -10.170 1.00 1.00 O ATOM 0 H GLY A 44 62.480 -6.716 -11.802 1.00 1.00 H new ATOM 0 HA2 GLY A 44 63.085 -8.800 -11.148 1.00 1.00 H new ATOM 0 HA3 GLY A 44 64.003 -9.022 -12.625 1.00 1.00 H new ATOM 630 N PHE A 45 65.827 -7.018 -11.348 1.00 1.00 N ATOM 631 CA PHE A 45 67.097 -6.709 -10.683 1.00 1.00 C ATOM 632 C PHE A 45 67.472 -5.235 -10.915 1.00 1.00 C ATOM 633 O PHE A 45 66.927 -4.628 -11.793 1.00 1.00 O ATOM 634 CB PHE A 45 68.176 -7.619 -11.279 1.00 1.00 C ATOM 635 CG PHE A 45 69.518 -7.329 -10.655 1.00 1.00 C ATOM 636 CD1 PHE A 45 70.277 -6.257 -11.127 1.00 1.00 C ATOM 637 CD2 PHE A 45 70.000 -8.124 -9.608 1.00 1.00 C ATOM 638 CE1 PHE A 45 71.514 -5.971 -10.551 1.00 1.00 C ATOM 639 CE2 PHE A 45 71.245 -7.840 -9.035 1.00 1.00 C ATOM 640 CZ PHE A 45 72.002 -6.759 -9.505 1.00 1.00 C ATOM 0 H PHE A 45 65.545 -6.342 -12.058 1.00 1.00 H new ATOM 0 HA PHE A 45 67.008 -6.875 -9.609 1.00 1.00 H new ATOM 0 HB2 PHE A 45 67.910 -8.663 -11.115 1.00 1.00 H new ATOM 0 HB3 PHE A 45 68.230 -7.470 -12.357 1.00 1.00 H new ATOM 0 HD1 PHE A 45 69.906 -5.649 -11.939 1.00 1.00 H new ATOM 0 HD2 PHE A 45 69.413 -8.954 -9.244 1.00 1.00 H new ATOM 0 HE1 PHE A 45 72.097 -5.138 -10.914 1.00 1.00 H new ATOM 0 HE2 PHE A 45 71.622 -8.454 -8.231 1.00 1.00 H new ATOM 0 HZ PHE A 45 72.960 -6.535 -9.060 1.00 1.00 H new ATOM 650 N PHE A 46 68.428 -4.713 -10.126 1.00 1.00 N ATOM 651 CA PHE A 46 68.952 -3.294 -10.239 1.00 1.00 C ATOM 652 C PHE A 46 68.978 -2.601 -8.865 1.00 1.00 C ATOM 653 O PHE A 46 67.978 -2.015 -8.454 1.00 1.00 O ATOM 654 CB PHE A 46 68.117 -2.396 -11.229 1.00 1.00 C ATOM 655 CG PHE A 46 68.967 -1.365 -11.942 1.00 1.00 C ATOM 656 CD1 PHE A 46 69.725 -1.752 -13.057 1.00 1.00 C ATOM 657 CD2 PHE A 46 68.946 -0.021 -11.545 1.00 1.00 C ATOM 658 CE1 PHE A 46 70.459 -0.800 -13.774 1.00 1.00 C ATOM 659 CE2 PHE A 46 69.691 0.929 -12.256 1.00 1.00 C ATOM 660 CZ PHE A 46 70.443 0.541 -13.372 1.00 1.00 C ATOM 0 H PHE A 46 68.876 -5.247 -9.381 1.00 1.00 H new ATOM 0 HA PHE A 46 69.962 -3.393 -10.638 1.00 1.00 H new ATOM 0 HB2 PHE A 46 67.630 -3.033 -11.968 1.00 1.00 H new ATOM 0 HB3 PHE A 46 67.327 -1.889 -10.675 1.00 1.00 H new ATOM 0 HD1 PHE A 46 69.742 -2.788 -13.363 1.00 1.00 H new ATOM 0 HD2 PHE A 46 68.356 0.282 -10.692 1.00 1.00 H new ATOM 0 HE1 PHE A 46 71.037 -1.099 -14.636 1.00 1.00 H new ATOM 0 HE2 PHE A 46 69.685 1.963 -11.943 1.00 1.00 H new ATOM 0 HZ PHE A 46 71.011 1.276 -13.923 1.00 1.00 H new ATOM 670 N ARG A 47 70.137 -2.685 -8.189 1.00 1.00 N ATOM 671 CA ARG A 47 70.379 -2.092 -6.853 1.00 1.00 C ATOM 672 C ARG A 47 70.705 -3.210 -5.870 1.00 1.00 C ATOM 673 O ARG A 47 70.292 -4.353 -6.072 1.00 1.00 O ATOM 674 CB ARG A 47 69.189 -1.254 -6.331 1.00 1.00 C ATOM 675 CG ARG A 47 69.545 -0.608 -4.957 1.00 1.00 C ATOM 676 CD ARG A 47 68.753 -1.273 -3.819 1.00 1.00 C ATOM 677 NE ARG A 47 67.388 -0.767 -3.791 1.00 1.00 N ATOM 678 CZ ARG A 47 67.132 0.481 -3.420 1.00 1.00 C ATOM 679 NH1 ARG A 47 68.113 1.281 -3.109 1.00 1.00 N ATOM 680 NH2 ARG A 47 65.903 0.909 -3.379 1.00 1.00 N ATOM 0 H ARG A 47 70.951 -3.176 -8.559 1.00 1.00 H new ATOM 0 HA ARG A 47 71.217 -1.402 -6.947 1.00 1.00 H new ATOM 0 HB2 ARG A 47 68.939 -0.476 -7.052 1.00 1.00 H new ATOM 0 HB3 ARG A 47 68.308 -1.887 -6.226 1.00 1.00 H new ATOM 0 HG2 ARG A 47 70.614 -0.708 -4.769 1.00 1.00 H new ATOM 0 HG3 ARG A 47 69.325 0.459 -4.984 1.00 1.00 H new ATOM 0 HD2 ARG A 47 68.745 -2.354 -3.956 1.00 1.00 H new ATOM 0 HD3 ARG A 47 69.241 -1.077 -2.864 1.00 1.00 H new ATOM 0 HE ARG A 47 66.618 -1.380 -4.060 1.00 1.00 H new ATOM 0 HH11 ARG A 47 69.076 0.947 -3.151 1.00 1.00 H new ATOM 0 HH12 ARG A 47 67.918 2.241 -2.824 1.00 1.00 H new ATOM 0 HH21 ARG A 47 65.137 0.285 -3.632 1.00 1.00 H new ATOM 0 HH22 ARG A 47 65.706 1.868 -3.094 1.00 1.00 H new ATOM 694 N CYS A 48 71.486 -2.897 -4.831 1.00 1.00 N ATOM 695 CA CYS A 48 71.900 -3.903 -3.849 1.00 1.00 C ATOM 696 C CYS A 48 72.897 -4.854 -4.524 1.00 1.00 C ATOM 697 O CYS A 48 72.575 -6.003 -4.804 1.00 1.00 O ATOM 698 CB CYS A 48 70.666 -4.687 -3.293 1.00 1.00 C ATOM 699 SG CYS A 48 70.444 -4.364 -1.521 1.00 1.00 S ATOM 0 H CYS A 48 71.843 -1.959 -4.649 1.00 1.00 H new ATOM 0 HA CYS A 48 72.375 -3.413 -2.999 1.00 1.00 H new ATOM 0 HB2 CYS A 48 69.768 -4.393 -3.836 1.00 1.00 H new ATOM 0 HB3 CYS A 48 70.804 -5.756 -3.458 1.00 1.00 H new ATOM 704 N ASN A 49 74.116 -4.380 -4.807 1.00 1.00 N ATOM 705 CA ASN A 49 75.123 -5.209 -5.469 1.00 1.00 C ATOM 706 C ASN A 49 76.465 -5.026 -4.735 1.00 1.00 C ATOM 707 O ASN A 49 76.786 -3.910 -4.326 1.00 1.00 O ATOM 708 CB ASN A 49 75.249 -4.772 -6.955 1.00 1.00 C ATOM 709 CG ASN A 49 74.051 -3.908 -7.360 1.00 1.00 C ATOM 710 OD1 ASN A 49 73.061 -4.420 -7.879 1.00 1.00 O ATOM 711 ND2 ASN A 49 74.087 -2.618 -7.146 1.00 1.00 N ATOM 0 H ASN A 49 74.425 -3.433 -4.589 1.00 1.00 H new ATOM 0 HA ASN A 49 74.836 -6.260 -5.439 1.00 1.00 H new ATOM 0 HB2 ASN A 49 76.174 -4.213 -7.099 1.00 1.00 H new ATOM 0 HB3 ASN A 49 75.304 -5.652 -7.596 1.00 1.00 H new ATOM 0 HD21 ASN A 49 73.293 -2.035 -7.410 1.00 1.00 H new ATOM 0 HD22 ASN A 49 74.909 -2.195 -6.715 1.00 1.00 H new ATOM 718 N PRO A 50 77.243 -6.066 -4.540 1.00 1.00 N ATOM 719 CA PRO A 50 78.550 -5.950 -3.813 1.00 1.00 C ATOM 720 C PRO A 50 79.587 -5.117 -4.584 1.00 1.00 C ATOM 721 O PRO A 50 80.579 -5.651 -5.075 1.00 1.00 O ATOM 722 CB PRO A 50 78.999 -7.415 -3.647 1.00 1.00 C ATOM 723 CG PRO A 50 78.334 -8.147 -4.766 1.00 1.00 C ATOM 724 CD PRO A 50 76.987 -7.451 -4.978 1.00 1.00 C ATOM 0 HA PRO A 50 78.448 -5.425 -2.863 1.00 1.00 H new ATOM 0 HB2 PRO A 50 80.084 -7.505 -3.705 1.00 1.00 H new ATOM 0 HB3 PRO A 50 78.697 -7.814 -2.679 1.00 1.00 H new ATOM 0 HG2 PRO A 50 78.940 -8.111 -5.672 1.00 1.00 H new ATOM 0 HG3 PRO A 50 78.196 -9.199 -4.517 1.00 1.00 H new ATOM 0 HD2 PRO A 50 76.674 -7.491 -6.021 1.00 1.00 H new ATOM 0 HD3 PRO A 50 76.197 -7.918 -4.390 1.00 1.00 H new ATOM 732 N GLU A 51 79.333 -3.808 -4.680 1.00 1.00 N ATOM 733 CA GLU A 51 80.224 -2.875 -5.380 1.00 1.00 C ATOM 734 C GLU A 51 80.333 -3.177 -6.873 1.00 1.00 C ATOM 735 O GLU A 51 80.902 -2.382 -7.620 1.00 1.00 O ATOM 736 CB GLU A 51 81.631 -2.867 -4.761 1.00 1.00 C ATOM 737 CG GLU A 51 81.588 -2.202 -3.382 1.00 1.00 C ATOM 738 CD GLU A 51 80.619 -2.945 -2.470 1.00 1.00 C ATOM 739 OE1 GLU A 51 79.449 -2.606 -2.483 1.00 1.00 O ATOM 740 OE2 GLU A 51 81.063 -3.840 -1.769 1.00 1.00 O ATOM 0 H GLU A 51 78.507 -3.366 -4.276 1.00 1.00 H new ATOM 0 HA GLU A 51 79.772 -1.890 -5.263 1.00 1.00 H new ATOM 0 HB2 GLU A 51 82.004 -3.887 -4.671 1.00 1.00 H new ATOM 0 HB3 GLU A 51 82.322 -2.331 -5.412 1.00 1.00 H new ATOM 0 HG2 GLU A 51 82.585 -2.199 -2.940 1.00 1.00 H new ATOM 0 HG3 GLU A 51 81.280 -1.161 -3.481 1.00 1.00 H new ATOM 747 N ARG A 52 79.794 -4.310 -7.327 1.00 1.00 N ATOM 748 CA ARG A 52 79.873 -4.633 -8.755 1.00 1.00 C ATOM 749 C ARG A 52 78.868 -3.814 -9.541 1.00 1.00 C ATOM 750 O ARG A 52 77.997 -3.161 -8.964 1.00 1.00 O ATOM 751 CB ARG A 52 79.621 -6.124 -9.019 1.00 1.00 C ATOM 752 CG ARG A 52 78.174 -6.539 -8.591 1.00 1.00 C ATOM 753 CD ARG A 52 77.390 -7.218 -9.747 1.00 1.00 C ATOM 754 NE ARG A 52 76.655 -8.367 -9.233 1.00 1.00 N ATOM 755 CZ ARG A 52 77.279 -9.515 -8.993 1.00 1.00 C ATOM 756 NH1 ARG A 52 78.553 -9.624 -9.258 1.00 1.00 N ATOM 757 NH2 ARG A 52 76.622 -10.533 -8.507 1.00 1.00 N ATOM 0 H ARG A 52 79.313 -5.000 -6.750 1.00 1.00 H new ATOM 0 HA ARG A 52 80.885 -4.391 -9.081 1.00 1.00 H new ATOM 0 HB2 ARG A 52 79.765 -6.338 -10.078 1.00 1.00 H new ATOM 0 HB3 ARG A 52 80.350 -6.721 -8.471 1.00 1.00 H new ATOM 0 HG2 ARG A 52 78.230 -7.221 -7.743 1.00 1.00 H new ATOM 0 HG3 ARG A 52 77.630 -5.657 -8.255 1.00 1.00 H new ATOM 0 HD2 ARG A 52 76.700 -6.505 -10.199 1.00 1.00 H new ATOM 0 HD3 ARG A 52 78.079 -7.535 -10.530 1.00 1.00 H new ATOM 0 HE ARG A 52 75.653 -8.289 -9.056 1.00 1.00 H new ATOM 0 HH11 ARG A 52 79.063 -8.831 -9.647 1.00 1.00 H new ATOM 0 HH12 ARG A 52 79.038 -10.502 -9.076 1.00 1.00 H new ATOM 0 HH21 ARG A 52 75.625 -10.449 -8.310 1.00 1.00 H new ATOM 0 HH22 ARG A 52 77.106 -11.412 -8.325 1.00 1.00 H new ATOM 771 N ILE A 53 78.991 -3.844 -10.863 1.00 1.00 N ATOM 772 CA ILE A 53 78.088 -3.100 -11.719 1.00 1.00 C ATOM 773 C ILE A 53 76.782 -3.859 -11.925 1.00 1.00 C ATOM 774 O ILE A 53 76.758 -5.072 -12.134 1.00 1.00 O ATOM 775 CB ILE A 53 78.757 -2.828 -13.072 1.00 1.00 C ATOM 776 CG1 ILE A 53 79.463 -4.098 -13.552 1.00 1.00 C ATOM 777 CG2 ILE A 53 79.781 -1.702 -12.921 1.00 1.00 C ATOM 778 CD1 ILE A 53 79.834 -3.951 -15.030 1.00 1.00 C ATOM 0 H ILE A 53 79.706 -4.375 -11.360 1.00 1.00 H new ATOM 0 HA ILE A 53 77.858 -2.152 -11.233 1.00 1.00 H new ATOM 0 HB ILE A 53 78.000 -2.533 -13.799 1.00 1.00 H new ATOM 0 HG12 ILE A 53 80.359 -4.275 -12.957 1.00 1.00 H new ATOM 0 HG13 ILE A 53 78.813 -4.962 -13.414 1.00 1.00 H new ATOM 0 HG21 ILE A 53 80.255 -1.510 -13.883 1.00 1.00 H new ATOM 0 HG22 ILE A 53 79.279 -0.798 -12.577 1.00 1.00 H new ATOM 0 HG23 ILE A 53 80.539 -1.995 -12.195 1.00 1.00 H new ATOM 0 HD11 ILE A 53 80.337 -4.856 -15.371 1.00 1.00 H new ATOM 0 HD12 ILE A 53 78.930 -3.795 -15.618 1.00 1.00 H new ATOM 0 HD13 ILE A 53 80.500 -3.097 -15.155 1.00 1.00 H new ATOM 790 N GLN A 54 75.711 -3.105 -11.823 1.00 1.00 N ATOM 791 CA GLN A 54 74.384 -3.686 -11.957 1.00 1.00 C ATOM 792 C GLN A 54 74.249 -4.294 -13.360 1.00 1.00 C ATOM 793 O GLN A 54 73.681 -3.673 -14.261 1.00 1.00 O ATOM 794 CB GLN A 54 73.319 -2.598 -11.751 1.00 1.00 C ATOM 795 CG GLN A 54 73.731 -1.297 -12.487 1.00 1.00 C ATOM 796 CD GLN A 54 74.463 -0.339 -11.546 1.00 1.00 C ATOM 797 OE1 GLN A 54 75.328 -0.759 -10.775 1.00 1.00 O ATOM 798 NE2 GLN A 54 74.165 0.934 -11.568 1.00 1.00 N ATOM 0 H GLN A 54 75.725 -2.100 -11.650 1.00 1.00 H new ATOM 0 HA GLN A 54 74.241 -4.463 -11.206 1.00 1.00 H new ATOM 0 HB2 GLN A 54 72.356 -2.946 -12.125 1.00 1.00 H new ATOM 0 HB3 GLN A 54 73.194 -2.398 -10.687 1.00 1.00 H new ATOM 0 HG2 GLN A 54 74.373 -1.542 -13.333 1.00 1.00 H new ATOM 0 HG3 GLN A 54 72.845 -0.808 -12.891 1.00 1.00 H new ATOM 0 HE21 GLN A 54 73.449 1.279 -12.207 1.00 1.00 H new ATOM 0 HE22 GLN A 54 74.649 1.582 -10.946 1.00 1.00 H new ATOM 807 N ILE A 55 74.749 -5.541 -13.527 1.00 1.00 N ATOM 808 CA ILE A 55 74.658 -6.264 -14.804 1.00 1.00 C ATOM 809 C ILE A 55 74.600 -7.788 -14.564 1.00 1.00 C ATOM 810 O ILE A 55 75.025 -8.263 -13.509 1.00 1.00 O ATOM 811 CB ILE A 55 75.871 -5.931 -15.677 1.00 1.00 C ATOM 812 CG1 ILE A 55 75.662 -6.500 -17.084 1.00 1.00 C ATOM 813 CG2 ILE A 55 77.139 -6.544 -15.065 1.00 1.00 C ATOM 814 CD1 ILE A 55 76.730 -5.937 -18.022 1.00 1.00 C ATOM 0 H ILE A 55 75.219 -6.063 -12.787 1.00 1.00 H new ATOM 0 HA ILE A 55 73.745 -5.953 -15.312 1.00 1.00 H new ATOM 0 HB ILE A 55 75.984 -4.848 -15.732 1.00 1.00 H new ATOM 0 HG12 ILE A 55 75.720 -7.588 -17.061 1.00 1.00 H new ATOM 0 HG13 ILE A 55 74.668 -6.241 -17.449 1.00 1.00 H new ATOM 0 HG21 ILE A 55 77.998 -6.303 -15.691 1.00 1.00 H new ATOM 0 HG22 ILE A 55 77.293 -6.138 -14.065 1.00 1.00 H new ATOM 0 HG23 ILE A 55 77.027 -7.626 -15.004 1.00 1.00 H new ATOM 0 HD11 ILE A 55 76.584 -6.340 -19.024 1.00 1.00 H new ATOM 0 HD12 ILE A 55 76.651 -4.850 -18.053 1.00 1.00 H new ATOM 0 HD13 ILE A 55 77.718 -6.218 -17.659 1.00 1.00 H new ATOM 826 N GLY A 56 74.090 -8.555 -15.538 1.00 1.00 N ATOM 827 CA GLY A 56 74.006 -10.033 -15.406 1.00 1.00 C ATOM 828 C GLY A 56 72.566 -10.495 -15.199 1.00 1.00 C ATOM 829 O GLY A 56 72.264 -11.691 -15.196 1.00 1.00 O ATOM 0 H GLY A 56 73.731 -8.190 -16.420 1.00 1.00 H new ATOM 0 HA2 GLY A 56 74.415 -10.503 -16.300 1.00 1.00 H new ATOM 0 HA3 GLY A 56 74.618 -10.360 -14.566 1.00 1.00 H new ATOM 833 N ASP A 57 71.699 -9.523 -15.053 1.00 1.00 N ATOM 834 CA ASP A 57 70.275 -9.799 -14.876 1.00 1.00 C ATOM 835 C ASP A 57 69.636 -10.131 -16.228 1.00 1.00 C ATOM 836 O ASP A 57 69.432 -9.248 -17.062 1.00 1.00 O ATOM 837 CB ASP A 57 69.589 -8.600 -14.250 1.00 1.00 C ATOM 838 CG ASP A 57 69.734 -7.381 -15.155 1.00 1.00 C ATOM 839 OD1 ASP A 57 70.822 -6.831 -15.203 1.00 1.00 O ATOM 840 OD2 ASP A 57 68.756 -7.015 -15.786 1.00 1.00 O ATOM 0 H ASP A 57 71.943 -8.533 -15.052 1.00 1.00 H new ATOM 0 HA ASP A 57 70.157 -10.656 -14.212 1.00 1.00 H new ATOM 0 HB2 ASP A 57 68.534 -8.819 -14.088 1.00 1.00 H new ATOM 0 HB3 ASP A 57 70.025 -8.391 -13.273 1.00 1.00 H new ATOM 845 N TRP A 58 69.379 -11.427 -16.461 1.00 1.00 N ATOM 846 CA TRP A 58 68.828 -11.896 -17.741 1.00 1.00 C ATOM 847 C TRP A 58 67.274 -11.925 -17.800 1.00 1.00 C ATOM 848 O TRP A 58 66.555 -11.686 -16.830 1.00 1.00 O ATOM 849 CB TRP A 58 69.456 -13.280 -18.122 1.00 1.00 C ATOM 850 CG TRP A 58 70.443 -13.173 -19.272 1.00 1.00 C ATOM 851 CD1 TRP A 58 70.248 -12.475 -20.419 1.00 1.00 C ATOM 852 CD2 TRP A 58 71.763 -13.798 -19.403 1.00 1.00 C ATOM 853 NE1 TRP A 58 71.364 -12.612 -21.226 1.00 1.00 N ATOM 854 CE2 TRP A 58 72.321 -13.418 -20.649 1.00 1.00 C ATOM 855 CE3 TRP A 58 72.528 -14.641 -18.571 1.00 1.00 C ATOM 856 CZ2 TRP A 58 73.586 -13.857 -21.055 1.00 1.00 C ATOM 857 CZ3 TRP A 58 73.800 -15.086 -18.979 1.00 1.00 C ATOM 858 CH2 TRP A 58 74.327 -14.694 -20.218 1.00 1.00 C ATOM 0 H TRP A 58 69.544 -12.168 -15.780 1.00 1.00 H new ATOM 0 HA TRP A 58 69.112 -11.156 -18.489 1.00 1.00 H new ATOM 0 HB2 TRP A 58 69.961 -13.698 -17.251 1.00 1.00 H new ATOM 0 HB3 TRP A 58 68.661 -13.974 -18.393 1.00 1.00 H new ATOM 0 HD1 TRP A 58 69.364 -11.904 -20.663 1.00 1.00 H new ATOM 0 HE1 TRP A 58 71.466 -12.169 -22.139 1.00 1.00 H new ATOM 0 HE3 TRP A 58 72.135 -14.948 -17.613 1.00 1.00 H new ATOM 0 HZ2 TRP A 58 73.987 -13.550 -22.010 1.00 1.00 H new ATOM 0 HZ3 TRP A 58 74.374 -15.734 -18.333 1.00 1.00 H new ATOM 0 HH2 TRP A 58 75.304 -15.039 -20.524 1.00 1.00 H new ATOM 869 N ARG A 59 66.842 -12.214 -19.017 1.00 1.00 N ATOM 870 CA ARG A 59 65.400 -12.277 -19.339 1.00 1.00 C ATOM 871 C ARG A 59 64.741 -13.554 -18.765 1.00 1.00 C ATOM 872 O ARG A 59 63.821 -13.494 -17.949 1.00 1.00 O ATOM 873 CB ARG A 59 65.134 -12.220 -20.869 1.00 1.00 C ATOM 874 CG ARG A 59 66.189 -11.348 -21.599 1.00 1.00 C ATOM 875 CD ARG A 59 67.145 -12.254 -22.385 1.00 1.00 C ATOM 876 NE ARG A 59 67.490 -13.412 -21.564 1.00 1.00 N ATOM 877 CZ ARG A 59 68.118 -14.460 -22.074 1.00 1.00 C ATOM 878 NH1 ARG A 59 68.494 -14.454 -23.322 1.00 1.00 N ATOM 879 NH2 ARG A 59 68.358 -15.499 -21.323 1.00 1.00 N ATOM 0 H ARG A 59 67.457 -12.411 -19.806 1.00 1.00 H new ATOM 0 HA ARG A 59 64.955 -11.398 -18.873 1.00 1.00 H new ATOM 0 HB2 ARG A 59 65.148 -13.230 -21.279 1.00 1.00 H new ATOM 0 HB3 ARG A 59 64.138 -11.816 -21.051 1.00 1.00 H new ATOM 0 HG2 ARG A 59 65.695 -10.650 -22.274 1.00 1.00 H new ATOM 0 HG3 ARG A 59 66.747 -10.752 -20.877 1.00 1.00 H new ATOM 0 HD2 ARG A 59 66.677 -12.578 -23.314 1.00 1.00 H new ATOM 0 HD3 ARG A 59 68.046 -11.704 -22.657 1.00 1.00 H new ATOM 0 HE ARG A 59 67.241 -13.413 -20.575 1.00 1.00 H new ATOM 0 HH11 ARG A 59 68.305 -13.641 -23.908 1.00 1.00 H new ATOM 0 HH12 ARG A 59 68.978 -15.263 -23.713 1.00 1.00 H new ATOM 0 HH21 ARG A 59 68.062 -15.502 -20.347 1.00 1.00 H new ATOM 0 HH22 ARG A 59 68.842 -16.309 -21.712 1.00 1.00 H new ATOM 893 N TYR A 60 65.238 -14.687 -19.227 1.00 1.00 N ATOM 894 CA TYR A 60 64.770 -16.026 -18.835 1.00 1.00 C ATOM 895 C TYR A 60 65.543 -16.613 -17.663 1.00 1.00 C ATOM 896 O TYR A 60 65.165 -17.667 -17.120 1.00 1.00 O ATOM 897 CB TYR A 60 64.827 -16.997 -20.025 1.00 1.00 C ATOM 898 CG TYR A 60 64.565 -18.413 -19.539 1.00 1.00 C ATOM 899 CD1 TYR A 60 63.273 -18.798 -19.155 1.00 1.00 C ATOM 900 CD2 TYR A 60 65.621 -19.329 -19.451 1.00 1.00 C ATOM 901 CE1 TYR A 60 63.037 -20.097 -18.689 1.00 1.00 C ATOM 902 CE2 TYR A 60 65.384 -20.629 -18.985 1.00 1.00 C ATOM 903 CZ TYR A 60 64.093 -21.013 -18.604 1.00 1.00 C ATOM 904 OH TYR A 60 63.862 -22.294 -18.144 1.00 1.00 O ATOM 0 H TYR A 60 66.000 -14.714 -19.905 1.00 1.00 H new ATOM 0 HA TYR A 60 63.737 -15.897 -18.511 1.00 1.00 H new ATOM 0 HB2 TYR A 60 64.086 -16.715 -20.773 1.00 1.00 H new ATOM 0 HB3 TYR A 60 65.803 -16.942 -20.506 1.00 1.00 H new ATOM 0 HD1 TYR A 60 62.459 -18.092 -19.219 1.00 1.00 H new ATOM 0 HD2 TYR A 60 66.618 -19.033 -19.742 1.00 1.00 H new ATOM 0 HE1 TYR A 60 62.041 -20.393 -18.395 1.00 1.00 H new ATOM 0 HE2 TYR A 60 66.198 -21.335 -18.920 1.00 1.00 H new ATOM 0 HH TYR A 60 64.701 -22.800 -18.149 1.00 1.00 H new ATOM 914 N GLU A 61 66.623 -15.980 -17.253 1.00 1.00 N ATOM 915 CA GLU A 61 67.420 -16.492 -16.179 1.00 1.00 C ATOM 916 C GLU A 61 66.799 -16.182 -14.836 1.00 1.00 C ATOM 917 O GLU A 61 67.215 -16.720 -13.825 1.00 1.00 O ATOM 918 CB GLU A 61 68.770 -15.793 -16.279 1.00 1.00 C ATOM 919 CG GLU A 61 69.785 -16.317 -15.235 1.00 1.00 C ATOM 920 CD GLU A 61 70.230 -15.177 -14.313 1.00 1.00 C ATOM 921 OE1 GLU A 61 69.371 -14.420 -13.887 1.00 1.00 O ATOM 922 OE2 GLU A 61 71.417 -15.076 -14.052 1.00 1.00 O ATOM 0 H GLU A 61 66.963 -15.106 -17.655 1.00 1.00 H new ATOM 0 HA GLU A 61 67.506 -17.576 -16.256 1.00 1.00 H new ATOM 0 HB2 GLU A 61 69.177 -15.936 -17.280 1.00 1.00 H new ATOM 0 HB3 GLU A 61 68.632 -14.721 -16.141 1.00 1.00 H new ATOM 0 HG2 GLU A 61 69.333 -17.116 -14.646 1.00 1.00 H new ATOM 0 HG3 GLU A 61 70.651 -16.745 -15.741 1.00 1.00 H new ATOM 929 N VAL A 62 65.875 -15.237 -14.787 1.00 1.00 N ATOM 930 CA VAL A 62 65.327 -14.826 -13.501 1.00 1.00 C ATOM 931 C VAL A 62 64.912 -16.032 -12.693 1.00 1.00 C ATOM 932 O VAL A 62 65.306 -16.157 -11.568 1.00 1.00 O ATOM 933 CB VAL A 62 64.143 -13.864 -13.693 1.00 1.00 C ATOM 934 CG1 VAL A 62 64.646 -12.551 -14.308 1.00 1.00 C ATOM 935 CG2 VAL A 62 63.089 -14.492 -14.618 1.00 1.00 C ATOM 0 H VAL A 62 65.495 -14.750 -15.598 1.00 1.00 H new ATOM 0 HA VAL A 62 66.105 -14.296 -12.951 1.00 1.00 H new ATOM 0 HB VAL A 62 63.688 -13.666 -12.723 1.00 1.00 H new ATOM 0 HG11 VAL A 62 63.807 -11.868 -14.445 1.00 1.00 H new ATOM 0 HG12 VAL A 62 65.380 -12.096 -13.643 1.00 1.00 H new ATOM 0 HG13 VAL A 62 65.108 -12.755 -15.274 1.00 1.00 H new ATOM 0 HG21 VAL A 62 62.257 -13.799 -14.744 1.00 1.00 H new ATOM 0 HG22 VAL A 62 63.537 -14.703 -15.589 1.00 1.00 H new ATOM 0 HG23 VAL A 62 62.725 -15.420 -14.177 1.00 1.00 H new ATOM 945 N ALA A 63 64.085 -16.893 -13.227 1.00 1.00 N ATOM 946 CA ALA A 63 63.648 -18.059 -12.487 1.00 1.00 C ATOM 947 C ALA A 63 64.814 -19.015 -12.311 1.00 1.00 C ATOM 948 O ALA A 63 65.091 -19.491 -11.204 1.00 1.00 O ATOM 949 CB ALA A 63 62.547 -18.761 -13.280 1.00 1.00 C ATOM 0 H ALA A 63 63.699 -16.814 -14.168 1.00 1.00 H new ATOM 0 HA ALA A 63 63.275 -17.755 -11.509 1.00 1.00 H new ATOM 0 HB1 ALA A 63 62.209 -19.641 -12.733 1.00 1.00 H new ATOM 0 HB2 ALA A 63 61.709 -18.078 -13.422 1.00 1.00 H new ATOM 0 HB3 ALA A 63 62.936 -19.065 -14.252 1.00 1.00 H new ATOM 955 N HIS A 64 65.490 -19.298 -13.425 1.00 1.00 N ATOM 956 CA HIS A 64 66.616 -20.224 -13.370 1.00 1.00 C ATOM 957 C HIS A 64 67.555 -19.789 -12.229 1.00 1.00 C ATOM 958 O HIS A 64 67.828 -20.534 -11.300 1.00 1.00 O ATOM 959 CB HIS A 64 67.341 -20.233 -14.737 1.00 1.00 C ATOM 960 CG HIS A 64 67.633 -21.650 -15.176 1.00 1.00 C ATOM 961 ND1 HIS A 64 66.635 -22.605 -15.301 1.00 1.00 N ATOM 962 CD2 HIS A 64 68.798 -22.277 -15.542 1.00 1.00 C ATOM 963 CE1 HIS A 64 67.213 -23.744 -15.730 1.00 1.00 C ATOM 964 NE2 HIS A 64 68.530 -23.598 -15.894 1.00 1.00 N ATOM 0 H HIS A 64 65.286 -18.913 -14.347 1.00 1.00 H new ATOM 0 HA HIS A 64 66.275 -21.239 -13.169 1.00 1.00 H new ATOM 0 HB2 HIS A 64 66.724 -19.735 -15.485 1.00 1.00 H new ATOM 0 HB3 HIS A 64 68.272 -19.670 -14.665 1.00 1.00 H new ATOM 0 HD2 HIS A 64 69.775 -21.816 -15.555 1.00 1.00 H new ATOM 0 HE1 HIS A 64 66.677 -24.662 -15.918 1.00 1.00 H new ATOM 0 HE2 HIS A 64 69.197 -24.302 -16.209 1.00 1.00 H new ATOM 972 N ASP A 65 68.006 -18.554 -12.303 1.00 1.00 N ATOM 973 CA ASP A 65 68.870 -18.001 -11.267 1.00 1.00 C ATOM 974 C ASP A 65 68.052 -17.682 -10.015 1.00 1.00 C ATOM 975 O ASP A 65 68.401 -18.081 -8.891 1.00 1.00 O ATOM 976 CB ASP A 65 69.581 -16.747 -11.774 1.00 1.00 C ATOM 977 CG ASP A 65 70.346 -16.072 -10.641 1.00 1.00 C ATOM 978 OD1 ASP A 65 70.482 -16.689 -9.597 1.00 1.00 O ATOM 979 OD2 ASP A 65 70.783 -14.950 -10.835 1.00 1.00 O ATOM 0 H ASP A 65 67.792 -17.911 -13.066 1.00 1.00 H new ATOM 0 HA ASP A 65 69.626 -18.743 -11.012 1.00 1.00 H new ATOM 0 HB2 ASP A 65 70.268 -17.011 -12.578 1.00 1.00 H new ATOM 0 HB3 ASP A 65 68.852 -16.053 -12.193 1.00 1.00 H new ATOM 984 N GLY A 66 66.909 -17.035 -10.181 1.00 1.00 N ATOM 985 CA GLY A 66 66.054 -16.743 -9.055 1.00 1.00 C ATOM 986 C GLY A 66 65.376 -18.022 -8.581 1.00 1.00 C ATOM 987 O GLY A 66 64.353 -17.985 -7.900 1.00 1.00 O ATOM 0 H GLY A 66 66.559 -16.706 -11.081 1.00 1.00 H new ATOM 0 HA2 GLY A 66 66.639 -16.308 -8.245 1.00 1.00 H new ATOM 0 HA3 GLY A 66 65.303 -16.005 -9.338 1.00 1.00 H new ATOM 991 N ARG A 67 66.027 -19.144 -8.867 1.00 1.00 N ATOM 992 CA ARG A 67 65.582 -20.443 -8.394 1.00 1.00 C ATOM 993 C ARG A 67 65.890 -20.460 -6.905 1.00 1.00 C ATOM 994 O ARG A 67 65.811 -21.517 -6.279 1.00 1.00 O ATOM 995 CB ARG A 67 66.305 -21.653 -9.048 1.00 1.00 C ATOM 996 CG ARG A 67 65.549 -22.249 -10.278 1.00 1.00 C ATOM 997 CD ARG A 67 65.237 -23.750 -10.057 1.00 1.00 C ATOM 998 NE ARG A 67 64.040 -23.904 -9.229 1.00 1.00 N ATOM 999 CZ ARG A 67 62.828 -23.975 -9.775 1.00 1.00 C ATOM 1000 NH1 ARG A 67 62.690 -23.917 -11.072 1.00 1.00 N ATOM 1001 NH2 ARG A 67 61.777 -24.105 -9.015 1.00 1.00 N ATOM 0 H ARG A 67 66.876 -19.175 -9.432 1.00 1.00 H new ATOM 0 HA ARG A 67 64.528 -20.556 -8.646 1.00 1.00 H new ATOM 0 HB2 ARG A 67 67.302 -21.343 -9.361 1.00 1.00 H new ATOM 0 HB3 ARG A 67 66.435 -22.435 -8.299 1.00 1.00 H new ATOM 0 HG2 ARG A 67 64.621 -21.700 -10.441 1.00 1.00 H new ATOM 0 HG3 ARG A 67 66.154 -22.127 -11.176 1.00 1.00 H new ATOM 0 HD2 ARG A 67 65.089 -24.243 -11.018 1.00 1.00 H new ATOM 0 HD3 ARG A 67 66.085 -24.238 -9.576 1.00 1.00 H new ATOM 0 HE ARG A 67 64.136 -23.958 -8.215 1.00 1.00 H new ATOM 0 HH11 ARG A 67 63.511 -23.817 -11.668 1.00 1.00 H new ATOM 0 HH12 ARG A 67 61.761 -23.972 -11.489 1.00 1.00 H new ATOM 0 HH21 ARG A 67 61.883 -24.152 -8.002 1.00 1.00 H new ATOM 0 HH22 ARG A 67 60.848 -24.159 -9.434 1.00 1.00 H new ATOM 1015 N LEU A 68 66.347 -19.297 -6.365 1.00 1.00 N ATOM 1016 CA LEU A 68 66.768 -19.221 -4.945 1.00 1.00 C ATOM 1017 C LEU A 68 65.902 -20.176 -4.130 1.00 1.00 C ATOM 1018 O LEU A 68 66.333 -20.720 -3.123 1.00 1.00 O ATOM 1019 CB LEU A 68 66.651 -17.775 -4.308 1.00 1.00 C ATOM 1020 CG LEU A 68 66.242 -16.694 -5.324 1.00 1.00 C ATOM 1021 CD1 LEU A 68 64.713 -16.642 -5.480 1.00 1.00 C ATOM 1022 CD2 LEU A 68 66.726 -15.310 -4.844 1.00 1.00 C ATOM 0 H LEU A 68 66.431 -18.421 -6.880 1.00 1.00 H new ATOM 0 HA LEU A 68 67.824 -19.489 -4.921 1.00 1.00 H new ATOM 0 HB2 LEU A 68 65.920 -17.800 -3.500 1.00 1.00 H new ATOM 0 HB3 LEU A 68 67.608 -17.503 -3.864 1.00 1.00 H new ATOM 0 HG LEU A 68 66.698 -16.945 -6.281 1.00 1.00 H new ATOM 0 HD11 LEU A 68 64.447 -15.871 -6.203 1.00 1.00 H new ATOM 0 HD12 LEU A 68 64.350 -17.608 -5.830 1.00 1.00 H new ATOM 0 HD13 LEU A 68 64.257 -16.410 -4.518 1.00 1.00 H new ATOM 0 HD21 LEU A 68 66.433 -14.550 -5.569 1.00 1.00 H new ATOM 0 HD22 LEU A 68 66.276 -15.082 -3.878 1.00 1.00 H new ATOM 0 HD23 LEU A 68 67.812 -15.318 -4.746 1.00 1.00 H new ATOM 1034 N LEU A 69 64.688 -20.393 -4.608 1.00 1.00 N ATOM 1035 CA LEU A 69 63.807 -21.325 -3.900 1.00 1.00 C ATOM 1036 C LEU A 69 64.439 -22.726 -3.923 1.00 1.00 C ATOM 1037 O LEU A 69 64.853 -23.238 -2.884 1.00 1.00 O ATOM 1038 CB LEU A 69 62.422 -21.341 -4.560 1.00 1.00 C ATOM 1039 CG LEU A 69 61.459 -22.293 -3.796 1.00 1.00 C ATOM 1040 CD1 LEU A 69 60.043 -21.708 -3.800 1.00 1.00 C ATOM 1041 CD2 LEU A 69 61.408 -23.676 -4.474 1.00 1.00 C ATOM 0 H LEU A 69 64.296 -19.962 -5.445 1.00 1.00 H new ATOM 0 HA LEU A 69 63.685 -21.006 -2.865 1.00 1.00 H new ATOM 0 HB2 LEU A 69 62.009 -20.332 -4.574 1.00 1.00 H new ATOM 0 HB3 LEU A 69 62.512 -21.663 -5.597 1.00 1.00 H new ATOM 0 HG LEU A 69 61.828 -22.399 -2.776 1.00 1.00 H new ATOM 0 HD11 LEU A 69 59.371 -22.378 -3.264 1.00 1.00 H new ATOM 0 HD12 LEU A 69 60.050 -20.734 -3.311 1.00 1.00 H new ATOM 0 HD13 LEU A 69 59.699 -21.595 -4.828 1.00 1.00 H new ATOM 0 HD21 LEU A 69 60.728 -24.326 -3.923 1.00 1.00 H new ATOM 0 HD22 LEU A 69 61.054 -23.566 -5.499 1.00 1.00 H new ATOM 0 HD23 LEU A 69 62.406 -24.115 -4.480 1.00 1.00 H new ATOM 1053 N ALA A 70 64.584 -23.320 -5.115 1.00 1.00 N ATOM 1054 CA ALA A 70 65.256 -24.632 -5.168 1.00 1.00 C ATOM 1055 C ALA A 70 66.741 -24.331 -5.072 1.00 1.00 C ATOM 1056 O ALA A 70 67.360 -24.559 -4.037 1.00 1.00 O ATOM 1057 CB ALA A 70 64.934 -25.392 -6.459 1.00 1.00 C ATOM 0 H ALA A 70 64.267 -22.944 -6.009 1.00 1.00 H new ATOM 0 HA ALA A 70 64.916 -25.277 -4.358 1.00 1.00 H new ATOM 0 HB1 ALA A 70 65.450 -26.352 -6.454 1.00 1.00 H new ATOM 0 HB2 ALA A 70 63.859 -25.558 -6.525 1.00 1.00 H new ATOM 0 HB3 ALA A 70 65.264 -24.807 -7.318 1.00 1.00 H new ATOM 1063 N ALA A 71 67.299 -23.825 -6.171 1.00 1.00 N ATOM 1064 CA ALA A 71 68.701 -23.455 -6.308 1.00 1.00 C ATOM 1065 C ALA A 71 69.268 -22.685 -5.118 1.00 1.00 C ATOM 1066 O ALA A 71 70.417 -22.253 -5.188 1.00 1.00 O ATOM 1067 CB ALA A 71 68.899 -22.652 -7.596 1.00 1.00 C ATOM 0 H ALA A 71 66.763 -23.656 -7.022 1.00 1.00 H new ATOM 0 HA ALA A 71 69.259 -24.391 -6.347 1.00 1.00 H new ATOM 0 HB1 ALA A 71 69.949 -22.377 -7.695 1.00 1.00 H new ATOM 0 HB2 ALA A 71 68.600 -23.257 -8.452 1.00 1.00 H new ATOM 0 HB3 ALA A 71 68.289 -21.749 -7.559 1.00 1.00 H new ATOM 1073 N HIS A 72 68.479 -22.470 -4.048 1.00 1.00 N ATOM 1074 CA HIS A 72 68.938 -21.707 -2.878 1.00 1.00 C ATOM 1075 C HIS A 72 70.448 -21.815 -2.695 1.00 1.00 C ATOM 1076 O HIS A 72 71.159 -20.817 -2.826 1.00 1.00 O ATOM 1077 CB HIS A 72 68.178 -22.247 -1.623 1.00 1.00 C ATOM 1078 CG HIS A 72 69.122 -22.666 -0.510 1.00 1.00 C ATOM 1079 ND1 HIS A 72 69.911 -21.755 0.171 1.00 1.00 N ATOM 1080 CD2 HIS A 72 69.413 -23.897 0.037 1.00 1.00 C ATOM 1081 CE1 HIS A 72 70.632 -22.440 1.080 1.00 1.00 C ATOM 1082 NE2 HIS A 72 70.366 -23.748 1.042 1.00 1.00 N ATOM 0 H HIS A 72 67.522 -22.815 -3.972 1.00 1.00 H new ATOM 0 HA HIS A 72 68.721 -20.649 -3.022 1.00 1.00 H new ATOM 0 HB2 HIS A 72 67.502 -21.477 -1.252 1.00 1.00 H new ATOM 0 HB3 HIS A 72 67.562 -23.098 -1.913 1.00 1.00 H new ATOM 0 HD2 HIS A 72 68.970 -24.834 -0.267 1.00 1.00 H new ATOM 0 HE1 HIS A 72 71.340 -21.986 1.758 1.00 1.00 H new ATOM 0 HE2 HIS A 72 70.773 -24.480 1.624 1.00 1.00 H new ATOM 1090 N MET A 73 70.946 -23.005 -2.414 1.00 1.00 N ATOM 1091 CA MET A 73 72.380 -23.154 -2.253 1.00 1.00 C ATOM 1092 C MET A 73 73.052 -22.976 -3.615 1.00 1.00 C ATOM 1093 O MET A 73 74.037 -22.246 -3.736 1.00 1.00 O ATOM 1094 CB MET A 73 72.720 -24.517 -1.635 1.00 1.00 C ATOM 1095 CG MET A 73 71.738 -25.588 -2.122 1.00 1.00 C ATOM 1096 SD MET A 73 72.457 -27.227 -1.843 1.00 1.00 S ATOM 1097 CE MET A 73 72.698 -27.081 -0.053 1.00 1.00 C ATOM 0 H MET A 73 70.399 -23.858 -2.296 1.00 1.00 H new ATOM 0 HA MET A 73 72.753 -22.391 -1.570 1.00 1.00 H new ATOM 0 HB2 MET A 73 73.738 -24.800 -1.902 1.00 1.00 H new ATOM 0 HB3 MET A 73 72.683 -24.449 -0.548 1.00 1.00 H new ATOM 0 HG2 MET A 73 70.791 -25.498 -1.591 1.00 1.00 H new ATOM 0 HG3 MET A 73 71.524 -25.447 -3.181 1.00 1.00 H new ATOM 0 HE1 MET A 73 72.653 -28.070 0.402 1.00 1.00 H new ATOM 0 HE2 MET A 73 73.671 -26.634 0.148 1.00 1.00 H new ATOM 0 HE3 MET A 73 71.915 -26.451 0.369 1.00 1.00 H new ATOM 1107 N VAL A 74 72.567 -23.697 -4.624 1.00 1.00 N ATOM 1108 CA VAL A 74 73.194 -23.650 -5.935 1.00 1.00 C ATOM 1109 C VAL A 74 73.522 -22.210 -6.348 1.00 1.00 C ATOM 1110 O VAL A 74 74.602 -22.007 -6.900 1.00 1.00 O ATOM 1111 CB VAL A 74 72.312 -24.328 -6.979 1.00 1.00 C ATOM 1112 CG1 VAL A 74 72.951 -24.214 -8.362 1.00 1.00 C ATOM 1113 CG2 VAL A 74 72.121 -25.806 -6.621 1.00 1.00 C ATOM 0 H VAL A 74 71.755 -24.310 -4.558 1.00 1.00 H new ATOM 0 HA VAL A 74 74.135 -24.197 -5.874 1.00 1.00 H new ATOM 0 HB VAL A 74 71.341 -23.832 -6.993 1.00 1.00 H new ATOM 0 HG11 VAL A 74 72.313 -24.701 -9.099 1.00 1.00 H new ATOM 0 HG12 VAL A 74 73.069 -23.162 -8.623 1.00 1.00 H new ATOM 0 HG13 VAL A 74 73.928 -24.697 -8.352 1.00 1.00 H new ATOM 0 HG21 VAL A 74 71.490 -26.283 -7.371 1.00 1.00 H new ATOM 0 HG22 VAL A 74 73.091 -26.302 -6.594 1.00 1.00 H new ATOM 0 HG23 VAL A 74 71.646 -25.885 -5.643 1.00 1.00 H new ATOM 1123 N ASN A 75 72.644 -21.190 -6.122 1.00 1.00 N ATOM 1124 CA ASN A 75 72.922 -19.771 -6.494 1.00 1.00 C ATOM 1125 C ASN A 75 74.396 -19.377 -6.285 1.00 1.00 C ATOM 1126 O ASN A 75 74.880 -18.364 -6.791 1.00 1.00 O ATOM 1127 CB ASN A 75 72.023 -18.892 -5.591 1.00 1.00 C ATOM 1128 CG ASN A 75 71.472 -17.682 -6.340 1.00 1.00 C ATOM 1129 OD1 ASN A 75 71.680 -16.484 -5.863 1.00 1.00 O flip ATOM 1130 ND2 ASN A 75 70.834 -17.835 -7.382 1.00 1.00 N flip ATOM 0 H ASN A 75 71.734 -21.326 -5.682 1.00 1.00 H new ATOM 0 HA ASN A 75 72.714 -19.632 -7.555 1.00 1.00 H new ATOM 0 HB2 ASN A 75 71.196 -19.491 -5.210 1.00 1.00 H new ATOM 0 HB3 ASN A 75 72.596 -18.554 -4.727 1.00 1.00 H new ATOM 0 HD21 ASN A 75 70.675 -18.773 -7.750 1.00 1.00 H new ATOM 0 HD22 ASN A 75 70.465 -17.024 -7.878 1.00 1.00 H new ATOM 1137 N GLY A 76 75.064 -20.240 -5.574 1.00 1.00 N ATOM 1138 CA GLY A 76 76.485 -20.078 -5.298 1.00 1.00 C ATOM 1139 C GLY A 76 77.199 -19.663 -6.603 1.00 1.00 C ATOM 1140 O GLY A 76 78.224 -19.005 -6.577 1.00 1.00 O ATOM 0 H GLY A 76 74.651 -21.078 -5.165 1.00 1.00 H new ATOM 0 HA2 GLY A 76 76.636 -19.322 -4.528 1.00 1.00 H new ATOM 0 HA3 GLY A 76 76.905 -21.009 -4.917 1.00 1.00 H new ATOM 1144 N ILE A 77 76.612 -20.038 -7.748 1.00 1.00 N ATOM 1145 CA ILE A 77 77.199 -19.650 -9.036 1.00 1.00 C ATOM 1146 C ILE A 77 77.026 -18.134 -9.184 1.00 1.00 C ATOM 1147 O ILE A 77 77.928 -17.440 -9.592 1.00 1.00 O ATOM 1148 CB ILE A 77 76.623 -20.454 -10.244 1.00 1.00 C ATOM 1149 CG1 ILE A 77 75.315 -19.860 -10.811 1.00 1.00 C ATOM 1150 CG2 ILE A 77 76.363 -21.904 -9.823 1.00 1.00 C ATOM 1151 CD1 ILE A 77 74.141 -20.080 -9.848 1.00 1.00 C ATOM 0 H ILE A 77 75.758 -20.592 -7.810 1.00 1.00 H new ATOM 0 HA ILE A 77 78.259 -19.902 -9.045 1.00 1.00 H new ATOM 0 HB ILE A 77 77.373 -20.400 -11.033 1.00 1.00 H new ATOM 0 HG12 ILE A 77 75.446 -18.793 -10.991 1.00 1.00 H new ATOM 0 HG13 ILE A 77 75.091 -20.321 -11.773 1.00 1.00 H new ATOM 0 HG21 ILE A 77 75.961 -22.462 -10.669 1.00 1.00 H new ATOM 0 HG22 ILE A 77 77.297 -22.361 -9.498 1.00 1.00 H new ATOM 0 HG23 ILE A 77 75.645 -21.922 -9.003 1.00 1.00 H new ATOM 0 HD11 ILE A 77 73.235 -19.651 -10.275 1.00 1.00 H new ATOM 0 HD12 ILE A 77 73.996 -21.149 -9.689 1.00 1.00 H new ATOM 0 HD13 ILE A 77 74.357 -19.597 -8.895 1.00 1.00 H new ATOM 1163 N VAL A 78 75.802 -17.687 -8.920 1.00 1.00 N ATOM 1164 CA VAL A 78 75.469 -16.260 -9.098 1.00 1.00 C ATOM 1165 C VAL A 78 76.730 -15.431 -8.774 1.00 1.00 C ATOM 1166 O VAL A 78 77.013 -14.435 -9.438 1.00 1.00 O ATOM 1167 CB VAL A 78 74.316 -15.803 -8.193 1.00 1.00 C ATOM 1168 CG1 VAL A 78 74.153 -14.281 -8.303 1.00 1.00 C ATOM 1169 CG2 VAL A 78 73.018 -16.458 -8.654 1.00 1.00 C ATOM 0 H VAL A 78 75.033 -18.270 -8.589 1.00 1.00 H new ATOM 0 HA VAL A 78 75.143 -16.112 -10.127 1.00 1.00 H new ATOM 0 HB VAL A 78 74.536 -16.086 -7.164 1.00 1.00 H new ATOM 0 HG11 VAL A 78 73.335 -13.955 -7.661 1.00 1.00 H new ATOM 0 HG12 VAL A 78 75.076 -13.793 -7.990 1.00 1.00 H new ATOM 0 HG13 VAL A 78 73.932 -14.012 -9.336 1.00 1.00 H new ATOM 0 HG21 VAL A 78 72.199 -16.134 -8.012 1.00 1.00 H new ATOM 0 HG22 VAL A 78 72.809 -16.167 -9.683 1.00 1.00 H new ATOM 0 HG23 VAL A 78 73.117 -17.542 -8.597 1.00 1.00 H new ATOM 1179 N ILE A 79 77.511 -15.903 -7.783 1.00 1.00 N ATOM 1180 CA ILE A 79 78.778 -15.260 -7.405 1.00 1.00 C ATOM 1181 C ILE A 79 79.998 -15.974 -8.040 1.00 1.00 C ATOM 1182 O ILE A 79 81.024 -15.352 -8.332 1.00 1.00 O ATOM 1183 CB ILE A 79 78.900 -15.243 -5.871 1.00 1.00 C ATOM 1184 CG1 ILE A 79 78.809 -16.675 -5.323 1.00 1.00 C ATOM 1185 CG2 ILE A 79 77.753 -14.409 -5.302 1.00 1.00 C ATOM 1186 CD1 ILE A 79 79.050 -16.703 -3.803 1.00 1.00 C ATOM 0 H ILE A 79 77.283 -16.730 -7.230 1.00 1.00 H new ATOM 0 HA ILE A 79 78.772 -14.238 -7.785 1.00 1.00 H new ATOM 0 HB ILE A 79 79.859 -14.814 -5.582 1.00 1.00 H new ATOM 0 HG12 ILE A 79 77.827 -17.091 -5.546 1.00 1.00 H new ATOM 0 HG13 ILE A 79 79.544 -17.306 -5.823 1.00 1.00 H new ATOM 0 HG21 ILE A 79 77.824 -14.386 -4.215 1.00 1.00 H new ATOM 0 HG22 ILE A 79 77.814 -13.393 -5.691 1.00 1.00 H new ATOM 0 HG23 ILE A 79 76.801 -14.852 -5.594 1.00 1.00 H new ATOM 0 HD11 ILE A 79 78.980 -17.729 -3.442 1.00 1.00 H new ATOM 0 HD12 ILE A 79 80.043 -16.309 -3.585 1.00 1.00 H new ATOM 0 HD13 ILE A 79 78.299 -16.091 -3.304 1.00 1.00 H new ATOM 1198 N ALA A 80 79.842 -17.282 -8.287 1.00 1.00 N ATOM 1199 CA ALA A 80 80.887 -18.115 -8.917 1.00 1.00 C ATOM 1200 C ALA A 80 80.855 -18.104 -10.465 1.00 1.00 C ATOM 1201 O ALA A 80 81.820 -18.543 -11.091 1.00 1.00 O ATOM 1202 CB ALA A 80 80.825 -19.574 -8.408 1.00 1.00 C ATOM 0 H ALA A 80 78.991 -17.796 -8.058 1.00 1.00 H new ATOM 0 HA ALA A 80 81.830 -17.658 -8.617 1.00 1.00 H new ATOM 0 HB1 ALA A 80 81.606 -20.161 -8.890 1.00 1.00 H new ATOM 0 HB2 ALA A 80 80.974 -19.589 -7.328 1.00 1.00 H new ATOM 0 HB3 ALA A 80 79.851 -20.001 -8.646 1.00 1.00 H new ATOM 1208 N GLU A 81 79.773 -17.610 -11.092 1.00 1.00 N ATOM 1209 CA GLU A 81 79.707 -17.591 -12.543 1.00 1.00 C ATOM 1210 C GLU A 81 80.437 -16.363 -13.049 1.00 1.00 C ATOM 1211 O GLU A 81 81.505 -16.491 -13.649 1.00 1.00 O ATOM 1212 CB GLU A 81 78.233 -17.653 -13.014 1.00 1.00 C ATOM 1213 CG GLU A 81 77.476 -16.341 -12.741 1.00 1.00 C ATOM 1214 CD GLU A 81 75.969 -16.593 -12.777 1.00 1.00 C ATOM 1215 OE1 GLU A 81 75.581 -17.693 -13.137 1.00 1.00 O ATOM 1216 OE2 GLU A 81 75.230 -15.677 -12.448 1.00 1.00 O ATOM 0 H GLU A 81 78.954 -17.229 -10.619 1.00 1.00 H new ATOM 0 HA GLU A 81 80.199 -18.469 -12.961 1.00 1.00 H new ATOM 0 HB2 GLU A 81 78.204 -17.871 -14.082 1.00 1.00 H new ATOM 0 HB3 GLU A 81 77.726 -18.474 -12.507 1.00 1.00 H new ATOM 0 HG2 GLU A 81 77.763 -15.941 -11.769 1.00 1.00 H new ATOM 0 HG3 GLU A 81 77.746 -15.593 -13.486 1.00 1.00 H new ATOM 1223 N ASP A 82 79.894 -15.173 -12.817 1.00 1.00 N ATOM 1224 CA ASP A 82 80.533 -13.957 -13.256 1.00 1.00 C ATOM 1225 C ASP A 82 81.713 -13.614 -12.363 1.00 1.00 C ATOM 1226 O ASP A 82 82.517 -12.759 -12.725 1.00 1.00 O ATOM 1227 CB ASP A 82 79.523 -12.816 -13.275 1.00 1.00 C ATOM 1228 CG ASP A 82 78.455 -13.119 -14.318 1.00 1.00 C ATOM 1229 OD1 ASP A 82 78.822 -13.368 -15.453 1.00 1.00 O ATOM 1230 OD2 ASP A 82 77.288 -13.110 -13.964 1.00 1.00 O ATOM 0 H ASP A 82 79.011 -15.034 -12.326 1.00 1.00 H new ATOM 0 HA ASP A 82 80.911 -14.108 -14.267 1.00 1.00 H new ATOM 0 HB2 ASP A 82 79.067 -12.700 -12.292 1.00 1.00 H new ATOM 0 HB3 ASP A 82 80.022 -11.875 -13.508 1.00 1.00 H new ATOM 1235 N ALA A 83 81.843 -14.319 -11.221 1.00 1.00 N ATOM 1236 CA ALA A 83 82.978 -14.126 -10.304 1.00 1.00 C ATOM 1237 C ALA A 83 84.173 -13.454 -10.982 1.00 1.00 C ATOM 1238 O ALA A 83 84.797 -12.587 -10.378 1.00 1.00 O ATOM 1239 CB ALA A 83 83.386 -15.505 -9.739 1.00 1.00 C ATOM 0 H ALA A 83 81.175 -15.026 -10.914 1.00 1.00 H new ATOM 0 HA ALA A 83 82.664 -13.457 -9.502 1.00 1.00 H new ATOM 0 HB1 ALA A 83 84.227 -15.384 -9.056 1.00 1.00 H new ATOM 0 HB2 ALA A 83 82.544 -15.942 -9.203 1.00 1.00 H new ATOM 0 HB3 ALA A 83 83.676 -16.163 -10.558 1.00 1.00 H new ATOM 1245 N LEU A 84 84.537 -13.882 -12.203 1.00 1.00 N ATOM 1246 CA LEU A 84 85.698 -13.335 -12.926 1.00 1.00 C ATOM 1247 C LEU A 84 85.929 -11.873 -12.594 1.00 1.00 C ATOM 1248 O LEU A 84 87.074 -11.428 -12.484 1.00 1.00 O ATOM 1249 CB LEU A 84 85.344 -13.462 -14.420 1.00 1.00 C ATOM 1250 CG LEU A 84 86.555 -13.227 -15.344 1.00 1.00 C ATOM 1251 CD1 LEU A 84 87.298 -14.546 -15.593 1.00 1.00 C ATOM 1252 CD2 LEU A 84 86.057 -12.687 -16.698 1.00 1.00 C ATOM 0 H LEU A 84 84.039 -14.611 -12.713 1.00 1.00 H new ATOM 0 HA LEU A 84 86.607 -13.871 -12.653 1.00 1.00 H new ATOM 0 HB2 LEU A 84 84.936 -14.455 -14.609 1.00 1.00 H new ATOM 0 HB3 LEU A 84 84.561 -12.744 -14.665 1.00 1.00 H new ATOM 0 HG LEU A 84 87.228 -12.514 -14.868 1.00 1.00 H new ATOM 0 HD11 LEU A 84 88.151 -14.365 -16.247 1.00 1.00 H new ATOM 0 HD12 LEU A 84 87.648 -14.951 -14.644 1.00 1.00 H new ATOM 0 HD13 LEU A 84 86.623 -15.260 -16.065 1.00 1.00 H new ATOM 0 HD21 LEU A 84 86.908 -12.518 -17.358 1.00 1.00 H new ATOM 0 HD22 LEU A 84 85.383 -13.413 -17.154 1.00 1.00 H new ATOM 0 HD23 LEU A 84 85.527 -11.748 -16.542 1.00 1.00 H new ATOM 1264 N ILE A 85 84.845 -11.150 -12.353 1.00 1.00 N ATOM 1265 CA ILE A 85 84.943 -9.759 -11.943 1.00 1.00 C ATOM 1266 C ILE A 85 84.748 -9.669 -10.434 1.00 1.00 C ATOM 1267 O ILE A 85 85.390 -8.900 -9.759 1.00 1.00 O ATOM 1268 CB ILE A 85 83.931 -8.888 -12.698 1.00 1.00 C ATOM 1269 CG1 ILE A 85 82.496 -9.352 -12.434 1.00 1.00 C ATOM 1270 CG2 ILE A 85 84.219 -8.978 -14.196 1.00 1.00 C ATOM 1271 CD1 ILE A 85 81.524 -8.349 -13.061 1.00 1.00 C ATOM 0 H ILE A 85 83.891 -11.503 -12.434 1.00 1.00 H new ATOM 0 HA ILE A 85 85.933 -9.377 -12.193 1.00 1.00 H new ATOM 0 HB ILE A 85 84.029 -7.860 -12.349 1.00 1.00 H new ATOM 0 HG12 ILE A 85 82.338 -10.344 -12.856 1.00 1.00 H new ATOM 0 HG13 ILE A 85 82.317 -9.430 -11.362 1.00 1.00 H new ATOM 0 HG21 ILE A 85 83.504 -8.362 -14.742 1.00 1.00 H new ATOM 0 HG22 ILE A 85 85.230 -8.623 -14.394 1.00 1.00 H new ATOM 0 HG23 ILE A 85 84.128 -10.014 -14.522 1.00 1.00 H new ATOM 0 HD11 ILE A 85 80.499 -8.672 -12.878 1.00 1.00 H new ATOM 0 HD12 ILE A 85 81.679 -7.366 -12.617 1.00 1.00 H new ATOM 0 HD13 ILE A 85 81.700 -8.294 -14.135 1.00 1.00 H new ATOM 1283 N ALA A 86 83.859 -10.495 -9.921 1.00 1.00 N ATOM 1284 CA ALA A 86 83.602 -10.479 -8.476 1.00 1.00 C ATOM 1285 C ALA A 86 84.834 -10.953 -7.681 1.00 1.00 C ATOM 1286 O ALA A 86 85.338 -10.190 -6.855 1.00 1.00 O ATOM 1287 CB ALA A 86 82.343 -11.285 -8.096 1.00 1.00 C ATOM 0 H ALA A 86 83.312 -11.170 -10.455 1.00 1.00 H new ATOM 0 HA ALA A 86 83.407 -9.442 -8.202 1.00 1.00 H new ATOM 0 HB1 ALA A 86 82.196 -11.243 -7.017 1.00 1.00 H new ATOM 0 HB2 ALA A 86 81.474 -10.860 -8.598 1.00 1.00 H new ATOM 0 HB3 ALA A 86 82.469 -12.323 -8.405 1.00 1.00 H new ATOM 1293 N GLU A 87 85.342 -12.181 -7.884 1.00 1.00 N ATOM 1294 CA GLU A 87 86.512 -12.642 -7.123 1.00 1.00 C ATOM 1295 C GLU A 87 87.791 -11.902 -7.520 1.00 1.00 C ATOM 1296 O GLU A 87 88.766 -11.914 -6.772 1.00 1.00 O ATOM 1297 CB GLU A 87 86.705 -14.149 -7.362 1.00 1.00 C ATOM 1298 CG GLU A 87 87.181 -14.397 -8.803 1.00 1.00 C ATOM 1299 CD GLU A 87 86.927 -15.848 -9.206 1.00 1.00 C ATOM 1300 OE1 GLU A 87 86.991 -16.703 -8.339 1.00 1.00 O ATOM 1301 OE2 GLU A 87 86.672 -16.079 -10.376 1.00 1.00 O ATOM 0 H GLU A 87 84.971 -12.856 -8.552 1.00 1.00 H new ATOM 0 HA GLU A 87 86.325 -12.436 -6.069 1.00 1.00 H new ATOM 0 HB2 GLU A 87 87.434 -14.547 -6.656 1.00 1.00 H new ATOM 0 HB3 GLU A 87 85.768 -14.677 -7.184 1.00 1.00 H new ATOM 0 HG2 GLU A 87 86.659 -13.727 -9.486 1.00 1.00 H new ATOM 0 HG3 GLU A 87 88.244 -14.171 -8.885 1.00 1.00 H new ATOM 1308 N ALA A 88 87.789 -11.260 -8.688 1.00 1.00 N ATOM 1309 CA ALA A 88 88.982 -10.513 -9.130 1.00 1.00 C ATOM 1310 C ALA A 88 88.880 -9.096 -8.590 1.00 1.00 C ATOM 1311 O ALA A 88 89.844 -8.328 -8.551 1.00 1.00 O ATOM 1312 CB ALA A 88 89.080 -10.504 -10.656 1.00 1.00 C ATOM 0 H ALA A 88 87.001 -11.237 -9.335 1.00 1.00 H new ATOM 0 HA ALA A 88 89.884 -10.993 -8.749 1.00 1.00 H new ATOM 0 HB1 ALA A 88 89.967 -9.948 -10.960 1.00 1.00 H new ATOM 0 HB2 ALA A 88 89.151 -11.528 -11.022 1.00 1.00 H new ATOM 0 HB3 ALA A 88 88.193 -10.029 -11.075 1.00 1.00 H new ATOM 1318 N VAL A 89 87.672 -8.829 -8.130 1.00 1.00 N ATOM 1319 CA VAL A 89 87.347 -7.556 -7.519 1.00 1.00 C ATOM 1320 C VAL A 89 87.555 -7.648 -6.011 1.00 1.00 C ATOM 1321 O VAL A 89 86.790 -7.080 -5.236 1.00 1.00 O ATOM 1322 CB VAL A 89 85.974 -6.987 -7.949 1.00 1.00 C ATOM 1323 CG1 VAL A 89 85.595 -5.756 -7.076 1.00 1.00 C ATOM 1324 CG2 VAL A 89 86.087 -6.518 -9.434 1.00 1.00 C ATOM 0 H VAL A 89 86.892 -9.486 -8.169 1.00 1.00 H new ATOM 0 HA VAL A 89 88.040 -6.805 -7.899 1.00 1.00 H new ATOM 0 HB VAL A 89 85.212 -7.757 -7.830 1.00 1.00 H new ATOM 0 HG11 VAL A 89 84.626 -5.369 -7.393 1.00 1.00 H new ATOM 0 HG12 VAL A 89 85.541 -6.055 -6.029 1.00 1.00 H new ATOM 0 HG13 VAL A 89 86.351 -4.980 -7.193 1.00 1.00 H new ATOM 0 HG21 VAL A 89 85.130 -6.112 -9.761 1.00 1.00 H new ATOM 0 HG22 VAL A 89 86.854 -5.748 -9.515 1.00 1.00 H new ATOM 0 HG23 VAL A 89 86.356 -7.366 -10.064 1.00 1.00 H new ATOM 1334 N GLY A 90 88.643 -8.347 -5.557 1.00 1.00 N ATOM 1335 CA GLY A 90 88.939 -8.419 -4.145 1.00 1.00 C ATOM 1336 C GLY A 90 89.268 -7.038 -3.614 1.00 1.00 C ATOM 1337 O GLY A 90 88.937 -6.771 -2.458 1.00 1.00 O ATOM 0 H GLY A 90 89.298 -8.848 -6.158 1.00 1.00 H new ATOM 0 HA2 GLY A 90 88.086 -8.831 -3.607 1.00 1.00 H new ATOM 0 HA3 GLY A 90 89.779 -9.093 -3.975 1.00 1.00 H new ATOM 1341 N PRO A 91 89.843 -6.106 -4.409 1.00 1.00 N ATOM 1342 CA PRO A 91 90.059 -4.713 -3.931 1.00 1.00 C ATOM 1343 C PRO A 91 88.859 -4.217 -3.113 1.00 1.00 C ATOM 1344 O PRO A 91 88.896 -3.133 -2.537 1.00 1.00 O ATOM 1345 CB PRO A 91 90.213 -3.890 -5.218 1.00 1.00 C ATOM 1346 CG PRO A 91 90.755 -4.836 -6.248 1.00 1.00 C ATOM 1347 CD PRO A 91 90.428 -6.271 -5.777 1.00 1.00 C ATOM 0 HA PRO A 91 90.925 -4.633 -3.275 1.00 1.00 H new ATOM 0 HB2 PRO A 91 89.256 -3.476 -5.534 1.00 1.00 H new ATOM 0 HB3 PRO A 91 90.890 -3.049 -5.065 1.00 1.00 H new ATOM 0 HG2 PRO A 91 90.307 -4.640 -7.222 1.00 1.00 H new ATOM 0 HG3 PRO A 91 91.831 -4.705 -6.360 1.00 1.00 H new ATOM 0 HD2 PRO A 91 89.723 -6.757 -6.452 1.00 1.00 H new ATOM 0 HD3 PRO A 91 91.324 -6.892 -5.751 1.00 1.00 H new ATOM 1355 N HIS A 92 87.804 -5.028 -3.064 1.00 1.00 N ATOM 1356 CA HIS A 92 86.625 -4.676 -2.326 1.00 1.00 C ATOM 1357 C HIS A 92 87.091 -4.227 -0.953 1.00 1.00 C ATOM 1358 O HIS A 92 86.428 -3.428 -0.315 1.00 1.00 O ATOM 1359 CB HIS A 92 85.676 -5.896 -2.200 1.00 1.00 C ATOM 1360 CG HIS A 92 86.020 -6.707 -0.962 1.00 1.00 C ATOM 1361 ND1 HIS A 92 87.303 -7.179 -0.725 1.00 1.00 N ATOM 1362 CD2 HIS A 92 85.278 -7.078 0.133 1.00 1.00 C ATOM 1363 CE1 HIS A 92 87.295 -7.793 0.473 1.00 1.00 C ATOM 1364 NE2 HIS A 92 86.086 -7.759 1.040 1.00 1.00 N ATOM 0 H HIS A 92 87.756 -5.933 -3.533 1.00 1.00 H new ATOM 0 HA HIS A 92 86.070 -3.886 -2.832 1.00 1.00 H new ATOM 0 HB2 HIS A 92 84.642 -5.556 -2.145 1.00 1.00 H new ATOM 0 HB3 HIS A 92 85.759 -6.523 -3.088 1.00 1.00 H new ATOM 0 HD1 HIS A 92 88.106 -7.079 -1.346 1.00 1.00 H new ATOM 0 HD2 HIS A 92 84.227 -6.873 0.270 1.00 1.00 H new ATOM 0 HE1 HIS A 92 88.161 -8.257 0.921 1.00 1.00 H new ATOM 1372 N LEU A 93 88.277 -4.692 -0.519 1.00 1.00 N ATOM 1373 CA LEU A 93 88.809 -4.231 0.743 1.00 1.00 C ATOM 1374 C LEU A 93 88.983 -2.722 0.614 1.00 1.00 C ATOM 1375 O LEU A 93 88.487 -1.946 1.423 1.00 1.00 O ATOM 1376 CB LEU A 93 90.154 -4.928 1.034 1.00 1.00 C ATOM 1377 CG LEU A 93 91.120 -4.817 -0.188 1.00 1.00 C ATOM 1378 CD1 LEU A 93 92.186 -3.731 0.063 1.00 1.00 C ATOM 1379 CD2 LEU A 93 91.823 -6.165 -0.438 1.00 1.00 C ATOM 0 H LEU A 93 88.858 -5.366 -1.017 1.00 1.00 H new ATOM 0 HA LEU A 93 88.143 -4.467 1.573 1.00 1.00 H new ATOM 0 HB2 LEU A 93 90.619 -4.477 1.911 1.00 1.00 H new ATOM 0 HB3 LEU A 93 89.980 -5.978 1.270 1.00 1.00 H new ATOM 0 HG LEU A 93 90.529 -4.547 -1.063 1.00 1.00 H new ATOM 0 HD11 LEU A 93 92.850 -3.667 -0.799 1.00 1.00 H new ATOM 0 HD12 LEU A 93 91.697 -2.769 0.216 1.00 1.00 H new ATOM 0 HD13 LEU A 93 92.765 -3.988 0.950 1.00 1.00 H new ATOM 0 HD21 LEU A 93 92.493 -6.073 -1.293 1.00 1.00 H new ATOM 0 HD22 LEU A 93 92.397 -6.445 0.445 1.00 1.00 H new ATOM 0 HD23 LEU A 93 91.076 -6.932 -0.644 1.00 1.00 H new ATOM 1391 N ALA A 94 89.693 -2.297 -0.428 1.00 1.00 N ATOM 1392 CA ALA A 94 89.899 -0.876 -0.635 1.00 1.00 C ATOM 1393 C ALA A 94 88.532 -0.203 -0.573 1.00 1.00 C ATOM 1394 O ALA A 94 88.337 0.714 0.195 1.00 1.00 O ATOM 1395 CB ALA A 94 90.566 -0.619 -1.990 1.00 1.00 C ATOM 0 H ALA A 94 90.124 -2.904 -1.125 1.00 1.00 H new ATOM 0 HA ALA A 94 90.559 -0.471 0.132 1.00 1.00 H new ATOM 0 HB1 ALA A 94 90.712 0.453 -2.126 1.00 1.00 H new ATOM 0 HB2 ALA A 94 91.532 -1.124 -2.022 1.00 1.00 H new ATOM 0 HB3 ALA A 94 89.930 -1.003 -2.787 1.00 1.00 H new ATOM 1401 N ARG A 95 87.581 -0.684 -1.365 1.00 1.00 N ATOM 1402 CA ARG A 95 86.223 -0.127 -1.349 1.00 1.00 C ATOM 1403 C ARG A 95 85.586 -0.318 0.050 1.00 1.00 C ATOM 1404 O ARG A 95 84.670 0.398 0.460 1.00 1.00 O ATOM 1405 CB ARG A 95 85.371 -0.857 -2.398 1.00 1.00 C ATOM 1406 CG ARG A 95 86.064 -0.836 -3.797 1.00 1.00 C ATOM 1407 CD ARG A 95 85.263 0.025 -4.781 1.00 1.00 C ATOM 1408 NE ARG A 95 85.310 1.424 -4.376 1.00 1.00 N ATOM 1409 CZ ARG A 95 86.345 2.197 -4.681 1.00 1.00 C ATOM 1410 NH1 ARG A 95 87.341 1.708 -5.364 1.00 1.00 N ATOM 1411 NH2 ARG A 95 86.362 3.445 -4.302 1.00 1.00 N ATOM 0 H ARG A 95 87.717 -1.452 -2.023 1.00 1.00 H new ATOM 0 HA ARG A 95 86.267 0.938 -1.577 1.00 1.00 H new ATOM 0 HB2 ARG A 95 85.208 -1.888 -2.085 1.00 1.00 H new ATOM 0 HB3 ARG A 95 84.391 -0.386 -2.467 1.00 1.00 H new ATOM 0 HG2 ARG A 95 87.076 -0.443 -3.702 1.00 1.00 H new ATOM 0 HG3 ARG A 95 86.151 -1.852 -4.181 1.00 1.00 H new ATOM 0 HD2 ARG A 95 85.670 -0.084 -5.786 1.00 1.00 H new ATOM 0 HD3 ARG A 95 84.229 -0.317 -4.817 1.00 1.00 H new ATOM 0 HE ARG A 95 84.531 1.817 -3.847 1.00 1.00 H new ATOM 0 HH11 ARG A 95 87.324 0.733 -5.663 1.00 1.00 H new ATOM 0 HH12 ARG A 95 88.137 2.300 -5.600 1.00 1.00 H new ATOM 0 HH21 ARG A 95 85.580 3.827 -3.771 1.00 1.00 H new ATOM 0 HH22 ARG A 95 87.158 4.038 -4.537 1.00 1.00 H new ATOM 1425 N ALA A 96 86.031 -1.370 0.726 1.00 1.00 N ATOM 1426 CA ALA A 96 85.438 -1.706 2.047 1.00 1.00 C ATOM 1427 C ALA A 96 85.450 -0.434 2.879 1.00 1.00 C ATOM 1428 O ALA A 96 84.589 -0.203 3.675 1.00 1.00 O ATOM 1429 CB ALA A 96 86.121 -2.864 2.793 1.00 1.00 C ATOM 0 H ALA A 96 86.773 -1.995 0.410 1.00 1.00 H new ATOM 0 HA ALA A 96 84.426 -2.074 1.876 1.00 1.00 H new ATOM 0 HB1 ALA A 96 85.616 -3.032 3.744 1.00 1.00 H new ATOM 0 HB2 ALA A 96 86.066 -3.769 2.188 1.00 1.00 H new ATOM 0 HB3 ALA A 96 87.166 -2.613 2.976 1.00 1.00 H new ATOM 1435 N LEU A 97 86.512 0.311 2.680 1.00 1.00 N ATOM 1436 CA LEU A 97 86.727 1.567 3.454 1.00 1.00 C ATOM 1437 C LEU A 97 85.316 2.246 3.715 1.00 1.00 C ATOM 1438 O LEU A 97 85.064 2.857 4.777 1.00 1.00 O ATOM 1439 CB LEU A 97 87.648 2.559 2.678 1.00 1.00 C ATOM 1440 CG LEU A 97 88.971 2.873 3.435 1.00 1.00 C ATOM 1441 CD1 LEU A 97 88.691 3.665 4.730 1.00 1.00 C ATOM 1442 CD2 LEU A 97 89.747 1.573 3.754 1.00 1.00 C ATOM 0 H LEU A 97 87.246 0.096 2.005 1.00 1.00 H new ATOM 0 HA LEU A 97 87.217 1.322 4.397 1.00 1.00 H new ATOM 0 HB2 LEU A 97 87.885 2.138 1.701 1.00 1.00 H new ATOM 0 HB3 LEU A 97 87.106 3.488 2.502 1.00 1.00 H new ATOM 0 HG LEU A 97 89.589 3.490 2.783 1.00 1.00 H new ATOM 0 HD11 LEU A 97 89.632 3.872 5.241 1.00 1.00 H new ATOM 0 HD12 LEU A 97 88.198 4.605 4.482 1.00 1.00 H new ATOM 0 HD13 LEU A 97 88.045 3.078 5.383 1.00 1.00 H new ATOM 0 HD21 LEU A 97 90.668 1.819 4.283 1.00 1.00 H new ATOM 0 HD22 LEU A 97 89.131 0.926 4.379 1.00 1.00 H new ATOM 0 HD23 LEU A 97 89.989 1.057 2.825 1.00 1.00 H new ATOM 1454 N GLY A 98 84.343 1.918 2.842 1.00 1.00 N ATOM 1455 CA GLY A 98 82.929 2.321 3.054 1.00 1.00 C ATOM 1456 C GLY A 98 82.176 1.254 3.888 1.00 1.00 C ATOM 1457 O GLY A 98 81.603 1.509 4.970 1.00 1.00 O ATOM 0 H GLY A 98 84.503 1.381 1.990 1.00 1.00 H new ATOM 0 HA2 GLY A 98 82.892 3.283 3.566 1.00 1.00 H new ATOM 0 HA3 GLY A 98 82.435 2.453 2.091 1.00 1.00 H new ATOM 1461 N GLN A 99 82.266 0.019 3.404 1.00 1.00 N ATOM 1462 CA GLN A 99 81.693 -1.115 4.072 1.00 1.00 C ATOM 1463 C GLN A 99 82.628 -1.450 5.229 1.00 1.00 C ATOM 1464 O GLN A 99 82.433 -2.437 5.931 1.00 1.00 O ATOM 1465 CB GLN A 99 81.513 -2.301 3.089 1.00 1.00 C ATOM 1466 CG GLN A 99 80.124 -2.267 2.401 1.00 1.00 C ATOM 1467 CD GLN A 99 80.130 -1.314 1.197 1.00 1.00 C ATOM 1468 OE1 GLN A 99 81.098 -1.280 0.434 1.00 1.00 O ATOM 1469 NE2 GLN A 99 79.093 -0.549 0.967 1.00 1.00 N ATOM 0 H GLN A 99 82.743 -0.211 2.532 1.00 1.00 H new ATOM 0 HA GLN A 99 80.694 -0.898 4.451 1.00 1.00 H new ATOM 0 HB2 GLN A 99 82.296 -2.268 2.331 1.00 1.00 H new ATOM 0 HB3 GLN A 99 81.630 -3.241 3.627 1.00 1.00 H new ATOM 0 HG2 GLN A 99 79.852 -3.270 2.074 1.00 1.00 H new ATOM 0 HG3 GLN A 99 79.367 -1.949 3.118 1.00 1.00 H new ATOM 0 HE21 GLN A 99 78.291 -0.575 1.596 1.00 1.00 H new ATOM 0 HE22 GLN A 99 79.087 0.073 0.158 1.00 1.00 H new ATOM 1478 N ILE A 100 83.632 -0.562 5.441 1.00 1.00 N ATOM 1479 CA ILE A 100 84.564 -0.752 6.539 1.00 1.00 C ATOM 1480 C ILE A 100 83.719 -0.734 7.762 1.00 1.00 C ATOM 1481 O ILE A 100 83.762 -1.658 8.544 1.00 1.00 O ATOM 1482 CB ILE A 100 85.694 0.333 6.631 1.00 1.00 C ATOM 1483 CG1 ILE A 100 87.091 -0.294 6.429 1.00 1.00 C ATOM 1484 CG2 ILE A 100 85.715 1.087 7.979 1.00 1.00 C ATOM 1485 CD1 ILE A 100 87.450 -1.238 7.589 1.00 1.00 C ATOM 0 H ILE A 100 83.800 0.268 4.872 1.00 1.00 H new ATOM 0 HA ILE A 100 85.111 -1.684 6.399 1.00 1.00 H new ATOM 0 HB ILE A 100 85.464 1.042 5.836 1.00 1.00 H new ATOM 0 HG12 ILE A 100 87.113 -0.845 5.489 1.00 1.00 H new ATOM 0 HG13 ILE A 100 87.839 0.495 6.354 1.00 1.00 H new ATOM 0 HG21 ILE A 100 86.521 1.821 7.973 1.00 1.00 H new ATOM 0 HG22 ILE A 100 84.762 1.595 8.127 1.00 1.00 H new ATOM 0 HG23 ILE A 100 85.877 0.377 8.790 1.00 1.00 H new ATOM 0 HD11 ILE A 100 88.439 -1.664 7.419 1.00 1.00 H new ATOM 0 HD12 ILE A 100 87.452 -0.680 8.525 1.00 1.00 H new ATOM 0 HD13 ILE A 100 86.714 -2.040 7.646 1.00 1.00 H new ATOM 1497 N VAL A 101 82.899 0.310 7.936 1.00 1.00 N ATOM 1498 CA VAL A 101 82.045 0.314 9.121 1.00 1.00 C ATOM 1499 C VAL A 101 81.351 -1.038 9.200 1.00 1.00 C ATOM 1500 O VAL A 101 81.488 -1.765 10.172 1.00 1.00 O ATOM 1501 CB VAL A 101 80.971 1.414 9.046 1.00 1.00 C ATOM 1502 CG1 VAL A 101 80.246 1.497 10.392 1.00 1.00 C ATOM 1503 CG2 VAL A 101 81.610 2.774 8.748 1.00 1.00 C ATOM 0 H VAL A 101 82.811 1.113 7.314 1.00 1.00 H new ATOM 0 HA VAL A 101 82.663 0.506 9.998 1.00 1.00 H new ATOM 0 HB VAL A 101 80.272 1.166 8.247 1.00 1.00 H new ATOM 0 HG11 VAL A 101 79.483 2.274 10.347 1.00 1.00 H new ATOM 0 HG12 VAL A 101 79.775 0.539 10.611 1.00 1.00 H new ATOM 0 HG13 VAL A 101 80.963 1.737 11.177 1.00 1.00 H new ATOM 0 HG21 VAL A 101 80.834 3.538 8.699 1.00 1.00 H new ATOM 0 HG22 VAL A 101 82.317 3.025 9.539 1.00 1.00 H new ATOM 0 HG23 VAL A 101 82.135 2.728 7.794 1.00 1.00 H new ATOM 1513 N CYS A 102 80.587 -1.331 8.168 1.00 1.00 N ATOM 1514 CA CYS A 102 79.838 -2.581 8.141 1.00 1.00 C ATOM 1515 C CYS A 102 80.750 -3.776 8.466 1.00 1.00 C ATOM 1516 O CYS A 102 80.312 -4.740 9.065 1.00 1.00 O ATOM 1517 CB CYS A 102 79.159 -2.781 6.756 1.00 1.00 C ATOM 1518 SG CYS A 102 80.106 -3.951 5.721 1.00 1.00 S ATOM 0 H CYS A 102 80.466 -0.736 7.348 1.00 1.00 H new ATOM 0 HA CYS A 102 79.063 -2.526 8.905 1.00 1.00 H new ATOM 0 HB2 CYS A 102 78.144 -3.154 6.896 1.00 1.00 H new ATOM 0 HB3 CYS A 102 79.079 -1.822 6.245 1.00 1.00 H new ATOM 1523 N ARG A 103 82.024 -3.633 8.095 1.00 1.00 N ATOM 1524 CA ARG A 103 83.060 -4.677 8.305 1.00 1.00 C ATOM 1525 C ARG A 103 83.698 -4.662 9.711 1.00 1.00 C ATOM 1526 O ARG A 103 83.712 -5.664 10.424 1.00 1.00 O ATOM 1527 CB ARG A 103 84.155 -4.467 7.257 1.00 1.00 C ATOM 1528 CG ARG A 103 85.139 -5.659 7.212 1.00 1.00 C ATOM 1529 CD ARG A 103 86.278 -5.501 8.249 1.00 1.00 C ATOM 1530 NE ARG A 103 86.044 -6.392 9.374 1.00 1.00 N ATOM 1531 CZ ARG A 103 86.962 -6.558 10.317 1.00 1.00 C ATOM 1532 NH1 ARG A 103 88.076 -5.880 10.269 1.00 1.00 N ATOM 1533 NH2 ARG A 103 86.747 -7.391 11.297 1.00 1.00 N ATOM 0 H ARG A 103 82.379 -2.793 7.639 1.00 1.00 H new ATOM 0 HA ARG A 103 82.568 -5.645 8.209 1.00 1.00 H new ATOM 0 HB2 ARG A 103 83.699 -4.334 6.276 1.00 1.00 H new ATOM 0 HB3 ARG A 103 84.702 -3.551 7.481 1.00 1.00 H new ATOM 0 HG2 ARG A 103 84.598 -6.585 7.404 1.00 1.00 H new ATOM 0 HG3 ARG A 103 85.566 -5.741 6.212 1.00 1.00 H new ATOM 0 HD2 ARG A 103 87.238 -5.729 7.786 1.00 1.00 H new ATOM 0 HD3 ARG A 103 86.327 -4.468 8.595 1.00 1.00 H new ATOM 0 HE ARG A 103 85.160 -6.897 9.439 1.00 1.00 H new ATOM 0 HH11 ARG A 103 88.241 -5.223 9.507 1.00 1.00 H new ATOM 0 HH12 ARG A 103 88.782 -6.007 10.994 1.00 1.00 H new ATOM 0 HH21 ARG A 103 85.873 -7.915 11.338 1.00 1.00 H new ATOM 0 HH22 ARG A 103 87.453 -7.519 12.022 1.00 1.00 H new ATOM 1547 N TYR A 104 84.192 -3.502 10.070 1.00 1.00 N ATOM 1548 CA TYR A 104 84.835 -3.189 11.343 1.00 1.00 C ATOM 1549 C TYR A 104 83.770 -2.615 12.278 1.00 1.00 C ATOM 1550 O TYR A 104 84.089 -1.984 13.281 1.00 1.00 O ATOM 1551 CB TYR A 104 86.051 -2.225 11.121 1.00 1.00 C ATOM 1552 CG TYR A 104 85.999 -1.019 12.038 1.00 1.00 C ATOM 1553 CD1 TYR A 104 85.174 0.046 11.704 1.00 1.00 C ATOM 1554 CD2 TYR A 104 86.739 -0.985 13.224 1.00 1.00 C ATOM 1555 CE1 TYR A 104 85.076 1.156 12.543 1.00 1.00 C ATOM 1556 CE2 TYR A 104 86.641 0.126 14.075 1.00 1.00 C ATOM 1557 CZ TYR A 104 85.807 1.197 13.733 1.00 1.00 C ATOM 1558 OH TYR A 104 85.703 2.289 14.569 1.00 1.00 O ATOM 0 H TYR A 104 84.158 -2.694 9.448 1.00 1.00 H new ATOM 0 HA TYR A 104 85.251 -4.083 11.806 1.00 1.00 H new ATOM 0 HB2 TYR A 104 86.980 -2.769 11.291 1.00 1.00 H new ATOM 0 HB3 TYR A 104 86.063 -1.891 10.084 1.00 1.00 H new ATOM 0 HD1 TYR A 104 84.604 0.015 10.787 1.00 1.00 H new ATOM 0 HD2 TYR A 104 87.384 -1.811 13.484 1.00 1.00 H new ATOM 0 HE1 TYR A 104 84.436 1.983 12.273 1.00 1.00 H new ATOM 0 HE2 TYR A 104 87.209 0.155 14.993 1.00 1.00 H new ATOM 0 HH TYR A 104 86.276 2.156 15.353 1.00 1.00 H new ATOM 1568 N GLY A 105 82.492 -2.893 12.014 1.00 1.00 N ATOM 1569 CA GLY A 105 81.433 -2.437 12.885 1.00 1.00 C ATOM 1570 C GLY A 105 80.251 -3.361 12.660 1.00 1.00 C ATOM 1571 O GLY A 105 80.124 -4.394 13.316 1.00 1.00 O ATOM 0 H GLY A 105 82.177 -3.430 11.206 1.00 1.00 H new ATOM 0 HA2 GLY A 105 81.751 -2.464 13.927 1.00 1.00 H new ATOM 0 HA3 GLY A 105 81.165 -1.405 12.660 1.00 1.00 H new ATOM 1575 N ALA A 106 79.381 -2.989 11.728 1.00 1.00 N ATOM 1576 CA ALA A 106 78.210 -3.785 11.420 1.00 1.00 C ATOM 1577 C ALA A 106 77.152 -3.700 12.520 1.00 1.00 C ATOM 1578 O ALA A 106 76.569 -4.718 12.880 1.00 1.00 O ATOM 1579 CB ALA A 106 78.624 -5.263 11.167 1.00 1.00 C ATOM 0 H ALA A 106 79.470 -2.137 11.174 1.00 1.00 H new ATOM 0 HA ALA A 106 77.760 -3.379 10.514 1.00 1.00 H new ATOM 0 HB1 ALA A 106 77.738 -5.855 10.936 1.00 1.00 H new ATOM 0 HB2 ALA A 106 79.319 -5.308 10.328 1.00 1.00 H new ATOM 0 HB3 ALA A 106 79.106 -5.664 12.059 1.00 1.00 H new ATOM 1585 N THR A 107 76.804 -2.512 13.033 1.00 1.00 N ATOM 1586 CA THR A 107 75.737 -2.476 14.020 1.00 1.00 C ATOM 1587 C THR A 107 74.433 -2.629 13.269 1.00 1.00 C ATOM 1588 O THR A 107 73.359 -2.545 13.861 1.00 1.00 O ATOM 1589 CB THR A 107 75.706 -1.158 14.835 1.00 1.00 C ATOM 1590 OG1 THR A 107 74.836 -1.330 15.952 1.00 1.00 O ATOM 1591 CG2 THR A 107 75.180 0.008 13.984 1.00 1.00 C ATOM 0 H THR A 107 77.223 -1.614 12.793 1.00 1.00 H new ATOM 0 HA THR A 107 75.901 -3.278 14.739 1.00 1.00 H new ATOM 0 HB THR A 107 76.721 -0.927 15.158 1.00 1.00 H new ATOM 0 HG1 THR A 107 74.017 -1.783 15.662 1.00 1.00 H new ATOM 0 HG21 THR A 107 75.170 0.919 14.582 1.00 1.00 H new ATOM 0 HG22 THR A 107 75.829 0.149 13.119 1.00 1.00 H new ATOM 0 HG23 THR A 107 74.168 -0.216 13.646 1.00 1.00 H new ATOM 1599 N VAL A 108 74.519 -2.909 11.951 1.00 1.00 N ATOM 1600 CA VAL A 108 73.318 -3.124 11.172 1.00 1.00 C ATOM 1601 C VAL A 108 72.889 -4.587 11.253 1.00 1.00 C ATOM 1602 O VAL A 108 71.723 -4.829 11.552 1.00 1.00 O ATOM 1603 CB VAL A 108 73.439 -2.635 9.707 1.00 1.00 C ATOM 1604 CG1 VAL A 108 73.838 -1.152 9.691 1.00 1.00 C ATOM 1605 CG2 VAL A 108 74.468 -3.453 8.922 1.00 1.00 C ATOM 0 H VAL A 108 75.392 -2.987 11.430 1.00 1.00 H new ATOM 0 HA VAL A 108 72.536 -2.507 11.614 1.00 1.00 H new ATOM 0 HB VAL A 108 72.469 -2.766 9.227 1.00 1.00 H new ATOM 0 HG11 VAL A 108 73.923 -0.809 8.660 1.00 1.00 H new ATOM 0 HG12 VAL A 108 73.078 -0.565 10.207 1.00 1.00 H new ATOM 0 HG13 VAL A 108 74.797 -1.028 10.195 1.00 1.00 H new ATOM 0 HG21 VAL A 108 74.525 -3.081 7.899 1.00 1.00 H new ATOM 0 HG22 VAL A 108 75.445 -3.361 9.397 1.00 1.00 H new ATOM 0 HG23 VAL A 108 74.168 -4.501 8.911 1.00 1.00 H new ATOM 1615 N ILE A 109 73.764 -5.599 10.967 1.00 1.00 N ATOM 1616 CA ILE A 109 73.359 -7.010 10.988 1.00 1.00 C ATOM 1617 C ILE A 109 72.570 -7.485 12.215 1.00 1.00 C ATOM 1618 O ILE A 109 71.752 -8.388 12.062 1.00 1.00 O ATOM 1619 CB ILE A 109 74.631 -7.934 10.743 1.00 1.00 C ATOM 1620 CG1 ILE A 109 74.940 -8.837 11.978 1.00 1.00 C ATOM 1621 CG2 ILE A 109 75.871 -7.081 10.390 1.00 1.00 C ATOM 1622 CD1 ILE A 109 76.259 -9.613 11.791 1.00 1.00 C ATOM 0 H ILE A 109 74.743 -5.449 10.723 1.00 1.00 H new ATOM 0 HA ILE A 109 72.638 -7.101 10.176 1.00 1.00 H new ATOM 0 HB ILE A 109 74.395 -8.585 9.901 1.00 1.00 H new ATOM 0 HG12 ILE A 109 75.003 -8.221 12.875 1.00 1.00 H new ATOM 0 HG13 ILE A 109 74.121 -9.540 12.131 1.00 1.00 H new ATOM 0 HG21 ILE A 109 76.728 -7.735 10.227 1.00 1.00 H new ATOM 0 HG22 ILE A 109 75.673 -6.509 9.483 1.00 1.00 H new ATOM 0 HG23 ILE A 109 76.088 -6.397 11.210 1.00 1.00 H new ATOM 0 HD11 ILE A 109 76.445 -10.232 12.669 1.00 1.00 H new ATOM 0 HD12 ILE A 109 76.186 -10.248 10.908 1.00 1.00 H new ATOM 0 HD13 ILE A 109 77.081 -8.908 11.664 1.00 1.00 H new ATOM 1634 N PRO A 110 72.780 -7.008 13.415 1.00 1.00 N ATOM 1635 CA PRO A 110 72.023 -7.567 14.565 1.00 1.00 C ATOM 1636 C PRO A 110 70.503 -7.516 14.347 1.00 1.00 C ATOM 1637 O PRO A 110 69.805 -8.492 14.622 1.00 1.00 O ATOM 1638 CB PRO A 110 72.497 -6.721 15.761 1.00 1.00 C ATOM 1639 CG PRO A 110 73.842 -6.225 15.339 1.00 1.00 C ATOM 1640 CD PRO A 110 73.697 -5.932 13.847 1.00 1.00 C ATOM 0 HA PRO A 110 72.214 -8.629 14.719 1.00 1.00 H new ATOM 0 HB2 PRO A 110 71.813 -5.897 15.964 1.00 1.00 H new ATOM 0 HB3 PRO A 110 72.558 -7.316 16.672 1.00 1.00 H new ATOM 0 HG2 PRO A 110 74.125 -5.330 15.893 1.00 1.00 H new ATOM 0 HG3 PRO A 110 74.615 -6.971 15.523 1.00 1.00 H new ATOM 0 HD2 PRO A 110 73.280 -4.942 13.663 1.00 1.00 H new ATOM 0 HD3 PRO A 110 74.654 -5.977 13.327 1.00 1.00 H new ATOM 1648 N ASN A 111 69.979 -6.370 13.909 1.00 1.00 N ATOM 1649 CA ASN A 111 68.527 -6.244 13.742 1.00 1.00 C ATOM 1650 C ASN A 111 68.030 -7.043 12.535 1.00 1.00 C ATOM 1651 O ASN A 111 67.292 -8.006 12.685 1.00 1.00 O ATOM 1652 CB ASN A 111 68.164 -4.762 13.583 1.00 1.00 C ATOM 1653 CG ASN A 111 66.690 -4.602 13.227 1.00 1.00 C ATOM 1654 OD1 ASN A 111 66.351 -4.366 12.067 1.00 1.00 O ATOM 1655 ND2 ASN A 111 65.787 -4.706 14.164 1.00 1.00 N ATOM 0 H ASN A 111 70.518 -5.538 13.669 1.00 1.00 H new ATOM 0 HA ASN A 111 68.040 -6.651 14.628 1.00 1.00 H new ATOM 0 HB2 ASN A 111 68.379 -4.229 14.509 1.00 1.00 H new ATOM 0 HB3 ASN A 111 68.782 -4.313 12.805 1.00 1.00 H new ATOM 0 HD21 ASN A 111 64.799 -4.592 13.936 1.00 1.00 H new ATOM 0 HD22 ASN A 111 66.069 -4.902 15.125 1.00 1.00 H new ATOM 1662 N ILE A 112 68.403 -6.630 11.340 1.00 1.00 N ATOM 1663 CA ILE A 112 67.956 -7.297 10.126 1.00 1.00 C ATOM 1664 C ILE A 112 68.087 -8.822 10.227 1.00 1.00 C ATOM 1665 O ILE A 112 67.334 -9.523 9.625 1.00 1.00 O ATOM 1666 CB ILE A 112 68.855 -6.779 8.995 1.00 1.00 C ATOM 1667 CG1 ILE A 112 68.496 -7.428 7.643 1.00 1.00 C ATOM 1668 CG2 ILE A 112 70.310 -7.088 9.351 1.00 1.00 C ATOM 1669 CD1 ILE A 112 69.659 -7.298 6.647 1.00 1.00 C ATOM 0 H ILE A 112 69.018 -5.832 11.180 1.00 1.00 H new ATOM 0 HA ILE A 112 66.902 -7.083 9.950 1.00 1.00 H new ATOM 0 HB ILE A 112 68.706 -5.704 8.891 1.00 1.00 H new ATOM 0 HG12 ILE A 112 68.256 -8.481 7.793 1.00 1.00 H new ATOM 0 HG13 ILE A 112 67.605 -6.953 7.232 1.00 1.00 H new ATOM 0 HG21 ILE A 112 70.964 -6.726 8.557 1.00 1.00 H new ATOM 0 HG22 ILE A 112 70.568 -6.593 10.287 1.00 1.00 H new ATOM 0 HG23 ILE A 112 70.436 -8.165 9.463 1.00 1.00 H new ATOM 0 HD11 ILE A 112 69.382 -7.763 5.701 1.00 1.00 H new ATOM 0 HD12 ILE A 112 69.880 -6.244 6.482 1.00 1.00 H new ATOM 0 HD13 ILE A 112 70.541 -7.795 7.051 1.00 1.00 H new ATOM 1681 N ASN A 113 69.035 -9.279 11.005 1.00 1.00 N ATOM 1682 CA ASN A 113 69.247 -10.737 11.177 1.00 1.00 C ATOM 1683 C ASN A 113 68.111 -11.285 12.010 1.00 1.00 C ATOM 1684 O ASN A 113 67.546 -12.349 11.771 1.00 1.00 O ATOM 1685 CB ASN A 113 70.589 -11.058 11.839 1.00 1.00 C ATOM 1686 CG ASN A 113 71.721 -10.900 10.823 1.00 1.00 C ATOM 1687 OD1 ASN A 113 71.865 -9.838 10.215 1.00 1.00 O ATOM 1688 ND2 ASN A 113 72.525 -11.901 10.593 1.00 1.00 N ATOM 0 H ASN A 113 69.678 -8.690 11.534 1.00 1.00 H new ATOM 0 HA ASN A 113 69.267 -11.203 10.192 1.00 1.00 H new ATOM 0 HB2 ASN A 113 70.754 -10.393 12.687 1.00 1.00 H new ATOM 0 HB3 ASN A 113 70.578 -12.076 12.229 1.00 1.00 H new ATOM 0 HD21 ASN A 113 73.275 -11.806 9.908 1.00 1.00 H new ATOM 0 HD22 ASN A 113 72.404 -12.779 11.098 1.00 1.00 H new ATOM 1695 N ALA A 114 67.805 -10.472 12.970 1.00 1.00 N ATOM 1696 CA ALA A 114 66.727 -10.777 13.879 1.00 1.00 C ATOM 1697 C ALA A 114 65.464 -11.040 13.026 1.00 1.00 C ATOM 1698 O ALA A 114 64.804 -12.077 13.161 1.00 1.00 O ATOM 1699 CB ALA A 114 66.512 -9.644 14.895 1.00 1.00 C ATOM 0 H ALA A 114 68.282 -9.589 13.152 1.00 1.00 H new ATOM 0 HA ALA A 114 66.965 -11.661 14.470 1.00 1.00 H new ATOM 0 HB1 ALA A 114 65.693 -9.906 15.564 1.00 1.00 H new ATOM 0 HB2 ALA A 114 67.423 -9.498 15.476 1.00 1.00 H new ATOM 0 HB3 ALA A 114 66.268 -8.723 14.366 1.00 1.00 H new ATOM 1705 N ALA A 115 65.169 -10.123 12.102 1.00 1.00 N ATOM 1706 CA ALA A 115 64.021 -10.266 11.179 1.00 1.00 C ATOM 1707 C ALA A 115 64.324 -11.103 9.899 1.00 1.00 C ATOM 1708 O ALA A 115 63.623 -12.014 9.558 1.00 1.00 O ATOM 1709 CB ALA A 115 63.543 -8.883 10.753 1.00 1.00 C ATOM 0 H ALA A 115 65.707 -9.267 11.966 1.00 1.00 H new ATOM 0 HA ALA A 115 63.257 -10.810 11.734 1.00 1.00 H new ATOM 0 HB1 ALA A 115 62.697 -8.984 10.073 1.00 1.00 H new ATOM 0 HB2 ALA A 115 63.236 -8.317 11.633 1.00 1.00 H new ATOM 0 HB3 ALA A 115 64.354 -8.357 10.248 1.00 1.00 H new ATOM 1715 N ILE A 116 65.418 -10.771 9.242 1.00 1.00 N ATOM 1716 CA ILE A 116 65.826 -11.515 7.989 1.00 1.00 C ATOM 1717 C ILE A 116 65.601 -12.986 8.281 1.00 1.00 C ATOM 1718 O ILE A 116 64.961 -13.706 7.530 1.00 1.00 O ATOM 1719 CB ILE A 116 67.297 -11.247 7.475 1.00 1.00 C ATOM 1720 CG1 ILE A 116 67.282 -10.390 6.177 1.00 1.00 C ATOM 1721 CG2 ILE A 116 68.038 -12.562 7.149 1.00 1.00 C ATOM 1722 CD1 ILE A 116 66.277 -9.223 6.262 1.00 1.00 C ATOM 0 H ILE A 116 66.048 -10.017 9.517 1.00 1.00 H new ATOM 0 HA ILE A 116 65.217 -11.148 7.163 1.00 1.00 H new ATOM 0 HB ILE A 116 67.811 -10.722 8.280 1.00 1.00 H new ATOM 0 HG12 ILE A 116 68.281 -9.995 5.993 1.00 1.00 H new ATOM 0 HG13 ILE A 116 67.029 -11.024 5.328 1.00 1.00 H new ATOM 0 HG21 ILE A 116 69.045 -12.335 6.799 1.00 1.00 H new ATOM 0 HG22 ILE A 116 68.096 -13.179 8.046 1.00 1.00 H new ATOM 0 HG23 ILE A 116 67.497 -13.102 6.372 1.00 1.00 H new ATOM 0 HD11 ILE A 116 66.302 -8.653 5.333 1.00 1.00 H new ATOM 0 HD12 ILE A 116 65.273 -9.618 6.419 1.00 1.00 H new ATOM 0 HD13 ILE A 116 66.545 -8.572 7.094 1.00 1.00 H new ATOM 1734 N GLU A 117 66.123 -13.363 9.420 1.00 1.00 N ATOM 1735 CA GLU A 117 65.956 -14.726 9.865 1.00 1.00 C ATOM 1736 C GLU A 117 64.479 -15.051 9.646 1.00 1.00 C ATOM 1737 O GLU A 117 64.150 -15.929 8.854 1.00 1.00 O ATOM 1738 CB GLU A 117 66.393 -14.951 11.322 1.00 1.00 C ATOM 1739 CG GLU A 117 67.914 -15.164 11.360 1.00 1.00 C ATOM 1740 CD GLU A 117 68.392 -15.357 12.793 1.00 1.00 C ATOM 1741 OE1 GLU A 117 67.553 -15.495 13.667 1.00 1.00 O ATOM 1742 OE2 GLU A 117 69.594 -15.356 12.993 1.00 1.00 O ATOM 0 H GLU A 117 66.657 -12.761 10.047 1.00 1.00 H new ATOM 0 HA GLU A 117 66.604 -15.395 9.298 1.00 1.00 H new ATOM 0 HB2 GLU A 117 66.118 -14.093 11.935 1.00 1.00 H new ATOM 0 HB3 GLU A 117 65.881 -15.818 11.739 1.00 1.00 H new ATOM 0 HG2 GLU A 117 68.180 -16.035 10.762 1.00 1.00 H new ATOM 0 HG3 GLU A 117 68.418 -14.306 10.915 1.00 1.00 H new ATOM 1749 N VAL A 118 63.602 -14.287 10.298 1.00 1.00 N ATOM 1750 CA VAL A 118 62.146 -14.501 10.126 1.00 1.00 C ATOM 1751 C VAL A 118 61.585 -13.922 8.794 1.00 1.00 C ATOM 1752 O VAL A 118 60.982 -14.665 8.021 1.00 1.00 O ATOM 1753 CB VAL A 118 61.371 -13.958 11.336 1.00 1.00 C ATOM 1754 CG1 VAL A 118 59.928 -14.477 11.305 1.00 1.00 C ATOM 1755 CG2 VAL A 118 62.034 -14.455 12.624 1.00 1.00 C ATOM 0 H VAL A 118 63.854 -13.532 10.936 1.00 1.00 H new ATOM 0 HA VAL A 118 62.000 -15.580 10.066 1.00 1.00 H new ATOM 0 HB VAL A 118 61.375 -12.869 11.301 1.00 1.00 H new ATOM 0 HG11 VAL A 118 59.383 -14.089 12.165 1.00 1.00 H new ATOM 0 HG12 VAL A 118 59.442 -14.145 10.388 1.00 1.00 H new ATOM 0 HG13 VAL A 118 59.932 -15.566 11.340 1.00 1.00 H new ATOM 0 HG21 VAL A 118 61.487 -14.072 13.486 1.00 1.00 H new ATOM 0 HG22 VAL A 118 62.023 -15.545 12.642 1.00 1.00 H new ATOM 0 HG23 VAL A 118 63.065 -14.102 12.662 1.00 1.00 H new ATOM 1765 N LEU A 119 61.745 -12.609 8.519 1.00 1.00 N ATOM 1766 CA LEU A 119 61.247 -11.923 7.319 1.00 1.00 C ATOM 1767 C LEU A 119 61.804 -12.419 5.971 1.00 1.00 C ATOM 1768 O LEU A 119 61.109 -12.282 4.965 1.00 1.00 O ATOM 1769 CB LEU A 119 61.651 -10.444 7.516 1.00 1.00 C ATOM 1770 CG LEU A 119 60.840 -9.460 6.629 1.00 1.00 C ATOM 1771 CD1 LEU A 119 59.701 -8.809 7.433 1.00 1.00 C ATOM 1772 CD2 LEU A 119 61.775 -8.336 6.149 1.00 1.00 C ATOM 0 H LEU A 119 62.242 -11.981 9.151 1.00 1.00 H new ATOM 0 HA LEU A 119 60.176 -12.110 7.242 1.00 1.00 H new ATOM 0 HB2 LEU A 119 61.515 -10.174 8.563 1.00 1.00 H new ATOM 0 HB3 LEU A 119 62.712 -10.332 7.293 1.00 1.00 H new ATOM 0 HG LEU A 119 60.422 -10.018 5.791 1.00 1.00 H new ATOM 0 HD11 LEU A 119 59.147 -8.124 6.791 1.00 1.00 H new ATOM 0 HD12 LEU A 119 59.029 -9.583 7.803 1.00 1.00 H new ATOM 0 HD13 LEU A 119 60.119 -8.258 8.276 1.00 1.00 H new ATOM 0 HD21 LEU A 119 61.216 -7.639 5.525 1.00 1.00 H new ATOM 0 HD22 LEU A 119 62.180 -7.806 7.011 1.00 1.00 H new ATOM 0 HD23 LEU A 119 62.593 -8.765 5.570 1.00 1.00 H new ATOM 1784 N GLY A 120 63.004 -13.043 5.911 1.00 1.00 N ATOM 1785 CA GLY A 120 63.494 -13.568 4.641 1.00 1.00 C ATOM 1786 C GLY A 120 63.871 -15.048 4.771 1.00 1.00 C ATOM 1787 O GLY A 120 63.398 -15.870 3.995 1.00 1.00 O ATOM 0 H GLY A 120 63.625 -13.186 6.707 1.00 1.00 H new ATOM 0 HA2 GLY A 120 62.729 -13.449 3.874 1.00 1.00 H new ATOM 0 HA3 GLY A 120 64.362 -12.994 4.316 1.00 1.00 H new ATOM 1791 N THR A 121 64.754 -15.341 5.742 1.00 1.00 N ATOM 1792 CA THR A 121 65.279 -16.697 6.002 1.00 1.00 C ATOM 1793 C THR A 121 66.758 -16.672 6.426 1.00 1.00 C ATOM 1794 O THR A 121 67.145 -17.240 7.448 1.00 1.00 O ATOM 1795 CB THR A 121 65.215 -17.591 4.744 1.00 1.00 C ATOM 1796 OG1 THR A 121 65.937 -18.779 5.017 1.00 1.00 O ATOM 1797 CG2 THR A 121 65.866 -16.900 3.520 1.00 1.00 C ATOM 0 H THR A 121 65.129 -14.636 6.377 1.00 1.00 H new ATOM 0 HA THR A 121 64.650 -17.093 6.799 1.00 1.00 H new ATOM 0 HB THR A 121 64.169 -17.792 4.510 1.00 1.00 H new ATOM 0 HG1 THR A 121 65.389 -19.556 4.781 1.00 1.00 H new ATOM 0 HG21 THR A 121 65.802 -17.559 2.654 1.00 1.00 H new ATOM 0 HG22 THR A 121 65.342 -15.968 3.307 1.00 1.00 H new ATOM 0 HG23 THR A 121 66.913 -16.686 3.737 1.00 1.00 H new ATOM 1805 N GLY A 122 67.575 -16.070 5.566 1.00 1.00 N ATOM 1806 CA GLY A 122 69.030 -16.010 5.760 1.00 1.00 C ATOM 1807 C GLY A 122 69.647 -17.207 5.032 1.00 1.00 C ATOM 1808 O GLY A 122 70.812 -17.212 4.645 1.00 1.00 O ATOM 0 H GLY A 122 67.253 -15.609 4.715 1.00 1.00 H new ATOM 0 HA2 GLY A 122 69.430 -15.076 5.366 1.00 1.00 H new ATOM 0 HA3 GLY A 122 69.276 -16.040 6.822 1.00 1.00 H new ATOM 1812 N THR A 123 68.783 -18.201 4.865 1.00 1.00 N ATOM 1813 CA THR A 123 69.182 -19.441 4.168 1.00 1.00 C ATOM 1814 C THR A 123 69.914 -18.982 2.888 1.00 1.00 C ATOM 1815 O THR A 123 69.323 -18.776 1.831 1.00 1.00 O ATOM 1816 CB THR A 123 68.004 -20.420 3.914 1.00 1.00 C ATOM 1817 OG1 THR A 123 68.544 -21.695 3.601 1.00 1.00 O ATOM 1818 CG2 THR A 123 67.082 -19.989 2.757 1.00 1.00 C ATOM 0 H THR A 123 67.817 -18.186 5.192 1.00 1.00 H new ATOM 0 HA THR A 123 69.844 -20.045 4.789 1.00 1.00 H new ATOM 0 HB THR A 123 67.398 -20.434 4.820 1.00 1.00 H new ATOM 0 HG1 THR A 123 67.814 -22.328 3.439 1.00 1.00 H new ATOM 0 HG21 THR A 123 66.282 -20.720 2.637 1.00 1.00 H new ATOM 0 HG22 THR A 123 66.651 -19.013 2.979 1.00 1.00 H new ATOM 0 HG23 THR A 123 67.660 -19.929 1.835 1.00 1.00 H new ATOM 1826 N ASP A 124 71.244 -18.853 3.013 1.00 1.00 N ATOM 1827 CA ASP A 124 72.091 -18.453 1.888 1.00 1.00 C ATOM 1828 C ASP A 124 73.588 -18.615 2.196 1.00 1.00 C ATOM 1829 O ASP A 124 73.980 -19.052 3.281 1.00 1.00 O ATOM 1830 CB ASP A 124 71.813 -17.004 1.487 1.00 1.00 C ATOM 1831 CG ASP A 124 72.298 -16.033 2.566 1.00 1.00 C ATOM 1832 OD1 ASP A 124 72.950 -16.479 3.496 1.00 1.00 O ATOM 1833 OD2 ASP A 124 72.023 -14.852 2.435 1.00 1.00 O ATOM 0 H ASP A 124 71.752 -19.020 3.882 1.00 1.00 H new ATOM 0 HA ASP A 124 71.841 -19.118 1.062 1.00 1.00 H new ATOM 0 HB2 ASP A 124 72.311 -16.782 0.543 1.00 1.00 H new ATOM 0 HB3 ASP A 124 70.744 -16.867 1.323 1.00 1.00 H new ATOM 1838 N TYR A 125 74.400 -18.160 1.239 1.00 1.00 N ATOM 1839 CA TYR A 125 75.860 -18.135 1.373 1.00 1.00 C ATOM 1840 C TYR A 125 76.418 -16.937 0.579 1.00 1.00 C ATOM 1841 O TYR A 125 75.892 -16.586 -0.476 1.00 1.00 O ATOM 1842 CB TYR A 125 76.498 -19.444 0.870 1.00 1.00 C ATOM 1843 CG TYR A 125 77.989 -19.238 0.664 1.00 1.00 C ATOM 1844 CD1 TYR A 125 78.455 -18.755 -0.565 1.00 1.00 C ATOM 1845 CD2 TYR A 125 78.898 -19.501 1.699 1.00 1.00 C ATOM 1846 CE1 TYR A 125 79.824 -18.539 -0.764 1.00 1.00 C ATOM 1847 CE2 TYR A 125 80.269 -19.281 1.501 1.00 1.00 C ATOM 1848 CZ TYR A 125 80.731 -18.800 0.269 1.00 1.00 C ATOM 1849 OH TYR A 125 82.080 -18.581 0.072 1.00 1.00 O ATOM 0 H TYR A 125 74.064 -17.797 0.347 1.00 1.00 H new ATOM 0 HA TYR A 125 76.109 -18.033 2.429 1.00 1.00 H new ATOM 0 HB2 TYR A 125 76.327 -20.244 1.591 1.00 1.00 H new ATOM 0 HB3 TYR A 125 76.031 -19.752 -0.065 1.00 1.00 H new ATOM 0 HD1 TYR A 125 77.756 -18.548 -1.362 1.00 1.00 H new ATOM 0 HD2 TYR A 125 78.542 -19.873 2.649 1.00 1.00 H new ATOM 0 HE1 TYR A 125 80.180 -18.171 -1.715 1.00 1.00 H new ATOM 0 HE2 TYR A 125 80.969 -19.482 2.299 1.00 1.00 H new ATOM 0 HH TYR A 125 82.571 -18.811 0.888 1.00 1.00 H new ATOM 1859 N ARG A 126 77.515 -16.359 1.069 1.00 1.00 N ATOM 1860 CA ARG A 126 78.184 -15.240 0.377 1.00 1.00 C ATOM 1861 C ARG A 126 79.689 -15.312 0.613 1.00 1.00 C ATOM 1862 O ARG A 126 80.135 -15.816 1.643 1.00 1.00 O ATOM 1863 CB ARG A 126 77.681 -13.859 0.841 1.00 1.00 C ATOM 1864 CG ARG A 126 76.214 -13.613 0.399 1.00 1.00 C ATOM 1865 CD ARG A 126 76.023 -12.146 -0.022 1.00 1.00 C ATOM 1866 NE ARG A 126 76.746 -11.887 -1.265 1.00 1.00 N ATOM 1867 CZ ARG A 126 76.336 -12.407 -2.420 1.00 1.00 C ATOM 1868 NH1 ARG A 126 75.264 -13.149 -2.455 1.00 1.00 N ATOM 1869 NH2 ARG A 126 77.000 -12.175 -3.522 1.00 1.00 N ATOM 0 H ARG A 126 77.964 -16.641 1.940 1.00 1.00 H new ATOM 0 HA ARG A 126 77.947 -15.344 -0.682 1.00 1.00 H new ATOM 0 HB2 ARG A 126 77.752 -13.790 1.927 1.00 1.00 H new ATOM 0 HB3 ARG A 126 78.322 -13.079 0.430 1.00 1.00 H new ATOM 0 HG2 ARG A 126 75.962 -14.273 -0.431 1.00 1.00 H new ATOM 0 HG3 ARG A 126 75.535 -13.855 1.217 1.00 1.00 H new ATOM 0 HD2 ARG A 126 74.963 -11.932 -0.157 1.00 1.00 H new ATOM 0 HD3 ARG A 126 76.384 -11.483 0.764 1.00 1.00 H new ATOM 0 HE ARG A 126 77.579 -11.298 -1.248 1.00 1.00 H new ATOM 0 HH11 ARG A 126 74.741 -13.330 -1.598 1.00 1.00 H new ATOM 0 HH12 ARG A 126 74.949 -13.548 -3.339 1.00 1.00 H new ATOM 0 HH21 ARG A 126 77.837 -11.593 -3.500 1.00 1.00 H new ATOM 0 HH22 ARG A 126 76.681 -12.576 -4.404 1.00 1.00 H new ATOM 1883 N PHE A 127 80.474 -14.822 -0.347 1.00 1.00 N ATOM 1884 CA PHE A 127 81.934 -14.856 -0.224 1.00 1.00 C ATOM 1885 C PHE A 127 82.469 -13.557 0.376 1.00 1.00 C ATOM 1886 O PHE A 127 81.675 -12.798 0.908 1.00 1.00 O ATOM 1887 CB PHE A 127 82.566 -15.096 -1.598 1.00 1.00 C ATOM 1888 CG PHE A 127 82.452 -13.855 -2.458 1.00 1.00 C ATOM 1889 CD1 PHE A 127 81.245 -13.555 -3.104 1.00 1.00 C ATOM 1890 CD2 PHE A 127 83.558 -13.011 -2.615 1.00 1.00 C ATOM 1891 CE1 PHE A 127 81.148 -12.410 -3.905 1.00 1.00 C ATOM 1892 CE2 PHE A 127 83.460 -11.868 -3.418 1.00 1.00 C ATOM 1893 CZ PHE A 127 82.256 -11.568 -4.064 1.00 1.00 C ATOM 1894 OXT PHE A 127 83.667 -13.344 0.298 1.00 1.00 O ATOM 0 H PHE A 127 80.130 -14.401 -1.210 1.00 1.00 H new ATOM 0 HA PHE A 127 82.200 -15.673 0.447 1.00 1.00 H new ATOM 0 HB2 PHE A 127 83.615 -15.369 -1.480 1.00 1.00 H new ATOM 0 HB3 PHE A 127 82.072 -15.934 -2.091 1.00 1.00 H new ATOM 0 HD1 PHE A 127 80.391 -14.205 -2.984 1.00 1.00 H new ATOM 0 HD2 PHE A 127 84.488 -13.242 -2.116 1.00 1.00 H new ATOM 0 HE1 PHE A 127 80.217 -12.176 -4.401 1.00 1.00 H new ATOM 0 HE2 PHE A 127 84.314 -11.218 -3.539 1.00 1.00 H new ATOM 0 HZ PHE A 127 82.181 -10.688 -4.685 1.00 1.00 H new TER 1904 PHE A 127 HETATM 1905 O1 MTN A 128 65.817 4.797 -10.462 1.00 1.00 O HETATM 1906 N1 MTN A 128 66.252 4.733 -9.274 1.00 1.00 N HETATM 1907 C1 MTN A 128 66.828 3.508 -8.681 1.00 1.00 C HETATM 1908 C2 MTN A 128 67.175 4.005 -7.323 1.00 1.00 C HETATM 1909 C3 MTN A 128 66.866 5.276 -7.117 1.00 1.00 C HETATM 1910 C4 MTN A 128 67.107 6.030 -5.830 1.00 1.00 C HETATM 1911 S1 MTN A 128 65.607 6.475 -4.902 1.00 1.00 S HETATM 1912 C5 MTN A 128 66.229 5.914 -8.340 1.00 1.00 C HETATM 1913 C6 MTN A 128 64.841 6.474 -8.053 1.00 1.00 C HETATM 1914 C7 MTN A 128 67.140 7.007 -8.892 1.00 1.00 C HETATM 1915 C8 MTN A 128 65.813 2.371 -8.599 1.00 1.00 C HETATM 1916 C9 MTN A 128 68.072 3.082 -9.441 1.00 1.00 C HETATM 0 H93 MTN A 128 67.813 2.883 -10.481 1.00 1.00 H new HETATM 0 H92 MTN A 128 68.815 3.878 -9.398 1.00 1.00 H new HETATM 0 H91 MTN A 128 68.482 2.178 -8.990 1.00 1.00 H new HETATM 0 H83 MTN A 128 64.970 2.680 -7.981 1.00 1.00 H new HETATM 0 H82 MTN A 128 65.459 2.126 -9.600 1.00 1.00 H new HETATM 0 H81 MTN A 128 66.285 1.494 -8.156 1.00 1.00 H new HETATM 0 H73 MTN A 128 68.158 6.625 -8.974 1.00 1.00 H new HETATM 0 H72 MTN A 128 66.786 7.312 -9.877 1.00 1.00 H new HETATM 0 H71 MTN A 128 67.127 7.865 -8.220 1.00 1.00 H new HETATM 0 H63 MTN A 128 64.381 6.802 -8.985 1.00 1.00 H new HETATM 0 H62 MTN A 128 64.224 5.700 -7.596 1.00 1.00 H new HETATM 0 H61 MTN A 128 64.924 7.321 -7.372 1.00 1.00 H new HETATM 0 H42 MTN A 128 67.747 5.425 -5.187 1.00 1.00 H new HETATM 0 H41 MTN A 128 67.657 6.942 -6.060 1.00 1.00 H new HETATM 0 H2 MTN A 128 67.643 3.378 -6.564 1.00 1.00 H new HETATM 1932 O1 MTN A 129 70.828 -9.796 -5.057 1.00 1.00 O HETATM 1933 N1 MTN A 129 70.165 -8.977 -4.352 1.00 1.00 N HETATM 1934 C1 MTN A 129 69.128 -8.082 -4.912 1.00 1.00 C HETATM 1935 C2 MTN A 129 68.723 -7.356 -3.683 1.00 1.00 C HETATM 1936 C3 MTN A 129 69.374 -7.737 -2.595 1.00 1.00 C HETATM 1937 C4 MTN A 129 69.193 -7.149 -1.226 1.00 1.00 C HETATM 1938 S1 MTN A 129 70.614 -6.181 -0.640 1.00 1.00 S HETATM 1939 C5 MTN A 129 70.373 -8.840 -2.877 1.00 1.00 C HETATM 1940 C6 MTN A 129 71.794 -8.520 -2.433 1.00 1.00 C HETATM 1941 C7 MTN A 129 69.893 -10.133 -2.218 1.00 1.00 C HETATM 1942 C8 MTN A 129 69.654 -7.138 -5.989 1.00 1.00 C HETATM 1943 C9 MTN A 129 67.966 -8.915 -5.434 1.00 1.00 C HETATM 0 H93 MTN A 129 68.323 -9.589 -6.213 1.00 1.00 H new HETATM 0 H92 MTN A 129 67.540 -9.497 -4.617 1.00 1.00 H new HETATM 0 H91 MTN A 129 67.202 -8.256 -5.846 1.00 1.00 H new HETATM 0 H83 MTN A 129 70.437 -6.506 -5.569 1.00 1.00 H new HETATM 0 H82 MTN A 129 70.062 -7.720 -6.815 1.00 1.00 H new HETATM 0 H81 MTN A 129 68.839 -6.512 -6.354 1.00 1.00 H new HETATM 0 H73 MTN A 129 68.836 -10.284 -2.439 1.00 1.00 H new HETATM 0 H72 MTN A 129 70.468 -10.974 -2.605 1.00 1.00 H new HETATM 0 H71 MTN A 129 70.032 -10.065 -1.139 1.00 1.00 H new HETATM 0 H63 MTN A 129 72.465 -9.313 -2.762 1.00 1.00 H new HETATM 0 H62 MTN A 129 72.108 -7.573 -2.873 1.00 1.00 H new HETATM 0 H61 MTN A 129 71.827 -8.444 -1.346 1.00 1.00 H new HETATM 0 H42 MTN A 129 68.309 -6.511 -1.230 1.00 1.00 H new HETATM 0 H41 MTN A 129 69.000 -7.956 -0.519 1.00 1.00 H new HETATM 0 H2 MTN A 129 67.958 -6.579 -3.677 1.00 1.00 H new HETATM 1959 O1 MTN A 130 82.012 -10.057 5.766 1.00 1.00 O HETATM 1960 N1 MTN A 130 81.201 -9.294 6.370 1.00 1.00 N HETATM 1961 C1 MTN A 130 80.897 -9.418 7.811 1.00 1.00 C HETATM 1962 C2 MTN A 130 79.923 -8.309 7.969 1.00 1.00 C HETATM 1963 C3 MTN A 130 79.680 -7.640 6.853 1.00 1.00 C HETATM 1964 C4 MTN A 130 78.721 -6.480 6.760 1.00 1.00 C HETATM 1965 S1 MTN A 130 78.827 -5.460 5.263 1.00 1.00 S HETATM 1966 C5 MTN A 130 80.472 -8.188 5.672 1.00 1.00 C HETATM 1967 C6 MTN A 130 79.584 -8.655 4.519 1.00 1.00 C HETATM 1968 C7 MTN A 130 81.527 -7.174 5.192 1.00 1.00 C HETATM 1969 C8 MTN A 130 80.284 -10.770 8.181 1.00 1.00 C HETATM 1970 C9 MTN A 130 82.147 -9.142 8.631 1.00 1.00 C HETATM 0 H93 MTN A 130 82.923 -9.860 8.365 1.00 1.00 H new HETATM 0 H92 MTN A 130 82.502 -8.132 8.425 1.00 1.00 H new HETATM 0 H91 MTN A 130 81.914 -9.235 9.692 1.00 1.00 H new HETATM 0 H83 MTN A 130 79.351 -10.909 7.634 1.00 1.00 H new HETATM 0 H82 MTN A 130 80.979 -11.568 7.921 1.00 1.00 H new HETATM 0 H81 MTN A 130 80.084 -10.798 9.252 1.00 1.00 H new HETATM 0 H73 MTN A 130 82.077 -6.787 6.050 1.00 1.00 H new HETATM 0 H72 MTN A 130 82.220 -7.666 4.509 1.00 1.00 H new HETATM 0 H71 MTN A 130 81.032 -6.351 4.677 1.00 1.00 H new HETATM 0 H63 MTN A 130 80.195 -9.158 3.770 1.00 1.00 H new HETATM 0 H62 MTN A 130 78.831 -9.346 4.897 1.00 1.00 H new HETATM 0 H61 MTN A 130 79.092 -7.794 4.067 1.00 1.00 H new HETATM 0 H42 MTN A 130 77.706 -6.870 6.836 1.00 1.00 H new HETATM 0 H41 MTN A 130 78.881 -5.835 7.624 1.00 1.00 H new HETATM 0 H2 MTN A 130 79.449 -8.067 8.920 1.00 1.00 H new