USER MOD reduce.3.24.130724 H: found=0, std=0, add=964, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 955 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 92 HIS : no HE2:sc= -2.61! C(o=-2.7!,f=-4.9!) USER MOD Set 1.2: A 99 GLN : amide:sc= -0.142 X(o=-2.7,f=-2.6) USER MOD Set 2.1: A 72 HIS : no HE2:sc= -6.1! C(o=-5.6!,f=-9.7!) USER MOD Set 2.2: A 73 MET CE :methyl -178:sc= 0 (180deg=0) USER MOD Set 2.3: A 123 THR OG1 : rot -63:sc= 0.513! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -161:sc= -0.0734 (180deg=-0.628) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot -56:sc= 0.0366 USER MOD Single : A 10 SER OG : rot 90:sc= 1.18 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 HIS : no HD1:sc= -0.626 K(o=-0.63,f=-1.7) USER MOD Single : A 39 THR OG1 : rot -109:sc= 0.956 USER MOD Single : A 48 CYS SG : rot 180:sc= -0.0113 USER MOD Single : A 49 ASN : amide:sc= -0.282 X(o=-0.28,f=-0.34) USER MOD Single : A 54 GLN : amide:sc= -0.043 X(o=-0.043,f=0) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 ASN : amide:sc= -0.592 K(o=-0.59,f=-1.8!) USER MOD Single : A 102 CYS SG : rot 10:sc= 0.049 USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=-0.0052) USER MOD Single : A 113 ASN : amide:sc= -5.58! C(o=-5.6!,f=-7.5!) USER MOD Single : A 121 THR OG1 : rot 2:sc= 1.06 USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 80.081 20.064 -24.318 1.00 1.00 N ATOM 2 CA MET A 1 80.635 18.842 -23.670 1.00 1.00 C ATOM 3 C MET A 1 79.496 17.859 -23.412 1.00 1.00 C ATOM 4 O MET A 1 78.466 18.228 -22.846 1.00 1.00 O ATOM 5 CB MET A 1 81.300 19.229 -22.346 1.00 1.00 C ATOM 6 CG MET A 1 82.364 20.304 -22.593 1.00 1.00 C ATOM 7 SD MET A 1 83.255 20.638 -21.048 1.00 1.00 S ATOM 8 CE MET A 1 82.875 22.405 -20.899 1.00 1.00 C ATOM 0 H1 MET A 1 80.849 20.588 -24.784 1.00 1.00 H new ATOM 0 H2 MET A 1 79.370 19.790 -25.026 1.00 1.00 H new ATOM 0 H3 MET A 1 79.637 20.668 -23.597 1.00 1.00 H new ATOM 0 HA MET A 1 81.377 18.377 -24.319 1.00 1.00 H new ATOM 0 HB2 MET A 1 80.550 19.600 -21.647 1.00 1.00 H new ATOM 0 HB3 MET A 1 81.756 18.352 -21.888 1.00 1.00 H new ATOM 0 HG2 MET A 1 83.061 19.972 -23.363 1.00 1.00 H new ATOM 0 HG3 MET A 1 81.896 21.217 -22.960 1.00 1.00 H new ATOM 0 HE1 MET A 1 83.341 22.803 -19.997 1.00 1.00 H new ATOM 0 HE2 MET A 1 83.260 22.935 -21.770 1.00 1.00 H new ATOM 0 HE3 MET A 1 81.795 22.541 -20.840 1.00 1.00 H new ATOM 18 N SER A 2 79.680 16.609 -23.836 1.00 1.00 N ATOM 19 CA SER A 2 78.655 15.580 -23.654 1.00 1.00 C ATOM 20 C SER A 2 78.844 14.851 -22.327 1.00 1.00 C ATOM 21 O SER A 2 78.106 13.919 -22.023 1.00 1.00 O ATOM 22 CB SER A 2 78.724 14.570 -24.799 1.00 1.00 C ATOM 23 OG SER A 2 79.981 13.908 -24.765 1.00 1.00 O ATOM 0 H SER A 2 80.525 16.285 -24.306 1.00 1.00 H new ATOM 0 HA SER A 2 77.681 16.068 -23.650 1.00 1.00 H new ATOM 0 HB2 SER A 2 77.915 13.845 -24.709 1.00 1.00 H new ATOM 0 HB3 SER A 2 78.593 15.077 -25.755 1.00 1.00 H new ATOM 0 HG SER A 2 80.028 13.258 -25.497 1.00 1.00 H new ATOM 29 N ASP A 3 79.824 15.303 -21.545 1.00 1.00 N ATOM 30 CA ASP A 3 80.110 14.713 -20.235 1.00 1.00 C ATOM 31 C ASP A 3 81.500 15.132 -19.765 1.00 1.00 C ATOM 32 O ASP A 3 82.510 14.756 -20.360 1.00 1.00 O ATOM 33 CB ASP A 3 80.014 13.170 -20.290 1.00 1.00 C ATOM 34 CG ASP A 3 80.781 12.529 -19.131 1.00 1.00 C ATOM 35 OD1 ASP A 3 80.391 12.748 -17.997 1.00 1.00 O ATOM 36 OD2 ASP A 3 81.744 11.829 -19.399 1.00 1.00 O ATOM 0 H ASP A 3 80.436 16.079 -21.796 1.00 1.00 H new ATOM 0 HA ASP A 3 79.366 15.078 -19.527 1.00 1.00 H new ATOM 0 HB2 ASP A 3 78.968 12.866 -20.250 1.00 1.00 H new ATOM 0 HB3 ASP A 3 80.415 12.811 -21.238 1.00 1.00 H new ATOM 41 N PHE A 4 81.541 15.894 -18.679 1.00 1.00 N ATOM 42 CA PHE A 4 82.803 16.348 -18.104 1.00 1.00 C ATOM 43 C PHE A 4 82.653 16.457 -16.602 1.00 1.00 C ATOM 44 O PHE A 4 81.591 16.824 -16.102 1.00 1.00 O ATOM 45 CB PHE A 4 83.208 17.709 -18.668 1.00 1.00 C ATOM 46 CG PHE A 4 84.489 18.158 -17.998 1.00 1.00 C ATOM 47 CD1 PHE A 4 85.713 17.588 -18.372 1.00 1.00 C ATOM 48 CD2 PHE A 4 84.453 19.140 -16.997 1.00 1.00 C ATOM 49 CE1 PHE A 4 86.898 17.999 -17.750 1.00 1.00 C ATOM 50 CE2 PHE A 4 85.640 19.550 -16.375 1.00 1.00 C ATOM 51 CZ PHE A 4 86.861 18.981 -16.753 1.00 1.00 C ATOM 0 H PHE A 4 80.712 16.212 -18.177 1.00 1.00 H new ATOM 0 HA PHE A 4 83.578 15.625 -18.358 1.00 1.00 H new ATOM 0 HB2 PHE A 4 83.350 17.642 -19.747 1.00 1.00 H new ATOM 0 HB3 PHE A 4 82.417 18.439 -18.495 1.00 1.00 H new ATOM 0 HD1 PHE A 4 85.742 16.830 -19.141 1.00 1.00 H new ATOM 0 HD2 PHE A 4 83.511 19.580 -16.706 1.00 1.00 H new ATOM 0 HE1 PHE A 4 87.841 17.558 -18.039 1.00 1.00 H new ATOM 0 HE2 PHE A 4 85.612 20.305 -15.604 1.00 1.00 H new ATOM 0 HZ PHE A 4 87.776 19.300 -16.275 1.00 1.00 H new ATOM 61 N ASP A 5 83.711 16.130 -15.873 1.00 1.00 N ATOM 62 CA ASP A 5 83.656 16.191 -14.423 1.00 1.00 C ATOM 63 C ASP A 5 85.052 16.426 -13.843 1.00 1.00 C ATOM 64 O ASP A 5 86.047 15.989 -14.419 1.00 1.00 O ATOM 65 CB ASP A 5 83.069 14.876 -13.903 1.00 1.00 C ATOM 66 CG ASP A 5 83.695 13.698 -14.641 1.00 1.00 C ATOM 67 OD1 ASP A 5 84.891 13.511 -14.504 1.00 1.00 O ATOM 68 OD2 ASP A 5 82.968 12.998 -15.328 1.00 1.00 O ATOM 0 H ASP A 5 84.605 15.824 -16.257 1.00 1.00 H new ATOM 0 HA ASP A 5 83.025 17.023 -14.112 1.00 1.00 H new ATOM 0 HB2 ASP A 5 83.253 14.784 -12.833 1.00 1.00 H new ATOM 0 HB3 ASP A 5 81.988 14.870 -14.043 1.00 1.00 H new ATOM 73 N THR A 6 85.127 17.122 -12.697 1.00 1.00 N ATOM 74 CA THR A 6 86.410 17.407 -12.047 1.00 1.00 C ATOM 75 C THR A 6 86.470 16.735 -10.670 1.00 1.00 C ATOM 76 O THR A 6 85.873 15.708 -10.443 1.00 1.00 O ATOM 77 CB THR A 6 86.590 18.935 -11.889 1.00 1.00 C ATOM 78 OG1 THR A 6 85.861 19.599 -12.914 1.00 1.00 O ATOM 79 CG2 THR A 6 88.074 19.314 -11.994 1.00 1.00 C ATOM 0 H THR A 6 84.315 17.495 -12.205 1.00 1.00 H new ATOM 0 HA THR A 6 87.213 17.010 -12.668 1.00 1.00 H new ATOM 0 HB THR A 6 86.219 19.236 -10.909 1.00 1.00 H new ATOM 0 HG1 THR A 6 86.158 19.274 -13.790 1.00 1.00 H new ATOM 0 HG21 THR A 6 88.183 20.393 -11.881 1.00 1.00 H new ATOM 0 HG22 THR A 6 88.635 18.808 -11.208 1.00 1.00 H new ATOM 0 HG23 THR A 6 88.459 19.011 -12.968 1.00 1.00 H new ATOM 87 N GLU A 7 87.238 17.305 -9.777 1.00 1.00 N ATOM 88 CA GLU A 7 87.413 16.737 -8.449 1.00 1.00 C ATOM 89 C GLU A 7 86.078 16.635 -7.731 1.00 1.00 C ATOM 90 O GLU A 7 85.697 15.591 -7.222 1.00 1.00 O ATOM 91 CB GLU A 7 88.399 17.592 -7.624 1.00 1.00 C ATOM 92 CG GLU A 7 87.929 19.073 -7.546 1.00 1.00 C ATOM 93 CD GLU A 7 87.300 19.383 -6.184 1.00 1.00 C ATOM 94 OE1 GLU A 7 86.107 19.178 -6.038 1.00 1.00 O ATOM 95 OE2 GLU A 7 88.024 19.826 -5.311 1.00 1.00 O ATOM 0 H GLU A 7 87.758 18.167 -9.939 1.00 1.00 H new ATOM 0 HA GLU A 7 87.825 15.734 -8.557 1.00 1.00 H new ATOM 0 HB2 GLU A 7 88.487 17.182 -6.618 1.00 1.00 H new ATOM 0 HB3 GLU A 7 89.390 17.545 -8.075 1.00 1.00 H new ATOM 0 HG2 GLU A 7 88.777 19.736 -7.717 1.00 1.00 H new ATOM 0 HG3 GLU A 7 87.205 19.270 -8.337 1.00 1.00 H new ATOM 102 N ARG A 8 85.338 17.706 -7.725 1.00 1.00 N ATOM 103 CA ARG A 8 84.041 17.652 -7.084 1.00 1.00 C ATOM 104 C ARG A 8 83.132 16.721 -7.890 1.00 1.00 C ATOM 105 O ARG A 8 82.587 15.746 -7.376 1.00 1.00 O ATOM 106 CB ARG A 8 83.442 19.065 -7.006 1.00 1.00 C ATOM 107 CG ARG A 8 84.007 19.917 -8.147 1.00 1.00 C ATOM 108 CD ARG A 8 83.174 21.177 -8.310 1.00 1.00 C ATOM 109 NE ARG A 8 83.650 21.934 -9.457 1.00 1.00 N ATOM 110 CZ ARG A 8 83.216 23.161 -9.691 1.00 1.00 C ATOM 111 NH1 ARG A 8 82.366 23.710 -8.870 1.00 1.00 N ATOM 112 NH2 ARG A 8 83.637 23.815 -10.737 1.00 1.00 N ATOM 0 H ARG A 8 85.591 18.603 -8.140 1.00 1.00 H new ATOM 0 HA ARG A 8 84.138 17.267 -6.069 1.00 1.00 H new ATOM 0 HB2 ARG A 8 82.355 19.016 -7.076 1.00 1.00 H new ATOM 0 HB3 ARG A 8 83.679 19.521 -6.045 1.00 1.00 H new ATOM 0 HG2 ARG A 8 85.044 20.180 -7.938 1.00 1.00 H new ATOM 0 HG3 ARG A 8 84.004 19.346 -9.075 1.00 1.00 H new ATOM 0 HD2 ARG A 8 82.124 20.916 -8.445 1.00 1.00 H new ATOM 0 HD3 ARG A 8 83.238 21.786 -7.408 1.00 1.00 H new ATOM 0 HE ARG A 8 84.329 21.512 -10.091 1.00 1.00 H new ATOM 0 HH11 ARG A 8 82.040 23.194 -8.053 1.00 1.00 H new ATOM 0 HH12 ARG A 8 82.027 24.656 -9.044 1.00 1.00 H new ATOM 0 HH21 ARG A 8 84.302 23.380 -11.377 1.00 1.00 H new ATOM 0 HH22 ARG A 8 83.301 24.761 -10.916 1.00 1.00 H new ATOM 126 N VAL A 9 82.963 17.055 -9.154 1.00 1.00 N ATOM 127 CA VAL A 9 82.089 16.253 -9.987 1.00 1.00 C ATOM 128 C VAL A 9 82.653 14.839 -10.194 1.00 1.00 C ATOM 129 O VAL A 9 81.981 13.878 -9.952 1.00 1.00 O ATOM 130 CB VAL A 9 81.854 16.930 -11.332 1.00 1.00 C ATOM 131 CG1 VAL A 9 80.683 16.251 -12.050 1.00 1.00 C ATOM 132 CG2 VAL A 9 81.518 18.408 -11.118 1.00 1.00 C ATOM 0 H VAL A 9 83.404 17.850 -9.616 1.00 1.00 H new ATOM 0 HA VAL A 9 81.134 16.163 -9.469 1.00 1.00 H new ATOM 0 HB VAL A 9 82.758 16.845 -11.935 1.00 1.00 H new ATOM 0 HG11 VAL A 9 80.516 16.736 -13.012 1.00 1.00 H new ATOM 0 HG12 VAL A 9 80.915 15.198 -12.210 1.00 1.00 H new ATOM 0 HG13 VAL A 9 79.784 16.335 -11.440 1.00 1.00 H new ATOM 0 HG21 VAL A 9 81.351 18.887 -12.083 1.00 1.00 H new ATOM 0 HG22 VAL A 9 80.617 18.492 -10.511 1.00 1.00 H new ATOM 0 HG23 VAL A 9 82.347 18.899 -10.608 1.00 1.00 H new ATOM 142 N SER A 10 83.876 14.719 -10.644 1.00 1.00 N ATOM 143 CA SER A 10 84.433 13.374 -10.873 1.00 1.00 C ATOM 144 C SER A 10 84.675 12.616 -9.550 1.00 1.00 C ATOM 145 O SER A 10 84.124 11.554 -9.341 1.00 1.00 O ATOM 146 CB SER A 10 85.749 13.448 -11.677 1.00 1.00 C ATOM 147 OG SER A 10 85.917 12.245 -12.412 1.00 1.00 O ATOM 0 H SER A 10 84.501 15.496 -10.858 1.00 1.00 H new ATOM 0 HA SER A 10 83.691 12.822 -11.451 1.00 1.00 H new ATOM 0 HB2 SER A 10 85.727 14.302 -12.354 1.00 1.00 H new ATOM 0 HB3 SER A 10 86.593 13.597 -11.003 1.00 1.00 H new ATOM 0 HG SER A 10 85.501 12.340 -13.294 1.00 1.00 H new ATOM 153 N ARG A 11 85.548 13.135 -8.701 1.00 1.00 N ATOM 154 CA ARG A 11 85.908 12.444 -7.450 1.00 1.00 C ATOM 155 C ARG A 11 84.729 12.335 -6.480 1.00 1.00 C ATOM 156 O ARG A 11 84.479 11.270 -5.940 1.00 1.00 O ATOM 157 CB ARG A 11 87.128 13.132 -6.763 1.00 1.00 C ATOM 158 CG ARG A 11 88.456 12.469 -7.185 1.00 1.00 C ATOM 159 CD ARG A 11 88.802 11.295 -6.251 1.00 1.00 C ATOM 160 NE ARG A 11 89.513 10.268 -6.997 1.00 1.00 N ATOM 161 CZ ARG A 11 90.213 9.328 -6.375 1.00 1.00 C ATOM 162 NH1 ARG A 11 90.348 9.361 -5.077 1.00 1.00 N ATOM 163 NH2 ARG A 11 90.779 8.378 -7.068 1.00 1.00 N ATOM 0 H ARG A 11 86.023 14.026 -8.844 1.00 1.00 H new ATOM 0 HA ARG A 11 86.190 11.427 -7.723 1.00 1.00 H new ATOM 0 HB2 ARG A 11 87.147 14.190 -7.026 1.00 1.00 H new ATOM 0 HB3 ARG A 11 87.018 13.075 -5.680 1.00 1.00 H new ATOM 0 HG2 ARG A 11 88.379 12.112 -8.212 1.00 1.00 H new ATOM 0 HG3 ARG A 11 89.259 13.206 -7.163 1.00 1.00 H new ATOM 0 HD2 ARG A 11 89.416 11.646 -5.422 1.00 1.00 H new ATOM 0 HD3 ARG A 11 87.891 10.880 -5.820 1.00 1.00 H new ATOM 0 HE ARG A 11 89.473 10.271 -8.016 1.00 1.00 H new ATOM 0 HH11 ARG A 11 89.915 10.111 -4.538 1.00 1.00 H new ATOM 0 HH12 ARG A 11 90.887 8.637 -4.602 1.00 1.00 H new ATOM 0 HH21 ARG A 11 90.682 8.360 -8.083 1.00 1.00 H new ATOM 0 HH22 ARG A 11 91.318 7.653 -6.594 1.00 1.00 H new ATOM 177 N ALA A 12 83.985 13.414 -6.281 1.00 1.00 N ATOM 178 CA ALA A 12 82.834 13.302 -5.378 1.00 1.00 C ATOM 179 C ALA A 12 81.786 12.406 -6.040 1.00 1.00 C ATOM 180 O ALA A 12 81.352 11.409 -5.461 1.00 1.00 O ATOM 181 CB ALA A 12 82.247 14.680 -5.005 1.00 1.00 C ATOM 0 H ALA A 12 84.138 14.330 -6.702 1.00 1.00 H new ATOM 0 HA ALA A 12 83.161 12.856 -4.439 1.00 1.00 H new ATOM 0 HB1 ALA A 12 81.398 14.545 -4.335 1.00 1.00 H new ATOM 0 HB2 ALA A 12 83.010 15.278 -4.507 1.00 1.00 H new ATOM 0 HB3 ALA A 12 81.918 15.192 -5.909 1.00 1.00 H new ATOM 187 N VAL A 13 81.376 12.771 -7.252 1.00 1.00 N ATOM 188 CA VAL A 13 80.364 11.953 -7.914 1.00 1.00 C ATOM 189 C VAL A 13 80.923 10.551 -8.140 1.00 1.00 C ATOM 190 O VAL A 13 80.336 9.595 -7.711 1.00 1.00 O ATOM 191 CB VAL A 13 79.809 12.578 -9.242 1.00 1.00 C ATOM 192 CG1 VAL A 13 80.391 11.896 -10.502 1.00 1.00 C ATOM 193 CG2 VAL A 13 78.280 12.431 -9.309 1.00 1.00 C ATOM 0 H VAL A 13 81.707 13.583 -7.773 1.00 1.00 H new ATOM 0 HA VAL A 13 79.500 11.904 -7.252 1.00 1.00 H new ATOM 0 HB VAL A 13 80.106 13.627 -9.228 1.00 1.00 H new ATOM 0 HG11 VAL A 13 79.976 12.365 -11.394 1.00 1.00 H new ATOM 0 HG12 VAL A 13 81.476 12.005 -10.506 1.00 1.00 H new ATOM 0 HG13 VAL A 13 80.133 10.837 -10.495 1.00 1.00 H new ATOM 0 HG21 VAL A 13 77.913 12.870 -10.237 1.00 1.00 H new ATOM 0 HG22 VAL A 13 78.014 11.374 -9.277 1.00 1.00 H new ATOM 0 HG23 VAL A 13 77.828 12.944 -8.461 1.00 1.00 H new ATOM 203 N ALA A 14 82.079 10.412 -8.748 1.00 1.00 N ATOM 204 CA ALA A 14 82.574 9.047 -8.940 1.00 1.00 C ATOM 205 C ALA A 14 82.777 8.358 -7.590 1.00 1.00 C ATOM 206 O ALA A 14 82.147 7.355 -7.321 1.00 1.00 O ATOM 207 CB ALA A 14 83.884 9.002 -9.734 1.00 1.00 C ATOM 0 H ALA A 14 82.669 11.165 -9.102 1.00 1.00 H new ATOM 0 HA ALA A 14 81.816 8.519 -9.519 1.00 1.00 H new ATOM 0 HB1 ALA A 14 84.206 7.967 -9.847 1.00 1.00 H new ATOM 0 HB2 ALA A 14 83.728 9.443 -10.719 1.00 1.00 H new ATOM 0 HB3 ALA A 14 84.651 9.564 -9.202 1.00 1.00 H new ATOM 213 N ALA A 15 83.651 8.898 -6.762 1.00 1.00 N ATOM 214 CA ALA A 15 83.914 8.246 -5.465 1.00 1.00 C ATOM 215 C ALA A 15 82.606 8.039 -4.706 1.00 1.00 C ATOM 216 O ALA A 15 82.272 6.924 -4.312 1.00 1.00 O ATOM 217 CB ALA A 15 84.892 9.054 -4.611 1.00 1.00 C ATOM 0 H ALA A 15 84.179 9.752 -6.940 1.00 1.00 H new ATOM 0 HA ALA A 15 84.373 7.279 -5.670 1.00 1.00 H new ATOM 0 HB1 ALA A 15 85.059 8.540 -3.664 1.00 1.00 H new ATOM 0 HB2 ALA A 15 85.839 9.156 -5.141 1.00 1.00 H new ATOM 0 HB3 ALA A 15 84.476 10.043 -4.418 1.00 1.00 H new ATOM 223 N ALA A 16 81.882 9.116 -4.493 1.00 1.00 N ATOM 224 CA ALA A 16 80.629 8.986 -3.759 1.00 1.00 C ATOM 225 C ALA A 16 79.619 8.138 -4.565 1.00 1.00 C ATOM 226 O ALA A 16 79.093 7.141 -4.073 1.00 1.00 O ATOM 227 CB ALA A 16 80.029 10.361 -3.435 1.00 1.00 C ATOM 0 H ALA A 16 82.120 10.059 -4.801 1.00 1.00 H new ATOM 0 HA ALA A 16 80.843 8.481 -2.817 1.00 1.00 H new ATOM 0 HB1 ALA A 16 79.095 10.231 -2.888 1.00 1.00 H new ATOM 0 HB2 ALA A 16 80.731 10.930 -2.825 1.00 1.00 H new ATOM 0 HB3 ALA A 16 79.834 10.900 -4.362 1.00 1.00 H new ATOM 233 N LEU A 17 79.356 8.567 -5.793 1.00 1.00 N ATOM 234 CA LEU A 17 78.366 7.835 -6.623 1.00 1.00 C ATOM 235 C LEU A 17 78.814 6.375 -6.747 1.00 1.00 C ATOM 236 O LEU A 17 78.057 5.468 -6.414 1.00 1.00 O ATOM 237 CB LEU A 17 78.197 8.438 -8.028 1.00 1.00 C ATOM 238 CG LEU A 17 76.935 7.916 -8.741 1.00 1.00 C ATOM 239 CD1 LEU A 17 75.688 8.671 -8.259 1.00 1.00 C ATOM 240 CD2 LEU A 17 77.094 8.133 -10.255 1.00 1.00 C ATOM 0 H LEU A 17 79.785 9.380 -6.235 1.00 1.00 H new ATOM 0 HA LEU A 17 77.398 7.912 -6.127 1.00 1.00 H new ATOM 0 HB2 LEU A 17 78.145 9.524 -7.951 1.00 1.00 H new ATOM 0 HB3 LEU A 17 79.075 8.203 -8.630 1.00 1.00 H new ATOM 0 HG LEU A 17 76.815 6.857 -8.514 1.00 1.00 H new ATOM 0 HD11 LEU A 17 74.808 8.287 -8.775 1.00 1.00 H new ATOM 0 HD12 LEU A 17 75.569 8.529 -7.185 1.00 1.00 H new ATOM 0 HD13 LEU A 17 75.800 9.734 -8.475 1.00 1.00 H new ATOM 0 HD21 LEU A 17 76.206 7.767 -10.770 1.00 1.00 H new ATOM 0 HD22 LEU A 17 77.219 9.196 -10.459 1.00 1.00 H new ATOM 0 HD23 LEU A 17 77.970 7.590 -10.610 1.00 1.00 H new ATOM 252 N VAL A 18 80.038 6.146 -7.236 1.00 1.00 N ATOM 253 CA VAL A 18 80.513 4.762 -7.381 1.00 1.00 C ATOM 254 C VAL A 18 80.808 4.146 -6.005 1.00 1.00 C ATOM 255 O VAL A 18 80.257 3.098 -5.662 1.00 1.00 O ATOM 256 CB VAL A 18 81.730 4.640 -8.365 1.00 1.00 C ATOM 257 CG1 VAL A 18 81.581 5.640 -9.554 1.00 1.00 C ATOM 258 CG2 VAL A 18 83.105 4.842 -7.662 1.00 1.00 C ATOM 0 H VAL A 18 80.697 6.868 -7.528 1.00 1.00 H new ATOM 0 HA VAL A 18 79.710 4.185 -7.839 1.00 1.00 H new ATOM 0 HB VAL A 18 81.715 3.619 -8.746 1.00 1.00 H new ATOM 0 HG11 VAL A 18 82.435 5.539 -10.224 1.00 1.00 H new ATOM 0 HG12 VAL A 18 80.663 5.422 -10.100 1.00 1.00 H new ATOM 0 HG13 VAL A 18 81.540 6.659 -9.169 1.00 1.00 H new ATOM 0 HG21 VAL A 18 83.906 4.746 -8.395 1.00 1.00 H new ATOM 0 HG22 VAL A 18 83.142 5.834 -7.213 1.00 1.00 H new ATOM 0 HG23 VAL A 18 83.231 4.087 -6.886 1.00 1.00 H new ATOM 268 N GLY A 19 81.698 4.771 -5.232 1.00 1.00 N ATOM 269 CA GLY A 19 82.078 4.246 -3.930 1.00 1.00 C ATOM 270 C GLY A 19 80.896 4.204 -2.972 1.00 1.00 C ATOM 271 O GLY A 19 79.742 4.243 -3.393 1.00 1.00 O ATOM 0 H GLY A 19 82.166 5.640 -5.489 1.00 1.00 H new ATOM 0 HA2 GLY A 19 82.487 3.242 -4.048 1.00 1.00 H new ATOM 0 HA3 GLY A 19 82.869 4.864 -3.505 1.00 1.00 H new ATOM 275 N PRO A 20 81.162 4.076 -1.702 1.00 1.00 N ATOM 276 CA PRO A 20 80.101 3.980 -0.675 1.00 1.00 C ATOM 277 C PRO A 20 79.495 5.322 -0.263 1.00 1.00 C ATOM 278 O PRO A 20 78.411 5.340 0.274 1.00 1.00 O ATOM 279 CB PRO A 20 80.823 3.306 0.492 1.00 1.00 C ATOM 280 CG PRO A 20 82.224 3.821 0.408 1.00 1.00 C ATOM 281 CD PRO A 20 82.507 4.040 -1.086 1.00 1.00 C ATOM 0 HA PRO A 20 79.235 3.432 -1.045 1.00 1.00 H new ATOM 0 HB2 PRO A 20 80.362 3.562 1.446 1.00 1.00 H new ATOM 0 HB3 PRO A 20 80.793 2.220 0.404 1.00 1.00 H new ATOM 0 HG2 PRO A 20 82.332 4.751 0.966 1.00 1.00 H new ATOM 0 HG3 PRO A 20 82.928 3.108 0.838 1.00 1.00 H new ATOM 0 HD2 PRO A 20 83.050 4.969 -1.258 1.00 1.00 H new ATOM 0 HD3 PRO A 20 83.114 3.235 -1.500 1.00 1.00 H new ATOM 289 N GLY A 21 80.200 6.438 -0.470 1.00 1.00 N ATOM 290 CA GLY A 21 79.645 7.728 -0.016 1.00 1.00 C ATOM 291 C GLY A 21 78.316 8.036 -0.699 1.00 1.00 C ATOM 292 O GLY A 21 77.284 8.167 -0.040 1.00 1.00 O ATOM 0 H GLY A 21 81.112 6.484 -0.925 1.00 1.00 H new ATOM 0 HA2 GLY A 21 79.503 7.704 1.064 1.00 1.00 H new ATOM 0 HA3 GLY A 21 80.357 8.526 -0.227 1.00 1.00 H new ATOM 296 N GLY A 22 78.349 8.146 -2.011 1.00 1.00 N ATOM 297 CA GLY A 22 77.105 8.434 -2.731 1.00 1.00 C ATOM 298 C GLY A 22 76.124 7.313 -2.435 1.00 1.00 C ATOM 299 O GLY A 22 74.996 7.549 -1.998 1.00 1.00 O ATOM 0 H GLY A 22 79.183 8.047 -2.591 1.00 1.00 H new ATOM 0 HA2 GLY A 22 76.695 9.393 -2.415 1.00 1.00 H new ATOM 0 HA3 GLY A 22 77.292 8.504 -3.803 1.00 1.00 H new ATOM 303 N VAL A 23 76.557 6.088 -2.694 1.00 1.00 N ATOM 304 CA VAL A 23 75.675 4.949 -2.455 1.00 1.00 C ATOM 305 C VAL A 23 75.218 4.957 -0.993 1.00 1.00 C ATOM 306 O VAL A 23 74.091 4.583 -0.689 1.00 1.00 O ATOM 307 CB VAL A 23 76.325 3.601 -2.807 1.00 1.00 C ATOM 308 CG1 VAL A 23 75.342 2.478 -2.463 1.00 1.00 C ATOM 309 CG2 VAL A 23 76.621 3.538 -4.312 1.00 1.00 C ATOM 0 H VAL A 23 77.482 5.858 -3.058 1.00 1.00 H new ATOM 0 HA VAL A 23 74.816 5.057 -3.117 1.00 1.00 H new ATOM 0 HB VAL A 23 77.253 3.492 -2.246 1.00 1.00 H new ATOM 0 HG11 VAL A 23 75.790 1.515 -2.708 1.00 1.00 H new ATOM 0 HG12 VAL A 23 75.110 2.511 -1.398 1.00 1.00 H new ATOM 0 HG13 VAL A 23 74.425 2.608 -3.038 1.00 1.00 H new ATOM 0 HG21 VAL A 23 77.081 2.580 -4.552 1.00 1.00 H new ATOM 0 HG22 VAL A 23 75.691 3.644 -4.870 1.00 1.00 H new ATOM 0 HG23 VAL A 23 77.301 4.345 -4.583 1.00 1.00 H new ATOM 319 N ALA A 24 76.100 5.405 -0.093 1.00 1.00 N ATOM 320 CA ALA A 24 75.709 5.449 1.323 1.00 1.00 C ATOM 321 C ALA A 24 74.570 6.443 1.528 1.00 1.00 C ATOM 322 O ALA A 24 73.506 6.062 2.009 1.00 1.00 O ATOM 323 CB ALA A 24 76.873 5.835 2.253 1.00 1.00 C ATOM 0 H ALA A 24 77.045 5.728 -0.302 1.00 1.00 H new ATOM 0 HA ALA A 24 75.390 4.440 1.583 1.00 1.00 H new ATOM 0 HB1 ALA A 24 76.524 5.851 3.285 1.00 1.00 H new ATOM 0 HB2 ALA A 24 77.676 5.105 2.153 1.00 1.00 H new ATOM 0 HB3 ALA A 24 77.244 6.823 1.980 1.00 1.00 H new ATOM 329 N LEU A 25 74.795 7.723 1.226 1.00 1.00 N ATOM 330 CA LEU A 25 73.762 8.721 1.465 1.00 1.00 C ATOM 331 C LEU A 25 72.499 8.439 0.669 1.00 1.00 C ATOM 332 O LEU A 25 71.404 8.481 1.224 1.00 1.00 O ATOM 333 CB LEU A 25 74.280 10.126 1.111 1.00 1.00 C ATOM 334 CG LEU A 25 73.298 11.202 1.622 1.00 1.00 C ATOM 335 CD1 LEU A 25 73.489 11.434 3.130 1.00 1.00 C ATOM 336 CD2 LEU A 25 73.543 12.516 0.877 1.00 1.00 C ATOM 0 H LEU A 25 75.661 8.083 0.826 1.00 1.00 H new ATOM 0 HA LEU A 25 73.514 8.672 2.525 1.00 1.00 H new ATOM 0 HB2 LEU A 25 75.264 10.281 1.555 1.00 1.00 H new ATOM 0 HB3 LEU A 25 74.399 10.216 0.031 1.00 1.00 H new ATOM 0 HG LEU A 25 72.280 10.856 1.442 1.00 1.00 H new ATOM 0 HD11 LEU A 25 72.788 12.196 3.473 1.00 1.00 H new ATOM 0 HD12 LEU A 25 73.305 10.504 3.667 1.00 1.00 H new ATOM 0 HD13 LEU A 25 74.509 11.767 3.320 1.00 1.00 H new ATOM 0 HD21 LEU A 25 72.849 13.274 1.239 1.00 1.00 H new ATOM 0 HD22 LEU A 25 74.566 12.848 1.052 1.00 1.00 H new ATOM 0 HD23 LEU A 25 73.388 12.363 -0.191 1.00 1.00 H new ATOM 348 N VAL A 26 72.629 8.191 -0.630 1.00 1.00 N ATOM 349 CA VAL A 26 71.435 7.971 -1.431 1.00 1.00 C ATOM 350 C VAL A 26 70.645 6.784 -0.895 1.00 1.00 C ATOM 351 O VAL A 26 69.469 6.923 -0.555 1.00 1.00 O ATOM 352 CB VAL A 26 71.851 7.701 -2.882 1.00 1.00 C ATOM 353 CG1 VAL A 26 70.629 7.310 -3.714 1.00 1.00 C ATOM 354 CG2 VAL A 26 72.497 8.961 -3.469 1.00 1.00 C ATOM 0 H VAL A 26 73.514 8.139 -1.134 1.00 1.00 H new ATOM 0 HA VAL A 26 70.803 8.858 -1.383 1.00 1.00 H new ATOM 0 HB VAL A 26 72.568 6.880 -2.903 1.00 1.00 H new ATOM 0 HG11 VAL A 26 70.935 7.120 -4.743 1.00 1.00 H new ATOM 0 HG12 VAL A 26 70.178 6.409 -3.297 1.00 1.00 H new ATOM 0 HG13 VAL A 26 69.901 8.121 -3.696 1.00 1.00 H new ATOM 0 HG21 VAL A 26 72.793 8.771 -4.501 1.00 1.00 H new ATOM 0 HG22 VAL A 26 71.781 9.783 -3.443 1.00 1.00 H new ATOM 0 HG23 VAL A 26 73.376 9.226 -2.882 1.00 1.00 H new ATOM 364 N VAL A 27 71.262 5.611 -0.872 1.00 1.00 N ATOM 365 CA VAL A 27 70.556 4.415 -0.432 1.00 1.00 C ATOM 366 C VAL A 27 70.052 4.553 0.991 1.00 1.00 C ATOM 367 O VAL A 27 68.957 4.095 1.321 1.00 1.00 O ATOM 368 CB VAL A 27 71.479 3.179 -0.564 1.00 1.00 C ATOM 369 CG1 VAL A 27 72.384 3.024 0.676 1.00 1.00 C ATOM 370 CG2 VAL A 27 70.625 1.915 -0.718 1.00 1.00 C ATOM 0 H VAL A 27 72.233 5.462 -1.147 1.00 1.00 H new ATOM 0 HA VAL A 27 69.685 4.283 -1.074 1.00 1.00 H new ATOM 0 HB VAL A 27 72.110 3.320 -1.442 1.00 1.00 H new ATOM 0 HG11 VAL A 27 73.021 2.148 0.554 1.00 1.00 H new ATOM 0 HG12 VAL A 27 73.006 3.912 0.786 1.00 1.00 H new ATOM 0 HG13 VAL A 27 71.765 2.902 1.565 1.00 1.00 H new ATOM 0 HG21 VAL A 27 71.276 1.045 -0.811 1.00 1.00 H new ATOM 0 HG22 VAL A 27 69.986 1.798 0.158 1.00 1.00 H new ATOM 0 HG23 VAL A 27 70.005 2.001 -1.610 1.00 1.00 H new ATOM 380 N LYS A 28 70.853 5.177 1.829 1.00 1.00 N ATOM 381 CA LYS A 28 70.470 5.343 3.211 1.00 1.00 C ATOM 382 C LYS A 28 69.314 6.317 3.318 1.00 1.00 C ATOM 383 O LYS A 28 68.287 6.024 3.934 1.00 1.00 O ATOM 384 CB LYS A 28 71.678 5.852 4.003 1.00 1.00 C ATOM 385 CG LYS A 28 71.337 5.956 5.487 1.00 1.00 C ATOM 386 CD LYS A 28 72.582 6.410 6.245 1.00 1.00 C ATOM 387 CE LYS A 28 72.273 6.508 7.737 1.00 1.00 C ATOM 388 NZ LYS A 28 73.501 6.931 8.467 1.00 1.00 N ATOM 0 H LYS A 28 71.760 5.572 1.581 1.00 1.00 H new ATOM 0 HA LYS A 28 70.146 4.387 3.622 1.00 1.00 H new ATOM 0 HB2 LYS A 28 72.522 5.177 3.864 1.00 1.00 H new ATOM 0 HB3 LYS A 28 71.984 6.827 3.625 1.00 1.00 H new ATOM 0 HG2 LYS A 28 70.523 6.665 5.639 1.00 1.00 H new ATOM 0 HG3 LYS A 28 70.995 4.992 5.865 1.00 1.00 H new ATOM 0 HD2 LYS A 28 73.397 5.706 6.079 1.00 1.00 H new ATOM 0 HD3 LYS A 28 72.915 7.377 5.869 1.00 1.00 H new ATOM 0 HE2 LYS A 28 71.470 7.225 7.907 1.00 1.00 H new ATOM 0 HE3 LYS A 28 71.926 5.545 8.112 1.00 1.00 H new ATOM 0 HZ1 LYS A 28 73.294 6.999 9.484 1.00 1.00 H new ATOM 0 HZ2 LYS A 28 74.255 6.231 8.313 1.00 1.00 H new ATOM 0 HZ3 LYS A 28 73.812 7.859 8.114 1.00 1.00 H new ATOM 402 N VAL A 29 69.524 7.505 2.778 1.00 1.00 N ATOM 403 CA VAL A 29 68.507 8.553 2.888 1.00 1.00 C ATOM 404 C VAL A 29 67.247 8.193 2.121 1.00 1.00 C ATOM 405 O VAL A 29 66.145 8.270 2.660 1.00 1.00 O ATOM 406 CB VAL A 29 69.060 9.908 2.401 1.00 1.00 C ATOM 407 CG1 VAL A 29 67.921 10.931 2.293 1.00 1.00 C ATOM 408 CG2 VAL A 29 70.097 10.425 3.406 1.00 1.00 C ATOM 0 H VAL A 29 70.367 7.771 2.269 1.00 1.00 H new ATOM 0 HA VAL A 29 68.244 8.640 3.942 1.00 1.00 H new ATOM 0 HB VAL A 29 69.521 9.772 1.423 1.00 1.00 H new ATOM 0 HG11 VAL A 29 68.320 11.885 1.949 1.00 1.00 H new ATOM 0 HG12 VAL A 29 67.176 10.572 1.583 1.00 1.00 H new ATOM 0 HG13 VAL A 29 67.457 11.064 3.270 1.00 1.00 H new ATOM 0 HG21 VAL A 29 70.489 11.383 3.064 1.00 1.00 H new ATOM 0 HG22 VAL A 29 69.627 10.553 4.381 1.00 1.00 H new ATOM 0 HG23 VAL A 29 70.913 9.707 3.488 1.00 1.00 H new ATOM 418 N CYS A 30 67.396 7.838 0.854 1.00 1.00 N ATOM 419 CA CYS A 30 66.219 7.528 0.076 1.00 1.00 C ATOM 420 C CYS A 30 65.547 6.266 0.601 1.00 1.00 C ATOM 421 O CYS A 30 64.365 6.294 0.952 1.00 1.00 O ATOM 422 CB CYS A 30 66.626 7.351 -1.391 1.00 1.00 C ATOM 423 SG CYS A 30 65.167 7.028 -2.408 1.00 1.00 S ATOM 0 H CYS A 30 68.286 7.761 0.362 1.00 1.00 H new ATOM 0 HA CYS A 30 65.503 8.345 0.159 1.00 1.00 H new ATOM 0 HB2 CYS A 30 67.135 8.247 -1.746 1.00 1.00 H new ATOM 0 HB3 CYS A 30 67.333 6.526 -1.483 1.00 1.00 H new ATOM 0 HG CYS A 30 65.527 6.882 -3.649 1.00 1.00 H new ATOM 428 N ALA A 31 66.264 5.145 0.575 1.00 1.00 N ATOM 429 CA ALA A 31 65.673 3.878 0.967 1.00 1.00 C ATOM 430 C ALA A 31 65.280 3.870 2.428 1.00 1.00 C ATOM 431 O ALA A 31 64.174 3.460 2.777 1.00 1.00 O ATOM 432 CB ALA A 31 66.654 2.727 0.654 1.00 1.00 C ATOM 0 H ALA A 31 67.242 5.092 0.290 1.00 1.00 H new ATOM 0 HA ALA A 31 64.759 3.735 0.391 1.00 1.00 H new ATOM 0 HB1 ALA A 31 66.207 1.778 0.949 1.00 1.00 H new ATOM 0 HB2 ALA A 31 66.867 2.711 -0.415 1.00 1.00 H new ATOM 0 HB3 ALA A 31 67.581 2.879 1.206 1.00 1.00 H new ATOM 438 N GLY A 32 66.205 4.266 3.285 1.00 1.00 N ATOM 439 CA GLY A 32 65.930 4.237 4.705 1.00 1.00 C ATOM 440 C GLY A 32 66.061 2.800 5.177 1.00 1.00 C ATOM 441 O GLY A 32 65.090 2.188 5.628 1.00 1.00 O ATOM 0 H GLY A 32 67.132 4.604 3.028 1.00 1.00 H new ATOM 0 HA2 GLY A 32 66.628 4.880 5.242 1.00 1.00 H new ATOM 0 HA3 GLY A 32 64.928 4.615 4.907 1.00 1.00 H new ATOM 445 N LEU A 33 67.281 2.266 5.039 1.00 1.00 N ATOM 446 CA LEU A 33 67.591 0.883 5.422 1.00 1.00 C ATOM 447 C LEU A 33 67.364 -0.061 4.225 1.00 1.00 C ATOM 448 O LEU A 33 66.235 -0.501 4.000 1.00 1.00 O ATOM 449 CB LEU A 33 66.722 0.445 6.622 1.00 1.00 C ATOM 450 CG LEU A 33 67.457 -0.600 7.484 1.00 1.00 C ATOM 451 CD1 LEU A 33 68.728 0.018 8.116 1.00 1.00 C ATOM 452 CD2 LEU A 33 66.503 -1.109 8.590 1.00 1.00 C ATOM 0 H LEU A 33 68.078 2.778 4.660 1.00 1.00 H new ATOM 0 HA LEU A 33 68.639 0.831 5.719 1.00 1.00 H new ATOM 0 HB2 LEU A 33 66.473 1.314 7.231 1.00 1.00 H new ATOM 0 HB3 LEU A 33 65.782 0.028 6.262 1.00 1.00 H new ATOM 0 HG LEU A 33 67.762 -1.436 6.854 1.00 1.00 H new ATOM 0 HD11 LEU A 33 69.235 -0.733 8.722 1.00 1.00 H new ATOM 0 HD12 LEU A 33 69.397 0.360 7.327 1.00 1.00 H new ATOM 0 HD13 LEU A 33 68.448 0.863 8.745 1.00 1.00 H new ATOM 0 HD21 LEU A 33 67.018 -1.849 9.203 1.00 1.00 H new ATOM 0 HD22 LEU A 33 66.192 -0.272 9.216 1.00 1.00 H new ATOM 0 HD23 LEU A 33 65.625 -1.565 8.132 1.00 1.00 H new ATOM 464 N PRO A 34 68.389 -0.375 3.440 1.00 1.00 N ATOM 465 CA PRO A 34 68.233 -1.271 2.253 1.00 1.00 C ATOM 466 C PRO A 34 68.063 -2.733 2.643 1.00 1.00 C ATOM 467 O PRO A 34 67.741 -3.575 1.802 1.00 1.00 O ATOM 468 CB PRO A 34 69.526 -1.061 1.451 1.00 1.00 C ATOM 469 CG PRO A 34 70.549 -0.654 2.464 1.00 1.00 C ATOM 470 CD PRO A 34 69.795 0.068 3.590 1.00 1.00 C ATOM 0 HA PRO A 34 67.335 -1.030 1.685 1.00 1.00 H new ATOM 0 HB2 PRO A 34 69.823 -1.974 0.935 1.00 1.00 H new ATOM 0 HB3 PRO A 34 69.397 -0.292 0.689 1.00 1.00 H new ATOM 0 HG2 PRO A 34 71.079 -1.525 2.850 1.00 1.00 H new ATOM 0 HG3 PRO A 34 71.296 0.001 2.017 1.00 1.00 H new ATOM 0 HD2 PRO A 34 70.193 -0.199 4.569 1.00 1.00 H new ATOM 0 HD3 PRO A 34 69.882 1.150 3.495 1.00 1.00 H new ATOM 478 N GLY A 35 68.304 -3.039 3.909 1.00 1.00 N ATOM 479 CA GLY A 35 68.182 -4.422 4.330 1.00 1.00 C ATOM 480 C GLY A 35 66.762 -4.921 4.035 1.00 1.00 C ATOM 481 O GLY A 35 66.576 -5.829 3.221 1.00 1.00 O ATOM 0 H GLY A 35 68.575 -2.377 4.636 1.00 1.00 H new ATOM 0 HA2 GLY A 35 68.912 -5.039 3.806 1.00 1.00 H new ATOM 0 HA3 GLY A 35 68.396 -4.510 5.395 1.00 1.00 H new ATOM 485 N VAL A 36 65.757 -4.284 4.643 1.00 1.00 N ATOM 486 CA VAL A 36 64.362 -4.647 4.363 1.00 1.00 C ATOM 487 C VAL A 36 63.916 -3.779 3.207 1.00 1.00 C ATOM 488 O VAL A 36 64.694 -2.930 2.784 1.00 1.00 O ATOM 489 CB VAL A 36 63.434 -4.406 5.569 1.00 1.00 C ATOM 490 CG1 VAL A 36 63.525 -5.583 6.552 1.00 1.00 C ATOM 491 CG2 VAL A 36 63.842 -3.109 6.271 1.00 1.00 C ATOM 0 H VAL A 36 65.877 -3.530 5.319 1.00 1.00 H new ATOM 0 HA VAL A 36 64.304 -5.711 4.135 1.00 1.00 H new ATOM 0 HB VAL A 36 62.405 -4.323 5.219 1.00 1.00 H new ATOM 0 HG11 VAL A 36 62.865 -5.401 7.400 1.00 1.00 H new ATOM 0 HG12 VAL A 36 63.224 -6.502 6.048 1.00 1.00 H new ATOM 0 HG13 VAL A 36 64.551 -5.683 6.906 1.00 1.00 H new ATOM 0 HG21 VAL A 36 63.187 -2.936 7.125 1.00 1.00 H new ATOM 0 HG22 VAL A 36 64.873 -3.190 6.615 1.00 1.00 H new ATOM 0 HG23 VAL A 36 63.757 -2.276 5.574 1.00 1.00 H new ATOM 501 N ILE A 37 62.677 -3.994 2.725 1.00 1.00 N ATOM 502 CA ILE A 37 62.088 -3.225 1.605 1.00 1.00 C ATOM 503 C ILE A 37 62.014 -4.093 0.349 1.00 1.00 C ATOM 504 O ILE A 37 63.033 -4.512 -0.196 1.00 1.00 O ATOM 505 CB ILE A 37 62.854 -1.896 1.320 1.00 1.00 C ATOM 506 CG1 ILE A 37 61.929 -0.873 0.642 1.00 1.00 C ATOM 507 CG2 ILE A 37 64.067 -2.134 0.387 1.00 1.00 C ATOM 508 CD1 ILE A 37 62.565 0.519 0.737 1.00 1.00 C ATOM 0 H ILE A 37 62.052 -4.707 3.101 1.00 1.00 H new ATOM 0 HA ILE A 37 61.078 -2.942 1.903 1.00 1.00 H new ATOM 0 HB ILE A 37 63.200 -1.516 2.282 1.00 1.00 H new ATOM 0 HG12 ILE A 37 61.770 -1.143 -0.402 1.00 1.00 H new ATOM 0 HG13 ILE A 37 60.951 -0.873 1.123 1.00 1.00 H new ATOM 0 HG21 ILE A 37 64.579 -1.189 0.208 1.00 1.00 H new ATOM 0 HG22 ILE A 37 64.755 -2.836 0.857 1.00 1.00 H new ATOM 0 HG23 ILE A 37 63.721 -2.545 -0.562 1.00 1.00 H new ATOM 0 HD11 ILE A 37 61.914 1.250 0.258 1.00 1.00 H new ATOM 0 HD12 ILE A 37 62.701 0.786 1.785 1.00 1.00 H new ATOM 0 HD13 ILE A 37 63.533 0.512 0.236 1.00 1.00 H new ATOM 520 N HIS A 38 60.790 -4.372 -0.110 1.00 1.00 N ATOM 521 CA HIS A 38 60.596 -5.191 -1.301 1.00 1.00 C ATOM 522 C HIS A 38 59.406 -4.674 -2.102 1.00 1.00 C ATOM 523 O HIS A 38 58.358 -4.355 -1.541 1.00 1.00 O ATOM 524 CB HIS A 38 60.357 -6.651 -0.904 1.00 1.00 C ATOM 525 CG HIS A 38 61.637 -7.239 -0.380 1.00 1.00 C ATOM 526 ND1 HIS A 38 62.037 -7.081 0.936 1.00 1.00 N ATOM 527 CD2 HIS A 38 62.625 -7.979 -0.986 1.00 1.00 C ATOM 528 CE1 HIS A 38 63.219 -7.708 1.080 1.00 1.00 C ATOM 529 NE2 HIS A 38 63.623 -8.272 -0.062 1.00 1.00 N ATOM 0 H HIS A 38 59.927 -4.044 0.324 1.00 1.00 H new ATOM 0 HA HIS A 38 61.494 -5.132 -1.916 1.00 1.00 H new ATOM 0 HB2 HIS A 38 59.578 -6.710 -0.144 1.00 1.00 H new ATOM 0 HB3 HIS A 38 60.007 -7.221 -1.764 1.00 1.00 H new ATOM 0 HD2 HIS A 38 62.626 -8.286 -2.021 1.00 1.00 H new ATOM 0 HE1 HIS A 38 63.774 -7.750 2.006 1.00 1.00 H new ATOM 0 HE2 HIS A 38 64.479 -8.803 -0.222 1.00 1.00 H new ATOM 537 N THR A 39 59.568 -4.611 -3.419 1.00 1.00 N ATOM 538 CA THR A 39 58.499 -4.150 -4.309 1.00 1.00 C ATOM 539 C THR A 39 57.921 -5.353 -5.068 1.00 1.00 C ATOM 540 O THR A 39 58.650 -6.016 -5.803 1.00 1.00 O ATOM 541 CB THR A 39 59.051 -3.139 -5.319 1.00 1.00 C ATOM 542 OG1 THR A 39 58.247 -3.162 -6.491 1.00 1.00 O ATOM 543 CG2 THR A 39 60.490 -3.506 -5.676 1.00 1.00 C ATOM 0 H THR A 39 60.429 -4.873 -3.898 1.00 1.00 H new ATOM 0 HA THR A 39 57.721 -3.672 -3.713 1.00 1.00 H new ATOM 0 HB THR A 39 59.033 -2.140 -4.884 1.00 1.00 H new ATOM 0 HG1 THR A 39 58.752 -3.569 -7.226 1.00 1.00 H new ATOM 0 HG21 THR A 39 60.882 -2.786 -6.395 1.00 1.00 H new ATOM 0 HG22 THR A 39 61.104 -3.490 -4.775 1.00 1.00 H new ATOM 0 HG23 THR A 39 60.513 -4.504 -6.113 1.00 1.00 H new ATOM 551 N PRO A 40 56.653 -5.670 -4.913 1.00 1.00 N ATOM 552 CA PRO A 40 56.046 -6.838 -5.618 1.00 1.00 C ATOM 553 C PRO A 40 56.390 -6.899 -7.109 1.00 1.00 C ATOM 554 O PRO A 40 56.382 -7.975 -7.704 1.00 1.00 O ATOM 555 CB PRO A 40 54.531 -6.626 -5.439 1.00 1.00 C ATOM 556 CG PRO A 40 54.381 -5.817 -4.191 1.00 1.00 C ATOM 557 CD PRO A 40 55.659 -4.979 -4.055 1.00 1.00 C ATOM 0 HA PRO A 40 56.421 -7.775 -5.208 1.00 1.00 H new ATOM 0 HB2 PRO A 40 54.104 -6.106 -6.297 1.00 1.00 H new ATOM 0 HB3 PRO A 40 54.010 -7.579 -5.353 1.00 1.00 H new ATOM 0 HG2 PRO A 40 53.502 -5.176 -4.248 1.00 1.00 H new ATOM 0 HG3 PRO A 40 54.248 -6.464 -3.324 1.00 1.00 H new ATOM 0 HD2 PRO A 40 55.497 -3.953 -4.384 1.00 1.00 H new ATOM 0 HD3 PRO A 40 55.994 -4.932 -3.019 1.00 1.00 H new ATOM 565 N ALA A 41 56.718 -5.750 -7.703 1.00 1.00 N ATOM 566 CA ALA A 41 57.087 -5.688 -9.121 1.00 1.00 C ATOM 567 C ALA A 41 58.411 -4.969 -9.303 1.00 1.00 C ATOM 568 O ALA A 41 58.623 -3.912 -8.707 1.00 1.00 O ATOM 569 CB ALA A 41 55.996 -4.978 -9.924 1.00 1.00 C ATOM 0 H ALA A 41 56.736 -4.849 -7.225 1.00 1.00 H new ATOM 0 HA ALA A 41 57.192 -6.709 -9.488 1.00 1.00 H new ATOM 0 HB1 ALA A 41 56.284 -4.940 -10.975 1.00 1.00 H new ATOM 0 HB2 ALA A 41 55.058 -5.524 -9.825 1.00 1.00 H new ATOM 0 HB3 ALA A 41 55.868 -3.964 -9.546 1.00 1.00 H new ATOM 575 N ARG A 42 59.291 -5.494 -10.134 1.00 1.00 N ATOM 576 CA ARG A 42 60.556 -4.823 -10.371 1.00 1.00 C ATOM 577 C ARG A 42 61.261 -5.426 -11.578 1.00 1.00 C ATOM 578 O ARG A 42 60.888 -6.495 -12.065 1.00 1.00 O ATOM 579 CB ARG A 42 61.456 -4.930 -9.137 1.00 1.00 C ATOM 580 CG ARG A 42 61.697 -6.401 -8.796 1.00 1.00 C ATOM 581 CD ARG A 42 62.675 -6.488 -7.628 1.00 1.00 C ATOM 582 NE ARG A 42 63.994 -6.023 -8.054 1.00 1.00 N ATOM 583 CZ ARG A 42 64.807 -5.359 -7.232 1.00 1.00 C ATOM 584 NH1 ARG A 42 64.453 -5.127 -5.997 1.00 1.00 N ATOM 585 NH2 ARG A 42 65.968 -4.944 -7.663 1.00 1.00 N ATOM 0 H ARG A 42 59.159 -6.365 -10.647 1.00 1.00 H new ATOM 0 HA ARG A 42 60.353 -3.771 -10.571 1.00 1.00 H new ATOM 0 HB2 ARG A 42 62.406 -4.431 -9.325 1.00 1.00 H new ATOM 0 HB3 ARG A 42 60.991 -4.423 -8.292 1.00 1.00 H new ATOM 0 HG2 ARG A 42 60.756 -6.886 -8.536 1.00 1.00 H new ATOM 0 HG3 ARG A 42 62.098 -6.927 -9.662 1.00 1.00 H new ATOM 0 HD2 ARG A 42 62.317 -5.883 -6.795 1.00 1.00 H new ATOM 0 HD3 ARG A 42 62.739 -7.516 -7.271 1.00 1.00 H new ATOM 0 HE ARG A 42 64.301 -6.212 -9.008 1.00 1.00 H new ATOM 0 HH11 ARG A 42 63.549 -5.454 -5.655 1.00 1.00 H new ATOM 0 HH12 ARG A 42 65.080 -4.618 -5.374 1.00 1.00 H new ATOM 0 HH21 ARG A 42 66.250 -5.128 -8.626 1.00 1.00 H new ATOM 0 HH22 ARG A 42 66.592 -4.436 -7.037 1.00 1.00 H new ATOM 599 N ARG A 43 62.275 -4.728 -12.060 1.00 1.00 N ATOM 600 CA ARG A 43 63.027 -5.206 -13.218 1.00 1.00 C ATOM 601 C ARG A 43 63.702 -6.555 -12.884 1.00 1.00 C ATOM 602 O ARG A 43 64.671 -6.967 -13.521 1.00 1.00 O ATOM 603 CB ARG A 43 64.062 -4.127 -13.646 1.00 1.00 C ATOM 604 CG ARG A 43 64.790 -4.468 -14.977 1.00 1.00 C ATOM 605 CD ARG A 43 63.794 -4.618 -16.142 1.00 1.00 C ATOM 606 NE ARG A 43 64.494 -4.980 -17.375 1.00 1.00 N ATOM 607 CZ ARG A 43 63.907 -5.741 -18.307 1.00 1.00 C ATOM 608 NH1 ARG A 43 62.681 -6.159 -18.134 1.00 1.00 N ATOM 609 NH2 ARG A 43 64.554 -6.069 -19.390 1.00 1.00 N ATOM 0 H ARG A 43 62.597 -3.839 -11.677 1.00 1.00 H new ATOM 0 HA ARG A 43 62.354 -5.375 -14.058 1.00 1.00 H new ATOM 0 HB2 ARG A 43 63.554 -3.168 -13.753 1.00 1.00 H new ATOM 0 HB3 ARG A 43 64.802 -4.009 -12.855 1.00 1.00 H new ATOM 0 HG2 ARG A 43 65.510 -3.683 -15.211 1.00 1.00 H new ATOM 0 HG3 ARG A 43 65.354 -5.393 -14.858 1.00 1.00 H new ATOM 0 HD2 ARG A 43 63.055 -5.382 -15.900 1.00 1.00 H new ATOM 0 HD3 ARG A 43 63.252 -3.684 -16.286 1.00 1.00 H new ATOM 0 HE ARG A 43 65.446 -4.647 -17.527 1.00 1.00 H new ATOM 0 HH11 ARG A 43 62.170 -5.905 -17.288 1.00 1.00 H new ATOM 0 HH12 ARG A 43 62.235 -6.739 -18.845 1.00 1.00 H new ATOM 0 HH21 ARG A 43 65.511 -5.746 -19.530 1.00 1.00 H new ATOM 0 HH22 ARG A 43 64.103 -6.649 -20.098 1.00 1.00 H new ATOM 623 N GLY A 44 63.158 -7.260 -11.887 1.00 1.00 N ATOM 624 CA GLY A 44 63.676 -8.562 -11.471 1.00 1.00 C ATOM 625 C GLY A 44 65.061 -8.418 -10.859 1.00 1.00 C ATOM 626 O GLY A 44 65.462 -9.197 -9.996 1.00 1.00 O ATOM 0 H GLY A 44 62.351 -6.944 -11.350 1.00 1.00 H new ATOM 0 HA2 GLY A 44 62.998 -9.014 -10.747 1.00 1.00 H new ATOM 0 HA3 GLY A 44 63.720 -9.233 -12.329 1.00 1.00 H new ATOM 630 N PHE A 45 65.783 -7.418 -11.337 1.00 1.00 N ATOM 631 CA PHE A 45 67.128 -7.146 -10.881 1.00 1.00 C ATOM 632 C PHE A 45 67.545 -5.758 -11.366 1.00 1.00 C ATOM 633 O PHE A 45 66.814 -5.128 -12.133 1.00 1.00 O ATOM 634 CB PHE A 45 68.096 -8.209 -11.457 1.00 1.00 C ATOM 635 CG PHE A 45 68.802 -7.655 -12.683 1.00 1.00 C ATOM 636 CD1 PHE A 45 68.136 -7.596 -13.913 1.00 1.00 C ATOM 637 CD2 PHE A 45 70.101 -7.149 -12.564 1.00 1.00 C ATOM 638 CE1 PHE A 45 68.775 -7.038 -15.027 1.00 1.00 C ATOM 639 CE2 PHE A 45 70.737 -6.584 -13.674 1.00 1.00 C ATOM 640 CZ PHE A 45 70.075 -6.530 -14.907 1.00 1.00 C ATOM 0 H PHE A 45 65.449 -6.773 -12.053 1.00 1.00 H new ATOM 0 HA PHE A 45 67.163 -7.183 -9.792 1.00 1.00 H new ATOM 0 HB2 PHE A 45 68.829 -8.493 -10.702 1.00 1.00 H new ATOM 0 HB3 PHE A 45 67.544 -9.111 -11.721 1.00 1.00 H new ATOM 0 HD1 PHE A 45 67.131 -7.980 -14.003 1.00 1.00 H new ATOM 0 HD2 PHE A 45 70.613 -7.195 -11.614 1.00 1.00 H new ATOM 0 HE1 PHE A 45 68.266 -6.999 -15.979 1.00 1.00 H new ATOM 0 HE2 PHE A 45 71.738 -6.190 -13.580 1.00 1.00 H new ATOM 0 HZ PHE A 45 70.567 -6.097 -15.765 1.00 1.00 H new ATOM 650 N PHE A 46 68.718 -5.327 -10.888 1.00 1.00 N ATOM 651 CA PHE A 46 69.323 -4.020 -11.229 1.00 1.00 C ATOM 652 C PHE A 46 69.289 -3.113 -10.012 1.00 1.00 C ATOM 653 O PHE A 46 68.226 -2.628 -9.633 1.00 1.00 O ATOM 654 CB PHE A 46 68.615 -3.353 -12.431 1.00 1.00 C ATOM 655 CG PHE A 46 69.478 -2.264 -13.046 1.00 1.00 C ATOM 656 CD1 PHE A 46 69.706 -1.064 -12.360 1.00 1.00 C ATOM 657 CD2 PHE A 46 70.037 -2.456 -14.322 1.00 1.00 C ATOM 658 CE1 PHE A 46 70.490 -0.063 -12.947 1.00 1.00 C ATOM 659 CE2 PHE A 46 70.817 -1.453 -14.907 1.00 1.00 C ATOM 660 CZ PHE A 46 71.045 -0.257 -14.218 1.00 1.00 C ATOM 0 H PHE A 46 69.286 -5.878 -10.245 1.00 1.00 H new ATOM 0 HA PHE A 46 70.358 -4.190 -11.525 1.00 1.00 H new ATOM 0 HB2 PHE A 46 68.385 -4.107 -13.184 1.00 1.00 H new ATOM 0 HB3 PHE A 46 67.666 -2.927 -12.106 1.00 1.00 H new ATOM 0 HD1 PHE A 46 69.278 -0.911 -11.380 1.00 1.00 H new ATOM 0 HD2 PHE A 46 69.864 -3.381 -14.852 1.00 1.00 H new ATOM 0 HE1 PHE A 46 70.667 0.862 -12.418 1.00 1.00 H new ATOM 0 HE2 PHE A 46 71.242 -1.602 -15.889 1.00 1.00 H new ATOM 0 HZ PHE A 46 71.650 0.517 -14.667 1.00 1.00 H new ATOM 670 N ARG A 47 70.480 -2.922 -9.417 1.00 1.00 N ATOM 671 CA ARG A 47 70.692 -2.090 -8.212 1.00 1.00 C ATOM 672 C ARG A 47 70.849 -2.961 -6.980 1.00 1.00 C ATOM 673 O ARG A 47 70.293 -4.049 -6.914 1.00 1.00 O ATOM 674 CB ARG A 47 69.574 -1.033 -7.955 1.00 1.00 C ATOM 675 CG ARG A 47 68.479 -1.540 -6.965 1.00 1.00 C ATOM 676 CD ARG A 47 67.596 -0.376 -6.579 1.00 1.00 C ATOM 677 NE ARG A 47 68.434 0.664 -5.998 1.00 1.00 N ATOM 678 CZ ARG A 47 68.952 0.555 -4.777 1.00 1.00 C ATOM 679 NH1 ARG A 47 68.683 -0.479 -4.031 1.00 1.00 N ATOM 680 NH2 ARG A 47 69.741 1.491 -4.328 1.00 1.00 N ATOM 0 H ARG A 47 71.339 -3.348 -9.764 1.00 1.00 H new ATOM 0 HA ARG A 47 71.609 -1.534 -8.409 1.00 1.00 H new ATOM 0 HB2 ARG A 47 70.024 -0.124 -7.557 1.00 1.00 H new ATOM 0 HB3 ARG A 47 69.106 -0.768 -8.903 1.00 1.00 H new ATOM 0 HG2 ARG A 47 67.885 -2.327 -7.430 1.00 1.00 H new ATOM 0 HG3 ARG A 47 68.943 -1.972 -6.078 1.00 1.00 H new ATOM 0 HD2 ARG A 47 67.069 0.006 -7.453 1.00 1.00 H new ATOM 0 HD3 ARG A 47 66.838 -0.696 -5.864 1.00 1.00 H new ATOM 0 HE ARG A 47 68.630 1.503 -6.544 1.00 1.00 H new ATOM 0 HH11 ARG A 47 68.070 -1.215 -4.381 1.00 1.00 H new ATOM 0 HH12 ARG A 47 69.086 -0.552 -3.097 1.00 1.00 H new ATOM 0 HH21 ARG A 47 69.957 2.299 -4.912 1.00 1.00 H new ATOM 0 HH22 ARG A 47 70.142 1.415 -3.393 1.00 1.00 H new ATOM 694 N CYS A 48 71.609 -2.463 -6.006 1.00 1.00 N ATOM 695 CA CYS A 48 71.826 -3.201 -4.767 1.00 1.00 C ATOM 696 C CYS A 48 72.499 -4.508 -5.107 1.00 1.00 C ATOM 697 O CYS A 48 71.909 -5.570 -4.974 1.00 1.00 O ATOM 698 CB CYS A 48 70.482 -3.463 -4.061 1.00 1.00 C ATOM 699 SG CYS A 48 70.767 -4.168 -2.414 1.00 1.00 S ATOM 0 H CYS A 48 72.080 -1.560 -6.051 1.00 1.00 H new ATOM 0 HA CYS A 48 72.455 -2.621 -4.092 1.00 1.00 H new ATOM 0 HB2 CYS A 48 69.921 -2.533 -3.974 1.00 1.00 H new ATOM 0 HB3 CYS A 48 69.877 -4.146 -4.657 1.00 1.00 H new ATOM 0 HG CYS A 48 69.625 -4.382 -1.830 1.00 1.00 H new ATOM 704 N ASN A 49 73.740 -4.418 -5.568 1.00 1.00 N ATOM 705 CA ASN A 49 74.492 -5.597 -5.956 1.00 1.00 C ATOM 706 C ASN A 49 75.875 -5.568 -5.309 1.00 1.00 C ATOM 707 O ASN A 49 76.339 -4.518 -4.879 1.00 1.00 O ATOM 708 CB ASN A 49 74.615 -5.623 -7.500 1.00 1.00 C ATOM 709 CG ASN A 49 73.653 -6.652 -8.103 1.00 1.00 C ATOM 710 OD1 ASN A 49 73.960 -7.272 -9.120 1.00 1.00 O ATOM 711 ND2 ASN A 49 72.500 -6.869 -7.525 1.00 1.00 N ATOM 0 H ASN A 49 74.244 -3.539 -5.681 1.00 1.00 H new ATOM 0 HA ASN A 49 73.977 -6.496 -5.619 1.00 1.00 H new ATOM 0 HB2 ASN A 49 74.397 -4.634 -7.904 1.00 1.00 H new ATOM 0 HB3 ASN A 49 75.639 -5.865 -7.784 1.00 1.00 H new ATOM 0 HD21 ASN A 49 71.854 -7.553 -7.918 1.00 1.00 H new ATOM 0 HD22 ASN A 49 72.247 -6.354 -6.682 1.00 1.00 H new ATOM 718 N PRO A 50 76.524 -6.702 -5.237 1.00 1.00 N ATOM 719 CA PRO A 50 77.890 -6.823 -4.643 1.00 1.00 C ATOM 720 C PRO A 50 78.931 -5.995 -5.415 1.00 1.00 C ATOM 721 O PRO A 50 79.969 -6.500 -5.800 1.00 1.00 O ATOM 722 CB PRO A 50 78.187 -8.340 -4.718 1.00 1.00 C ATOM 723 CG PRO A 50 77.226 -8.898 -5.727 1.00 1.00 C ATOM 724 CD PRO A 50 76.002 -7.997 -5.703 1.00 1.00 C ATOM 0 HA PRO A 50 77.939 -6.436 -3.625 1.00 1.00 H new ATOM 0 HB2 PRO A 50 79.219 -8.522 -5.019 1.00 1.00 H new ATOM 0 HB3 PRO A 50 78.051 -8.813 -3.746 1.00 1.00 H new ATOM 0 HG2 PRO A 50 77.674 -8.917 -6.720 1.00 1.00 H new ATOM 0 HG3 PRO A 50 76.957 -9.925 -5.479 1.00 1.00 H new ATOM 0 HD2 PRO A 50 75.549 -7.913 -6.691 1.00 1.00 H new ATOM 0 HD3 PRO A 50 75.235 -8.383 -5.032 1.00 1.00 H new ATOM 732 N GLU A 51 78.630 -4.710 -5.607 1.00 1.00 N ATOM 733 CA GLU A 51 79.522 -3.782 -6.319 1.00 1.00 C ATOM 734 C GLU A 51 80.374 -4.491 -7.383 1.00 1.00 C ATOM 735 O GLU A 51 81.571 -4.225 -7.511 1.00 1.00 O ATOM 736 CB GLU A 51 80.433 -3.039 -5.332 1.00 1.00 C ATOM 737 CG GLU A 51 81.114 -4.029 -4.385 1.00 1.00 C ATOM 738 CD GLU A 51 80.135 -4.491 -3.311 1.00 1.00 C ATOM 739 OE1 GLU A 51 79.401 -3.657 -2.807 1.00 1.00 O ATOM 740 OE2 GLU A 51 80.130 -5.673 -3.012 1.00 1.00 O ATOM 0 H GLU A 51 77.766 -4.281 -5.277 1.00 1.00 H new ATOM 0 HA GLU A 51 78.882 -3.064 -6.832 1.00 1.00 H new ATOM 0 HB2 GLU A 51 81.186 -2.472 -5.879 1.00 1.00 H new ATOM 0 HB3 GLU A 51 79.848 -2.320 -4.758 1.00 1.00 H new ATOM 0 HG2 GLU A 51 81.480 -4.888 -4.947 1.00 1.00 H new ATOM 0 HG3 GLU A 51 81.981 -3.560 -3.919 1.00 1.00 H new ATOM 747 N ARG A 52 79.739 -5.373 -8.159 1.00 1.00 N ATOM 748 CA ARG A 52 80.421 -6.111 -9.240 1.00 1.00 C ATOM 749 C ARG A 52 79.717 -5.851 -10.570 1.00 1.00 C ATOM 750 O ARG A 52 78.495 -5.682 -10.605 1.00 1.00 O ATOM 751 CB ARG A 52 80.414 -7.631 -8.954 1.00 1.00 C ATOM 752 CG ARG A 52 81.514 -7.998 -7.944 1.00 1.00 C ATOM 753 CD ARG A 52 81.421 -9.481 -7.568 1.00 1.00 C ATOM 754 NE ARG A 52 80.093 -9.842 -7.091 1.00 1.00 N ATOM 755 CZ ARG A 52 79.808 -11.118 -6.829 1.00 1.00 C ATOM 756 NH1 ARG A 52 80.757 -12.011 -6.873 1.00 1.00 N ATOM 757 NH2 ARG A 52 78.593 -11.481 -6.529 1.00 1.00 N ATOM 0 H ARG A 52 78.749 -5.598 -8.063 1.00 1.00 H new ATOM 0 HA ARG A 52 81.453 -5.763 -9.292 1.00 1.00 H new ATOM 0 HB2 ARG A 52 79.441 -7.928 -8.564 1.00 1.00 H new ATOM 0 HB3 ARG A 52 80.567 -8.182 -9.882 1.00 1.00 H new ATOM 0 HG2 ARG A 52 82.494 -7.785 -8.371 1.00 1.00 H new ATOM 0 HG3 ARG A 52 81.415 -7.383 -7.050 1.00 1.00 H new ATOM 0 HD2 ARG A 52 81.673 -10.091 -8.435 1.00 1.00 H new ATOM 0 HD3 ARG A 52 82.157 -9.706 -6.796 1.00 1.00 H new ATOM 0 HE ARG A 52 79.384 -9.121 -6.958 1.00 1.00 H new ATOM 0 HH11 ARG A 52 81.710 -11.732 -7.107 1.00 1.00 H new ATOM 0 HH12 ARG A 52 80.547 -12.989 -6.674 1.00 1.00 H new ATOM 0 HH21 ARG A 52 77.847 -10.786 -6.493 1.00 1.00 H new ATOM 0 HH22 ARG A 52 78.388 -12.460 -6.331 1.00 1.00 H new ATOM 771 N ILE A 53 80.492 -5.719 -11.647 1.00 1.00 N ATOM 772 CA ILE A 53 79.936 -5.360 -12.951 1.00 1.00 C ATOM 773 C ILE A 53 78.577 -6.011 -13.214 1.00 1.00 C ATOM 774 O ILE A 53 78.335 -7.182 -12.926 1.00 1.00 O ATOM 775 CB ILE A 53 80.942 -5.797 -14.020 1.00 1.00 C ATOM 776 CG1 ILE A 53 80.490 -5.372 -15.425 1.00 1.00 C ATOM 777 CG2 ILE A 53 81.084 -7.315 -13.980 1.00 1.00 C ATOM 778 CD1 ILE A 53 80.490 -3.844 -15.556 1.00 1.00 C ATOM 0 H ILE A 53 81.503 -5.855 -11.642 1.00 1.00 H new ATOM 0 HA ILE A 53 79.769 -4.283 -12.976 1.00 1.00 H new ATOM 0 HB ILE A 53 81.896 -5.315 -13.808 1.00 1.00 H new ATOM 0 HG12 ILE A 53 81.154 -5.806 -16.173 1.00 1.00 H new ATOM 0 HG13 ILE A 53 79.490 -5.759 -15.623 1.00 1.00 H new ATOM 0 HG21 ILE A 53 81.799 -7.634 -14.739 1.00 1.00 H new ATOM 0 HG22 ILE A 53 81.438 -7.621 -12.996 1.00 1.00 H new ATOM 0 HG23 ILE A 53 80.116 -7.776 -14.177 1.00 1.00 H new ATOM 0 HD11 ILE A 53 80.167 -3.565 -16.559 1.00 1.00 H new ATOM 0 HD12 ILE A 53 79.807 -3.416 -14.822 1.00 1.00 H new ATOM 0 HD13 ILE A 53 81.496 -3.464 -15.380 1.00 1.00 H new ATOM 790 N GLN A 54 77.690 -5.156 -13.738 1.00 1.00 N ATOM 791 CA GLN A 54 76.319 -5.558 -14.024 1.00 1.00 C ATOM 792 C GLN A 54 76.131 -6.069 -15.447 1.00 1.00 C ATOM 793 O GLN A 54 75.558 -5.383 -16.290 1.00 1.00 O ATOM 794 CB GLN A 54 75.393 -4.351 -13.806 1.00 1.00 C ATOM 795 CG GLN A 54 75.554 -3.779 -12.371 1.00 1.00 C ATOM 796 CD GLN A 54 76.422 -2.518 -12.376 1.00 1.00 C ATOM 797 OE1 GLN A 54 77.465 -2.476 -11.725 1.00 1.00 O ATOM 798 NE2 GLN A 54 76.044 -1.481 -13.076 1.00 1.00 N ATOM 0 H GLN A 54 77.902 -4.186 -13.970 1.00 1.00 H new ATOM 0 HA GLN A 54 76.076 -6.379 -13.350 1.00 1.00 H new ATOM 0 HB2 GLN A 54 75.621 -3.576 -14.538 1.00 1.00 H new ATOM 0 HB3 GLN A 54 74.357 -4.649 -13.969 1.00 1.00 H new ATOM 0 HG2 GLN A 54 74.573 -3.548 -11.956 1.00 1.00 H new ATOM 0 HG3 GLN A 54 76.004 -4.532 -11.724 1.00 1.00 H new ATOM 0 HE21 GLN A 54 75.179 -1.518 -13.615 1.00 1.00 H new ATOM 0 HE22 GLN A 54 76.614 -0.635 -13.083 1.00 1.00 H new ATOM 807 N ILE A 55 76.558 -7.306 -15.680 1.00 1.00 N ATOM 808 CA ILE A 55 76.390 -7.971 -16.976 1.00 1.00 C ATOM 809 C ILE A 55 76.123 -9.453 -16.728 1.00 1.00 C ATOM 810 O ILE A 55 76.578 -9.991 -15.717 1.00 1.00 O ATOM 811 CB ILE A 55 77.633 -7.769 -17.870 1.00 1.00 C ATOM 812 CG1 ILE A 55 77.266 -8.037 -19.350 1.00 1.00 C ATOM 813 CG2 ILE A 55 78.759 -8.718 -17.439 1.00 1.00 C ATOM 814 CD1 ILE A 55 76.658 -6.781 -19.995 1.00 1.00 C ATOM 0 H ILE A 55 77.030 -7.878 -14.980 1.00 1.00 H new ATOM 0 HA ILE A 55 75.545 -7.532 -17.507 1.00 1.00 H new ATOM 0 HB ILE A 55 77.977 -6.740 -17.763 1.00 1.00 H new ATOM 0 HG12 ILE A 55 78.156 -8.340 -19.901 1.00 1.00 H new ATOM 0 HG13 ILE A 55 76.557 -8.862 -19.410 1.00 1.00 H new ATOM 0 HG21 ILE A 55 79.629 -8.565 -18.078 1.00 1.00 H new ATOM 0 HG22 ILE A 55 79.029 -8.515 -16.403 1.00 1.00 H new ATOM 0 HG23 ILE A 55 78.420 -9.750 -17.530 1.00 1.00 H new ATOM 0 HD11 ILE A 55 76.407 -6.991 -21.035 1.00 1.00 H new ATOM 0 HD12 ILE A 55 75.756 -6.495 -19.455 1.00 1.00 H new ATOM 0 HD13 ILE A 55 77.380 -5.965 -19.953 1.00 1.00 H new ATOM 826 N GLY A 56 75.378 -10.116 -17.612 1.00 1.00 N ATOM 827 CA GLY A 56 75.068 -11.537 -17.420 1.00 1.00 C ATOM 828 C GLY A 56 73.624 -11.684 -16.946 1.00 1.00 C ATOM 829 O GLY A 56 73.157 -12.786 -16.650 1.00 1.00 O ATOM 0 H GLY A 56 74.982 -9.702 -18.456 1.00 1.00 H new ATOM 0 HA2 GLY A 56 75.213 -12.081 -18.353 1.00 1.00 H new ATOM 0 HA3 GLY A 56 75.748 -11.973 -16.688 1.00 1.00 H new ATOM 833 N ASP A 57 72.937 -10.543 -16.850 1.00 1.00 N ATOM 834 CA ASP A 57 71.556 -10.522 -16.384 1.00 1.00 C ATOM 835 C ASP A 57 70.537 -10.768 -17.510 1.00 1.00 C ATOM 836 O ASP A 57 70.268 -9.898 -18.340 1.00 1.00 O ATOM 837 CB ASP A 57 71.274 -9.180 -15.728 1.00 1.00 C ATOM 838 CG ASP A 57 72.085 -9.045 -14.444 1.00 1.00 C ATOM 839 OD1 ASP A 57 71.694 -9.641 -13.455 1.00 1.00 O ATOM 840 OD2 ASP A 57 73.087 -8.346 -14.470 1.00 1.00 O ATOM 0 H ASP A 57 73.316 -9.627 -17.089 1.00 1.00 H new ATOM 0 HA ASP A 57 71.441 -11.338 -15.670 1.00 1.00 H new ATOM 0 HB2 ASP A 57 71.526 -8.371 -16.414 1.00 1.00 H new ATOM 0 HB3 ASP A 57 70.210 -9.091 -15.507 1.00 1.00 H new ATOM 845 N TRP A 58 69.956 -11.970 -17.475 1.00 1.00 N ATOM 846 CA TRP A 58 68.924 -12.385 -18.435 1.00 1.00 C ATOM 847 C TRP A 58 67.593 -11.796 -17.991 1.00 1.00 C ATOM 848 O TRP A 58 67.541 -11.151 -16.944 1.00 1.00 O ATOM 849 CB TRP A 58 68.872 -13.915 -18.599 1.00 1.00 C ATOM 850 CG TRP A 58 69.526 -14.335 -19.890 1.00 1.00 C ATOM 851 CD1 TRP A 58 69.264 -13.807 -21.111 1.00 1.00 C ATOM 852 CD2 TRP A 58 70.539 -15.361 -20.103 1.00 1.00 C ATOM 853 NE1 TRP A 58 70.056 -14.435 -22.052 1.00 1.00 N ATOM 854 CE2 TRP A 58 70.858 -15.401 -21.484 1.00 1.00 C ATOM 855 CE3 TRP A 58 71.209 -16.250 -19.244 1.00 1.00 C ATOM 856 CZ2 TRP A 58 71.802 -16.289 -21.991 1.00 1.00 C ATOM 857 CZ3 TRP A 58 72.163 -17.147 -19.753 1.00 1.00 C ATOM 858 CH2 TRP A 58 72.457 -17.165 -21.124 1.00 1.00 C ATOM 0 H TRP A 58 70.186 -12.683 -16.783 1.00 1.00 H new ATOM 0 HA TRP A 58 69.168 -12.002 -19.426 1.00 1.00 H new ATOM 0 HB2 TRP A 58 69.375 -14.393 -17.758 1.00 1.00 H new ATOM 0 HB3 TRP A 58 67.836 -14.252 -18.584 1.00 1.00 H new ATOM 0 HD1 TRP A 58 68.551 -13.022 -21.315 1.00 1.00 H new ATOM 0 HE1 TRP A 58 70.048 -14.211 -23.047 1.00 1.00 H new ATOM 0 HE3 TRP A 58 70.989 -16.243 -18.187 1.00 1.00 H new ATOM 0 HZ2 TRP A 58 72.026 -16.300 -23.047 1.00 1.00 H new ATOM 0 HZ3 TRP A 58 72.672 -17.826 -19.085 1.00 1.00 H new ATOM 0 HH2 TRP A 58 73.191 -17.857 -21.509 1.00 1.00 H new ATOM 869 N ARG A 59 66.495 -12.020 -18.734 1.00 1.00 N ATOM 870 CA ARG A 59 65.177 -11.509 -18.337 1.00 1.00 C ATOM 871 C ARG A 59 64.330 -12.631 -17.697 1.00 1.00 C ATOM 872 O ARG A 59 63.798 -12.488 -16.595 1.00 1.00 O ATOM 873 CB ARG A 59 64.463 -10.958 -19.590 1.00 1.00 C ATOM 874 CG ARG A 59 65.480 -10.206 -20.513 1.00 1.00 C ATOM 875 CD ARG A 59 65.728 -10.983 -21.823 1.00 1.00 C ATOM 876 NE ARG A 59 66.096 -12.372 -21.553 1.00 1.00 N ATOM 877 CZ ARG A 59 66.300 -13.235 -22.549 1.00 1.00 C ATOM 878 NH1 ARG A 59 66.196 -12.842 -23.788 1.00 1.00 N ATOM 879 NH2 ARG A 59 66.626 -14.474 -22.287 1.00 1.00 N ATOM 0 H ARG A 59 66.496 -12.548 -19.607 1.00 1.00 H new ATOM 0 HA ARG A 59 65.302 -10.716 -17.599 1.00 1.00 H new ATOM 0 HB2 ARG A 59 63.999 -11.776 -20.141 1.00 1.00 H new ATOM 0 HB3 ARG A 59 63.663 -10.280 -19.292 1.00 1.00 H new ATOM 0 HG2 ARG A 59 65.098 -9.212 -20.744 1.00 1.00 H new ATOM 0 HG3 ARG A 59 66.423 -10.070 -19.984 1.00 1.00 H new ATOM 0 HD2 ARG A 59 64.830 -10.955 -22.441 1.00 1.00 H new ATOM 0 HD3 ARG A 59 66.521 -10.498 -22.392 1.00 1.00 H new ATOM 0 HE ARG A 59 66.198 -12.686 -20.588 1.00 1.00 H new ATOM 0 HH11 ARG A 59 65.958 -11.872 -23.997 1.00 1.00 H new ATOM 0 HH12 ARG A 59 66.353 -13.504 -24.548 1.00 1.00 H new ATOM 0 HH21 ARG A 59 66.725 -14.782 -21.320 1.00 1.00 H new ATOM 0 HH22 ARG A 59 66.782 -15.133 -23.050 1.00 1.00 H new ATOM 893 N TYR A 60 64.202 -13.734 -18.454 1.00 1.00 N ATOM 894 CA TYR A 60 63.419 -14.930 -18.063 1.00 1.00 C ATOM 895 C TYR A 60 64.200 -15.810 -17.078 1.00 1.00 C ATOM 896 O TYR A 60 63.656 -16.710 -16.410 1.00 1.00 O ATOM 897 CB TYR A 60 63.057 -15.755 -19.330 1.00 1.00 C ATOM 898 CG TYR A 60 64.033 -16.913 -19.523 1.00 1.00 C ATOM 899 CD1 TYR A 60 65.320 -16.679 -20.027 1.00 1.00 C ATOM 900 CD2 TYR A 60 63.645 -18.215 -19.180 1.00 1.00 C ATOM 901 CE1 TYR A 60 66.214 -17.748 -20.184 1.00 1.00 C ATOM 902 CE2 TYR A 60 64.539 -19.281 -19.341 1.00 1.00 C ATOM 903 CZ TYR A 60 65.823 -19.047 -19.842 1.00 1.00 C ATOM 904 OH TYR A 60 66.706 -20.097 -19.997 1.00 1.00 O ATOM 0 H TYR A 60 64.644 -13.826 -19.369 1.00 1.00 H new ATOM 0 HA TYR A 60 62.508 -14.593 -17.568 1.00 1.00 H new ATOM 0 HB2 TYR A 60 62.042 -16.141 -19.240 1.00 1.00 H new ATOM 0 HB3 TYR A 60 63.075 -15.109 -20.207 1.00 1.00 H new ATOM 0 HD1 TYR A 60 65.623 -15.677 -20.294 1.00 1.00 H new ATOM 0 HD2 TYR A 60 62.654 -18.397 -18.791 1.00 1.00 H new ATOM 0 HE1 TYR A 60 67.207 -17.568 -20.570 1.00 1.00 H new ATOM 0 HE2 TYR A 60 64.236 -20.284 -19.078 1.00 1.00 H new ATOM 0 HH TYR A 60 66.276 -20.930 -19.712 1.00 1.00 H new ATOM 914 N GLU A 61 65.467 -15.527 -16.968 1.00 1.00 N ATOM 915 CA GLU A 61 66.308 -16.259 -16.069 1.00 1.00 C ATOM 916 C GLU A 61 65.911 -15.911 -14.651 1.00 1.00 C ATOM 917 O GLU A 61 66.332 -16.533 -13.693 1.00 1.00 O ATOM 918 CB GLU A 61 67.771 -15.901 -16.319 1.00 1.00 C ATOM 919 CG GLU A 61 68.695 -16.713 -15.410 1.00 1.00 C ATOM 920 CD GLU A 61 70.139 -16.280 -15.632 1.00 1.00 C ATOM 921 OE1 GLU A 61 70.391 -15.086 -15.603 1.00 1.00 O ATOM 922 OE2 GLU A 61 70.973 -17.147 -15.829 1.00 1.00 O ATOM 0 H GLU A 61 65.940 -14.791 -17.493 1.00 1.00 H new ATOM 0 HA GLU A 61 66.189 -17.331 -16.229 1.00 1.00 H new ATOM 0 HB2 GLU A 61 68.023 -16.090 -17.362 1.00 1.00 H new ATOM 0 HB3 GLU A 61 67.924 -14.836 -16.142 1.00 1.00 H new ATOM 0 HG2 GLU A 61 68.417 -16.566 -14.366 1.00 1.00 H new ATOM 0 HG3 GLU A 61 68.587 -17.777 -15.621 1.00 1.00 H new ATOM 929 N VAL A 62 65.135 -14.856 -14.516 1.00 1.00 N ATOM 930 CA VAL A 62 64.762 -14.369 -13.183 1.00 1.00 C ATOM 931 C VAL A 62 64.366 -15.519 -12.292 1.00 1.00 C ATOM 932 O VAL A 62 64.871 -15.637 -11.185 1.00 1.00 O ATOM 933 CB VAL A 62 63.605 -13.350 -13.239 1.00 1.00 C ATOM 934 CG1 VAL A 62 64.097 -12.011 -13.824 1.00 1.00 C ATOM 935 CG2 VAL A 62 62.447 -13.907 -14.084 1.00 1.00 C ATOM 0 H VAL A 62 64.750 -14.319 -15.293 1.00 1.00 H new ATOM 0 HA VAL A 62 65.639 -13.867 -12.774 1.00 1.00 H new ATOM 0 HB VAL A 62 63.246 -13.175 -12.225 1.00 1.00 H new ATOM 0 HG11 VAL A 62 63.269 -11.302 -13.857 1.00 1.00 H new ATOM 0 HG12 VAL A 62 64.893 -11.610 -13.196 1.00 1.00 H new ATOM 0 HG13 VAL A 62 64.477 -12.172 -14.833 1.00 1.00 H new ATOM 0 HG21 VAL A 62 61.637 -13.179 -14.116 1.00 1.00 H new ATOM 0 HG22 VAL A 62 62.798 -14.104 -15.097 1.00 1.00 H new ATOM 0 HG23 VAL A 62 62.085 -14.834 -13.639 1.00 1.00 H new ATOM 945 N ALA A 63 63.465 -16.367 -12.736 1.00 1.00 N ATOM 946 CA ALA A 63 63.071 -17.465 -11.921 1.00 1.00 C ATOM 947 C ALA A 63 64.235 -18.414 -11.778 1.00 1.00 C ATOM 948 O ALA A 63 64.589 -18.801 -10.669 1.00 1.00 O ATOM 949 CB ALA A 63 61.896 -18.178 -12.587 1.00 1.00 C ATOM 0 H ALA A 63 63.005 -16.309 -13.644 1.00 1.00 H new ATOM 0 HA ALA A 63 62.770 -17.115 -10.934 1.00 1.00 H new ATOM 0 HB1 ALA A 63 61.586 -19.022 -11.971 1.00 1.00 H new ATOM 0 HB2 ALA A 63 61.063 -17.483 -12.697 1.00 1.00 H new ATOM 0 HB3 ALA A 63 62.199 -18.539 -13.570 1.00 1.00 H new ATOM 955 N HIS A 64 64.871 -18.728 -12.911 1.00 1.00 N ATOM 956 CA HIS A 64 66.026 -19.639 -12.885 1.00 1.00 C ATOM 957 C HIS A 64 67.084 -19.133 -11.884 1.00 1.00 C ATOM 958 O HIS A 64 67.396 -19.816 -10.905 1.00 1.00 O ATOM 959 CB HIS A 64 66.613 -19.744 -14.312 1.00 1.00 C ATOM 960 CG HIS A 64 66.337 -21.095 -14.937 1.00 1.00 C ATOM 961 ND1 HIS A 64 67.356 -21.940 -15.348 1.00 1.00 N ATOM 962 CD2 HIS A 64 65.164 -21.738 -15.271 1.00 1.00 C ATOM 963 CE1 HIS A 64 66.787 -23.027 -15.904 1.00 1.00 C ATOM 964 NE2 HIS A 64 65.452 -22.954 -15.882 1.00 1.00 N ATOM 0 H HIS A 64 64.617 -18.378 -13.835 1.00 1.00 H new ATOM 0 HA HIS A 64 65.710 -20.629 -12.557 1.00 1.00 H new ATOM 0 HB2 HIS A 64 66.187 -18.960 -14.938 1.00 1.00 H new ATOM 0 HB3 HIS A 64 67.689 -19.574 -14.276 1.00 1.00 H new ATOM 0 HD2 HIS A 64 64.171 -21.355 -15.086 1.00 1.00 H new ATOM 0 HE1 HIS A 64 67.342 -23.857 -16.317 1.00 1.00 H new ATOM 0 HE2 HIS A 64 64.788 -23.642 -16.237 1.00 1.00 H new ATOM 972 N ASP A 65 67.595 -17.924 -12.100 1.00 1.00 N ATOM 973 CA ASP A 65 68.568 -17.339 -11.183 1.00 1.00 C ATOM 974 C ASP A 65 67.894 -17.079 -9.831 1.00 1.00 C ATOM 975 O ASP A 65 68.359 -17.533 -8.773 1.00 1.00 O ATOM 976 CB ASP A 65 69.129 -16.043 -11.785 1.00 1.00 C ATOM 977 CG ASP A 65 69.892 -15.233 -10.742 1.00 1.00 C ATOM 978 OD1 ASP A 65 69.261 -14.751 -9.816 1.00 1.00 O ATOM 979 OD2 ASP A 65 71.093 -15.098 -10.896 1.00 1.00 O ATOM 0 H ASP A 65 67.354 -17.334 -12.896 1.00 1.00 H new ATOM 0 HA ASP A 65 69.399 -18.027 -11.028 1.00 1.00 H new ATOM 0 HB2 ASP A 65 69.790 -16.283 -12.618 1.00 1.00 H new ATOM 0 HB3 ASP A 65 68.313 -15.444 -12.188 1.00 1.00 H new ATOM 984 N GLY A 66 66.764 -16.386 -9.852 1.00 1.00 N ATOM 985 CA GLY A 66 66.005 -16.109 -8.640 1.00 1.00 C ATOM 986 C GLY A 66 65.476 -17.403 -8.017 1.00 1.00 C ATOM 987 O GLY A 66 64.477 -17.393 -7.300 1.00 1.00 O ATOM 0 H GLY A 66 66.350 -16.003 -10.702 1.00 1.00 H new ATOM 0 HA2 GLY A 66 66.637 -15.587 -7.922 1.00 1.00 H new ATOM 0 HA3 GLY A 66 65.172 -15.446 -8.872 1.00 1.00 H new ATOM 991 N ARG A 67 66.200 -18.490 -8.228 1.00 1.00 N ATOM 992 CA ARG A 67 65.876 -19.771 -7.630 1.00 1.00 C ATOM 993 C ARG A 67 66.360 -19.753 -6.180 1.00 1.00 C ATOM 994 O ARG A 67 66.191 -20.738 -5.468 1.00 1.00 O ATOM 995 CB ARG A 67 66.525 -20.950 -8.374 1.00 1.00 C ATOM 996 CG ARG A 67 65.700 -21.383 -9.584 1.00 1.00 C ATOM 997 CD ARG A 67 64.612 -22.355 -9.147 1.00 1.00 C ATOM 998 NE ARG A 67 65.222 -23.640 -8.828 1.00 1.00 N ATOM 999 CZ ARG A 67 64.647 -24.790 -9.147 1.00 1.00 C ATOM 1000 NH1 ARG A 67 63.472 -24.807 -9.710 1.00 1.00 N ATOM 1001 NH2 ARG A 67 65.258 -25.912 -8.883 1.00 1.00 N ATOM 0 H ARG A 67 67.030 -18.507 -8.820 1.00 1.00 H new ATOM 0 HA ARG A 67 64.797 -19.915 -7.689 1.00 1.00 H new ATOM 0 HB2 ARG A 67 67.526 -20.667 -8.700 1.00 1.00 H new ATOM 0 HB3 ARG A 67 66.638 -21.792 -7.691 1.00 1.00 H new ATOM 0 HG2 ARG A 67 65.251 -20.511 -10.060 1.00 1.00 H new ATOM 0 HG3 ARG A 67 66.345 -21.855 -10.325 1.00 1.00 H new ATOM 0 HD2 ARG A 67 64.084 -21.963 -8.278 1.00 1.00 H new ATOM 0 HD3 ARG A 67 63.874 -22.475 -9.940 1.00 1.00 H new ATOM 0 HE ARG A 67 66.120 -23.654 -8.344 1.00 1.00 H new ATOM 0 HH11 ARG A 67 62.989 -23.931 -9.908 1.00 1.00 H new ATOM 0 HH12 ARG A 67 63.036 -25.696 -9.953 1.00 1.00 H new ATOM 0 HH21 ARG A 67 66.173 -25.901 -8.433 1.00 1.00 H new ATOM 0 HH22 ARG A 67 64.820 -26.801 -9.126 1.00 1.00 H new ATOM 1015 N LEU A 68 67.039 -18.650 -5.781 1.00 1.00 N ATOM 1016 CA LEU A 68 67.604 -18.553 -4.416 1.00 1.00 C ATOM 1017 C LEU A 68 66.649 -19.253 -3.460 1.00 1.00 C ATOM 1018 O LEU A 68 67.041 -19.822 -2.444 1.00 1.00 O ATOM 1019 CB LEU A 68 67.806 -17.089 -3.962 1.00 1.00 C ATOM 1020 CG LEU A 68 66.541 -16.221 -4.250 1.00 1.00 C ATOM 1021 CD1 LEU A 68 65.847 -15.807 -2.939 1.00 1.00 C ATOM 1022 CD2 LEU A 68 66.932 -14.937 -5.005 1.00 1.00 C ATOM 0 H LEU A 68 67.205 -17.834 -6.370 1.00 1.00 H new ATOM 0 HA LEU A 68 68.587 -19.024 -4.416 1.00 1.00 H new ATOM 0 HB2 LEU A 68 68.030 -17.065 -2.895 1.00 1.00 H new ATOM 0 HB3 LEU A 68 68.666 -16.662 -4.478 1.00 1.00 H new ATOM 0 HG LEU A 68 65.863 -16.825 -4.853 1.00 1.00 H new ATOM 0 HD11 LEU A 68 64.969 -15.203 -3.167 1.00 1.00 H new ATOM 0 HD12 LEU A 68 65.542 -16.699 -2.391 1.00 1.00 H new ATOM 0 HD13 LEU A 68 66.538 -15.226 -2.329 1.00 1.00 H new ATOM 0 HD21 LEU A 68 66.039 -14.342 -5.198 1.00 1.00 H new ATOM 0 HD22 LEU A 68 67.630 -14.358 -4.400 1.00 1.00 H new ATOM 0 HD23 LEU A 68 67.404 -15.201 -5.951 1.00 1.00 H new ATOM 1034 N LEU A 69 65.386 -19.241 -3.817 1.00 1.00 N ATOM 1035 CA LEU A 69 64.431 -19.947 -2.976 1.00 1.00 C ATOM 1036 C LEU A 69 64.824 -21.438 -3.005 1.00 1.00 C ATOM 1037 O LEU A 69 65.257 -21.983 -1.994 1.00 1.00 O ATOM 1038 CB LEU A 69 63.019 -19.728 -3.519 1.00 1.00 C ATOM 1039 CG LEU A 69 61.960 -20.320 -2.552 1.00 1.00 C ATOM 1040 CD1 LEU A 69 60.716 -19.426 -2.539 1.00 1.00 C ATOM 1041 CD2 LEU A 69 61.546 -21.726 -3.017 1.00 1.00 C ATOM 0 H LEU A 69 65.003 -18.777 -4.641 1.00 1.00 H new ATOM 0 HA LEU A 69 64.445 -19.582 -1.949 1.00 1.00 H new ATOM 0 HB2 LEU A 69 62.838 -18.662 -3.655 1.00 1.00 H new ATOM 0 HB3 LEU A 69 62.925 -20.195 -4.499 1.00 1.00 H new ATOM 0 HG LEU A 69 62.394 -20.375 -1.554 1.00 1.00 H new ATOM 0 HD11 LEU A 69 59.974 -19.845 -1.859 1.00 1.00 H new ATOM 0 HD12 LEU A 69 60.991 -18.425 -2.205 1.00 1.00 H new ATOM 0 HD13 LEU A 69 60.297 -19.371 -3.544 1.00 1.00 H new ATOM 0 HD21 LEU A 69 60.802 -22.132 -2.331 1.00 1.00 H new ATOM 0 HD22 LEU A 69 61.121 -21.667 -4.019 1.00 1.00 H new ATOM 0 HD23 LEU A 69 62.420 -22.377 -3.031 1.00 1.00 H new ATOM 1053 N ALA A 70 64.727 -22.077 -4.180 1.00 1.00 N ATOM 1054 CA ALA A 70 65.146 -23.479 -4.281 1.00 1.00 C ATOM 1055 C ALA A 70 66.674 -23.477 -4.328 1.00 1.00 C ATOM 1056 O ALA A 70 67.326 -23.859 -3.360 1.00 1.00 O ATOM 1057 CB ALA A 70 64.582 -24.116 -5.553 1.00 1.00 C ATOM 0 H ALA A 70 64.375 -21.663 -5.043 1.00 1.00 H new ATOM 0 HA ALA A 70 64.777 -24.057 -3.434 1.00 1.00 H new ATOM 0 HB1 ALA A 70 64.903 -25.156 -5.612 1.00 1.00 H new ATOM 0 HB2 ALA A 70 63.493 -24.073 -5.530 1.00 1.00 H new ATOM 0 HB3 ALA A 70 64.948 -23.573 -6.425 1.00 1.00 H new ATOM 1063 N ALA A 71 67.232 -23.024 -5.456 1.00 1.00 N ATOM 1064 CA ALA A 71 68.686 -22.914 -5.675 1.00 1.00 C ATOM 1065 C ALA A 71 69.425 -22.307 -4.505 1.00 1.00 C ATOM 1066 O ALA A 71 70.634 -22.098 -4.613 1.00 1.00 O ATOM 1067 CB ALA A 71 69.006 -22.050 -6.892 1.00 1.00 C ATOM 0 H ALA A 71 66.681 -22.718 -6.258 1.00 1.00 H new ATOM 0 HA ALA A 71 69.017 -23.942 -5.820 1.00 1.00 H new ATOM 0 HB1 ALA A 71 70.087 -21.991 -7.023 1.00 1.00 H new ATOM 0 HB2 ALA A 71 68.557 -22.493 -7.781 1.00 1.00 H new ATOM 0 HB3 ALA A 71 68.604 -21.048 -6.743 1.00 1.00 H new ATOM 1073 N HIS A 72 68.715 -21.954 -3.432 1.00 1.00 N ATOM 1074 CA HIS A 72 69.326 -21.285 -2.287 1.00 1.00 C ATOM 1075 C HIS A 72 70.828 -21.540 -2.233 1.00 1.00 C ATOM 1076 O HIS A 72 71.608 -20.598 -2.377 1.00 1.00 O ATOM 1077 CB HIS A 72 68.604 -21.787 -1.000 1.00 1.00 C ATOM 1078 CG HIS A 72 69.579 -22.440 -0.049 1.00 1.00 C ATOM 1079 ND1 HIS A 72 70.699 -21.773 0.415 1.00 1.00 N ATOM 1080 CD2 HIS A 72 69.653 -23.707 0.475 1.00 1.00 C ATOM 1081 CE1 HIS A 72 71.397 -22.632 1.177 1.00 1.00 C ATOM 1082 NE2 HIS A 72 70.804 -23.825 1.247 1.00 1.00 N ATOM 0 H HIS A 72 67.714 -22.122 -3.334 1.00 1.00 H new ATOM 0 HA HIS A 72 69.208 -20.205 -2.375 1.00 1.00 H new ATOM 0 HB2 HIS A 72 68.113 -20.949 -0.504 1.00 1.00 H new ATOM 0 HB3 HIS A 72 67.824 -22.498 -1.271 1.00 1.00 H new ATOM 0 HD1 HIS A 72 70.949 -20.805 0.215 1.00 1.00 H new ATOM 0 HD2 HIS A 72 68.929 -24.492 0.313 1.00 1.00 H new ATOM 0 HE1 HIS A 72 72.325 -22.387 1.672 1.00 1.00 H new ATOM 1090 N MET A 73 71.248 -22.780 -2.075 1.00 1.00 N ATOM 1091 CA MET A 73 72.674 -23.041 -2.070 1.00 1.00 C ATOM 1092 C MET A 73 73.216 -22.969 -3.500 1.00 1.00 C ATOM 1093 O MET A 73 74.252 -22.356 -3.745 1.00 1.00 O ATOM 1094 CB MET A 73 72.985 -24.397 -1.443 1.00 1.00 C ATOM 1095 CG MET A 73 74.487 -24.486 -1.154 1.00 1.00 C ATOM 1096 SD MET A 73 74.795 -25.843 0.000 1.00 1.00 S ATOM 1097 CE MET A 73 74.544 -24.891 1.520 1.00 1.00 C ATOM 0 H MET A 73 70.648 -23.596 -1.953 1.00 1.00 H new ATOM 0 HA MET A 73 73.164 -22.279 -1.464 1.00 1.00 H new ATOM 0 HB2 MET A 73 72.417 -24.524 -0.521 1.00 1.00 H new ATOM 0 HB3 MET A 73 72.684 -25.200 -2.116 1.00 1.00 H new ATOM 0 HG2 MET A 73 75.038 -24.649 -2.080 1.00 1.00 H new ATOM 0 HG3 MET A 73 74.844 -23.547 -0.732 1.00 1.00 H new ATOM 0 HE1 MET A 73 74.722 -25.531 2.384 1.00 1.00 H new ATOM 0 HE2 MET A 73 75.238 -24.051 1.542 1.00 1.00 H new ATOM 0 HE3 MET A 73 73.521 -24.517 1.550 1.00 1.00 H new ATOM 1107 N VAL A 74 72.565 -23.674 -4.429 1.00 1.00 N ATOM 1108 CA VAL A 74 73.076 -23.740 -5.802 1.00 1.00 C ATOM 1109 C VAL A 74 73.527 -22.352 -6.271 1.00 1.00 C ATOM 1110 O VAL A 74 74.612 -22.250 -6.845 1.00 1.00 O ATOM 1111 CB VAL A 74 72.019 -24.334 -6.740 1.00 1.00 C ATOM 1112 CG1 VAL A 74 72.520 -24.313 -8.182 1.00 1.00 C ATOM 1113 CG2 VAL A 74 71.714 -25.782 -6.332 1.00 1.00 C ATOM 0 H VAL A 74 71.704 -24.195 -4.263 1.00 1.00 H new ATOM 0 HA VAL A 74 73.945 -24.398 -5.824 1.00 1.00 H new ATOM 0 HB VAL A 74 71.112 -23.734 -6.666 1.00 1.00 H new ATOM 0 HG11 VAL A 74 71.760 -24.738 -8.838 1.00 1.00 H new ATOM 0 HG12 VAL A 74 72.724 -23.285 -8.481 1.00 1.00 H new ATOM 0 HG13 VAL A 74 73.434 -24.901 -8.258 1.00 1.00 H new ATOM 0 HG21 VAL A 74 70.962 -26.198 -7.002 1.00 1.00 H new ATOM 0 HG22 VAL A 74 72.625 -26.377 -6.394 1.00 1.00 H new ATOM 0 HG23 VAL A 74 71.338 -25.800 -5.309 1.00 1.00 H new ATOM 1123 N ASN A 75 72.736 -21.283 -6.055 1.00 1.00 N ATOM 1124 CA ASN A 75 73.132 -19.912 -6.474 1.00 1.00 C ATOM 1125 C ASN A 75 74.641 -19.684 -6.289 1.00 1.00 C ATOM 1126 O ASN A 75 75.247 -18.817 -6.913 1.00 1.00 O ATOM 1127 CB ASN A 75 72.311 -18.912 -5.623 1.00 1.00 C ATOM 1128 CG ASN A 75 73.082 -17.622 -5.315 1.00 1.00 C ATOM 1129 OD1 ASN A 75 73.162 -16.722 -6.151 1.00 1.00 O ATOM 1130 ND2 ASN A 75 73.650 -17.485 -4.147 1.00 1.00 N ATOM 0 H ASN A 75 71.826 -21.335 -5.597 1.00 1.00 H new ATOM 0 HA ASN A 75 72.926 -19.770 -7.535 1.00 1.00 H new ATOM 0 HB2 ASN A 75 71.390 -18.663 -6.151 1.00 1.00 H new ATOM 0 HB3 ASN A 75 72.022 -19.390 -4.687 1.00 1.00 H new ATOM 0 HD21 ASN A 75 74.161 -16.631 -3.926 1.00 1.00 H new ATOM 0 HD22 ASN A 75 73.582 -18.232 -3.456 1.00 1.00 H new ATOM 1137 N GLY A 76 75.221 -20.519 -5.464 1.00 1.00 N ATOM 1138 CA GLY A 76 76.657 -20.486 -5.216 1.00 1.00 C ATOM 1139 C GLY A 76 77.395 -20.323 -6.562 1.00 1.00 C ATOM 1140 O GLY A 76 78.555 -19.904 -6.610 1.00 1.00 O ATOM 0 H GLY A 76 74.722 -21.241 -4.943 1.00 1.00 H new ATOM 0 HA2 GLY A 76 76.905 -19.661 -4.548 1.00 1.00 H new ATOM 0 HA3 GLY A 76 76.975 -21.404 -4.721 1.00 1.00 H new ATOM 1144 N ILE A 77 76.689 -20.651 -7.660 1.00 1.00 N ATOM 1145 CA ILE A 77 77.263 -20.531 -9.003 1.00 1.00 C ATOM 1146 C ILE A 77 76.959 -19.135 -9.540 1.00 1.00 C ATOM 1147 O ILE A 77 77.842 -18.463 -10.060 1.00 1.00 O ATOM 1148 CB ILE A 77 76.754 -21.654 -9.934 1.00 1.00 C ATOM 1149 CG1 ILE A 77 75.228 -21.609 -10.075 1.00 1.00 C ATOM 1150 CG2 ILE A 77 77.168 -23.015 -9.352 1.00 1.00 C ATOM 1151 CD1 ILE A 77 74.753 -22.847 -10.855 1.00 1.00 C ATOM 0 H ILE A 77 75.730 -20.997 -7.640 1.00 1.00 H new ATOM 0 HA ILE A 77 78.345 -20.655 -8.958 1.00 1.00 H new ATOM 0 HB ILE A 77 77.194 -21.511 -10.921 1.00 1.00 H new ATOM 0 HG12 ILE A 77 74.761 -21.584 -9.090 1.00 1.00 H new ATOM 0 HG13 ILE A 77 74.926 -20.700 -10.594 1.00 1.00 H new ATOM 0 HG21 ILE A 77 76.812 -23.813 -10.004 1.00 1.00 H new ATOM 0 HG22 ILE A 77 78.254 -23.064 -9.278 1.00 1.00 H new ATOM 0 HG23 ILE A 77 76.731 -23.135 -8.360 1.00 1.00 H new ATOM 0 HD11 ILE A 77 73.668 -22.818 -10.957 1.00 1.00 H new ATOM 0 HD12 ILE A 77 75.211 -22.851 -11.844 1.00 1.00 H new ATOM 0 HD13 ILE A 77 75.043 -23.749 -10.317 1.00 1.00 H new ATOM 1163 N VAL A 78 75.685 -18.751 -9.483 1.00 1.00 N ATOM 1164 CA VAL A 78 75.247 -17.473 -9.999 1.00 1.00 C ATOM 1165 C VAL A 78 76.352 -16.432 -9.761 1.00 1.00 C ATOM 1166 O VAL A 78 76.583 -15.556 -10.594 1.00 1.00 O ATOM 1167 CB VAL A 78 73.960 -17.096 -9.272 1.00 1.00 C ATOM 1168 CG1 VAL A 78 73.610 -15.635 -9.528 1.00 1.00 C ATOM 1169 CG2 VAL A 78 72.822 -18.001 -9.767 1.00 1.00 C ATOM 0 H VAL A 78 74.939 -19.318 -9.080 1.00 1.00 H new ATOM 0 HA VAL A 78 75.054 -17.517 -11.071 1.00 1.00 H new ATOM 0 HB VAL A 78 74.101 -17.232 -8.200 1.00 1.00 H new ATOM 0 HG11 VAL A 78 72.689 -15.384 -9.002 1.00 1.00 H new ATOM 0 HG12 VAL A 78 74.419 -14.999 -9.168 1.00 1.00 H new ATOM 0 HG13 VAL A 78 73.472 -15.476 -10.597 1.00 1.00 H new ATOM 0 HG21 VAL A 78 71.898 -17.738 -9.252 1.00 1.00 H new ATOM 0 HG22 VAL A 78 72.690 -17.866 -10.841 1.00 1.00 H new ATOM 0 HG23 VAL A 78 73.069 -19.042 -9.560 1.00 1.00 H new ATOM 1179 N ILE A 79 77.036 -16.547 -8.611 1.00 1.00 N ATOM 1180 CA ILE A 79 78.120 -15.624 -8.258 1.00 1.00 C ATOM 1181 C ILE A 79 79.488 -16.126 -8.756 1.00 1.00 C ATOM 1182 O ILE A 79 80.416 -15.336 -8.958 1.00 1.00 O ATOM 1183 CB ILE A 79 78.153 -15.458 -6.736 1.00 1.00 C ATOM 1184 CG1 ILE A 79 78.248 -16.836 -6.068 1.00 1.00 C ATOM 1185 CG2 ILE A 79 76.867 -14.763 -6.280 1.00 1.00 C ATOM 1186 CD1 ILE A 79 78.467 -16.661 -4.562 1.00 1.00 C ATOM 0 H ILE A 79 76.856 -17.269 -7.913 1.00 1.00 H new ATOM 0 HA ILE A 79 77.927 -14.667 -8.744 1.00 1.00 H new ATOM 0 HB ILE A 79 79.019 -14.859 -6.454 1.00 1.00 H new ATOM 0 HG12 ILE A 79 77.335 -17.404 -6.250 1.00 1.00 H new ATOM 0 HG13 ILE A 79 79.070 -17.406 -6.502 1.00 1.00 H new ATOM 0 HG21 ILE A 79 76.884 -14.641 -5.197 1.00 1.00 H new ATOM 0 HG22 ILE A 79 76.795 -13.784 -6.754 1.00 1.00 H new ATOM 0 HG23 ILE A 79 76.006 -15.368 -6.564 1.00 1.00 H new ATOM 0 HD11 ILE A 79 78.534 -17.640 -4.088 1.00 1.00 H new ATOM 0 HD12 ILE A 79 79.392 -16.110 -4.390 1.00 1.00 H new ATOM 0 HD13 ILE A 79 77.631 -16.108 -4.135 1.00 1.00 H new ATOM 1198 N ALA A 80 79.581 -17.430 -9.011 1.00 1.00 N ATOM 1199 CA ALA A 80 80.782 -18.070 -9.548 1.00 1.00 C ATOM 1200 C ALA A 80 80.849 -17.934 -11.076 1.00 1.00 C ATOM 1201 O ALA A 80 81.869 -18.268 -11.687 1.00 1.00 O ATOM 1202 CB ALA A 80 80.839 -19.554 -9.152 1.00 1.00 C ATOM 0 H ALA A 80 78.813 -18.082 -8.848 1.00 1.00 H new ATOM 0 HA ALA A 80 81.643 -17.559 -9.117 1.00 1.00 H new ATOM 0 HB1 ALA A 80 81.741 -20.006 -9.564 1.00 1.00 H new ATOM 0 HB2 ALA A 80 80.853 -19.640 -8.066 1.00 1.00 H new ATOM 0 HB3 ALA A 80 79.963 -20.069 -9.545 1.00 1.00 H new ATOM 1208 N GLU A 81 79.781 -17.415 -11.697 1.00 1.00 N ATOM 1209 CA GLU A 81 79.778 -17.222 -13.136 1.00 1.00 C ATOM 1210 C GLU A 81 80.664 -16.033 -13.472 1.00 1.00 C ATOM 1211 O GLU A 81 81.733 -16.201 -14.059 1.00 1.00 O ATOM 1212 CB GLU A 81 78.329 -16.972 -13.620 1.00 1.00 C ATOM 1213 CG GLU A 81 77.786 -18.202 -14.353 1.00 1.00 C ATOM 1214 CD GLU A 81 78.455 -18.327 -15.719 1.00 1.00 C ATOM 1215 OE1 GLU A 81 78.635 -17.306 -16.363 1.00 1.00 O ATOM 1216 OE2 GLU A 81 78.780 -19.440 -16.100 1.00 1.00 O ATOM 0 H GLU A 81 78.924 -17.128 -11.225 1.00 1.00 H new ATOM 0 HA GLU A 81 80.163 -18.110 -13.637 1.00 1.00 H new ATOM 0 HB2 GLU A 81 77.690 -16.738 -12.768 1.00 1.00 H new ATOM 0 HB3 GLU A 81 78.305 -16.107 -14.283 1.00 1.00 H new ATOM 0 HG2 GLU A 81 77.972 -19.100 -13.763 1.00 1.00 H new ATOM 0 HG3 GLU A 81 76.706 -18.118 -14.473 1.00 1.00 H new ATOM 1223 N ASP A 82 80.231 -14.828 -13.094 1.00 1.00 N ATOM 1224 CA ASP A 82 81.038 -13.658 -13.379 1.00 1.00 C ATOM 1225 C ASP A 82 82.387 -13.819 -12.716 1.00 1.00 C ATOM 1226 O ASP A 82 83.394 -13.804 -13.416 1.00 1.00 O ATOM 1227 CB ASP A 82 80.360 -12.387 -12.868 1.00 1.00 C ATOM 1228 CG ASP A 82 80.023 -12.528 -11.385 1.00 1.00 C ATOM 1229 OD1 ASP A 82 79.754 -13.639 -10.960 1.00 1.00 O ATOM 1230 OD2 ASP A 82 80.038 -11.519 -10.699 1.00 1.00 O ATOM 0 H ASP A 82 79.354 -14.647 -12.606 1.00 1.00 H new ATOM 0 HA ASP A 82 81.158 -13.567 -14.458 1.00 1.00 H new ATOM 0 HB2 ASP A 82 81.016 -11.530 -13.019 1.00 1.00 H new ATOM 0 HB3 ASP A 82 79.451 -12.197 -13.438 1.00 1.00 H new ATOM 1235 N ALA A 83 82.391 -13.975 -11.365 1.00 1.00 N ATOM 1236 CA ALA A 83 83.642 -14.142 -10.580 1.00 1.00 C ATOM 1237 C ALA A 83 84.869 -14.030 -11.475 1.00 1.00 C ATOM 1238 O ALA A 83 85.641 -13.089 -11.363 1.00 1.00 O ATOM 1239 CB ALA A 83 83.649 -15.502 -9.880 1.00 1.00 C ATOM 0 H ALA A 83 81.543 -13.988 -10.799 1.00 1.00 H new ATOM 0 HA ALA A 83 83.677 -13.347 -9.836 1.00 1.00 H new ATOM 0 HB1 ALA A 83 84.570 -15.612 -9.308 1.00 1.00 H new ATOM 0 HB2 ALA A 83 82.794 -15.569 -9.207 1.00 1.00 H new ATOM 0 HB3 ALA A 83 83.587 -16.295 -10.625 1.00 1.00 H new ATOM 1245 N LEU A 84 85.059 -15.046 -12.315 1.00 1.00 N ATOM 1246 CA LEU A 84 86.238 -15.125 -13.196 1.00 1.00 C ATOM 1247 C LEU A 84 86.782 -13.732 -13.511 1.00 1.00 C ATOM 1248 O LEU A 84 87.991 -13.516 -13.426 1.00 1.00 O ATOM 1249 CB LEU A 84 85.838 -15.773 -14.530 1.00 1.00 C ATOM 1250 CG LEU A 84 85.422 -17.238 -14.335 1.00 1.00 C ATOM 1251 CD1 LEU A 84 84.681 -17.715 -15.589 1.00 1.00 C ATOM 1252 CD2 LEU A 84 86.660 -18.126 -14.116 1.00 1.00 C ATOM 0 H LEU A 84 84.414 -15.831 -12.409 1.00 1.00 H new ATOM 0 HA LEU A 84 86.999 -15.712 -12.681 1.00 1.00 H new ATOM 0 HB2 LEU A 84 85.014 -15.215 -14.976 1.00 1.00 H new ATOM 0 HB3 LEU A 84 86.674 -15.720 -15.228 1.00 1.00 H new ATOM 0 HG LEU A 84 84.777 -17.310 -13.460 1.00 1.00 H new ATOM 0 HD11 LEU A 84 84.381 -18.755 -15.461 1.00 1.00 H new ATOM 0 HD12 LEU A 84 83.796 -17.099 -15.745 1.00 1.00 H new ATOM 0 HD13 LEU A 84 85.339 -17.631 -16.454 1.00 1.00 H new ATOM 0 HD21 LEU A 84 86.346 -19.161 -13.980 1.00 1.00 H new ATOM 0 HD22 LEU A 84 87.315 -18.057 -14.984 1.00 1.00 H new ATOM 0 HD23 LEU A 84 87.197 -17.790 -13.229 1.00 1.00 H new ATOM 1264 N ILE A 85 85.908 -12.777 -13.834 1.00 1.00 N ATOM 1265 CA ILE A 85 86.358 -11.408 -14.097 1.00 1.00 C ATOM 1266 C ILE A 85 86.160 -10.587 -12.828 1.00 1.00 C ATOM 1267 O ILE A 85 87.060 -9.883 -12.367 1.00 1.00 O ATOM 1268 CB ILE A 85 85.588 -10.794 -15.280 1.00 1.00 C ATOM 1269 CG1 ILE A 85 84.047 -11.031 -15.143 1.00 1.00 C ATOM 1270 CG2 ILE A 85 86.101 -11.437 -16.576 1.00 1.00 C ATOM 1271 CD1 ILE A 85 83.337 -9.722 -14.799 1.00 1.00 C ATOM 0 H ILE A 85 84.902 -12.921 -13.919 1.00 1.00 H new ATOM 0 HA ILE A 85 87.413 -11.411 -14.371 1.00 1.00 H new ATOM 0 HB ILE A 85 85.755 -9.717 -15.293 1.00 1.00 H new ATOM 0 HG12 ILE A 85 83.650 -11.434 -16.075 1.00 1.00 H new ATOM 0 HG13 ILE A 85 83.854 -11.772 -14.367 1.00 1.00 H new ATOM 0 HG21 ILE A 85 85.567 -11.015 -17.428 1.00 1.00 H new ATOM 0 HG22 ILE A 85 87.168 -11.240 -16.682 1.00 1.00 H new ATOM 0 HG23 ILE A 85 85.933 -12.513 -16.540 1.00 1.00 H new ATOM 0 HD11 ILE A 85 82.266 -9.902 -14.707 1.00 1.00 H new ATOM 0 HD12 ILE A 85 83.722 -9.336 -13.855 1.00 1.00 H new ATOM 0 HD13 ILE A 85 83.515 -8.993 -15.589 1.00 1.00 H new ATOM 1283 N ALA A 86 84.953 -10.699 -12.283 1.00 1.00 N ATOM 1284 CA ALA A 86 84.587 -9.987 -11.067 1.00 1.00 C ATOM 1285 C ALA A 86 85.712 -10.089 -10.031 1.00 1.00 C ATOM 1286 O ALA A 86 86.032 -9.115 -9.359 1.00 1.00 O ATOM 1287 CB ALA A 86 83.275 -10.577 -10.519 1.00 1.00 C ATOM 0 H ALA A 86 84.209 -11.280 -12.668 1.00 1.00 H new ATOM 0 HA ALA A 86 84.437 -8.930 -11.288 1.00 1.00 H new ATOM 0 HB1 ALA A 86 82.992 -10.050 -9.608 1.00 1.00 H new ATOM 0 HB2 ALA A 86 82.487 -10.464 -11.263 1.00 1.00 H new ATOM 0 HB3 ALA A 86 83.416 -11.635 -10.298 1.00 1.00 H new ATOM 1293 N GLU A 87 86.295 -11.275 -9.909 1.00 1.00 N ATOM 1294 CA GLU A 87 87.382 -11.509 -8.960 1.00 1.00 C ATOM 1295 C GLU A 87 88.584 -10.608 -9.266 1.00 1.00 C ATOM 1296 O GLU A 87 89.719 -10.931 -8.915 1.00 1.00 O ATOM 1297 CB GLU A 87 87.811 -12.981 -9.029 1.00 1.00 C ATOM 1298 CG GLU A 87 88.537 -13.253 -10.353 1.00 1.00 C ATOM 1299 CD GLU A 87 88.643 -14.755 -10.597 1.00 1.00 C ATOM 1300 OE1 GLU A 87 87.649 -15.438 -10.411 1.00 1.00 O ATOM 1301 OE2 GLU A 87 89.713 -15.200 -10.976 1.00 1.00 O ATOM 0 H GLU A 87 86.033 -12.095 -10.457 1.00 1.00 H new ATOM 0 HA GLU A 87 87.023 -11.272 -7.958 1.00 1.00 H new ATOM 0 HB2 GLU A 87 88.466 -13.218 -8.190 1.00 1.00 H new ATOM 0 HB3 GLU A 87 86.938 -13.628 -8.944 1.00 1.00 H new ATOM 0 HG2 GLU A 87 87.999 -12.781 -11.175 1.00 1.00 H new ATOM 0 HG3 GLU A 87 89.533 -12.810 -10.328 1.00 1.00 H new ATOM 1308 N ALA A 88 88.320 -9.473 -9.921 1.00 1.00 N ATOM 1309 CA ALA A 88 89.359 -8.516 -10.272 1.00 1.00 C ATOM 1310 C ALA A 88 89.028 -7.150 -9.677 1.00 1.00 C ATOM 1311 O ALA A 88 89.856 -6.239 -9.694 1.00 1.00 O ATOM 1312 CB ALA A 88 89.458 -8.398 -11.796 1.00 1.00 C ATOM 0 H ALA A 88 87.384 -9.198 -10.219 1.00 1.00 H new ATOM 0 HA ALA A 88 90.312 -8.862 -9.872 1.00 1.00 H new ATOM 0 HB1 ALA A 88 90.237 -7.681 -12.056 1.00 1.00 H new ATOM 0 HB2 ALA A 88 89.705 -9.371 -12.221 1.00 1.00 H new ATOM 0 HB3 ALA A 88 88.503 -8.058 -12.197 1.00 1.00 H new ATOM 1318 N VAL A 89 87.812 -7.019 -9.134 1.00 1.00 N ATOM 1319 CA VAL A 89 87.362 -5.775 -8.516 1.00 1.00 C ATOM 1320 C VAL A 89 87.318 -5.957 -7.005 1.00 1.00 C ATOM 1321 O VAL A 89 86.466 -5.385 -6.338 1.00 1.00 O ATOM 1322 CB VAL A 89 85.980 -5.363 -9.050 1.00 1.00 C ATOM 1323 CG1 VAL A 89 85.984 -5.468 -10.579 1.00 1.00 C ATOM 1324 CG2 VAL A 89 84.874 -6.263 -8.458 1.00 1.00 C ATOM 0 H VAL A 89 87.120 -7.768 -9.112 1.00 1.00 H new ATOM 0 HA VAL A 89 88.063 -4.979 -8.767 1.00 1.00 H new ATOM 0 HB VAL A 89 85.773 -4.335 -8.752 1.00 1.00 H new ATOM 0 HG11 VAL A 89 85.007 -5.178 -10.966 1.00 1.00 H new ATOM 0 HG12 VAL A 89 86.748 -4.806 -10.987 1.00 1.00 H new ATOM 0 HG13 VAL A 89 86.200 -6.495 -10.873 1.00 1.00 H new ATOM 0 HG21 VAL A 89 83.905 -5.954 -8.849 1.00 1.00 H new ATOM 0 HG22 VAL A 89 85.062 -7.300 -8.734 1.00 1.00 H new ATOM 0 HG23 VAL A 89 84.873 -6.171 -7.372 1.00 1.00 H new ATOM 1334 N GLY A 90 88.256 -6.744 -6.467 1.00 1.00 N ATOM 1335 CA GLY A 90 88.321 -6.975 -5.030 1.00 1.00 C ATOM 1336 C GLY A 90 88.709 -5.707 -4.263 1.00 1.00 C ATOM 1337 O GLY A 90 88.139 -5.437 -3.207 1.00 1.00 O ATOM 0 H GLY A 90 88.975 -7.227 -7.006 1.00 1.00 H new ATOM 0 HA2 GLY A 90 87.354 -7.331 -4.676 1.00 1.00 H new ATOM 0 HA3 GLY A 90 89.046 -7.761 -4.821 1.00 1.00 H new ATOM 1341 N PRO A 91 89.644 -4.915 -4.763 1.00 1.00 N ATOM 1342 CA PRO A 91 90.064 -3.654 -4.080 1.00 1.00 C ATOM 1343 C PRO A 91 88.862 -2.865 -3.577 1.00 1.00 C ATOM 1344 O PRO A 91 89.003 -1.931 -2.785 1.00 1.00 O ATOM 1345 CB PRO A 91 90.830 -2.898 -5.163 1.00 1.00 C ATOM 1346 CG PRO A 91 91.412 -3.964 -6.033 1.00 1.00 C ATOM 1347 CD PRO A 91 90.414 -5.130 -6.007 1.00 1.00 C ATOM 0 HA PRO A 91 90.668 -3.834 -3.191 1.00 1.00 H new ATOM 0 HB2 PRO A 91 90.170 -2.242 -5.730 1.00 1.00 H new ATOM 0 HB3 PRO A 91 91.610 -2.270 -4.731 1.00 1.00 H new ATOM 0 HG2 PRO A 91 91.559 -3.600 -7.050 1.00 1.00 H new ATOM 0 HG3 PRO A 91 92.388 -4.279 -5.663 1.00 1.00 H new ATOM 0 HD2 PRO A 91 89.766 -5.121 -6.884 1.00 1.00 H new ATOM 0 HD3 PRO A 91 90.925 -6.093 -5.999 1.00 1.00 H new ATOM 1355 N HIS A 92 87.682 -3.253 -4.046 1.00 1.00 N ATOM 1356 CA HIS A 92 86.468 -2.595 -3.636 1.00 1.00 C ATOM 1357 C HIS A 92 86.337 -2.684 -2.121 1.00 1.00 C ATOM 1358 O HIS A 92 85.602 -1.927 -1.515 1.00 1.00 O ATOM 1359 CB HIS A 92 85.240 -3.255 -4.307 1.00 1.00 C ATOM 1360 CG HIS A 92 84.786 -4.457 -3.504 1.00 1.00 C ATOM 1361 ND1 HIS A 92 84.227 -4.318 -2.243 1.00 1.00 N ATOM 1362 CD2 HIS A 92 84.831 -5.811 -3.742 1.00 1.00 C ATOM 1363 CE1 HIS A 92 83.968 -5.550 -1.770 1.00 1.00 C ATOM 1364 NE2 HIS A 92 84.317 -6.496 -2.644 1.00 1.00 N ATOM 0 H HIS A 92 87.550 -4.018 -4.708 1.00 1.00 H new ATOM 0 HA HIS A 92 86.509 -1.550 -3.943 1.00 1.00 H new ATOM 0 HB2 HIS A 92 84.427 -2.533 -4.385 1.00 1.00 H new ATOM 0 HB3 HIS A 92 85.492 -3.561 -5.322 1.00 1.00 H new ATOM 0 HD1 HIS A 92 84.045 -3.438 -1.760 1.00 1.00 H new ATOM 0 HD2 HIS A 92 85.208 -6.272 -4.643 1.00 1.00 H new ATOM 0 HE1 HIS A 92 83.532 -5.749 -0.802 1.00 1.00 H new ATOM 1372 N LEU A 93 87.094 -3.596 -1.513 1.00 1.00 N ATOM 1373 CA LEU A 93 87.058 -3.745 -0.065 1.00 1.00 C ATOM 1374 C LEU A 93 87.703 -2.527 0.596 1.00 1.00 C ATOM 1375 O LEU A 93 87.054 -1.821 1.373 1.00 1.00 O ATOM 1376 CB LEU A 93 87.779 -5.039 0.360 1.00 1.00 C ATOM 1377 CG LEU A 93 89.218 -5.098 -0.243 1.00 1.00 C ATOM 1378 CD1 LEU A 93 90.279 -4.727 0.820 1.00 1.00 C ATOM 1379 CD2 LEU A 93 89.518 -6.515 -0.772 1.00 1.00 C ATOM 0 H LEU A 93 87.729 -4.232 -1.994 1.00 1.00 H new ATOM 0 HA LEU A 93 86.020 -3.813 0.260 1.00 1.00 H new ATOM 0 HB2 LEU A 93 87.834 -5.089 1.447 1.00 1.00 H new ATOM 0 HB3 LEU A 93 87.206 -5.905 0.029 1.00 1.00 H new ATOM 0 HG LEU A 93 89.264 -4.379 -1.061 1.00 1.00 H new ATOM 0 HD11 LEU A 93 91.273 -4.776 0.375 1.00 1.00 H new ATOM 0 HD12 LEU A 93 90.093 -3.716 1.182 1.00 1.00 H new ATOM 0 HD13 LEU A 93 90.220 -5.428 1.653 1.00 1.00 H new ATOM 0 HD21 LEU A 93 90.524 -6.542 -1.190 1.00 1.00 H new ATOM 0 HD22 LEU A 93 89.445 -7.232 0.046 1.00 1.00 H new ATOM 0 HD23 LEU A 93 88.797 -6.774 -1.547 1.00 1.00 H new ATOM 1391 N ALA A 94 88.973 -2.272 0.283 1.00 1.00 N ATOM 1392 CA ALA A 94 89.660 -1.130 0.856 1.00 1.00 C ATOM 1393 C ALA A 94 88.869 0.121 0.548 1.00 1.00 C ATOM 1394 O ALA A 94 88.535 0.897 1.443 1.00 1.00 O ATOM 1395 CB ALA A 94 91.063 -1.009 0.267 1.00 1.00 C ATOM 0 H ALA A 94 89.535 -2.835 -0.355 1.00 1.00 H new ATOM 0 HA ALA A 94 89.745 -1.261 1.935 1.00 1.00 H new ATOM 0 HB1 ALA A 94 91.568 -0.148 0.705 1.00 1.00 H new ATOM 0 HB2 ALA A 94 91.630 -1.914 0.488 1.00 1.00 H new ATOM 0 HB3 ALA A 94 90.994 -0.879 -0.813 1.00 1.00 H new ATOM 1401 N ARG A 95 88.543 0.296 -0.727 1.00 1.00 N ATOM 1402 CA ARG A 95 87.757 1.450 -1.123 1.00 1.00 C ATOM 1403 C ARG A 95 86.499 1.463 -0.274 1.00 1.00 C ATOM 1404 O ARG A 95 86.188 2.418 0.463 1.00 1.00 O ATOM 1405 CB ARG A 95 87.365 1.374 -2.612 1.00 1.00 C ATOM 1406 CG ARG A 95 88.624 1.440 -3.526 1.00 1.00 C ATOM 1407 CD ARG A 95 88.595 2.702 -4.406 1.00 1.00 C ATOM 1408 NE ARG A 95 87.352 2.755 -5.171 1.00 1.00 N ATOM 1409 CZ ARG A 95 87.153 1.959 -6.219 1.00 1.00 C ATOM 1410 NH1 ARG A 95 88.065 1.093 -6.566 1.00 1.00 N ATOM 1411 NH2 ARG A 95 86.040 2.041 -6.898 1.00 1.00 N ATOM 0 H ARG A 95 88.805 -0.332 -1.487 1.00 1.00 H new ATOM 0 HA ARG A 95 88.344 2.357 -0.978 1.00 1.00 H new ATOM 0 HB2 ARG A 95 86.822 0.448 -2.802 1.00 1.00 H new ATOM 0 HB3 ARG A 95 86.691 2.195 -2.856 1.00 1.00 H new ATOM 0 HG2 ARG A 95 89.525 1.440 -2.912 1.00 1.00 H new ATOM 0 HG3 ARG A 95 88.668 0.552 -4.157 1.00 1.00 H new ATOM 0 HD2 ARG A 95 88.685 3.591 -3.782 1.00 1.00 H new ATOM 0 HD3 ARG A 95 89.448 2.701 -5.084 1.00 1.00 H new ATOM 0 HE ARG A 95 86.623 3.414 -4.897 1.00 1.00 H new ATOM 0 HH11 ARG A 95 88.932 1.025 -6.034 1.00 1.00 H new ATOM 0 HH12 ARG A 95 87.910 0.484 -7.369 1.00 1.00 H new ATOM 0 HH21 ARG A 95 85.324 2.715 -6.625 1.00 1.00 H new ATOM 0 HH22 ARG A 95 85.887 1.431 -7.701 1.00 1.00 H new ATOM 1425 N ALA A 96 85.716 0.422 -0.342 1.00 1.00 N ATOM 1426 CA ALA A 96 84.484 0.433 0.408 1.00 1.00 C ATOM 1427 C ALA A 96 84.702 0.913 1.832 1.00 1.00 C ATOM 1428 O ALA A 96 83.754 1.004 2.570 1.00 1.00 O ATOM 1429 CB ALA A 96 83.745 -0.892 0.301 1.00 1.00 C ATOM 0 H ALA A 96 85.896 -0.420 -0.889 1.00 1.00 H new ATOM 0 HA ALA A 96 83.817 1.166 -0.045 1.00 1.00 H new ATOM 0 HB1 ALA A 96 82.823 -0.842 0.880 1.00 1.00 H new ATOM 0 HB2 ALA A 96 83.507 -1.093 -0.744 1.00 1.00 H new ATOM 0 HB3 ALA A 96 84.375 -1.692 0.690 1.00 1.00 H new ATOM 1435 N LEU A 97 85.977 1.003 2.250 1.00 1.00 N ATOM 1436 CA LEU A 97 86.379 1.225 3.659 1.00 1.00 C ATOM 1437 C LEU A 97 85.172 1.312 4.592 1.00 1.00 C ATOM 1438 O LEU A 97 85.116 0.539 5.546 1.00 1.00 O ATOM 1439 CB LEU A 97 87.075 2.608 3.640 1.00 1.00 C ATOM 1440 CG LEU A 97 88.043 2.811 4.812 1.00 1.00 C ATOM 1441 CD1 LEU A 97 87.327 2.515 6.129 1.00 1.00 C ATOM 1442 CD2 LEU A 97 89.301 1.924 4.649 1.00 1.00 C ATOM 0 H LEU A 97 86.771 0.923 1.614 1.00 1.00 H new ATOM 0 HA LEU A 97 87.004 0.408 4.019 1.00 1.00 H new ATOM 0 HB2 LEU A 97 87.620 2.721 2.703 1.00 1.00 H new ATOM 0 HB3 LEU A 97 86.316 3.390 3.664 1.00 1.00 H new ATOM 0 HG LEU A 97 88.375 3.849 4.821 1.00 1.00 H new ATOM 0 HD11 LEU A 97 88.018 2.660 6.959 1.00 1.00 H new ATOM 0 HD12 LEU A 97 86.478 3.189 6.241 1.00 1.00 H new ATOM 0 HD13 LEU A 97 86.974 1.484 6.127 1.00 1.00 H new ATOM 0 HD21 LEU A 97 89.972 2.086 5.492 1.00 1.00 H new ATOM 0 HD22 LEU A 97 89.005 0.875 4.617 1.00 1.00 H new ATOM 0 HD23 LEU A 97 89.813 2.185 3.723 1.00 1.00 H new ATOM 1454 N GLY A 98 84.194 2.141 4.375 1.00 1.00 N ATOM 1455 CA GLY A 98 83.051 2.097 5.244 1.00 1.00 C ATOM 1456 C GLY A 98 82.557 0.646 5.344 1.00 1.00 C ATOM 1457 O GLY A 98 81.923 0.274 6.331 1.00 1.00 O ATOM 0 H GLY A 98 84.160 2.836 3.629 1.00 1.00 H new ATOM 0 HA2 GLY A 98 83.314 2.474 6.232 1.00 1.00 H new ATOM 0 HA3 GLY A 98 82.259 2.739 4.858 1.00 1.00 H new ATOM 1461 N GLN A 99 82.879 -0.190 4.330 1.00 1.00 N ATOM 1462 CA GLN A 99 82.468 -1.597 4.400 1.00 1.00 C ATOM 1463 C GLN A 99 83.276 -2.264 5.497 1.00 1.00 C ATOM 1464 O GLN A 99 82.865 -3.257 6.098 1.00 1.00 O ATOM 1465 CB GLN A 99 82.718 -2.342 3.088 1.00 1.00 C ATOM 1466 CG GLN A 99 82.031 -3.728 3.106 1.00 1.00 C ATOM 1467 CD GLN A 99 82.896 -4.775 2.392 1.00 1.00 C ATOM 1468 OE1 GLN A 99 84.060 -4.964 2.744 1.00 1.00 O ATOM 1469 NE2 GLN A 99 82.393 -5.469 1.406 1.00 1.00 N ATOM 0 H GLN A 99 83.398 0.075 3.493 1.00 1.00 H new ATOM 0 HA GLN A 99 81.397 -1.632 4.600 1.00 1.00 H new ATOM 0 HB2 GLN A 99 82.339 -1.754 2.252 1.00 1.00 H new ATOM 0 HB3 GLN A 99 83.790 -2.464 2.932 1.00 1.00 H new ATOM 0 HG2 GLN A 99 81.854 -4.038 4.136 1.00 1.00 H new ATOM 0 HG3 GLN A 99 81.057 -3.662 2.621 1.00 1.00 H new ATOM 0 HE21 GLN A 99 81.428 -5.314 1.113 1.00 1.00 H new ATOM 0 HE22 GLN A 99 82.965 -6.166 0.929 1.00 1.00 H new ATOM 1478 N ILE A 100 84.425 -1.672 5.767 1.00 1.00 N ATOM 1479 CA ILE A 100 85.295 -2.181 6.823 1.00 1.00 C ATOM 1480 C ILE A 100 84.569 -2.057 8.167 1.00 1.00 C ATOM 1481 O ILE A 100 84.671 -2.940 9.019 1.00 1.00 O ATOM 1482 CB ILE A 100 86.669 -1.434 6.856 1.00 1.00 C ATOM 1483 CG1 ILE A 100 87.823 -2.450 6.949 1.00 1.00 C ATOM 1484 CG2 ILE A 100 86.769 -0.471 8.062 1.00 1.00 C ATOM 1485 CD1 ILE A 100 88.112 -3.033 5.560 1.00 1.00 C ATOM 0 H ILE A 100 84.778 -0.849 5.280 1.00 1.00 H new ATOM 0 HA ILE A 100 85.516 -3.229 6.621 1.00 1.00 H new ATOM 0 HB ILE A 100 86.742 -0.856 5.935 1.00 1.00 H new ATOM 0 HG12 ILE A 100 88.716 -1.965 7.344 1.00 1.00 H new ATOM 0 HG13 ILE A 100 87.562 -3.249 7.642 1.00 1.00 H new ATOM 0 HG21 ILE A 100 87.738 0.029 8.049 1.00 1.00 H new ATOM 0 HG22 ILE A 100 85.976 0.274 8.000 1.00 1.00 H new ATOM 0 HG23 ILE A 100 86.664 -1.036 8.988 1.00 1.00 H new ATOM 0 HD11 ILE A 100 88.929 -3.751 5.630 1.00 1.00 H new ATOM 0 HD12 ILE A 100 87.220 -3.533 5.183 1.00 1.00 H new ATOM 0 HD13 ILE A 100 88.393 -2.229 4.879 1.00 1.00 H new ATOM 1497 N VAL A 101 83.835 -0.959 8.349 1.00 1.00 N ATOM 1498 CA VAL A 101 83.111 -0.758 9.595 1.00 1.00 C ATOM 1499 C VAL A 101 82.089 -1.879 9.767 1.00 1.00 C ATOM 1500 O VAL A 101 82.128 -2.609 10.753 1.00 1.00 O ATOM 1501 CB VAL A 101 82.392 0.594 9.586 1.00 1.00 C ATOM 1502 CG1 VAL A 101 81.613 0.776 10.895 1.00 1.00 C ATOM 1503 CG2 VAL A 101 83.424 1.712 9.453 1.00 1.00 C ATOM 0 H VAL A 101 83.729 -0.212 7.663 1.00 1.00 H new ATOM 0 HA VAL A 101 83.820 -0.770 10.423 1.00 1.00 H new ATOM 0 HB VAL A 101 81.698 0.629 8.746 1.00 1.00 H new ATOM 0 HG11 VAL A 101 81.103 1.739 10.884 1.00 1.00 H new ATOM 0 HG12 VAL A 101 80.878 -0.023 10.995 1.00 1.00 H new ATOM 0 HG13 VAL A 101 82.304 0.741 11.737 1.00 1.00 H new ATOM 0 HG21 VAL A 101 82.917 2.677 9.446 1.00 1.00 H new ATOM 0 HG22 VAL A 101 84.115 1.671 10.295 1.00 1.00 H new ATOM 0 HG23 VAL A 101 83.978 1.587 8.523 1.00 1.00 H new ATOM 1513 N CYS A 102 81.158 -2.000 8.825 1.00 1.00 N ATOM 1514 CA CYS A 102 80.121 -3.016 8.912 1.00 1.00 C ATOM 1515 C CYS A 102 80.703 -4.365 9.331 1.00 1.00 C ATOM 1516 O CYS A 102 79.984 -5.192 9.867 1.00 1.00 O ATOM 1517 CB CYS A 102 79.470 -3.110 7.509 1.00 1.00 C ATOM 1518 SG CYS A 102 78.941 -4.802 7.113 1.00 1.00 S ATOM 0 H CYS A 102 81.103 -1.408 7.996 1.00 1.00 H new ATOM 0 HA CYS A 102 79.383 -2.748 9.668 1.00 1.00 H new ATOM 0 HB2 CYS A 102 78.610 -2.442 7.463 1.00 1.00 H new ATOM 0 HB3 CYS A 102 80.180 -2.767 6.757 1.00 1.00 H new ATOM 0 HG CYS A 102 79.030 -5.544 8.176 1.00 1.00 H new ATOM 1523 N ARG A 103 82.009 -4.524 9.136 1.00 1.00 N ATOM 1524 CA ARG A 103 82.729 -5.762 9.524 1.00 1.00 C ATOM 1525 C ARG A 103 83.228 -5.667 10.972 1.00 1.00 C ATOM 1526 O ARG A 103 83.183 -6.618 11.758 1.00 1.00 O ATOM 1527 CB ARG A 103 83.927 -5.969 8.583 1.00 1.00 C ATOM 1528 CG ARG A 103 84.290 -7.460 8.505 1.00 1.00 C ATOM 1529 CD ARG A 103 85.702 -7.625 7.930 1.00 1.00 C ATOM 1530 NE ARG A 103 85.776 -7.104 6.567 1.00 1.00 N ATOM 1531 CZ ARG A 103 86.947 -6.996 5.943 1.00 1.00 C ATOM 1532 NH1 ARG A 103 88.045 -7.345 6.556 1.00 1.00 N ATOM 1533 NH2 ARG A 103 87.002 -6.538 4.722 1.00 1.00 N ATOM 0 H ARG A 103 82.605 -3.814 8.710 1.00 1.00 H new ATOM 0 HA ARG A 103 82.043 -6.606 9.446 1.00 1.00 H new ATOM 0 HB2 ARG A 103 83.686 -5.593 7.588 1.00 1.00 H new ATOM 0 HB3 ARG A 103 84.783 -5.397 8.941 1.00 1.00 H new ATOM 0 HG2 ARG A 103 84.238 -7.908 9.497 1.00 1.00 H new ATOM 0 HG3 ARG A 103 83.569 -7.986 7.879 1.00 1.00 H new ATOM 0 HD2 ARG A 103 86.420 -7.102 8.562 1.00 1.00 H new ATOM 0 HD3 ARG A 103 85.980 -8.679 7.936 1.00 1.00 H new ATOM 0 HE ARG A 103 84.921 -6.820 6.088 1.00 1.00 H new ATOM 0 HH11 ARG A 103 88.005 -7.700 7.511 1.00 1.00 H new ATOM 0 HH12 ARG A 103 88.943 -7.263 6.080 1.00 1.00 H new ATOM 0 HH21 ARG A 103 86.146 -6.261 4.242 1.00 1.00 H new ATOM 0 HH22 ARG A 103 87.901 -6.457 4.248 1.00 1.00 H new ATOM 1547 N TYR A 104 83.639 -4.460 11.274 1.00 1.00 N ATOM 1548 CA TYR A 104 84.120 -4.025 12.593 1.00 1.00 C ATOM 1549 C TYR A 104 83.016 -3.287 13.343 1.00 1.00 C ATOM 1550 O TYR A 104 83.278 -2.545 14.290 1.00 1.00 O ATOM 1551 CB TYR A 104 85.405 -3.192 12.543 1.00 1.00 C ATOM 1552 CG TYR A 104 85.796 -2.839 13.972 1.00 1.00 C ATOM 1553 CD1 TYR A 104 86.083 -3.857 14.902 1.00 1.00 C ATOM 1554 CD2 TYR A 104 85.823 -1.501 14.380 1.00 1.00 C ATOM 1555 CE1 TYR A 104 86.392 -3.530 16.226 1.00 1.00 C ATOM 1556 CE2 TYR A 104 86.143 -1.178 15.705 1.00 1.00 C ATOM 1557 CZ TYR A 104 86.423 -2.192 16.627 1.00 1.00 C ATOM 1558 OH TYR A 104 86.724 -1.869 17.935 1.00 1.00 O ATOM 0 H TYR A 104 83.654 -3.708 10.585 1.00 1.00 H new ATOM 0 HA TYR A 104 84.383 -4.932 13.137 1.00 1.00 H new ATOM 0 HB2 TYR A 104 86.204 -3.753 12.057 1.00 1.00 H new ATOM 0 HB3 TYR A 104 85.249 -2.287 11.956 1.00 1.00 H new ATOM 0 HD1 TYR A 104 86.064 -4.891 14.592 1.00 1.00 H new ATOM 0 HD2 TYR A 104 85.597 -0.717 13.673 1.00 1.00 H new ATOM 0 HE1 TYR A 104 86.607 -4.312 16.939 1.00 1.00 H new ATOM 0 HE2 TYR A 104 86.174 -0.144 16.015 1.00 1.00 H new ATOM 0 HH TYR A 104 86.704 -0.895 18.045 1.00 1.00 H new ATOM 1568 N GLY A 105 81.770 -3.509 12.956 1.00 1.00 N ATOM 1569 CA GLY A 105 80.665 -2.880 13.643 1.00 1.00 C ATOM 1570 C GLY A 105 79.399 -3.617 13.266 1.00 1.00 C ATOM 1571 O GLY A 105 78.993 -4.566 13.940 1.00 1.00 O ATOM 0 H GLY A 105 81.505 -4.114 12.178 1.00 1.00 H new ATOM 0 HA2 GLY A 105 80.818 -2.913 14.722 1.00 1.00 H new ATOM 0 HA3 GLY A 105 80.591 -1.829 13.364 1.00 1.00 H new ATOM 1575 N ALA A 106 78.779 -3.174 12.186 1.00 1.00 N ATOM 1576 CA ALA A 106 77.560 -3.780 11.713 1.00 1.00 C ATOM 1577 C ALA A 106 76.396 -3.562 12.705 1.00 1.00 C ATOM 1578 O ALA A 106 75.930 -4.506 13.335 1.00 1.00 O ATOM 1579 CB ALA A 106 77.813 -5.294 11.459 1.00 1.00 C ATOM 0 H ALA A 106 79.108 -2.391 11.621 1.00 1.00 H new ATOM 0 HA ALA A 106 77.265 -3.303 10.778 1.00 1.00 H new ATOM 0 HB1 ALA A 106 76.896 -5.761 11.101 1.00 1.00 H new ATOM 0 HB2 ALA A 106 78.596 -5.411 10.710 1.00 1.00 H new ATOM 0 HB3 ALA A 106 78.124 -5.772 12.388 1.00 1.00 H new ATOM 1585 N THR A 107 75.945 -2.311 12.887 1.00 1.00 N ATOM 1586 CA THR A 107 74.832 -2.063 13.820 1.00 1.00 C ATOM 1587 C THR A 107 73.509 -2.464 13.153 1.00 1.00 C ATOM 1588 O THR A 107 72.793 -3.321 13.652 1.00 1.00 O ATOM 1589 CB THR A 107 74.767 -0.591 14.248 1.00 1.00 C ATOM 1590 OG1 THR A 107 76.060 -0.152 14.636 1.00 1.00 O ATOM 1591 CG2 THR A 107 73.800 -0.452 15.431 1.00 1.00 C ATOM 0 H THR A 107 76.316 -1.483 12.421 1.00 1.00 H new ATOM 0 HA THR A 107 75.001 -2.663 14.714 1.00 1.00 H new ATOM 0 HB THR A 107 74.416 0.018 13.415 1.00 1.00 H new ATOM 0 HG1 THR A 107 76.018 0.789 14.908 1.00 1.00 H new ATOM 0 HG21 THR A 107 73.750 0.592 15.739 1.00 1.00 H new ATOM 0 HG22 THR A 107 72.808 -0.790 15.132 1.00 1.00 H new ATOM 0 HG23 THR A 107 74.154 -1.060 16.264 1.00 1.00 H new ATOM 1599 N VAL A 108 73.176 -1.814 12.039 1.00 1.00 N ATOM 1600 CA VAL A 108 71.929 -2.118 11.351 1.00 1.00 C ATOM 1601 C VAL A 108 71.990 -3.534 10.788 1.00 1.00 C ATOM 1602 O VAL A 108 71.026 -4.293 10.863 1.00 1.00 O ATOM 1603 CB VAL A 108 71.684 -1.096 10.249 1.00 1.00 C ATOM 1604 CG1 VAL A 108 71.611 0.300 10.875 1.00 1.00 C ATOM 1605 CG2 VAL A 108 72.828 -1.142 9.234 1.00 1.00 C ATOM 0 H VAL A 108 73.743 -1.087 11.602 1.00 1.00 H new ATOM 0 HA VAL A 108 71.097 -2.063 12.053 1.00 1.00 H new ATOM 0 HB VAL A 108 70.748 -1.325 9.739 1.00 1.00 H new ATOM 0 HG11 VAL A 108 71.436 1.040 10.094 1.00 1.00 H new ATOM 0 HG12 VAL A 108 70.794 0.333 11.596 1.00 1.00 H new ATOM 0 HG13 VAL A 108 72.551 0.522 11.381 1.00 1.00 H new ATOM 0 HG21 VAL A 108 72.647 -0.409 8.448 1.00 1.00 H new ATOM 0 HG22 VAL A 108 73.768 -0.912 9.735 1.00 1.00 H new ATOM 0 HG23 VAL A 108 72.885 -2.138 8.795 1.00 1.00 H new ATOM 1615 N ILE A 109 73.131 -3.857 10.189 1.00 1.00 N ATOM 1616 CA ILE A 109 73.328 -5.170 9.565 1.00 1.00 C ATOM 1617 C ILE A 109 72.630 -6.286 10.382 1.00 1.00 C ATOM 1618 O ILE A 109 71.737 -6.920 9.845 1.00 1.00 O ATOM 1619 CB ILE A 109 74.843 -5.450 9.372 1.00 1.00 C ATOM 1620 CG1 ILE A 109 75.353 -4.725 8.095 1.00 1.00 C ATOM 1621 CG2 ILE A 109 75.111 -6.967 9.253 1.00 1.00 C ATOM 1622 CD1 ILE A 109 75.150 -5.594 6.842 1.00 1.00 C ATOM 0 H ILE A 109 73.935 -3.233 10.120 1.00 1.00 H new ATOM 0 HA ILE A 109 72.863 -5.163 8.579 1.00 1.00 H new ATOM 0 HB ILE A 109 75.377 -5.073 10.244 1.00 1.00 H new ATOM 0 HG12 ILE A 109 74.824 -3.780 7.975 1.00 1.00 H new ATOM 0 HG13 ILE A 109 76.411 -4.486 8.207 1.00 1.00 H new ATOM 0 HG21 ILE A 109 76.179 -7.138 9.118 1.00 1.00 H new ATOM 0 HG22 ILE A 109 74.775 -7.468 10.161 1.00 1.00 H new ATOM 0 HG23 ILE A 109 74.569 -7.366 8.396 1.00 1.00 H new ATOM 0 HD11 ILE A 109 75.516 -5.060 5.965 1.00 1.00 H new ATOM 0 HD12 ILE A 109 75.700 -6.528 6.954 1.00 1.00 H new ATOM 0 HD13 ILE A 109 74.089 -5.811 6.718 1.00 1.00 H new ATOM 1634 N PRO A 110 72.986 -6.528 11.637 1.00 1.00 N ATOM 1635 CA PRO A 110 72.359 -7.589 12.500 1.00 1.00 C ATOM 1636 C PRO A 110 70.871 -7.335 12.782 1.00 1.00 C ATOM 1637 O PRO A 110 70.144 -8.254 13.151 1.00 1.00 O ATOM 1638 CB PRO A 110 73.175 -7.525 13.806 1.00 1.00 C ATOM 1639 CG PRO A 110 73.688 -6.142 13.839 1.00 1.00 C ATOM 1640 CD PRO A 110 74.011 -5.823 12.387 1.00 1.00 C ATOM 0 HA PRO A 110 72.383 -8.563 12.012 1.00 1.00 H new ATOM 0 HB2 PRO A 110 72.554 -7.741 14.675 1.00 1.00 H new ATOM 0 HB3 PRO A 110 73.987 -8.252 13.805 1.00 1.00 H new ATOM 0 HG2 PRO A 110 72.946 -5.453 14.242 1.00 1.00 H new ATOM 0 HG3 PRO A 110 74.573 -6.062 14.470 1.00 1.00 H new ATOM 0 HD2 PRO A 110 73.978 -4.750 12.197 1.00 1.00 H new ATOM 0 HD3 PRO A 110 75.010 -6.164 12.116 1.00 1.00 H new ATOM 1648 N ASN A 111 70.432 -6.080 12.643 1.00 1.00 N ATOM 1649 CA ASN A 111 69.033 -5.747 12.932 1.00 1.00 C ATOM 1650 C ASN A 111 68.083 -6.476 11.979 1.00 1.00 C ATOM 1651 O ASN A 111 67.354 -7.390 12.378 1.00 1.00 O ATOM 1652 CB ASN A 111 68.839 -4.233 12.776 1.00 1.00 C ATOM 1653 CG ASN A 111 67.501 -3.794 13.362 1.00 1.00 C ATOM 1654 OD1 ASN A 111 66.494 -3.752 12.654 1.00 1.00 O ATOM 1655 ND2 ASN A 111 67.432 -3.453 14.620 1.00 1.00 N ATOM 0 H ASN A 111 71.008 -5.295 12.340 1.00 1.00 H new ATOM 0 HA ASN A 111 68.805 -6.060 13.951 1.00 1.00 H new ATOM 0 HB2 ASN A 111 69.651 -3.705 13.276 1.00 1.00 H new ATOM 0 HB3 ASN A 111 68.885 -3.963 11.721 1.00 1.00 H new ATOM 0 HD21 ASN A 111 66.543 -3.151 15.019 1.00 1.00 H new ATOM 0 HD22 ASN A 111 68.267 -3.489 15.205 1.00 1.00 H new ATOM 1662 N ILE A 112 68.093 -6.076 10.718 1.00 1.00 N ATOM 1663 CA ILE A 112 67.220 -6.698 9.725 1.00 1.00 C ATOM 1664 C ILE A 112 67.741 -8.087 9.390 1.00 1.00 C ATOM 1665 O ILE A 112 67.013 -8.960 8.930 1.00 1.00 O ATOM 1666 CB ILE A 112 67.133 -5.814 8.437 1.00 1.00 C ATOM 1667 CG1 ILE A 112 67.717 -6.533 7.185 1.00 1.00 C ATOM 1668 CG2 ILE A 112 67.873 -4.483 8.640 1.00 1.00 C ATOM 1669 CD1 ILE A 112 69.262 -6.602 7.243 1.00 1.00 C ATOM 0 H ILE A 112 68.688 -5.331 10.356 1.00 1.00 H new ATOM 0 HA ILE A 112 66.215 -6.786 10.138 1.00 1.00 H new ATOM 0 HB ILE A 112 66.074 -5.628 8.261 1.00 1.00 H new ATOM 0 HG12 ILE A 112 67.308 -7.541 7.119 1.00 1.00 H new ATOM 0 HG13 ILE A 112 67.408 -6.004 6.283 1.00 1.00 H new ATOM 0 HG21 ILE A 112 67.800 -3.884 7.732 1.00 1.00 H new ATOM 0 HG22 ILE A 112 67.423 -3.939 9.471 1.00 1.00 H new ATOM 0 HG23 ILE A 112 68.922 -4.680 8.861 1.00 1.00 H new ATOM 0 HD11 ILE A 112 69.637 -7.110 6.354 1.00 1.00 H new ATOM 0 HD12 ILE A 112 69.670 -5.592 7.283 1.00 1.00 H new ATOM 0 HD13 ILE A 112 69.568 -7.153 8.132 1.00 1.00 H new ATOM 1681 N ASN A 113 69.017 -8.236 9.591 1.00 1.00 N ATOM 1682 CA ASN A 113 69.673 -9.488 9.266 1.00 1.00 C ATOM 1683 C ASN A 113 68.916 -10.625 9.925 1.00 1.00 C ATOM 1684 O ASN A 113 68.400 -11.500 9.250 1.00 1.00 O ATOM 1685 CB ASN A 113 71.125 -9.473 9.753 1.00 1.00 C ATOM 1686 CG ASN A 113 71.647 -10.867 10.134 1.00 1.00 C ATOM 1687 OD1 ASN A 113 71.315 -11.377 11.205 1.00 1.00 O ATOM 1688 ND2 ASN A 113 72.451 -11.507 9.328 1.00 1.00 N ATOM 0 H ASN A 113 69.629 -7.517 9.976 1.00 1.00 H new ATOM 0 HA ASN A 113 69.677 -9.625 8.185 1.00 1.00 H new ATOM 0 HB2 ASN A 113 71.760 -9.055 8.972 1.00 1.00 H new ATOM 0 HB3 ASN A 113 71.206 -8.813 10.617 1.00 1.00 H new ATOM 0 HD21 ASN A 113 72.804 -12.429 9.585 1.00 1.00 H new ATOM 0 HD22 ASN A 113 72.726 -11.085 8.441 1.00 1.00 H new ATOM 1695 N ALA A 114 68.819 -10.567 11.242 1.00 1.00 N ATOM 1696 CA ALA A 114 68.109 -11.572 12.008 1.00 1.00 C ATOM 1697 C ALA A 114 66.618 -11.538 11.701 1.00 1.00 C ATOM 1698 O ALA A 114 65.914 -12.531 11.889 1.00 1.00 O ATOM 1699 CB ALA A 114 68.351 -11.334 13.498 1.00 1.00 C ATOM 0 H ALA A 114 69.229 -9.824 11.807 1.00 1.00 H new ATOM 0 HA ALA A 114 68.483 -12.558 11.731 1.00 1.00 H new ATOM 0 HB1 ALA A 114 67.819 -12.088 14.078 1.00 1.00 H new ATOM 0 HB2 ALA A 114 69.418 -11.401 13.709 1.00 1.00 H new ATOM 0 HB3 ALA A 114 67.989 -10.343 13.772 1.00 1.00 H new ATOM 1705 N ALA A 115 66.148 -10.408 11.170 1.00 1.00 N ATOM 1706 CA ALA A 115 64.756 -10.299 10.806 1.00 1.00 C ATOM 1707 C ALA A 115 64.465 -11.047 9.499 1.00 1.00 C ATOM 1708 O ALA A 115 63.654 -11.982 9.478 1.00 1.00 O ATOM 1709 CB ALA A 115 64.378 -8.824 10.647 1.00 1.00 C ATOM 0 H ALA A 115 66.708 -9.575 10.989 1.00 1.00 H new ATOM 0 HA ALA A 115 64.161 -10.750 11.600 1.00 1.00 H new ATOM 0 HB1 ALA A 115 63.326 -8.746 10.372 1.00 1.00 H new ATOM 0 HB2 ALA A 115 64.547 -8.302 11.589 1.00 1.00 H new ATOM 0 HB3 ALA A 115 64.991 -8.373 9.867 1.00 1.00 H new ATOM 1715 N ILE A 116 65.103 -10.658 8.390 1.00 1.00 N ATOM 1716 CA ILE A 116 64.825 -11.320 7.115 1.00 1.00 C ATOM 1717 C ILE A 116 65.412 -12.725 7.062 1.00 1.00 C ATOM 1718 O ILE A 116 64.788 -13.645 6.536 1.00 1.00 O ATOM 1719 CB ILE A 116 65.374 -10.473 5.961 1.00 1.00 C ATOM 1720 CG1 ILE A 116 64.840 -11.009 4.625 1.00 1.00 C ATOM 1721 CG2 ILE A 116 66.899 -10.528 5.959 1.00 1.00 C ATOM 1722 CD1 ILE A 116 65.469 -10.227 3.463 1.00 1.00 C ATOM 0 H ILE A 116 65.795 -9.910 8.349 1.00 1.00 H new ATOM 0 HA ILE A 116 63.744 -11.416 7.018 1.00 1.00 H new ATOM 0 HB ILE A 116 65.051 -9.440 6.092 1.00 1.00 H new ATOM 0 HG12 ILE A 116 65.072 -12.070 4.529 1.00 1.00 H new ATOM 0 HG13 ILE A 116 63.754 -10.916 4.593 1.00 1.00 H new ATOM 0 HG21 ILE A 116 67.284 -9.924 5.137 1.00 1.00 H new ATOM 0 HG22 ILE A 116 67.278 -10.138 6.904 1.00 1.00 H new ATOM 0 HG23 ILE A 116 67.226 -11.560 5.835 1.00 1.00 H new ATOM 0 HD11 ILE A 116 65.087 -10.611 2.517 1.00 1.00 H new ATOM 0 HD12 ILE A 116 65.215 -9.171 3.555 1.00 1.00 H new ATOM 0 HD13 ILE A 116 66.552 -10.343 3.491 1.00 1.00 H new ATOM 1734 N GLU A 117 66.634 -12.879 7.569 1.00 1.00 N ATOM 1735 CA GLU A 117 67.288 -14.194 7.528 1.00 1.00 C ATOM 1736 C GLU A 117 66.314 -15.223 8.043 1.00 1.00 C ATOM 1737 O GLU A 117 65.971 -16.173 7.331 1.00 1.00 O ATOM 1738 CB GLU A 117 68.590 -14.251 8.366 1.00 1.00 C ATOM 1739 CG GLU A 117 69.815 -13.883 7.504 1.00 1.00 C ATOM 1740 CD GLU A 117 69.870 -12.395 7.242 1.00 1.00 C ATOM 1741 OE1 GLU A 117 70.455 -11.706 8.042 1.00 1.00 O ATOM 1742 OE2 GLU A 117 69.348 -11.973 6.227 1.00 1.00 O ATOM 0 H GLU A 117 67.182 -12.136 8.002 1.00 1.00 H new ATOM 0 HA GLU A 117 67.573 -14.393 6.495 1.00 1.00 H new ATOM 0 HB2 GLU A 117 68.515 -13.565 9.210 1.00 1.00 H new ATOM 0 HB3 GLU A 117 68.718 -15.252 8.779 1.00 1.00 H new ATOM 0 HG2 GLU A 117 70.727 -14.200 8.009 1.00 1.00 H new ATOM 0 HG3 GLU A 117 69.772 -14.421 6.557 1.00 1.00 H new ATOM 1749 N VAL A 118 65.859 -15.034 9.279 1.00 1.00 N ATOM 1750 CA VAL A 118 64.919 -15.956 9.853 1.00 1.00 C ATOM 1751 C VAL A 118 63.721 -16.088 8.939 1.00 1.00 C ATOM 1752 O VAL A 118 62.963 -17.055 9.051 1.00 1.00 O ATOM 1753 CB VAL A 118 64.476 -15.490 11.241 1.00 1.00 C ATOM 1754 CG1 VAL A 118 63.456 -16.481 11.809 1.00 1.00 C ATOM 1755 CG2 VAL A 118 65.699 -15.432 12.163 1.00 1.00 C ATOM 0 H VAL A 118 66.129 -14.259 9.884 1.00 1.00 H new ATOM 0 HA VAL A 118 65.402 -16.927 9.962 1.00 1.00 H new ATOM 0 HB VAL A 118 64.020 -14.502 11.171 1.00 1.00 H new ATOM 0 HG11 VAL A 118 63.139 -16.150 12.798 1.00 1.00 H new ATOM 0 HG12 VAL A 118 62.590 -16.531 11.149 1.00 1.00 H new ATOM 0 HG13 VAL A 118 63.911 -17.468 11.885 1.00 1.00 H new ATOM 0 HG21 VAL A 118 65.392 -15.100 13.155 1.00 1.00 H new ATOM 0 HG22 VAL A 118 66.148 -16.423 12.235 1.00 1.00 H new ATOM 0 HG23 VAL A 118 66.428 -14.732 11.756 1.00 1.00 H new ATOM 1765 N LEU A 119 63.570 -15.171 7.964 1.00 1.00 N ATOM 1766 CA LEU A 119 62.479 -15.329 7.016 1.00 1.00 C ATOM 1767 C LEU A 119 62.875 -16.428 6.027 1.00 1.00 C ATOM 1768 O LEU A 119 62.177 -17.444 5.953 1.00 1.00 O ATOM 1769 CB LEU A 119 62.177 -14.011 6.280 1.00 1.00 C ATOM 1770 CG LEU A 119 60.691 -13.939 5.863 1.00 1.00 C ATOM 1771 CD1 LEU A 119 60.323 -15.174 5.030 1.00 1.00 C ATOM 1772 CD2 LEU A 119 59.781 -13.853 7.117 1.00 1.00 C ATOM 0 H LEU A 119 64.164 -14.354 7.824 1.00 1.00 H new ATOM 0 HA LEU A 119 61.567 -15.606 7.546 1.00 1.00 H new ATOM 0 HB2 LEU A 119 62.419 -13.166 6.925 1.00 1.00 H new ATOM 0 HB3 LEU A 119 62.811 -13.930 5.397 1.00 1.00 H new ATOM 0 HG LEU A 119 60.539 -13.043 5.261 1.00 1.00 H new ATOM 0 HD11 LEU A 119 59.274 -15.117 4.739 1.00 1.00 H new ATOM 0 HD12 LEU A 119 60.946 -15.209 4.136 1.00 1.00 H new ATOM 0 HD13 LEU A 119 60.487 -16.074 5.622 1.00 1.00 H new ATOM 0 HD21 LEU A 119 58.737 -13.803 6.806 1.00 1.00 H new ATOM 0 HD22 LEU A 119 59.933 -14.736 7.738 1.00 1.00 H new ATOM 0 HD23 LEU A 119 60.033 -12.960 7.689 1.00 1.00 H new ATOM 1784 N GLY A 120 63.991 -16.284 5.256 1.00 1.00 N ATOM 1785 CA GLY A 120 64.326 -17.376 4.336 1.00 1.00 C ATOM 1786 C GLY A 120 64.758 -18.638 5.103 1.00 1.00 C ATOM 1787 O GLY A 120 63.964 -19.553 5.335 1.00 1.00 O ATOM 0 H GLY A 120 64.622 -15.483 5.257 1.00 1.00 H new ATOM 0 HA2 GLY A 120 63.463 -17.605 3.710 1.00 1.00 H new ATOM 0 HA3 GLY A 120 65.128 -17.060 3.669 1.00 1.00 H new ATOM 1791 N THR A 121 66.029 -18.659 5.481 1.00 1.00 N ATOM 1792 CA THR A 121 66.614 -19.785 6.214 1.00 1.00 C ATOM 1793 C THR A 121 67.900 -19.313 6.883 1.00 1.00 C ATOM 1794 O THR A 121 68.411 -19.933 7.819 1.00 1.00 O ATOM 1795 CB THR A 121 66.875 -20.959 5.263 1.00 1.00 C ATOM 1796 OG1 THR A 121 65.630 -21.523 4.872 1.00 1.00 O ATOM 1797 CG2 THR A 121 67.722 -22.026 5.957 1.00 1.00 C ATOM 0 H THR A 121 66.685 -17.902 5.291 1.00 1.00 H new ATOM 0 HA THR A 121 65.923 -20.136 6.980 1.00 1.00 H new ATOM 0 HB THR A 121 67.414 -20.598 4.387 1.00 1.00 H new ATOM 0 HG1 THR A 121 64.898 -21.009 5.273 1.00 1.00 H new ATOM 0 HG21 THR A 121 67.899 -22.853 5.270 1.00 1.00 H new ATOM 0 HG22 THR A 121 68.676 -21.594 6.259 1.00 1.00 H new ATOM 0 HG23 THR A 121 67.195 -22.393 6.838 1.00 1.00 H new ATOM 1805 N GLY A 122 68.390 -18.188 6.376 1.00 1.00 N ATOM 1806 CA GLY A 122 69.599 -17.519 6.837 1.00 1.00 C ATOM 1807 C GLY A 122 70.720 -17.588 5.808 1.00 1.00 C ATOM 1808 O GLY A 122 71.497 -16.644 5.706 1.00 1.00 O ATOM 0 H GLY A 122 67.938 -17.699 5.603 1.00 1.00 H new ATOM 0 HA2 GLY A 122 69.374 -16.476 7.058 1.00 1.00 H new ATOM 0 HA3 GLY A 122 69.933 -17.977 7.768 1.00 1.00 H new ATOM 1812 N THR A 123 70.838 -18.692 5.076 1.00 1.00 N ATOM 1813 CA THR A 123 71.914 -18.843 4.084 1.00 1.00 C ATOM 1814 C THR A 123 72.287 -17.517 3.419 1.00 1.00 C ATOM 1815 O THR A 123 71.669 -17.097 2.441 1.00 1.00 O ATOM 1816 CB THR A 123 71.468 -19.831 2.996 1.00 1.00 C ATOM 1817 OG1 THR A 123 72.096 -19.509 1.761 1.00 1.00 O ATOM 1818 CG2 THR A 123 69.952 -19.744 2.833 1.00 1.00 C ATOM 0 H THR A 123 70.210 -19.493 5.145 1.00 1.00 H new ATOM 0 HA THR A 123 72.793 -19.211 4.614 1.00 1.00 H new ATOM 0 HB THR A 123 71.753 -20.842 3.287 1.00 1.00 H new ATOM 0 HG1 THR A 123 71.810 -18.618 1.471 1.00 1.00 H new ATOM 0 HG21 THR A 123 69.628 -20.443 2.062 1.00 1.00 H new ATOM 0 HG22 THR A 123 69.469 -19.996 3.777 1.00 1.00 H new ATOM 0 HG23 THR A 123 69.675 -18.730 2.543 1.00 1.00 H new ATOM 1826 N ASP A 124 73.319 -16.875 3.961 1.00 1.00 N ATOM 1827 CA ASP A 124 73.809 -15.604 3.432 1.00 1.00 C ATOM 1828 C ASP A 124 75.314 -15.501 3.663 1.00 1.00 C ATOM 1829 O ASP A 124 75.830 -16.021 4.652 1.00 1.00 O ATOM 1830 CB ASP A 124 73.095 -14.440 4.113 1.00 1.00 C ATOM 1831 CG ASP A 124 71.646 -14.384 3.646 1.00 1.00 C ATOM 1832 OD1 ASP A 124 71.436 -14.359 2.446 1.00 1.00 O ATOM 1833 OD2 ASP A 124 70.769 -14.375 4.490 1.00 1.00 O ATOM 0 H ASP A 124 73.835 -17.217 4.772 1.00 1.00 H new ATOM 0 HA ASP A 124 73.605 -15.560 2.362 1.00 1.00 H new ATOM 0 HB2 ASP A 124 73.134 -14.560 5.196 1.00 1.00 H new ATOM 0 HB3 ASP A 124 73.600 -13.503 3.878 1.00 1.00 H new ATOM 1838 N TYR A 125 76.017 -14.830 2.755 1.00 1.00 N ATOM 1839 CA TYR A 125 77.466 -14.674 2.887 1.00 1.00 C ATOM 1840 C TYR A 125 77.921 -13.379 2.206 1.00 1.00 C ATOM 1841 O TYR A 125 77.336 -12.949 1.213 1.00 1.00 O ATOM 1842 CB TYR A 125 78.181 -15.906 2.253 1.00 1.00 C ATOM 1843 CG TYR A 125 79.064 -15.470 1.096 1.00 1.00 C ATOM 1844 CD1 TYR A 125 78.476 -15.073 -0.111 1.00 1.00 C ATOM 1845 CD2 TYR A 125 80.454 -15.422 1.248 1.00 1.00 C ATOM 1846 CE1 TYR A 125 79.278 -14.634 -1.170 1.00 1.00 C ATOM 1847 CE2 TYR A 125 81.256 -14.976 0.191 1.00 1.00 C ATOM 1848 CZ TYR A 125 80.668 -14.584 -1.019 1.00 1.00 C ATOM 1849 OH TYR A 125 81.460 -14.138 -2.058 1.00 1.00 O ATOM 0 H TYR A 125 75.614 -14.389 1.928 1.00 1.00 H new ATOM 0 HA TYR A 125 77.729 -14.616 3.943 1.00 1.00 H new ATOM 0 HB2 TYR A 125 78.783 -16.413 3.007 1.00 1.00 H new ATOM 0 HB3 TYR A 125 77.440 -16.624 1.902 1.00 1.00 H new ATOM 0 HD1 TYR A 125 77.402 -15.106 -0.225 1.00 1.00 H new ATOM 0 HD2 TYR A 125 80.907 -15.728 2.179 1.00 1.00 H new ATOM 0 HE1 TYR A 125 78.825 -14.334 -2.103 1.00 1.00 H new ATOM 0 HE2 TYR A 125 82.329 -14.934 0.308 1.00 1.00 H new ATOM 0 HH TYR A 125 82.401 -14.166 -1.787 1.00 1.00 H new ATOM 1859 N ARG A 126 78.995 -12.795 2.722 1.00 1.00 N ATOM 1860 CA ARG A 126 79.561 -11.584 2.138 1.00 1.00 C ATOM 1861 C ARG A 126 81.079 -11.546 2.374 1.00 1.00 C ATOM 1862 O ARG A 126 81.578 -12.083 3.362 1.00 1.00 O ATOM 1863 CB ARG A 126 78.854 -10.337 2.728 1.00 1.00 C ATOM 1864 CG ARG A 126 78.402 -9.384 1.602 1.00 1.00 C ATOM 1865 CD ARG A 126 77.162 -9.943 0.873 1.00 1.00 C ATOM 1866 NE ARG A 126 77.566 -10.840 -0.206 1.00 1.00 N ATOM 1867 CZ ARG A 126 76.664 -11.454 -0.965 1.00 1.00 C ATOM 1868 NH1 ARG A 126 75.391 -11.278 -0.736 1.00 1.00 N ATOM 1869 NH2 ARG A 126 77.050 -12.237 -1.936 1.00 1.00 N ATOM 0 H ARG A 126 79.492 -13.140 3.543 1.00 1.00 H new ATOM 0 HA ARG A 126 79.395 -11.583 1.061 1.00 1.00 H new ATOM 0 HB2 ARG A 126 77.991 -10.647 3.318 1.00 1.00 H new ATOM 0 HB3 ARG A 126 79.531 -9.814 3.404 1.00 1.00 H new ATOM 0 HG2 ARG A 126 78.172 -8.404 2.020 1.00 1.00 H new ATOM 0 HG3 ARG A 126 79.215 -9.244 0.890 1.00 1.00 H new ATOM 0 HD2 ARG A 126 76.527 -10.477 1.580 1.00 1.00 H new ATOM 0 HD3 ARG A 126 76.569 -9.122 0.469 1.00 1.00 H new ATOM 0 HE ARG A 126 78.558 -10.998 -0.380 1.00 1.00 H new ATOM 0 HH11 ARG A 126 75.089 -10.670 0.025 1.00 1.00 H new ATOM 0 HH12 ARG A 126 74.698 -11.749 -1.318 1.00 1.00 H new ATOM 0 HH21 ARG A 126 78.045 -12.378 -2.113 1.00 1.00 H new ATOM 0 HH22 ARG A 126 76.357 -12.708 -2.518 1.00 1.00 H new ATOM 1883 N PHE A 127 81.804 -10.908 1.460 1.00 1.00 N ATOM 1884 CA PHE A 127 83.257 -10.791 1.576 1.00 1.00 C ATOM 1885 C PHE A 127 83.755 -9.705 0.615 1.00 1.00 C ATOM 1886 O PHE A 127 84.825 -9.170 0.855 1.00 1.00 O ATOM 1887 CB PHE A 127 83.934 -12.152 1.276 1.00 1.00 C ATOM 1888 CG PHE A 127 85.309 -11.950 0.665 1.00 1.00 C ATOM 1889 CD1 PHE A 127 86.441 -11.842 1.483 1.00 1.00 C ATOM 1890 CD2 PHE A 127 85.440 -11.854 -0.725 1.00 1.00 C ATOM 1891 CE1 PHE A 127 87.702 -11.638 0.908 1.00 1.00 C ATOM 1892 CE2 PHE A 127 86.698 -11.655 -1.300 1.00 1.00 C ATOM 1893 CZ PHE A 127 87.830 -11.544 -0.483 1.00 1.00 C ATOM 1894 OXT PHE A 127 83.055 -9.429 -0.346 1.00 1.00 O ATOM 0 H PHE A 127 81.411 -10.464 0.630 1.00 1.00 H new ATOM 0 HA PHE A 127 83.520 -10.508 2.595 1.00 1.00 H new ATOM 0 HB2 PHE A 127 84.022 -12.730 2.196 1.00 1.00 H new ATOM 0 HB3 PHE A 127 83.310 -12.731 0.595 1.00 1.00 H new ATOM 0 HD1 PHE A 127 86.342 -11.916 2.556 1.00 1.00 H new ATOM 0 HD2 PHE A 127 84.566 -11.934 -1.355 1.00 1.00 H new ATOM 0 HE1 PHE A 127 88.575 -11.553 1.538 1.00 1.00 H new ATOM 0 HE2 PHE A 127 86.797 -11.587 -2.373 1.00 1.00 H new ATOM 0 HZ PHE A 127 88.802 -11.386 -0.926 1.00 1.00 H new