USER MOD reduce.3.24.130724 H: found=0, std=0, add=1006, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 1000 hydrogens (45 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 49 ASN : amide:sc= -4.56! C(o=-5.3!,f=-6.6!) USER MOD Set 1.2: A 54 GLN : amide:sc= -0.693 X(o=-5.3,f=-5.5!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 152:sc= 0.958 (180deg=-1.85!) USER MOD Single : A 2 SER OG : rot -45:sc= 0.57 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.0762 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 HIS : no HD1:sc= -0.421 X(o=-0.42,f=-0.83) USER MOD Single : A 39 THR OG1 : rot -150:sc= 0.0336 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 72 HIS : no HD1:sc= -3.89! C(o=-3.9!,f=-6!) USER MOD Single : A 73 MET CE :methyl -164:sc= 0 (180deg=-0.318) USER MOD Single : A 75 ASN : amide:sc= -1.02 X(o=-1,f=-1!) USER MOD Single : A 92 HIS : no HE2:sc= -8.38! C(o=-8.4!,f=-16!) USER MOD Single : A 99 GLN : amide:sc= -1.67 X(o=-1.7,f=-1.4!) USER MOD Single : A 104 TYR OH : rot 30:sc= 0.233 USER MOD Single : A 107 THR OG1 : rot -43:sc= 0.316 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=-0.066) USER MOD Single : A 113 ASN : amide:sc= 0.111 K(o=0.11,f=-0.77) USER MOD Single : A 121 THR OG1 : rot 60:sc= 0.437! USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 78.273 25.483 -22.331 1.00 1.00 N ATOM 2 CA MET A 1 78.621 24.033 -22.438 1.00 1.00 C ATOM 3 C MET A 1 77.352 23.181 -22.318 1.00 1.00 C ATOM 4 O MET A 1 76.343 23.624 -21.771 1.00 1.00 O ATOM 5 CB MET A 1 79.605 23.684 -21.301 1.00 1.00 C ATOM 6 CG MET A 1 79.334 24.593 -20.088 1.00 1.00 C ATOM 7 SD MET A 1 80.240 26.150 -20.283 1.00 1.00 S ATOM 8 CE MET A 1 80.425 26.534 -18.523 1.00 1.00 C ATOM 0 H1 MET A 1 79.084 26.007 -21.944 1.00 1.00 H new ATOM 0 H2 MET A 1 78.039 25.854 -23.274 1.00 1.00 H new ATOM 0 H3 MET A 1 77.454 25.598 -21.700 1.00 1.00 H new ATOM 0 HA MET A 1 79.082 23.828 -23.404 1.00 1.00 H new ATOM 0 HB2 MET A 1 79.492 22.638 -21.017 1.00 1.00 H new ATOM 0 HB3 MET A 1 80.632 23.813 -21.643 1.00 1.00 H new ATOM 0 HG2 MET A 1 78.266 24.790 -20.000 1.00 1.00 H new ATOM 0 HG3 MET A 1 79.643 24.093 -19.170 1.00 1.00 H new ATOM 0 HE1 MET A 1 80.967 27.473 -18.410 1.00 1.00 H new ATOM 0 HE2 MET A 1 79.440 26.626 -18.065 1.00 1.00 H new ATOM 0 HE3 MET A 1 80.980 25.734 -18.032 1.00 1.00 H new ATOM 18 N SER A 2 77.425 21.955 -22.838 1.00 1.00 N ATOM 19 CA SER A 2 76.310 21.009 -22.814 1.00 1.00 C ATOM 20 C SER A 2 76.292 20.206 -21.513 1.00 1.00 C ATOM 21 O SER A 2 75.582 19.212 -21.426 1.00 1.00 O ATOM 22 CB SER A 2 76.395 20.058 -24.010 1.00 1.00 C ATOM 23 OG SER A 2 75.162 19.358 -24.144 1.00 1.00 O ATOM 0 H SER A 2 78.263 21.589 -23.290 1.00 1.00 H new ATOM 0 HA SER A 2 75.385 21.582 -22.875 1.00 1.00 H new ATOM 0 HB2 SER A 2 76.609 20.618 -24.920 1.00 1.00 H new ATOM 0 HB3 SER A 2 77.214 19.352 -23.870 1.00 1.00 H new ATOM 0 HG SER A 2 74.869 19.040 -23.265 1.00 1.00 H new ATOM 29 N ASP A 3 77.073 20.674 -20.525 1.00 1.00 N ATOM 30 CA ASP A 3 77.170 20.047 -19.190 1.00 1.00 C ATOM 31 C ASP A 3 78.585 20.203 -18.625 1.00 1.00 C ATOM 32 O ASP A 3 79.559 19.761 -19.232 1.00 1.00 O ATOM 33 CB ASP A 3 76.803 18.542 -19.223 1.00 1.00 C ATOM 34 CG ASP A 3 75.287 18.338 -19.088 1.00 1.00 C ATOM 35 OD1 ASP A 3 74.644 19.159 -18.454 1.00 1.00 O ATOM 36 OD2 ASP A 3 74.798 17.354 -19.619 1.00 1.00 O ATOM 0 H ASP A 3 77.659 21.502 -20.628 1.00 1.00 H new ATOM 0 HA ASP A 3 76.453 20.561 -18.549 1.00 1.00 H new ATOM 0 HB2 ASP A 3 77.150 18.100 -20.157 1.00 1.00 H new ATOM 0 HB3 ASP A 3 77.316 18.022 -18.414 1.00 1.00 H new ATOM 41 N PHE A 4 78.681 20.824 -17.451 1.00 1.00 N ATOM 42 CA PHE A 4 79.978 21.017 -16.795 1.00 1.00 C ATOM 43 C PHE A 4 79.800 21.157 -15.285 1.00 1.00 C ATOM 44 O PHE A 4 78.753 21.602 -14.816 1.00 1.00 O ATOM 45 CB PHE A 4 80.693 22.246 -17.365 1.00 1.00 C ATOM 46 CG PHE A 4 82.130 22.256 -16.897 1.00 1.00 C ATOM 47 CD1 PHE A 4 83.075 21.436 -17.530 1.00 1.00 C ATOM 48 CD2 PHE A 4 82.519 23.080 -15.835 1.00 1.00 C ATOM 49 CE1 PHE A 4 84.407 21.442 -17.099 1.00 1.00 C ATOM 50 CE2 PHE A 4 83.854 23.085 -15.404 1.00 1.00 C ATOM 51 CZ PHE A 4 84.797 22.266 -16.036 1.00 1.00 C ATOM 0 H PHE A 4 77.885 21.200 -16.936 1.00 1.00 H new ATOM 0 HA PHE A 4 80.594 20.139 -16.990 1.00 1.00 H new ATOM 0 HB2 PHE A 4 80.654 22.230 -18.454 1.00 1.00 H new ATOM 0 HB3 PHE A 4 80.188 23.156 -17.042 1.00 1.00 H new ATOM 0 HD1 PHE A 4 82.775 20.800 -18.350 1.00 1.00 H new ATOM 0 HD2 PHE A 4 81.792 23.712 -15.347 1.00 1.00 H new ATOM 0 HE1 PHE A 4 85.135 20.810 -17.587 1.00 1.00 H new ATOM 0 HE2 PHE A 4 84.154 23.721 -14.584 1.00 1.00 H new ATOM 0 HZ PHE A 4 85.825 22.270 -15.704 1.00 1.00 H new ATOM 61 N ASP A 5 80.819 20.738 -14.525 1.00 1.00 N ATOM 62 CA ASP A 5 80.752 20.792 -13.059 1.00 1.00 C ATOM 63 C ASP A 5 82.169 20.930 -12.464 1.00 1.00 C ATOM 64 O ASP A 5 83.130 20.429 -13.044 1.00 1.00 O ATOM 65 CB ASP A 5 80.071 19.501 -12.532 1.00 1.00 C ATOM 66 CG ASP A 5 79.409 18.733 -13.671 1.00 1.00 C ATOM 67 OD1 ASP A 5 78.402 19.205 -14.170 1.00 1.00 O ATOM 68 OD2 ASP A 5 79.921 17.681 -14.024 1.00 1.00 O ATOM 0 H ASP A 5 81.691 20.361 -14.896 1.00 1.00 H new ATOM 0 HA ASP A 5 80.167 21.660 -12.755 1.00 1.00 H new ATOM 0 HB2 ASP A 5 80.811 18.868 -12.043 1.00 1.00 H new ATOM 0 HB3 ASP A 5 79.325 19.759 -11.780 1.00 1.00 H new ATOM 73 N THR A 6 82.298 21.621 -11.319 1.00 1.00 N ATOM 74 CA THR A 6 83.617 21.815 -10.694 1.00 1.00 C ATOM 75 C THR A 6 84.247 20.469 -10.307 1.00 1.00 C ATOM 76 O THR A 6 83.902 19.439 -10.883 1.00 1.00 O ATOM 77 CB THR A 6 83.508 22.747 -9.467 1.00 1.00 C ATOM 78 OG1 THR A 6 82.384 23.601 -9.624 1.00 1.00 O ATOM 79 CG2 THR A 6 84.778 23.604 -9.337 1.00 1.00 C ATOM 0 H THR A 6 81.521 22.048 -10.815 1.00 1.00 H new ATOM 0 HA THR A 6 84.271 22.291 -11.425 1.00 1.00 H new ATOM 0 HB THR A 6 83.393 22.139 -8.569 1.00 1.00 H new ATOM 0 HG1 THR A 6 82.311 24.192 -8.846 1.00 1.00 H new ATOM 0 HG21 THR A 6 84.689 24.257 -8.469 1.00 1.00 H new ATOM 0 HG22 THR A 6 85.645 22.954 -9.215 1.00 1.00 H new ATOM 0 HG23 THR A 6 84.902 24.210 -10.235 1.00 1.00 H new ATOM 87 N GLU A 7 85.185 20.478 -9.351 1.00 1.00 N ATOM 88 CA GLU A 7 85.844 19.255 -8.931 1.00 1.00 C ATOM 89 C GLU A 7 84.924 18.440 -8.058 1.00 1.00 C ATOM 90 O GLU A 7 84.535 17.364 -8.469 1.00 1.00 O ATOM 91 CB GLU A 7 87.152 19.588 -8.192 1.00 1.00 C ATOM 92 CG GLU A 7 86.903 20.555 -7.011 1.00 1.00 C ATOM 93 CD GLU A 7 88.102 21.493 -6.822 1.00 1.00 C ATOM 94 OE1 GLU A 7 88.116 22.537 -7.454 1.00 1.00 O ATOM 95 OE2 GLU A 7 88.989 21.146 -6.058 1.00 1.00 O ATOM 0 H GLU A 7 85.496 21.317 -8.862 1.00 1.00 H new ATOM 0 HA GLU A 7 86.089 18.662 -9.812 1.00 1.00 H new ATOM 0 HB2 GLU A 7 87.607 18.669 -7.822 1.00 1.00 H new ATOM 0 HB3 GLU A 7 87.861 20.036 -8.888 1.00 1.00 H new ATOM 0 HG2 GLU A 7 86.002 21.140 -7.196 1.00 1.00 H new ATOM 0 HG3 GLU A 7 86.732 19.986 -6.097 1.00 1.00 H new ATOM 102 N ARG A 8 84.583 18.899 -6.838 1.00 1.00 N ATOM 103 CA ARG A 8 83.739 18.138 -5.937 1.00 1.00 C ATOM 104 C ARG A 8 82.531 17.600 -6.631 1.00 1.00 C ATOM 105 O ARG A 8 82.168 16.444 -6.436 1.00 1.00 O ATOM 106 CB ARG A 8 83.295 19.147 -4.850 1.00 1.00 C ATOM 107 CG ARG A 8 82.397 18.502 -3.771 1.00 1.00 C ATOM 108 CD ARG A 8 80.899 18.731 -4.091 1.00 1.00 C ATOM 109 NE ARG A 8 80.431 20.035 -3.603 1.00 1.00 N ATOM 110 CZ ARG A 8 79.247 20.525 -3.992 1.00 1.00 C ATOM 111 NH1 ARG A 8 78.532 19.880 -4.872 1.00 1.00 N ATOM 112 NH2 ARG A 8 78.802 21.655 -3.507 1.00 1.00 N ATOM 0 H ARG A 8 84.888 19.798 -6.466 1.00 1.00 H new ATOM 0 HA ARG A 8 84.278 17.281 -5.534 1.00 1.00 H new ATOM 0 HB2 ARG A 8 84.178 19.575 -4.374 1.00 1.00 H new ATOM 0 HB3 ARG A 8 82.757 19.969 -5.321 1.00 1.00 H new ATOM 0 HG2 ARG A 8 82.602 17.433 -3.713 1.00 1.00 H new ATOM 0 HG3 ARG A 8 82.633 18.925 -2.795 1.00 1.00 H new ATOM 0 HD2 ARG A 8 80.744 18.669 -5.168 1.00 1.00 H new ATOM 0 HD3 ARG A 8 80.305 17.938 -3.637 1.00 1.00 H new ATOM 0 HE ARG A 8 81.014 20.573 -2.961 1.00 1.00 H new ATOM 0 HH11 ARG A 8 78.875 19.003 -5.264 1.00 1.00 H new ATOM 0 HH12 ARG A 8 77.630 20.253 -5.169 1.00 1.00 H new ATOM 0 HH21 ARG A 8 79.358 22.172 -2.826 1.00 1.00 H new ATOM 0 HH22 ARG A 8 77.899 22.020 -3.810 1.00 1.00 H new ATOM 126 N VAL A 9 81.911 18.416 -7.454 1.00 1.00 N ATOM 127 CA VAL A 9 80.750 17.940 -8.166 1.00 1.00 C ATOM 128 C VAL A 9 81.195 16.895 -9.191 1.00 1.00 C ATOM 129 O VAL A 9 80.670 15.786 -9.207 1.00 1.00 O ATOM 130 CB VAL A 9 79.986 19.102 -8.825 1.00 1.00 C ATOM 131 CG1 VAL A 9 78.474 18.913 -8.627 1.00 1.00 C ATOM 132 CG2 VAL A 9 80.411 20.433 -8.198 1.00 1.00 C ATOM 0 H VAL A 9 82.181 19.382 -7.642 1.00 1.00 H new ATOM 0 HA VAL A 9 80.056 17.475 -7.466 1.00 1.00 H new ATOM 0 HB VAL A 9 80.217 19.112 -9.890 1.00 1.00 H new ATOM 0 HG11 VAL A 9 77.940 19.739 -9.096 1.00 1.00 H new ATOM 0 HG12 VAL A 9 78.162 17.973 -9.083 1.00 1.00 H new ATOM 0 HG13 VAL A 9 78.246 18.892 -7.561 1.00 1.00 H new ATOM 0 HG21 VAL A 9 79.865 21.249 -8.671 1.00 1.00 H new ATOM 0 HG22 VAL A 9 80.190 20.419 -7.131 1.00 1.00 H new ATOM 0 HG23 VAL A 9 81.481 20.579 -8.345 1.00 1.00 H new ATOM 142 N SER A 10 82.168 17.233 -10.044 1.00 1.00 N ATOM 143 CA SER A 10 82.653 16.291 -11.041 1.00 1.00 C ATOM 144 C SER A 10 83.191 15.019 -10.407 1.00 1.00 C ATOM 145 O SER A 10 82.886 13.934 -10.901 1.00 1.00 O ATOM 146 CB SER A 10 83.779 16.905 -11.888 1.00 1.00 C ATOM 147 OG SER A 10 84.266 15.915 -12.784 1.00 1.00 O ATOM 0 H SER A 10 82.627 18.144 -10.060 1.00 1.00 H new ATOM 0 HA SER A 10 81.795 16.052 -11.669 1.00 1.00 H new ATOM 0 HB2 SER A 10 83.408 17.767 -12.442 1.00 1.00 H new ATOM 0 HB3 SER A 10 84.584 17.262 -11.245 1.00 1.00 H new ATOM 0 HG SER A 10 84.984 16.295 -13.332 1.00 1.00 H new ATOM 153 N ARG A 11 83.966 15.089 -9.304 1.00 1.00 N ATOM 154 CA ARG A 11 84.420 13.855 -8.710 1.00 1.00 C ATOM 155 C ARG A 11 83.245 13.251 -8.016 1.00 1.00 C ATOM 156 O ARG A 11 82.927 12.108 -8.300 1.00 1.00 O ATOM 157 CB ARG A 11 85.605 14.101 -7.747 1.00 1.00 C ATOM 158 CG ARG A 11 86.792 13.195 -8.135 1.00 1.00 C ATOM 159 CD ARG A 11 87.253 13.493 -9.583 1.00 1.00 C ATOM 160 NE ARG A 11 88.694 13.678 -9.607 1.00 1.00 N ATOM 161 CZ ARG A 11 89.515 12.637 -9.631 1.00 1.00 C ATOM 162 NH1 ARG A 11 89.030 11.426 -9.670 1.00 1.00 N ATOM 163 NH2 ARG A 11 90.805 12.827 -9.614 1.00 1.00 N ATOM 0 H ARG A 11 84.267 15.947 -8.841 1.00 1.00 H new ATOM 0 HA ARG A 11 84.797 13.170 -9.469 1.00 1.00 H new ATOM 0 HB2 ARG A 11 85.907 15.148 -7.787 1.00 1.00 H new ATOM 0 HB3 ARG A 11 85.300 13.896 -6.721 1.00 1.00 H new ATOM 0 HG2 ARG A 11 87.620 13.354 -7.444 1.00 1.00 H new ATOM 0 HG3 ARG A 11 86.501 12.148 -8.048 1.00 1.00 H new ATOM 0 HD2 ARG A 11 86.971 12.672 -10.242 1.00 1.00 H new ATOM 0 HD3 ARG A 11 86.755 14.387 -9.957 1.00 1.00 H new ATOM 0 HE ARG A 11 89.080 14.622 -9.605 1.00 1.00 H new ATOM 0 HH11 ARG A 11 88.020 11.281 -9.682 1.00 1.00 H new ATOM 0 HH12 ARG A 11 89.661 10.624 -9.689 1.00 1.00 H new ATOM 0 HH21 ARG A 11 91.181 13.775 -9.582 1.00 1.00 H new ATOM 0 HH22 ARG A 11 91.438 12.028 -9.632 1.00 1.00 H new ATOM 177 N ALA A 12 82.633 13.950 -7.016 1.00 1.00 N ATOM 178 CA ALA A 12 81.541 13.338 -6.267 1.00 1.00 C ATOM 179 C ALA A 12 80.698 12.552 -7.206 1.00 1.00 C ATOM 180 O ALA A 12 80.333 11.417 -6.903 1.00 1.00 O ATOM 181 CB ALA A 12 80.635 14.406 -5.621 1.00 1.00 C ATOM 0 H ALA A 12 82.878 14.899 -6.732 1.00 1.00 H new ATOM 0 HA ALA A 12 81.976 12.712 -5.488 1.00 1.00 H new ATOM 0 HB1 ALA A 12 79.831 13.917 -5.070 1.00 1.00 H new ATOM 0 HB2 ALA A 12 81.224 15.017 -4.937 1.00 1.00 H new ATOM 0 HB3 ALA A 12 80.209 15.040 -6.398 1.00 1.00 H new ATOM 187 N VAL A 13 80.410 13.103 -8.376 1.00 1.00 N ATOM 188 CA VAL A 13 79.641 12.299 -9.275 1.00 1.00 C ATOM 189 C VAL A 13 80.460 11.033 -9.549 1.00 1.00 C ATOM 190 O VAL A 13 79.991 9.968 -9.319 1.00 1.00 O ATOM 191 CB VAL A 13 79.309 13.002 -10.595 1.00 1.00 C ATOM 192 CG1 VAL A 13 78.636 11.981 -11.527 1.00 1.00 C ATOM 193 CG2 VAL A 13 78.337 14.164 -10.343 1.00 1.00 C ATOM 0 H VAL A 13 80.678 14.033 -8.697 1.00 1.00 H new ATOM 0 HA VAL A 13 78.679 12.080 -8.812 1.00 1.00 H new ATOM 0 HB VAL A 13 80.222 13.394 -11.044 1.00 1.00 H new ATOM 0 HG11 VAL A 13 78.390 12.460 -12.475 1.00 1.00 H new ATOM 0 HG12 VAL A 13 79.317 11.149 -11.707 1.00 1.00 H new ATOM 0 HG13 VAL A 13 77.723 11.609 -11.061 1.00 1.00 H new ATOM 0 HG21 VAL A 13 78.107 14.657 -11.287 1.00 1.00 H new ATOM 0 HG22 VAL A 13 77.418 13.780 -9.901 1.00 1.00 H new ATOM 0 HG23 VAL A 13 78.795 14.881 -9.661 1.00 1.00 H new ATOM 203 N ALA A 14 81.717 11.137 -9.955 1.00 1.00 N ATOM 204 CA ALA A 14 82.486 9.901 -10.164 1.00 1.00 C ATOM 205 C ALA A 14 82.742 9.115 -8.854 1.00 1.00 C ATOM 206 O ALA A 14 82.307 7.992 -8.745 1.00 1.00 O ATOM 207 CB ALA A 14 83.844 10.242 -10.787 1.00 1.00 C ATOM 0 H ALA A 14 82.212 12.009 -10.140 1.00 1.00 H new ATOM 0 HA ALA A 14 81.887 9.272 -10.822 1.00 1.00 H new ATOM 0 HB1 ALA A 14 84.414 9.326 -10.942 1.00 1.00 H new ATOM 0 HB2 ALA A 14 83.690 10.740 -11.744 1.00 1.00 H new ATOM 0 HB3 ALA A 14 84.395 10.903 -10.119 1.00 1.00 H new ATOM 213 N ALA A 15 83.508 9.680 -7.907 1.00 1.00 N ATOM 214 CA ALA A 15 83.861 8.904 -6.677 1.00 1.00 C ATOM 215 C ALA A 15 82.626 8.410 -5.908 1.00 1.00 C ATOM 216 O ALA A 15 82.469 7.220 -5.662 1.00 1.00 O ATOM 217 CB ALA A 15 84.721 9.734 -5.708 1.00 1.00 C ATOM 0 H ALA A 15 83.887 10.626 -7.950 1.00 1.00 H new ATOM 0 HA ALA A 15 84.423 8.043 -7.038 1.00 1.00 H new ATOM 0 HB1 ALA A 15 84.957 9.136 -4.827 1.00 1.00 H new ATOM 0 HB2 ALA A 15 85.646 10.030 -6.204 1.00 1.00 H new ATOM 0 HB3 ALA A 15 84.171 10.625 -5.405 1.00 1.00 H new ATOM 223 N ALA A 16 81.807 9.351 -5.497 1.00 1.00 N ATOM 224 CA ALA A 16 80.622 9.010 -4.710 1.00 1.00 C ATOM 225 C ALA A 16 79.681 8.091 -5.542 1.00 1.00 C ATOM 226 O ALA A 16 79.268 7.004 -5.119 1.00 1.00 O ATOM 227 CB ALA A 16 79.929 10.337 -4.298 1.00 1.00 C ATOM 0 H ALA A 16 81.927 10.346 -5.685 1.00 1.00 H new ATOM 0 HA ALA A 16 80.890 8.456 -3.811 1.00 1.00 H new ATOM 0 HB1 ALA A 16 79.040 10.115 -3.708 1.00 1.00 H new ATOM 0 HB2 ALA A 16 80.618 10.938 -3.704 1.00 1.00 H new ATOM 0 HB3 ALA A 16 79.643 10.891 -5.192 1.00 1.00 H new ATOM 233 N LEU A 17 79.346 8.598 -6.704 1.00 1.00 N ATOM 234 CA LEU A 17 78.407 7.845 -7.567 1.00 1.00 C ATOM 235 C LEU A 17 79.006 6.462 -7.832 1.00 1.00 C ATOM 236 O LEU A 17 78.335 5.452 -7.630 1.00 1.00 O ATOM 237 CB LEU A 17 78.071 8.493 -8.916 1.00 1.00 C ATOM 238 CG LEU A 17 76.875 7.782 -9.568 1.00 1.00 C ATOM 239 CD1 LEU A 17 75.580 8.045 -8.777 1.00 1.00 C ATOM 240 CD2 LEU A 17 76.711 8.302 -11.008 1.00 1.00 C ATOM 0 H LEU A 17 79.680 9.485 -7.080 1.00 1.00 H new ATOM 0 HA LEU A 17 77.466 7.813 -7.018 1.00 1.00 H new ATOM 0 HB2 LEU A 17 77.841 9.549 -8.772 1.00 1.00 H new ATOM 0 HB3 LEU A 17 78.937 8.443 -9.577 1.00 1.00 H new ATOM 0 HG LEU A 17 77.062 6.708 -9.571 1.00 1.00 H new ATOM 0 HD11 LEU A 17 74.748 7.531 -9.259 1.00 1.00 H new ATOM 0 HD12 LEU A 17 75.694 7.674 -7.758 1.00 1.00 H new ATOM 0 HD13 LEU A 17 75.379 9.116 -8.753 1.00 1.00 H new ATOM 0 HD21 LEU A 17 75.864 7.804 -11.481 1.00 1.00 H new ATOM 0 HD22 LEU A 17 76.534 9.377 -10.989 1.00 1.00 H new ATOM 0 HD23 LEU A 17 77.618 8.093 -11.576 1.00 1.00 H new ATOM 252 N VAL A 18 80.269 6.410 -8.277 1.00 1.00 N ATOM 253 CA VAL A 18 80.878 5.099 -8.534 1.00 1.00 C ATOM 254 C VAL A 18 81.136 4.366 -7.209 1.00 1.00 C ATOM 255 O VAL A 18 80.677 3.235 -7.021 1.00 1.00 O ATOM 256 CB VAL A 18 82.176 5.199 -9.389 1.00 1.00 C ATOM 257 CG1 VAL A 18 81.971 6.185 -10.585 1.00 1.00 C ATOM 258 CG2 VAL A 18 83.405 5.629 -8.540 1.00 1.00 C ATOM 0 H VAL A 18 80.864 7.218 -8.459 1.00 1.00 H new ATOM 0 HA VAL A 18 80.169 4.519 -9.125 1.00 1.00 H new ATOM 0 HB VAL A 18 82.382 4.202 -9.779 1.00 1.00 H new ATOM 0 HG11 VAL A 18 82.888 6.242 -11.171 1.00 1.00 H new ATOM 0 HG12 VAL A 18 81.158 5.827 -11.217 1.00 1.00 H new ATOM 0 HG13 VAL A 18 81.723 7.175 -10.202 1.00 1.00 H new ATOM 0 HG21 VAL A 18 84.287 5.685 -9.179 1.00 1.00 H new ATOM 0 HG22 VAL A 18 83.216 6.606 -8.095 1.00 1.00 H new ATOM 0 HG23 VAL A 18 83.575 4.898 -7.750 1.00 1.00 H new ATOM 268 N GLY A 19 81.899 4.991 -6.313 1.00 1.00 N ATOM 269 CA GLY A 19 82.245 4.383 -5.048 1.00 1.00 C ATOM 270 C GLY A 19 81.018 4.099 -4.209 1.00 1.00 C ATOM 271 O GLY A 19 79.888 4.323 -4.646 1.00 1.00 O ATOM 0 H GLY A 19 82.287 5.924 -6.450 1.00 1.00 H new ATOM 0 HA2 GLY A 19 82.786 3.454 -5.227 1.00 1.00 H new ATOM 0 HA3 GLY A 19 82.917 5.043 -4.499 1.00 1.00 H new ATOM 275 N PRO A 20 81.221 3.597 -3.024 1.00 1.00 N ATOM 276 CA PRO A 20 80.126 3.253 -2.098 1.00 1.00 C ATOM 277 C PRO A 20 79.633 4.465 -1.320 1.00 1.00 C ATOM 278 O PRO A 20 78.526 4.458 -0.815 1.00 1.00 O ATOM 279 CB PRO A 20 80.742 2.194 -1.175 1.00 1.00 C ATOM 280 CG PRO A 20 82.226 2.452 -1.193 1.00 1.00 C ATOM 281 CD PRO A 20 82.531 3.343 -2.411 1.00 1.00 C ATOM 0 HA PRO A 20 79.242 2.888 -2.621 1.00 1.00 H new ATOM 0 HB2 PRO A 20 80.343 2.275 -0.164 1.00 1.00 H new ATOM 0 HB3 PRO A 20 80.515 1.188 -1.527 1.00 1.00 H new ATOM 0 HG2 PRO A 20 82.540 2.943 -0.272 1.00 1.00 H new ATOM 0 HG3 PRO A 20 82.777 1.514 -1.258 1.00 1.00 H new ATOM 0 HD2 PRO A 20 83.015 4.273 -2.111 1.00 1.00 H new ATOM 0 HD3 PRO A 20 83.204 2.844 -3.108 1.00 1.00 H new ATOM 289 N GLY A 21 80.492 5.478 -1.185 1.00 1.00 N ATOM 290 CA GLY A 21 80.119 6.660 -0.390 1.00 1.00 C ATOM 291 C GLY A 21 78.879 7.354 -0.970 1.00 1.00 C ATOM 292 O GLY A 21 77.866 7.510 -0.297 1.00 1.00 O ATOM 0 H GLY A 21 81.423 5.510 -1.600 1.00 1.00 H new ATOM 0 HA2 GLY A 21 79.923 6.361 0.640 1.00 1.00 H new ATOM 0 HA3 GLY A 21 80.953 7.362 -0.365 1.00 1.00 H new ATOM 296 N GLY A 22 78.980 7.783 -2.214 1.00 1.00 N ATOM 297 CA GLY A 22 77.847 8.489 -2.828 1.00 1.00 C ATOM 298 C GLY A 22 76.656 7.582 -2.729 1.00 1.00 C ATOM 299 O GLY A 22 75.596 7.964 -2.241 1.00 1.00 O ATOM 0 H GLY A 22 79.799 7.666 -2.810 1.00 1.00 H new ATOM 0 HA2 GLY A 22 77.657 9.432 -2.315 1.00 1.00 H new ATOM 0 HA3 GLY A 22 78.062 8.730 -3.869 1.00 1.00 H new ATOM 303 N VAL A 23 76.841 6.377 -3.205 1.00 1.00 N ATOM 304 CA VAL A 23 75.760 5.411 -3.160 1.00 1.00 C ATOM 305 C VAL A 23 75.335 5.195 -1.692 1.00 1.00 C ATOM 306 O VAL A 23 74.161 4.960 -1.418 1.00 1.00 O ATOM 307 CB VAL A 23 76.147 4.082 -3.824 1.00 1.00 C ATOM 308 CG1 VAL A 23 74.921 3.164 -3.866 1.00 1.00 C ATOM 309 CG2 VAL A 23 76.624 4.323 -5.262 1.00 1.00 C ATOM 0 H VAL A 23 77.709 6.041 -3.621 1.00 1.00 H new ATOM 0 HA VAL A 23 74.918 5.807 -3.728 1.00 1.00 H new ATOM 0 HB VAL A 23 76.950 3.623 -3.247 1.00 1.00 H new ATOM 0 HG11 VAL A 23 75.190 2.219 -4.337 1.00 1.00 H new ATOM 0 HG12 VAL A 23 74.571 2.977 -2.851 1.00 1.00 H new ATOM 0 HG13 VAL A 23 74.128 3.642 -4.441 1.00 1.00 H new ATOM 0 HG21 VAL A 23 76.895 3.372 -5.720 1.00 1.00 H new ATOM 0 HG22 VAL A 23 75.824 4.788 -5.838 1.00 1.00 H new ATOM 0 HG23 VAL A 23 77.493 4.981 -5.252 1.00 1.00 H new ATOM 319 N ALA A 24 76.305 5.281 -0.754 1.00 1.00 N ATOM 320 CA ALA A 24 75.954 5.080 0.669 1.00 1.00 C ATOM 321 C ALA A 24 74.831 6.046 1.091 1.00 1.00 C ATOM 322 O ALA A 24 73.761 5.599 1.496 1.00 1.00 O ATOM 323 CB ALA A 24 77.147 5.316 1.612 1.00 1.00 C ATOM 0 H ALA A 24 77.288 5.478 -0.941 1.00 1.00 H new ATOM 0 HA ALA A 24 75.633 4.042 0.754 1.00 1.00 H new ATOM 0 HB1 ALA A 24 76.833 5.155 2.643 1.00 1.00 H new ATOM 0 HB2 ALA A 24 77.950 4.621 1.364 1.00 1.00 H new ATOM 0 HB3 ALA A 24 77.505 6.339 1.497 1.00 1.00 H new ATOM 329 N LEU A 25 75.067 7.369 1.036 1.00 1.00 N ATOM 330 CA LEU A 25 74.039 8.312 1.474 1.00 1.00 C ATOM 331 C LEU A 25 72.790 8.244 0.617 1.00 1.00 C ATOM 332 O LEU A 25 71.682 8.300 1.143 1.00 1.00 O ATOM 333 CB LEU A 25 74.586 9.744 1.445 1.00 1.00 C ATOM 334 CG LEU A 25 75.571 9.967 2.613 1.00 1.00 C ATOM 335 CD1 LEU A 25 76.551 11.094 2.265 1.00 1.00 C ATOM 336 CD2 LEU A 25 74.807 10.361 3.888 1.00 1.00 C ATOM 0 H LEU A 25 75.933 7.793 0.703 1.00 1.00 H new ATOM 0 HA LEU A 25 73.767 8.031 2.491 1.00 1.00 H new ATOM 0 HB2 LEU A 25 75.089 9.929 0.496 1.00 1.00 H new ATOM 0 HB3 LEU A 25 73.763 10.456 1.513 1.00 1.00 H new ATOM 0 HG LEU A 25 76.115 9.038 2.782 1.00 1.00 H new ATOM 0 HD11 LEU A 25 77.242 11.244 3.094 1.00 1.00 H new ATOM 0 HD12 LEU A 25 77.112 10.825 1.370 1.00 1.00 H new ATOM 0 HD13 LEU A 25 75.997 12.015 2.083 1.00 1.00 H new ATOM 0 HD21 LEU A 25 75.514 10.515 4.703 1.00 1.00 H new ATOM 0 HD22 LEU A 25 74.252 11.282 3.710 1.00 1.00 H new ATOM 0 HD23 LEU A 25 74.112 9.565 4.156 1.00 1.00 H new ATOM 348 N VAL A 26 72.948 8.166 -0.689 1.00 1.00 N ATOM 349 CA VAL A 26 71.768 8.153 -1.531 1.00 1.00 C ATOM 350 C VAL A 26 70.872 6.961 -1.210 1.00 1.00 C ATOM 351 O VAL A 26 69.710 7.147 -0.858 1.00 1.00 O ATOM 352 CB VAL A 26 72.220 8.087 -2.980 1.00 1.00 C ATOM 353 CG1 VAL A 26 71.008 7.969 -3.902 1.00 1.00 C ATOM 354 CG2 VAL A 26 73.000 9.366 -3.302 1.00 1.00 C ATOM 0 H VAL A 26 73.843 8.113 -1.176 1.00 1.00 H new ATOM 0 HA VAL A 26 71.187 9.058 -1.351 1.00 1.00 H new ATOM 0 HB VAL A 26 72.854 7.214 -3.133 1.00 1.00 H new ATOM 0 HG11 VAL A 26 71.342 7.922 -4.938 1.00 1.00 H new ATOM 0 HG12 VAL A 26 70.453 7.063 -3.659 1.00 1.00 H new ATOM 0 HG13 VAL A 26 70.363 8.837 -3.768 1.00 1.00 H new ATOM 0 HG21 VAL A 26 73.333 9.337 -4.339 1.00 1.00 H new ATOM 0 HG22 VAL A 26 72.356 10.232 -3.152 1.00 1.00 H new ATOM 0 HG23 VAL A 26 73.866 9.439 -2.644 1.00 1.00 H new ATOM 364 N VAL A 27 71.380 5.740 -1.364 1.00 1.00 N ATOM 365 CA VAL A 27 70.574 4.546 -1.129 1.00 1.00 C ATOM 366 C VAL A 27 70.036 4.471 0.295 1.00 1.00 C ATOM 367 O VAL A 27 68.937 3.969 0.532 1.00 1.00 O ATOM 368 CB VAL A 27 71.431 3.311 -1.452 1.00 1.00 C ATOM 369 CG1 VAL A 27 72.368 2.985 -0.277 1.00 1.00 C ATOM 370 CG2 VAL A 27 70.532 2.103 -1.721 1.00 1.00 C ATOM 0 H VAL A 27 72.341 5.553 -1.649 1.00 1.00 H new ATOM 0 HA VAL A 27 69.700 4.586 -1.779 1.00 1.00 H new ATOM 0 HB VAL A 27 72.026 3.531 -2.338 1.00 1.00 H new ATOM 0 HG11 VAL A 27 72.967 2.108 -0.522 1.00 1.00 H new ATOM 0 HG12 VAL A 27 73.026 3.834 -0.090 1.00 1.00 H new ATOM 0 HG13 VAL A 27 71.776 2.782 0.615 1.00 1.00 H new ATOM 0 HG21 VAL A 27 71.149 1.234 -1.949 1.00 1.00 H new ATOM 0 HG22 VAL A 27 69.926 1.897 -0.839 1.00 1.00 H new ATOM 0 HG23 VAL A 27 69.879 2.316 -2.568 1.00 1.00 H new ATOM 380 N LYS A 28 70.818 4.957 1.230 1.00 1.00 N ATOM 381 CA LYS A 28 70.406 4.929 2.617 1.00 1.00 C ATOM 382 C LYS A 28 69.219 5.853 2.792 1.00 1.00 C ATOM 383 O LYS A 28 68.172 5.485 3.321 1.00 1.00 O ATOM 384 CB LYS A 28 71.556 5.441 3.482 1.00 1.00 C ATOM 385 CG LYS A 28 71.192 5.337 4.959 1.00 1.00 C ATOM 386 CD LYS A 28 72.291 5.990 5.790 1.00 1.00 C ATOM 387 CE LYS A 28 71.943 5.877 7.275 1.00 1.00 C ATOM 388 NZ LYS A 28 72.698 6.909 8.033 1.00 1.00 N ATOM 0 H LYS A 28 71.734 5.373 1.061 1.00 1.00 H new ATOM 0 HA LYS A 28 70.139 3.913 2.908 1.00 1.00 H new ATOM 0 HB2 LYS A 28 72.457 4.862 3.281 1.00 1.00 H new ATOM 0 HB3 LYS A 28 71.779 6.477 3.227 1.00 1.00 H new ATOM 0 HG2 LYS A 28 70.237 5.828 5.146 1.00 1.00 H new ATOM 0 HG3 LYS A 28 71.075 4.292 5.245 1.00 1.00 H new ATOM 0 HD2 LYS A 28 73.247 5.506 5.592 1.00 1.00 H new ATOM 0 HD3 LYS A 28 72.400 7.038 5.510 1.00 1.00 H new ATOM 0 HE2 LYS A 28 70.871 6.012 7.421 1.00 1.00 H new ATOM 0 HE3 LYS A 28 72.192 4.882 7.645 1.00 1.00 H new ATOM 0 HZ1 LYS A 28 72.465 6.837 9.044 1.00 1.00 H new ATOM 0 HZ2 LYS A 28 73.719 6.759 7.901 1.00 1.00 H new ATOM 0 HZ3 LYS A 28 72.439 7.854 7.685 1.00 1.00 H new ATOM 402 N VAL A 29 69.440 7.074 2.373 1.00 1.00 N ATOM 403 CA VAL A 29 68.409 8.084 2.538 1.00 1.00 C ATOM 404 C VAL A 29 67.169 7.712 1.746 1.00 1.00 C ATOM 405 O VAL A 29 66.066 7.772 2.279 1.00 1.00 O ATOM 406 CB VAL A 29 68.873 9.495 2.161 1.00 1.00 C ATOM 407 CG1 VAL A 29 67.677 10.457 2.288 1.00 1.00 C ATOM 408 CG2 VAL A 29 69.960 9.951 3.133 1.00 1.00 C ATOM 0 H VAL A 29 70.299 7.394 1.926 1.00 1.00 H new ATOM 0 HA VAL A 29 68.173 8.108 3.602 1.00 1.00 H new ATOM 0 HB VAL A 29 69.261 9.493 1.143 1.00 1.00 H new ATOM 0 HG11 VAL A 29 67.992 11.466 2.023 1.00 1.00 H new ATOM 0 HG12 VAL A 29 66.880 10.137 1.617 1.00 1.00 H new ATOM 0 HG13 VAL A 29 67.311 10.449 3.315 1.00 1.00 H new ATOM 0 HG21 VAL A 29 70.290 10.955 2.865 1.00 1.00 H new ATOM 0 HG22 VAL A 29 69.561 9.959 4.147 1.00 1.00 H new ATOM 0 HG23 VAL A 29 70.805 9.265 3.081 1.00 1.00 H new ATOM 418 N CYS A 30 67.326 7.328 0.480 1.00 1.00 N ATOM 419 CA CYS A 30 66.148 6.975 -0.294 1.00 1.00 C ATOM 420 C CYS A 30 65.517 5.691 0.258 1.00 1.00 C ATOM 421 O CYS A 30 64.354 5.704 0.652 1.00 1.00 O ATOM 422 CB CYS A 30 66.542 6.833 -1.792 1.00 1.00 C ATOM 423 SG CYS A 30 66.119 5.199 -2.462 1.00 1.00 S ATOM 0 H CYS A 30 68.217 7.256 -0.010 1.00 1.00 H new ATOM 0 HA CYS A 30 65.399 7.762 -0.213 1.00 1.00 H new ATOM 0 HB2 CYS A 30 66.036 7.604 -2.373 1.00 1.00 H new ATOM 0 HB3 CYS A 30 67.613 7.002 -1.902 1.00 1.00 H new ATOM 428 N ALA A 31 66.246 4.574 0.247 1.00 1.00 N ATOM 429 CA ALA A 31 65.698 3.302 0.693 1.00 1.00 C ATOM 430 C ALA A 31 65.258 3.351 2.136 1.00 1.00 C ATOM 431 O ALA A 31 64.126 2.998 2.458 1.00 1.00 O ATOM 432 CB ALA A 31 66.778 2.218 0.516 1.00 1.00 C ATOM 0 H ALA A 31 67.216 4.529 -0.066 1.00 1.00 H new ATOM 0 HA ALA A 31 64.816 3.074 0.094 1.00 1.00 H new ATOM 0 HB1 ALA A 31 66.385 1.256 0.845 1.00 1.00 H new ATOM 0 HB2 ALA A 31 67.060 2.154 -0.535 1.00 1.00 H new ATOM 0 HB3 ALA A 31 67.653 2.476 1.112 1.00 1.00 H new ATOM 438 N GLY A 32 66.165 3.760 3.010 1.00 1.00 N ATOM 439 CA GLY A 32 65.862 3.816 4.427 1.00 1.00 C ATOM 440 C GLY A 32 66.162 2.458 5.042 1.00 1.00 C ATOM 441 O GLY A 32 65.246 1.696 5.343 1.00 1.00 O ATOM 0 H GLY A 32 67.110 4.055 2.763 1.00 1.00 H new ATOM 0 HA2 GLY A 32 66.458 4.590 4.911 1.00 1.00 H new ATOM 0 HA3 GLY A 32 64.815 4.077 4.580 1.00 1.00 H new ATOM 445 N LEU A 33 67.456 2.162 5.208 1.00 1.00 N ATOM 446 CA LEU A 33 67.897 0.887 5.774 1.00 1.00 C ATOM 447 C LEU A 33 67.997 -0.188 4.668 1.00 1.00 C ATOM 448 O LEU A 33 67.056 -0.951 4.446 1.00 1.00 O ATOM 449 CB LEU A 33 66.922 0.434 6.876 1.00 1.00 C ATOM 450 CG LEU A 33 67.661 -0.400 7.920 1.00 1.00 C ATOM 451 CD1 LEU A 33 66.655 -0.940 8.931 1.00 1.00 C ATOM 452 CD2 LEU A 33 68.378 -1.565 7.231 1.00 1.00 C ATOM 0 H LEU A 33 68.217 2.793 4.956 1.00 1.00 H new ATOM 0 HA LEU A 33 68.885 1.021 6.213 1.00 1.00 H new ATOM 0 HB2 LEU A 33 66.467 1.304 7.350 1.00 1.00 H new ATOM 0 HB3 LEU A 33 66.113 -0.151 6.439 1.00 1.00 H new ATOM 0 HG LEU A 33 68.397 0.219 8.433 1.00 1.00 H new ATOM 0 HD11 LEU A 33 67.176 -1.537 9.680 1.00 1.00 H new ATOM 0 HD12 LEU A 33 66.147 -0.108 9.419 1.00 1.00 H new ATOM 0 HD13 LEU A 33 65.921 -1.562 8.418 1.00 1.00 H new ATOM 0 HD21 LEU A 33 68.905 -2.160 7.977 1.00 1.00 H new ATOM 0 HD22 LEU A 33 67.647 -2.190 6.719 1.00 1.00 H new ATOM 0 HD23 LEU A 33 69.093 -1.175 6.506 1.00 1.00 H new ATOM 464 N PRO A 34 69.111 -0.256 3.973 1.00 1.00 N ATOM 465 CA PRO A 34 69.327 -1.251 2.869 1.00 1.00 C ATOM 466 C PRO A 34 69.066 -2.713 3.276 1.00 1.00 C ATOM 467 O PRO A 34 68.686 -3.527 2.434 1.00 1.00 O ATOM 468 CB PRO A 34 70.802 -1.046 2.474 1.00 1.00 C ATOM 469 CG PRO A 34 71.127 0.350 2.895 1.00 1.00 C ATOM 470 CD PRO A 34 70.286 0.619 4.144 1.00 1.00 C ATOM 0 HA PRO A 34 68.622 -1.083 2.055 1.00 1.00 H new ATOM 0 HB2 PRO A 34 71.448 -1.769 2.973 1.00 1.00 H new ATOM 0 HB3 PRO A 34 70.945 -1.178 1.401 1.00 1.00 H new ATOM 0 HG2 PRO A 34 72.190 0.455 3.110 1.00 1.00 H new ATOM 0 HG3 PRO A 34 70.890 1.062 2.104 1.00 1.00 H new ATOM 0 HD2 PRO A 34 70.834 0.379 5.055 1.00 1.00 H new ATOM 0 HD3 PRO A 34 69.997 1.668 4.213 1.00 1.00 H new ATOM 478 N GLY A 35 69.294 -3.055 4.544 1.00 1.00 N ATOM 479 CA GLY A 35 69.083 -4.449 4.956 1.00 1.00 C ATOM 480 C GLY A 35 67.648 -4.876 4.655 1.00 1.00 C ATOM 481 O GLY A 35 67.412 -5.786 3.860 1.00 1.00 O ATOM 0 H GLY A 35 69.611 -2.421 5.278 1.00 1.00 H new ATOM 0 HA2 GLY A 35 69.782 -5.101 4.431 1.00 1.00 H new ATOM 0 HA3 GLY A 35 69.286 -4.556 6.022 1.00 1.00 H new ATOM 485 N VAL A 36 66.696 -4.187 5.267 1.00 1.00 N ATOM 486 CA VAL A 36 65.282 -4.470 5.023 1.00 1.00 C ATOM 487 C VAL A 36 64.888 -3.609 3.843 1.00 1.00 C ATOM 488 O VAL A 36 65.599 -2.652 3.574 1.00 1.00 O ATOM 489 CB VAL A 36 64.410 -4.145 6.266 1.00 1.00 C ATOM 490 CG1 VAL A 36 64.104 -2.641 6.334 1.00 1.00 C ATOM 491 CG2 VAL A 36 63.081 -4.926 6.202 1.00 1.00 C ATOM 0 H VAL A 36 66.871 -3.433 5.932 1.00 1.00 H new ATOM 0 HA VAL A 36 65.124 -5.529 4.819 1.00 1.00 H new ATOM 0 HB VAL A 36 64.967 -4.439 7.156 1.00 1.00 H new ATOM 0 HG11 VAL A 36 63.492 -2.434 7.212 1.00 1.00 H new ATOM 0 HG12 VAL A 36 65.038 -2.082 6.402 1.00 1.00 H new ATOM 0 HG13 VAL A 36 63.565 -2.338 5.436 1.00 1.00 H new ATOM 0 HG21 VAL A 36 62.478 -4.690 7.079 1.00 1.00 H new ATOM 0 HG22 VAL A 36 62.537 -4.645 5.301 1.00 1.00 H new ATOM 0 HG23 VAL A 36 63.288 -5.996 6.181 1.00 1.00 H new ATOM 501 N ILE A 37 63.783 -3.955 3.163 1.00 1.00 N ATOM 502 CA ILE A 37 63.272 -3.207 1.994 1.00 1.00 C ATOM 503 C ILE A 37 63.099 -4.141 0.800 1.00 1.00 C ATOM 504 O ILE A 37 64.078 -4.651 0.256 1.00 1.00 O ATOM 505 CB ILE A 37 64.174 -2.024 1.554 1.00 1.00 C ATOM 506 CG1 ILE A 37 63.424 -1.158 0.486 1.00 1.00 C ATOM 507 CG2 ILE A 37 65.501 -2.565 0.955 1.00 1.00 C ATOM 508 CD1 ILE A 37 63.222 0.270 1.009 1.00 1.00 C ATOM 0 H ILE A 37 63.213 -4.765 3.407 1.00 1.00 H new ATOM 0 HA ILE A 37 62.318 -2.790 2.317 1.00 1.00 H new ATOM 0 HB ILE A 37 64.402 -1.406 2.422 1.00 1.00 H new ATOM 0 HG12 ILE A 37 63.996 -1.136 -0.442 1.00 1.00 H new ATOM 0 HG13 ILE A 37 62.459 -1.608 0.255 1.00 1.00 H new ATOM 0 HG21 ILE A 37 66.129 -1.729 0.648 1.00 1.00 H new ATOM 0 HG22 ILE A 37 66.025 -3.156 1.706 1.00 1.00 H new ATOM 0 HG23 ILE A 37 65.281 -3.190 0.090 1.00 1.00 H new ATOM 0 HD11 ILE A 37 62.700 0.862 0.258 1.00 1.00 H new ATOM 0 HD12 ILE A 37 62.631 0.242 1.924 1.00 1.00 H new ATOM 0 HD13 ILE A 37 64.192 0.722 1.217 1.00 1.00 H new ATOM 520 N HIS A 38 61.851 -4.355 0.379 1.00 1.00 N ATOM 521 CA HIS A 38 61.556 -5.220 -0.769 1.00 1.00 C ATOM 522 C HIS A 38 60.444 -4.573 -1.592 1.00 1.00 C ATOM 523 O HIS A 38 59.428 -4.154 -1.039 1.00 1.00 O ATOM 524 CB HIS A 38 61.103 -6.594 -0.277 1.00 1.00 C ATOM 525 CG HIS A 38 62.028 -7.057 0.813 1.00 1.00 C ATOM 526 ND1 HIS A 38 61.784 -6.795 2.154 1.00 1.00 N ATOM 527 CD2 HIS A 38 63.213 -7.748 0.779 1.00 1.00 C ATOM 528 CE1 HIS A 38 62.801 -7.320 2.862 1.00 1.00 C ATOM 529 NE2 HIS A 38 63.700 -7.911 2.071 1.00 1.00 N ATOM 0 H HIS A 38 61.027 -3.942 0.815 1.00 1.00 H new ATOM 0 HA HIS A 38 62.449 -5.344 -1.382 1.00 1.00 H new ATOM 0 HB2 HIS A 38 60.080 -6.541 0.096 1.00 1.00 H new ATOM 0 HB3 HIS A 38 61.106 -7.308 -1.101 1.00 1.00 H new ATOM 0 HD2 HIS A 38 63.695 -8.111 -0.117 1.00 1.00 H new ATOM 0 HE1 HIS A 38 62.880 -7.270 3.938 1.00 1.00 H new ATOM 0 HE2 HIS A 38 64.560 -8.381 2.354 1.00 1.00 H new ATOM 537 N THR A 39 60.636 -4.491 -2.910 1.00 1.00 N ATOM 538 CA THR A 39 59.636 -3.877 -3.793 1.00 1.00 C ATOM 539 C THR A 39 58.778 -4.953 -4.474 1.00 1.00 C ATOM 540 O THR A 39 59.254 -6.064 -4.716 1.00 1.00 O ATOM 541 CB THR A 39 60.352 -3.035 -4.852 1.00 1.00 C ATOM 542 OG1 THR A 39 61.463 -3.764 -5.352 1.00 1.00 O ATOM 543 CG2 THR A 39 60.848 -1.728 -4.223 1.00 1.00 C ATOM 0 H THR A 39 61.467 -4.838 -3.389 1.00 1.00 H new ATOM 0 HA THR A 39 58.979 -3.243 -3.198 1.00 1.00 H new ATOM 0 HB THR A 39 59.661 -2.807 -5.664 1.00 1.00 H new ATOM 0 HG1 THR A 39 62.166 -3.140 -5.629 1.00 1.00 H new ATOM 0 HG21 THR A 39 61.357 -1.131 -4.979 1.00 1.00 H new ATOM 0 HG22 THR A 39 59.999 -1.169 -3.830 1.00 1.00 H new ATOM 0 HG23 THR A 39 61.541 -1.954 -3.412 1.00 1.00 H new ATOM 551 N PRO A 40 57.530 -4.662 -4.778 1.00 1.00 N ATOM 552 CA PRO A 40 56.614 -5.650 -5.424 1.00 1.00 C ATOM 553 C PRO A 40 56.904 -5.863 -6.917 1.00 1.00 C ATOM 554 O PRO A 40 56.824 -6.986 -7.411 1.00 1.00 O ATOM 555 CB PRO A 40 55.225 -5.009 -5.223 1.00 1.00 C ATOM 556 CG PRO A 40 55.493 -3.542 -5.238 1.00 1.00 C ATOM 557 CD PRO A 40 56.846 -3.369 -4.547 1.00 1.00 C ATOM 0 HA PRO A 40 56.718 -6.644 -4.990 1.00 1.00 H new ATOM 0 HB2 PRO A 40 54.535 -5.296 -6.017 1.00 1.00 H new ATOM 0 HB3 PRO A 40 54.775 -5.322 -4.281 1.00 1.00 H new ATOM 0 HG2 PRO A 40 55.521 -3.158 -6.258 1.00 1.00 H new ATOM 0 HG3 PRO A 40 54.711 -2.994 -4.713 1.00 1.00 H new ATOM 0 HD2 PRO A 40 57.409 -2.538 -4.972 1.00 1.00 H new ATOM 0 HD3 PRO A 40 56.728 -3.163 -3.483 1.00 1.00 H new ATOM 565 N ALA A 41 57.257 -4.784 -7.626 1.00 1.00 N ATOM 566 CA ALA A 41 57.569 -4.857 -9.063 1.00 1.00 C ATOM 567 C ALA A 41 58.913 -4.214 -9.377 1.00 1.00 C ATOM 568 O ALA A 41 59.187 -3.106 -8.913 1.00 1.00 O ATOM 569 CB ALA A 41 56.483 -4.159 -9.869 1.00 1.00 C ATOM 0 H ALA A 41 57.334 -3.847 -7.229 1.00 1.00 H new ATOM 0 HA ALA A 41 57.617 -5.911 -9.335 1.00 1.00 H new ATOM 0 HB1 ALA A 41 56.723 -4.218 -10.931 1.00 1.00 H new ATOM 0 HB2 ALA A 41 55.525 -4.645 -9.686 1.00 1.00 H new ATOM 0 HB3 ALA A 41 56.423 -3.113 -9.569 1.00 1.00 H new ATOM 575 N ARG A 42 59.746 -4.863 -10.177 1.00 1.00 N ATOM 576 CA ARG A 42 61.025 -4.273 -10.533 1.00 1.00 C ATOM 577 C ARG A 42 61.675 -5.088 -11.645 1.00 1.00 C ATOM 578 O ARG A 42 61.264 -6.210 -11.931 1.00 1.00 O ATOM 579 CB ARG A 42 61.939 -4.200 -9.275 1.00 1.00 C ATOM 580 CG ARG A 42 62.310 -2.731 -8.888 1.00 1.00 C ATOM 581 CD ARG A 42 63.776 -2.441 -9.229 1.00 1.00 C ATOM 582 NE ARG A 42 64.654 -3.363 -8.517 1.00 1.00 N ATOM 583 CZ ARG A 42 64.885 -3.227 -7.214 1.00 1.00 C ATOM 584 NH1 ARG A 42 64.349 -2.238 -6.558 1.00 1.00 N ATOM 585 NH2 ARG A 42 65.656 -4.080 -6.593 1.00 1.00 N ATOM 0 H ARG A 42 59.564 -5.780 -10.584 1.00 1.00 H new ATOM 0 HA ARG A 42 60.874 -3.258 -10.900 1.00 1.00 H new ATOM 0 HB2 ARG A 42 61.434 -4.677 -8.435 1.00 1.00 H new ATOM 0 HB3 ARG A 42 62.852 -4.765 -9.460 1.00 1.00 H new ATOM 0 HG2 ARG A 42 61.662 -2.034 -9.419 1.00 1.00 H new ATOM 0 HG3 ARG A 42 62.140 -2.575 -7.823 1.00 1.00 H new ATOM 0 HD2 ARG A 42 63.932 -2.536 -10.304 1.00 1.00 H new ATOM 0 HD3 ARG A 42 64.022 -1.414 -8.961 1.00 1.00 H new ATOM 0 HE ARG A 42 65.099 -4.126 -9.027 1.00 1.00 H new ATOM 0 HH11 ARG A 42 63.752 -1.568 -7.043 1.00 1.00 H new ATOM 0 HH12 ARG A 42 64.526 -2.133 -5.559 1.00 1.00 H new ATOM 0 HH21 ARG A 42 66.082 -4.851 -7.107 1.00 1.00 H new ATOM 0 HH22 ARG A 42 65.832 -3.975 -5.594 1.00 1.00 H new ATOM 599 N ARG A 43 62.690 -4.507 -12.256 1.00 1.00 N ATOM 600 CA ARG A 43 63.390 -5.191 -13.330 1.00 1.00 C ATOM 601 C ARG A 43 64.041 -6.496 -12.810 1.00 1.00 C ATOM 602 O ARG A 43 65.021 -6.975 -13.375 1.00 1.00 O ATOM 603 CB ARG A 43 64.437 -4.258 -13.969 1.00 1.00 C ATOM 604 CG ARG A 43 64.771 -4.739 -15.399 1.00 1.00 C ATOM 605 CD ARG A 43 63.742 -4.200 -16.428 1.00 1.00 C ATOM 606 NE ARG A 43 64.324 -3.099 -17.194 1.00 1.00 N ATOM 607 CZ ARG A 43 65.323 -3.309 -18.046 1.00 1.00 C ATOM 608 NH1 ARG A 43 65.783 -4.516 -18.219 1.00 1.00 N ATOM 609 NH2 ARG A 43 65.842 -2.312 -18.712 1.00 1.00 N ATOM 0 H ARG A 43 63.045 -3.577 -12.033 1.00 1.00 H new ATOM 0 HA ARG A 43 62.669 -5.463 -14.101 1.00 1.00 H new ATOM 0 HB2 ARG A 43 64.056 -3.237 -14.000 1.00 1.00 H new ATOM 0 HB3 ARG A 43 65.342 -4.243 -13.361 1.00 1.00 H new ATOM 0 HG2 ARG A 43 65.772 -4.405 -15.673 1.00 1.00 H new ATOM 0 HG3 ARG A 43 64.780 -5.829 -15.426 1.00 1.00 H new ATOM 0 HD2 ARG A 43 63.437 -5.001 -17.102 1.00 1.00 H new ATOM 0 HD3 ARG A 43 62.845 -3.859 -15.912 1.00 1.00 H new ATOM 0 HE ARG A 43 63.958 -2.155 -17.073 1.00 1.00 H new ATOM 0 HH11 ARG A 43 65.377 -5.296 -17.702 1.00 1.00 H new ATOM 0 HH12 ARG A 43 66.549 -4.681 -18.872 1.00 1.00 H new ATOM 0 HH21 ARG A 43 65.481 -1.367 -18.580 1.00 1.00 H new ATOM 0 HH22 ARG A 43 66.608 -2.478 -19.364 1.00 1.00 H new ATOM 623 N GLY A 44 63.486 -7.060 -11.722 1.00 1.00 N ATOM 624 CA GLY A 44 63.999 -8.288 -11.128 1.00 1.00 C ATOM 625 C GLY A 44 65.265 -8.005 -10.331 1.00 1.00 C ATOM 626 O GLY A 44 65.593 -8.721 -9.386 1.00 1.00 O ATOM 0 H GLY A 44 62.675 -6.673 -11.239 1.00 1.00 H new ATOM 0 HA2 GLY A 44 63.243 -8.728 -10.477 1.00 1.00 H new ATOM 0 HA3 GLY A 44 64.210 -9.017 -11.910 1.00 1.00 H new ATOM 630 N PHE A 45 65.964 -6.946 -10.715 1.00 1.00 N ATOM 631 CA PHE A 45 67.195 -6.556 -10.036 1.00 1.00 C ATOM 632 C PHE A 45 67.638 -5.170 -10.512 1.00 1.00 C ATOM 633 O PHE A 45 67.081 -4.658 -11.468 1.00 1.00 O ATOM 634 CB PHE A 45 68.302 -7.588 -10.296 1.00 1.00 C ATOM 635 CG PHE A 45 68.224 -8.041 -11.733 1.00 1.00 C ATOM 636 CD1 PHE A 45 68.902 -7.326 -12.726 1.00 1.00 C ATOM 637 CD2 PHE A 45 67.456 -9.159 -12.075 1.00 1.00 C ATOM 638 CE1 PHE A 45 68.814 -7.731 -14.064 1.00 1.00 C ATOM 639 CE2 PHE A 45 67.363 -9.563 -13.413 1.00 1.00 C ATOM 640 CZ PHE A 45 68.043 -8.848 -14.407 1.00 1.00 C ATOM 0 H PHE A 45 65.701 -6.341 -11.493 1.00 1.00 H new ATOM 0 HA PHE A 45 67.006 -6.517 -8.963 1.00 1.00 H new ATOM 0 HB2 PHE A 45 69.279 -7.151 -10.092 1.00 1.00 H new ATOM 0 HB3 PHE A 45 68.187 -8.440 -9.626 1.00 1.00 H new ATOM 0 HD1 PHE A 45 69.493 -6.462 -12.461 1.00 1.00 H new ATOM 0 HD2 PHE A 45 66.934 -9.711 -11.307 1.00 1.00 H new ATOM 0 HE1 PHE A 45 69.341 -7.182 -14.831 1.00 1.00 H new ATOM 0 HE2 PHE A 45 66.768 -10.424 -13.678 1.00 1.00 H new ATOM 0 HZ PHE A 45 67.972 -9.159 -15.439 1.00 1.00 H new ATOM 650 N PHE A 46 68.673 -4.642 -9.827 1.00 1.00 N ATOM 651 CA PHE A 46 69.327 -3.318 -10.094 1.00 1.00 C ATOM 652 C PHE A 46 69.467 -2.539 -8.791 1.00 1.00 C ATOM 653 O PHE A 46 68.496 -1.924 -8.357 1.00 1.00 O ATOM 654 CB PHE A 46 68.555 -2.378 -11.106 1.00 1.00 C ATOM 655 CG PHE A 46 69.238 -2.320 -12.468 1.00 1.00 C ATOM 656 CD1 PHE A 46 69.197 -3.414 -13.341 1.00 1.00 C ATOM 657 CD2 PHE A 46 69.901 -1.144 -12.861 1.00 1.00 C ATOM 658 CE1 PHE A 46 69.817 -3.337 -14.593 1.00 1.00 C ATOM 659 CE2 PHE A 46 70.519 -1.069 -14.109 1.00 1.00 C ATOM 660 CZ PHE A 46 70.478 -2.164 -14.975 1.00 1.00 C ATOM 0 H PHE A 46 69.101 -5.133 -9.042 1.00 1.00 H new ATOM 0 HA PHE A 46 70.285 -3.574 -10.547 1.00 1.00 H new ATOM 0 HB2 PHE A 46 67.534 -2.738 -11.228 1.00 1.00 H new ATOM 0 HB3 PHE A 46 68.491 -1.373 -10.690 1.00 1.00 H new ATOM 0 HD1 PHE A 46 68.686 -4.319 -13.047 1.00 1.00 H new ATOM 0 HD2 PHE A 46 69.932 -0.295 -12.194 1.00 1.00 H new ATOM 0 HE1 PHE A 46 69.785 -4.182 -15.264 1.00 1.00 H new ATOM 0 HE2 PHE A 46 71.029 -0.164 -14.406 1.00 1.00 H new ATOM 0 HZ PHE A 46 70.957 -2.105 -15.941 1.00 1.00 H new ATOM 670 N ARG A 47 70.666 -2.560 -8.184 1.00 1.00 N ATOM 671 CA ARG A 47 70.931 -1.834 -6.936 1.00 1.00 C ATOM 672 C ARG A 47 70.717 -2.751 -5.736 1.00 1.00 C ATOM 673 O ARG A 47 70.309 -3.902 -5.897 1.00 1.00 O ATOM 674 CB ARG A 47 70.052 -0.577 -6.837 1.00 1.00 C ATOM 675 CG ARG A 47 70.717 0.488 -5.961 1.00 1.00 C ATOM 676 CD ARG A 47 69.686 1.527 -5.541 1.00 1.00 C ATOM 677 NE ARG A 47 68.460 0.881 -5.058 1.00 1.00 N ATOM 678 CZ ARG A 47 68.454 0.118 -3.963 1.00 1.00 C ATOM 679 NH1 ARG A 47 69.532 -0.014 -3.249 1.00 1.00 N ATOM 680 NH2 ARG A 47 67.360 -0.497 -3.597 1.00 1.00 N ATOM 0 H ARG A 47 71.470 -3.076 -8.542 1.00 1.00 H new ATOM 0 HA ARG A 47 71.972 -1.510 -6.937 1.00 1.00 H new ATOM 0 HB2 ARG A 47 69.874 -0.174 -7.834 1.00 1.00 H new ATOM 0 HB3 ARG A 47 69.080 -0.840 -6.421 1.00 1.00 H new ATOM 0 HG2 ARG A 47 71.158 0.023 -5.079 1.00 1.00 H new ATOM 0 HG3 ARG A 47 71.528 0.968 -6.508 1.00 1.00 H new ATOM 0 HD2 ARG A 47 70.101 2.161 -4.758 1.00 1.00 H new ATOM 0 HD3 ARG A 47 69.452 2.175 -6.385 1.00 1.00 H new ATOM 0 HE ARG A 47 67.590 1.019 -5.572 1.00 1.00 H new ATOM 0 HH11 ARG A 47 70.388 0.467 -3.525 1.00 1.00 H new ATOM 0 HH12 ARG A 47 69.522 -0.598 -2.413 1.00 1.00 H new ATOM 0 HH21 ARG A 47 66.508 -0.394 -4.149 1.00 1.00 H new ATOM 0 HH22 ARG A 47 67.358 -1.080 -2.760 1.00 1.00 H new ATOM 694 N CYS A 48 71.015 -2.255 -4.537 1.00 1.00 N ATOM 695 CA CYS A 48 70.876 -3.067 -3.350 1.00 1.00 C ATOM 696 C CYS A 48 71.927 -4.155 -3.451 1.00 1.00 C ATOM 697 O CYS A 48 71.599 -5.339 -3.496 1.00 1.00 O ATOM 698 CB CYS A 48 69.457 -3.663 -3.289 1.00 1.00 C ATOM 699 SG CYS A 48 68.985 -3.960 -1.566 1.00 1.00 S ATOM 0 H CYS A 48 71.350 -1.306 -4.371 1.00 1.00 H new ATOM 0 HA CYS A 48 71.017 -2.485 -2.439 1.00 1.00 H new ATOM 0 HB2 CYS A 48 68.747 -2.981 -3.757 1.00 1.00 H new ATOM 0 HB3 CYS A 48 69.421 -4.596 -3.851 1.00 1.00 H new ATOM 704 N ASN A 49 73.201 -3.760 -3.464 1.00 1.00 N ATOM 705 CA ASN A 49 74.291 -4.712 -3.533 1.00 1.00 C ATOM 706 C ASN A 49 75.541 -4.048 -2.945 1.00 1.00 C ATOM 707 O ASN A 49 75.652 -2.823 -2.981 1.00 1.00 O ATOM 708 CB ASN A 49 74.542 -5.108 -4.991 1.00 1.00 C ATOM 709 CG ASN A 49 74.288 -3.911 -5.902 1.00 1.00 C ATOM 710 OD1 ASN A 49 74.149 -2.783 -5.427 1.00 1.00 O ATOM 711 ND2 ASN A 49 74.222 -4.086 -7.189 1.00 1.00 N ATOM 0 H ASN A 49 73.495 -2.784 -3.427 1.00 1.00 H new ATOM 0 HA ASN A 49 74.045 -5.612 -2.969 1.00 1.00 H new ATOM 0 HB2 ASN A 49 75.568 -5.457 -5.111 1.00 1.00 H new ATOM 0 HB3 ASN A 49 73.889 -5.935 -5.271 1.00 1.00 H new ATOM 0 HD21 ASN A 49 74.055 -3.290 -7.804 1.00 1.00 H new ATOM 0 HD22 ASN A 49 74.337 -5.020 -7.583 1.00 1.00 H new ATOM 718 N PRO A 50 76.493 -4.793 -2.458 1.00 1.00 N ATOM 719 CA PRO A 50 77.765 -4.207 -1.925 1.00 1.00 C ATOM 720 C PRO A 50 78.626 -3.567 -3.037 1.00 1.00 C ATOM 721 O PRO A 50 79.623 -4.149 -3.464 1.00 1.00 O ATOM 722 CB PRO A 50 78.476 -5.419 -1.298 1.00 1.00 C ATOM 723 CG PRO A 50 77.926 -6.599 -2.034 1.00 1.00 C ATOM 724 CD PRO A 50 76.471 -6.257 -2.335 1.00 1.00 C ATOM 0 HA PRO A 50 77.585 -3.397 -1.218 1.00 1.00 H new ATOM 0 HB2 PRO A 50 79.558 -5.348 -1.414 1.00 1.00 H new ATOM 0 HB3 PRO A 50 78.274 -5.488 -0.229 1.00 1.00 H new ATOM 0 HG2 PRO A 50 78.483 -6.782 -2.953 1.00 1.00 H new ATOM 0 HG3 PRO A 50 77.999 -7.505 -1.432 1.00 1.00 H new ATOM 0 HD2 PRO A 50 76.126 -6.734 -3.253 1.00 1.00 H new ATOM 0 HD3 PRO A 50 75.806 -6.585 -1.536 1.00 1.00 H new ATOM 732 N GLU A 51 78.229 -2.368 -3.493 1.00 1.00 N ATOM 733 CA GLU A 51 78.953 -1.638 -4.554 1.00 1.00 C ATOM 734 C GLU A 51 79.446 -2.559 -5.665 1.00 1.00 C ATOM 735 O GLU A 51 80.651 -2.688 -5.889 1.00 1.00 O ATOM 736 CB GLU A 51 80.140 -0.848 -3.978 1.00 1.00 C ATOM 737 CG GLU A 51 81.001 -1.739 -3.078 1.00 1.00 C ATOM 738 CD GLU A 51 82.186 -0.960 -2.562 1.00 1.00 C ATOM 739 OE1 GLU A 51 83.103 -0.717 -3.332 1.00 1.00 O ATOM 740 OE2 GLU A 51 82.157 -0.622 -1.399 1.00 1.00 O ATOM 0 H GLU A 51 77.406 -1.879 -3.143 1.00 1.00 H new ATOM 0 HA GLU A 51 78.233 -0.943 -4.987 1.00 1.00 H new ATOM 0 HB2 GLU A 51 80.747 -0.450 -4.791 1.00 1.00 H new ATOM 0 HB3 GLU A 51 79.772 0.005 -3.408 1.00 1.00 H new ATOM 0 HG2 GLU A 51 80.407 -2.109 -2.242 1.00 1.00 H new ATOM 0 HG3 GLU A 51 81.343 -2.611 -3.636 1.00 1.00 H new ATOM 747 N ARG A 52 78.499 -3.182 -6.375 1.00 1.00 N ATOM 748 CA ARG A 52 78.830 -4.081 -7.492 1.00 1.00 C ATOM 749 C ARG A 52 77.761 -4.036 -8.600 1.00 1.00 C ATOM 750 O ARG A 52 76.561 -4.103 -8.325 1.00 1.00 O ATOM 751 CB ARG A 52 78.985 -5.528 -6.986 1.00 1.00 C ATOM 752 CG ARG A 52 80.344 -5.719 -6.295 1.00 1.00 C ATOM 753 CD ARG A 52 80.425 -7.128 -5.689 1.00 1.00 C ATOM 754 NE ARG A 52 81.748 -7.358 -5.113 1.00 1.00 N ATOM 755 CZ ARG A 52 82.094 -6.825 -3.945 1.00 1.00 C ATOM 756 NH1 ARG A 52 81.256 -6.057 -3.305 1.00 1.00 N ATOM 757 NH2 ARG A 52 83.277 -7.064 -3.443 1.00 1.00 N ATOM 0 H ARG A 52 77.499 -3.082 -6.199 1.00 1.00 H new ATOM 0 HA ARG A 52 79.773 -3.736 -7.916 1.00 1.00 H new ATOM 0 HB2 ARG A 52 78.181 -5.763 -6.289 1.00 1.00 H new ATOM 0 HB3 ARG A 52 78.895 -6.222 -7.821 1.00 1.00 H new ATOM 0 HG2 ARG A 52 81.151 -5.575 -7.013 1.00 1.00 H new ATOM 0 HG3 ARG A 52 80.474 -4.969 -5.515 1.00 1.00 H new ATOM 0 HD2 ARG A 52 79.661 -7.245 -4.920 1.00 1.00 H new ATOM 0 HD3 ARG A 52 80.221 -7.874 -6.457 1.00 1.00 H new ATOM 0 HE ARG A 52 82.419 -7.938 -5.616 1.00 1.00 H new ATOM 0 HH11 ARG A 52 80.336 -5.865 -3.701 1.00 1.00 H new ATOM 0 HH12 ARG A 52 81.521 -5.648 -2.409 1.00 1.00 H new ATOM 0 HH21 ARG A 52 83.934 -7.659 -3.947 1.00 1.00 H new ATOM 0 HH22 ARG A 52 83.543 -6.655 -2.547 1.00 1.00 H new ATOM 771 N ILE A 53 78.234 -3.979 -9.854 1.00 1.00 N ATOM 772 CA ILE A 53 77.355 -3.985 -11.042 1.00 1.00 C ATOM 773 C ILE A 53 76.451 -5.228 -10.934 1.00 1.00 C ATOM 774 O ILE A 53 76.783 -6.103 -10.141 1.00 1.00 O ATOM 775 CB ILE A 53 78.266 -3.977 -12.314 1.00 1.00 C ATOM 776 CG1 ILE A 53 78.076 -2.672 -13.108 1.00 1.00 C ATOM 777 CG2 ILE A 53 77.972 -5.166 -13.225 1.00 1.00 C ATOM 778 CD1 ILE A 53 78.728 -1.507 -12.354 1.00 1.00 C ATOM 0 H ILE A 53 79.228 -3.928 -10.077 1.00 1.00 H new ATOM 0 HA ILE A 53 76.708 -3.111 -11.109 1.00 1.00 H new ATOM 0 HB ILE A 53 79.298 -4.050 -11.970 1.00 1.00 H new ATOM 0 HG12 ILE A 53 78.520 -2.770 -14.099 1.00 1.00 H new ATOM 0 HG13 ILE A 53 77.014 -2.475 -13.253 1.00 1.00 H new ATOM 0 HG21 ILE A 53 78.624 -5.126 -14.097 1.00 1.00 H new ATOM 0 HG22 ILE A 53 78.150 -6.094 -12.681 1.00 1.00 H new ATOM 0 HG23 ILE A 53 76.932 -5.129 -13.548 1.00 1.00 H new ATOM 0 HD11 ILE A 53 78.591 -0.585 -12.920 1.00 1.00 H new ATOM 0 HD12 ILE A 53 78.264 -1.403 -11.373 1.00 1.00 H new ATOM 0 HD13 ILE A 53 79.793 -1.703 -12.232 1.00 1.00 H new ATOM 790 N GLN A 54 75.338 -5.369 -11.690 1.00 1.00 N ATOM 791 CA GLN A 54 74.487 -6.564 -11.574 1.00 1.00 C ATOM 792 C GLN A 54 74.407 -7.269 -12.950 1.00 1.00 C ATOM 793 O GLN A 54 73.830 -6.713 -13.884 1.00 1.00 O ATOM 794 CB GLN A 54 73.079 -6.061 -11.189 1.00 1.00 C ATOM 795 CG GLN A 54 72.963 -5.851 -9.673 1.00 1.00 C ATOM 796 CD GLN A 54 72.786 -7.193 -8.974 1.00 1.00 C ATOM 797 OE1 GLN A 54 72.152 -8.095 -9.521 1.00 1.00 O ATOM 798 NE2 GLN A 54 73.297 -7.380 -7.787 1.00 1.00 N ATOM 0 H GLN A 54 75.017 -4.682 -12.372 1.00 1.00 H new ATOM 0 HA GLN A 54 74.882 -7.264 -10.838 1.00 1.00 H new ATOM 0 HB2 GLN A 54 72.870 -5.124 -11.706 1.00 1.00 H new ATOM 0 HB3 GLN A 54 72.330 -6.781 -11.518 1.00 1.00 H new ATOM 0 HG2 GLN A 54 73.856 -5.351 -9.297 1.00 1.00 H new ATOM 0 HG3 GLN A 54 72.116 -5.201 -9.451 1.00 1.00 H new ATOM 0 HE21 GLN A 54 73.822 -6.632 -7.334 1.00 1.00 H new ATOM 0 HE22 GLN A 54 73.171 -8.274 -7.313 1.00 1.00 H new ATOM 807 N ILE A 55 74.937 -8.502 -13.072 1.00 1.00 N ATOM 808 CA ILE A 55 74.853 -9.256 -14.342 1.00 1.00 C ATOM 809 C ILE A 55 74.734 -10.767 -14.039 1.00 1.00 C ATOM 810 O ILE A 55 75.116 -11.191 -12.951 1.00 1.00 O ATOM 811 CB ILE A 55 76.077 -8.928 -15.251 1.00 1.00 C ATOM 812 CG1 ILE A 55 77.272 -9.902 -15.012 1.00 1.00 C ATOM 813 CG2 ILE A 55 76.540 -7.495 -14.968 1.00 1.00 C ATOM 814 CD1 ILE A 55 77.208 -11.069 -16.014 1.00 1.00 C ATOM 0 H ILE A 55 75.421 -8.992 -12.320 1.00 1.00 H new ATOM 0 HA ILE A 55 73.961 -8.956 -14.892 1.00 1.00 H new ATOM 0 HB ILE A 55 75.758 -9.041 -16.287 1.00 1.00 H new ATOM 0 HG12 ILE A 55 78.215 -9.368 -15.123 1.00 1.00 H new ATOM 0 HG13 ILE A 55 77.241 -10.285 -13.992 1.00 1.00 H new ATOM 0 HG21 ILE A 55 77.396 -7.258 -15.600 1.00 1.00 H new ATOM 0 HG22 ILE A 55 75.727 -6.801 -15.182 1.00 1.00 H new ATOM 0 HG23 ILE A 55 76.827 -7.405 -13.920 1.00 1.00 H new ATOM 0 HD11 ILE A 55 78.046 -11.744 -15.840 1.00 1.00 H new ATOM 0 HD12 ILE A 55 76.272 -11.611 -15.882 1.00 1.00 H new ATOM 0 HD13 ILE A 55 77.261 -10.679 -17.030 1.00 1.00 H new ATOM 826 N GLY A 56 74.202 -11.576 -14.976 1.00 1.00 N ATOM 827 CA GLY A 56 74.049 -13.032 -14.751 1.00 1.00 C ATOM 828 C GLY A 56 72.588 -13.446 -14.615 1.00 1.00 C ATOM 829 O GLY A 56 72.263 -14.631 -14.578 1.00 1.00 O ATOM 0 H GLY A 56 73.874 -11.254 -15.886 1.00 1.00 H new ATOM 0 HA2 GLY A 56 74.503 -13.575 -15.580 1.00 1.00 H new ATOM 0 HA3 GLY A 56 74.591 -13.317 -13.849 1.00 1.00 H new ATOM 833 N ASP A 57 71.721 -12.451 -14.576 1.00 1.00 N ATOM 834 CA ASP A 57 70.271 -12.683 -14.488 1.00 1.00 C ATOM 835 C ASP A 57 69.628 -12.230 -15.782 1.00 1.00 C ATOM 836 O ASP A 57 69.845 -11.090 -16.195 1.00 1.00 O ATOM 837 CB ASP A 57 69.693 -11.882 -13.324 1.00 1.00 C ATOM 838 CG ASP A 57 70.585 -12.046 -12.105 1.00 1.00 C ATOM 839 OD1 ASP A 57 71.637 -11.429 -12.081 1.00 1.00 O ATOM 840 OD2 ASP A 57 70.210 -12.791 -11.214 1.00 1.00 O ATOM 0 H ASP A 57 71.987 -11.467 -14.603 1.00 1.00 H new ATOM 0 HA ASP A 57 70.074 -13.742 -14.324 1.00 1.00 H new ATOM 0 HB2 ASP A 57 69.619 -10.829 -13.595 1.00 1.00 H new ATOM 0 HB3 ASP A 57 68.683 -12.225 -13.098 1.00 1.00 H new ATOM 845 N TRP A 58 68.821 -13.071 -16.440 1.00 1.00 N ATOM 846 CA TRP A 58 68.174 -12.665 -17.678 1.00 1.00 C ATOM 847 C TRP A 58 66.733 -13.178 -17.694 1.00 1.00 C ATOM 848 O TRP A 58 66.351 -14.108 -16.992 1.00 1.00 O ATOM 849 CB TRP A 58 68.928 -13.204 -18.927 1.00 1.00 C ATOM 850 CG TRP A 58 70.104 -12.335 -19.296 1.00 1.00 C ATOM 851 CD1 TRP A 58 70.093 -10.982 -19.403 1.00 1.00 C ATOM 852 CD2 TRP A 58 71.461 -12.753 -19.650 1.00 1.00 C ATOM 853 NE1 TRP A 58 71.357 -10.552 -19.770 1.00 1.00 N ATOM 854 CE2 TRP A 58 72.233 -11.604 -19.936 1.00 1.00 C ATOM 855 CE3 TRP A 58 72.089 -14.008 -19.738 1.00 1.00 C ATOM 856 CZ2 TRP A 58 73.580 -11.694 -20.297 1.00 1.00 C ATOM 857 CZ3 TRP A 58 73.443 -14.104 -20.103 1.00 1.00 C ATOM 858 CH2 TRP A 58 74.187 -12.949 -20.381 1.00 1.00 C ATOM 0 H TRP A 58 68.607 -14.021 -16.136 1.00 1.00 H new ATOM 0 HA TRP A 58 68.188 -11.576 -17.721 1.00 1.00 H new ATOM 0 HB2 TRP A 58 69.274 -14.219 -18.731 1.00 1.00 H new ATOM 0 HB3 TRP A 58 68.239 -13.259 -19.770 1.00 1.00 H new ATOM 0 HD1 TRP A 58 69.238 -10.345 -19.230 1.00 1.00 H new ATOM 0 HE1 TRP A 58 71.610 -9.573 -19.902 1.00 1.00 H new ATOM 0 HE3 TRP A 58 71.527 -14.905 -19.524 1.00 1.00 H new ATOM 0 HZ2 TRP A 58 74.147 -10.800 -20.509 1.00 1.00 H new ATOM 0 HZ3 TRP A 58 73.913 -15.074 -20.170 1.00 1.00 H new ATOM 0 HH2 TRP A 58 75.227 -13.029 -20.660 1.00 1.00 H new ATOM 869 N ARG A 59 65.981 -12.508 -18.510 1.00 1.00 N ATOM 870 CA ARG A 59 64.557 -12.815 -18.657 1.00 1.00 C ATOM 871 C ARG A 59 64.366 -14.351 -18.664 1.00 1.00 C ATOM 872 O ARG A 59 63.394 -14.871 -18.116 1.00 1.00 O ATOM 873 CB ARG A 59 64.002 -12.223 -19.954 1.00 1.00 C ATOM 874 CG ARG A 59 64.736 -12.828 -21.148 1.00 1.00 C ATOM 875 CD ARG A 59 64.229 -12.179 -22.432 1.00 1.00 C ATOM 876 NE ARG A 59 64.908 -12.751 -23.591 1.00 1.00 N ATOM 877 CZ ARG A 59 66.119 -12.335 -23.947 1.00 1.00 C ATOM 878 NH1 ARG A 59 66.733 -11.433 -23.229 1.00 1.00 N ATOM 879 NH2 ARG A 59 66.697 -12.826 -25.010 1.00 1.00 N ATOM 0 H ARG A 59 66.312 -11.740 -19.094 1.00 1.00 H new ATOM 0 HA ARG A 59 64.015 -12.374 -17.820 1.00 1.00 H new ATOM 0 HB2 ARG A 59 62.934 -12.426 -20.030 1.00 1.00 H new ATOM 0 HB3 ARG A 59 64.122 -11.140 -19.952 1.00 1.00 H new ATOM 0 HG2 ARG A 59 65.810 -12.671 -21.047 1.00 1.00 H new ATOM 0 HG3 ARG A 59 64.573 -13.905 -21.182 1.00 1.00 H new ATOM 0 HD2 ARG A 59 63.153 -12.328 -22.522 1.00 1.00 H new ATOM 0 HD3 ARG A 59 64.400 -11.103 -22.396 1.00 1.00 H new ATOM 0 HE ARG A 59 64.447 -13.480 -24.135 1.00 1.00 H new ATOM 0 HH11 ARG A 59 66.283 -11.050 -22.398 1.00 1.00 H new ATOM 0 HH12 ARG A 59 67.662 -11.112 -23.500 1.00 1.00 H new ATOM 0 HH21 ARG A 59 66.219 -13.531 -25.571 1.00 1.00 H new ATOM 0 HH22 ARG A 59 67.626 -12.504 -25.280 1.00 1.00 H new ATOM 893 N TYR A 60 65.321 -15.059 -19.274 1.00 1.00 N ATOM 894 CA TYR A 60 65.292 -16.538 -19.341 1.00 1.00 C ATOM 895 C TYR A 60 66.021 -17.188 -18.171 1.00 1.00 C ATOM 896 O TYR A 60 65.613 -18.245 -17.651 1.00 1.00 O ATOM 897 CB TYR A 60 65.898 -17.055 -20.649 1.00 1.00 C ATOM 898 CG TYR A 60 65.553 -18.527 -20.824 1.00 1.00 C ATOM 899 CD1 TYR A 60 64.280 -18.898 -21.285 1.00 1.00 C ATOM 900 CD2 TYR A 60 66.502 -19.519 -20.535 1.00 1.00 C ATOM 901 CE1 TYR A 60 63.958 -20.254 -21.453 1.00 1.00 C ATOM 902 CE2 TYR A 60 66.178 -20.877 -20.705 1.00 1.00 C ATOM 903 CZ TYR A 60 64.907 -21.242 -21.164 1.00 1.00 C ATOM 904 OH TYR A 60 64.589 -22.577 -21.328 1.00 1.00 O ATOM 0 H TYR A 60 66.129 -14.638 -19.732 1.00 1.00 H new ATOM 0 HA TYR A 60 64.239 -16.815 -19.292 1.00 1.00 H new ATOM 0 HB2 TYR A 60 65.516 -16.479 -21.492 1.00 1.00 H new ATOM 0 HB3 TYR A 60 66.980 -16.923 -20.637 1.00 1.00 H new ATOM 0 HD1 TYR A 60 63.546 -18.138 -21.511 1.00 1.00 H new ATOM 0 HD2 TYR A 60 67.483 -19.239 -20.181 1.00 1.00 H new ATOM 0 HE1 TYR A 60 62.977 -20.536 -21.806 1.00 1.00 H new ATOM 0 HE2 TYR A 60 66.910 -21.639 -20.481 1.00 1.00 H new ATOM 0 HH TYR A 60 65.361 -23.129 -21.084 1.00 1.00 H new ATOM 914 N GLU A 61 67.106 -16.563 -17.726 1.00 1.00 N ATOM 915 CA GLU A 61 67.861 -17.102 -16.621 1.00 1.00 C ATOM 916 C GLU A 61 67.168 -16.810 -15.315 1.00 1.00 C ATOM 917 O GLU A 61 67.555 -17.324 -14.282 1.00 1.00 O ATOM 918 CB GLU A 61 69.280 -16.527 -16.567 1.00 1.00 C ATOM 919 CG GLU A 61 70.121 -17.069 -17.721 1.00 1.00 C ATOM 920 CD GLU A 61 71.559 -16.575 -17.573 1.00 1.00 C ATOM 921 OE1 GLU A 61 71.832 -15.885 -16.601 1.00 1.00 O ATOM 922 OE2 GLU A 61 72.364 -16.888 -18.433 1.00 1.00 O ATOM 0 H GLU A 61 67.472 -15.693 -18.114 1.00 1.00 H new ATOM 0 HA GLU A 61 67.926 -18.179 -16.776 1.00 1.00 H new ATOM 0 HB2 GLU A 61 69.240 -15.439 -16.618 1.00 1.00 H new ATOM 0 HB3 GLU A 61 69.747 -16.785 -15.616 1.00 1.00 H new ATOM 0 HG2 GLU A 61 70.097 -18.159 -17.723 1.00 1.00 H new ATOM 0 HG3 GLU A 61 69.707 -16.739 -18.674 1.00 1.00 H new ATOM 929 N VAL A 62 66.197 -15.913 -15.322 1.00 1.00 N ATOM 930 CA VAL A 62 65.563 -15.530 -14.061 1.00 1.00 C ATOM 931 C VAL A 62 65.231 -16.781 -13.265 1.00 1.00 C ATOM 932 O VAL A 62 65.638 -16.919 -12.131 1.00 1.00 O ATOM 933 CB VAL A 62 64.291 -14.712 -14.345 1.00 1.00 C ATOM 934 CG1 VAL A 62 63.314 -15.518 -15.217 1.00 1.00 C ATOM 935 CG2 VAL A 62 63.614 -14.342 -13.024 1.00 1.00 C ATOM 0 H VAL A 62 65.836 -15.446 -16.154 1.00 1.00 H new ATOM 0 HA VAL A 62 66.246 -14.912 -13.477 1.00 1.00 H new ATOM 0 HB VAL A 62 64.571 -13.805 -14.881 1.00 1.00 H new ATOM 0 HG11 VAL A 62 62.421 -14.923 -15.407 1.00 1.00 H new ATOM 0 HG12 VAL A 62 63.792 -15.767 -16.164 1.00 1.00 H new ATOM 0 HG13 VAL A 62 63.036 -16.435 -14.699 1.00 1.00 H new ATOM 0 HG21 VAL A 62 62.713 -13.763 -13.227 1.00 1.00 H new ATOM 0 HG22 VAL A 62 63.347 -15.251 -12.485 1.00 1.00 H new ATOM 0 HG23 VAL A 62 64.299 -13.748 -12.418 1.00 1.00 H new ATOM 945 N ALA A 63 64.484 -17.677 -13.843 1.00 1.00 N ATOM 946 CA ALA A 63 64.125 -18.896 -13.151 1.00 1.00 C ATOM 947 C ALA A 63 65.370 -19.731 -12.884 1.00 1.00 C ATOM 948 O ALA A 63 65.651 -20.101 -11.736 1.00 1.00 O ATOM 949 CB ALA A 63 63.161 -19.701 -14.026 1.00 1.00 C ATOM 0 H ALA A 63 64.109 -17.594 -14.788 1.00 1.00 H new ATOM 0 HA ALA A 63 63.652 -18.644 -12.202 1.00 1.00 H new ATOM 0 HB1 ALA A 63 62.885 -20.622 -13.512 1.00 1.00 H new ATOM 0 HB2 ALA A 63 62.265 -19.111 -14.219 1.00 1.00 H new ATOM 0 HB3 ALA A 63 63.645 -19.945 -14.972 1.00 1.00 H new ATOM 955 N HIS A 64 66.122 -20.012 -13.958 1.00 1.00 N ATOM 956 CA HIS A 64 67.332 -20.826 -13.802 1.00 1.00 C ATOM 957 C HIS A 64 68.237 -20.216 -12.703 1.00 1.00 C ATOM 958 O HIS A 64 68.555 -20.867 -11.713 1.00 1.00 O ATOM 959 CB HIS A 64 68.073 -20.937 -15.153 1.00 1.00 C ATOM 960 CG HIS A 64 67.598 -22.151 -15.918 1.00 1.00 C ATOM 961 ND1 HIS A 64 68.447 -23.191 -16.266 1.00 1.00 N ATOM 962 CD2 HIS A 64 66.361 -22.504 -16.401 1.00 1.00 C ATOM 963 CE1 HIS A 64 67.718 -24.108 -16.927 1.00 1.00 C ATOM 964 NE2 HIS A 64 66.439 -23.738 -17.037 1.00 1.00 N ATOM 0 H HIS A 64 65.924 -19.701 -14.909 1.00 1.00 H new ATOM 0 HA HIS A 64 67.057 -21.834 -13.490 1.00 1.00 H new ATOM 0 HB2 HIS A 64 67.901 -20.037 -15.744 1.00 1.00 H new ATOM 0 HB3 HIS A 64 69.147 -21.005 -14.981 1.00 1.00 H new ATOM 0 HD2 HIS A 64 65.463 -21.912 -16.302 1.00 1.00 H new ATOM 0 HE1 HIS A 64 68.118 -25.031 -17.321 1.00 1.00 H new ATOM 0 HE2 HIS A 64 65.682 -24.251 -17.490 1.00 1.00 H new ATOM 972 N ASP A 65 68.629 -18.966 -12.876 1.00 1.00 N ATOM 973 CA ASP A 65 69.471 -18.274 -11.896 1.00 1.00 C ATOM 974 C ASP A 65 68.677 -17.915 -10.622 1.00 1.00 C ATOM 975 O ASP A 65 69.031 -18.306 -9.494 1.00 1.00 O ATOM 976 CB ASP A 65 70.044 -16.997 -12.535 1.00 1.00 C ATOM 977 CG ASP A 65 70.840 -16.204 -11.508 1.00 1.00 C ATOM 978 OD1 ASP A 65 71.224 -16.786 -10.509 1.00 1.00 O ATOM 979 OD2 ASP A 65 71.058 -15.020 -11.733 1.00 1.00 O ATOM 0 H ASP A 65 68.380 -18.401 -13.688 1.00 1.00 H new ATOM 0 HA ASP A 65 70.281 -18.942 -11.604 1.00 1.00 H new ATOM 0 HB2 ASP A 65 70.684 -17.259 -13.378 1.00 1.00 H new ATOM 0 HB3 ASP A 65 69.233 -16.384 -12.929 1.00 1.00 H new ATOM 984 N GLY A 66 67.541 -17.260 -10.784 1.00 1.00 N ATOM 985 CA GLY A 66 66.697 -16.937 -9.647 1.00 1.00 C ATOM 986 C GLY A 66 66.066 -18.195 -9.073 1.00 1.00 C ATOM 987 O GLY A 66 65.024 -18.144 -8.429 1.00 1.00 O ATOM 0 H GLY A 66 67.183 -16.943 -11.685 1.00 1.00 H new ATOM 0 HA2 GLY A 66 67.288 -16.437 -8.879 1.00 1.00 H new ATOM 0 HA3 GLY A 66 65.917 -16.240 -9.953 1.00 1.00 H new ATOM 991 N ARG A 67 66.756 -19.312 -9.252 1.00 1.00 N ATOM 992 CA ARG A 67 66.326 -20.579 -8.689 1.00 1.00 C ATOM 993 C ARG A 67 66.632 -20.561 -7.213 1.00 1.00 C ATOM 994 O ARG A 67 66.512 -21.594 -6.557 1.00 1.00 O ATOM 995 CB ARG A 67 66.977 -21.828 -9.333 1.00 1.00 C ATOM 996 CG ARG A 67 66.091 -22.414 -10.473 1.00 1.00 C ATOM 997 CD ARG A 67 66.001 -23.951 -10.399 1.00 1.00 C ATOM 998 NE ARG A 67 67.173 -24.537 -11.028 1.00 1.00 N ATOM 999 CZ ARG A 67 67.228 -24.669 -12.348 1.00 1.00 C ATOM 1000 NH1 ARG A 67 66.240 -24.225 -13.079 1.00 1.00 N ATOM 1001 NH2 ARG A 67 68.263 -25.223 -12.914 1.00 1.00 N ATOM 0 H ARG A 67 67.623 -19.364 -9.787 1.00 1.00 H new ATOM 0 HA ARG A 67 65.259 -20.670 -8.893 1.00 1.00 H new ATOM 0 HB2 ARG A 67 67.956 -21.564 -9.732 1.00 1.00 H new ATOM 0 HB3 ARG A 67 67.139 -22.589 -8.570 1.00 1.00 H new ATOM 0 HG2 ARG A 67 65.090 -21.988 -10.410 1.00 1.00 H new ATOM 0 HG3 ARG A 67 66.502 -22.121 -11.439 1.00 1.00 H new ATOM 0 HD2 ARG A 67 65.934 -24.272 -9.360 1.00 1.00 H new ATOM 0 HD3 ARG A 67 65.096 -24.297 -10.898 1.00 1.00 H new ATOM 0 HE ARG A 67 67.956 -24.848 -10.453 1.00 1.00 H new ATOM 0 HH11 ARG A 67 65.436 -23.782 -12.635 1.00 1.00 H new ATOM 0 HH12 ARG A 67 66.273 -24.322 -14.094 1.00 1.00 H new ATOM 0 HH21 ARG A 67 69.038 -25.559 -12.342 1.00 1.00 H new ATOM 0 HH22 ARG A 67 68.298 -25.321 -13.929 1.00 1.00 H new ATOM 1015 N LEU A 68 67.101 -19.399 -6.716 1.00 1.00 N ATOM 1016 CA LEU A 68 67.489 -19.263 -5.288 1.00 1.00 C ATOM 1017 C LEU A 68 66.590 -20.203 -4.448 1.00 1.00 C ATOM 1018 O LEU A 68 66.978 -20.664 -3.377 1.00 1.00 O ATOM 1019 CB LEU A 68 67.299 -17.792 -4.793 1.00 1.00 C ATOM 1020 CG LEU A 68 68.617 -16.983 -4.890 1.00 1.00 C ATOM 1021 CD1 LEU A 68 68.317 -15.479 -5.041 1.00 1.00 C ATOM 1022 CD2 LEU A 68 69.442 -17.178 -3.609 1.00 1.00 C ATOM 0 H LEU A 68 67.221 -18.550 -7.268 1.00 1.00 H new ATOM 0 HA LEU A 68 68.541 -19.527 -5.177 1.00 1.00 H new ATOM 0 HB2 LEU A 68 66.527 -17.304 -5.388 1.00 1.00 H new ATOM 0 HB3 LEU A 68 66.950 -17.797 -3.761 1.00 1.00 H new ATOM 0 HG LEU A 68 69.170 -17.339 -5.759 1.00 1.00 H new ATOM 0 HD11 LEU A 68 69.254 -14.926 -5.108 1.00 1.00 H new ATOM 0 HD12 LEU A 68 67.733 -15.314 -5.946 1.00 1.00 H new ATOM 0 HD13 LEU A 68 67.752 -15.132 -4.176 1.00 1.00 H new ATOM 0 HD21 LEU A 68 70.368 -16.607 -3.682 1.00 1.00 H new ATOM 0 HD22 LEU A 68 68.868 -16.830 -2.750 1.00 1.00 H new ATOM 0 HD23 LEU A 68 69.676 -18.235 -3.485 1.00 1.00 H new ATOM 1034 N LEU A 69 65.398 -20.500 -4.976 1.00 1.00 N ATOM 1035 CA LEU A 69 64.500 -21.428 -4.270 1.00 1.00 C ATOM 1036 C LEU A 69 65.159 -22.816 -4.231 1.00 1.00 C ATOM 1037 O LEU A 69 65.545 -23.289 -3.159 1.00 1.00 O ATOM 1038 CB LEU A 69 63.154 -21.518 -5.010 1.00 1.00 C ATOM 1039 CG LEU A 69 62.265 -22.610 -4.397 1.00 1.00 C ATOM 1040 CD1 LEU A 69 62.005 -22.310 -2.914 1.00 1.00 C ATOM 1041 CD2 LEU A 69 60.941 -22.638 -5.161 1.00 1.00 C ATOM 0 H LEU A 69 65.039 -20.129 -5.856 1.00 1.00 H new ATOM 0 HA LEU A 69 64.322 -21.069 -3.256 1.00 1.00 H new ATOM 0 HB2 LEU A 69 62.642 -20.557 -4.961 1.00 1.00 H new ATOM 0 HB3 LEU A 69 63.327 -21.734 -6.064 1.00 1.00 H new ATOM 0 HG LEU A 69 62.762 -23.577 -4.470 1.00 1.00 H new ATOM 0 HD11 LEU A 69 61.374 -23.091 -2.490 1.00 1.00 H new ATOM 0 HD12 LEU A 69 62.953 -22.279 -2.377 1.00 1.00 H new ATOM 0 HD13 LEU A 69 61.503 -21.347 -2.820 1.00 1.00 H new ATOM 0 HD21 LEU A 69 60.294 -23.408 -4.740 1.00 1.00 H new ATOM 0 HD22 LEU A 69 60.452 -21.668 -5.077 1.00 1.00 H new ATOM 0 HD23 LEU A 69 61.132 -22.858 -6.211 1.00 1.00 H new ATOM 1053 N ALA A 70 65.339 -23.448 -5.405 1.00 1.00 N ATOM 1054 CA ALA A 70 66.029 -24.746 -5.405 1.00 1.00 C ATOM 1055 C ALA A 70 67.503 -24.391 -5.337 1.00 1.00 C ATOM 1056 O ALA A 70 68.123 -24.562 -4.291 1.00 1.00 O ATOM 1057 CB ALA A 70 65.689 -25.597 -6.644 1.00 1.00 C ATOM 0 H ALA A 70 65.035 -23.105 -6.316 1.00 1.00 H new ATOM 0 HA ALA A 70 65.718 -25.370 -4.567 1.00 1.00 H new ATOM 0 HB1 ALA A 70 66.225 -26.545 -6.593 1.00 1.00 H new ATOM 0 HB2 ALA A 70 64.616 -25.788 -6.671 1.00 1.00 H new ATOM 0 HB3 ALA A 70 65.985 -25.061 -7.546 1.00 1.00 H new ATOM 1063 N ALA A 71 68.044 -23.906 -6.459 1.00 1.00 N ATOM 1064 CA ALA A 71 69.432 -23.496 -6.603 1.00 1.00 C ATOM 1065 C ALA A 71 69.955 -22.701 -5.427 1.00 1.00 C ATOM 1066 O ALA A 71 71.113 -22.287 -5.465 1.00 1.00 O ATOM 1067 CB ALA A 71 69.631 -22.686 -7.883 1.00 1.00 C ATOM 0 H ALA A 71 67.505 -23.787 -7.316 1.00 1.00 H new ATOM 0 HA ALA A 71 70.005 -24.422 -6.649 1.00 1.00 H new ATOM 0 HB1 ALA A 71 70.677 -22.391 -7.968 1.00 1.00 H new ATOM 0 HB2 ALA A 71 69.354 -23.293 -8.745 1.00 1.00 H new ATOM 0 HB3 ALA A 71 69.004 -21.795 -7.851 1.00 1.00 H new ATOM 1073 N HIS A 72 69.125 -22.474 -4.392 1.00 1.00 N ATOM 1074 CA HIS A 72 69.536 -21.713 -3.211 1.00 1.00 C ATOM 1075 C HIS A 72 71.042 -21.812 -3.013 1.00 1.00 C ATOM 1076 O HIS A 72 71.746 -20.809 -3.120 1.00 1.00 O ATOM 1077 CB HIS A 72 68.767 -22.315 -1.986 1.00 1.00 C ATOM 1078 CG HIS A 72 69.706 -22.786 -0.907 1.00 1.00 C ATOM 1079 ND1 HIS A 72 70.648 -21.953 -0.329 1.00 1.00 N ATOM 1080 CD2 HIS A 72 69.877 -24.014 -0.322 1.00 1.00 C ATOM 1081 CE1 HIS A 72 71.341 -22.687 0.561 1.00 1.00 C ATOM 1082 NE2 HIS A 72 70.910 -23.951 0.603 1.00 1.00 N ATOM 0 H HIS A 72 68.163 -22.811 -4.356 1.00 1.00 H new ATOM 0 HA HIS A 72 69.298 -20.655 -3.326 1.00 1.00 H new ATOM 0 HB2 HIS A 72 68.092 -21.563 -1.577 1.00 1.00 H new ATOM 0 HB3 HIS A 72 68.150 -23.149 -2.320 1.00 1.00 H new ATOM 0 HD2 HIS A 72 69.296 -24.896 -0.547 1.00 1.00 H new ATOM 0 HE1 HIS A 72 72.147 -22.301 1.167 1.00 1.00 H new ATOM 0 HE2 HIS A 72 71.264 -24.707 1.189 1.00 1.00 H new ATOM 1090 N MET A 73 71.549 -23.008 -2.762 1.00 1.00 N ATOM 1091 CA MET A 73 72.982 -23.144 -2.597 1.00 1.00 C ATOM 1092 C MET A 73 73.671 -23.040 -3.948 1.00 1.00 C ATOM 1093 O MET A 73 74.668 -22.327 -4.079 1.00 1.00 O ATOM 1094 CB MET A 73 73.345 -24.476 -1.934 1.00 1.00 C ATOM 1095 CG MET A 73 74.768 -24.390 -1.341 1.00 1.00 C ATOM 1096 SD MET A 73 75.550 -26.016 -1.420 1.00 1.00 S ATOM 1097 CE MET A 73 74.457 -26.822 -0.232 1.00 1.00 C ATOM 0 H MET A 73 71.010 -23.869 -2.671 1.00 1.00 H new ATOM 0 HA MET A 73 73.323 -22.338 -1.948 1.00 1.00 H new ATOM 0 HB2 MET A 73 72.627 -24.710 -1.148 1.00 1.00 H new ATOM 0 HB3 MET A 73 73.293 -25.283 -2.665 1.00 1.00 H new ATOM 0 HG2 MET A 73 75.361 -23.662 -1.894 1.00 1.00 H new ATOM 0 HG3 MET A 73 74.723 -24.046 -0.308 1.00 1.00 H new ATOM 0 HE1 MET A 73 74.908 -27.756 0.102 1.00 1.00 H new ATOM 0 HE2 MET A 73 74.304 -26.166 0.625 1.00 1.00 H new ATOM 0 HE3 MET A 73 73.497 -27.031 -0.704 1.00 1.00 H new ATOM 1107 N VAL A 74 73.200 -23.823 -4.929 1.00 1.00 N ATOM 1108 CA VAL A 74 73.863 -23.873 -6.227 1.00 1.00 C ATOM 1109 C VAL A 74 74.209 -22.487 -6.762 1.00 1.00 C ATOM 1110 O VAL A 74 75.343 -22.310 -7.187 1.00 1.00 O ATOM 1111 CB VAL A 74 73.010 -24.607 -7.266 1.00 1.00 C ATOM 1112 CG1 VAL A 74 73.791 -24.734 -8.575 1.00 1.00 C ATOM 1113 CG2 VAL A 74 72.637 -25.999 -6.764 1.00 1.00 C ATOM 0 H VAL A 74 72.376 -24.419 -4.846 1.00 1.00 H new ATOM 0 HA VAL A 74 74.791 -24.421 -6.063 1.00 1.00 H new ATOM 0 HB VAL A 74 72.097 -24.035 -7.434 1.00 1.00 H new ATOM 0 HG11 VAL A 74 73.182 -25.257 -9.313 1.00 1.00 H new ATOM 0 HG12 VAL A 74 74.040 -23.741 -8.948 1.00 1.00 H new ATOM 0 HG13 VAL A 74 74.708 -25.296 -8.398 1.00 1.00 H new ATOM 0 HG21 VAL A 74 72.031 -26.506 -7.515 1.00 1.00 H new ATOM 0 HG22 VAL A 74 73.544 -26.575 -6.580 1.00 1.00 H new ATOM 0 HG23 VAL A 74 72.069 -25.912 -5.838 1.00 1.00 H new ATOM 1123 N ASN A 75 73.312 -21.479 -6.726 1.00 1.00 N ATOM 1124 CA ASN A 75 73.650 -20.123 -7.185 1.00 1.00 C ATOM 1125 C ASN A 75 75.046 -19.700 -6.705 1.00 1.00 C ATOM 1126 O ASN A 75 75.623 -18.748 -7.210 1.00 1.00 O ATOM 1127 CB ASN A 75 72.592 -19.183 -6.579 1.00 1.00 C ATOM 1128 CG ASN A 75 72.403 -17.921 -7.407 1.00 1.00 C ATOM 1129 OD1 ASN A 75 73.371 -17.324 -7.869 1.00 1.00 O ATOM 1130 ND2 ASN A 75 71.194 -17.471 -7.607 1.00 1.00 N ATOM 0 H ASN A 75 72.356 -21.581 -6.386 1.00 1.00 H new ATOM 0 HA ASN A 75 73.658 -20.085 -8.274 1.00 1.00 H new ATOM 0 HB2 ASN A 75 71.641 -19.711 -6.502 1.00 1.00 H new ATOM 0 HB3 ASN A 75 72.888 -18.910 -5.566 1.00 1.00 H new ATOM 0 HD21 ASN A 75 71.050 -16.619 -8.150 1.00 1.00 H new ATOM 0 HD22 ASN A 75 70.393 -17.971 -7.221 1.00 1.00 H new ATOM 1137 N GLY A 76 75.552 -20.440 -5.731 1.00 1.00 N ATOM 1138 CA GLY A 76 76.880 -20.158 -5.164 1.00 1.00 C ATOM 1139 C GLY A 76 77.870 -19.921 -6.308 1.00 1.00 C ATOM 1140 O GLY A 76 78.905 -19.284 -6.155 1.00 1.00 O ATOM 0 H GLY A 76 75.074 -21.238 -5.312 1.00 1.00 H new ATOM 0 HA2 GLY A 76 76.835 -19.282 -4.517 1.00 1.00 H new ATOM 0 HA3 GLY A 76 77.211 -20.993 -4.547 1.00 1.00 H new ATOM 1144 N ILE A 77 77.531 -20.511 -7.439 1.00 1.00 N ATOM 1145 CA ILE A 77 78.383 -20.428 -8.633 1.00 1.00 C ATOM 1146 C ILE A 77 78.066 -19.164 -9.434 1.00 1.00 C ATOM 1147 O ILE A 77 78.944 -18.323 -9.629 1.00 1.00 O ATOM 1148 CB ILE A 77 78.265 -21.687 -9.511 1.00 1.00 C ATOM 1149 CG1 ILE A 77 76.775 -22.093 -9.731 1.00 1.00 C ATOM 1150 CG2 ILE A 77 79.029 -22.836 -8.829 1.00 1.00 C ATOM 1151 CD1 ILE A 77 76.418 -22.013 -11.219 1.00 1.00 C ATOM 0 H ILE A 77 76.677 -21.054 -7.566 1.00 1.00 H new ATOM 0 HA ILE A 77 79.418 -20.371 -8.296 1.00 1.00 H new ATOM 0 HB ILE A 77 78.694 -21.475 -10.490 1.00 1.00 H new ATOM 0 HG12 ILE A 77 76.609 -23.106 -9.364 1.00 1.00 H new ATOM 0 HG13 ILE A 77 76.123 -21.435 -9.157 1.00 1.00 H new ATOM 0 HG21 ILE A 77 78.954 -23.736 -9.440 1.00 1.00 H new ATOM 0 HG22 ILE A 77 80.077 -22.560 -8.717 1.00 1.00 H new ATOM 0 HG23 ILE A 77 78.597 -23.028 -7.847 1.00 1.00 H new ATOM 0 HD11 ILE A 77 75.375 -22.299 -11.359 1.00 1.00 H new ATOM 0 HD12 ILE A 77 76.565 -20.993 -11.574 1.00 1.00 H new ATOM 0 HD13 ILE A 77 77.059 -22.690 -11.784 1.00 1.00 H new ATOM 1163 N VAL A 78 76.824 -19.058 -9.926 1.00 1.00 N ATOM 1164 CA VAL A 78 76.415 -17.930 -10.728 1.00 1.00 C ATOM 1165 C VAL A 78 77.060 -16.663 -10.178 1.00 1.00 C ATOM 1166 O VAL A 78 77.302 -15.721 -10.918 1.00 1.00 O ATOM 1167 CB VAL A 78 74.889 -17.832 -10.704 1.00 1.00 C ATOM 1168 CG1 VAL A 78 74.436 -16.426 -11.122 1.00 1.00 C ATOM 1169 CG2 VAL A 78 74.307 -18.874 -11.663 1.00 1.00 C ATOM 0 H VAL A 78 76.092 -19.752 -9.773 1.00 1.00 H new ATOM 0 HA VAL A 78 76.738 -18.056 -11.761 1.00 1.00 H new ATOM 0 HB VAL A 78 74.532 -18.022 -9.692 1.00 1.00 H new ATOM 0 HG11 VAL A 78 73.348 -16.373 -11.100 1.00 1.00 H new ATOM 0 HG12 VAL A 78 74.849 -15.690 -10.432 1.00 1.00 H new ATOM 0 HG13 VAL A 78 74.789 -16.215 -12.131 1.00 1.00 H new ATOM 0 HG21 VAL A 78 73.219 -18.811 -11.652 1.00 1.00 H new ATOM 0 HG22 VAL A 78 74.671 -18.683 -12.672 1.00 1.00 H new ATOM 0 HG23 VAL A 78 74.616 -19.871 -11.348 1.00 1.00 H new ATOM 1179 N ILE A 79 77.357 -16.656 -8.877 1.00 1.00 N ATOM 1180 CA ILE A 79 77.997 -15.488 -8.286 1.00 1.00 C ATOM 1181 C ILE A 79 79.439 -15.323 -8.817 1.00 1.00 C ATOM 1182 O ILE A 79 79.808 -14.252 -9.272 1.00 1.00 O ATOM 1183 CB ILE A 79 77.999 -15.568 -6.735 1.00 1.00 C ATOM 1184 CG1 ILE A 79 79.221 -16.372 -6.235 1.00 1.00 C ATOM 1185 CG2 ILE A 79 76.694 -16.236 -6.243 1.00 1.00 C ATOM 1186 CD1 ILE A 79 79.044 -16.739 -4.759 1.00 1.00 C ATOM 0 H ILE A 79 77.170 -17.423 -8.232 1.00 1.00 H new ATOM 0 HA ILE A 79 77.417 -14.613 -8.578 1.00 1.00 H new ATOM 0 HB ILE A 79 78.060 -14.556 -6.334 1.00 1.00 H new ATOM 0 HG12 ILE A 79 79.339 -17.277 -6.831 1.00 1.00 H new ATOM 0 HG13 ILE A 79 80.130 -15.785 -6.365 1.00 1.00 H new ATOM 0 HG21 ILE A 79 76.701 -16.290 -5.154 1.00 1.00 H new ATOM 0 HG22 ILE A 79 75.838 -15.648 -6.572 1.00 1.00 H new ATOM 0 HG23 ILE A 79 76.623 -17.242 -6.655 1.00 1.00 H new ATOM 0 HD11 ILE A 79 79.911 -17.305 -4.418 1.00 1.00 H new ATOM 0 HD12 ILE A 79 78.949 -15.829 -4.167 1.00 1.00 H new ATOM 0 HD13 ILE A 79 78.146 -17.345 -4.640 1.00 1.00 H new ATOM 1198 N ALA A 80 80.267 -16.368 -8.754 1.00 1.00 N ATOM 1199 CA ALA A 80 81.640 -16.216 -9.225 1.00 1.00 C ATOM 1200 C ALA A 80 81.670 -15.861 -10.706 1.00 1.00 C ATOM 1201 O ALA A 80 82.141 -14.782 -11.065 1.00 1.00 O ATOM 1202 CB ALA A 80 82.428 -17.503 -8.994 1.00 1.00 C ATOM 0 H ALA A 80 80.023 -17.292 -8.397 1.00 1.00 H new ATOM 0 HA ALA A 80 82.100 -15.405 -8.659 1.00 1.00 H new ATOM 0 HB1 ALA A 80 83.450 -17.373 -9.351 1.00 1.00 H new ATOM 0 HB2 ALA A 80 82.442 -17.735 -7.929 1.00 1.00 H new ATOM 0 HB3 ALA A 80 81.955 -18.321 -9.537 1.00 1.00 H new ATOM 1208 N GLU A 81 81.177 -16.754 -11.576 1.00 1.00 N ATOM 1209 CA GLU A 81 81.198 -16.456 -13.001 1.00 1.00 C ATOM 1210 C GLU A 81 80.624 -15.053 -13.251 1.00 1.00 C ATOM 1211 O GLU A 81 81.366 -14.142 -13.590 1.00 1.00 O ATOM 1212 CB GLU A 81 80.391 -17.535 -13.776 1.00 1.00 C ATOM 1213 CG GLU A 81 79.488 -18.298 -12.800 1.00 1.00 C ATOM 1214 CD GLU A 81 78.475 -19.153 -13.550 1.00 1.00 C ATOM 1215 OE1 GLU A 81 77.640 -18.587 -14.236 1.00 1.00 O ATOM 1216 OE2 GLU A 81 78.542 -20.366 -13.421 1.00 1.00 O ATOM 0 H GLU A 81 80.774 -17.656 -11.324 1.00 1.00 H new ATOM 0 HA GLU A 81 82.227 -16.472 -13.361 1.00 1.00 H new ATOM 0 HB2 GLU A 81 79.789 -17.065 -14.554 1.00 1.00 H new ATOM 0 HB3 GLU A 81 81.072 -18.226 -14.274 1.00 1.00 H new ATOM 0 HG2 GLU A 81 80.097 -18.931 -12.155 1.00 1.00 H new ATOM 0 HG3 GLU A 81 78.966 -17.592 -12.154 1.00 1.00 H new ATOM 1223 N ASP A 82 79.312 -14.875 -13.117 1.00 1.00 N ATOM 1224 CA ASP A 82 78.765 -13.555 -13.391 1.00 1.00 C ATOM 1225 C ASP A 82 79.399 -12.527 -12.460 1.00 1.00 C ATOM 1226 O ASP A 82 80.065 -11.599 -12.916 1.00 1.00 O ATOM 1227 CB ASP A 82 77.244 -13.581 -13.264 1.00 1.00 C ATOM 1228 CG ASP A 82 76.693 -14.569 -14.290 1.00 1.00 C ATOM 1229 OD1 ASP A 82 76.718 -14.248 -15.467 1.00 1.00 O ATOM 1230 OD2 ASP A 82 76.250 -15.628 -13.883 1.00 1.00 O ATOM 0 H ASP A 82 78.640 -15.589 -12.835 1.00 1.00 H new ATOM 0 HA ASP A 82 79.002 -13.265 -14.414 1.00 1.00 H new ATOM 0 HB2 ASP A 82 76.952 -13.878 -12.257 1.00 1.00 H new ATOM 0 HB3 ASP A 82 76.832 -12.587 -13.435 1.00 1.00 H new ATOM 1235 N ALA A 83 79.174 -12.679 -11.171 1.00 1.00 N ATOM 1236 CA ALA A 83 79.745 -11.724 -10.226 1.00 1.00 C ATOM 1237 C ALA A 83 81.279 -11.874 -10.171 1.00 1.00 C ATOM 1238 O ALA A 83 81.857 -12.111 -9.110 1.00 1.00 O ATOM 1239 CB ALA A 83 79.085 -11.837 -8.826 1.00 1.00 C ATOM 0 H ALA A 83 78.619 -13.428 -10.757 1.00 1.00 H new ATOM 0 HA ALA A 83 79.527 -10.717 -10.581 1.00 1.00 H new ATOM 0 HB1 ALA A 83 79.537 -11.110 -8.151 1.00 1.00 H new ATOM 0 HB2 ALA A 83 78.017 -11.639 -8.910 1.00 1.00 H new ATOM 0 HB3 ALA A 83 79.237 -12.842 -8.432 1.00 1.00 H new ATOM 1245 N LEU A 84 81.938 -11.714 -11.340 1.00 1.00 N ATOM 1246 CA LEU A 84 83.402 -11.806 -11.446 1.00 1.00 C ATOM 1247 C LEU A 84 84.007 -10.490 -10.977 1.00 1.00 C ATOM 1248 O LEU A 84 85.217 -10.269 -11.059 1.00 1.00 O ATOM 1249 CB LEU A 84 83.793 -12.067 -12.929 1.00 1.00 C ATOM 1250 CG LEU A 84 84.998 -13.025 -13.073 1.00 1.00 C ATOM 1251 CD1 LEU A 84 86.215 -12.501 -12.306 1.00 1.00 C ATOM 1252 CD2 LEU A 84 84.636 -14.429 -12.570 1.00 1.00 C ATOM 0 H LEU A 84 81.471 -11.519 -12.226 1.00 1.00 H new ATOM 0 HA LEU A 84 83.775 -12.623 -10.829 1.00 1.00 H new ATOM 0 HB2 LEU A 84 82.937 -12.486 -13.457 1.00 1.00 H new ATOM 0 HB3 LEU A 84 84.030 -11.118 -13.410 1.00 1.00 H new ATOM 0 HG LEU A 84 85.251 -13.079 -14.132 1.00 1.00 H new ATOM 0 HD11 LEU A 84 87.047 -13.195 -12.425 1.00 1.00 H new ATOM 0 HD12 LEU A 84 86.499 -11.524 -12.697 1.00 1.00 H new ATOM 0 HD13 LEU A 84 85.967 -12.410 -11.248 1.00 1.00 H new ATOM 0 HD21 LEU A 84 85.497 -15.088 -12.680 1.00 1.00 H new ATOM 0 HD22 LEU A 84 84.351 -14.377 -11.519 1.00 1.00 H new ATOM 0 HD23 LEU A 84 83.803 -14.821 -13.153 1.00 1.00 H new ATOM 1264 N ILE A 85 83.138 -9.638 -10.453 1.00 1.00 N ATOM 1265 CA ILE A 85 83.540 -8.346 -9.927 1.00 1.00 C ATOM 1266 C ILE A 85 83.828 -8.494 -8.442 1.00 1.00 C ATOM 1267 O ILE A 85 84.302 -7.592 -7.821 1.00 1.00 O ATOM 1268 CB ILE A 85 82.463 -7.258 -10.180 1.00 1.00 C ATOM 1269 CG1 ILE A 85 81.022 -7.791 -9.863 1.00 1.00 C ATOM 1270 CG2 ILE A 85 82.562 -6.764 -11.638 1.00 1.00 C ATOM 1271 CD1 ILE A 85 80.219 -8.133 -11.145 1.00 1.00 C ATOM 0 H ILE A 85 82.138 -9.824 -10.382 1.00 1.00 H new ATOM 0 HA ILE A 85 84.440 -8.017 -10.447 1.00 1.00 H new ATOM 0 HB ILE A 85 82.649 -6.421 -9.507 1.00 1.00 H new ATOM 0 HG12 ILE A 85 81.097 -8.680 -9.237 1.00 1.00 H new ATOM 0 HG13 ILE A 85 80.479 -7.041 -9.288 1.00 1.00 H new ATOM 0 HG21 ILE A 85 81.805 -6.000 -11.815 1.00 1.00 H new ATOM 0 HG22 ILE A 85 83.552 -6.342 -11.813 1.00 1.00 H new ATOM 0 HG23 ILE A 85 82.399 -7.601 -12.317 1.00 1.00 H new ATOM 0 HD11 ILE A 85 79.230 -8.497 -10.868 1.00 1.00 H new ATOM 0 HD12 ILE A 85 80.118 -7.239 -11.760 1.00 1.00 H new ATOM 0 HD13 ILE A 85 80.745 -8.904 -11.709 1.00 1.00 H new ATOM 1283 N ALA A 86 83.517 -9.657 -7.886 1.00 1.00 N ATOM 1284 CA ALA A 86 83.755 -9.921 -6.458 1.00 1.00 C ATOM 1285 C ALA A 86 85.084 -10.674 -6.230 1.00 1.00 C ATOM 1286 O ALA A 86 85.548 -10.800 -5.098 1.00 1.00 O ATOM 1287 CB ALA A 86 82.583 -10.696 -5.854 1.00 1.00 C ATOM 0 H ALA A 86 83.100 -10.437 -8.394 1.00 1.00 H new ATOM 0 HA ALA A 86 83.835 -8.959 -5.953 1.00 1.00 H new ATOM 0 HB1 ALA A 86 82.776 -10.883 -4.798 1.00 1.00 H new ATOM 0 HB2 ALA A 86 81.668 -10.112 -5.958 1.00 1.00 H new ATOM 0 HB3 ALA A 86 82.468 -11.646 -6.375 1.00 1.00 H new ATOM 1293 N GLU A 87 85.662 -11.199 -7.315 1.00 1.00 N ATOM 1294 CA GLU A 87 86.921 -11.974 -7.236 1.00 1.00 C ATOM 1295 C GLU A 87 88.185 -11.098 -7.347 1.00 1.00 C ATOM 1296 O GLU A 87 89.196 -11.384 -6.705 1.00 1.00 O ATOM 1297 CB GLU A 87 86.949 -13.027 -8.348 1.00 1.00 C ATOM 1298 CG GLU A 87 88.004 -14.136 -8.051 1.00 1.00 C ATOM 1299 CD GLU A 87 88.977 -14.286 -9.222 1.00 1.00 C ATOM 1300 OE1 GLU A 87 88.515 -14.326 -10.349 1.00 1.00 O ATOM 1301 OE2 GLU A 87 90.172 -14.358 -8.973 1.00 1.00 O ATOM 0 H GLU A 87 85.286 -11.106 -8.259 1.00 1.00 H new ATOM 0 HA GLU A 87 86.935 -12.441 -6.251 1.00 1.00 H new ATOM 0 HB2 GLU A 87 85.962 -13.479 -8.449 1.00 1.00 H new ATOM 0 HB3 GLU A 87 87.180 -12.548 -9.300 1.00 1.00 H new ATOM 0 HG2 GLU A 87 88.555 -13.887 -7.144 1.00 1.00 H new ATOM 0 HG3 GLU A 87 87.500 -15.085 -7.867 1.00 1.00 H new ATOM 1308 N ALA A 88 88.140 -10.057 -8.190 1.00 1.00 N ATOM 1309 CA ALA A 88 89.310 -9.171 -8.393 1.00 1.00 C ATOM 1310 C ALA A 88 89.033 -7.763 -7.851 1.00 1.00 C ATOM 1311 O ALA A 88 89.930 -6.921 -7.751 1.00 1.00 O ATOM 1312 CB ALA A 88 89.653 -9.120 -9.882 1.00 1.00 C ATOM 0 H ALA A 88 87.319 -9.804 -8.740 1.00 1.00 H new ATOM 0 HA ALA A 88 90.160 -9.574 -7.842 1.00 1.00 H new ATOM 0 HB1 ALA A 88 90.514 -8.469 -10.035 1.00 1.00 H new ATOM 0 HB2 ALA A 88 89.890 -10.124 -10.235 1.00 1.00 H new ATOM 0 HB3 ALA A 88 88.800 -8.731 -10.439 1.00 1.00 H new ATOM 1318 N VAL A 89 87.783 -7.541 -7.474 1.00 1.00 N ATOM 1319 CA VAL A 89 87.379 -6.246 -6.894 1.00 1.00 C ATOM 1320 C VAL A 89 87.325 -6.364 -5.397 1.00 1.00 C ATOM 1321 O VAL A 89 86.534 -5.678 -4.749 1.00 1.00 O ATOM 1322 CB VAL A 89 86.068 -5.686 -7.436 1.00 1.00 C ATOM 1323 CG1 VAL A 89 85.854 -4.215 -6.976 1.00 1.00 C ATOM 1324 CG2 VAL A 89 86.103 -5.748 -8.966 1.00 1.00 C ATOM 0 H VAL A 89 87.030 -8.225 -7.553 1.00 1.00 H new ATOM 0 HA VAL A 89 88.139 -5.526 -7.197 1.00 1.00 H new ATOM 0 HB VAL A 89 85.241 -6.283 -7.050 1.00 1.00 H new ATOM 0 HG11 VAL A 89 84.912 -3.842 -7.377 1.00 1.00 H new ATOM 0 HG12 VAL A 89 85.826 -4.175 -5.887 1.00 1.00 H new ATOM 0 HG13 VAL A 89 86.674 -3.597 -7.341 1.00 1.00 H new ATOM 0 HG21 VAL A 89 85.171 -5.350 -9.368 1.00 1.00 H new ATOM 0 HG22 VAL A 89 86.940 -5.155 -9.335 1.00 1.00 H new ATOM 0 HG23 VAL A 89 86.223 -6.783 -9.286 1.00 1.00 H new ATOM 1334 N GLY A 90 88.209 -7.185 -4.837 1.00 1.00 N ATOM 1335 CA GLY A 90 88.289 -7.312 -3.401 1.00 1.00 C ATOM 1336 C GLY A 90 88.802 -6.002 -2.783 1.00 1.00 C ATOM 1337 O GLY A 90 88.251 -5.557 -1.778 1.00 1.00 O ATOM 0 H GLY A 90 88.870 -7.763 -5.356 1.00 1.00 H new ATOM 0 HA2 GLY A 90 87.307 -7.555 -2.994 1.00 1.00 H new ATOM 0 HA3 GLY A 90 88.956 -8.133 -3.137 1.00 1.00 H new ATOM 1341 N PRO A 91 89.818 -5.340 -3.362 1.00 1.00 N ATOM 1342 CA PRO A 91 90.324 -4.036 -2.831 1.00 1.00 C ATOM 1343 C PRO A 91 89.166 -3.125 -2.417 1.00 1.00 C ATOM 1344 O PRO A 91 89.364 -2.124 -1.727 1.00 1.00 O ATOM 1345 CB PRO A 91 91.120 -3.414 -4.016 1.00 1.00 C ATOM 1346 CG PRO A 91 91.070 -4.419 -5.143 1.00 1.00 C ATOM 1347 CD PRO A 91 90.639 -5.747 -4.527 1.00 1.00 C ATOM 0 HA PRO A 91 90.939 -4.166 -1.940 1.00 1.00 H new ATOM 0 HB2 PRO A 91 90.680 -2.465 -4.323 1.00 1.00 H new ATOM 0 HB3 PRO A 91 92.150 -3.208 -3.725 1.00 1.00 H new ATOM 0 HG2 PRO A 91 90.366 -4.103 -5.913 1.00 1.00 H new ATOM 0 HG3 PRO A 91 92.045 -4.513 -5.622 1.00 1.00 H new ATOM 0 HD2 PRO A 91 90.065 -6.348 -5.232 1.00 1.00 H new ATOM 0 HD3 PRO A 91 91.498 -6.346 -4.223 1.00 1.00 H new ATOM 1355 N HIS A 92 87.968 -3.485 -2.844 1.00 1.00 N ATOM 1356 CA HIS A 92 86.805 -2.699 -2.511 1.00 1.00 C ATOM 1357 C HIS A 92 86.721 -2.607 -1.005 1.00 1.00 C ATOM 1358 O HIS A 92 86.060 -1.747 -0.486 1.00 1.00 O ATOM 1359 CB HIS A 92 85.511 -3.355 -3.031 1.00 1.00 C ATOM 1360 CG HIS A 92 85.198 -4.581 -2.206 1.00 1.00 C ATOM 1361 ND1 HIS A 92 85.775 -5.813 -2.460 1.00 1.00 N ATOM 1362 CD2 HIS A 92 84.414 -4.757 -1.093 1.00 1.00 C ATOM 1363 CE1 HIS A 92 85.337 -6.669 -1.514 1.00 1.00 C ATOM 1364 NE2 HIS A 92 84.507 -6.076 -0.658 1.00 1.00 N ATOM 0 H HIS A 92 87.781 -4.309 -3.416 1.00 1.00 H new ATOM 0 HA HIS A 92 86.901 -1.717 -2.974 1.00 1.00 H new ATOM 0 HB2 HIS A 92 84.685 -2.646 -2.976 1.00 1.00 H new ATOM 0 HB3 HIS A 92 85.626 -3.629 -4.080 1.00 1.00 H new ATOM 0 HD1 HIS A 92 86.415 -6.033 -3.223 1.00 1.00 H new ATOM 0 HD2 HIS A 92 83.816 -3.989 -0.626 1.00 1.00 H new ATOM 0 HE1 HIS A 92 85.624 -7.709 -1.458 1.00 1.00 H new ATOM 1372 N LEU A 93 87.411 -3.502 -0.314 1.00 1.00 N ATOM 1373 CA LEU A 93 87.397 -3.483 1.144 1.00 1.00 C ATOM 1374 C LEU A 93 88.070 -2.205 1.624 1.00 1.00 C ATOM 1375 O LEU A 93 87.468 -1.399 2.337 1.00 1.00 O ATOM 1376 CB LEU A 93 88.110 -4.728 1.700 1.00 1.00 C ATOM 1377 CG LEU A 93 89.517 -4.897 1.044 1.00 1.00 C ATOM 1378 CD1 LEU A 93 90.631 -4.432 2.010 1.00 1.00 C ATOM 1379 CD2 LEU A 93 89.760 -6.371 0.666 1.00 1.00 C ATOM 0 H LEU A 93 87.980 -4.240 -0.729 1.00 1.00 H new ATOM 0 HA LEU A 93 86.369 -3.503 1.507 1.00 1.00 H new ATOM 0 HB2 LEU A 93 88.216 -4.640 2.781 1.00 1.00 H new ATOM 0 HB3 LEU A 93 87.506 -5.615 1.510 1.00 1.00 H new ATOM 0 HG LEU A 93 89.543 -4.281 0.145 1.00 1.00 H new ATOM 0 HD11 LEU A 93 91.603 -4.559 1.533 1.00 1.00 H new ATOM 0 HD12 LEU A 93 90.482 -3.381 2.258 1.00 1.00 H new ATOM 0 HD13 LEU A 93 90.594 -5.028 2.922 1.00 1.00 H new ATOM 0 HD21 LEU A 93 90.745 -6.472 0.210 1.00 1.00 H new ATOM 0 HD22 LEU A 93 89.710 -6.989 1.562 1.00 1.00 H new ATOM 0 HD23 LEU A 93 88.997 -6.696 -0.042 1.00 1.00 H new ATOM 1391 N ALA A 94 89.324 -2.021 1.213 1.00 1.00 N ATOM 1392 CA ALA A 94 90.084 -0.834 1.577 1.00 1.00 C ATOM 1393 C ALA A 94 89.338 0.391 1.090 1.00 1.00 C ATOM 1394 O ALA A 94 89.033 1.293 1.867 1.00 1.00 O ATOM 1395 CB ALA A 94 91.457 -0.881 0.921 1.00 1.00 C ATOM 0 H ALA A 94 89.833 -2.682 0.627 1.00 1.00 H new ATOM 0 HA ALA A 94 90.206 -0.793 2.659 1.00 1.00 H new ATOM 0 HB1 ALA A 94 92.022 0.009 1.196 1.00 1.00 H new ATOM 0 HB2 ALA A 94 91.991 -1.769 1.259 1.00 1.00 H new ATOM 0 HB3 ALA A 94 91.342 -0.917 -0.162 1.00 1.00 H new ATOM 1401 N ARG A 95 89.011 0.419 -0.204 1.00 1.00 N ATOM 1402 CA ARG A 95 88.272 1.553 -0.722 1.00 1.00 C ATOM 1403 C ARG A 95 86.980 1.650 0.069 1.00 1.00 C ATOM 1404 O ARG A 95 86.687 2.650 0.731 1.00 1.00 O ATOM 1405 CB ARG A 95 87.990 1.406 -2.231 1.00 1.00 C ATOM 1406 CG ARG A 95 89.315 1.196 -3.024 1.00 1.00 C ATOM 1407 CD ARG A 95 89.453 2.245 -4.138 1.00 1.00 C ATOM 1408 NE ARG A 95 88.314 2.186 -5.046 1.00 1.00 N ATOM 1409 CZ ARG A 95 88.188 1.202 -5.930 1.00 1.00 C ATOM 1410 NH1 ARG A 95 89.086 0.259 -5.984 1.00 1.00 N ATOM 1411 NH2 ARG A 95 87.166 1.179 -6.742 1.00 1.00 N ATOM 0 H ARG A 95 89.240 -0.306 -0.884 1.00 1.00 H new ATOM 0 HA ARG A 95 88.859 2.465 -0.610 1.00 1.00 H new ATOM 0 HB2 ARG A 95 87.322 0.561 -2.400 1.00 1.00 H new ATOM 0 HB3 ARG A 95 87.478 2.296 -2.598 1.00 1.00 H new ATOM 0 HG2 ARG A 95 90.165 1.265 -2.346 1.00 1.00 H new ATOM 0 HG3 ARG A 95 89.332 0.195 -3.456 1.00 1.00 H new ATOM 0 HD2 ARG A 95 89.524 3.241 -3.700 1.00 1.00 H new ATOM 0 HD3 ARG A 95 90.376 2.074 -4.693 1.00 1.00 H new ATOM 0 HE ARG A 95 87.601 2.914 -5.002 1.00 1.00 H new ATOM 0 HH11 ARG A 95 89.884 0.277 -5.348 1.00 1.00 H new ATOM 0 HH12 ARG A 95 88.991 -0.497 -6.662 1.00 1.00 H new ATOM 0 HH21 ARG A 95 86.463 1.917 -6.698 1.00 1.00 H new ATOM 0 HH22 ARG A 95 87.070 0.423 -7.420 1.00 1.00 H new ATOM 1425 N ALA A 96 86.159 0.632 0.080 1.00 1.00 N ATOM 1426 CA ALA A 96 84.930 0.740 0.831 1.00 1.00 C ATOM 1427 C ALA A 96 85.191 1.324 2.217 1.00 1.00 C ATOM 1428 O ALA A 96 84.249 1.458 2.987 1.00 1.00 O ATOM 1429 CB ALA A 96 84.204 -0.589 0.859 1.00 1.00 C ATOM 0 H ALA A 96 86.308 -0.254 -0.404 1.00 1.00 H new ATOM 0 HA ALA A 96 84.262 1.441 0.331 1.00 1.00 H new ATOM 0 HB1 ALA A 96 83.281 -0.487 1.429 1.00 1.00 H new ATOM 0 HB2 ALA A 96 83.969 -0.897 -0.160 1.00 1.00 H new ATOM 0 HB3 ALA A 96 84.839 -1.341 1.328 1.00 1.00 H new ATOM 1435 N LEU A 97 86.486 1.409 2.606 1.00 1.00 N ATOM 1436 CA LEU A 97 86.922 1.706 3.985 1.00 1.00 C ATOM 1437 C LEU A 97 85.730 1.672 4.919 1.00 1.00 C ATOM 1438 O LEU A 97 85.776 0.905 5.857 1.00 1.00 O ATOM 1439 CB LEU A 97 87.454 3.153 3.906 1.00 1.00 C ATOM 1440 CG LEU A 97 88.392 3.518 5.051 1.00 1.00 C ATOM 1441 CD1 LEU A 97 88.980 4.907 4.774 1.00 1.00 C ATOM 1442 CD2 LEU A 97 87.628 3.561 6.369 1.00 1.00 C ATOM 0 H LEU A 97 87.264 1.271 1.961 1.00 1.00 H new ATOM 0 HA LEU A 97 87.659 0.993 4.353 1.00 1.00 H new ATOM 0 HB2 LEU A 97 87.978 3.288 2.960 1.00 1.00 H new ATOM 0 HB3 LEU A 97 86.610 3.843 3.904 1.00 1.00 H new ATOM 0 HG LEU A 97 89.182 2.770 5.123 1.00 1.00 H new ATOM 0 HD11 LEU A 97 89.654 5.185 5.584 1.00 1.00 H new ATOM 0 HD12 LEU A 97 89.531 4.888 3.834 1.00 1.00 H new ATOM 0 HD13 LEU A 97 88.173 5.637 4.707 1.00 1.00 H new ATOM 0 HD21 LEU A 97 88.311 3.823 7.177 1.00 1.00 H new ATOM 0 HD22 LEU A 97 86.836 4.308 6.307 1.00 1.00 H new ATOM 0 HD23 LEU A 97 87.189 2.583 6.567 1.00 1.00 H new ATOM 1454 N GLY A 98 84.662 2.380 4.708 1.00 1.00 N ATOM 1455 CA GLY A 98 83.531 2.204 5.586 1.00 1.00 C ATOM 1456 C GLY A 98 83.289 0.682 5.725 1.00 1.00 C ATOM 1457 O GLY A 98 82.741 0.241 6.737 1.00 1.00 O ATOM 0 H GLY A 98 84.544 3.066 3.962 1.00 1.00 H new ATOM 0 HA2 GLY A 98 83.727 2.652 6.560 1.00 1.00 H new ATOM 0 HA3 GLY A 98 82.648 2.698 5.180 1.00 1.00 H new ATOM 1461 N GLN A 99 83.770 -0.143 4.732 1.00 1.00 N ATOM 1462 CA GLN A 99 83.599 -1.607 4.900 1.00 1.00 C ATOM 1463 C GLN A 99 84.413 -2.047 6.078 1.00 1.00 C ATOM 1464 O GLN A 99 84.147 -3.076 6.707 1.00 1.00 O ATOM 1465 CB GLN A 99 84.061 -2.390 3.677 1.00 1.00 C ATOM 1466 CG GLN A 99 83.649 -3.872 3.766 1.00 1.00 C ATOM 1467 CD GLN A 99 82.233 -4.049 3.200 1.00 1.00 C ATOM 1468 OE1 GLN A 99 81.405 -4.727 3.801 1.00 1.00 O ATOM 1469 NE2 GLN A 99 81.910 -3.457 2.077 1.00 1.00 N ATOM 0 H GLN A 99 84.240 0.160 3.879 1.00 1.00 H new ATOM 0 HA GLN A 99 82.537 -1.805 5.043 1.00 1.00 H new ATOM 0 HB2 GLN A 99 83.635 -1.946 2.777 1.00 1.00 H new ATOM 0 HB3 GLN A 99 85.145 -2.317 3.585 1.00 1.00 H new ATOM 0 HG2 GLN A 99 84.354 -4.490 3.209 1.00 1.00 H new ATOM 0 HG3 GLN A 99 83.681 -4.207 4.803 1.00 1.00 H new ATOM 0 HE21 GLN A 99 82.601 -2.894 1.580 1.00 1.00 H new ATOM 0 HE22 GLN A 99 80.968 -3.559 1.699 1.00 1.00 H new ATOM 1478 N ILE A 100 85.379 -1.215 6.415 1.00 1.00 N ATOM 1479 CA ILE A 100 86.216 -1.492 7.579 1.00 1.00 C ATOM 1480 C ILE A 100 85.344 -1.455 8.810 1.00 1.00 C ATOM 1481 O ILE A 100 85.411 -2.346 9.648 1.00 1.00 O ATOM 1482 CB ILE A 100 87.353 -0.459 7.745 1.00 1.00 C ATOM 1483 CG1 ILE A 100 88.356 -0.584 6.578 1.00 1.00 C ATOM 1484 CG2 ILE A 100 88.069 -0.670 9.087 1.00 1.00 C ATOM 1485 CD1 ILE A 100 89.246 -1.839 6.680 1.00 1.00 C ATOM 0 H ILE A 100 85.606 -0.356 5.914 1.00 1.00 H new ATOM 0 HA ILE A 100 86.676 -2.470 7.439 1.00 1.00 H new ATOM 0 HB ILE A 100 86.924 0.543 7.733 1.00 1.00 H new ATOM 0 HG12 ILE A 100 87.808 -0.610 5.636 1.00 1.00 H new ATOM 0 HG13 ILE A 100 88.989 0.303 6.554 1.00 1.00 H new ATOM 0 HG21 ILE A 100 88.868 0.064 9.192 1.00 1.00 H new ATOM 0 HG22 ILE A 100 87.356 -0.550 9.903 1.00 1.00 H new ATOM 0 HG23 ILE A 100 88.492 -1.674 9.120 1.00 1.00 H new ATOM 0 HD11 ILE A 100 89.929 -1.870 5.831 1.00 1.00 H new ATOM 0 HD12 ILE A 100 89.819 -1.804 7.606 1.00 1.00 H new ATOM 0 HD13 ILE A 100 88.619 -2.731 6.674 1.00 1.00 H new ATOM 1497 N VAL A 101 84.510 -0.421 8.930 1.00 1.00 N ATOM 1498 CA VAL A 101 83.649 -0.354 10.094 1.00 1.00 C ATOM 1499 C VAL A 101 82.772 -1.597 10.069 1.00 1.00 C ATOM 1500 O VAL A 101 82.798 -2.394 10.991 1.00 1.00 O ATOM 1501 CB VAL A 101 82.809 0.936 10.084 1.00 1.00 C ATOM 1502 CG1 VAL A 101 81.926 0.977 11.330 1.00 1.00 C ATOM 1503 CG2 VAL A 101 83.749 2.149 10.103 1.00 1.00 C ATOM 0 H VAL A 101 84.418 0.346 8.264 1.00 1.00 H new ATOM 0 HA VAL A 101 84.236 -0.326 11.012 1.00 1.00 H new ATOM 0 HB VAL A 101 82.187 0.958 9.189 1.00 1.00 H new ATOM 0 HG11 VAL A 101 81.331 1.890 11.324 1.00 1.00 H new ATOM 0 HG12 VAL A 101 81.263 0.112 11.335 1.00 1.00 H new ATOM 0 HG13 VAL A 101 82.553 0.959 12.221 1.00 1.00 H new ATOM 0 HG21 VAL A 101 83.160 3.066 10.096 1.00 1.00 H new ATOM 0 HG22 VAL A 101 84.363 2.119 11.003 1.00 1.00 H new ATOM 0 HG23 VAL A 101 84.392 2.124 9.224 1.00 1.00 H new ATOM 1513 N CYS A 102 82.000 -1.773 9.002 1.00 1.00 N ATOM 1514 CA CYS A 102 81.128 -2.918 8.879 1.00 1.00 C ATOM 1515 C CYS A 102 81.872 -4.198 9.280 1.00 1.00 C ATOM 1516 O CYS A 102 81.272 -5.206 9.601 1.00 1.00 O ATOM 1517 CB CYS A 102 80.582 -2.954 7.421 1.00 1.00 C ATOM 1518 SG CYS A 102 80.775 -4.572 6.643 1.00 1.00 S ATOM 0 H CYS A 102 81.966 -1.130 8.211 1.00 1.00 H new ATOM 0 HA CYS A 102 80.278 -2.843 9.558 1.00 1.00 H new ATOM 0 HB2 CYS A 102 79.527 -2.682 7.426 1.00 1.00 H new ATOM 0 HB3 CYS A 102 81.102 -2.204 6.824 1.00 1.00 H new ATOM 1523 N ARG A 103 83.189 -4.130 9.300 1.00 1.00 N ATOM 1524 CA ARG A 103 84.010 -5.283 9.712 1.00 1.00 C ATOM 1525 C ARG A 103 84.406 -5.219 11.201 1.00 1.00 C ATOM 1526 O ARG A 103 84.342 -6.200 11.946 1.00 1.00 O ATOM 1527 CB ARG A 103 85.261 -5.344 8.794 1.00 1.00 C ATOM 1528 CG ARG A 103 86.461 -6.068 9.454 1.00 1.00 C ATOM 1529 CD ARG A 103 86.133 -7.543 9.770 1.00 1.00 C ATOM 1530 NE ARG A 103 86.801 -7.959 11.004 1.00 1.00 N ATOM 1531 CZ ARG A 103 88.125 -7.915 11.130 1.00 1.00 C ATOM 1532 NH1 ARG A 103 88.870 -7.476 10.153 1.00 1.00 N ATOM 1533 NH2 ARG A 103 88.684 -8.317 12.239 1.00 1.00 N ATOM 0 H ARG A 103 83.723 -3.301 9.040 1.00 1.00 H new ATOM 0 HA ARG A 103 83.423 -6.195 9.602 1.00 1.00 H new ATOM 0 HB2 ARG A 103 85.000 -5.855 7.867 1.00 1.00 H new ATOM 0 HB3 ARG A 103 85.558 -4.330 8.526 1.00 1.00 H new ATOM 0 HG2 ARG A 103 87.324 -6.021 8.790 1.00 1.00 H new ATOM 0 HG3 ARG A 103 86.737 -5.551 10.373 1.00 1.00 H new ATOM 0 HD2 ARG A 103 85.055 -7.669 9.872 1.00 1.00 H new ATOM 0 HD3 ARG A 103 86.452 -8.179 8.944 1.00 1.00 H new ATOM 0 HE ARG A 103 86.238 -8.291 11.787 1.00 1.00 H new ATOM 0 HH11 ARG A 103 88.438 -7.163 9.284 1.00 1.00 H new ATOM 0 HH12 ARG A 103 89.884 -7.446 10.259 1.00 1.00 H new ATOM 0 HH21 ARG A 103 88.106 -8.663 13.005 1.00 1.00 H new ATOM 0 HH22 ARG A 103 89.699 -8.285 12.340 1.00 1.00 H new ATOM 1547 N TYR A 104 84.812 -4.021 11.573 1.00 1.00 N ATOM 1548 CA TYR A 104 85.250 -3.607 12.912 1.00 1.00 C ATOM 1549 C TYR A 104 84.208 -2.721 13.605 1.00 1.00 C ATOM 1550 O TYR A 104 84.559 -1.984 14.530 1.00 1.00 O ATOM 1551 CB TYR A 104 86.661 -2.961 12.890 1.00 1.00 C ATOM 1552 CG TYR A 104 87.717 -4.048 13.051 1.00 1.00 C ATOM 1553 CD1 TYR A 104 87.816 -4.740 14.269 1.00 1.00 C ATOM 1554 CD2 TYR A 104 88.568 -4.377 11.992 1.00 1.00 C ATOM 1555 CE1 TYR A 104 88.766 -5.752 14.425 1.00 1.00 C ATOM 1556 CE2 TYR A 104 89.521 -5.398 12.149 1.00 1.00 C ATOM 1557 CZ TYR A 104 89.618 -6.084 13.369 1.00 1.00 C ATOM 1558 OH TYR A 104 90.546 -7.098 13.530 1.00 1.00 O ATOM 0 H TYR A 104 84.851 -3.249 10.908 1.00 1.00 H new ATOM 0 HA TYR A 104 85.337 -4.511 13.514 1.00 1.00 H new ATOM 0 HB2 TYR A 104 86.814 -2.426 11.953 1.00 1.00 H new ATOM 0 HB3 TYR A 104 86.751 -2.229 13.693 1.00 1.00 H new ATOM 0 HD1 TYR A 104 87.156 -4.489 15.087 1.00 1.00 H new ATOM 0 HD2 TYR A 104 88.493 -3.847 11.054 1.00 1.00 H new ATOM 0 HE1 TYR A 104 88.842 -6.279 15.365 1.00 1.00 H new ATOM 0 HE2 TYR A 104 90.178 -5.654 11.331 1.00 1.00 H new ATOM 0 HH TYR A 104 90.201 -7.760 14.165 1.00 1.00 H new ATOM 1568 N GLY A 105 82.933 -2.770 13.194 1.00 1.00 N ATOM 1569 CA GLY A 105 81.940 -1.938 13.852 1.00 1.00 C ATOM 1570 C GLY A 105 80.527 -2.280 13.416 1.00 1.00 C ATOM 1571 O GLY A 105 79.581 -1.788 14.020 1.00 1.00 O ATOM 0 H GLY A 105 82.582 -3.357 12.437 1.00 1.00 H new ATOM 0 HA2 GLY A 105 82.025 -2.059 14.932 1.00 1.00 H new ATOM 0 HA3 GLY A 105 82.143 -0.890 13.632 1.00 1.00 H new ATOM 1575 N ALA A 106 80.389 -3.105 12.363 1.00 1.00 N ATOM 1576 CA ALA A 106 79.084 -3.496 11.846 1.00 1.00 C ATOM 1577 C ALA A 106 77.992 -3.509 12.892 1.00 1.00 C ATOM 1578 O ALA A 106 77.572 -4.562 13.342 1.00 1.00 O ATOM 1579 CB ALA A 106 79.201 -4.889 11.193 1.00 1.00 C ATOM 0 H ALA A 106 81.176 -3.511 11.857 1.00 1.00 H new ATOM 0 HA ALA A 106 78.792 -2.742 11.115 1.00 1.00 H new ATOM 0 HB1 ALA A 106 78.229 -5.191 10.803 1.00 1.00 H new ATOM 0 HB2 ALA A 106 79.923 -4.849 10.377 1.00 1.00 H new ATOM 0 HB3 ALA A 106 79.534 -5.613 11.937 1.00 1.00 H new ATOM 1585 N THR A 107 77.526 -2.346 13.283 1.00 1.00 N ATOM 1586 CA THR A 107 76.463 -2.283 14.243 1.00 1.00 C ATOM 1587 C THR A 107 75.182 -2.262 13.446 1.00 1.00 C ATOM 1588 O THR A 107 74.096 -2.130 14.005 1.00 1.00 O ATOM 1589 CB THR A 107 76.587 -1.012 15.092 1.00 1.00 C ATOM 1590 OG1 THR A 107 75.631 -1.048 16.149 1.00 1.00 O ATOM 1591 CG2 THR A 107 76.335 0.211 14.207 1.00 1.00 C ATOM 0 H THR A 107 77.865 -1.443 12.952 1.00 1.00 H new ATOM 0 HA THR A 107 76.491 -3.131 14.927 1.00 1.00 H new ATOM 0 HB THR A 107 77.588 -0.952 15.519 1.00 1.00 H new ATOM 0 HG1 THR A 107 74.773 -1.371 15.803 1.00 1.00 H new ATOM 0 HG21 THR A 107 76.422 1.118 14.806 1.00 1.00 H new ATOM 0 HG22 THR A 107 77.070 0.236 13.403 1.00 1.00 H new ATOM 0 HG23 THR A 107 75.333 0.152 13.781 1.00 1.00 H new ATOM 1599 N VAL A 108 75.312 -2.430 12.111 1.00 1.00 N ATOM 1600 CA VAL A 108 74.153 -2.493 11.235 1.00 1.00 C ATOM 1601 C VAL A 108 73.757 -3.929 10.967 1.00 1.00 C ATOM 1602 O VAL A 108 72.983 -4.160 10.044 1.00 1.00 O ATOM 1603 CB VAL A 108 74.384 -1.783 9.878 1.00 1.00 C ATOM 1604 CG1 VAL A 108 75.449 -2.524 9.059 1.00 1.00 C ATOM 1605 CG2 VAL A 108 73.059 -1.747 9.059 1.00 1.00 C ATOM 0 H VAL A 108 76.208 -2.522 11.633 1.00 1.00 H new ATOM 0 HA VAL A 108 73.354 -1.971 11.761 1.00 1.00 H new ATOM 0 HB VAL A 108 74.722 -0.767 10.081 1.00 1.00 H new ATOM 0 HG11 VAL A 108 75.599 -2.012 8.109 1.00 1.00 H new ATOM 0 HG12 VAL A 108 76.387 -2.542 9.614 1.00 1.00 H new ATOM 0 HG13 VAL A 108 75.119 -3.546 8.872 1.00 1.00 H new ATOM 0 HG21 VAL A 108 73.233 -1.246 8.107 1.00 1.00 H new ATOM 0 HG22 VAL A 108 72.717 -2.766 8.875 1.00 1.00 H new ATOM 0 HG23 VAL A 108 72.299 -1.205 9.621 1.00 1.00 H new ATOM 1615 N ILE A 109 74.200 -4.933 11.747 1.00 1.00 N ATOM 1616 CA ILE A 109 73.784 -6.289 11.513 1.00 1.00 C ATOM 1617 C ILE A 109 72.757 -6.735 12.589 1.00 1.00 C ATOM 1618 O ILE A 109 72.157 -7.784 12.429 1.00 1.00 O ATOM 1619 CB ILE A 109 75.028 -7.204 11.626 1.00 1.00 C ATOM 1620 CG1 ILE A 109 75.626 -7.096 13.056 1.00 1.00 C ATOM 1621 CG2 ILE A 109 76.094 -6.776 10.602 1.00 1.00 C ATOM 1622 CD1 ILE A 109 76.803 -8.067 13.234 1.00 1.00 C ATOM 0 H ILE A 109 74.839 -4.812 12.532 1.00 1.00 H new ATOM 0 HA ILE A 109 73.326 -6.358 10.526 1.00 1.00 H new ATOM 0 HB ILE A 109 74.728 -8.233 11.427 1.00 1.00 H new ATOM 0 HG12 ILE A 109 75.961 -6.075 13.238 1.00 1.00 H new ATOM 0 HG13 ILE A 109 74.855 -7.314 13.794 1.00 1.00 H new ATOM 0 HG21 ILE A 109 76.965 -7.426 10.690 1.00 1.00 H new ATOM 0 HG22 ILE A 109 75.683 -6.854 9.595 1.00 1.00 H new ATOM 0 HG23 ILE A 109 76.390 -5.745 10.794 1.00 1.00 H new ATOM 0 HD11 ILE A 109 77.204 -7.972 14.243 1.00 1.00 H new ATOM 0 HD12 ILE A 109 76.459 -9.089 13.075 1.00 1.00 H new ATOM 0 HD13 ILE A 109 77.583 -7.830 12.510 1.00 1.00 H new ATOM 1634 N PRO A 110 72.586 -6.030 13.724 1.00 1.00 N ATOM 1635 CA PRO A 110 71.668 -6.510 14.799 1.00 1.00 C ATOM 1636 C PRO A 110 70.202 -6.492 14.385 1.00 1.00 C ATOM 1637 O PRO A 110 69.487 -7.474 14.595 1.00 1.00 O ATOM 1638 CB PRO A 110 71.952 -5.588 16.001 1.00 1.00 C ATOM 1639 CG PRO A 110 72.471 -4.327 15.403 1.00 1.00 C ATOM 1640 CD PRO A 110 73.182 -4.723 14.100 1.00 1.00 C ATOM 0 HA PRO A 110 71.851 -7.558 15.037 1.00 1.00 H new ATOM 0 HB2 PRO A 110 71.048 -5.407 16.582 1.00 1.00 H new ATOM 0 HB3 PRO A 110 72.681 -6.034 16.677 1.00 1.00 H new ATOM 0 HG2 PRO A 110 71.658 -3.628 15.205 1.00 1.00 H new ATOM 0 HG3 PRO A 110 73.160 -3.829 16.085 1.00 1.00 H new ATOM 0 HD2 PRO A 110 73.024 -3.977 13.321 1.00 1.00 H new ATOM 0 HD3 PRO A 110 74.259 -4.807 14.247 1.00 1.00 H new ATOM 1648 N ASN A 111 69.742 -5.383 13.815 1.00 1.00 N ATOM 1649 CA ASN A 111 68.347 -5.302 13.417 1.00 1.00 C ATOM 1650 C ASN A 111 68.078 -6.271 12.263 1.00 1.00 C ATOM 1651 O ASN A 111 67.323 -7.223 12.417 1.00 1.00 O ATOM 1652 CB ASN A 111 68.020 -3.856 13.019 1.00 1.00 C ATOM 1653 CG ASN A 111 66.675 -3.778 12.305 1.00 1.00 C ATOM 1654 OD1 ASN A 111 66.627 -3.721 11.078 1.00 1.00 O ATOM 1655 ND2 ASN A 111 65.574 -3.756 13.007 1.00 1.00 N ATOM 0 H ASN A 111 70.299 -4.550 13.623 1.00 1.00 H new ATOM 0 HA ASN A 111 67.704 -5.587 14.249 1.00 1.00 H new ATOM 0 HB2 ASN A 111 68.001 -3.226 13.908 1.00 1.00 H new ATOM 0 HB3 ASN A 111 68.804 -3.467 12.369 1.00 1.00 H new ATOM 0 HD21 ASN A 111 64.671 -3.691 12.537 1.00 1.00 H new ATOM 0 HD22 ASN A 111 65.617 -3.803 14.025 1.00 1.00 H new ATOM 1662 N ILE A 112 68.669 -6.020 11.103 1.00 1.00 N ATOM 1663 CA ILE A 112 68.452 -6.859 9.924 1.00 1.00 C ATOM 1664 C ILE A 112 68.481 -8.374 10.243 1.00 1.00 C ATOM 1665 O ILE A 112 67.649 -9.123 9.772 1.00 1.00 O ATOM 1666 CB ILE A 112 69.587 -6.490 8.933 1.00 1.00 C ATOM 1667 CG1 ILE A 112 69.695 -7.517 7.800 1.00 1.00 C ATOM 1668 CG2 ILE A 112 70.926 -6.401 9.672 1.00 1.00 C ATOM 1669 CD1 ILE A 112 70.798 -7.130 6.811 1.00 1.00 C ATOM 0 H ILE A 112 69.306 -5.239 10.949 1.00 1.00 H new ATOM 0 HA ILE A 112 67.460 -6.674 9.512 1.00 1.00 H new ATOM 0 HB ILE A 112 69.344 -5.521 8.497 1.00 1.00 H new ATOM 0 HG12 ILE A 112 69.905 -8.502 8.216 1.00 1.00 H new ATOM 0 HG13 ILE A 112 68.741 -7.588 7.277 1.00 1.00 H new ATOM 0 HG21 ILE A 112 71.715 -6.141 8.966 1.00 1.00 H new ATOM 0 HG22 ILE A 112 70.865 -5.635 10.445 1.00 1.00 H new ATOM 0 HG23 ILE A 112 71.153 -7.363 10.132 1.00 1.00 H new ATOM 0 HD11 ILE A 112 70.853 -7.875 6.018 1.00 1.00 H new ATOM 0 HD12 ILE A 112 70.573 -6.155 6.378 1.00 1.00 H new ATOM 0 HD13 ILE A 112 71.754 -7.084 7.332 1.00 1.00 H new ATOM 1681 N ASN A 113 69.396 -8.767 11.094 1.00 1.00 N ATOM 1682 CA ASN A 113 69.471 -10.192 11.492 1.00 1.00 C ATOM 1683 C ASN A 113 68.245 -10.549 12.310 1.00 1.00 C ATOM 1684 O ASN A 113 67.640 -11.600 12.160 1.00 1.00 O ATOM 1685 CB ASN A 113 70.766 -10.562 12.245 1.00 1.00 C ATOM 1686 CG ASN A 113 71.827 -11.079 11.264 1.00 1.00 C ATOM 1687 OD1 ASN A 113 71.945 -12.291 11.070 1.00 1.00 O ATOM 1688 ND2 ASN A 113 72.588 -10.243 10.628 1.00 1.00 N ATOM 0 H ASN A 113 70.091 -8.158 11.526 1.00 1.00 H new ATOM 0 HA ASN A 113 69.495 -10.780 10.575 1.00 1.00 H new ATOM 0 HB2 ASN A 113 71.147 -9.690 12.776 1.00 1.00 H new ATOM 0 HB3 ASN A 113 70.553 -11.324 12.995 1.00 1.00 H new ATOM 0 HD21 ASN A 113 73.284 -10.588 9.967 1.00 1.00 H new ATOM 0 HD22 ASN A 113 72.490 -9.240 10.789 1.00 1.00 H new ATOM 1695 N ALA A 114 67.905 -9.628 13.156 1.00 1.00 N ATOM 1696 CA ALA A 114 66.749 -9.832 14.005 1.00 1.00 C ATOM 1697 C ALA A 114 65.502 -10.033 13.115 1.00 1.00 C ATOM 1698 O ALA A 114 64.783 -11.034 13.256 1.00 1.00 O ATOM 1699 CB ALA A 114 66.556 -8.673 14.983 1.00 1.00 C ATOM 0 H ALA A 114 68.392 -8.741 13.285 1.00 1.00 H new ATOM 0 HA ALA A 114 66.906 -10.724 14.611 1.00 1.00 H new ATOM 0 HB1 ALA A 114 65.679 -8.862 15.603 1.00 1.00 H new ATOM 0 HB2 ALA A 114 67.437 -8.583 15.618 1.00 1.00 H new ATOM 0 HB3 ALA A 114 66.414 -7.747 14.426 1.00 1.00 H new ATOM 1705 N ALA A 115 65.257 -9.116 12.169 1.00 1.00 N ATOM 1706 CA ALA A 115 64.100 -9.243 11.279 1.00 1.00 C ATOM 1707 C ALA A 115 64.300 -10.245 10.131 1.00 1.00 C ATOM 1708 O ALA A 115 63.477 -11.140 9.968 1.00 1.00 O ATOM 1709 CB ALA A 115 63.751 -7.869 10.714 1.00 1.00 C ATOM 0 H ALA A 115 65.835 -8.292 12.003 1.00 1.00 H new ATOM 0 HA ALA A 115 63.283 -9.639 11.882 1.00 1.00 H new ATOM 0 HB1 ALA A 115 62.891 -7.956 10.051 1.00 1.00 H new ATOM 0 HB2 ALA A 115 63.511 -7.189 11.532 1.00 1.00 H new ATOM 0 HB3 ALA A 115 64.602 -7.479 10.155 1.00 1.00 H new ATOM 1715 N ILE A 116 65.338 -10.075 9.281 1.00 1.00 N ATOM 1716 CA ILE A 116 65.520 -10.976 8.117 1.00 1.00 C ATOM 1717 C ILE A 116 65.502 -12.444 8.511 1.00 1.00 C ATOM 1718 O ILE A 116 64.844 -13.271 7.898 1.00 1.00 O ATOM 1719 CB ILE A 116 66.889 -10.698 7.446 1.00 1.00 C ATOM 1720 CG1 ILE A 116 66.834 -9.463 6.531 1.00 1.00 C ATOM 1721 CG2 ILE A 116 67.406 -11.902 6.642 1.00 1.00 C ATOM 1722 CD1 ILE A 116 66.156 -9.767 5.188 1.00 1.00 C ATOM 0 H ILE A 116 66.044 -9.345 9.372 1.00 1.00 H new ATOM 0 HA ILE A 116 64.690 -10.778 7.439 1.00 1.00 H new ATOM 0 HB ILE A 116 67.585 -10.508 8.263 1.00 1.00 H new ATOM 0 HG12 ILE A 116 66.294 -8.662 7.036 1.00 1.00 H new ATOM 0 HG13 ILE A 116 67.846 -9.100 6.351 1.00 1.00 H new ATOM 0 HG21 ILE A 116 68.368 -11.654 6.193 1.00 1.00 H new ATOM 0 HG22 ILE A 116 67.526 -12.758 7.306 1.00 1.00 H new ATOM 0 HG23 ILE A 116 66.692 -12.149 5.857 1.00 1.00 H new ATOM 0 HD11 ILE A 116 66.141 -8.865 4.576 1.00 1.00 H new ATOM 0 HD12 ILE A 116 66.711 -10.548 4.669 1.00 1.00 H new ATOM 0 HD13 ILE A 116 65.134 -10.104 5.364 1.00 1.00 H new ATOM 1734 N GLU A 117 66.317 -12.745 9.496 1.00 1.00 N ATOM 1735 CA GLU A 117 66.439 -14.139 9.911 1.00 1.00 C ATOM 1736 C GLU A 117 65.024 -14.665 9.982 1.00 1.00 C ATOM 1737 O GLU A 117 64.667 -15.606 9.284 1.00 1.00 O ATOM 1738 CB GLU A 117 67.188 -14.353 11.217 1.00 1.00 C ATOM 1739 CG GLU A 117 68.686 -14.142 10.961 1.00 1.00 C ATOM 1740 CD GLU A 117 69.479 -14.297 12.249 1.00 1.00 C ATOM 1741 OE1 GLU A 117 69.049 -13.767 13.258 1.00 1.00 O ATOM 1742 OE2 GLU A 117 70.520 -14.936 12.204 1.00 1.00 O ATOM 0 H GLU A 117 66.889 -12.078 10.013 1.00 1.00 H new ATOM 0 HA GLU A 117 67.051 -14.680 9.190 1.00 1.00 H new ATOM 0 HB2 GLU A 117 66.832 -13.656 11.976 1.00 1.00 H new ATOM 0 HB3 GLU A 117 67.007 -15.358 11.597 1.00 1.00 H new ATOM 0 HG2 GLU A 117 69.039 -14.862 10.222 1.00 1.00 H new ATOM 0 HG3 GLU A 117 68.852 -13.149 10.543 1.00 1.00 H new ATOM 1749 N VAL A 118 64.211 -14.006 10.778 1.00 1.00 N ATOM 1750 CA VAL A 118 62.810 -14.400 10.875 1.00 1.00 C ATOM 1751 C VAL A 118 62.155 -14.333 9.467 1.00 1.00 C ATOM 1752 O VAL A 118 61.547 -15.300 9.007 1.00 1.00 O ATOM 1753 CB VAL A 118 62.098 -13.446 11.843 1.00 1.00 C ATOM 1754 CG1 VAL A 118 60.618 -13.804 11.936 1.00 1.00 C ATOM 1755 CG2 VAL A 118 62.752 -13.545 13.232 1.00 1.00 C ATOM 0 H VAL A 118 64.481 -13.212 11.358 1.00 1.00 H new ATOM 0 HA VAL A 118 62.728 -15.421 11.248 1.00 1.00 H new ATOM 0 HB VAL A 118 62.188 -12.424 11.474 1.00 1.00 H new ATOM 0 HG11 VAL A 118 60.121 -13.121 12.625 1.00 1.00 H new ATOM 0 HG12 VAL A 118 60.161 -13.720 10.950 1.00 1.00 H new ATOM 0 HG13 VAL A 118 60.513 -14.826 12.299 1.00 1.00 H new ATOM 0 HG21 VAL A 118 62.247 -12.868 13.921 1.00 1.00 H new ATOM 0 HG22 VAL A 118 62.668 -14.567 13.601 1.00 1.00 H new ATOM 0 HG23 VAL A 118 63.804 -13.270 13.159 1.00 1.00 H new ATOM 1765 N LEU A 119 62.271 -13.169 8.812 1.00 1.00 N ATOM 1766 CA LEU A 119 61.653 -13.002 7.478 1.00 1.00 C ATOM 1767 C LEU A 119 62.134 -14.189 6.610 1.00 1.00 C ATOM 1768 O LEU A 119 61.337 -15.062 6.246 1.00 1.00 O ATOM 1769 CB LEU A 119 62.145 -11.655 6.873 1.00 1.00 C ATOM 1770 CG LEU A 119 61.213 -11.098 5.755 1.00 1.00 C ATOM 1771 CD1 LEU A 119 61.319 -9.568 5.719 1.00 1.00 C ATOM 1772 CD2 LEU A 119 61.667 -11.619 4.383 1.00 1.00 C ATOM 0 H LEU A 119 62.768 -12.351 9.164 1.00 1.00 H new ATOM 0 HA LEU A 119 60.564 -12.987 7.528 1.00 1.00 H new ATOM 0 HB2 LEU A 119 62.225 -10.916 7.670 1.00 1.00 H new ATOM 0 HB3 LEU A 119 63.146 -11.793 6.465 1.00 1.00 H new ATOM 0 HG LEU A 119 60.192 -11.417 5.966 1.00 1.00 H new ATOM 0 HD11 LEU A 119 60.668 -9.176 4.938 1.00 1.00 H new ATOM 0 HD12 LEU A 119 61.015 -9.159 6.683 1.00 1.00 H new ATOM 0 HD13 LEU A 119 62.349 -9.279 5.511 1.00 1.00 H new ATOM 0 HD21 LEU A 119 61.010 -11.224 3.608 1.00 1.00 H new ATOM 0 HD22 LEU A 119 62.690 -11.295 4.191 1.00 1.00 H new ATOM 0 HD23 LEU A 119 61.624 -12.708 4.375 1.00 1.00 H new ATOM 1784 N GLY A 120 63.428 -14.202 6.272 1.00 1.00 N ATOM 1785 CA GLY A 120 63.978 -15.276 5.435 1.00 1.00 C ATOM 1786 C GLY A 120 64.114 -16.612 6.206 1.00 1.00 C ATOM 1787 O GLY A 120 63.253 -17.488 6.138 1.00 1.00 O ATOM 0 H GLY A 120 64.105 -13.495 6.559 1.00 1.00 H new ATOM 0 HA2 GLY A 120 63.334 -15.424 4.568 1.00 1.00 H new ATOM 0 HA3 GLY A 120 64.956 -14.975 5.058 1.00 1.00 H new ATOM 1791 N THR A 121 65.218 -16.669 6.922 1.00 1.00 N ATOM 1792 CA THR A 121 65.599 -17.824 7.769 1.00 1.00 C ATOM 1793 C THR A 121 67.100 -17.905 7.995 1.00 1.00 C ATOM 1794 O THR A 121 67.541 -18.372 9.042 1.00 1.00 O ATOM 1795 CB THR A 121 65.097 -19.167 7.158 1.00 1.00 C ATOM 1796 OG1 THR A 121 63.699 -19.295 7.380 1.00 1.00 O ATOM 1797 CG2 THR A 121 65.787 -20.373 7.819 1.00 1.00 C ATOM 0 H THR A 121 65.900 -15.911 6.945 1.00 1.00 H new ATOM 0 HA THR A 121 65.116 -17.663 8.733 1.00 1.00 H new ATOM 0 HB THR A 121 65.329 -19.154 6.093 1.00 1.00 H new ATOM 0 HG1 THR A 121 63.230 -18.547 6.954 1.00 1.00 H new ATOM 0 HG21 THR A 121 65.416 -21.295 7.371 1.00 1.00 H new ATOM 0 HG22 THR A 121 66.864 -20.304 7.667 1.00 1.00 H new ATOM 0 HG23 THR A 121 65.570 -20.376 8.887 1.00 1.00 H new ATOM 1805 N GLY A 122 67.887 -17.517 7.002 1.00 1.00 N ATOM 1806 CA GLY A 122 69.339 -17.633 7.111 1.00 1.00 C ATOM 1807 C GLY A 122 69.731 -18.823 6.268 1.00 1.00 C ATOM 1808 O GLY A 122 70.890 -18.977 5.893 1.00 1.00 O ATOM 0 H GLY A 122 67.553 -17.124 6.122 1.00 1.00 H new ATOM 0 HA2 GLY A 122 69.830 -16.726 6.757 1.00 1.00 H new ATOM 0 HA3 GLY A 122 69.641 -17.774 8.149 1.00 1.00 H new ATOM 1812 N THR A 123 68.704 -19.643 5.985 1.00 1.00 N ATOM 1813 CA THR A 123 68.910 -20.834 5.151 1.00 1.00 C ATOM 1814 C THR A 123 69.515 -20.321 3.850 1.00 1.00 C ATOM 1815 O THR A 123 68.837 -20.172 2.833 1.00 1.00 O ATOM 1816 CB THR A 123 67.597 -21.599 4.871 1.00 1.00 C ATOM 1817 OG1 THR A 123 67.899 -22.754 4.099 1.00 1.00 O ATOM 1818 CG2 THR A 123 66.593 -20.728 4.083 1.00 1.00 C ATOM 0 H THR A 123 67.748 -19.507 6.313 1.00 1.00 H new ATOM 0 HA THR A 123 69.558 -21.547 5.661 1.00 1.00 H new ATOM 0 HB THR A 123 67.145 -21.869 5.826 1.00 1.00 H new ATOM 0 HG1 THR A 123 67.074 -23.250 3.915 1.00 1.00 H new ATOM 0 HG21 THR A 123 65.681 -21.297 3.903 1.00 1.00 H new ATOM 0 HG22 THR A 123 66.356 -19.834 4.660 1.00 1.00 H new ATOM 0 HG23 THR A 123 67.034 -20.438 3.129 1.00 1.00 H new ATOM 1826 N ASP A 124 70.823 -20.107 3.938 1.00 1.00 N ATOM 1827 CA ASP A 124 71.643 -19.634 2.825 1.00 1.00 C ATOM 1828 C ASP A 124 73.140 -19.789 3.119 1.00 1.00 C ATOM 1829 O ASP A 124 73.539 -20.188 4.214 1.00 1.00 O ATOM 1830 CB ASP A 124 71.350 -18.156 2.558 1.00 1.00 C ATOM 1831 CG ASP A 124 69.889 -17.962 2.182 1.00 1.00 C ATOM 1832 OD1 ASP A 124 69.509 -18.402 1.111 1.00 1.00 O ATOM 1833 OD2 ASP A 124 69.166 -17.386 2.978 1.00 1.00 O ATOM 0 H ASP A 124 71.353 -20.259 4.796 1.00 1.00 H new ATOM 0 HA ASP A 124 71.393 -20.239 1.954 1.00 1.00 H new ATOM 0 HB2 ASP A 124 71.585 -17.567 3.444 1.00 1.00 H new ATOM 0 HB3 ASP A 124 71.990 -17.792 1.754 1.00 1.00 H new ATOM 1838 N TYR A 125 73.949 -19.400 2.138 1.00 1.00 N ATOM 1839 CA TYR A 125 75.408 -19.404 2.268 1.00 1.00 C ATOM 1840 C TYR A 125 75.969 -18.231 1.433 1.00 1.00 C ATOM 1841 O TYR A 125 75.484 -17.959 0.337 1.00 1.00 O ATOM 1842 CB TYR A 125 76.000 -20.774 1.814 1.00 1.00 C ATOM 1843 CG TYR A 125 77.124 -20.568 0.820 1.00 1.00 C ATOM 1844 CD1 TYR A 125 76.819 -20.424 -0.533 1.00 1.00 C ATOM 1845 CD2 TYR A 125 78.455 -20.488 1.251 1.00 1.00 C ATOM 1846 CE1 TYR A 125 77.838 -20.204 -1.461 1.00 1.00 C ATOM 1847 CE2 TYR A 125 79.478 -20.263 0.318 1.00 1.00 C ATOM 1848 CZ TYR A 125 79.166 -20.122 -1.038 1.00 1.00 C ATOM 1849 OH TYR A 125 80.169 -19.900 -1.959 1.00 1.00 O ATOM 0 H TYR A 125 73.616 -19.073 1.231 1.00 1.00 H new ATOM 0 HA TYR A 125 75.695 -19.272 3.311 1.00 1.00 H new ATOM 0 HB2 TYR A 125 76.370 -21.321 2.681 1.00 1.00 H new ATOM 0 HB3 TYR A 125 75.216 -21.383 1.363 1.00 1.00 H new ATOM 0 HD1 TYR A 125 75.792 -20.483 -0.863 1.00 1.00 H new ATOM 0 HD2 TYR A 125 78.693 -20.599 2.299 1.00 1.00 H new ATOM 0 HE1 TYR A 125 77.599 -20.097 -2.509 1.00 1.00 H new ATOM 0 HE2 TYR A 125 80.505 -20.199 0.646 1.00 1.00 H new ATOM 0 HH TYR A 125 81.034 -19.869 -1.500 1.00 1.00 H new ATOM 1859 N ARG A 126 77.032 -17.592 1.928 1.00 1.00 N ATOM 1860 CA ARG A 126 77.693 -16.511 1.182 1.00 1.00 C ATOM 1861 C ARG A 126 79.176 -16.433 1.531 1.00 1.00 C ATOM 1862 O ARG A 126 79.592 -16.853 2.609 1.00 1.00 O ATOM 1863 CB ARG A 126 77.032 -15.146 1.417 1.00 1.00 C ATOM 1864 CG ARG A 126 75.648 -15.115 0.752 1.00 1.00 C ATOM 1865 CD ARG A 126 75.155 -13.668 0.627 1.00 1.00 C ATOM 1866 NE ARG A 126 73.864 -13.633 -0.059 1.00 1.00 N ATOM 1867 CZ ARG A 126 73.758 -13.931 -1.354 1.00 1.00 C ATOM 1868 NH1 ARG A 126 74.811 -14.295 -2.034 1.00 1.00 N ATOM 1869 NH2 ARG A 126 72.596 -13.865 -1.946 1.00 1.00 N ATOM 0 H ARG A 126 77.453 -17.800 2.834 1.00 1.00 H new ATOM 0 HA ARG A 126 77.584 -16.755 0.125 1.00 1.00 H new ATOM 0 HB2 ARG A 126 76.936 -14.958 2.486 1.00 1.00 H new ATOM 0 HB3 ARG A 126 77.659 -14.353 1.009 1.00 1.00 H new ATOM 0 HG2 ARG A 126 75.700 -15.576 -0.234 1.00 1.00 H new ATOM 0 HG3 ARG A 126 74.940 -15.699 1.340 1.00 1.00 H new ATOM 0 HD2 ARG A 126 75.062 -13.221 1.617 1.00 1.00 H new ATOM 0 HD3 ARG A 126 75.884 -13.074 0.076 1.00 1.00 H new ATOM 0 HE ARG A 126 73.027 -13.375 0.464 1.00 1.00 H new ATOM 0 HH11 ARG A 126 75.720 -14.352 -1.575 1.00 1.00 H new ATOM 0 HH12 ARG A 126 74.725 -14.522 -3.025 1.00 1.00 H new ATOM 0 HH21 ARG A 126 71.770 -13.585 -1.418 1.00 1.00 H new ATOM 0 HH22 ARG A 126 72.515 -14.093 -2.937 1.00 1.00 H new ATOM 1883 N PHE A 127 79.971 -15.876 0.610 1.00 1.00 N ATOM 1884 CA PHE A 127 81.415 -15.724 0.824 1.00 1.00 C ATOM 1885 C PHE A 127 81.787 -14.240 0.878 1.00 1.00 C ATOM 1886 O PHE A 127 82.436 -13.844 1.829 1.00 1.00 O ATOM 1887 CB PHE A 127 82.195 -16.431 -0.301 1.00 1.00 C ATOM 1888 CG PHE A 127 82.300 -15.545 -1.531 1.00 1.00 C ATOM 1889 CD1 PHE A 127 81.166 -15.288 -2.312 1.00 1.00 C ATOM 1890 CD2 PHE A 127 83.536 -14.988 -1.889 1.00 1.00 C ATOM 1891 CE1 PHE A 127 81.270 -14.474 -3.447 1.00 1.00 C ATOM 1892 CE2 PHE A 127 83.636 -14.177 -3.025 1.00 1.00 C ATOM 1893 CZ PHE A 127 82.504 -13.922 -3.803 1.00 1.00 C ATOM 1894 OXT PHE A 127 81.411 -13.525 -0.038 1.00 1.00 O ATOM 0 H PHE A 127 79.640 -15.524 -0.288 1.00 1.00 H new ATOM 0 HA PHE A 127 81.681 -16.185 1.776 1.00 1.00 H new ATOM 0 HB2 PHE A 127 83.193 -16.690 0.051 1.00 1.00 H new ATOM 0 HB3 PHE A 127 81.697 -17.365 -0.562 1.00 1.00 H new ATOM 0 HD1 PHE A 127 80.213 -15.717 -2.039 1.00 1.00 H new ATOM 0 HD2 PHE A 127 84.411 -15.185 -1.288 1.00 1.00 H new ATOM 0 HE1 PHE A 127 80.396 -14.272 -4.048 1.00 1.00 H new ATOM 0 HE2 PHE A 127 84.588 -13.748 -3.300 1.00 1.00 H new ATOM 0 HZ PHE A 127 82.582 -13.298 -4.681 1.00 1.00 H new TER 1904 PHE A 127 HETATM 1905 O1 MTN A 128 66.164 3.777 -10.198 1.00 1.00 O HETATM 1906 N1 MTN A 128 66.342 3.836 -8.946 1.00 1.00 N HETATM 1907 C1 MTN A 128 67.259 2.939 -8.212 1.00 1.00 C HETATM 1908 C2 MTN A 128 67.053 3.462 -6.820 1.00 1.00 C HETATM 1909 C3 MTN A 128 66.204 4.451 -6.739 1.00 1.00 C HETATM 1910 C4 MTN A 128 65.823 5.128 -5.465 1.00 1.00 C HETATM 1911 S1 MTN A 128 67.123 5.123 -4.212 1.00 1.00 S HETATM 1912 C5 MTN A 128 65.623 4.835 -8.077 1.00 1.00 C HETATM 1913 C6 MTN A 128 64.099 4.741 -8.084 1.00 1.00 C HETATM 1914 C7 MTN A 128 66.075 6.244 -8.458 1.00 1.00 C HETATM 1915 C8 MTN A 128 66.825 1.471 -8.306 1.00 1.00 C HETATM 1916 C9 MTN A 128 68.701 3.147 -8.729 1.00 1.00 C HETATM 0 H93 MTN A 128 68.742 2.918 -9.794 1.00 1.00 H new HETATM 0 H92 MTN A 128 68.999 4.183 -8.569 1.00 1.00 H new HETATM 0 H91 MTN A 128 69.380 2.487 -8.189 1.00 1.00 H new HETATM 0 H83 MTN A 128 65.827 1.359 -7.881 1.00 1.00 H new HETATM 0 H82 MTN A 128 66.811 1.162 -9.351 1.00 1.00 H new HETATM 0 H81 MTN A 128 67.527 0.848 -7.752 1.00 1.00 H new HETATM 0 H73 MTN A 128 67.151 6.334 -8.308 1.00 1.00 H new HETATM 0 H72 MTN A 128 65.838 6.431 -9.505 1.00 1.00 H new HETATM 0 H71 MTN A 128 65.559 6.973 -7.833 1.00 1.00 H new HETATM 0 H63 MTN A 128 63.730 4.896 -9.098 1.00 1.00 H new HETATM 0 H62 MTN A 128 63.794 3.755 -7.733 1.00 1.00 H new HETATM 0 H61 MTN A 128 63.684 5.505 -7.426 1.00 1.00 H new HETATM 0 H42 MTN A 128 65.547 6.160 -5.683 1.00 1.00 H new HETATM 0 H41 MTN A 128 64.938 4.640 -5.057 1.00 1.00 H new HETATM 0 H2 MTN A 128 67.568 3.051 -5.951 1.00 1.00 H new HETATM 1932 O1 MTN A 129 71.400 -10.013 -4.404 1.00 1.00 O HETATM 1933 N1 MTN A 129 70.632 -9.143 -3.895 1.00 1.00 N HETATM 1934 C1 MTN A 129 69.577 -8.458 -4.662 1.00 1.00 C HETATM 1935 C2 MTN A 129 69.014 -7.587 -3.602 1.00 1.00 C HETATM 1936 C3 MTN A 129 69.612 -7.716 -2.429 1.00 1.00 C HETATM 1937 C4 MTN A 129 69.255 -6.954 -1.192 1.00 1.00 C HETATM 1938 S1 MTN A 129 70.218 -5.441 -0.955 1.00 1.00 S HETATM 1939 C5 MTN A 129 70.733 -8.734 -2.462 1.00 1.00 C HETATM 1940 C6 MTN A 129 72.084 -8.147 -2.056 1.00 1.00 C HETATM 1941 C7 MTN A 129 70.385 -9.940 -1.583 1.00 1.00 C HETATM 1942 C8 MTN A 129 70.136 -7.641 -5.824 1.00 1.00 C HETATM 1943 C9 MTN A 129 68.547 -9.463 -5.139 1.00 1.00 C HETATM 0 H93 MTN A 129 69.030 -10.204 -5.776 1.00 1.00 H new HETATM 0 H92 MTN A 129 68.099 -9.961 -4.279 1.00 1.00 H new HETATM 0 H91 MTN A 129 67.771 -8.948 -5.705 1.00 1.00 H new HETATM 0 H83 MTN A 129 70.818 -6.882 -5.440 1.00 1.00 H new HETATM 0 H82 MTN A 129 70.673 -8.300 -6.507 1.00 1.00 H new HETATM 0 H81 MTN A 129 69.317 -7.157 -6.356 1.00 1.00 H new HETATM 0 H73 MTN A 129 69.370 -10.270 -1.804 1.00 1.00 H new HETATM 0 H72 MTN A 129 71.083 -10.752 -1.787 1.00 1.00 H new HETATM 0 H71 MTN A 129 70.454 -9.657 -0.533 1.00 1.00 H new HETATM 0 H63 MTN A 129 72.868 -8.885 -2.227 1.00 1.00 H new HETATM 0 H62 MTN A 129 72.288 -7.257 -2.651 1.00 1.00 H new HETATM 0 H61 MTN A 129 72.062 -7.880 -0.999 1.00 1.00 H new HETATM 0 H42 MTN A 129 68.197 -6.696 -1.229 1.00 1.00 H new HETATM 0 H41 MTN A 129 69.395 -7.601 -0.326 1.00 1.00 H new HETATM 0 H2 MTN A 129 68.183 -6.903 -3.774 1.00 1.00 H new HETATM 1959 O1 MTN A 130 82.632 -9.768 5.060 1.00 1.00 O HETATM 1960 N1 MTN A 130 81.549 -9.196 5.389 1.00 1.00 N HETATM 1961 C1 MTN A 130 80.311 -9.327 4.606 1.00 1.00 C HETATM 1962 C2 MTN A 130 79.410 -8.481 5.422 1.00 1.00 C HETATM 1963 C3 MTN A 130 79.998 -7.952 6.481 1.00 1.00 C HETATM 1964 C4 MTN A 130 79.329 -7.068 7.475 1.00 1.00 C HETATM 1965 S1 MTN A 130 78.957 -5.418 6.850 1.00 1.00 S HETATM 1966 C5 MTN A 130 81.452 -8.348 6.592 1.00 1.00 C HETATM 1967 C6 MTN A 130 82.422 -7.178 6.610 1.00 1.00 C HETATM 1968 C7 MTN A 130 81.663 -9.239 7.813 1.00 1.00 C HETATM 1969 C8 MTN A 130 80.457 -8.806 3.178 1.00 1.00 C HETATM 1970 C9 MTN A 130 79.855 -10.778 4.616 1.00 1.00 C HETATM 0 H93 MTN A 130 80.630 -11.406 4.177 1.00 1.00 H new HETATM 0 H92 MTN A 130 79.670 -11.094 5.643 1.00 1.00 H new HETATM 0 H91 MTN A 130 78.937 -10.875 4.036 1.00 1.00 H new HETATM 0 H83 MTN A 130 80.726 -7.750 3.202 1.00 1.00 H new HETATM 0 H82 MTN A 130 81.237 -9.367 2.664 1.00 1.00 H new HETATM 0 H81 MTN A 130 79.513 -8.928 2.648 1.00 1.00 H new HETATM 0 H73 MTN A 130 80.896 -10.014 7.835 1.00 1.00 H new HETATM 0 H72 MTN A 130 82.647 -9.704 7.758 1.00 1.00 H new HETATM 0 H71 MTN A 130 81.596 -8.637 8.719 1.00 1.00 H new HETATM 0 H63 MTN A 130 83.445 -7.552 6.565 1.00 1.00 H new HETATM 0 H62 MTN A 130 82.233 -6.535 5.750 1.00 1.00 H new HETATM 0 H61 MTN A 130 82.285 -6.606 7.528 1.00 1.00 H new HETATM 0 H42 MTN A 130 78.402 -7.540 7.801 1.00 1.00 H new HETATM 0 H41 MTN A 130 79.967 -6.978 8.354 1.00 1.00 H new HETATM 0 H2 MTN A 130 78.363 -8.311 5.173 1.00 1.00 H new