USER MOD reduce.3.24.130724 H: found=0, std=0, add=964, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 955 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 157:sc= 1.09 (180deg=-1.69!) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot -58:sc= 0.223 USER MOD Single : A 10 SER OG : rot -123:sc= -4.83! USER MOD Single : A 28 LYS NZ :NH3+ -123:sc= -7.47! (180deg=-13.4!) USER MOD Single : A 30 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 HIS :FLIP no HD1:sc= -0.807 F(o=-2,f=-0.81) USER MOD Single : A 39 THR OG1 : rot -92:sc= 0.145 USER MOD Single : A 48 CYS SG : rot -50:sc= -0.0333 USER MOD Single : A 49 ASN : amide:sc= -2.93! C(o=-2.9!,f=-4.6!) USER MOD Single : A 54 GLN :FLIP amide:sc= -1.24 F(o=-1.9,f=-1.2) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= -0.906 K(o=-0.91,f=-2.7!) USER MOD Single : A 72 HIS :FLIP no HE2:sc= -3.45! C(o=-8.3!,f=-3.4!) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -1.89 X(o=-1.9,f=-2.1) USER MOD Single : A 92 HIS : no HD1:sc= -10.1! C(o=-10!,f=-15!) USER MOD Single : A 99 GLN : amide:sc= -0.468 X(o=-0.47,f=-0.41) USER MOD Single : A 102 CYS SG : rot 24:sc= -0.391 USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot -27:sc= 0.211 USER MOD Single : A 111 ASN : amide:sc= -3.27 K(o=-3.3,f=-5.6!) USER MOD Single : A 113 ASN : amide:sc= -0.137 X(o=-0.14,f=-0.15) USER MOD Single : A 121 THR OG1 : rot -40:sc= 0.368 USER MOD Single : A 123 THR OG1 : rot -70:sc= 0.332 USER MOD Single : A 125 TYR OH : rot 15:sc= -0.618 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 81.037 21.269 -23.836 1.00 1.00 N ATOM 2 CA MET A 1 81.423 19.877 -24.208 1.00 1.00 C ATOM 3 C MET A 1 80.221 18.951 -24.010 1.00 1.00 C ATOM 4 O MET A 1 79.215 19.341 -23.423 1.00 1.00 O ATOM 5 CB MET A 1 82.601 19.419 -23.319 1.00 1.00 C ATOM 6 CG MET A 1 82.592 20.197 -21.992 1.00 1.00 C ATOM 7 SD MET A 1 83.525 21.738 -22.187 1.00 1.00 S ATOM 8 CE MET A 1 83.255 22.408 -20.524 1.00 1.00 C ATOM 0 H1 MET A 1 81.889 21.812 -23.591 1.00 1.00 H new ATOM 0 H2 MET A 1 80.557 21.723 -24.639 1.00 1.00 H new ATOM 0 H3 MET A 1 80.395 21.244 -23.018 1.00 1.00 H new ATOM 0 HA MET A 1 81.732 19.842 -25.253 1.00 1.00 H new ATOM 0 HB2 MET A 1 82.525 18.349 -23.123 1.00 1.00 H new ATOM 0 HB3 MET A 1 83.545 19.582 -23.839 1.00 1.00 H new ATOM 0 HG2 MET A 1 81.567 20.416 -21.694 1.00 1.00 H new ATOM 0 HG3 MET A 1 83.032 19.591 -21.200 1.00 1.00 H new ATOM 0 HE1 MET A 1 83.757 23.372 -20.434 1.00 1.00 H new ATOM 0 HE2 MET A 1 82.186 22.538 -20.353 1.00 1.00 H new ATOM 0 HE3 MET A 1 83.660 21.718 -19.784 1.00 1.00 H new ATOM 18 N SER A 2 80.341 17.723 -24.514 1.00 1.00 N ATOM 19 CA SER A 2 79.267 16.735 -24.407 1.00 1.00 C ATOM 20 C SER A 2 79.388 15.922 -23.126 1.00 1.00 C ATOM 21 O SER A 2 78.608 15.000 -22.907 1.00 1.00 O ATOM 22 CB SER A 2 79.308 15.794 -25.607 1.00 1.00 C ATOM 23 OG SER A 2 80.552 15.102 -25.619 1.00 1.00 O ATOM 0 H SER A 2 81.172 17.388 -25.001 1.00 1.00 H new ATOM 0 HA SER A 2 78.319 17.272 -24.387 1.00 1.00 H new ATOM 0 HB2 SER A 2 78.484 15.083 -25.555 1.00 1.00 H new ATOM 0 HB3 SER A 2 79.184 16.359 -26.531 1.00 1.00 H new ATOM 0 HG SER A 2 80.581 14.495 -26.388 1.00 1.00 H new ATOM 29 N ASP A 3 80.360 16.284 -22.283 1.00 1.00 N ATOM 30 CA ASP A 3 80.579 15.594 -21.009 1.00 1.00 C ATOM 31 C ASP A 3 81.988 15.859 -20.483 1.00 1.00 C ATOM 32 O ASP A 3 82.978 15.485 -21.110 1.00 1.00 O ATOM 33 CB ASP A 3 80.369 14.064 -21.169 1.00 1.00 C ATOM 34 CG ASP A 3 78.944 13.645 -20.788 1.00 1.00 C ATOM 35 OD1 ASP A 3 78.191 14.486 -20.327 1.00 1.00 O ATOM 36 OD2 ASP A 3 78.625 12.482 -20.976 1.00 1.00 O ATOM 0 H ASP A 3 81.008 17.052 -22.461 1.00 1.00 H new ATOM 0 HA ASP A 3 79.853 15.982 -20.294 1.00 1.00 H new ATOM 0 HB2 ASP A 3 80.570 13.775 -22.201 1.00 1.00 H new ATOM 0 HB3 ASP A 3 81.085 13.531 -20.543 1.00 1.00 H new ATOM 41 N PHE A 4 82.061 16.481 -19.307 1.00 1.00 N ATOM 42 CA PHE A 4 83.339 16.762 -18.662 1.00 1.00 C ATOM 43 C PHE A 4 83.147 16.754 -17.156 1.00 1.00 C ATOM 44 O PHE A 4 82.095 17.141 -16.651 1.00 1.00 O ATOM 45 CB PHE A 4 83.915 18.106 -19.117 1.00 1.00 C ATOM 46 CG PHE A 4 85.114 18.470 -18.265 1.00 1.00 C ATOM 47 CD1 PHE A 4 86.349 17.847 -18.493 1.00 1.00 C ATOM 48 CD2 PHE A 4 84.992 19.429 -17.252 1.00 1.00 C ATOM 49 CE1 PHE A 4 87.460 18.185 -17.709 1.00 1.00 C ATOM 50 CE2 PHE A 4 86.104 19.765 -16.467 1.00 1.00 C ATOM 51 CZ PHE A 4 87.337 19.144 -16.697 1.00 1.00 C ATOM 0 H PHE A 4 81.247 16.800 -18.782 1.00 1.00 H new ATOM 0 HA PHE A 4 84.051 15.989 -18.949 1.00 1.00 H new ATOM 0 HB2 PHE A 4 84.207 18.050 -20.166 1.00 1.00 H new ATOM 0 HB3 PHE A 4 83.154 18.882 -19.039 1.00 1.00 H new ATOM 0 HD1 PHE A 4 86.444 17.106 -19.273 1.00 1.00 H new ATOM 0 HD2 PHE A 4 84.041 19.910 -17.075 1.00 1.00 H new ATOM 0 HE1 PHE A 4 88.411 17.705 -17.886 1.00 1.00 H new ATOM 0 HE2 PHE A 4 86.009 20.503 -15.685 1.00 1.00 H new ATOM 0 HZ PHE A 4 88.194 19.405 -16.093 1.00 1.00 H new ATOM 61 N ASP A 5 84.165 16.294 -16.444 1.00 1.00 N ATOM 62 CA ASP A 5 84.092 16.218 -14.994 1.00 1.00 C ATOM 63 C ASP A 5 85.476 16.391 -14.381 1.00 1.00 C ATOM 64 O ASP A 5 86.466 15.953 -14.967 1.00 1.00 O ATOM 65 CB ASP A 5 83.513 14.844 -14.600 1.00 1.00 C ATOM 66 CG ASP A 5 81.990 14.837 -14.713 1.00 1.00 C ATOM 67 OD1 ASP A 5 81.406 15.903 -14.774 1.00 1.00 O ATOM 68 OD2 ASP A 5 81.426 13.752 -14.737 1.00 1.00 O ATOM 0 H ASP A 5 85.046 15.970 -16.844 1.00 1.00 H new ATOM 0 HA ASP A 5 83.450 17.016 -14.620 1.00 1.00 H new ATOM 0 HB2 ASP A 5 83.932 14.071 -15.244 1.00 1.00 H new ATOM 0 HB3 ASP A 5 83.806 14.602 -13.579 1.00 1.00 H new ATOM 73 N THR A 6 85.558 17.015 -13.191 1.00 1.00 N ATOM 74 CA THR A 6 86.849 17.212 -12.519 1.00 1.00 C ATOM 75 C THR A 6 86.897 16.406 -11.215 1.00 1.00 C ATOM 76 O THR A 6 86.223 15.419 -11.055 1.00 1.00 O ATOM 77 CB THR A 6 87.075 18.715 -12.228 1.00 1.00 C ATOM 78 OG1 THR A 6 86.307 19.485 -13.138 1.00 1.00 O ATOM 79 CG2 THR A 6 88.561 19.076 -12.388 1.00 1.00 C ATOM 0 H THR A 6 84.755 17.386 -12.683 1.00 1.00 H new ATOM 0 HA THR A 6 87.644 16.859 -13.177 1.00 1.00 H new ATOM 0 HB THR A 6 86.769 18.927 -11.204 1.00 1.00 H new ATOM 0 HG1 THR A 6 86.564 19.259 -14.056 1.00 1.00 H new ATOM 0 HG21 THR A 6 88.702 20.137 -12.180 1.00 1.00 H new ATOM 0 HG22 THR A 6 89.156 18.487 -11.690 1.00 1.00 H new ATOM 0 HG23 THR A 6 88.880 18.861 -13.408 1.00 1.00 H new ATOM 87 N GLU A 7 87.726 16.826 -10.298 1.00 1.00 N ATOM 88 CA GLU A 7 87.885 16.127 -9.035 1.00 1.00 C ATOM 89 C GLU A 7 86.551 16.017 -8.321 1.00 1.00 C ATOM 90 O GLU A 7 86.152 14.941 -7.902 1.00 1.00 O ATOM 91 CB GLU A 7 88.900 16.873 -8.151 1.00 1.00 C ATOM 92 CG GLU A 7 88.976 16.222 -6.756 1.00 1.00 C ATOM 93 CD GLU A 7 87.852 16.738 -5.859 1.00 1.00 C ATOM 94 OE1 GLU A 7 87.474 17.889 -6.015 1.00 1.00 O ATOM 95 OE2 GLU A 7 87.390 15.980 -5.022 1.00 1.00 O ATOM 0 H GLU A 7 88.310 17.656 -10.396 1.00 1.00 H new ATOM 0 HA GLU A 7 88.256 15.121 -9.232 1.00 1.00 H new ATOM 0 HB2 GLU A 7 89.883 16.856 -8.621 1.00 1.00 H new ATOM 0 HB3 GLU A 7 88.610 17.919 -8.056 1.00 1.00 H new ATOM 0 HG2 GLU A 7 88.905 15.138 -6.850 1.00 1.00 H new ATOM 0 HG3 GLU A 7 89.942 16.439 -6.300 1.00 1.00 H new ATOM 102 N ARG A 8 85.840 17.125 -8.229 1.00 1.00 N ATOM 103 CA ARG A 8 84.535 17.088 -7.586 1.00 1.00 C ATOM 104 C ARG A 8 83.561 16.260 -8.435 1.00 1.00 C ATOM 105 O ARG A 8 82.966 15.288 -7.981 1.00 1.00 O ATOM 106 CB ARG A 8 83.974 18.499 -7.449 1.00 1.00 C ATOM 107 CG ARG A 8 82.744 18.445 -6.546 1.00 1.00 C ATOM 108 CD ARG A 8 82.053 19.792 -6.566 1.00 1.00 C ATOM 109 NE ARG A 8 82.975 20.813 -6.074 1.00 1.00 N ATOM 110 CZ ARG A 8 83.204 21.946 -6.734 1.00 1.00 C ATOM 111 NH1 ARG A 8 82.629 22.182 -7.885 1.00 1.00 N ATOM 112 NH2 ARG A 8 84.028 22.820 -6.235 1.00 1.00 N ATOM 0 H ARG A 8 86.130 18.038 -8.579 1.00 1.00 H new ATOM 0 HA ARG A 8 84.650 16.640 -6.599 1.00 1.00 H new ATOM 0 HB2 ARG A 8 84.725 19.166 -7.026 1.00 1.00 H new ATOM 0 HB3 ARG A 8 83.708 18.898 -8.428 1.00 1.00 H new ATOM 0 HG2 ARG A 8 82.061 17.667 -6.888 1.00 1.00 H new ATOM 0 HG3 ARG A 8 83.036 18.188 -5.528 1.00 1.00 H new ATOM 0 HD2 ARG A 8 81.731 20.034 -7.579 1.00 1.00 H new ATOM 0 HD3 ARG A 8 81.158 19.764 -5.945 1.00 1.00 H new ATOM 0 HE ARG A 8 83.461 20.652 -5.192 1.00 1.00 H new ATOM 0 HH11 ARG A 8 81.995 21.493 -8.289 1.00 1.00 H new ATOM 0 HH12 ARG A 8 82.815 23.055 -8.378 1.00 1.00 H new ATOM 0 HH21 ARG A 8 84.492 22.634 -5.346 1.00 1.00 H new ATOM 0 HH22 ARG A 8 84.210 23.691 -6.733 1.00 1.00 H new ATOM 126 N VAL A 9 83.396 16.699 -9.668 1.00 1.00 N ATOM 127 CA VAL A 9 82.462 16.014 -10.560 1.00 1.00 C ATOM 128 C VAL A 9 82.975 14.582 -10.842 1.00 1.00 C ATOM 129 O VAL A 9 82.272 13.605 -10.677 1.00 1.00 O ATOM 130 CB VAL A 9 82.230 16.815 -11.867 1.00 1.00 C ATOM 131 CG1 VAL A 9 80.762 16.709 -12.313 1.00 1.00 C ATOM 132 CG2 VAL A 9 82.566 18.293 -11.653 1.00 1.00 C ATOM 0 H VAL A 9 83.877 17.502 -10.072 1.00 1.00 H new ATOM 0 HA VAL A 9 81.491 15.944 -10.069 1.00 1.00 H new ATOM 0 HB VAL A 9 82.879 16.394 -12.635 1.00 1.00 H new ATOM 0 HG11 VAL A 9 80.619 17.278 -13.232 1.00 1.00 H new ATOM 0 HG12 VAL A 9 80.510 15.663 -12.490 1.00 1.00 H new ATOM 0 HG13 VAL A 9 80.115 17.111 -11.533 1.00 1.00 H new ATOM 0 HG21 VAL A 9 82.398 18.842 -12.579 1.00 1.00 H new ATOM 0 HG22 VAL A 9 81.929 18.701 -10.869 1.00 1.00 H new ATOM 0 HG23 VAL A 9 83.611 18.390 -11.358 1.00 1.00 H new ATOM 142 N SER A 10 84.208 14.456 -11.242 1.00 1.00 N ATOM 143 CA SER A 10 84.739 13.113 -11.494 1.00 1.00 C ATOM 144 C SER A 10 84.904 12.320 -10.182 1.00 1.00 C ATOM 145 O SER A 10 84.284 11.298 -9.989 1.00 1.00 O ATOM 146 CB SER A 10 86.115 13.164 -12.204 1.00 1.00 C ATOM 147 OG SER A 10 86.165 14.274 -13.087 1.00 1.00 O ATOM 0 H SER A 10 84.858 15.226 -11.401 1.00 1.00 H new ATOM 0 HA SER A 10 84.015 12.616 -12.140 1.00 1.00 H new ATOM 0 HB2 SER A 10 86.912 13.241 -11.465 1.00 1.00 H new ATOM 0 HB3 SER A 10 86.282 12.240 -12.758 1.00 1.00 H new ATOM 0 HG SER A 10 86.363 13.961 -13.994 1.00 1.00 H new ATOM 153 N ARG A 11 85.778 12.778 -9.292 1.00 1.00 N ATOM 154 CA ARG A 11 86.053 12.033 -8.053 1.00 1.00 C ATOM 155 C ARG A 11 84.830 11.931 -7.141 1.00 1.00 C ATOM 156 O ARG A 11 84.486 10.840 -6.702 1.00 1.00 O ATOM 157 CB ARG A 11 87.247 12.667 -7.292 1.00 1.00 C ATOM 158 CG ARG A 11 88.005 11.604 -6.490 1.00 1.00 C ATOM 159 CD ARG A 11 89.280 12.221 -5.911 1.00 1.00 C ATOM 160 NE ARG A 11 90.225 12.515 -6.986 1.00 1.00 N ATOM 161 CZ ARG A 11 90.858 11.533 -7.623 1.00 1.00 C ATOM 162 NH1 ARG A 11 90.636 10.290 -7.290 1.00 1.00 N ATOM 163 NH2 ARG A 11 91.703 11.810 -8.582 1.00 1.00 N ATOM 0 H ARG A 11 86.304 13.646 -9.395 1.00 1.00 H new ATOM 0 HA ARG A 11 86.313 11.016 -8.347 1.00 1.00 H new ATOM 0 HB2 ARG A 11 87.923 13.146 -8.000 1.00 1.00 H new ATOM 0 HB3 ARG A 11 86.885 13.446 -6.621 1.00 1.00 H new ATOM 0 HG2 ARG A 11 87.376 11.221 -5.687 1.00 1.00 H new ATOM 0 HG3 ARG A 11 88.255 10.758 -7.131 1.00 1.00 H new ATOM 0 HD2 ARG A 11 89.038 13.135 -5.368 1.00 1.00 H new ATOM 0 HD3 ARG A 11 89.733 11.535 -5.195 1.00 1.00 H new ATOM 0 HE ARG A 11 90.401 13.484 -7.251 1.00 1.00 H new ATOM 0 HH11 ARG A 11 89.978 10.072 -6.542 1.00 1.00 H new ATOM 0 HH12 ARG A 11 91.121 9.537 -7.778 1.00 1.00 H new ATOM 0 HH21 ARG A 11 91.878 12.780 -8.843 1.00 1.00 H new ATOM 0 HH22 ARG A 11 92.187 11.056 -9.069 1.00 1.00 H new ATOM 177 N ALA A 12 84.152 13.045 -6.887 1.00 1.00 N ATOM 178 CA ALA A 12 82.948 12.970 -6.043 1.00 1.00 C ATOM 179 C ALA A 12 81.838 12.246 -6.809 1.00 1.00 C ATOM 180 O ALA A 12 81.331 11.214 -6.365 1.00 1.00 O ATOM 181 CB ALA A 12 82.464 14.369 -5.600 1.00 1.00 C ATOM 0 H ALA A 12 84.394 13.974 -7.231 1.00 1.00 H new ATOM 0 HA ALA A 12 83.201 12.415 -5.140 1.00 1.00 H new ATOM 0 HB1 ALA A 12 81.574 14.266 -4.979 1.00 1.00 H new ATOM 0 HB2 ALA A 12 83.250 14.862 -5.028 1.00 1.00 H new ATOM 0 HB3 ALA A 12 82.226 14.967 -6.480 1.00 1.00 H new ATOM 187 N VAL A 13 81.470 12.785 -7.966 1.00 1.00 N ATOM 188 CA VAL A 13 80.415 12.127 -8.713 1.00 1.00 C ATOM 189 C VAL A 13 80.895 10.716 -9.121 1.00 1.00 C ATOM 190 O VAL A 13 80.262 9.759 -8.787 1.00 1.00 O ATOM 191 CB VAL A 13 79.894 12.959 -9.944 1.00 1.00 C ATOM 192 CG1 VAL A 13 79.983 12.143 -11.250 1.00 1.00 C ATOM 193 CG2 VAL A 13 78.417 13.299 -9.750 1.00 1.00 C ATOM 0 H VAL A 13 81.862 13.628 -8.386 1.00 1.00 H new ATOM 0 HA VAL A 13 79.546 12.042 -8.061 1.00 1.00 H new ATOM 0 HB VAL A 13 80.513 13.854 -10.011 1.00 1.00 H new ATOM 0 HG11 VAL A 13 79.616 12.745 -12.081 1.00 1.00 H new ATOM 0 HG12 VAL A 13 81.020 11.864 -11.435 1.00 1.00 H new ATOM 0 HG13 VAL A 13 79.376 11.243 -11.158 1.00 1.00 H new ATOM 0 HG21 VAL A 13 78.061 13.875 -10.604 1.00 1.00 H new ATOM 0 HG22 VAL A 13 77.840 12.378 -9.667 1.00 1.00 H new ATOM 0 HG23 VAL A 13 78.295 13.887 -8.840 1.00 1.00 H new ATOM 203 N ALA A 14 82.036 10.561 -9.783 1.00 1.00 N ATOM 204 CA ALA A 14 82.429 9.178 -10.136 1.00 1.00 C ATOM 205 C ALA A 14 82.676 8.334 -8.887 1.00 1.00 C ATOM 206 O ALA A 14 81.970 7.371 -8.681 1.00 1.00 O ATOM 207 CB ALA A 14 83.686 9.085 -11.042 1.00 1.00 C ATOM 0 H ALA A 14 82.671 11.304 -10.074 1.00 1.00 H new ATOM 0 HA ALA A 14 81.582 8.792 -10.703 1.00 1.00 H new ATOM 0 HB1 ALA A 14 83.906 8.038 -11.253 1.00 1.00 H new ATOM 0 HB2 ALA A 14 83.500 9.613 -11.977 1.00 1.00 H new ATOM 0 HB3 ALA A 14 84.536 9.538 -10.532 1.00 1.00 H new ATOM 213 N ALA A 15 83.667 8.697 -8.068 1.00 1.00 N ATOM 214 CA ALA A 15 83.961 7.855 -6.881 1.00 1.00 C ATOM 215 C ALA A 15 82.709 7.657 -6.013 1.00 1.00 C ATOM 216 O ALA A 15 82.340 6.531 -5.707 1.00 1.00 O ATOM 217 CB ALA A 15 85.124 8.403 -6.024 1.00 1.00 C ATOM 0 H ALA A 15 84.257 9.521 -8.184 1.00 1.00 H new ATOM 0 HA ALA A 15 84.278 6.888 -7.271 1.00 1.00 H new ATOM 0 HB1 ALA A 15 85.290 7.744 -5.172 1.00 1.00 H new ATOM 0 HB2 ALA A 15 86.030 8.450 -6.628 1.00 1.00 H new ATOM 0 HB3 ALA A 15 84.873 9.402 -5.667 1.00 1.00 H new ATOM 223 N ALA A 16 82.101 8.748 -5.585 1.00 1.00 N ATOM 224 CA ALA A 16 80.917 8.628 -4.721 1.00 1.00 C ATOM 225 C ALA A 16 79.752 7.982 -5.509 1.00 1.00 C ATOM 226 O ALA A 16 79.196 6.957 -5.103 1.00 1.00 O ATOM 227 CB ALA A 16 80.507 10.018 -4.170 1.00 1.00 C ATOM 0 H ALA A 16 82.386 9.702 -5.806 1.00 1.00 H new ATOM 0 HA ALA A 16 81.159 7.987 -3.873 1.00 1.00 H new ATOM 0 HB1 ALA A 16 79.629 9.912 -3.532 1.00 1.00 H new ATOM 0 HB2 ALA A 16 81.329 10.436 -3.589 1.00 1.00 H new ATOM 0 HB3 ALA A 16 80.274 10.684 -5.001 1.00 1.00 H new ATOM 233 N LEU A 17 79.402 8.619 -6.615 1.00 1.00 N ATOM 234 CA LEU A 17 78.270 8.107 -7.425 1.00 1.00 C ATOM 235 C LEU A 17 78.564 6.648 -7.802 1.00 1.00 C ATOM 236 O LEU A 17 77.750 5.763 -7.549 1.00 1.00 O ATOM 237 CB LEU A 17 78.015 8.949 -8.694 1.00 1.00 C ATOM 238 CG LEU A 17 76.674 8.581 -9.367 1.00 1.00 C ATOM 239 CD1 LEU A 17 76.009 9.841 -9.934 1.00 1.00 C ATOM 240 CD2 LEU A 17 76.932 7.618 -10.529 1.00 1.00 C ATOM 0 H LEU A 17 79.854 9.459 -6.975 1.00 1.00 H new ATOM 0 HA LEU A 17 77.362 8.176 -6.826 1.00 1.00 H new ATOM 0 HB2 LEU A 17 78.012 10.007 -8.433 1.00 1.00 H new ATOM 0 HB3 LEU A 17 78.830 8.797 -9.401 1.00 1.00 H new ATOM 0 HG LEU A 17 76.026 8.118 -8.622 1.00 1.00 H new ATOM 0 HD11 LEU A 17 75.064 9.572 -10.407 1.00 1.00 H new ATOM 0 HD12 LEU A 17 75.822 10.549 -9.126 1.00 1.00 H new ATOM 0 HD13 LEU A 17 76.667 10.299 -10.673 1.00 1.00 H new ATOM 0 HD21 LEU A 17 75.986 7.359 -11.004 1.00 1.00 H new ATOM 0 HD22 LEU A 17 77.585 8.096 -11.259 1.00 1.00 H new ATOM 0 HD23 LEU A 17 77.409 6.713 -10.153 1.00 1.00 H new ATOM 252 N VAL A 18 79.722 6.390 -8.409 1.00 1.00 N ATOM 253 CA VAL A 18 80.045 5.005 -8.785 1.00 1.00 C ATOM 254 C VAL A 18 80.347 4.175 -7.534 1.00 1.00 C ATOM 255 O VAL A 18 79.712 3.147 -7.296 1.00 1.00 O ATOM 256 CB VAL A 18 81.199 4.925 -9.830 1.00 1.00 C ATOM 257 CG1 VAL A 18 81.037 6.069 -10.869 1.00 1.00 C ATOM 258 CG2 VAL A 18 82.613 4.993 -9.170 1.00 1.00 C ATOM 0 H VAL A 18 80.429 7.086 -8.645 1.00 1.00 H new ATOM 0 HA VAL A 18 79.169 4.580 -9.276 1.00 1.00 H new ATOM 0 HB VAL A 18 81.128 3.956 -10.325 1.00 1.00 H new ATOM 0 HG11 VAL A 18 81.844 6.014 -11.600 1.00 1.00 H new ATOM 0 HG12 VAL A 18 80.079 5.965 -11.378 1.00 1.00 H new ATOM 0 HG13 VAL A 18 81.075 7.032 -10.359 1.00 1.00 H new ATOM 0 HG21 VAL A 18 83.379 4.933 -9.943 1.00 1.00 H new ATOM 0 HG22 VAL A 18 82.717 5.933 -8.629 1.00 1.00 H new ATOM 0 HG23 VAL A 18 82.731 4.160 -8.477 1.00 1.00 H new ATOM 268 N GLY A 19 81.339 4.608 -6.752 1.00 1.00 N ATOM 269 CA GLY A 19 81.740 3.877 -5.568 1.00 1.00 C ATOM 270 C GLY A 19 80.585 3.709 -4.615 1.00 1.00 C ATOM 271 O GLY A 19 79.441 4.001 -4.951 1.00 1.00 O ATOM 0 H GLY A 19 81.872 5.460 -6.925 1.00 1.00 H new ATOM 0 HA2 GLY A 19 82.124 2.898 -5.854 1.00 1.00 H new ATOM 0 HA3 GLY A 19 82.553 4.405 -5.069 1.00 1.00 H new ATOM 275 N PRO A 20 80.865 3.219 -3.446 1.00 1.00 N ATOM 276 CA PRO A 20 79.840 2.970 -2.424 1.00 1.00 C ATOM 277 C PRO A 20 79.457 4.226 -1.631 1.00 1.00 C ATOM 278 O PRO A 20 78.385 4.257 -1.055 1.00 1.00 O ATOM 279 CB PRO A 20 80.484 1.900 -1.536 1.00 1.00 C ATOM 280 CG PRO A 20 81.957 2.161 -1.617 1.00 1.00 C ATOM 281 CD PRO A 20 82.208 2.877 -2.956 1.00 1.00 C ATOM 0 HA PRO A 20 78.893 2.654 -2.861 1.00 1.00 H new ATOM 0 HB2 PRO A 20 80.127 1.973 -0.509 1.00 1.00 H new ATOM 0 HB3 PRO A 20 80.241 0.897 -1.888 1.00 1.00 H new ATOM 0 HG2 PRO A 20 82.287 2.778 -0.781 1.00 1.00 H new ATOM 0 HG3 PRO A 20 82.518 1.228 -1.566 1.00 1.00 H new ATOM 0 HD2 PRO A 20 82.821 3.768 -2.821 1.00 1.00 H new ATOM 0 HD3 PRO A 20 82.735 2.232 -3.659 1.00 1.00 H new ATOM 289 N GLY A 21 80.349 5.237 -1.543 1.00 1.00 N ATOM 290 CA GLY A 21 80.016 6.428 -0.723 1.00 1.00 C ATOM 291 C GLY A 21 78.810 7.188 -1.280 1.00 1.00 C ATOM 292 O GLY A 21 77.774 7.290 -0.627 1.00 1.00 O ATOM 0 H GLY A 21 81.260 5.259 -2.002 1.00 1.00 H new ATOM 0 HA2 GLY A 21 79.807 6.117 0.301 1.00 1.00 H new ATOM 0 HA3 GLY A 21 80.878 7.094 -0.684 1.00 1.00 H new ATOM 296 N GLY A 22 78.920 7.702 -2.498 1.00 1.00 N ATOM 297 CA GLY A 22 77.774 8.431 -3.060 1.00 1.00 C ATOM 298 C GLY A 22 76.582 7.501 -2.943 1.00 1.00 C ATOM 299 O GLY A 22 75.538 7.861 -2.404 1.00 1.00 O ATOM 0 H GLY A 22 79.744 7.638 -3.096 1.00 1.00 H new ATOM 0 HA2 GLY A 22 77.598 9.359 -2.516 1.00 1.00 H new ATOM 0 HA3 GLY A 22 77.957 8.701 -4.100 1.00 1.00 H new ATOM 303 N VAL A 23 76.758 6.286 -3.438 1.00 1.00 N ATOM 304 CA VAL A 23 75.678 5.297 -3.342 1.00 1.00 C ATOM 305 C VAL A 23 75.293 5.122 -1.857 1.00 1.00 C ATOM 306 O VAL A 23 74.137 4.837 -1.532 1.00 1.00 O ATOM 307 CB VAL A 23 76.046 3.945 -3.961 1.00 1.00 C ATOM 308 CG1 VAL A 23 74.811 3.039 -3.940 1.00 1.00 C ATOM 309 CG2 VAL A 23 76.477 4.146 -5.415 1.00 1.00 C ATOM 0 H VAL A 23 77.608 5.960 -3.898 1.00 1.00 H new ATOM 0 HA VAL A 23 74.831 5.672 -3.916 1.00 1.00 H new ATOM 0 HB VAL A 23 76.861 3.495 -3.394 1.00 1.00 H new ATOM 0 HG11 VAL A 23 75.061 2.073 -4.379 1.00 1.00 H new ATOM 0 HG12 VAL A 23 74.482 2.896 -2.911 1.00 1.00 H new ATOM 0 HG13 VAL A 23 74.010 3.502 -4.516 1.00 1.00 H new ATOM 0 HG21 VAL A 23 76.738 3.183 -5.853 1.00 1.00 H new ATOM 0 HG22 VAL A 23 75.657 4.591 -5.979 1.00 1.00 H new ATOM 0 HG23 VAL A 23 77.343 4.807 -5.450 1.00 1.00 H new ATOM 319 N ALA A 24 76.278 5.301 -0.948 1.00 1.00 N ATOM 320 CA ALA A 24 75.949 5.151 0.476 1.00 1.00 C ATOM 321 C ALA A 24 74.841 6.135 0.850 1.00 1.00 C ATOM 322 O ALA A 24 73.769 5.718 1.289 1.00 1.00 O ATOM 323 CB ALA A 24 77.155 5.377 1.409 1.00 1.00 C ATOM 0 H ALA A 24 77.248 5.535 -1.160 1.00 1.00 H new ATOM 0 HA ALA A 24 75.624 4.120 0.614 1.00 1.00 H new ATOM 0 HB1 ALA A 24 76.842 5.251 2.445 1.00 1.00 H new ATOM 0 HB2 ALA A 24 77.936 4.654 1.176 1.00 1.00 H new ATOM 0 HB3 ALA A 24 77.541 6.386 1.267 1.00 1.00 H new ATOM 329 N LEU A 25 75.085 7.445 0.712 1.00 1.00 N ATOM 330 CA LEU A 25 74.067 8.413 1.103 1.00 1.00 C ATOM 331 C LEU A 25 72.773 8.160 0.337 1.00 1.00 C ATOM 332 O LEU A 25 71.692 8.194 0.908 1.00 1.00 O ATOM 333 CB LEU A 25 74.539 9.857 0.838 1.00 1.00 C ATOM 334 CG LEU A 25 75.534 10.287 1.930 1.00 1.00 C ATOM 335 CD1 LEU A 25 76.857 9.528 1.752 1.00 1.00 C ATOM 336 CD2 LEU A 25 75.791 11.793 1.831 1.00 1.00 C ATOM 0 H LEU A 25 75.949 7.844 0.345 1.00 1.00 H new ATOM 0 HA LEU A 25 73.891 8.292 2.172 1.00 1.00 H new ATOM 0 HB2 LEU A 25 75.011 9.921 -0.143 1.00 1.00 H new ATOM 0 HB3 LEU A 25 73.684 10.533 0.825 1.00 1.00 H new ATOM 0 HG LEU A 25 75.113 10.056 2.909 1.00 1.00 H new ATOM 0 HD11 LEU A 25 77.560 9.835 2.527 1.00 1.00 H new ATOM 0 HD12 LEU A 25 76.675 8.456 1.831 1.00 1.00 H new ATOM 0 HD13 LEU A 25 77.277 9.754 0.772 1.00 1.00 H new ATOM 0 HD21 LEU A 25 76.496 12.094 2.606 1.00 1.00 H new ATOM 0 HD22 LEU A 25 76.207 12.027 0.851 1.00 1.00 H new ATOM 0 HD23 LEU A 25 74.853 12.332 1.965 1.00 1.00 H new ATOM 348 N VAL A 26 72.874 7.919 -0.953 1.00 1.00 N ATOM 349 CA VAL A 26 71.661 7.702 -1.730 1.00 1.00 C ATOM 350 C VAL A 26 70.858 6.515 -1.179 1.00 1.00 C ATOM 351 O VAL A 26 69.695 6.672 -0.806 1.00 1.00 O ATOM 352 CB VAL A 26 72.059 7.438 -3.179 1.00 1.00 C ATOM 353 CG1 VAL A 26 70.833 6.997 -3.977 1.00 1.00 C ATOM 354 CG2 VAL A 26 72.640 8.719 -3.776 1.00 1.00 C ATOM 0 H VAL A 26 73.748 7.868 -1.476 1.00 1.00 H new ATOM 0 HA VAL A 26 71.028 8.587 -1.666 1.00 1.00 H new ATOM 0 HB VAL A 26 72.807 6.646 -3.219 1.00 1.00 H new ATOM 0 HG11 VAL A 26 71.120 6.809 -5.012 1.00 1.00 H new ATOM 0 HG12 VAL A 26 70.425 6.084 -3.542 1.00 1.00 H new ATOM 0 HG13 VAL A 26 70.078 7.782 -3.947 1.00 1.00 H new ATOM 0 HG21 VAL A 26 72.927 8.540 -4.812 1.00 1.00 H new ATOM 0 HG22 VAL A 26 71.891 9.510 -3.739 1.00 1.00 H new ATOM 0 HG23 VAL A 26 73.517 9.022 -3.204 1.00 1.00 H new ATOM 364 N VAL A 27 71.459 5.323 -1.168 1.00 1.00 N ATOM 365 CA VAL A 27 70.759 4.122 -0.710 1.00 1.00 C ATOM 366 C VAL A 27 70.258 4.240 0.725 1.00 1.00 C ATOM 367 O VAL A 27 69.150 3.799 1.028 1.00 1.00 O ATOM 368 CB VAL A 27 71.700 2.895 -0.828 1.00 1.00 C ATOM 369 CG1 VAL A 27 71.179 1.726 0.032 1.00 1.00 C ATOM 370 CG2 VAL A 27 71.754 2.436 -2.290 1.00 1.00 C ATOM 0 H VAL A 27 72.421 5.165 -1.468 1.00 1.00 H new ATOM 0 HA VAL A 27 69.884 3.999 -1.349 1.00 1.00 H new ATOM 0 HB VAL A 27 72.691 3.185 -0.480 1.00 1.00 H new ATOM 0 HG11 VAL A 27 71.853 0.875 -0.064 1.00 1.00 H new ATOM 0 HG12 VAL A 27 71.132 2.035 1.076 1.00 1.00 H new ATOM 0 HG13 VAL A 27 70.183 1.441 -0.307 1.00 1.00 H new ATOM 0 HG21 VAL A 27 72.415 1.573 -2.376 1.00 1.00 H new ATOM 0 HG22 VAL A 27 70.753 2.161 -2.622 1.00 1.00 H new ATOM 0 HG23 VAL A 27 72.133 3.247 -2.912 1.00 1.00 H new ATOM 380 N LYS A 28 71.066 4.800 1.614 1.00 1.00 N ATOM 381 CA LYS A 28 70.635 4.890 3.009 1.00 1.00 C ATOM 382 C LYS A 28 69.467 5.878 3.134 1.00 1.00 C ATOM 383 O LYS A 28 68.403 5.537 3.653 1.00 1.00 O ATOM 384 CB LYS A 28 71.829 5.212 3.952 1.00 1.00 C ATOM 385 CG LYS A 28 72.441 6.608 3.666 1.00 1.00 C ATOM 386 CD LYS A 28 71.936 7.611 4.713 1.00 1.00 C ATOM 387 CE LYS A 28 72.607 8.977 4.540 1.00 1.00 C ATOM 388 NZ LYS A 28 72.223 9.577 3.236 1.00 1.00 N ATOM 0 H LYS A 28 71.988 5.186 1.411 1.00 1.00 H new ATOM 0 HA LYS A 28 70.264 3.919 3.336 1.00 1.00 H new ATOM 0 HB2 LYS A 28 71.493 5.170 4.988 1.00 1.00 H new ATOM 0 HB3 LYS A 28 72.598 4.449 3.835 1.00 1.00 H new ATOM 0 HG2 LYS A 28 73.529 6.553 3.695 1.00 1.00 H new ATOM 0 HG3 LYS A 28 72.165 6.940 2.665 1.00 1.00 H new ATOM 0 HD2 LYS A 28 70.855 7.720 4.624 1.00 1.00 H new ATOM 0 HD3 LYS A 28 72.137 7.228 5.714 1.00 1.00 H new ATOM 0 HE2 LYS A 28 72.313 9.640 5.354 1.00 1.00 H new ATOM 0 HE3 LYS A 28 73.690 8.867 4.593 1.00 1.00 H new ATOM 0 HZ1 LYS A 28 73.079 9.783 2.683 1.00 1.00 H new ATOM 0 HZ2 LYS A 28 71.623 8.910 2.710 1.00 1.00 H new ATOM 0 HZ3 LYS A 28 71.697 10.459 3.401 1.00 1.00 H new ATOM 402 N VAL A 29 69.660 7.094 2.652 1.00 1.00 N ATOM 403 CA VAL A 29 68.584 8.090 2.735 1.00 1.00 C ATOM 404 C VAL A 29 67.352 7.612 1.976 1.00 1.00 C ATOM 405 O VAL A 29 66.245 7.628 2.516 1.00 1.00 O ATOM 406 CB VAL A 29 69.046 9.477 2.206 1.00 1.00 C ATOM 407 CG1 VAL A 29 67.913 10.201 1.451 1.00 1.00 C ATOM 408 CG2 VAL A 29 69.462 10.352 3.398 1.00 1.00 C ATOM 0 H VAL A 29 70.521 7.417 2.210 1.00 1.00 H new ATOM 0 HA VAL A 29 68.324 8.207 3.787 1.00 1.00 H new ATOM 0 HB VAL A 29 69.878 9.316 1.521 1.00 1.00 H new ATOM 0 HG11 VAL A 29 68.272 11.167 1.096 1.00 1.00 H new ATOM 0 HG12 VAL A 29 67.598 9.596 0.601 1.00 1.00 H new ATOM 0 HG13 VAL A 29 67.068 10.353 2.122 1.00 1.00 H new ATOM 0 HG21 VAL A 29 69.788 11.328 3.037 1.00 1.00 H new ATOM 0 HG22 VAL A 29 68.613 10.479 4.070 1.00 1.00 H new ATOM 0 HG23 VAL A 29 70.281 9.871 3.934 1.00 1.00 H new ATOM 418 N CYS A 30 67.529 7.191 0.726 1.00 1.00 N ATOM 419 CA CYS A 30 66.387 6.744 -0.042 1.00 1.00 C ATOM 420 C CYS A 30 65.789 5.486 0.574 1.00 1.00 C ATOM 421 O CYS A 30 64.632 5.487 0.987 1.00 1.00 O ATOM 422 CB CYS A 30 66.864 6.452 -1.469 1.00 1.00 C ATOM 423 SG CYS A 30 65.459 6.386 -2.597 1.00 1.00 S ATOM 0 H CYS A 30 68.426 7.153 0.241 1.00 1.00 H new ATOM 0 HA CYS A 30 65.616 7.515 -0.047 1.00 1.00 H new ATOM 0 HB2 CYS A 30 67.562 7.224 -1.792 1.00 1.00 H new ATOM 0 HB3 CYS A 30 67.403 5.505 -1.493 1.00 1.00 H new ATOM 0 HG CYS A 30 65.881 6.140 -3.802 1.00 1.00 H new ATOM 428 N ALA A 31 66.550 4.392 0.612 1.00 1.00 N ATOM 429 CA ALA A 31 66.017 3.145 1.139 1.00 1.00 C ATOM 430 C ALA A 31 65.499 3.325 2.553 1.00 1.00 C ATOM 431 O ALA A 31 64.385 2.903 2.868 1.00 1.00 O ATOM 432 CB ALA A 31 67.096 2.047 1.105 1.00 1.00 C ATOM 0 H ALA A 31 67.517 4.347 0.290 1.00 1.00 H new ATOM 0 HA ALA A 31 65.181 2.842 0.508 1.00 1.00 H new ATOM 0 HB1 ALA A 31 66.684 1.119 1.502 1.00 1.00 H new ATOM 0 HB2 ALA A 31 67.422 1.889 0.077 1.00 1.00 H new ATOM 0 HB3 ALA A 31 67.948 2.355 1.712 1.00 1.00 H new ATOM 438 N GLY A 32 66.319 3.910 3.407 1.00 1.00 N ATOM 439 CA GLY A 32 65.923 4.088 4.790 1.00 1.00 C ATOM 440 C GLY A 32 65.999 2.744 5.493 1.00 1.00 C ATOM 441 O GLY A 32 64.973 2.139 5.798 1.00 1.00 O ATOM 0 H GLY A 32 67.247 4.264 3.173 1.00 1.00 H new ATOM 0 HA2 GLY A 32 66.577 4.809 5.281 1.00 1.00 H new ATOM 0 HA3 GLY A 32 64.910 4.487 4.845 1.00 1.00 H new ATOM 445 N LEU A 33 67.235 2.283 5.692 1.00 1.00 N ATOM 446 CA LEU A 33 67.519 0.983 6.323 1.00 1.00 C ATOM 447 C LEU A 33 67.460 -0.139 5.255 1.00 1.00 C ATOM 448 O LEU A 33 66.384 -0.667 4.975 1.00 1.00 O ATOM 449 CB LEU A 33 66.503 0.667 7.486 1.00 1.00 C ATOM 450 CG LEU A 33 67.235 0.376 8.820 1.00 1.00 C ATOM 451 CD1 LEU A 33 67.297 1.641 9.688 1.00 1.00 C ATOM 452 CD2 LEU A 33 66.484 -0.703 9.593 1.00 1.00 C ATOM 0 H LEU A 33 68.073 2.798 5.421 1.00 1.00 H new ATOM 0 HA LEU A 33 68.518 1.030 6.756 1.00 1.00 H new ATOM 0 HB2 LEU A 33 65.827 1.511 7.618 1.00 1.00 H new ATOM 0 HB3 LEU A 33 65.891 -0.192 7.212 1.00 1.00 H new ATOM 0 HG LEU A 33 68.247 0.043 8.589 1.00 1.00 H new ATOM 0 HD11 LEU A 33 67.815 1.417 10.621 1.00 1.00 H new ATOM 0 HD12 LEU A 33 67.835 2.423 9.153 1.00 1.00 H new ATOM 0 HD13 LEU A 33 66.285 1.982 9.907 1.00 1.00 H new ATOM 0 HD21 LEU A 33 67.001 -0.905 10.531 1.00 1.00 H new ATOM 0 HD22 LEU A 33 65.471 -0.361 9.804 1.00 1.00 H new ATOM 0 HD23 LEU A 33 66.442 -1.615 8.997 1.00 1.00 H new ATOM 464 N PRO A 34 68.569 -0.513 4.656 1.00 1.00 N ATOM 465 CA PRO A 34 68.581 -1.579 3.613 1.00 1.00 C ATOM 466 C PRO A 34 67.763 -2.825 3.995 1.00 1.00 C ATOM 467 O PRO A 34 67.516 -3.683 3.144 1.00 1.00 O ATOM 468 CB PRO A 34 70.065 -1.931 3.467 1.00 1.00 C ATOM 469 CG PRO A 34 70.798 -0.685 3.843 1.00 1.00 C ATOM 470 CD PRO A 34 69.928 0.026 4.888 1.00 1.00 C ATOM 0 HA PRO A 34 68.117 -1.228 2.691 1.00 1.00 H new ATOM 0 HB2 PRO A 34 70.339 -2.761 4.118 1.00 1.00 H new ATOM 0 HB3 PRO A 34 70.300 -2.234 2.447 1.00 1.00 H new ATOM 0 HG2 PRO A 34 71.781 -0.920 4.250 1.00 1.00 H new ATOM 0 HG3 PRO A 34 70.957 -0.049 2.972 1.00 1.00 H new ATOM 0 HD2 PRO A 34 70.272 -0.183 5.901 1.00 1.00 H new ATOM 0 HD3 PRO A 34 69.955 1.108 4.759 1.00 1.00 H new ATOM 478 N GLY A 35 67.382 -2.946 5.271 1.00 1.00 N ATOM 479 CA GLY A 35 66.632 -4.144 5.678 1.00 1.00 C ATOM 480 C GLY A 35 65.304 -4.211 4.947 1.00 1.00 C ATOM 481 O GLY A 35 65.072 -5.130 4.163 1.00 1.00 O ATOM 0 H GLY A 35 67.567 -2.267 6.010 1.00 1.00 H new ATOM 0 HA2 GLY A 35 67.218 -5.038 5.463 1.00 1.00 H new ATOM 0 HA3 GLY A 35 66.461 -4.126 6.754 1.00 1.00 H new ATOM 485 N VAL A 36 64.450 -3.219 5.161 1.00 1.00 N ATOM 486 CA VAL A 36 63.170 -3.195 4.470 1.00 1.00 C ATOM 487 C VAL A 36 63.426 -2.738 3.048 1.00 1.00 C ATOM 488 O VAL A 36 64.472 -3.042 2.515 1.00 1.00 O ATOM 489 CB VAL A 36 62.183 -2.264 5.182 1.00 1.00 C ATOM 490 CG1 VAL A 36 61.939 -2.770 6.608 1.00 1.00 C ATOM 491 CG2 VAL A 36 62.767 -0.854 5.235 1.00 1.00 C ATOM 0 H VAL A 36 64.615 -2.436 5.794 1.00 1.00 H new ATOM 0 HA VAL A 36 62.720 -4.188 4.469 1.00 1.00 H new ATOM 0 HB VAL A 36 61.239 -2.248 4.637 1.00 1.00 H new ATOM 0 HG11 VAL A 36 61.237 -2.107 7.114 1.00 1.00 H new ATOM 0 HG12 VAL A 36 61.525 -3.777 6.571 1.00 1.00 H new ATOM 0 HG13 VAL A 36 62.882 -2.785 7.155 1.00 1.00 H new ATOM 0 HG21 VAL A 36 62.067 -0.189 5.741 1.00 1.00 H new ATOM 0 HG22 VAL A 36 63.710 -0.871 5.781 1.00 1.00 H new ATOM 0 HG23 VAL A 36 62.941 -0.494 4.221 1.00 1.00 H new ATOM 501 N ILE A 37 62.475 -2.023 2.464 1.00 1.00 N ATOM 502 CA ILE A 37 62.594 -1.514 1.086 1.00 1.00 C ATOM 503 C ILE A 37 62.472 -2.646 0.049 1.00 1.00 C ATOM 504 O ILE A 37 63.436 -3.089 -0.577 1.00 1.00 O ATOM 505 CB ILE A 37 63.903 -0.676 0.895 1.00 1.00 C ATOM 506 CG1 ILE A 37 63.640 0.456 -0.114 1.00 1.00 C ATOM 507 CG2 ILE A 37 65.111 -1.512 0.391 1.00 1.00 C ATOM 508 CD1 ILE A 37 63.032 -0.115 -1.403 1.00 1.00 C ATOM 0 H ILE A 37 61.598 -1.775 2.922 1.00 1.00 H new ATOM 0 HA ILE A 37 61.756 -0.838 0.913 1.00 1.00 H new ATOM 0 HB ILE A 37 64.166 -0.288 1.879 1.00 1.00 H new ATOM 0 HG12 ILE A 37 62.964 1.191 0.321 1.00 1.00 H new ATOM 0 HG13 ILE A 37 64.571 0.975 -0.341 1.00 1.00 H new ATOM 0 HG21 ILE A 37 65.981 -0.865 0.282 1.00 1.00 H new ATOM 0 HG22 ILE A 37 65.333 -2.301 1.110 1.00 1.00 H new ATOM 0 HG23 ILE A 37 64.868 -1.958 -0.573 1.00 1.00 H new ATOM 0 HD11 ILE A 37 62.850 0.695 -2.109 1.00 1.00 H new ATOM 0 HD12 ILE A 37 63.723 -0.833 -1.844 1.00 1.00 H new ATOM 0 HD13 ILE A 37 62.090 -0.613 -1.172 1.00 1.00 H new ATOM 520 N HIS A 38 61.250 -3.118 -0.165 1.00 1.00 N ATOM 521 CA HIS A 38 61.010 -4.174 -1.139 1.00 1.00 C ATOM 522 C HIS A 38 59.751 -3.845 -1.931 1.00 1.00 C ATOM 523 O HIS A 38 58.717 -3.513 -1.349 1.00 1.00 O ATOM 524 CB HIS A 38 60.848 -5.511 -0.416 1.00 1.00 C ATOM 525 CG HIS A 38 62.130 -5.829 0.292 1.00 1.00 C ATOM 526 ND1 HIS A 38 63.433 -5.765 -0.124 1.00 1.00 N flip ATOM 527 CD2 HIS A 38 62.172 -6.255 1.611 1.00 1.00 C flip ATOM 528 CE1 HIS A 38 64.277 -6.139 0.915 1.00 1.00 C flip ATOM 529 NE2 HIS A 38 63.466 -6.425 1.938 1.00 1.00 N flip ATOM 0 H HIS A 38 60.415 -2.789 0.320 1.00 1.00 H new ATOM 0 HA HIS A 38 61.855 -4.247 -1.824 1.00 1.00 H new ATOM 0 HB2 HIS A 38 60.025 -5.459 0.297 1.00 1.00 H new ATOM 0 HB3 HIS A 38 60.603 -6.299 -1.128 1.00 1.00 H new ATOM 0 HD2 HIS A 38 61.322 -6.420 2.257 1.00 1.00 H new ATOM 0 HE1 HIS A 38 65.356 -6.188 0.899 1.00 1.00 H new ATOM 0 HE2 HIS A 38 63.789 -6.734 2.855 1.00 1.00 H new ATOM 537 N THR A 39 59.841 -3.951 -3.260 1.00 1.00 N ATOM 538 CA THR A 39 58.705 -3.670 -4.144 1.00 1.00 C ATOM 539 C THR A 39 58.511 -4.859 -5.106 1.00 1.00 C ATOM 540 O THR A 39 59.376 -5.116 -5.943 1.00 1.00 O ATOM 541 CB THR A 39 58.994 -2.393 -4.954 1.00 1.00 C ATOM 542 OG1 THR A 39 58.031 -2.267 -5.998 1.00 1.00 O ATOM 543 CG2 THR A 39 60.409 -2.442 -5.574 1.00 1.00 C ATOM 0 H THR A 39 60.692 -4.230 -3.749 1.00 1.00 H new ATOM 0 HA THR A 39 57.801 -3.526 -3.552 1.00 1.00 H new ATOM 0 HB THR A 39 58.936 -1.537 -4.282 1.00 1.00 H new ATOM 0 HG1 THR A 39 58.374 -2.691 -6.812 1.00 1.00 H new ATOM 0 HG21 THR A 39 60.590 -1.529 -6.141 1.00 1.00 H new ATOM 0 HG22 THR A 39 61.151 -2.529 -4.780 1.00 1.00 H new ATOM 0 HG23 THR A 39 60.486 -3.303 -6.238 1.00 1.00 H new ATOM 551 N PRO A 40 57.431 -5.604 -5.007 1.00 1.00 N ATOM 552 CA PRO A 40 57.212 -6.781 -5.894 1.00 1.00 C ATOM 553 C PRO A 40 57.587 -6.498 -7.346 1.00 1.00 C ATOM 554 O PRO A 40 58.524 -7.080 -7.892 1.00 1.00 O ATOM 555 CB PRO A 40 55.704 -7.050 -5.753 1.00 1.00 C ATOM 556 CG PRO A 40 55.350 -6.576 -4.379 1.00 1.00 C ATOM 557 CD PRO A 40 56.308 -5.421 -4.063 1.00 1.00 C ATOM 0 HA PRO A 40 57.835 -7.630 -5.613 1.00 1.00 H new ATOM 0 HB2 PRO A 40 55.135 -6.515 -6.513 1.00 1.00 H new ATOM 0 HB3 PRO A 40 55.480 -8.110 -5.874 1.00 1.00 H new ATOM 0 HG2 PRO A 40 54.313 -6.243 -4.337 1.00 1.00 H new ATOM 0 HG3 PRO A 40 55.456 -7.380 -3.651 1.00 1.00 H new ATOM 0 HD2 PRO A 40 55.825 -4.454 -4.204 1.00 1.00 H new ATOM 0 HD3 PRO A 40 56.649 -5.459 -3.028 1.00 1.00 H new ATOM 565 N ALA A 41 56.810 -5.637 -7.967 1.00 1.00 N ATOM 566 CA ALA A 41 56.989 -5.284 -9.372 1.00 1.00 C ATOM 567 C ALA A 41 58.185 -4.367 -9.561 1.00 1.00 C ATOM 568 O ALA A 41 58.304 -3.331 -8.908 1.00 1.00 O ATOM 569 CB ALA A 41 55.725 -4.596 -9.906 1.00 1.00 C ATOM 0 H ALA A 41 56.031 -5.156 -7.516 1.00 1.00 H new ATOM 0 HA ALA A 41 57.169 -6.204 -9.929 1.00 1.00 H new ATOM 0 HB1 ALA A 41 55.868 -4.336 -10.955 1.00 1.00 H new ATOM 0 HB2 ALA A 41 54.875 -5.272 -9.812 1.00 1.00 H new ATOM 0 HB3 ALA A 41 55.533 -3.690 -9.331 1.00 1.00 H new ATOM 575 N ARG A 42 59.052 -4.766 -10.475 1.00 1.00 N ATOM 576 CA ARG A 42 60.244 -3.992 -10.777 1.00 1.00 C ATOM 577 C ARG A 42 60.983 -4.585 -11.958 1.00 1.00 C ATOM 578 O ARG A 42 60.624 -5.652 -12.450 1.00 1.00 O ATOM 579 CB ARG A 42 61.150 -3.981 -9.542 1.00 1.00 C ATOM 580 CG ARG A 42 61.841 -5.371 -9.368 1.00 1.00 C ATOM 581 CD ARG A 42 61.825 -5.848 -7.895 1.00 1.00 C ATOM 582 NE ARG A 42 60.917 -6.983 -7.766 1.00 1.00 N ATOM 583 CZ ARG A 42 60.921 -7.755 -6.683 1.00 1.00 C ATOM 584 NH1 ARG A 42 61.721 -7.486 -5.687 1.00 1.00 N ATOM 585 NH2 ARG A 42 60.117 -8.781 -6.607 1.00 1.00 N ATOM 0 H ARG A 42 58.953 -5.622 -11.021 1.00 1.00 H new ATOM 0 HA ARG A 42 59.956 -2.973 -11.037 1.00 1.00 H new ATOM 0 HB2 ARG A 42 61.905 -3.201 -9.643 1.00 1.00 H new ATOM 0 HB3 ARG A 42 60.564 -3.744 -8.654 1.00 1.00 H new ATOM 0 HG2 ARG A 42 61.336 -6.107 -9.993 1.00 1.00 H new ATOM 0 HG3 ARG A 42 62.872 -5.310 -9.718 1.00 1.00 H new ATOM 0 HD2 ARG A 42 62.829 -6.134 -7.582 1.00 1.00 H new ATOM 0 HD3 ARG A 42 61.506 -5.036 -7.241 1.00 1.00 H new ATOM 0 HE ARG A 42 60.265 -7.189 -8.523 1.00 1.00 H new ATOM 0 HH11 ARG A 42 62.346 -6.681 -5.738 1.00 1.00 H new ATOM 0 HH12 ARG A 42 61.721 -8.080 -4.858 1.00 1.00 H new ATOM 0 HH21 ARG A 42 59.484 -8.992 -7.379 1.00 1.00 H new ATOM 0 HH22 ARG A 42 60.121 -9.372 -5.776 1.00 1.00 H new ATOM 599 N ARG A 43 62.035 -3.909 -12.383 1.00 1.00 N ATOM 600 CA ARG A 43 62.842 -4.396 -13.489 1.00 1.00 C ATOM 601 C ARG A 43 63.505 -5.742 -13.106 1.00 1.00 C ATOM 602 O ARG A 43 64.476 -6.171 -13.721 1.00 1.00 O ATOM 603 CB ARG A 43 63.901 -3.322 -13.836 1.00 1.00 C ATOM 604 CG ARG A 43 64.866 -3.782 -14.953 1.00 1.00 C ATOM 605 CD ARG A 43 64.093 -4.438 -16.105 1.00 1.00 C ATOM 606 NE ARG A 43 64.982 -4.743 -17.220 1.00 1.00 N ATOM 607 CZ ARG A 43 64.574 -5.546 -18.196 1.00 1.00 C ATOM 608 NH1 ARG A 43 63.361 -6.023 -18.165 1.00 1.00 N ATOM 609 NH2 ARG A 43 65.373 -5.857 -19.181 1.00 1.00 N ATOM 0 H ARG A 43 62.350 -3.026 -11.982 1.00 1.00 H new ATOM 0 HA ARG A 43 62.219 -4.575 -14.366 1.00 1.00 H new ATOM 0 HB2 ARG A 43 63.397 -2.407 -14.149 1.00 1.00 H new ATOM 0 HB3 ARG A 43 64.475 -3.080 -12.941 1.00 1.00 H new ATOM 0 HG2 ARG A 43 65.430 -2.928 -15.327 1.00 1.00 H new ATOM 0 HG3 ARG A 43 65.590 -4.488 -14.546 1.00 1.00 H new ATOM 0 HD2 ARG A 43 63.616 -5.353 -15.754 1.00 1.00 H new ATOM 0 HD3 ARG A 43 63.298 -3.772 -16.440 1.00 1.00 H new ATOM 0 HE ARG A 43 65.918 -4.339 -17.250 1.00 1.00 H new ATOM 0 HH11 ARG A 43 62.736 -5.778 -17.397 1.00 1.00 H new ATOM 0 HH12 ARG A 43 63.037 -6.641 -18.909 1.00 1.00 H new ATOM 0 HH21 ARG A 43 66.321 -5.482 -19.206 1.00 1.00 H new ATOM 0 HH22 ARG A 43 65.049 -6.475 -19.925 1.00 1.00 H new ATOM 623 N GLY A 44 62.962 -6.416 -12.080 1.00 1.00 N ATOM 624 CA GLY A 44 63.498 -7.696 -11.616 1.00 1.00 C ATOM 625 C GLY A 44 64.851 -7.499 -10.937 1.00 1.00 C ATOM 626 O GLY A 44 65.230 -8.265 -10.051 1.00 1.00 O ATOM 0 H GLY A 44 62.149 -6.090 -11.557 1.00 1.00 H new ATOM 0 HA2 GLY A 44 62.799 -8.157 -10.918 1.00 1.00 H new ATOM 0 HA3 GLY A 44 63.604 -8.379 -12.459 1.00 1.00 H new ATOM 630 N PHE A 45 65.558 -6.457 -11.354 1.00 1.00 N ATOM 631 CA PHE A 45 66.868 -6.133 -10.799 1.00 1.00 C ATOM 632 C PHE A 45 67.183 -4.674 -11.091 1.00 1.00 C ATOM 633 O PHE A 45 66.593 -4.104 -11.999 1.00 1.00 O ATOM 634 CB PHE A 45 67.942 -7.054 -11.398 1.00 1.00 C ATOM 635 CG PHE A 45 67.532 -7.432 -12.798 1.00 1.00 C ATOM 636 CD1 PHE A 45 67.851 -6.594 -13.869 1.00 1.00 C ATOM 637 CD2 PHE A 45 66.806 -8.609 -13.016 1.00 1.00 C ATOM 638 CE1 PHE A 45 67.448 -6.934 -15.167 1.00 1.00 C ATOM 639 CE2 PHE A 45 66.397 -8.949 -14.312 1.00 1.00 C ATOM 640 CZ PHE A 45 66.720 -8.111 -15.388 1.00 1.00 C ATOM 0 H PHE A 45 65.243 -5.815 -12.082 1.00 1.00 H new ATOM 0 HA PHE A 45 66.859 -6.288 -9.720 1.00 1.00 H new ATOM 0 HB2 PHE A 45 68.908 -6.549 -11.411 1.00 1.00 H new ATOM 0 HB3 PHE A 45 68.058 -7.947 -10.784 1.00 1.00 H new ATOM 0 HD1 PHE A 45 68.408 -5.685 -13.697 1.00 1.00 H new ATOM 0 HD2 PHE A 45 66.561 -9.255 -12.185 1.00 1.00 H new ATOM 0 HE1 PHE A 45 67.698 -6.290 -15.997 1.00 1.00 H new ATOM 0 HE2 PHE A 45 65.834 -9.855 -14.482 1.00 1.00 H new ATOM 0 HZ PHE A 45 66.408 -8.372 -16.388 1.00 1.00 H new ATOM 650 N PHE A 46 68.139 -4.130 -10.323 1.00 1.00 N ATOM 651 CA PHE A 46 68.628 -2.728 -10.436 1.00 1.00 C ATOM 652 C PHE A 46 68.666 -2.092 -9.065 1.00 1.00 C ATOM 653 O PHE A 46 67.644 -1.552 -8.649 1.00 1.00 O ATOM 654 CB PHE A 46 67.762 -1.791 -11.364 1.00 1.00 C ATOM 655 CG PHE A 46 68.515 -1.476 -12.646 1.00 1.00 C ATOM 656 CD1 PHE A 46 69.482 -0.460 -12.641 1.00 1.00 C ATOM 657 CD2 PHE A 46 68.257 -2.189 -13.826 1.00 1.00 C ATOM 658 CE1 PHE A 46 70.190 -0.158 -13.813 1.00 1.00 C ATOM 659 CE2 PHE A 46 68.967 -1.883 -14.997 1.00 1.00 C ATOM 660 CZ PHE A 46 69.932 -0.868 -14.990 1.00 1.00 C ATOM 0 H PHE A 46 68.610 -4.656 -9.587 1.00 1.00 H new ATOM 0 HA PHE A 46 69.614 -2.813 -10.893 1.00 1.00 H new ATOM 0 HB2 PHE A 46 66.815 -2.277 -11.600 1.00 1.00 H new ATOM 0 HB3 PHE A 46 67.524 -0.867 -10.838 1.00 1.00 H new ATOM 0 HD1 PHE A 46 69.681 0.090 -11.733 1.00 1.00 H new ATOM 0 HD2 PHE A 46 67.513 -2.972 -13.833 1.00 1.00 H new ATOM 0 HE1 PHE A 46 70.935 0.624 -13.807 1.00 1.00 H new ATOM 0 HE2 PHE A 46 68.769 -2.432 -15.906 1.00 1.00 H new ATOM 0 HZ PHE A 46 70.476 -0.634 -15.893 1.00 1.00 H new ATOM 670 N ARG A 47 69.837 -2.133 -8.391 1.00 1.00 N ATOM 671 CA ARG A 47 70.025 -1.517 -7.058 1.00 1.00 C ATOM 672 C ARG A 47 70.246 -2.562 -5.984 1.00 1.00 C ATOM 673 O ARG A 47 69.650 -3.635 -6.031 1.00 1.00 O ATOM 674 CB ARG A 47 68.829 -0.644 -6.644 1.00 1.00 C ATOM 675 CG ARG A 47 69.030 -0.131 -5.216 1.00 1.00 C ATOM 676 CD ARG A 47 68.020 0.990 -4.884 1.00 1.00 C ATOM 677 NE ARG A 47 68.735 2.164 -4.410 1.00 1.00 N ATOM 678 CZ ARG A 47 69.480 2.900 -5.229 1.00 1.00 C ATOM 679 NH1 ARG A 47 69.536 2.611 -6.499 1.00 1.00 N ATOM 680 NH2 ARG A 47 70.141 3.921 -4.764 1.00 1.00 N ATOM 0 H ARG A 47 70.674 -2.591 -8.753 1.00 1.00 H new ATOM 0 HA ARG A 47 70.911 -0.889 -7.149 1.00 1.00 H new ATOM 0 HB2 ARG A 47 68.726 0.196 -7.331 1.00 1.00 H new ATOM 0 HB3 ARG A 47 67.907 -1.222 -6.706 1.00 1.00 H new ATOM 0 HG2 ARG A 47 68.911 -0.953 -4.510 1.00 1.00 H new ATOM 0 HG3 ARG A 47 70.047 0.244 -5.100 1.00 1.00 H new ATOM 0 HD2 ARG A 47 67.435 1.240 -5.769 1.00 1.00 H new ATOM 0 HD3 ARG A 47 67.318 0.648 -4.124 1.00 1.00 H new ATOM 0 HE ARG A 47 68.663 2.429 -3.428 1.00 1.00 H new ATOM 0 HH11 ARG A 47 69.008 1.819 -6.866 1.00 1.00 H new ATOM 0 HH12 ARG A 47 70.108 3.177 -7.126 1.00 1.00 H new ATOM 0 HH21 ARG A 47 70.087 4.155 -3.773 1.00 1.00 H new ATOM 0 HH22 ARG A 47 70.713 4.487 -5.391 1.00 1.00 H new ATOM 694 N CYS A 48 71.119 -2.227 -5.031 1.00 1.00 N ATOM 695 CA CYS A 48 71.431 -3.115 -3.918 1.00 1.00 C ATOM 696 C CYS A 48 72.157 -4.351 -4.410 1.00 1.00 C ATOM 697 O CYS A 48 71.579 -5.424 -4.469 1.00 1.00 O ATOM 698 CB CYS A 48 70.134 -3.510 -3.183 1.00 1.00 C ATOM 699 SG CYS A 48 70.495 -4.746 -1.916 1.00 1.00 S ATOM 0 H CYS A 48 71.623 -1.340 -5.012 1.00 1.00 H new ATOM 0 HA CYS A 48 72.086 -2.589 -3.223 1.00 1.00 H new ATOM 0 HB2 CYS A 48 69.683 -2.629 -2.726 1.00 1.00 H new ATOM 0 HB3 CYS A 48 69.409 -3.907 -3.894 1.00 1.00 H new ATOM 0 HG CYS A 48 71.189 -5.713 -2.439 1.00 1.00 H new ATOM 704 N ASN A 49 73.432 -4.207 -4.790 1.00 1.00 N ATOM 705 CA ASN A 49 74.211 -5.338 -5.296 1.00 1.00 C ATOM 706 C ASN A 49 75.617 -5.322 -4.677 1.00 1.00 C ATOM 707 O ASN A 49 76.094 -4.261 -4.291 1.00 1.00 O ATOM 708 CB ASN A 49 74.327 -5.196 -6.817 1.00 1.00 C ATOM 709 CG ASN A 49 74.850 -3.806 -7.177 1.00 1.00 C ATOM 710 OD1 ASN A 49 74.233 -3.101 -7.978 1.00 1.00 O ATOM 711 ND2 ASN A 49 75.958 -3.373 -6.641 1.00 1.00 N ATOM 0 H ASN A 49 73.941 -3.324 -4.756 1.00 1.00 H new ATOM 0 HA ASN A 49 73.720 -6.275 -5.035 1.00 1.00 H new ATOM 0 HB2 ASN A 49 74.999 -5.959 -7.211 1.00 1.00 H new ATOM 0 HB3 ASN A 49 73.354 -5.358 -7.280 1.00 1.00 H new ATOM 0 HD21 ASN A 49 76.315 -2.449 -6.885 1.00 1.00 H new ATOM 0 HD22 ASN A 49 76.467 -3.958 -5.978 1.00 1.00 H new ATOM 718 N PRO A 50 76.274 -6.458 -4.569 1.00 1.00 N ATOM 719 CA PRO A 50 77.660 -6.559 -3.979 1.00 1.00 C ATOM 720 C PRO A 50 78.708 -5.700 -4.718 1.00 1.00 C ATOM 721 O PRO A 50 79.727 -6.211 -5.182 1.00 1.00 O ATOM 722 CB PRO A 50 77.982 -8.072 -4.083 1.00 1.00 C ATOM 723 CG PRO A 50 77.056 -8.589 -5.132 1.00 1.00 C ATOM 724 CD PRO A 50 75.778 -7.788 -4.975 1.00 1.00 C ATOM 0 HA PRO A 50 77.694 -6.175 -2.959 1.00 1.00 H new ATOM 0 HB2 PRO A 50 79.024 -8.236 -4.359 1.00 1.00 H new ATOM 0 HB3 PRO A 50 77.821 -8.577 -3.130 1.00 1.00 H new ATOM 0 HG2 PRO A 50 77.480 -8.460 -6.128 1.00 1.00 H new ATOM 0 HG3 PRO A 50 76.870 -9.655 -5.000 1.00 1.00 H new ATOM 0 HD2 PRO A 50 75.212 -7.742 -5.906 1.00 1.00 H new ATOM 0 HD3 PRO A 50 75.119 -8.221 -4.223 1.00 1.00 H new ATOM 732 N GLU A 51 78.439 -4.391 -4.810 1.00 1.00 N ATOM 733 CA GLU A 51 79.336 -3.438 -5.479 1.00 1.00 C ATOM 734 C GLU A 51 79.474 -3.733 -6.967 1.00 1.00 C ATOM 735 O GLU A 51 79.602 -2.817 -7.779 1.00 1.00 O ATOM 736 CB GLU A 51 80.727 -3.443 -4.838 1.00 1.00 C ATOM 737 CG GLU A 51 80.659 -2.819 -3.445 1.00 1.00 C ATOM 738 CD GLU A 51 81.975 -3.050 -2.716 1.00 1.00 C ATOM 739 OE1 GLU A 51 82.373 -4.198 -2.618 1.00 1.00 O ATOM 740 OE2 GLU A 51 82.573 -2.079 -2.283 1.00 1.00 O ATOM 0 H GLU A 51 77.597 -3.964 -4.425 1.00 1.00 H new ATOM 0 HA GLU A 51 78.884 -2.454 -5.359 1.00 1.00 H new ATOM 0 HB2 GLU A 51 81.102 -4.464 -4.771 1.00 1.00 H new ATOM 0 HB3 GLU A 51 81.427 -2.886 -5.462 1.00 1.00 H new ATOM 0 HG2 GLU A 51 80.458 -1.751 -3.524 1.00 1.00 H new ATOM 0 HG3 GLU A 51 79.837 -3.257 -2.879 1.00 1.00 H new ATOM 747 N ARG A 52 79.442 -5.008 -7.327 1.00 1.00 N ATOM 748 CA ARG A 52 79.559 -5.390 -8.722 1.00 1.00 C ATOM 749 C ARG A 52 78.654 -4.510 -9.569 1.00 1.00 C ATOM 750 O ARG A 52 77.516 -4.233 -9.191 1.00 1.00 O ATOM 751 CB ARG A 52 79.174 -6.865 -8.873 1.00 1.00 C ATOM 752 CG ARG A 52 80.328 -7.747 -8.384 1.00 1.00 C ATOM 753 CD ARG A 52 79.860 -9.201 -8.258 1.00 1.00 C ATOM 754 NE ARG A 52 80.991 -10.072 -7.951 1.00 1.00 N ATOM 755 CZ ARG A 52 81.484 -10.169 -6.717 1.00 1.00 C ATOM 756 NH1 ARG A 52 80.973 -9.462 -5.745 1.00 1.00 N ATOM 757 NH2 ARG A 52 82.486 -10.970 -6.480 1.00 1.00 N ATOM 0 H ARG A 52 79.337 -5.787 -6.677 1.00 1.00 H new ATOM 0 HA ARG A 52 80.586 -5.256 -9.061 1.00 1.00 H new ATOM 0 HB2 ARG A 52 78.272 -7.077 -8.299 1.00 1.00 H new ATOM 0 HB3 ARG A 52 78.948 -7.088 -9.916 1.00 1.00 H new ATOM 0 HG2 ARG A 52 81.164 -7.685 -9.080 1.00 1.00 H new ATOM 0 HG3 ARG A 52 80.688 -7.387 -7.420 1.00 1.00 H new ATOM 0 HD2 ARG A 52 79.107 -9.281 -7.474 1.00 1.00 H new ATOM 0 HD3 ARG A 52 79.388 -9.520 -9.187 1.00 1.00 H new ATOM 0 HE ARG A 52 81.414 -10.620 -8.700 1.00 1.00 H new ATOM 0 HH11 ARG A 52 80.192 -8.832 -5.929 1.00 1.00 H new ATOM 0 HH12 ARG A 52 81.354 -9.540 -4.802 1.00 1.00 H new ATOM 0 HH21 ARG A 52 82.890 -11.520 -7.238 1.00 1.00 H new ATOM 0 HH22 ARG A 52 82.866 -11.046 -5.536 1.00 1.00 H new ATOM 771 N ILE A 53 79.169 -4.045 -10.703 1.00 1.00 N ATOM 772 CA ILE A 53 78.398 -3.172 -11.573 1.00 1.00 C ATOM 773 C ILE A 53 77.029 -3.781 -11.823 1.00 1.00 C ATOM 774 O ILE A 53 76.916 -4.936 -12.224 1.00 1.00 O ATOM 775 CB ILE A 53 79.160 -2.991 -12.893 1.00 1.00 C ATOM 776 CG1 ILE A 53 78.418 -2.009 -13.835 1.00 1.00 C ATOM 777 CG2 ILE A 53 79.304 -4.352 -13.586 1.00 1.00 C ATOM 778 CD1 ILE A 53 78.807 -0.568 -13.506 1.00 1.00 C ATOM 0 H ILE A 53 80.109 -4.257 -11.037 1.00 1.00 H new ATOM 0 HA ILE A 53 78.260 -2.198 -11.103 1.00 1.00 H new ATOM 0 HB ILE A 53 80.143 -2.576 -12.670 1.00 1.00 H new ATOM 0 HG12 ILE A 53 78.665 -2.232 -14.873 1.00 1.00 H new ATOM 0 HG13 ILE A 53 77.341 -2.136 -13.729 1.00 1.00 H new ATOM 0 HG21 ILE A 53 79.845 -4.227 -14.524 1.00 1.00 H new ATOM 0 HG22 ILE A 53 79.854 -5.034 -12.938 1.00 1.00 H new ATOM 0 HG23 ILE A 53 78.315 -4.763 -13.789 1.00 1.00 H new ATOM 0 HD11 ILE A 53 78.280 0.113 -14.174 1.00 1.00 H new ATOM 0 HD12 ILE A 53 78.537 -0.345 -12.474 1.00 1.00 H new ATOM 0 HD13 ILE A 53 79.882 -0.443 -13.635 1.00 1.00 H new ATOM 790 N GLN A 54 76.001 -2.999 -11.539 1.00 1.00 N ATOM 791 CA GLN A 54 74.639 -3.496 -11.685 1.00 1.00 C ATOM 792 C GLN A 54 74.430 -3.969 -13.132 1.00 1.00 C ATOM 793 O GLN A 54 73.840 -3.278 -13.965 1.00 1.00 O ATOM 794 CB GLN A 54 73.685 -2.338 -11.346 1.00 1.00 C ATOM 795 CG GLN A 54 72.421 -2.861 -10.687 1.00 1.00 C ATOM 796 CD GLN A 54 71.805 -3.960 -11.546 1.00 1.00 C ATOM 797 OE1 GLN A 54 71.163 -3.641 -12.634 1.00 1.00 O flip ATOM 798 NE2 GLN A 54 71.924 -5.141 -11.221 1.00 1.00 N flip ATOM 0 H GLN A 54 76.077 -2.036 -11.212 1.00 1.00 H new ATOM 0 HA GLN A 54 74.448 -4.338 -11.020 1.00 1.00 H new ATOM 0 HB2 GLN A 54 74.183 -1.633 -10.681 1.00 1.00 H new ATOM 0 HB3 GLN A 54 73.429 -1.793 -12.255 1.00 1.00 H new ATOM 0 HG2 GLN A 54 72.651 -3.249 -9.695 1.00 1.00 H new ATOM 0 HG3 GLN A 54 71.707 -2.048 -10.554 1.00 1.00 H new ATOM 0 HE21 GLN A 54 72.427 -5.387 -10.369 1.00 1.00 H new ATOM 0 HE22 GLN A 54 71.519 -5.874 -11.804 1.00 1.00 H new ATOM 807 N ILE A 55 74.914 -5.189 -13.397 1.00 1.00 N ATOM 808 CA ILE A 55 74.780 -5.816 -14.706 1.00 1.00 C ATOM 809 C ILE A 55 74.837 -7.343 -14.604 1.00 1.00 C ATOM 810 O ILE A 55 75.296 -7.896 -13.604 1.00 1.00 O ATOM 811 CB ILE A 55 75.862 -5.302 -15.675 1.00 1.00 C ATOM 812 CG1 ILE A 55 75.287 -5.268 -17.099 1.00 1.00 C ATOM 813 CG2 ILE A 55 77.092 -6.228 -15.653 1.00 1.00 C ATOM 814 CD1 ILE A 55 76.373 -4.834 -18.076 1.00 1.00 C ATOM 0 H ILE A 55 75.406 -5.761 -12.711 1.00 1.00 H new ATOM 0 HA ILE A 55 73.802 -5.542 -15.101 1.00 1.00 H new ATOM 0 HB ILE A 55 76.166 -4.302 -15.364 1.00 1.00 H new ATOM 0 HG12 ILE A 55 74.909 -6.253 -17.373 1.00 1.00 H new ATOM 0 HG13 ILE A 55 74.444 -4.578 -17.146 1.00 1.00 H new ATOM 0 HG21 ILE A 55 77.845 -5.849 -16.344 1.00 1.00 H new ATOM 0 HG22 ILE A 55 77.506 -6.259 -14.645 1.00 1.00 H new ATOM 0 HG23 ILE A 55 76.796 -7.233 -15.955 1.00 1.00 H new ATOM 0 HD11 ILE A 55 75.965 -4.810 -19.086 1.00 1.00 H new ATOM 0 HD12 ILE A 55 76.730 -3.840 -17.805 1.00 1.00 H new ATOM 0 HD13 ILE A 55 77.202 -5.541 -18.036 1.00 1.00 H new ATOM 826 N GLY A 56 74.421 -8.012 -15.673 1.00 1.00 N ATOM 827 CA GLY A 56 74.478 -9.466 -15.759 1.00 1.00 C ATOM 828 C GLY A 56 73.111 -10.101 -15.605 1.00 1.00 C ATOM 829 O GLY A 56 72.875 -11.180 -16.136 1.00 1.00 O ATOM 0 H GLY A 56 74.035 -7.562 -16.503 1.00 1.00 H new ATOM 0 HA2 GLY A 56 74.905 -9.755 -16.719 1.00 1.00 H new ATOM 0 HA3 GLY A 56 75.144 -9.848 -14.985 1.00 1.00 H new ATOM 833 N ASP A 57 72.207 -9.463 -14.876 1.00 1.00 N ATOM 834 CA ASP A 57 70.882 -10.038 -14.670 1.00 1.00 C ATOM 835 C ASP A 57 70.194 -10.426 -15.989 1.00 1.00 C ATOM 836 O ASP A 57 69.911 -9.583 -16.837 1.00 1.00 O ATOM 837 CB ASP A 57 70.008 -9.026 -13.908 1.00 1.00 C ATOM 838 CG ASP A 57 70.886 -8.120 -13.047 1.00 1.00 C ATOM 839 OD1 ASP A 57 71.297 -8.563 -11.987 1.00 1.00 O ATOM 840 OD2 ASP A 57 71.145 -7.009 -13.473 1.00 1.00 O ATOM 0 H ASP A 57 72.360 -8.562 -14.423 1.00 1.00 H new ATOM 0 HA ASP A 57 71.005 -10.954 -14.092 1.00 1.00 H new ATOM 0 HB2 ASP A 57 69.434 -8.426 -14.614 1.00 1.00 H new ATOM 0 HB3 ASP A 57 69.290 -9.554 -13.280 1.00 1.00 H new ATOM 845 N TRP A 58 69.927 -11.705 -16.136 1.00 1.00 N ATOM 846 CA TRP A 58 69.256 -12.201 -17.316 1.00 1.00 C ATOM 847 C TRP A 58 67.721 -11.964 -17.227 1.00 1.00 C ATOM 848 O TRP A 58 67.146 -11.499 -16.237 1.00 1.00 O ATOM 849 CB TRP A 58 69.550 -13.703 -17.501 1.00 1.00 C ATOM 850 CG TRP A 58 70.969 -13.934 -17.966 1.00 1.00 C ATOM 851 CD1 TRP A 58 72.072 -13.700 -17.216 1.00 1.00 C ATOM 852 CD2 TRP A 58 71.461 -14.482 -19.241 1.00 1.00 C ATOM 853 NE1 TRP A 58 73.200 -14.049 -17.942 1.00 1.00 N ATOM 854 CE2 TRP A 58 72.879 -14.537 -19.189 1.00 1.00 C ATOM 855 CE3 TRP A 58 70.831 -14.926 -20.422 1.00 1.00 C ATOM 856 CZ2 TRP A 58 73.638 -15.014 -20.259 1.00 1.00 C ATOM 857 CZ3 TRP A 58 71.597 -15.407 -21.503 1.00 1.00 C ATOM 858 CH2 TRP A 58 72.995 -15.452 -21.419 1.00 1.00 C ATOM 0 H TRP A 58 70.165 -12.422 -15.451 1.00 1.00 H new ATOM 0 HA TRP A 58 69.636 -11.653 -18.178 1.00 1.00 H new ATOM 0 HB2 TRP A 58 69.384 -14.226 -16.559 1.00 1.00 H new ATOM 0 HB3 TRP A 58 68.855 -14.125 -18.227 1.00 1.00 H new ATOM 0 HD1 TRP A 58 72.073 -13.304 -16.211 1.00 1.00 H new ATOM 0 HE1 TRP A 58 74.154 -13.955 -17.594 1.00 1.00 H new ATOM 0 HE3 TRP A 58 69.754 -14.897 -20.499 1.00 1.00 H new ATOM 0 HZ2 TRP A 58 74.715 -15.044 -20.190 1.00 1.00 H new ATOM 0 HZ3 TRP A 58 71.103 -15.743 -22.403 1.00 1.00 H new ATOM 0 HH2 TRP A 58 73.575 -15.825 -22.250 1.00 1.00 H new ATOM 869 N ARG A 59 67.156 -12.180 -18.373 1.00 1.00 N ATOM 870 CA ARG A 59 65.676 -11.951 -18.561 1.00 1.00 C ATOM 871 C ARG A 59 64.820 -13.181 -18.164 1.00 1.00 C ATOM 872 O ARG A 59 64.023 -13.135 -17.222 1.00 1.00 O ATOM 873 CB ARG A 59 65.327 -11.522 -20.005 1.00 1.00 C ATOM 874 CG ARG A 59 66.573 -10.941 -20.689 1.00 1.00 C ATOM 875 CD ARG A 59 67.367 -12.070 -21.347 1.00 1.00 C ATOM 876 NE ARG A 59 66.795 -12.353 -22.657 1.00 1.00 N ATOM 877 CZ ARG A 59 67.258 -13.338 -23.414 1.00 1.00 C ATOM 878 NH1 ARG A 59 68.205 -14.116 -22.968 1.00 1.00 N ATOM 879 NH2 ARG A 59 66.751 -13.532 -24.600 1.00 1.00 N ATOM 0 H ARG A 59 67.647 -12.508 -19.204 1.00 1.00 H new ATOM 0 HA ARG A 59 65.428 -11.134 -17.884 1.00 1.00 H new ATOM 0 HB2 ARG A 59 64.957 -12.378 -20.569 1.00 1.00 H new ATOM 0 HB3 ARG A 59 64.529 -10.780 -19.991 1.00 1.00 H new ATOM 0 HG2 ARG A 59 66.280 -10.204 -21.437 1.00 1.00 H new ATOM 0 HG3 ARG A 59 67.194 -10.423 -19.958 1.00 1.00 H new ATOM 0 HD2 ARG A 59 68.414 -11.785 -21.447 1.00 1.00 H new ATOM 0 HD3 ARG A 59 67.338 -12.963 -20.723 1.00 1.00 H new ATOM 0 HE ARG A 59 66.022 -11.781 -22.999 1.00 1.00 H new ATOM 0 HH11 ARG A 59 68.591 -13.967 -22.035 1.00 1.00 H new ATOM 0 HH12 ARG A 59 68.560 -14.873 -23.552 1.00 1.00 H new ATOM 0 HH21 ARG A 59 66.003 -12.928 -24.940 1.00 1.00 H new ATOM 0 HH22 ARG A 59 67.103 -14.288 -25.188 1.00 1.00 H new ATOM 893 N TYR A 60 65.003 -14.261 -18.888 1.00 1.00 N ATOM 894 CA TYR A 60 64.271 -15.527 -18.641 1.00 1.00 C ATOM 895 C TYR A 60 64.971 -16.442 -17.621 1.00 1.00 C ATOM 896 O TYR A 60 64.366 -17.375 -17.060 1.00 1.00 O ATOM 897 CB TYR A 60 64.054 -16.273 -19.966 1.00 1.00 C ATOM 898 CG TYR A 60 63.781 -17.742 -19.691 1.00 1.00 C ATOM 899 CD1 TYR A 60 62.498 -18.172 -19.322 1.00 1.00 C ATOM 900 CD2 TYR A 60 64.825 -18.667 -19.791 1.00 1.00 C ATOM 901 CE1 TYR A 60 62.266 -19.530 -19.059 1.00 1.00 C ATOM 902 CE2 TYR A 60 64.595 -20.017 -19.528 1.00 1.00 C ATOM 903 CZ TYR A 60 63.317 -20.451 -19.162 1.00 1.00 C ATOM 904 OH TYR A 60 63.089 -21.788 -18.905 1.00 1.00 O ATOM 0 H TYR A 60 65.658 -14.309 -19.669 1.00 1.00 H new ATOM 0 HA TYR A 60 63.309 -15.257 -18.205 1.00 1.00 H new ATOM 0 HB2 TYR A 60 63.217 -15.833 -20.508 1.00 1.00 H new ATOM 0 HB3 TYR A 60 64.934 -16.170 -20.600 1.00 1.00 H new ATOM 0 HD1 TYR A 60 61.691 -17.459 -19.241 1.00 1.00 H new ATOM 0 HD2 TYR A 60 65.813 -18.335 -20.073 1.00 1.00 H new ATOM 0 HE1 TYR A 60 61.279 -19.865 -18.778 1.00 1.00 H new ATOM 0 HE2 TYR A 60 65.404 -20.728 -19.607 1.00 1.00 H new ATOM 0 HH TYR A 60 63.922 -22.290 -19.023 1.00 1.00 H new ATOM 914 N GLU A 61 66.231 -16.181 -17.360 1.00 1.00 N ATOM 915 CA GLU A 61 66.980 -16.977 -16.418 1.00 1.00 C ATOM 916 C GLU A 61 66.640 -16.548 -15.005 1.00 1.00 C ATOM 917 O GLU A 61 67.022 -17.193 -14.054 1.00 1.00 O ATOM 918 CB GLU A 61 68.483 -16.790 -16.674 1.00 1.00 C ATOM 919 CG GLU A 61 69.267 -18.053 -16.335 1.00 1.00 C ATOM 920 CD GLU A 61 70.731 -17.859 -16.720 1.00 1.00 C ATOM 921 OE1 GLU A 61 71.403 -17.097 -16.044 1.00 1.00 O ATOM 922 OE2 GLU A 61 71.155 -18.465 -17.690 1.00 1.00 O ATOM 0 H GLU A 61 66.759 -15.421 -17.789 1.00 1.00 H new ATOM 0 HA GLU A 61 66.722 -18.029 -16.542 1.00 1.00 H new ATOM 0 HB2 GLU A 61 68.646 -16.529 -17.720 1.00 1.00 H new ATOM 0 HB3 GLU A 61 68.855 -15.958 -16.076 1.00 1.00 H new ATOM 0 HG2 GLU A 61 69.185 -18.270 -15.270 1.00 1.00 H new ATOM 0 HG3 GLU A 61 68.850 -18.907 -16.868 1.00 1.00 H new ATOM 929 N VAL A 62 65.977 -15.417 -14.861 1.00 1.00 N ATOM 930 CA VAL A 62 65.690 -14.900 -13.519 1.00 1.00 C ATOM 931 C VAL A 62 65.186 -16.000 -12.633 1.00 1.00 C ATOM 932 O VAL A 62 65.702 -16.202 -11.542 1.00 1.00 O ATOM 933 CB VAL A 62 64.637 -13.777 -13.562 1.00 1.00 C ATOM 934 CG1 VAL A 62 65.267 -12.536 -14.167 1.00 1.00 C ATOM 935 CG2 VAL A 62 63.426 -14.194 -14.412 1.00 1.00 C ATOM 0 H VAL A 62 65.630 -14.844 -15.630 1.00 1.00 H new ATOM 0 HA VAL A 62 66.621 -14.497 -13.121 1.00 1.00 H new ATOM 0 HB VAL A 62 64.295 -13.576 -12.547 1.00 1.00 H new ATOM 0 HG11 VAL A 62 64.530 -11.734 -14.202 1.00 1.00 H new ATOM 0 HG12 VAL A 62 66.114 -12.223 -13.556 1.00 1.00 H new ATOM 0 HG13 VAL A 62 65.610 -12.758 -15.177 1.00 1.00 H new ATOM 0 HG21 VAL A 62 62.696 -13.385 -14.427 1.00 1.00 H new ATOM 0 HG22 VAL A 62 63.752 -14.408 -15.430 1.00 1.00 H new ATOM 0 HG23 VAL A 62 62.970 -15.086 -13.982 1.00 1.00 H new ATOM 945 N ALA A 63 64.193 -16.722 -13.085 1.00 1.00 N ATOM 946 CA ALA A 63 63.673 -17.786 -12.291 1.00 1.00 C ATOM 947 C ALA A 63 64.704 -18.886 -12.192 1.00 1.00 C ATOM 948 O ALA A 63 65.015 -19.360 -11.096 1.00 1.00 O ATOM 949 CB ALA A 63 62.396 -18.323 -12.940 1.00 1.00 C ATOM 0 H ALA A 63 63.738 -16.589 -13.988 1.00 1.00 H new ATOM 0 HA ALA A 63 63.441 -17.422 -11.290 1.00 1.00 H new ATOM 0 HB1 ALA A 63 61.995 -19.137 -12.336 1.00 1.00 H new ATOM 0 HB2 ALA A 63 61.658 -17.524 -13.007 1.00 1.00 H new ATOM 0 HB3 ALA A 63 62.623 -18.692 -13.940 1.00 1.00 H new ATOM 955 N HIS A 64 65.257 -19.260 -13.353 1.00 1.00 N ATOM 956 CA HIS A 64 66.265 -20.324 -13.385 1.00 1.00 C ATOM 957 C HIS A 64 67.446 -19.974 -12.453 1.00 1.00 C ATOM 958 O HIS A 64 67.724 -20.672 -11.467 1.00 1.00 O ATOM 959 CB HIS A 64 66.735 -20.500 -14.842 1.00 1.00 C ATOM 960 CG HIS A 64 67.068 -21.938 -15.120 1.00 1.00 C ATOM 961 ND1 HIS A 64 68.368 -22.369 -15.319 1.00 1.00 N ATOM 962 CD2 HIS A 64 66.277 -23.053 -15.236 1.00 1.00 C ATOM 963 CE1 HIS A 64 68.323 -23.694 -15.546 1.00 1.00 C ATOM 964 NE2 HIS A 64 67.073 -24.162 -15.506 1.00 1.00 N ATOM 0 H HIS A 64 65.030 -18.853 -14.260 1.00 1.00 H new ATOM 0 HA HIS A 64 65.838 -21.261 -13.027 1.00 1.00 H new ATOM 0 HB2 HIS A 64 65.955 -20.163 -15.525 1.00 1.00 H new ATOM 0 HB3 HIS A 64 67.610 -19.876 -15.025 1.00 1.00 H new ATOM 0 HD2 HIS A 64 65.202 -23.068 -15.134 1.00 1.00 H new ATOM 0 HE1 HIS A 64 69.193 -24.305 -15.737 1.00 1.00 H new ATOM 0 HE2 HIS A 64 66.767 -25.125 -15.644 1.00 1.00 H new ATOM 972 N ASP A 65 68.097 -18.855 -12.728 1.00 1.00 N ATOM 973 CA ASP A 65 69.201 -18.392 -11.891 1.00 1.00 C ATOM 974 C ASP A 65 68.658 -17.933 -10.515 1.00 1.00 C ATOM 975 O ASP A 65 69.054 -18.439 -9.447 1.00 1.00 O ATOM 976 CB ASP A 65 69.920 -17.214 -12.606 1.00 1.00 C ATOM 977 CG ASP A 65 71.155 -17.703 -13.366 1.00 1.00 C ATOM 978 OD1 ASP A 65 71.086 -18.772 -13.952 1.00 1.00 O ATOM 979 OD2 ASP A 65 72.153 -17.001 -13.347 1.00 1.00 O ATOM 0 H ASP A 65 67.884 -18.250 -13.521 1.00 1.00 H new ATOM 0 HA ASP A 65 69.910 -19.204 -11.732 1.00 1.00 H new ATOM 0 HB2 ASP A 65 69.231 -16.730 -13.298 1.00 1.00 H new ATOM 0 HB3 ASP A 65 70.214 -16.464 -11.872 1.00 1.00 H new ATOM 984 N GLY A 66 67.707 -17.005 -10.515 1.00 1.00 N ATOM 985 CA GLY A 66 67.116 -16.524 -9.272 1.00 1.00 C ATOM 986 C GLY A 66 66.299 -17.620 -8.587 1.00 1.00 C ATOM 987 O GLY A 66 65.315 -17.347 -7.910 1.00 1.00 O ATOM 0 H GLY A 66 67.330 -16.572 -11.358 1.00 1.00 H new ATOM 0 HA2 GLY A 66 67.903 -16.181 -8.601 1.00 1.00 H new ATOM 0 HA3 GLY A 66 66.477 -15.666 -9.479 1.00 1.00 H new ATOM 991 N ARG A 67 66.747 -18.853 -8.737 1.00 1.00 N ATOM 992 CA ARG A 67 66.118 -19.991 -8.097 1.00 1.00 C ATOM 993 C ARG A 67 66.537 -20.027 -6.639 1.00 1.00 C ATOM 994 O ARG A 67 66.248 -21.014 -5.957 1.00 1.00 O ATOM 995 CB ARG A 67 66.453 -21.339 -8.761 1.00 1.00 C ATOM 996 CG ARG A 67 65.376 -21.778 -9.773 1.00 1.00 C ATOM 997 CD ARG A 67 65.338 -23.317 -9.904 1.00 1.00 C ATOM 998 NE ARG A 67 66.047 -23.721 -11.110 1.00 1.00 N ATOM 999 CZ ARG A 67 65.627 -24.740 -11.852 1.00 1.00 C ATOM 1000 NH1 ARG A 67 64.589 -25.445 -11.478 1.00 1.00 N ATOM 1001 NH2 ARG A 67 66.262 -25.046 -12.944 1.00 1.00 N ATOM 0 H ARG A 67 67.558 -19.093 -9.307 1.00 1.00 H new ATOM 0 HA ARG A 67 65.041 -19.859 -8.199 1.00 1.00 H new ATOM 0 HB2 ARG A 67 67.415 -21.262 -9.268 1.00 1.00 H new ATOM 0 HB3 ARG A 67 66.558 -22.104 -7.992 1.00 1.00 H new ATOM 0 HG2 ARG A 67 64.400 -21.412 -9.454 1.00 1.00 H new ATOM 0 HG3 ARG A 67 65.581 -21.331 -10.746 1.00 1.00 H new ATOM 0 HD2 ARG A 67 65.796 -23.778 -9.029 1.00 1.00 H new ATOM 0 HD3 ARG A 67 64.305 -23.664 -9.943 1.00 1.00 H new ATOM 0 HE ARG A 67 66.884 -23.211 -11.391 1.00 1.00 H new ATOM 0 HH11 ARG A 67 64.099 -25.213 -10.614 1.00 1.00 H new ATOM 0 HH12 ARG A 67 64.270 -26.226 -12.051 1.00 1.00 H new ATOM 0 HH21 ARG A 67 67.079 -24.505 -13.228 1.00 1.00 H new ATOM 0 HH22 ARG A 67 65.944 -25.827 -13.517 1.00 1.00 H new ATOM 1015 N LEU A 68 67.272 -18.989 -6.177 1.00 1.00 N ATOM 1016 CA LEU A 68 67.764 -18.967 -4.774 1.00 1.00 C ATOM 1017 C LEU A 68 66.728 -19.675 -3.891 1.00 1.00 C ATOM 1018 O LEU A 68 67.055 -20.273 -2.879 1.00 1.00 O ATOM 1019 CB LEU A 68 67.951 -17.525 -4.224 1.00 1.00 C ATOM 1020 CG LEU A 68 66.690 -16.666 -4.508 1.00 1.00 C ATOM 1021 CD1 LEU A 68 66.390 -15.726 -3.331 1.00 1.00 C ATOM 1022 CD2 LEU A 68 66.909 -15.830 -5.766 1.00 1.00 C ATOM 0 H LEU A 68 67.533 -18.176 -6.734 1.00 1.00 H new ATOM 0 HA LEU A 68 68.735 -19.462 -4.758 1.00 1.00 H new ATOM 0 HB2 LEU A 68 68.140 -17.561 -3.151 1.00 1.00 H new ATOM 0 HB3 LEU A 68 68.824 -17.064 -4.686 1.00 1.00 H new ATOM 0 HG LEU A 68 65.845 -17.340 -4.647 1.00 1.00 H new ATOM 0 HD11 LEU A 68 65.502 -15.135 -3.555 1.00 1.00 H new ATOM 0 HD12 LEU A 68 66.217 -16.315 -2.430 1.00 1.00 H new ATOM 0 HD13 LEU A 68 67.238 -15.060 -3.172 1.00 1.00 H new ATOM 0 HD21 LEU A 68 66.022 -15.228 -5.962 1.00 1.00 H new ATOM 0 HD22 LEU A 68 67.768 -15.174 -5.622 1.00 1.00 H new ATOM 0 HD23 LEU A 68 67.095 -16.490 -6.614 1.00 1.00 H new ATOM 1034 N LEU A 69 65.459 -19.638 -4.298 1.00 1.00 N ATOM 1035 CA LEU A 69 64.460 -20.363 -3.502 1.00 1.00 C ATOM 1036 C LEU A 69 64.806 -21.855 -3.585 1.00 1.00 C ATOM 1037 O LEU A 69 65.194 -22.462 -2.583 1.00 1.00 O ATOM 1038 CB LEU A 69 63.035 -20.129 -4.068 1.00 1.00 C ATOM 1039 CG LEU A 69 62.280 -19.066 -3.251 1.00 1.00 C ATOM 1040 CD1 LEU A 69 62.698 -17.661 -3.679 1.00 1.00 C ATOM 1041 CD2 LEU A 69 60.790 -19.236 -3.493 1.00 1.00 C ATOM 0 H LEU A 69 65.109 -19.148 -5.121 1.00 1.00 H new ATOM 0 HA LEU A 69 64.474 -20.011 -2.471 1.00 1.00 H new ATOM 0 HB2 LEU A 69 63.102 -19.812 -5.109 1.00 1.00 H new ATOM 0 HB3 LEU A 69 62.477 -21.065 -4.055 1.00 1.00 H new ATOM 0 HG LEU A 69 62.516 -19.194 -2.194 1.00 1.00 H new ATOM 0 HD11 LEU A 69 62.153 -16.924 -3.090 1.00 1.00 H new ATOM 0 HD12 LEU A 69 63.769 -17.535 -3.518 1.00 1.00 H new ATOM 0 HD13 LEU A 69 62.471 -17.520 -4.736 1.00 1.00 H new ATOM 0 HD21 LEU A 69 60.241 -18.489 -2.920 1.00 1.00 H new ATOM 0 HD22 LEU A 69 60.577 -19.108 -4.554 1.00 1.00 H new ATOM 0 HD23 LEU A 69 60.482 -20.233 -3.179 1.00 1.00 H new ATOM 1053 N ALA A 70 64.708 -22.446 -4.792 1.00 1.00 N ATOM 1054 CA ALA A 70 65.065 -23.861 -4.931 1.00 1.00 C ATOM 1055 C ALA A 70 66.574 -23.917 -4.917 1.00 1.00 C ATOM 1056 O ALA A 70 67.157 -24.302 -3.916 1.00 1.00 O ATOM 1057 CB ALA A 70 64.522 -24.431 -6.246 1.00 1.00 C ATOM 0 H ALA A 70 64.398 -21.985 -5.648 1.00 1.00 H new ATOM 0 HA ALA A 70 64.636 -24.456 -4.125 1.00 1.00 H new ATOM 0 HB1 ALA A 70 64.798 -25.482 -6.329 1.00 1.00 H new ATOM 0 HB2 ALA A 70 63.436 -24.339 -6.261 1.00 1.00 H new ATOM 0 HB3 ALA A 70 64.945 -23.878 -7.085 1.00 1.00 H new ATOM 1063 N ALA A 71 67.191 -23.457 -6.016 1.00 1.00 N ATOM 1064 CA ALA A 71 68.649 -23.358 -6.190 1.00 1.00 C ATOM 1065 C ALA A 71 69.371 -22.800 -4.984 1.00 1.00 C ATOM 1066 O ALA A 71 70.575 -22.556 -5.066 1.00 1.00 O ATOM 1067 CB ALA A 71 68.973 -22.478 -7.391 1.00 1.00 C ATOM 0 H ALA A 71 66.674 -23.134 -6.833 1.00 1.00 H new ATOM 0 HA ALA A 71 68.998 -24.380 -6.338 1.00 1.00 H new ATOM 0 HB1 ALA A 71 70.054 -22.411 -7.512 1.00 1.00 H new ATOM 0 HB2 ALA A 71 68.534 -22.912 -8.289 1.00 1.00 H new ATOM 0 HB3 ALA A 71 68.563 -21.481 -7.232 1.00 1.00 H new ATOM 1073 N HIS A 72 68.644 -22.530 -3.905 1.00 1.00 N ATOM 1074 CA HIS A 72 69.210 -21.918 -2.709 1.00 1.00 C ATOM 1075 C HIS A 72 70.724 -22.058 -2.637 1.00 1.00 C ATOM 1076 O HIS A 72 71.418 -21.050 -2.750 1.00 1.00 O ATOM 1077 CB HIS A 72 68.543 -22.611 -1.506 1.00 1.00 C ATOM 1078 CG HIS A 72 69.036 -24.043 -1.379 1.00 1.00 C ATOM 1079 ND1 HIS A 72 69.283 -25.039 -2.313 1.00 1.00 N flip ATOM 1080 CD2 HIS A 72 69.376 -24.598 -0.156 1.00 1.00 C flip ATOM 1081 CE1 HIS A 72 69.762 -26.174 -1.673 1.00 1.00 C flip ATOM 1082 NE2 HIS A 72 69.799 -25.858 -0.379 1.00 1.00 N flip ATOM 0 H HIS A 72 67.646 -22.729 -3.835 1.00 1.00 H new ATOM 0 HA HIS A 72 69.017 -20.845 -2.718 1.00 1.00 H new ATOM 0 HB2 HIS A 72 68.766 -22.061 -0.592 1.00 1.00 H new ATOM 0 HB3 HIS A 72 67.460 -22.602 -1.628 1.00 1.00 H new ATOM 0 HD1 HIS A 72 69.135 -24.951 -3.318 1.00 1.00 H new ATOM 0 HD2 HIS A 72 69.313 -24.108 0.805 1.00 1.00 H new ATOM 0 HE1 HIS A 72 70.044 -27.112 -2.127 1.00 1.00 H new ATOM 1090 N MET A 73 71.248 -23.256 -2.499 1.00 1.00 N ATOM 1091 CA MET A 73 72.675 -23.431 -2.480 1.00 1.00 C ATOM 1092 C MET A 73 73.212 -23.325 -3.901 1.00 1.00 C ATOM 1093 O MET A 73 74.240 -22.686 -4.137 1.00 1.00 O ATOM 1094 CB MET A 73 73.011 -24.770 -1.837 1.00 1.00 C ATOM 1095 CG MET A 73 72.910 -24.623 -0.318 1.00 1.00 C ATOM 1096 SD MET A 73 73.327 -26.179 0.492 1.00 1.00 S ATOM 1097 CE MET A 73 73.861 -25.432 2.047 1.00 1.00 C ATOM 0 H MET A 73 70.708 -24.115 -2.399 1.00 1.00 H new ATOM 0 HA MET A 73 73.150 -22.651 -1.886 1.00 1.00 H new ATOM 0 HB2 MET A 73 72.325 -25.541 -2.189 1.00 1.00 H new ATOM 0 HB3 MET A 73 74.016 -25.084 -2.120 1.00 1.00 H new ATOM 0 HG2 MET A 73 73.583 -23.836 0.023 1.00 1.00 H new ATOM 0 HG3 MET A 73 71.900 -24.321 -0.042 1.00 1.00 H new ATOM 0 HE1 MET A 73 74.177 -26.214 2.737 1.00 1.00 H new ATOM 0 HE2 MET A 73 74.695 -24.756 1.858 1.00 1.00 H new ATOM 0 HE3 MET A 73 73.034 -24.874 2.486 1.00 1.00 H new ATOM 1107 N VAL A 74 72.547 -24.001 -4.848 1.00 1.00 N ATOM 1108 CA VAL A 74 73.022 -24.010 -6.221 1.00 1.00 C ATOM 1109 C VAL A 74 73.408 -22.602 -6.644 1.00 1.00 C ATOM 1110 O VAL A 74 74.532 -22.426 -7.116 1.00 1.00 O ATOM 1111 CB VAL A 74 71.942 -24.556 -7.152 1.00 1.00 C ATOM 1112 CG1 VAL A 74 72.425 -24.486 -8.596 1.00 1.00 C ATOM 1113 CG2 VAL A 74 71.613 -26.011 -6.801 1.00 1.00 C ATOM 0 H VAL A 74 71.695 -24.537 -4.685 1.00 1.00 H new ATOM 0 HA VAL A 74 73.898 -24.655 -6.285 1.00 1.00 H new ATOM 0 HB VAL A 74 71.044 -23.950 -7.032 1.00 1.00 H new ATOM 0 HG11 VAL A 74 71.652 -24.876 -9.258 1.00 1.00 H new ATOM 0 HG12 VAL A 74 72.638 -23.450 -8.859 1.00 1.00 H new ATOM 0 HG13 VAL A 74 73.331 -25.082 -8.706 1.00 1.00 H new ATOM 0 HG21 VAL A 74 70.841 -26.382 -7.475 1.00 1.00 H new ATOM 0 HG22 VAL A 74 72.510 -26.622 -6.904 1.00 1.00 H new ATOM 0 HG23 VAL A 74 71.253 -26.065 -5.773 1.00 1.00 H new ATOM 1123 N ASN A 75 72.549 -21.569 -6.451 1.00 1.00 N ATOM 1124 CA ASN A 75 72.920 -20.189 -6.798 1.00 1.00 C ATOM 1125 C ASN A 75 74.383 -19.912 -6.431 1.00 1.00 C ATOM 1126 O ASN A 75 75.028 -19.017 -6.971 1.00 1.00 O ATOM 1127 CB ASN A 75 71.996 -19.249 -6.010 1.00 1.00 C ATOM 1128 CG ASN A 75 72.129 -17.818 -6.504 1.00 1.00 C ATOM 1129 OD1 ASN A 75 73.067 -17.118 -6.118 1.00 1.00 O ATOM 1130 ND2 ASN A 75 71.245 -17.338 -7.329 1.00 1.00 N ATOM 0 H ASN A 75 71.611 -21.670 -6.063 1.00 1.00 H new ATOM 0 HA ASN A 75 72.811 -20.031 -7.871 1.00 1.00 H new ATOM 0 HB2 ASN A 75 70.962 -19.579 -6.113 1.00 1.00 H new ATOM 0 HB3 ASN A 75 72.242 -19.296 -4.949 1.00 1.00 H new ATOM 0 HD21 ASN A 75 71.326 -16.377 -7.660 1.00 1.00 H new ATOM 0 HD22 ASN A 75 70.471 -17.923 -7.644 1.00 1.00 H new ATOM 1137 N GLY A 76 74.880 -20.727 -5.524 1.00 1.00 N ATOM 1138 CA GLY A 76 76.270 -20.620 -5.073 1.00 1.00 C ATOM 1139 C GLY A 76 77.168 -20.401 -6.297 1.00 1.00 C ATOM 1140 O GLY A 76 78.290 -19.908 -6.197 1.00 1.00 O ATOM 0 H GLY A 76 74.349 -21.475 -5.078 1.00 1.00 H new ATOM 0 HA2 GLY A 76 76.377 -19.792 -4.372 1.00 1.00 H new ATOM 0 HA3 GLY A 76 76.566 -21.526 -4.544 1.00 1.00 H new ATOM 1144 N ILE A 77 76.635 -20.782 -7.462 1.00 1.00 N ATOM 1145 CA ILE A 77 77.364 -20.626 -8.724 1.00 1.00 C ATOM 1146 C ILE A 77 77.187 -19.191 -9.220 1.00 1.00 C ATOM 1147 O ILE A 77 78.141 -18.550 -9.607 1.00 1.00 O ATOM 1148 CB ILE A 77 76.898 -21.632 -9.786 1.00 1.00 C ATOM 1149 CG1 ILE A 77 77.273 -23.055 -9.338 1.00 1.00 C ATOM 1150 CG2 ILE A 77 77.602 -21.322 -11.129 1.00 1.00 C ATOM 1151 CD1 ILE A 77 76.550 -24.084 -10.214 1.00 1.00 C ATOM 0 H ILE A 77 75.708 -21.198 -7.557 1.00 1.00 H new ATOM 0 HA ILE A 77 78.420 -20.830 -8.545 1.00 1.00 H new ATOM 0 HB ILE A 77 75.818 -21.557 -9.910 1.00 1.00 H new ATOM 0 HG12 ILE A 77 78.351 -23.196 -9.410 1.00 1.00 H new ATOM 0 HG13 ILE A 77 77.002 -23.200 -8.292 1.00 1.00 H new ATOM 0 HG21 ILE A 77 77.273 -22.035 -11.885 1.00 1.00 H new ATOM 0 HG22 ILE A 77 77.348 -20.311 -11.448 1.00 1.00 H new ATOM 0 HG23 ILE A 77 78.682 -21.401 -11.001 1.00 1.00 H new ATOM 0 HD11 ILE A 77 76.820 -25.090 -9.892 1.00 1.00 H new ATOM 0 HD12 ILE A 77 75.472 -23.949 -10.119 1.00 1.00 H new ATOM 0 HD13 ILE A 77 76.843 -23.946 -11.255 1.00 1.00 H new ATOM 1163 N VAL A 78 75.930 -18.737 -9.259 1.00 1.00 N ATOM 1164 CA VAL A 78 75.619 -17.403 -9.746 1.00 1.00 C ATOM 1165 C VAL A 78 76.758 -16.453 -9.329 1.00 1.00 C ATOM 1166 O VAL A 78 77.109 -15.532 -10.066 1.00 1.00 O ATOM 1167 CB VAL A 78 74.279 -16.954 -9.175 1.00 1.00 C ATOM 1168 CG1 VAL A 78 74.089 -15.463 -9.423 1.00 1.00 C ATOM 1169 CG2 VAL A 78 73.165 -17.736 -9.877 1.00 1.00 C ATOM 0 H VAL A 78 75.119 -19.277 -8.959 1.00 1.00 H new ATOM 0 HA VAL A 78 75.537 -17.396 -10.833 1.00 1.00 H new ATOM 0 HB VAL A 78 74.250 -17.141 -8.102 1.00 1.00 H new ATOM 0 HG11 VAL A 78 73.130 -15.145 -9.014 1.00 1.00 H new ATOM 0 HG12 VAL A 78 74.892 -14.908 -8.938 1.00 1.00 H new ATOM 0 HG13 VAL A 78 74.109 -15.267 -10.495 1.00 1.00 H new ATOM 0 HG21 VAL A 78 72.198 -17.427 -9.480 1.00 1.00 H new ATOM 0 HG22 VAL A 78 73.199 -17.535 -10.948 1.00 1.00 H new ATOM 0 HG23 VAL A 78 73.304 -18.803 -9.703 1.00 1.00 H new ATOM 1179 N ILE A 79 77.342 -16.701 -8.148 1.00 1.00 N ATOM 1180 CA ILE A 79 78.456 -15.878 -7.659 1.00 1.00 C ATOM 1181 C ILE A 79 79.793 -16.440 -8.171 1.00 1.00 C ATOM 1182 O ILE A 79 80.758 -15.715 -8.331 1.00 1.00 O ATOM 1183 CB ILE A 79 78.456 -15.852 -6.101 1.00 1.00 C ATOM 1184 CG1 ILE A 79 79.421 -16.920 -5.531 1.00 1.00 C ATOM 1185 CG2 ILE A 79 77.040 -16.144 -5.590 1.00 1.00 C ATOM 1186 CD1 ILE A 79 79.166 -17.139 -4.038 1.00 1.00 C ATOM 0 H ILE A 79 77.065 -17.456 -7.520 1.00 1.00 H new ATOM 0 HA ILE A 79 78.332 -14.862 -8.033 1.00 1.00 H new ATOM 0 HB ILE A 79 78.786 -14.866 -5.773 1.00 1.00 H new ATOM 0 HG12 ILE A 79 79.290 -17.859 -6.069 1.00 1.00 H new ATOM 0 HG13 ILE A 79 80.453 -16.605 -5.686 1.00 1.00 H new ATOM 0 HG21 ILE A 79 77.036 -16.127 -4.500 1.00 1.00 H new ATOM 0 HG22 ILE A 79 76.353 -15.386 -5.968 1.00 1.00 H new ATOM 0 HG23 ILE A 79 76.723 -17.127 -5.939 1.00 1.00 H new ATOM 0 HD11 ILE A 79 79.855 -17.893 -3.658 1.00 1.00 H new ATOM 0 HD12 ILE A 79 79.321 -16.203 -3.501 1.00 1.00 H new ATOM 0 HD13 ILE A 79 78.140 -17.477 -3.890 1.00 1.00 H new ATOM 1198 N ALA A 80 79.802 -17.731 -8.475 1.00 1.00 N ATOM 1199 CA ALA A 80 80.958 -18.427 -9.033 1.00 1.00 C ATOM 1200 C ALA A 80 80.958 -18.385 -10.571 1.00 1.00 C ATOM 1201 O ALA A 80 81.940 -18.783 -11.203 1.00 1.00 O ATOM 1202 CB ALA A 80 81.001 -19.881 -8.535 1.00 1.00 C ATOM 0 H ALA A 80 78.992 -18.336 -8.339 1.00 1.00 H new ATOM 0 HA ALA A 80 81.853 -17.909 -8.689 1.00 1.00 H new ATOM 0 HB1 ALA A 80 81.869 -20.386 -8.960 1.00 1.00 H new ATOM 0 HB2 ALA A 80 81.072 -19.891 -7.447 1.00 1.00 H new ATOM 0 HB3 ALA A 80 80.093 -20.398 -8.844 1.00 1.00 H new ATOM 1208 N GLU A 81 79.848 -17.912 -11.176 1.00 1.00 N ATOM 1209 CA GLU A 81 79.750 -17.849 -12.615 1.00 1.00 C ATOM 1210 C GLU A 81 80.515 -16.669 -13.172 1.00 1.00 C ATOM 1211 O GLU A 81 81.517 -16.884 -13.824 1.00 1.00 O ATOM 1212 CB GLU A 81 78.282 -17.722 -13.025 1.00 1.00 C ATOM 1213 CG GLU A 81 78.149 -17.862 -14.545 1.00 1.00 C ATOM 1214 CD GLU A 81 78.526 -19.276 -14.970 1.00 1.00 C ATOM 1215 OE1 GLU A 81 78.488 -20.155 -14.124 1.00 1.00 O ATOM 1216 OE2 GLU A 81 78.857 -19.456 -16.129 1.00 1.00 O ATOM 0 H GLU A 81 79.024 -17.575 -10.679 1.00 1.00 H new ATOM 0 HA GLU A 81 80.182 -18.765 -13.018 1.00 1.00 H new ATOM 0 HB2 GLU A 81 77.689 -18.490 -12.527 1.00 1.00 H new ATOM 0 HB3 GLU A 81 77.888 -16.757 -12.704 1.00 1.00 H new ATOM 0 HG2 GLU A 81 77.126 -17.641 -14.851 1.00 1.00 H new ATOM 0 HG3 GLU A 81 78.794 -17.139 -15.044 1.00 1.00 H new ATOM 1223 N ASP A 82 80.012 -15.441 -12.969 1.00 1.00 N ATOM 1224 CA ASP A 82 80.665 -14.249 -13.508 1.00 1.00 C ATOM 1225 C ASP A 82 81.826 -13.779 -12.631 1.00 1.00 C ATOM 1226 O ASP A 82 82.680 -13.059 -13.097 1.00 1.00 O ATOM 1227 CB ASP A 82 79.645 -13.111 -13.652 1.00 1.00 C ATOM 1228 CG ASP A 82 78.403 -13.597 -14.403 1.00 1.00 C ATOM 1229 OD1 ASP A 82 78.269 -14.794 -14.583 1.00 1.00 O ATOM 1230 OD2 ASP A 82 77.600 -12.755 -14.784 1.00 1.00 O ATOM 0 H ASP A 82 79.161 -15.253 -12.439 1.00 1.00 H new ATOM 0 HA ASP A 82 81.070 -14.518 -14.484 1.00 1.00 H new ATOM 0 HB2 ASP A 82 79.360 -12.743 -12.666 1.00 1.00 H new ATOM 0 HB3 ASP A 82 80.097 -12.275 -14.186 1.00 1.00 H new ATOM 1235 N ALA A 83 81.878 -14.204 -11.375 1.00 1.00 N ATOM 1236 CA ALA A 83 82.975 -13.772 -10.499 1.00 1.00 C ATOM 1237 C ALA A 83 84.371 -13.827 -11.130 1.00 1.00 C ATOM 1238 O ALA A 83 85.102 -12.855 -11.024 1.00 1.00 O ATOM 1239 CB ALA A 83 82.992 -14.607 -9.213 1.00 1.00 C ATOM 0 H ALA A 83 81.198 -14.830 -10.943 1.00 1.00 H new ATOM 0 HA ALA A 83 82.765 -12.722 -10.296 1.00 1.00 H new ATOM 0 HB1 ALA A 83 83.810 -14.275 -8.574 1.00 1.00 H new ATOM 0 HB2 ALA A 83 82.046 -14.482 -8.685 1.00 1.00 H new ATOM 0 HB3 ALA A 83 83.131 -15.659 -9.464 1.00 1.00 H new ATOM 1245 N LEU A 84 84.762 -14.964 -11.695 1.00 1.00 N ATOM 1246 CA LEU A 84 86.138 -15.133 -12.213 1.00 1.00 C ATOM 1247 C LEU A 84 86.733 -13.812 -12.744 1.00 1.00 C ATOM 1248 O LEU A 84 87.945 -13.634 -12.670 1.00 1.00 O ATOM 1249 CB LEU A 84 86.218 -16.220 -13.339 1.00 1.00 C ATOM 1250 CG LEU A 84 84.822 -16.682 -13.785 1.00 1.00 C ATOM 1251 CD1 LEU A 84 84.053 -17.325 -12.595 1.00 1.00 C ATOM 1252 CD2 LEU A 84 84.039 -15.485 -14.388 1.00 1.00 C ATOM 0 H LEU A 84 84.162 -15.781 -11.811 1.00 1.00 H new ATOM 0 HA LEU A 84 86.729 -15.464 -11.359 1.00 1.00 H new ATOM 0 HB2 LEU A 84 86.759 -15.817 -14.196 1.00 1.00 H new ATOM 0 HB3 LEU A 84 86.786 -17.077 -12.978 1.00 1.00 H new ATOM 0 HG LEU A 84 84.926 -17.445 -14.557 1.00 1.00 H new ATOM 0 HD11 LEU A 84 83.067 -17.646 -12.930 1.00 1.00 H new ATOM 0 HD12 LEU A 84 84.609 -18.187 -12.226 1.00 1.00 H new ATOM 0 HD13 LEU A 84 83.944 -16.593 -11.794 1.00 1.00 H new ATOM 0 HD21 LEU A 84 83.050 -15.818 -14.702 1.00 1.00 H new ATOM 0 HD22 LEU A 84 83.936 -14.702 -13.637 1.00 1.00 H new ATOM 0 HD23 LEU A 84 84.580 -15.093 -15.249 1.00 1.00 H new ATOM 1264 N ILE A 85 85.904 -12.888 -13.231 1.00 1.00 N ATOM 1265 CA ILE A 85 86.417 -11.586 -13.702 1.00 1.00 C ATOM 1266 C ILE A 85 86.190 -10.525 -12.609 1.00 1.00 C ATOM 1267 O ILE A 85 87.132 -9.897 -12.127 1.00 1.00 O ATOM 1268 CB ILE A 85 85.733 -11.196 -15.023 1.00 1.00 C ATOM 1269 CG1 ILE A 85 84.191 -11.280 -14.881 1.00 1.00 C ATOM 1270 CG2 ILE A 85 86.200 -12.185 -16.101 1.00 1.00 C ATOM 1271 CD1 ILE A 85 83.560 -9.891 -14.887 1.00 1.00 C ATOM 0 H ILE A 85 84.894 -13.005 -13.312 1.00 1.00 H new ATOM 0 HA ILE A 85 87.487 -11.655 -13.895 1.00 1.00 H new ATOM 0 HB ILE A 85 85.997 -10.173 -15.290 1.00 1.00 H new ATOM 0 HG12 ILE A 85 83.780 -11.873 -15.698 1.00 1.00 H new ATOM 0 HG13 ILE A 85 83.936 -11.794 -13.954 1.00 1.00 H new ATOM 0 HG21 ILE A 85 85.731 -11.934 -17.052 1.00 1.00 H new ATOM 0 HG22 ILE A 85 87.284 -12.126 -16.204 1.00 1.00 H new ATOM 0 HG23 ILE A 85 85.917 -13.198 -15.813 1.00 1.00 H new ATOM 0 HD11 ILE A 85 82.479 -9.982 -14.786 1.00 1.00 H new ATOM 0 HD12 ILE A 85 83.954 -9.309 -14.054 1.00 1.00 H new ATOM 0 HD13 ILE A 85 83.796 -9.388 -15.825 1.00 1.00 H new ATOM 1283 N ALA A 86 84.922 -10.341 -12.239 1.00 1.00 N ATOM 1284 CA ALA A 86 84.553 -9.372 -11.213 1.00 1.00 C ATOM 1285 C ALA A 86 85.357 -9.605 -9.934 1.00 1.00 C ATOM 1286 O ALA A 86 85.736 -8.654 -9.266 1.00 1.00 O ATOM 1287 CB ALA A 86 83.059 -9.484 -10.916 1.00 1.00 C ATOM 0 H ALA A 86 84.134 -10.852 -12.637 1.00 1.00 H new ATOM 0 HA ALA A 86 84.777 -8.371 -11.582 1.00 1.00 H new ATOM 0 HB1 ALA A 86 82.785 -8.759 -10.149 1.00 1.00 H new ATOM 0 HB2 ALA A 86 82.491 -9.283 -11.825 1.00 1.00 H new ATOM 0 HB3 ALA A 86 82.833 -10.490 -10.562 1.00 1.00 H new ATOM 1293 N GLU A 87 85.609 -10.865 -9.590 1.00 1.00 N ATOM 1294 CA GLU A 87 86.378 -11.189 -8.386 1.00 1.00 C ATOM 1295 C GLU A 87 87.646 -10.333 -8.327 1.00 1.00 C ATOM 1296 O GLU A 87 88.328 -10.277 -7.303 1.00 1.00 O ATOM 1297 CB GLU A 87 86.754 -12.685 -8.406 1.00 1.00 C ATOM 1298 CG GLU A 87 86.853 -13.247 -6.977 1.00 1.00 C ATOM 1299 CD GLU A 87 87.297 -14.705 -7.035 1.00 1.00 C ATOM 1300 OE1 GLU A 87 86.492 -15.533 -7.425 1.00 1.00 O ATOM 1301 OE2 GLU A 87 88.440 -14.966 -6.695 1.00 1.00 O ATOM 0 H GLU A 87 85.295 -11.676 -10.123 1.00 1.00 H new ATOM 0 HA GLU A 87 85.772 -10.979 -7.504 1.00 1.00 H new ATOM 0 HB2 GLU A 87 86.007 -13.244 -8.970 1.00 1.00 H new ATOM 0 HB3 GLU A 87 87.706 -12.818 -8.920 1.00 1.00 H new ATOM 0 HG2 GLU A 87 87.564 -12.662 -6.393 1.00 1.00 H new ATOM 0 HG3 GLU A 87 85.888 -13.169 -6.476 1.00 1.00 H new ATOM 1308 N ALA A 88 87.946 -9.669 -9.437 1.00 1.00 N ATOM 1309 CA ALA A 88 89.126 -8.807 -9.518 1.00 1.00 C ATOM 1310 C ALA A 88 88.805 -7.424 -8.957 1.00 1.00 C ATOM 1311 O ALA A 88 89.669 -6.555 -8.867 1.00 1.00 O ATOM 1312 CB ALA A 88 89.595 -8.679 -10.971 1.00 1.00 C ATOM 0 H ALA A 88 87.392 -9.709 -10.293 1.00 1.00 H new ATOM 0 HA ALA A 88 89.924 -9.257 -8.928 1.00 1.00 H new ATOM 0 HB1 ALA A 88 90.473 -8.035 -11.014 1.00 1.00 H new ATOM 0 HB2 ALA A 88 89.849 -9.665 -11.360 1.00 1.00 H new ATOM 0 HB3 ALA A 88 88.797 -8.246 -11.574 1.00 1.00 H new ATOM 1318 N VAL A 89 87.556 -7.248 -8.562 1.00 1.00 N ATOM 1319 CA VAL A 89 87.087 -6.002 -7.987 1.00 1.00 C ATOM 1320 C VAL A 89 87.197 -6.076 -6.481 1.00 1.00 C ATOM 1321 O VAL A 89 86.424 -5.447 -5.771 1.00 1.00 O ATOM 1322 CB VAL A 89 85.630 -5.725 -8.385 1.00 1.00 C ATOM 1323 CG1 VAL A 89 85.163 -4.365 -7.806 1.00 1.00 C ATOM 1324 CG2 VAL A 89 85.536 -5.691 -9.916 1.00 1.00 C ATOM 0 H VAL A 89 86.837 -7.968 -8.632 1.00 1.00 H new ATOM 0 HA VAL A 89 87.705 -5.189 -8.368 1.00 1.00 H new ATOM 0 HB VAL A 89 84.989 -6.511 -7.986 1.00 1.00 H new ATOM 0 HG11 VAL A 89 84.128 -4.182 -8.096 1.00 1.00 H new ATOM 0 HG12 VAL A 89 85.236 -4.388 -6.719 1.00 1.00 H new ATOM 0 HG13 VAL A 89 85.796 -3.567 -8.195 1.00 1.00 H new ATOM 0 HG21 VAL A 89 84.506 -5.495 -10.213 1.00 1.00 H new ATOM 0 HG22 VAL A 89 86.181 -4.902 -10.303 1.00 1.00 H new ATOM 0 HG23 VAL A 89 85.854 -6.652 -10.321 1.00 1.00 H new ATOM 1334 N GLY A 90 88.209 -6.789 -5.975 1.00 1.00 N ATOM 1335 CA GLY A 90 88.420 -6.885 -4.542 1.00 1.00 C ATOM 1336 C GLY A 90 88.834 -5.539 -3.930 1.00 1.00 C ATOM 1337 O GLY A 90 88.298 -5.164 -2.888 1.00 1.00 O ATOM 0 H GLY A 90 88.886 -7.302 -6.539 1.00 1.00 H new ATOM 0 HA2 GLY A 90 87.505 -7.235 -4.064 1.00 1.00 H new ATOM 0 HA3 GLY A 90 89.191 -7.628 -4.338 1.00 1.00 H new ATOM 1341 N PRO A 91 89.756 -4.795 -4.536 1.00 1.00 N ATOM 1342 CA PRO A 91 90.189 -3.471 -4.000 1.00 1.00 C ATOM 1343 C PRO A 91 89.007 -2.685 -3.441 1.00 1.00 C ATOM 1344 O PRO A 91 89.191 -1.743 -2.663 1.00 1.00 O ATOM 1345 CB PRO A 91 90.786 -2.741 -5.225 1.00 1.00 C ATOM 1346 CG PRO A 91 90.868 -3.757 -6.340 1.00 1.00 C ATOM 1347 CD PRO A 91 90.528 -5.125 -5.746 1.00 1.00 C ATOM 0 HA PRO A 91 90.899 -3.576 -3.179 1.00 1.00 H new ATOM 0 HB2 PRO A 91 90.160 -1.898 -5.516 1.00 1.00 H new ATOM 0 HB3 PRO A 91 91.773 -2.340 -4.993 1.00 1.00 H new ATOM 0 HG2 PRO A 91 90.173 -3.504 -7.140 1.00 1.00 H new ATOM 0 HG3 PRO A 91 91.867 -3.767 -6.776 1.00 1.00 H new ATOM 0 HD2 PRO A 91 89.945 -5.730 -6.441 1.00 1.00 H new ATOM 0 HD3 PRO A 91 91.427 -5.692 -5.506 1.00 1.00 H new ATOM 1355 N HIS A 92 87.796 -3.070 -3.837 1.00 1.00 N ATOM 1356 CA HIS A 92 86.639 -2.362 -3.352 1.00 1.00 C ATOM 1357 C HIS A 92 86.739 -2.368 -1.823 1.00 1.00 C ATOM 1358 O HIS A 92 86.615 -1.340 -1.174 1.00 1.00 O ATOM 1359 CB HIS A 92 85.343 -3.067 -3.815 1.00 1.00 C ATOM 1360 CG HIS A 92 84.968 -4.180 -2.872 1.00 1.00 C ATOM 1361 ND1 HIS A 92 84.512 -3.931 -1.594 1.00 1.00 N ATOM 1362 CD2 HIS A 92 84.986 -5.543 -3.012 1.00 1.00 C ATOM 1363 CE1 HIS A 92 84.279 -5.118 -1.012 1.00 1.00 C ATOM 1364 NE2 HIS A 92 84.556 -6.135 -1.835 1.00 1.00 N ATOM 0 H HIS A 92 87.604 -3.844 -4.472 1.00 1.00 H new ATOM 0 HA HIS A 92 86.607 -1.344 -3.739 1.00 1.00 H new ATOM 0 HB2 HIS A 92 84.530 -2.343 -3.870 1.00 1.00 H new ATOM 0 HB3 HIS A 92 85.481 -3.467 -4.819 1.00 1.00 H new ATOM 0 HD2 HIS A 92 85.289 -6.074 -3.902 1.00 1.00 H new ATOM 0 HE1 HIS A 92 83.913 -5.237 -0.003 1.00 1.00 H new ATOM 0 HE2 HIS A 92 84.469 -7.132 -1.639 1.00 1.00 H new ATOM 1372 N LEU A 93 87.073 -3.537 -1.268 1.00 1.00 N ATOM 1373 CA LEU A 93 87.243 -3.626 0.189 1.00 1.00 C ATOM 1374 C LEU A 93 88.002 -2.382 0.762 1.00 1.00 C ATOM 1375 O LEU A 93 87.441 -1.660 1.576 1.00 1.00 O ATOM 1376 CB LEU A 93 88.056 -4.889 0.550 1.00 1.00 C ATOM 1377 CG LEU A 93 89.478 -4.886 -0.129 1.00 1.00 C ATOM 1378 CD1 LEU A 93 90.581 -4.463 0.885 1.00 1.00 C ATOM 1379 CD2 LEU A 93 89.808 -6.299 -0.652 1.00 1.00 C ATOM 0 H LEU A 93 87.227 -4.406 -1.780 1.00 1.00 H new ATOM 0 HA LEU A 93 86.245 -3.668 0.626 1.00 1.00 H new ATOM 0 HB2 LEU A 93 88.171 -4.950 1.632 1.00 1.00 H new ATOM 0 HB3 LEU A 93 87.506 -5.777 0.237 1.00 1.00 H new ATOM 0 HG LEU A 93 89.456 -4.171 -0.951 1.00 1.00 H new ATOM 0 HD11 LEU A 93 91.552 -4.470 0.390 1.00 1.00 H new ATOM 0 HD12 LEU A 93 90.369 -3.460 1.256 1.00 1.00 H new ATOM 0 HD13 LEU A 93 90.595 -5.163 1.720 1.00 1.00 H new ATOM 0 HD21 LEU A 93 90.792 -6.293 -1.121 1.00 1.00 H new ATOM 0 HD22 LEU A 93 89.806 -7.004 0.179 1.00 1.00 H new ATOM 0 HD23 LEU A 93 89.059 -6.600 -1.384 1.00 1.00 H new ATOM 1391 N ALA A 94 89.260 -2.131 0.349 1.00 1.00 N ATOM 1392 CA ALA A 94 89.994 -0.971 0.861 1.00 1.00 C ATOM 1393 C ALA A 94 89.205 0.288 0.539 1.00 1.00 C ATOM 1394 O ALA A 94 88.804 1.015 1.431 1.00 1.00 O ATOM 1395 CB ALA A 94 91.366 -0.890 0.204 1.00 1.00 C ATOM 0 H ALA A 94 89.774 -2.703 -0.321 1.00 1.00 H new ATOM 0 HA ALA A 94 90.124 -1.068 1.939 1.00 1.00 H new ATOM 0 HB1 ALA A 94 91.904 -0.025 0.591 1.00 1.00 H new ATOM 0 HB2 ALA A 94 91.929 -1.796 0.425 1.00 1.00 H new ATOM 0 HB3 ALA A 94 91.247 -0.791 -0.875 1.00 1.00 H new ATOM 1401 N ARG A 95 88.953 0.518 -0.743 1.00 1.00 N ATOM 1402 CA ARG A 95 88.166 1.685 -1.138 1.00 1.00 C ATOM 1403 C ARG A 95 86.858 1.697 -0.322 1.00 1.00 C ATOM 1404 O ARG A 95 86.553 2.609 0.470 1.00 1.00 O ATOM 1405 CB ARG A 95 87.847 1.600 -2.645 1.00 1.00 C ATOM 1406 CG ARG A 95 88.997 2.185 -3.469 1.00 1.00 C ATOM 1407 CD ARG A 95 88.907 1.680 -4.911 1.00 1.00 C ATOM 1408 NE ARG A 95 87.569 1.918 -5.450 1.00 1.00 N ATOM 1409 CZ ARG A 95 87.227 3.090 -5.982 1.00 1.00 C ATOM 1410 NH1 ARG A 95 88.086 4.070 -6.016 1.00 1.00 N ATOM 1411 NH2 ARG A 95 86.027 3.257 -6.471 1.00 1.00 N ATOM 0 H ARG A 95 89.272 -0.070 -1.513 1.00 1.00 H new ATOM 0 HA ARG A 95 88.726 2.600 -0.946 1.00 1.00 H new ATOM 0 HB2 ARG A 95 87.679 0.561 -2.929 1.00 1.00 H new ATOM 0 HB3 ARG A 95 86.926 2.142 -2.859 1.00 1.00 H new ATOM 0 HG2 ARG A 95 88.953 3.274 -3.451 1.00 1.00 H new ATOM 0 HG3 ARG A 95 89.953 1.898 -3.032 1.00 1.00 H new ATOM 0 HD2 ARG A 95 89.650 2.186 -5.528 1.00 1.00 H new ATOM 0 HD3 ARG A 95 89.136 0.615 -4.945 1.00 1.00 H new ATOM 0 HE ARG A 95 86.880 1.167 -5.418 1.00 1.00 H new ATOM 0 HH11 ARG A 95 89.023 3.940 -5.635 1.00 1.00 H new ATOM 0 HH12 ARG A 95 87.821 4.966 -6.424 1.00 1.00 H new ATOM 0 HH21 ARG A 95 85.354 2.491 -6.445 1.00 1.00 H new ATOM 0 HH22 ARG A 95 85.763 4.154 -6.879 1.00 1.00 H new ATOM 1425 N ALA A 96 86.031 0.690 -0.454 1.00 1.00 N ATOM 1426 CA ALA A 96 84.795 0.692 0.266 1.00 1.00 C ATOM 1427 C ALA A 96 85.013 1.049 1.741 1.00 1.00 C ATOM 1428 O ALA A 96 84.055 1.213 2.485 1.00 1.00 O ATOM 1429 CB ALA A 96 84.050 -0.631 0.006 1.00 1.00 C ATOM 0 H ALA A 96 86.192 -0.126 -1.044 1.00 1.00 H new ATOM 0 HA ALA A 96 84.138 1.481 -0.099 1.00 1.00 H new ATOM 0 HB1 ALA A 96 83.108 -0.632 0.554 1.00 1.00 H new ATOM 0 HB2 ALA A 96 83.850 -0.732 -1.061 1.00 1.00 H new ATOM 0 HB3 ALA A 96 84.665 -1.467 0.341 1.00 1.00 H new ATOM 1435 N LEU A 97 86.307 0.998 2.182 1.00 1.00 N ATOM 1436 CA LEU A 97 86.701 1.111 3.590 1.00 1.00 C ATOM 1437 C LEU A 97 85.510 1.203 4.527 1.00 1.00 C ATOM 1438 O LEU A 97 85.426 0.389 5.432 1.00 1.00 O ATOM 1439 CB LEU A 97 87.432 2.471 3.660 1.00 1.00 C ATOM 1440 CG LEU A 97 88.313 2.603 4.909 1.00 1.00 C ATOM 1441 CD1 LEU A 97 89.360 3.698 4.677 1.00 1.00 C ATOM 1442 CD2 LEU A 97 87.472 2.982 6.132 1.00 1.00 C ATOM 0 H LEU A 97 87.099 0.876 1.551 1.00 1.00 H new ATOM 0 HA LEU A 97 87.285 0.241 3.890 1.00 1.00 H new ATOM 0 HB2 LEU A 97 88.049 2.594 2.770 1.00 1.00 H new ATOM 0 HB3 LEU A 97 86.697 3.276 3.652 1.00 1.00 H new ATOM 0 HG LEU A 97 88.795 1.643 5.092 1.00 1.00 H new ATOM 0 HD11 LEU A 97 89.988 3.795 5.563 1.00 1.00 H new ATOM 0 HD12 LEU A 97 89.980 3.433 3.820 1.00 1.00 H new ATOM 0 HD13 LEU A 97 88.858 4.646 4.483 1.00 1.00 H new ATOM 0 HD21 LEU A 97 88.119 3.070 7.005 1.00 1.00 H new ATOM 0 HD22 LEU A 97 86.975 3.935 5.951 1.00 1.00 H new ATOM 0 HD23 LEU A 97 86.723 2.211 6.311 1.00 1.00 H new ATOM 1454 N GLY A 98 84.547 2.063 4.344 1.00 1.00 N ATOM 1455 CA GLY A 98 83.401 2.009 5.204 1.00 1.00 C ATOM 1456 C GLY A 98 82.908 0.561 5.251 1.00 1.00 C ATOM 1457 O GLY A 98 82.281 0.153 6.214 1.00 1.00 O ATOM 0 H GLY A 98 84.531 2.790 3.628 1.00 1.00 H new ATOM 0 HA2 GLY A 98 83.660 2.355 6.205 1.00 1.00 H new ATOM 0 HA3 GLY A 98 82.615 2.667 4.832 1.00 1.00 H new ATOM 1461 N GLN A 99 83.231 -0.267 4.218 1.00 1.00 N ATOM 1462 CA GLN A 99 82.789 -1.664 4.311 1.00 1.00 C ATOM 1463 C GLN A 99 83.566 -2.341 5.409 1.00 1.00 C ATOM 1464 O GLN A 99 83.133 -3.341 5.959 1.00 1.00 O ATOM 1465 CB GLN A 99 82.927 -2.426 3.002 1.00 1.00 C ATOM 1466 CG GLN A 99 81.835 -1.957 2.039 1.00 1.00 C ATOM 1467 CD GLN A 99 80.469 -2.441 2.493 1.00 1.00 C ATOM 1468 OE1 GLN A 99 79.559 -1.634 2.684 1.00 1.00 O ATOM 1469 NE2 GLN A 99 80.267 -3.709 2.674 1.00 1.00 N ATOM 0 H GLN A 99 83.753 -0.010 3.381 1.00 1.00 H new ATOM 0 HA GLN A 99 81.723 -1.665 4.540 1.00 1.00 H new ATOM 0 HB2 GLN A 99 83.912 -2.254 2.568 1.00 1.00 H new ATOM 0 HB3 GLN A 99 82.839 -3.498 3.179 1.00 1.00 H new ATOM 0 HG2 GLN A 99 81.839 -0.869 1.980 1.00 1.00 H new ATOM 0 HG3 GLN A 99 82.043 -2.331 1.037 1.00 1.00 H new ATOM 0 HE21 GLN A 99 81.024 -4.374 2.515 1.00 1.00 H new ATOM 0 HE22 GLN A 99 79.351 -4.042 2.976 1.00 1.00 H new ATOM 1478 N ILE A 100 84.696 -1.774 5.779 1.00 1.00 N ATOM 1479 CA ILE A 100 85.468 -2.346 6.882 1.00 1.00 C ATOM 1480 C ILE A 100 84.686 -2.233 8.187 1.00 1.00 C ATOM 1481 O ILE A 100 84.799 -3.106 9.047 1.00 1.00 O ATOM 1482 CB ILE A 100 86.854 -1.661 7.058 1.00 1.00 C ATOM 1483 CG1 ILE A 100 87.864 -2.306 6.109 1.00 1.00 C ATOM 1484 CG2 ILE A 100 87.363 -1.823 8.511 1.00 1.00 C ATOM 1485 CD1 ILE A 100 89.167 -1.515 6.132 1.00 1.00 C ATOM 0 H ILE A 100 85.099 -0.940 5.351 1.00 1.00 H new ATOM 0 HA ILE A 100 85.641 -3.393 6.634 1.00 1.00 H new ATOM 0 HB ILE A 100 86.746 -0.600 6.833 1.00 1.00 H new ATOM 0 HG12 ILE A 100 88.049 -3.338 6.406 1.00 1.00 H new ATOM 0 HG13 ILE A 100 87.461 -2.332 5.097 1.00 1.00 H new ATOM 0 HG21 ILE A 100 88.333 -1.337 8.613 1.00 1.00 H new ATOM 0 HG22 ILE A 100 86.653 -1.363 9.199 1.00 1.00 H new ATOM 0 HG23 ILE A 100 87.461 -2.883 8.746 1.00 1.00 H new ATOM 0 HD11 ILE A 100 89.885 -1.977 5.455 1.00 1.00 H new ATOM 0 HD12 ILE A 100 88.976 -0.490 5.814 1.00 1.00 H new ATOM 0 HD13 ILE A 100 89.573 -1.512 7.144 1.00 1.00 H new ATOM 1497 N VAL A 101 83.884 -1.172 8.343 1.00 1.00 N ATOM 1498 CA VAL A 101 83.137 -1.015 9.591 1.00 1.00 C ATOM 1499 C VAL A 101 82.197 -2.212 9.814 1.00 1.00 C ATOM 1500 O VAL A 101 82.319 -2.932 10.811 1.00 1.00 O ATOM 1501 CB VAL A 101 82.366 0.335 9.619 1.00 1.00 C ATOM 1502 CG1 VAL A 101 81.074 0.257 8.791 1.00 1.00 C ATOM 1503 CG2 VAL A 101 81.993 0.678 11.066 1.00 1.00 C ATOM 0 H VAL A 101 83.740 -0.438 7.650 1.00 1.00 H new ATOM 0 HA VAL A 101 83.850 -0.994 10.416 1.00 1.00 H new ATOM 0 HB VAL A 101 83.014 1.101 9.193 1.00 1.00 H new ATOM 0 HG11 VAL A 101 80.558 1.216 8.831 1.00 1.00 H new ATOM 0 HG12 VAL A 101 81.319 0.019 7.756 1.00 1.00 H new ATOM 0 HG13 VAL A 101 80.427 -0.520 9.198 1.00 1.00 H new ATOM 0 HG21 VAL A 101 81.452 1.624 11.088 1.00 1.00 H new ATOM 0 HG22 VAL A 101 81.361 -0.110 11.476 1.00 1.00 H new ATOM 0 HG23 VAL A 101 82.900 0.764 11.665 1.00 1.00 H new ATOM 1513 N CYS A 102 81.242 -2.411 8.911 1.00 1.00 N ATOM 1514 CA CYS A 102 80.286 -3.499 9.062 1.00 1.00 C ATOM 1515 C CYS A 102 80.983 -4.823 9.375 1.00 1.00 C ATOM 1516 O CYS A 102 80.348 -5.724 9.891 1.00 1.00 O ATOM 1517 CB CYS A 102 79.437 -3.619 7.789 1.00 1.00 C ATOM 1518 SG CYS A 102 80.487 -3.258 6.359 1.00 1.00 S ATOM 0 H CYS A 102 81.111 -1.839 8.076 1.00 1.00 H new ATOM 0 HA CYS A 102 79.637 -3.270 9.907 1.00 1.00 H new ATOM 0 HB2 CYS A 102 79.018 -4.622 7.707 1.00 1.00 H new ATOM 0 HB3 CYS A 102 78.598 -2.925 7.827 1.00 1.00 H new ATOM 0 HG CYS A 102 81.729 -3.492 6.663 1.00 1.00 H new ATOM 1523 N ARG A 103 82.287 -4.907 9.079 1.00 1.00 N ATOM 1524 CA ARG A 103 83.091 -6.145 9.333 1.00 1.00 C ATOM 1525 C ARG A 103 83.634 -6.171 10.771 1.00 1.00 C ATOM 1526 O ARG A 103 83.590 -7.152 11.514 1.00 1.00 O ATOM 1527 CB ARG A 103 84.240 -6.181 8.287 1.00 1.00 C ATOM 1528 CG ARG A 103 85.590 -6.548 8.928 1.00 1.00 C ATOM 1529 CD ARG A 103 86.678 -6.701 7.844 1.00 1.00 C ATOM 1530 NE ARG A 103 87.835 -5.856 8.157 1.00 1.00 N ATOM 1531 CZ ARG A 103 88.421 -5.888 9.354 1.00 1.00 C ATOM 1532 NH1 ARG A 103 87.966 -6.690 10.272 1.00 1.00 N ATOM 1533 NH2 ARG A 103 89.451 -5.121 9.611 1.00 1.00 N ATOM 0 H ARG A 103 82.821 -4.143 8.664 1.00 1.00 H new ATOM 0 HA ARG A 103 82.465 -7.031 9.228 1.00 1.00 H new ATOM 0 HB2 ARG A 103 83.999 -6.905 7.508 1.00 1.00 H new ATOM 0 HB3 ARG A 103 84.321 -5.208 7.803 1.00 1.00 H new ATOM 0 HG2 ARG A 103 85.883 -5.776 9.640 1.00 1.00 H new ATOM 0 HG3 ARG A 103 85.493 -7.478 9.488 1.00 1.00 H new ATOM 0 HD2 ARG A 103 86.989 -7.744 7.777 1.00 1.00 H new ATOM 0 HD3 ARG A 103 86.272 -6.426 6.871 1.00 1.00 H new ATOM 0 HE ARG A 103 88.200 -5.228 7.441 1.00 1.00 H new ATOM 0 HH11 ARG A 103 87.165 -7.290 10.074 1.00 1.00 H new ATOM 0 HH12 ARG A 103 88.410 -6.719 11.190 1.00 1.00 H new ATOM 0 HH21 ARG A 103 89.811 -4.493 8.893 1.00 1.00 H new ATOM 0 HH22 ARG A 103 89.893 -5.152 10.530 1.00 1.00 H new ATOM 1547 N TYR A 104 84.072 -5.029 11.102 1.00 1.00 N ATOM 1548 CA TYR A 104 84.605 -4.692 12.443 1.00 1.00 C ATOM 1549 C TYR A 104 83.460 -4.014 13.238 1.00 1.00 C ATOM 1550 O TYR A 104 83.663 -3.319 14.221 1.00 1.00 O ATOM 1551 CB TYR A 104 85.950 -3.879 12.401 1.00 1.00 C ATOM 1552 CG TYR A 104 85.813 -2.585 13.172 1.00 1.00 C ATOM 1553 CD1 TYR A 104 85.851 -2.569 14.578 1.00 1.00 C ATOM 1554 CD2 TYR A 104 85.576 -1.417 12.475 1.00 1.00 C ATOM 1555 CE1 TYR A 104 85.634 -1.365 15.271 1.00 1.00 C ATOM 1556 CE2 TYR A 104 85.373 -0.210 13.154 1.00 1.00 C ATOM 1557 CZ TYR A 104 85.394 -0.180 14.552 1.00 1.00 C ATOM 1558 OH TYR A 104 85.163 1.015 15.220 1.00 1.00 O ATOM 0 H TYR A 104 84.090 -4.241 10.455 1.00 1.00 H new ATOM 0 HA TYR A 104 84.908 -5.599 12.966 1.00 1.00 H new ATOM 0 HB2 TYR A 104 86.757 -4.477 12.824 1.00 1.00 H new ATOM 0 HB3 TYR A 104 86.220 -3.666 11.367 1.00 1.00 H new ATOM 0 HD1 TYR A 104 86.047 -3.480 15.124 1.00 1.00 H new ATOM 0 HD2 TYR A 104 85.547 -1.435 11.396 1.00 1.00 H new ATOM 0 HE1 TYR A 104 85.652 -1.350 16.351 1.00 1.00 H new ATOM 0 HE2 TYR A 104 85.200 0.699 12.598 1.00 1.00 H new ATOM 0 HH TYR A 104 85.017 1.732 14.568 1.00 1.00 H new ATOM 1568 N GLY A 105 82.205 -4.258 12.849 1.00 1.00 N ATOM 1569 CA GLY A 105 81.104 -3.662 13.573 1.00 1.00 C ATOM 1570 C GLY A 105 79.806 -4.365 13.176 1.00 1.00 C ATOM 1571 O GLY A 105 79.382 -5.313 13.830 1.00 1.00 O ATOM 0 H GLY A 105 81.941 -4.847 12.059 1.00 1.00 H new ATOM 0 HA2 GLY A 105 81.267 -3.752 14.647 1.00 1.00 H new ATOM 0 HA3 GLY A 105 81.039 -2.597 13.349 1.00 1.00 H new ATOM 1575 N ALA A 106 79.164 -3.873 12.116 1.00 1.00 N ATOM 1576 CA ALA A 106 77.899 -4.434 11.648 1.00 1.00 C ATOM 1577 C ALA A 106 76.794 -4.221 12.689 1.00 1.00 C ATOM 1578 O ALA A 106 76.177 -5.179 13.163 1.00 1.00 O ATOM 1579 CB ALA A 106 78.064 -5.941 11.307 1.00 1.00 C ATOM 0 H ALA A 106 79.502 -3.084 11.564 1.00 1.00 H new ATOM 0 HA ALA A 106 77.605 -3.912 10.737 1.00 1.00 H new ATOM 0 HB1 ALA A 106 77.112 -6.342 10.960 1.00 1.00 H new ATOM 0 HB2 ALA A 106 78.813 -6.057 10.524 1.00 1.00 H new ATOM 0 HB3 ALA A 106 78.383 -6.483 12.197 1.00 1.00 H new ATOM 1585 N THR A 107 76.522 -2.963 13.046 1.00 1.00 N ATOM 1586 CA THR A 107 75.465 -2.673 14.007 1.00 1.00 C ATOM 1587 C THR A 107 74.164 -2.490 13.254 1.00 1.00 C ATOM 1588 O THR A 107 73.096 -2.356 13.863 1.00 1.00 O ATOM 1589 CB THR A 107 75.778 -1.388 14.799 1.00 1.00 C ATOM 1590 OG1 THR A 107 74.870 -1.263 15.888 1.00 1.00 O ATOM 1591 CG2 THR A 107 75.633 -0.156 13.899 1.00 1.00 C ATOM 0 H THR A 107 77.013 -2.143 12.688 1.00 1.00 H new ATOM 0 HA THR A 107 75.389 -3.501 14.712 1.00 1.00 H new ATOM 0 HB THR A 107 76.802 -1.452 15.167 1.00 1.00 H new ATOM 0 HG1 THR A 107 74.029 -1.715 15.666 1.00 1.00 H new ATOM 0 HG21 THR A 107 75.857 0.743 14.474 1.00 1.00 H new ATOM 0 HG22 THR A 107 76.326 -0.234 13.061 1.00 1.00 H new ATOM 0 HG23 THR A 107 74.612 -0.100 13.521 1.00 1.00 H new ATOM 1599 N VAL A 108 74.235 -2.510 11.913 1.00 1.00 N ATOM 1600 CA VAL A 108 73.041 -2.375 11.104 1.00 1.00 C ATOM 1601 C VAL A 108 72.403 -3.722 10.870 1.00 1.00 C ATOM 1602 O VAL A 108 71.210 -3.880 11.126 1.00 1.00 O ATOM 1603 CB VAL A 108 73.356 -1.692 9.786 1.00 1.00 C ATOM 1604 CG1 VAL A 108 74.065 -0.371 10.095 1.00 1.00 C ATOM 1605 CG2 VAL A 108 74.257 -2.596 8.939 1.00 1.00 C ATOM 0 H VAL A 108 75.100 -2.617 11.384 1.00 1.00 H new ATOM 0 HA VAL A 108 72.331 -1.750 11.646 1.00 1.00 H new ATOM 0 HB VAL A 108 72.441 -1.500 9.225 1.00 1.00 H new ATOM 0 HG11 VAL A 108 74.303 0.141 9.163 1.00 1.00 H new ATOM 0 HG12 VAL A 108 73.412 0.260 10.699 1.00 1.00 H new ATOM 0 HG13 VAL A 108 74.985 -0.572 10.644 1.00 1.00 H new ATOM 0 HG21 VAL A 108 74.481 -2.103 7.993 1.00 1.00 H new ATOM 0 HG22 VAL A 108 75.185 -2.790 9.476 1.00 1.00 H new ATOM 0 HG23 VAL A 108 73.746 -3.539 8.744 1.00 1.00 H new ATOM 1615 N ILE A 109 73.136 -4.736 10.360 1.00 1.00 N ATOM 1616 CA ILE A 109 72.559 -6.047 10.095 1.00 1.00 C ATOM 1617 C ILE A 109 71.780 -6.652 11.248 1.00 1.00 C ATOM 1618 O ILE A 109 70.847 -7.391 10.992 1.00 1.00 O ATOM 1619 CB ILE A 109 73.716 -7.043 9.668 1.00 1.00 C ATOM 1620 CG1 ILE A 109 74.150 -8.034 10.797 1.00 1.00 C ATOM 1621 CG2 ILE A 109 74.962 -6.252 9.278 1.00 1.00 C ATOM 1622 CD1 ILE A 109 75.110 -9.073 10.232 1.00 1.00 C ATOM 0 H ILE A 109 74.126 -4.659 10.128 1.00 1.00 H new ATOM 0 HA ILE A 109 71.832 -5.896 9.297 1.00 1.00 H new ATOM 0 HB ILE A 109 73.306 -7.620 8.839 1.00 1.00 H new ATOM 0 HG12 ILE A 109 74.629 -7.487 11.609 1.00 1.00 H new ATOM 0 HG13 ILE A 109 73.273 -8.527 11.218 1.00 1.00 H new ATOM 0 HG21 ILE A 109 75.754 -6.941 8.985 1.00 1.00 H new ATOM 0 HG22 ILE A 109 74.728 -5.593 8.442 1.00 1.00 H new ATOM 0 HG23 ILE A 109 75.295 -5.656 10.128 1.00 1.00 H new ATOM 0 HD11 ILE A 109 75.409 -9.761 11.023 1.00 1.00 H new ATOM 0 HD12 ILE A 109 74.616 -9.629 9.435 1.00 1.00 H new ATOM 0 HD13 ILE A 109 75.993 -8.574 9.833 1.00 1.00 H new ATOM 1634 N PRO A 110 72.154 -6.442 12.483 1.00 1.00 N ATOM 1635 CA PRO A 110 71.468 -7.110 13.614 1.00 1.00 C ATOM 1636 C PRO A 110 69.968 -6.883 13.560 1.00 1.00 C ATOM 1637 O PRO A 110 69.190 -7.783 13.871 1.00 1.00 O ATOM 1638 CB PRO A 110 72.139 -6.493 14.849 1.00 1.00 C ATOM 1639 CG PRO A 110 73.486 -6.097 14.350 1.00 1.00 C ATOM 1640 CD PRO A 110 73.201 -5.538 12.976 1.00 1.00 C ATOM 0 HA PRO A 110 71.563 -8.196 13.608 1.00 1.00 H new ATOM 0 HB2 PRO A 110 71.581 -5.635 15.223 1.00 1.00 H new ATOM 0 HB3 PRO A 110 72.209 -7.209 15.668 1.00 1.00 H new ATOM 0 HG2 PRO A 110 73.952 -5.354 14.997 1.00 1.00 H new ATOM 0 HG3 PRO A 110 74.164 -6.949 14.304 1.00 1.00 H new ATOM 0 HD2 PRO A 110 72.858 -4.504 13.020 1.00 1.00 H new ATOM 0 HD3 PRO A 110 74.085 -5.554 12.339 1.00 1.00 H new ATOM 1648 N ASN A 111 69.562 -5.686 13.162 1.00 1.00 N ATOM 1649 CA ASN A 111 68.142 -5.401 13.079 1.00 1.00 C ATOM 1650 C ASN A 111 67.508 -6.290 12.002 1.00 1.00 C ATOM 1651 O ASN A 111 66.701 -7.179 12.294 1.00 1.00 O ATOM 1652 CB ASN A 111 67.953 -3.914 12.724 1.00 1.00 C ATOM 1653 CG ASN A 111 66.607 -3.688 12.034 1.00 1.00 C ATOM 1654 OD1 ASN A 111 66.540 -2.993 11.026 1.00 1.00 O ATOM 1655 ND2 ASN A 111 65.533 -4.263 12.504 1.00 1.00 N ATOM 0 H ASN A 111 70.178 -4.917 12.899 1.00 1.00 H new ATOM 0 HA ASN A 111 67.659 -5.607 14.034 1.00 1.00 H new ATOM 0 HB2 ASN A 111 68.009 -3.309 13.629 1.00 1.00 H new ATOM 0 HB3 ASN A 111 68.761 -3.586 12.071 1.00 1.00 H new ATOM 0 HD21 ASN A 111 64.638 -4.134 12.033 1.00 1.00 H new ATOM 0 HD22 ASN A 111 65.589 -4.841 13.343 1.00 1.00 H new ATOM 1662 N ILE A 112 67.873 -6.042 10.755 1.00 1.00 N ATOM 1663 CA ILE A 112 67.307 -6.815 9.657 1.00 1.00 C ATOM 1664 C ILE A 112 67.633 -8.293 9.821 1.00 1.00 C ATOM 1665 O ILE A 112 66.810 -9.151 9.578 1.00 1.00 O ATOM 1666 CB ILE A 112 67.848 -6.285 8.290 1.00 1.00 C ATOM 1667 CG1 ILE A 112 69.076 -7.097 7.814 1.00 1.00 C ATOM 1668 CG2 ILE A 112 68.272 -4.827 8.459 1.00 1.00 C ATOM 1669 CD1 ILE A 112 69.633 -6.513 6.519 1.00 1.00 C ATOM 0 H ILE A 112 68.545 -5.326 10.479 1.00 1.00 H new ATOM 0 HA ILE A 112 66.223 -6.699 9.672 1.00 1.00 H new ATOM 0 HB ILE A 112 67.055 -6.384 7.549 1.00 1.00 H new ATOM 0 HG12 ILE A 112 69.846 -7.088 8.585 1.00 1.00 H new ATOM 0 HG13 ILE A 112 68.793 -8.138 7.658 1.00 1.00 H new ATOM 0 HG21 ILE A 112 68.652 -4.446 7.511 1.00 1.00 H new ATOM 0 HG22 ILE A 112 67.414 -4.232 8.771 1.00 1.00 H new ATOM 0 HG23 ILE A 112 69.054 -4.761 9.216 1.00 1.00 H new ATOM 0 HD11 ILE A 112 70.496 -7.096 6.199 1.00 1.00 H new ATOM 0 HD12 ILE A 112 68.866 -6.546 5.746 1.00 1.00 H new ATOM 0 HD13 ILE A 112 69.936 -5.479 6.687 1.00 1.00 H new ATOM 1681 N ASN A 113 68.873 -8.557 10.152 1.00 1.00 N ATOM 1682 CA ASN A 113 69.352 -9.935 10.229 1.00 1.00 C ATOM 1683 C ASN A 113 68.365 -10.844 10.937 1.00 1.00 C ATOM 1684 O ASN A 113 67.834 -11.759 10.319 1.00 1.00 O ATOM 1685 CB ASN A 113 70.691 -9.983 10.972 1.00 1.00 C ATOM 1686 CG ASN A 113 71.108 -11.416 11.272 1.00 1.00 C ATOM 1687 OD1 ASN A 113 70.802 -12.330 10.511 1.00 1.00 O ATOM 1688 ND2 ASN A 113 71.804 -11.657 12.351 1.00 1.00 N ATOM 0 H ASN A 113 69.573 -7.848 10.373 1.00 1.00 H new ATOM 0 HA ASN A 113 69.471 -10.291 9.206 1.00 1.00 H new ATOM 0 HB2 ASN A 113 71.460 -9.497 10.371 1.00 1.00 H new ATOM 0 HB3 ASN A 113 70.612 -9.423 11.904 1.00 1.00 H new ATOM 0 HD21 ASN A 113 72.097 -12.610 12.566 1.00 1.00 H new ATOM 0 HD22 ASN A 113 72.054 -10.892 12.978 1.00 1.00 H new ATOM 1695 N ALA A 114 68.085 -10.611 12.197 1.00 1.00 N ATOM 1696 CA ALA A 114 67.153 -11.468 12.895 1.00 1.00 C ATOM 1697 C ALA A 114 65.802 -11.509 12.198 1.00 1.00 C ATOM 1698 O ALA A 114 65.074 -12.495 12.325 1.00 1.00 O ATOM 1699 CB ALA A 114 66.991 -10.969 14.332 1.00 1.00 C ATOM 0 H ALA A 114 68.479 -9.851 12.752 1.00 1.00 H new ATOM 0 HA ALA A 114 67.551 -12.483 12.897 1.00 1.00 H new ATOM 0 HB1 ALA A 114 66.289 -11.612 14.863 1.00 1.00 H new ATOM 0 HB2 ALA A 114 67.957 -10.992 14.836 1.00 1.00 H new ATOM 0 HB3 ALA A 114 66.611 -9.947 14.322 1.00 1.00 H new ATOM 1705 N ALA A 115 65.484 -10.469 11.418 1.00 1.00 N ATOM 1706 CA ALA A 115 64.217 -10.440 10.674 1.00 1.00 C ATOM 1707 C ALA A 115 64.271 -11.187 9.311 1.00 1.00 C ATOM 1708 O ALA A 115 63.492 -12.101 9.024 1.00 1.00 O ATOM 1709 CB ALA A 115 63.840 -8.968 10.431 1.00 1.00 C ATOM 0 H ALA A 115 66.075 -9.648 11.286 1.00 1.00 H new ATOM 0 HA ALA A 115 63.473 -10.961 11.277 1.00 1.00 H new ATOM 0 HB1 ALA A 115 62.901 -8.919 9.879 1.00 1.00 H new ATOM 0 HB2 ALA A 115 63.725 -8.459 11.388 1.00 1.00 H new ATOM 0 HB3 ALA A 115 64.626 -8.482 9.853 1.00 1.00 H new ATOM 1715 N ILE A 116 65.185 -10.722 8.486 1.00 1.00 N ATOM 1716 CA ILE A 116 65.321 -11.282 7.135 1.00 1.00 C ATOM 1717 C ILE A 116 65.785 -12.735 7.194 1.00 1.00 C ATOM 1718 O ILE A 116 65.123 -13.633 6.687 1.00 1.00 O ATOM 1719 CB ILE A 116 66.257 -10.456 6.246 1.00 1.00 C ATOM 1720 CG1 ILE A 116 65.591 -9.104 5.940 1.00 1.00 C ATOM 1721 CG2 ILE A 116 66.506 -11.211 4.929 1.00 1.00 C ATOM 1722 CD1 ILE A 116 66.552 -8.206 5.146 1.00 1.00 C ATOM 0 H ILE A 116 65.839 -9.972 8.710 1.00 1.00 H new ATOM 0 HA ILE A 116 64.331 -11.244 6.680 1.00 1.00 H new ATOM 0 HB ILE A 116 67.206 -10.294 6.757 1.00 1.00 H new ATOM 0 HG12 ILE A 116 64.675 -9.262 5.370 1.00 1.00 H new ATOM 0 HG13 ILE A 116 65.307 -8.612 6.870 1.00 1.00 H new ATOM 0 HG21 ILE A 116 67.172 -10.626 4.294 1.00 1.00 H new ATOM 0 HG22 ILE A 116 66.965 -12.176 5.144 1.00 1.00 H new ATOM 0 HG23 ILE A 116 65.558 -11.367 4.414 1.00 1.00 H new ATOM 0 HD11 ILE A 116 66.069 -7.252 4.936 1.00 1.00 H new ATOM 0 HD12 ILE A 116 67.456 -8.034 5.731 1.00 1.00 H new ATOM 0 HD13 ILE A 116 66.815 -8.694 4.208 1.00 1.00 H new ATOM 1734 N GLU A 117 66.936 -12.947 7.776 1.00 1.00 N ATOM 1735 CA GLU A 117 67.501 -14.296 7.859 1.00 1.00 C ATOM 1736 C GLU A 117 66.428 -15.274 8.280 1.00 1.00 C ATOM 1737 O GLU A 117 66.093 -16.204 7.523 1.00 1.00 O ATOM 1738 CB GLU A 117 68.698 -14.340 8.832 1.00 1.00 C ATOM 1739 CG GLU A 117 68.887 -15.752 9.406 1.00 1.00 C ATOM 1740 CD GLU A 117 70.246 -15.854 10.080 1.00 1.00 C ATOM 1741 OE1 GLU A 117 71.079 -15.000 9.823 1.00 1.00 O ATOM 1742 OE2 GLU A 117 70.431 -16.780 10.847 1.00 1.00 O ATOM 0 H GLU A 117 67.508 -12.218 8.201 1.00 1.00 H new ATOM 0 HA GLU A 117 67.871 -14.580 6.874 1.00 1.00 H new ATOM 0 HB2 GLU A 117 69.605 -14.030 8.313 1.00 1.00 H new ATOM 0 HB3 GLU A 117 68.537 -13.631 9.645 1.00 1.00 H new ATOM 0 HG2 GLU A 117 68.097 -15.972 10.124 1.00 1.00 H new ATOM 0 HG3 GLU A 117 68.809 -16.492 8.610 1.00 1.00 H new ATOM 1749 N VAL A 118 65.897 -15.071 9.481 1.00 1.00 N ATOM 1750 CA VAL A 118 64.873 -15.952 9.970 1.00 1.00 C ATOM 1751 C VAL A 118 63.748 -16.041 8.953 1.00 1.00 C ATOM 1752 O VAL A 118 62.927 -16.956 9.024 1.00 1.00 O ATOM 1753 CB VAL A 118 64.348 -15.455 11.309 1.00 1.00 C ATOM 1754 CG1 VAL A 118 63.306 -16.434 11.852 1.00 1.00 C ATOM 1755 CG2 VAL A 118 65.517 -15.358 12.294 1.00 1.00 C ATOM 0 H VAL A 118 66.160 -14.316 10.114 1.00 1.00 H new ATOM 0 HA VAL A 118 65.294 -16.947 10.117 1.00 1.00 H new ATOM 0 HB VAL A 118 63.886 -14.476 11.181 1.00 1.00 H new ATOM 0 HG11 VAL A 118 62.933 -16.074 12.811 1.00 1.00 H new ATOM 0 HG12 VAL A 118 62.478 -16.512 11.147 1.00 1.00 H new ATOM 0 HG13 VAL A 118 63.763 -17.415 11.986 1.00 1.00 H new ATOM 0 HG21 VAL A 118 65.152 -15.003 13.258 1.00 1.00 H new ATOM 0 HG22 VAL A 118 65.971 -16.341 12.418 1.00 1.00 H new ATOM 0 HG23 VAL A 118 66.261 -14.661 11.908 1.00 1.00 H new ATOM 1765 N LEU A 119 63.709 -15.115 7.974 1.00 1.00 N ATOM 1766 CA LEU A 119 62.674 -15.183 6.958 1.00 1.00 C ATOM 1767 C LEU A 119 63.045 -16.226 5.904 1.00 1.00 C ATOM 1768 O LEU A 119 62.301 -17.193 5.728 1.00 1.00 O ATOM 1769 CB LEU A 119 62.490 -13.811 6.294 1.00 1.00 C ATOM 1770 CG LEU A 119 61.071 -13.689 5.699 1.00 1.00 C ATOM 1771 CD1 LEU A 119 60.093 -13.179 6.766 1.00 1.00 C ATOM 1772 CD2 LEU A 119 61.092 -12.702 4.528 1.00 1.00 C ATOM 0 H LEU A 119 64.365 -14.340 7.877 1.00 1.00 H new ATOM 0 HA LEU A 119 61.736 -15.473 7.432 1.00 1.00 H new ATOM 0 HB2 LEU A 119 62.654 -13.020 7.026 1.00 1.00 H new ATOM 0 HB3 LEU A 119 63.234 -13.677 5.508 1.00 1.00 H new ATOM 0 HG LEU A 119 60.748 -14.671 5.353 1.00 1.00 H new ATOM 0 HD11 LEU A 119 59.095 -13.097 6.335 1.00 1.00 H new ATOM 0 HD12 LEU A 119 60.071 -13.877 7.603 1.00 1.00 H new ATOM 0 HD13 LEU A 119 60.418 -12.200 7.119 1.00 1.00 H new ATOM 0 HD21 LEU A 119 60.090 -12.615 4.107 1.00 1.00 H new ATOM 0 HD22 LEU A 119 61.423 -11.725 4.881 1.00 1.00 H new ATOM 0 HD23 LEU A 119 61.778 -13.062 3.761 1.00 1.00 H new ATOM 1784 N GLY A 120 64.186 -16.060 5.188 1.00 1.00 N ATOM 1785 CA GLY A 120 64.532 -17.056 4.190 1.00 1.00 C ATOM 1786 C GLY A 120 64.949 -18.377 4.844 1.00 1.00 C ATOM 1787 O GLY A 120 64.142 -19.294 5.001 1.00 1.00 O ATOM 0 H GLY A 120 64.840 -15.283 5.287 1.00 1.00 H new ATOM 0 HA2 GLY A 120 63.680 -17.226 3.532 1.00 1.00 H new ATOM 0 HA3 GLY A 120 65.345 -16.683 3.568 1.00 1.00 H new ATOM 1791 N THR A 121 66.222 -18.456 5.203 1.00 1.00 N ATOM 1792 CA THR A 121 66.803 -19.649 5.823 1.00 1.00 C ATOM 1793 C THR A 121 68.144 -19.258 6.441 1.00 1.00 C ATOM 1794 O THR A 121 68.643 -19.906 7.363 1.00 1.00 O ATOM 1795 CB THR A 121 66.971 -20.760 4.782 1.00 1.00 C ATOM 1796 OG1 THR A 121 65.777 -20.847 4.015 1.00 1.00 O ATOM 1797 CG2 THR A 121 67.226 -22.096 5.480 1.00 1.00 C ATOM 0 H THR A 121 66.888 -17.694 5.074 1.00 1.00 H new ATOM 0 HA THR A 121 66.144 -20.034 6.601 1.00 1.00 H new ATOM 0 HB THR A 121 67.819 -20.533 4.136 1.00 1.00 H new ATOM 0 HG1 THR A 121 65.001 -20.739 4.604 1.00 1.00 H new ATOM 0 HG21 THR A 121 67.344 -22.880 4.732 1.00 1.00 H new ATOM 0 HG22 THR A 121 68.134 -22.026 6.079 1.00 1.00 H new ATOM 0 HG23 THR A 121 66.382 -22.336 6.127 1.00 1.00 H new ATOM 1805 N GLY A 122 68.703 -18.169 5.913 1.00 1.00 N ATOM 1806 CA GLY A 122 69.977 -17.595 6.350 1.00 1.00 C ATOM 1807 C GLY A 122 71.062 -17.672 5.284 1.00 1.00 C ATOM 1808 O GLY A 122 71.851 -16.730 5.189 1.00 1.00 O ATOM 0 H GLY A 122 68.272 -17.648 5.150 1.00 1.00 H new ATOM 0 HA2 GLY A 122 69.823 -16.553 6.629 1.00 1.00 H new ATOM 0 HA3 GLY A 122 70.317 -18.117 7.244 1.00 1.00 H new ATOM 1812 N THR A 123 71.126 -18.742 4.481 1.00 1.00 N ATOM 1813 CA THR A 123 72.168 -18.849 3.449 1.00 1.00 C ATOM 1814 C THR A 123 72.555 -17.484 2.880 1.00 1.00 C ATOM 1815 O THR A 123 71.957 -17.006 1.919 1.00 1.00 O ATOM 1816 CB THR A 123 71.670 -19.723 2.290 1.00 1.00 C ATOM 1817 OG1 THR A 123 72.429 -19.432 1.121 1.00 1.00 O ATOM 1818 CG2 THR A 123 70.188 -19.433 2.017 1.00 1.00 C ATOM 0 H THR A 123 70.483 -19.532 4.523 1.00 1.00 H new ATOM 0 HA THR A 123 73.042 -19.293 3.926 1.00 1.00 H new ATOM 0 HB THR A 123 71.788 -20.773 2.556 1.00 1.00 H new ATOM 0 HG1 THR A 123 72.204 -18.534 0.800 1.00 1.00 H new ATOM 0 HG21 THR A 123 69.841 -20.057 1.193 1.00 1.00 H new ATOM 0 HG22 THR A 123 69.604 -19.653 2.910 1.00 1.00 H new ATOM 0 HG23 THR A 123 70.065 -18.383 1.753 1.00 1.00 H new ATOM 1826 N ASP A 124 73.567 -16.867 3.491 1.00 1.00 N ATOM 1827 CA ASP A 124 74.061 -15.564 3.044 1.00 1.00 C ATOM 1828 C ASP A 124 75.565 -15.496 3.281 1.00 1.00 C ATOM 1829 O ASP A 124 76.066 -16.027 4.272 1.00 1.00 O ATOM 1830 CB ASP A 124 73.357 -14.414 3.778 1.00 1.00 C ATOM 1831 CG ASP A 124 73.785 -14.374 5.236 1.00 1.00 C ATOM 1832 OD1 ASP A 124 73.747 -15.414 5.873 1.00 1.00 O ATOM 1833 OD2 ASP A 124 74.142 -13.302 5.695 1.00 1.00 O ATOM 0 H ASP A 124 74.061 -17.249 4.297 1.00 1.00 H new ATOM 0 HA ASP A 124 73.845 -15.455 1.981 1.00 1.00 H new ATOM 0 HB2 ASP A 124 73.597 -13.466 3.296 1.00 1.00 H new ATOM 0 HB3 ASP A 124 72.276 -14.540 3.713 1.00 1.00 H new ATOM 1838 N TYR A 125 76.292 -14.832 2.378 1.00 1.00 N ATOM 1839 CA TYR A 125 77.740 -14.706 2.507 1.00 1.00 C ATOM 1840 C TYR A 125 78.221 -13.403 1.850 1.00 1.00 C ATOM 1841 O TYR A 125 77.656 -12.938 0.859 1.00 1.00 O ATOM 1842 CB TYR A 125 78.424 -15.929 1.841 1.00 1.00 C ATOM 1843 CG TYR A 125 79.726 -15.514 1.180 1.00 1.00 C ATOM 1844 CD1 TYR A 125 79.701 -14.993 -0.119 1.00 1.00 C ATOM 1845 CD2 TYR A 125 80.938 -15.617 1.870 1.00 1.00 C ATOM 1846 CE1 TYR A 125 80.887 -14.578 -0.732 1.00 1.00 C ATOM 1847 CE2 TYR A 125 82.127 -15.196 1.259 1.00 1.00 C ATOM 1848 CZ TYR A 125 82.101 -14.677 -0.043 1.00 1.00 C ATOM 1849 OH TYR A 125 83.271 -14.259 -0.643 1.00 1.00 O ATOM 0 H TYR A 125 75.900 -14.376 1.554 1.00 1.00 H new ATOM 0 HA TYR A 125 78.006 -14.676 3.564 1.00 1.00 H new ATOM 0 HB2 TYR A 125 78.618 -16.697 2.590 1.00 1.00 H new ATOM 0 HB3 TYR A 125 77.756 -16.368 1.100 1.00 1.00 H new ATOM 0 HD1 TYR A 125 78.763 -14.911 -0.649 1.00 1.00 H new ATOM 0 HD2 TYR A 125 80.958 -16.020 2.872 1.00 1.00 H new ATOM 0 HE1 TYR A 125 80.866 -14.181 -1.736 1.00 1.00 H new ATOM 0 HE2 TYR A 125 83.064 -15.271 1.791 1.00 1.00 H new ATOM 0 HH TYR A 125 83.059 -13.712 -1.428 1.00 1.00 H new ATOM 1859 N ARG A 126 79.294 -12.846 2.399 1.00 1.00 N ATOM 1860 CA ARG A 126 79.892 -11.629 1.860 1.00 1.00 C ATOM 1861 C ARG A 126 81.395 -11.619 2.121 1.00 1.00 C ATOM 1862 O ARG A 126 81.863 -12.172 3.117 1.00 1.00 O ATOM 1863 CB ARG A 126 79.243 -10.386 2.476 1.00 1.00 C ATOM 1864 CG ARG A 126 77.761 -10.336 2.092 1.00 1.00 C ATOM 1865 CD ARG A 126 77.144 -9.022 2.565 1.00 1.00 C ATOM 1866 NE ARG A 126 75.837 -8.836 1.947 1.00 1.00 N ATOM 1867 CZ ARG A 126 74.771 -9.506 2.372 1.00 1.00 C ATOM 1868 NH1 ARG A 126 74.876 -10.334 3.374 1.00 1.00 N ATOM 1869 NH2 ARG A 126 73.619 -9.335 1.783 1.00 1.00 N ATOM 0 H ARG A 126 79.770 -13.219 3.220 1.00 1.00 H new ATOM 0 HA ARG A 126 79.719 -11.611 0.784 1.00 1.00 H new ATOM 0 HB2 ARG A 126 79.347 -10.409 3.561 1.00 1.00 H new ATOM 0 HB3 ARG A 126 79.750 -9.487 2.126 1.00 1.00 H new ATOM 0 HG2 ARG A 126 77.653 -10.430 1.011 1.00 1.00 H new ATOM 0 HG3 ARG A 126 77.232 -11.178 2.539 1.00 1.00 H new ATOM 0 HD2 ARG A 126 77.045 -9.027 3.650 1.00 1.00 H new ATOM 0 HD3 ARG A 126 77.799 -8.189 2.308 1.00 1.00 H new ATOM 0 HE ARG A 126 75.739 -8.179 1.173 1.00 1.00 H new ATOM 0 HH11 ARG A 126 75.777 -10.468 3.833 1.00 1.00 H new ATOM 0 HH12 ARG A 126 74.057 -10.848 3.699 1.00 1.00 H new ATOM 0 HH21 ARG A 126 73.538 -8.688 0.998 1.00 1.00 H new ATOM 0 HH22 ARG A 126 72.799 -9.848 2.107 1.00 1.00 H new ATOM 1883 N PHE A 127 82.152 -10.960 1.241 1.00 1.00 N ATOM 1884 CA PHE A 127 83.605 -10.857 1.396 1.00 1.00 C ATOM 1885 C PHE A 127 84.022 -9.388 1.290 1.00 1.00 C ATOM 1886 O PHE A 127 83.411 -8.673 0.513 1.00 1.00 O ATOM 1887 CB PHE A 127 84.312 -11.706 0.313 1.00 1.00 C ATOM 1888 CG PHE A 127 85.610 -11.048 -0.128 1.00 1.00 C ATOM 1889 CD1 PHE A 127 85.591 -10.115 -1.172 1.00 1.00 C ATOM 1890 CD2 PHE A 127 86.818 -11.357 0.510 1.00 1.00 C ATOM 1891 CE1 PHE A 127 86.777 -9.495 -1.582 1.00 1.00 C ATOM 1892 CE2 PHE A 127 88.005 -10.734 0.101 1.00 1.00 C ATOM 1893 CZ PHE A 127 87.984 -9.804 -0.946 1.00 1.00 C ATOM 1894 OXT PHE A 127 84.950 -9.005 1.983 1.00 1.00 O ATOM 0 H PHE A 127 81.783 -10.490 0.414 1.00 1.00 H new ATOM 0 HA PHE A 127 83.898 -11.238 2.374 1.00 1.00 H new ATOM 0 HB2 PHE A 127 84.519 -12.702 0.703 1.00 1.00 H new ATOM 0 HB3 PHE A 127 83.652 -11.831 -0.546 1.00 1.00 H new ATOM 0 HD1 PHE A 127 84.659 -9.873 -1.662 1.00 1.00 H new ATOM 0 HD2 PHE A 127 86.835 -12.075 1.317 1.00 1.00 H new ATOM 0 HE1 PHE A 127 86.760 -8.778 -2.389 1.00 1.00 H new ATOM 0 HE2 PHE A 127 88.936 -10.971 0.594 1.00 1.00 H new ATOM 0 HZ PHE A 127 88.899 -9.326 -1.262 1.00 1.00 H new