USER MOD reduce.3.24.130724 H: found=0, std=0, add=1006, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 1000 hydrogens (45 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 49 ASN : amide:sc= -13.1! C(o=-19!,f=-27!) USER MOD Set 1.2: A 54 GLN : amide:sc= -5.93! C(o=-19!,f=-26!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -130:sc= 1.43 (180deg=-0.652) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 HIS : no HE2:sc= -1.11 X(o=-1.1,f=-1.5) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0.0678 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 72 HIS : no HD1:sc= -8.55! C(o=-8.6!,f=-17!) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 HIS : no HD1:sc= -2.41! K(o=-2.4!,f=-1.6) USER MOD Single : A 99 GLN : amide:sc= -0.0706 K(o=-0.071,f=-0.75) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -5.81! C(o=-5.8!,f=-4.4!) USER MOD Single : A 113 ASN : amide:sc= -2.51 K(o=-2.5,f=-1.2) USER MOD Single : A 121 THR OG1 : rot -90:sc= -0.36 USER MOD Single : A 123 THR OG1 : rot -150:sc= 0 USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 78.245 22.684 -22.271 1.00 1.00 N ATOM 2 CA MET A 1 78.839 21.398 -22.737 1.00 1.00 C ATOM 3 C MET A 1 77.811 20.283 -22.571 1.00 1.00 C ATOM 4 O MET A 1 76.747 20.493 -21.990 1.00 1.00 O ATOM 5 CB MET A 1 80.096 21.081 -21.916 1.00 1.00 C ATOM 6 CG MET A 1 81.066 22.273 -21.942 1.00 1.00 C ATOM 7 SD MET A 1 80.693 23.386 -20.562 1.00 1.00 S ATOM 8 CE MET A 1 82.280 24.258 -20.539 1.00 1.00 C ATOM 0 H1 MET A 1 78.387 23.415 -22.997 1.00 1.00 H new ATOM 0 H2 MET A 1 77.227 22.556 -22.104 1.00 1.00 H new ATOM 0 H3 MET A 1 78.707 22.979 -21.387 1.00 1.00 H new ATOM 0 HA MET A 1 79.117 21.480 -23.788 1.00 1.00 H new ATOM 0 HB2 MET A 1 79.818 20.852 -20.887 1.00 1.00 H new ATOM 0 HB3 MET A 1 80.587 20.195 -22.318 1.00 1.00 H new ATOM 0 HG2 MET A 1 82.095 21.920 -21.870 1.00 1.00 H new ATOM 0 HG3 MET A 1 80.977 22.807 -22.888 1.00 1.00 H new ATOM 0 HE1 MET A 1 82.272 25.007 -19.747 1.00 1.00 H new ATOM 0 HE2 MET A 1 83.084 23.545 -20.356 1.00 1.00 H new ATOM 0 HE3 MET A 1 82.440 24.747 -21.500 1.00 1.00 H new ATOM 18 N SER A 2 78.133 19.097 -23.087 1.00 1.00 N ATOM 19 CA SER A 2 77.231 17.949 -22.997 1.00 1.00 C ATOM 20 C SER A 2 77.586 17.070 -21.802 1.00 1.00 C ATOM 21 O SER A 2 76.957 16.037 -21.579 1.00 1.00 O ATOM 22 CB SER A 2 77.324 17.116 -24.275 1.00 1.00 C ATOM 23 OG SER A 2 76.958 17.919 -25.388 1.00 1.00 O ATOM 0 H SER A 2 79.010 18.906 -23.571 1.00 1.00 H new ATOM 0 HA SER A 2 76.216 18.324 -22.869 1.00 1.00 H new ATOM 0 HB2 SER A 2 78.338 16.738 -24.403 1.00 1.00 H new ATOM 0 HB3 SER A 2 76.667 16.249 -24.206 1.00 1.00 H new ATOM 0 HG SER A 2 77.019 17.387 -26.209 1.00 1.00 H new ATOM 29 N ASP A 3 78.593 17.487 -21.041 1.00 1.00 N ATOM 30 CA ASP A 3 79.028 16.731 -19.869 1.00 1.00 C ATOM 31 C ASP A 3 80.347 17.289 -19.339 1.00 1.00 C ATOM 32 O ASP A 3 81.404 17.070 -19.931 1.00 1.00 O ATOM 33 CB ASP A 3 79.211 15.248 -20.238 1.00 1.00 C ATOM 34 CG ASP A 3 79.747 15.132 -21.659 1.00 1.00 C ATOM 35 OD1 ASP A 3 80.882 15.523 -21.876 1.00 1.00 O ATOM 36 OD2 ASP A 3 79.013 14.657 -22.511 1.00 1.00 O ATOM 0 H ASP A 3 79.123 18.342 -21.213 1.00 1.00 H new ATOM 0 HA ASP A 3 78.265 16.821 -19.095 1.00 1.00 H new ATOM 0 HB2 ASP A 3 79.900 14.772 -19.540 1.00 1.00 H new ATOM 0 HB3 ASP A 3 78.259 14.723 -20.155 1.00 1.00 H new ATOM 41 N PHE A 4 80.285 17.988 -18.209 1.00 1.00 N ATOM 42 CA PHE A 4 81.490 18.548 -17.599 1.00 1.00 C ATOM 43 C PHE A 4 81.324 18.599 -16.086 1.00 1.00 C ATOM 44 O PHE A 4 80.222 18.806 -15.582 1.00 1.00 O ATOM 45 CB PHE A 4 81.772 19.954 -18.138 1.00 1.00 C ATOM 46 CG PHE A 4 83.227 20.299 -17.904 1.00 1.00 C ATOM 47 CD1 PHE A 4 83.627 20.910 -16.709 1.00 1.00 C ATOM 48 CD2 PHE A 4 84.176 19.994 -18.887 1.00 1.00 C ATOM 49 CE1 PHE A 4 84.978 21.217 -16.499 1.00 1.00 C ATOM 50 CE2 PHE A 4 85.525 20.301 -18.677 1.00 1.00 C ATOM 51 CZ PHE A 4 85.926 20.914 -17.485 1.00 1.00 C ATOM 0 H PHE A 4 79.422 18.180 -17.700 1.00 1.00 H new ATOM 0 HA PHE A 4 82.335 17.907 -17.852 1.00 1.00 H new ATOM 0 HB2 PHE A 4 81.542 20.000 -19.203 1.00 1.00 H new ATOM 0 HB3 PHE A 4 81.130 20.681 -17.642 1.00 1.00 H new ATOM 0 HD1 PHE A 4 82.895 21.144 -15.950 1.00 1.00 H new ATOM 0 HD2 PHE A 4 83.867 19.522 -19.808 1.00 1.00 H new ATOM 0 HE1 PHE A 4 85.288 21.687 -15.577 1.00 1.00 H new ATOM 0 HE2 PHE A 4 86.257 20.065 -19.435 1.00 1.00 H new ATOM 0 HZ PHE A 4 86.967 21.154 -17.325 1.00 1.00 H new ATOM 61 N ASP A 5 82.418 18.388 -15.366 1.00 1.00 N ATOM 62 CA ASP A 5 82.370 18.393 -13.911 1.00 1.00 C ATOM 63 C ASP A 5 83.728 18.799 -13.342 1.00 1.00 C ATOM 64 O ASP A 5 84.769 18.487 -13.920 1.00 1.00 O ATOM 65 CB ASP A 5 82.008 16.987 -13.429 1.00 1.00 C ATOM 66 CG ASP A 5 80.805 16.466 -14.208 1.00 1.00 C ATOM 67 OD1 ASP A 5 79.729 17.013 -14.039 1.00 1.00 O ATOM 68 OD2 ASP A 5 80.980 15.526 -14.966 1.00 1.00 O ATOM 0 H ASP A 5 83.342 18.213 -15.762 1.00 1.00 H new ATOM 0 HA ASP A 5 81.622 19.109 -13.571 1.00 1.00 H new ATOM 0 HB2 ASP A 5 82.857 16.317 -13.563 1.00 1.00 H new ATOM 0 HB3 ASP A 5 81.782 17.005 -12.363 1.00 1.00 H new ATOM 73 N THR A 6 83.715 19.474 -12.193 1.00 1.00 N ATOM 74 CA THR A 6 84.948 19.903 -11.528 1.00 1.00 C ATOM 75 C THR A 6 85.227 18.984 -10.329 1.00 1.00 C ATOM 76 O THR A 6 84.643 17.938 -10.187 1.00 1.00 O ATOM 77 CB THR A 6 84.802 21.373 -11.052 1.00 1.00 C ATOM 78 OG1 THR A 6 83.763 21.997 -11.790 1.00 1.00 O ATOM 79 CG2 THR A 6 86.109 22.159 -11.266 1.00 1.00 C ATOM 0 H THR A 6 82.861 19.737 -11.701 1.00 1.00 H new ATOM 0 HA THR A 6 85.781 19.841 -12.228 1.00 1.00 H new ATOM 0 HB THR A 6 84.570 21.370 -9.987 1.00 1.00 H new ATOM 0 HG1 THR A 6 83.664 22.926 -11.494 1.00 1.00 H new ATOM 0 HG21 THR A 6 85.977 23.185 -10.923 1.00 1.00 H new ATOM 0 HG22 THR A 6 86.913 21.689 -10.700 1.00 1.00 H new ATOM 0 HG23 THR A 6 86.363 22.160 -12.326 1.00 1.00 H new ATOM 87 N GLU A 7 86.121 19.400 -9.475 1.00 1.00 N ATOM 88 CA GLU A 7 86.486 18.621 -8.291 1.00 1.00 C ATOM 89 C GLU A 7 85.261 18.377 -7.411 1.00 1.00 C ATOM 90 O GLU A 7 85.003 17.276 -6.958 1.00 1.00 O ATOM 91 CB GLU A 7 87.561 19.377 -7.493 1.00 1.00 C ATOM 92 CG GLU A 7 87.803 18.710 -6.131 1.00 1.00 C ATOM 93 CD GLU A 7 89.105 19.234 -5.531 1.00 1.00 C ATOM 94 OE1 GLU A 7 89.111 20.366 -5.074 1.00 1.00 O ATOM 95 OE2 GLU A 7 90.079 18.501 -5.548 1.00 1.00 O ATOM 0 H GLU A 7 86.624 20.283 -9.566 1.00 1.00 H new ATOM 0 HA GLU A 7 86.879 17.656 -8.610 1.00 1.00 H new ATOM 0 HB2 GLU A 7 88.491 19.401 -8.061 1.00 1.00 H new ATOM 0 HB3 GLU A 7 87.250 20.411 -7.346 1.00 1.00 H new ATOM 0 HG2 GLU A 7 86.971 18.919 -5.459 1.00 1.00 H new ATOM 0 HG3 GLU A 7 87.854 17.628 -6.248 1.00 1.00 H new ATOM 102 N ARG A 8 84.482 19.402 -7.191 1.00 1.00 N ATOM 103 CA ARG A 8 83.290 19.219 -6.376 1.00 1.00 C ATOM 104 C ARG A 8 82.287 18.326 -7.127 1.00 1.00 C ATOM 105 O ARG A 8 81.897 17.280 -6.656 1.00 1.00 O ATOM 106 CB ARG A 8 82.654 20.594 -6.060 1.00 1.00 C ATOM 107 CG ARG A 8 83.294 21.684 -6.931 1.00 1.00 C ATOM 108 CD ARG A 8 82.603 23.019 -6.648 1.00 1.00 C ATOM 109 NE ARG A 8 81.199 22.950 -7.038 1.00 1.00 N ATOM 110 CZ ARG A 8 80.826 23.126 -8.301 1.00 1.00 C ATOM 111 NH1 ARG A 8 81.722 23.331 -9.227 1.00 1.00 N ATOM 112 NH2 ARG A 8 79.559 23.079 -8.615 1.00 1.00 N ATOM 0 H ARG A 8 84.634 20.346 -7.546 1.00 1.00 H new ATOM 0 HA ARG A 8 83.561 18.736 -5.437 1.00 1.00 H new ATOM 0 HB2 ARG A 8 81.580 20.557 -6.241 1.00 1.00 H new ATOM 0 HB3 ARG A 8 82.791 20.833 -5.005 1.00 1.00 H new ATOM 0 HG2 ARG A 8 84.360 21.759 -6.717 1.00 1.00 H new ATOM 0 HG3 ARG A 8 83.198 21.427 -7.986 1.00 1.00 H new ATOM 0 HD2 ARG A 8 82.682 23.261 -5.588 1.00 1.00 H new ATOM 0 HD3 ARG A 8 83.102 23.819 -7.196 1.00 1.00 H new ATOM 0 HE ARG A 8 80.491 22.763 -6.328 1.00 1.00 H new ATOM 0 HH11 ARG A 8 82.712 23.356 -8.982 1.00 1.00 H new ATOM 0 HH12 ARG A 8 81.433 23.466 -10.196 1.00 1.00 H new ATOM 0 HH21 ARG A 8 78.860 22.908 -7.892 1.00 1.00 H new ATOM 0 HH22 ARG A 8 79.268 23.214 -9.583 1.00 1.00 H new ATOM 126 N VAL A 9 81.876 18.800 -8.292 1.00 1.00 N ATOM 127 CA VAL A 9 80.902 18.055 -9.087 1.00 1.00 C ATOM 128 C VAL A 9 81.508 16.723 -9.585 1.00 1.00 C ATOM 129 O VAL A 9 80.923 15.693 -9.384 1.00 1.00 O ATOM 130 CB VAL A 9 80.308 18.911 -10.244 1.00 1.00 C ATOM 131 CG1 VAL A 9 78.912 19.446 -9.839 1.00 1.00 C ATOM 132 CG2 VAL A 9 81.225 20.110 -10.548 1.00 1.00 C ATOM 0 H VAL A 9 82.191 19.678 -8.705 1.00 1.00 H new ATOM 0 HA VAL A 9 80.061 17.809 -8.439 1.00 1.00 H new ATOM 0 HB VAL A 9 80.225 18.281 -11.130 1.00 1.00 H new ATOM 0 HG11 VAL A 9 78.502 20.044 -10.653 1.00 1.00 H new ATOM 0 HG12 VAL A 9 78.247 18.607 -9.634 1.00 1.00 H new ATOM 0 HG13 VAL A 9 79.004 20.063 -8.945 1.00 1.00 H new ATOM 0 HG21 VAL A 9 80.797 20.699 -11.359 1.00 1.00 H new ATOM 0 HG22 VAL A 9 81.318 20.732 -9.658 1.00 1.00 H new ATOM 0 HG23 VAL A 9 82.210 19.749 -10.843 1.00 1.00 H new ATOM 142 N SER A 10 82.689 16.758 -10.197 1.00 1.00 N ATOM 143 CA SER A 10 83.317 15.497 -10.676 1.00 1.00 C ATOM 144 C SER A 10 83.693 14.577 -9.494 1.00 1.00 C ATOM 145 O SER A 10 83.229 13.460 -9.406 1.00 1.00 O ATOM 146 CB SER A 10 84.609 15.763 -11.498 1.00 1.00 C ATOM 147 OG SER A 10 84.843 14.668 -12.374 1.00 1.00 O ATOM 0 H SER A 10 83.227 17.606 -10.376 1.00 1.00 H new ATOM 0 HA SER A 10 82.574 15.016 -11.312 1.00 1.00 H new ATOM 0 HB2 SER A 10 84.506 16.685 -12.070 1.00 1.00 H new ATOM 0 HB3 SER A 10 85.459 15.896 -10.828 1.00 1.00 H new ATOM 0 HG SER A 10 85.656 14.834 -12.895 1.00 1.00 H new ATOM 153 N ARG A 11 84.583 15.041 -8.631 1.00 1.00 N ATOM 154 CA ARG A 11 85.057 14.221 -7.502 1.00 1.00 C ATOM 155 C ARG A 11 83.919 13.909 -6.501 1.00 1.00 C ATOM 156 O ARG A 11 83.787 12.765 -6.080 1.00 1.00 O ATOM 157 CB ARG A 11 86.276 14.901 -6.806 1.00 1.00 C ATOM 158 CG ARG A 11 87.607 14.258 -7.242 1.00 1.00 C ATOM 159 CD ARG A 11 87.878 12.999 -6.417 1.00 1.00 C ATOM 160 NE ARG A 11 89.017 12.270 -6.974 1.00 1.00 N ATOM 161 CZ ARG A 11 90.271 12.705 -6.822 1.00 1.00 C ATOM 162 NH1 ARG A 11 90.514 13.799 -6.152 1.00 1.00 N ATOM 163 NH2 ARG A 11 91.264 12.037 -7.349 1.00 1.00 N ATOM 0 H ARG A 11 84.995 15.973 -8.680 1.00 1.00 H new ATOM 0 HA ARG A 11 85.391 13.262 -7.898 1.00 1.00 H new ATOM 0 HB2 ARG A 11 86.288 15.964 -7.048 1.00 1.00 H new ATOM 0 HB3 ARG A 11 86.170 14.821 -5.724 1.00 1.00 H new ATOM 0 HG2 ARG A 11 87.568 14.006 -8.302 1.00 1.00 H new ATOM 0 HG3 ARG A 11 88.423 14.969 -7.113 1.00 1.00 H new ATOM 0 HD2 ARG A 11 88.081 13.270 -5.381 1.00 1.00 H new ATOM 0 HD3 ARG A 11 86.995 12.361 -6.412 1.00 1.00 H new ATOM 0 HE ARG A 11 88.850 11.407 -7.492 1.00 1.00 H new ATOM 0 HH11 ARG A 11 89.744 14.327 -5.741 1.00 1.00 H new ATOM 0 HH12 ARG A 11 91.474 14.126 -6.040 1.00 1.00 H new ATOM 0 HH21 ARG A 11 91.081 11.183 -7.877 1.00 1.00 H new ATOM 0 HH22 ARG A 11 92.221 12.370 -7.233 1.00 1.00 H new ATOM 177 N ALA A 12 83.050 14.888 -6.193 1.00 1.00 N ATOM 178 CA ALA A 12 81.908 14.557 -5.307 1.00 1.00 C ATOM 179 C ALA A 12 80.956 13.651 -6.079 1.00 1.00 C ATOM 180 O ALA A 12 80.601 12.576 -5.614 1.00 1.00 O ATOM 181 CB ALA A 12 81.108 15.760 -4.755 1.00 1.00 C ATOM 0 H ALA A 12 83.102 15.854 -6.516 1.00 1.00 H new ATOM 0 HA ALA A 12 82.344 14.080 -4.430 1.00 1.00 H new ATOM 0 HB1 ALA A 12 80.298 15.398 -4.121 1.00 1.00 H new ATOM 0 HB2 ALA A 12 81.769 16.399 -4.170 1.00 1.00 H new ATOM 0 HB3 ALA A 12 80.692 16.331 -5.585 1.00 1.00 H new ATOM 187 N VAL A 13 80.528 14.103 -7.265 1.00 1.00 N ATOM 188 CA VAL A 13 79.600 13.261 -8.009 1.00 1.00 C ATOM 189 C VAL A 13 80.291 11.947 -8.324 1.00 1.00 C ATOM 190 O VAL A 13 79.816 10.912 -7.953 1.00 1.00 O ATOM 191 CB VAL A 13 79.093 13.872 -9.333 1.00 1.00 C ATOM 192 CG1 VAL A 13 78.110 12.888 -9.984 1.00 1.00 C ATOM 193 CG2 VAL A 13 78.365 15.204 -9.073 1.00 1.00 C ATOM 0 H VAL A 13 80.790 14.986 -7.702 1.00 1.00 H new ATOM 0 HA VAL A 13 78.724 13.137 -7.373 1.00 1.00 H new ATOM 0 HB VAL A 13 79.945 14.058 -9.987 1.00 1.00 H new ATOM 0 HG11 VAL A 13 77.743 13.307 -10.921 1.00 1.00 H new ATOM 0 HG12 VAL A 13 78.618 11.944 -10.182 1.00 1.00 H new ATOM 0 HG13 VAL A 13 77.270 12.714 -9.311 1.00 1.00 H new ATOM 0 HG21 VAL A 13 78.016 15.618 -10.019 1.00 1.00 H new ATOM 0 HG22 VAL A 13 77.513 15.031 -8.416 1.00 1.00 H new ATOM 0 HG23 VAL A 13 79.051 15.907 -8.600 1.00 1.00 H new ATOM 203 N ALA A 14 81.448 11.982 -8.959 1.00 1.00 N ATOM 204 CA ALA A 14 82.122 10.714 -9.258 1.00 1.00 C ATOM 205 C ALA A 14 82.355 9.936 -7.975 1.00 1.00 C ATOM 206 O ALA A 14 81.855 8.842 -7.831 1.00 1.00 O ATOM 207 CB ALA A 14 83.485 10.916 -9.955 1.00 1.00 C ATOM 0 H ALA A 14 81.929 12.826 -9.269 1.00 1.00 H new ATOM 0 HA ALA A 14 81.468 10.166 -9.936 1.00 1.00 H new ATOM 0 HB1 ALA A 14 83.940 9.945 -10.153 1.00 1.00 H new ATOM 0 HB2 ALA A 14 83.337 11.446 -10.896 1.00 1.00 H new ATOM 0 HB3 ALA A 14 84.141 11.499 -9.309 1.00 1.00 H new ATOM 213 N ALA A 15 83.139 10.500 -7.065 1.00 1.00 N ATOM 214 CA ALA A 15 83.449 9.752 -5.832 1.00 1.00 C ATOM 215 C ALA A 15 82.161 9.328 -5.124 1.00 1.00 C ATOM 216 O ALA A 15 81.964 8.160 -4.826 1.00 1.00 O ATOM 217 CB ALA A 15 84.338 10.522 -4.847 1.00 1.00 C ATOM 0 H ALA A 15 83.559 11.427 -7.139 1.00 1.00 H new ATOM 0 HA ALA A 15 84.014 8.877 -6.154 1.00 1.00 H new ATOM 0 HB1 ALA A 15 84.522 9.907 -3.966 1.00 1.00 H new ATOM 0 HB2 ALA A 15 85.287 10.763 -5.326 1.00 1.00 H new ATOM 0 HB3 ALA A 15 83.837 11.443 -4.549 1.00 1.00 H new ATOM 223 N ALA A 16 81.315 10.302 -4.830 1.00 1.00 N ATOM 224 CA ALA A 16 80.072 9.995 -4.133 1.00 1.00 C ATOM 225 C ALA A 16 79.161 9.126 -5.032 1.00 1.00 C ATOM 226 O ALA A 16 78.735 8.039 -4.642 1.00 1.00 O ATOM 227 CB ALA A 16 79.341 11.285 -3.712 1.00 1.00 C ATOM 0 H ALA A 16 81.457 11.287 -5.055 1.00 1.00 H new ATOM 0 HA ALA A 16 80.314 9.436 -3.229 1.00 1.00 H new ATOM 0 HB1 ALA A 16 78.417 11.027 -3.194 1.00 1.00 H new ATOM 0 HB2 ALA A 16 79.980 11.865 -3.046 1.00 1.00 H new ATOM 0 HB3 ALA A 16 79.108 11.877 -4.597 1.00 1.00 H new ATOM 233 N LEU A 17 78.876 9.643 -6.226 1.00 1.00 N ATOM 234 CA LEU A 17 77.992 8.905 -7.160 1.00 1.00 C ATOM 235 C LEU A 17 78.587 7.518 -7.411 1.00 1.00 C ATOM 236 O LEU A 17 77.932 6.510 -7.168 1.00 1.00 O ATOM 237 CB LEU A 17 77.813 9.620 -8.521 1.00 1.00 C ATOM 238 CG LEU A 17 76.629 9.026 -9.313 1.00 1.00 C ATOM 239 CD1 LEU A 17 75.318 9.695 -8.898 1.00 1.00 C ATOM 240 CD2 LEU A 17 76.837 9.275 -10.815 1.00 1.00 C ATOM 0 H LEU A 17 79.224 10.537 -6.572 1.00 1.00 H new ATOM 0 HA LEU A 17 77.009 8.845 -6.693 1.00 1.00 H new ATOM 0 HB2 LEU A 17 77.646 10.684 -8.356 1.00 1.00 H new ATOM 0 HB3 LEU A 17 78.728 9.528 -9.106 1.00 1.00 H new ATOM 0 HG LEU A 17 76.580 7.957 -9.104 1.00 1.00 H new ATOM 0 HD11 LEU A 17 74.494 9.264 -9.466 1.00 1.00 H new ATOM 0 HD12 LEU A 17 75.148 9.534 -7.833 1.00 1.00 H new ATOM 0 HD13 LEU A 17 75.376 10.765 -9.098 1.00 1.00 H new ATOM 0 HD21 LEU A 17 76.000 8.855 -11.373 1.00 1.00 H new ATOM 0 HD22 LEU A 17 76.896 10.347 -11.001 1.00 1.00 H new ATOM 0 HD23 LEU A 17 77.763 8.800 -11.138 1.00 1.00 H new ATOM 252 N VAL A 18 79.834 7.455 -7.903 1.00 1.00 N ATOM 253 CA VAL A 18 80.436 6.143 -8.167 1.00 1.00 C ATOM 254 C VAL A 18 80.782 5.435 -6.863 1.00 1.00 C ATOM 255 O VAL A 18 80.333 4.314 -6.621 1.00 1.00 O ATOM 256 CB VAL A 18 81.663 6.231 -9.140 1.00 1.00 C ATOM 257 CG1 VAL A 18 81.415 7.318 -10.227 1.00 1.00 C ATOM 258 CG2 VAL A 18 83.010 6.504 -8.406 1.00 1.00 C ATOM 0 H VAL A 18 80.422 8.260 -8.118 1.00 1.00 H new ATOM 0 HA VAL A 18 79.690 5.539 -8.684 1.00 1.00 H new ATOM 0 HB VAL A 18 81.755 5.252 -9.611 1.00 1.00 H new ATOM 0 HG11 VAL A 18 82.275 7.368 -10.895 1.00 1.00 H new ATOM 0 HG12 VAL A 18 80.524 7.062 -10.801 1.00 1.00 H new ATOM 0 HG13 VAL A 18 81.272 8.286 -9.747 1.00 1.00 H new ATOM 0 HG21 VAL A 18 83.818 6.553 -9.136 1.00 1.00 H new ATOM 0 HG22 VAL A 18 82.947 7.451 -7.870 1.00 1.00 H new ATOM 0 HG23 VAL A 18 83.208 5.699 -7.698 1.00 1.00 H new ATOM 268 N GLY A 19 81.611 6.060 -6.038 1.00 1.00 N ATOM 269 CA GLY A 19 82.035 5.440 -4.794 1.00 1.00 C ATOM 270 C GLY A 19 80.856 5.051 -3.918 1.00 1.00 C ATOM 271 O GLY A 19 79.704 5.126 -4.337 1.00 1.00 O ATOM 0 H GLY A 19 81.999 6.988 -6.207 1.00 1.00 H new ATOM 0 HA2 GLY A 19 82.629 4.554 -5.015 1.00 1.00 H new ATOM 0 HA3 GLY A 19 82.680 6.128 -4.248 1.00 1.00 H new ATOM 275 N PRO A 20 81.133 4.616 -2.716 1.00 1.00 N ATOM 276 CA PRO A 20 80.100 4.178 -1.760 1.00 1.00 C ATOM 277 C PRO A 20 79.437 5.353 -1.034 1.00 1.00 C ATOM 278 O PRO A 20 78.366 5.188 -0.493 1.00 1.00 O ATOM 279 CB PRO A 20 80.866 3.241 -0.783 1.00 1.00 C ATOM 280 CG PRO A 20 82.319 3.308 -1.184 1.00 1.00 C ATOM 281 CD PRO A 20 82.459 4.519 -2.102 1.00 1.00 C ATOM 0 HA PRO A 20 79.270 3.674 -2.255 1.00 1.00 H new ATOM 0 HB2 PRO A 20 80.732 3.563 0.250 1.00 1.00 H new ATOM 0 HB3 PRO A 20 80.491 2.220 -0.849 1.00 1.00 H new ATOM 0 HG2 PRO A 20 82.959 3.409 -0.308 1.00 1.00 H new ATOM 0 HG3 PRO A 20 82.623 2.395 -1.697 1.00 1.00 H new ATOM 0 HD2 PRO A 20 82.714 5.421 -1.546 1.00 1.00 H new ATOM 0 HD3 PRO A 20 83.240 4.373 -2.848 1.00 1.00 H new ATOM 289 N GLY A 21 80.107 6.519 -0.970 1.00 1.00 N ATOM 290 CA GLY A 21 79.535 7.651 -0.212 1.00 1.00 C ATOM 291 C GLY A 21 78.214 8.149 -0.794 1.00 1.00 C ATOM 292 O GLY A 21 77.181 8.104 -0.128 1.00 1.00 O ATOM 0 H GLY A 21 81.008 6.701 -1.413 1.00 1.00 H new ATOM 0 HA2 GLY A 21 79.378 7.347 0.823 1.00 1.00 H new ATOM 0 HA3 GLY A 21 80.252 8.472 -0.198 1.00 1.00 H new ATOM 296 N GLY A 22 78.242 8.629 -2.024 1.00 1.00 N ATOM 297 CA GLY A 22 76.996 9.136 -2.621 1.00 1.00 C ATOM 298 C GLY A 22 75.994 8.008 -2.532 1.00 1.00 C ATOM 299 O GLY A 22 74.890 8.176 -2.021 1.00 1.00 O ATOM 0 H GLY A 22 79.070 8.683 -2.617 1.00 1.00 H new ATOM 0 HA2 GLY A 22 76.639 10.016 -2.087 1.00 1.00 H new ATOM 0 HA3 GLY A 22 77.155 9.434 -3.657 1.00 1.00 H new ATOM 303 N VAL A 23 76.403 6.852 -3.019 1.00 1.00 N ATOM 304 CA VAL A 23 75.526 5.696 -2.947 1.00 1.00 C ATOM 305 C VAL A 23 75.168 5.429 -1.469 1.00 1.00 C ATOM 306 O VAL A 23 74.061 4.980 -1.179 1.00 1.00 O ATOM 307 CB VAL A 23 76.121 4.443 -3.601 1.00 1.00 C ATOM 308 CG1 VAL A 23 75.048 3.354 -3.604 1.00 1.00 C ATOM 309 CG2 VAL A 23 76.517 4.737 -5.053 1.00 1.00 C ATOM 0 H VAL A 23 77.310 6.688 -3.457 1.00 1.00 H new ATOM 0 HA VAL A 23 74.626 5.926 -3.517 1.00 1.00 H new ATOM 0 HB VAL A 23 77.005 4.128 -3.046 1.00 1.00 H new ATOM 0 HG11 VAL A 23 75.448 2.451 -4.065 1.00 1.00 H new ATOM 0 HG12 VAL A 23 74.748 3.136 -2.579 1.00 1.00 H new ATOM 0 HG13 VAL A 23 74.182 3.698 -4.170 1.00 1.00 H new ATOM 0 HG21 VAL A 23 76.938 3.839 -5.504 1.00 1.00 H new ATOM 0 HG22 VAL A 23 75.636 5.047 -5.615 1.00 1.00 H new ATOM 0 HG23 VAL A 23 77.259 5.535 -5.073 1.00 1.00 H new ATOM 319 N ALA A 24 76.100 5.741 -0.535 1.00 1.00 N ATOM 320 CA ALA A 24 75.773 5.525 0.893 1.00 1.00 C ATOM 321 C ALA A 24 74.547 6.370 1.277 1.00 1.00 C ATOM 322 O ALA A 24 73.526 5.820 1.673 1.00 1.00 O ATOM 323 CB ALA A 24 76.916 5.905 1.865 1.00 1.00 C ATOM 0 H ALA A 24 77.028 6.120 -0.727 1.00 1.00 H new ATOM 0 HA ALA A 24 75.589 4.455 0.991 1.00 1.00 H new ATOM 0 HB1 ALA A 24 76.599 5.718 2.891 1.00 1.00 H new ATOM 0 HB2 ALA A 24 77.798 5.304 1.643 1.00 1.00 H new ATOM 0 HB3 ALA A 24 77.158 6.961 1.747 1.00 1.00 H new ATOM 329 N LEU A 25 74.639 7.707 1.180 1.00 1.00 N ATOM 330 CA LEU A 25 73.509 8.578 1.565 1.00 1.00 C ATOM 331 C LEU A 25 72.256 8.309 0.744 1.00 1.00 C ATOM 332 O LEU A 25 71.164 8.168 1.296 1.00 1.00 O ATOM 333 CB LEU A 25 73.923 10.084 1.429 1.00 1.00 C ATOM 334 CG LEU A 25 72.743 10.987 0.969 1.00 1.00 C ATOM 335 CD1 LEU A 25 71.546 10.892 1.945 1.00 1.00 C ATOM 336 CD2 LEU A 25 73.232 12.442 0.890 1.00 1.00 C ATOM 0 H LEU A 25 75.465 8.203 0.846 1.00 1.00 H new ATOM 0 HA LEU A 25 73.268 8.350 2.603 1.00 1.00 H new ATOM 0 HB2 LEU A 25 74.298 10.442 2.388 1.00 1.00 H new ATOM 0 HB3 LEU A 25 74.742 10.169 0.714 1.00 1.00 H new ATOM 0 HG LEU A 25 72.404 10.646 -0.009 1.00 1.00 H new ATOM 0 HD11 LEU A 25 70.739 11.535 1.594 1.00 1.00 H new ATOM 0 HD12 LEU A 25 71.195 9.861 1.991 1.00 1.00 H new ATOM 0 HD13 LEU A 25 71.860 11.213 2.938 1.00 1.00 H new ATOM 0 HD21 LEU A 25 72.412 13.084 0.568 1.00 1.00 H new ATOM 0 HD22 LEU A 25 73.580 12.763 1.872 1.00 1.00 H new ATOM 0 HD23 LEU A 25 74.051 12.512 0.174 1.00 1.00 H new ATOM 348 N VAL A 26 72.394 8.284 -0.561 1.00 1.00 N ATOM 349 CA VAL A 26 71.222 8.093 -1.386 1.00 1.00 C ATOM 350 C VAL A 26 70.523 6.789 -1.030 1.00 1.00 C ATOM 351 O VAL A 26 69.348 6.794 -0.668 1.00 1.00 O ATOM 352 CB VAL A 26 71.671 8.079 -2.835 1.00 1.00 C ATOM 353 CG1 VAL A 26 70.487 7.756 -3.743 1.00 1.00 C ATOM 354 CG2 VAL A 26 72.235 9.461 -3.163 1.00 1.00 C ATOM 0 H VAL A 26 73.276 8.390 -1.063 1.00 1.00 H new ATOM 0 HA VAL A 26 70.510 8.901 -1.220 1.00 1.00 H new ATOM 0 HB VAL A 26 72.434 7.317 -2.993 1.00 1.00 H new ATOM 0 HG11 VAL A 26 70.817 7.748 -4.782 1.00 1.00 H new ATOM 0 HG12 VAL A 26 70.085 6.777 -3.482 1.00 1.00 H new ATOM 0 HG13 VAL A 26 69.713 8.512 -3.614 1.00 1.00 H new ATOM 0 HG21 VAL A 26 72.567 9.482 -4.201 1.00 1.00 H new ATOM 0 HG22 VAL A 26 71.461 10.214 -3.014 1.00 1.00 H new ATOM 0 HG23 VAL A 26 73.080 9.674 -2.508 1.00 1.00 H new ATOM 364 N VAL A 27 71.226 5.679 -1.159 1.00 1.00 N ATOM 365 CA VAL A 27 70.626 4.385 -0.881 1.00 1.00 C ATOM 366 C VAL A 27 70.102 4.316 0.556 1.00 1.00 C ATOM 367 O VAL A 27 69.073 3.704 0.819 1.00 1.00 O ATOM 368 CB VAL A 27 71.652 3.268 -1.166 1.00 1.00 C ATOM 369 CG1 VAL A 27 72.538 3.017 0.059 1.00 1.00 C ATOM 370 CG2 VAL A 27 70.910 1.982 -1.533 1.00 1.00 C ATOM 0 H VAL A 27 72.203 5.645 -1.451 1.00 1.00 H new ATOM 0 HA VAL A 27 69.768 4.243 -1.538 1.00 1.00 H new ATOM 0 HB VAL A 27 72.288 3.581 -1.994 1.00 1.00 H new ATOM 0 HG11 VAL A 27 73.253 2.226 -0.165 1.00 1.00 H new ATOM 0 HG12 VAL A 27 73.075 3.931 0.313 1.00 1.00 H new ATOM 0 HG13 VAL A 27 71.916 2.716 0.902 1.00 1.00 H new ATOM 0 HG21 VAL A 27 71.632 1.191 -1.735 1.00 1.00 H new ATOM 0 HG22 VAL A 27 70.267 1.684 -0.705 1.00 1.00 H new ATOM 0 HG23 VAL A 27 70.302 2.154 -2.421 1.00 1.00 H new ATOM 380 N LYS A 28 70.824 4.939 1.471 1.00 1.00 N ATOM 381 CA LYS A 28 70.411 4.926 2.873 1.00 1.00 C ATOM 382 C LYS A 28 69.099 5.690 3.035 1.00 1.00 C ATOM 383 O LYS A 28 68.116 5.173 3.564 1.00 1.00 O ATOM 384 CB LYS A 28 71.501 5.611 3.698 1.00 1.00 C ATOM 385 CG LYS A 28 71.175 5.550 5.190 1.00 1.00 C ATOM 386 CD LYS A 28 72.318 6.230 5.994 1.00 1.00 C ATOM 387 CE LYS A 28 72.689 5.388 7.218 1.00 1.00 C ATOM 388 NZ LYS A 28 73.687 6.130 8.038 1.00 1.00 N ATOM 0 H LYS A 28 71.684 5.453 1.279 1.00 1.00 H new ATOM 0 HA LYS A 28 70.265 3.899 3.209 1.00 1.00 H new ATOM 0 HB2 LYS A 28 72.461 5.129 3.511 1.00 1.00 H new ATOM 0 HB3 LYS A 28 71.600 6.651 3.385 1.00 1.00 H new ATOM 0 HG2 LYS A 28 70.228 6.052 5.388 1.00 1.00 H new ATOM 0 HG3 LYS A 28 71.059 4.513 5.507 1.00 1.00 H new ATOM 0 HD2 LYS A 28 73.192 6.359 5.356 1.00 1.00 H new ATOM 0 HD3 LYS A 28 72.005 7.225 6.311 1.00 1.00 H new ATOM 0 HE2 LYS A 28 71.800 5.175 7.811 1.00 1.00 H new ATOM 0 HE3 LYS A 28 73.100 4.429 6.904 1.00 1.00 H new ATOM 0 HZ1 LYS A 28 73.943 5.562 8.871 1.00 1.00 H new ATOM 0 HZ2 LYS A 28 74.538 6.312 7.468 1.00 1.00 H new ATOM 0 HZ3 LYS A 28 73.278 7.035 8.348 1.00 1.00 H new ATOM 402 N VAL A 29 69.117 6.942 2.606 1.00 1.00 N ATOM 403 CA VAL A 29 67.924 7.787 2.757 1.00 1.00 C ATOM 404 C VAL A 29 66.763 7.239 1.954 1.00 1.00 C ATOM 405 O VAL A 29 65.657 7.110 2.475 1.00 1.00 O ATOM 406 CB VAL A 29 68.191 9.263 2.383 1.00 1.00 C ATOM 407 CG1 VAL A 29 66.854 10.003 2.176 1.00 1.00 C ATOM 408 CG2 VAL A 29 68.935 9.931 3.540 1.00 1.00 C ATOM 0 H VAL A 29 69.916 7.394 2.161 1.00 1.00 H new ATOM 0 HA VAL A 29 67.661 7.765 3.815 1.00 1.00 H new ATOM 0 HB VAL A 29 68.778 9.303 1.466 1.00 1.00 H new ATOM 0 HG11 VAL A 29 67.050 11.042 1.913 1.00 1.00 H new ATOM 0 HG12 VAL A 29 66.294 9.525 1.372 1.00 1.00 H new ATOM 0 HG13 VAL A 29 66.271 9.966 3.096 1.00 1.00 H new ATOM 0 HG21 VAL A 29 69.132 10.974 3.292 1.00 1.00 H new ATOM 0 HG22 VAL A 29 68.325 9.881 4.442 1.00 1.00 H new ATOM 0 HG23 VAL A 29 69.880 9.415 3.712 1.00 1.00 H new ATOM 418 N CYS A 30 66.995 6.928 0.696 1.00 1.00 N ATOM 419 CA CYS A 30 65.907 6.413 -0.110 1.00 1.00 C ATOM 420 C CYS A 30 65.438 5.081 0.463 1.00 1.00 C ATOM 421 O CYS A 30 64.282 4.944 0.861 1.00 1.00 O ATOM 422 CB CYS A 30 66.415 6.245 -1.547 1.00 1.00 C ATOM 423 SG CYS A 30 65.222 5.329 -2.552 1.00 1.00 S ATOM 0 H CYS A 30 67.893 7.018 0.222 1.00 1.00 H new ATOM 0 HA CYS A 30 65.060 7.100 -0.105 1.00 1.00 H new ATOM 0 HB2 CYS A 30 66.594 7.225 -1.990 1.00 1.00 H new ATOM 0 HB3 CYS A 30 67.370 5.719 -1.540 1.00 1.00 H new ATOM 428 N ALA A 31 66.320 4.100 0.491 1.00 1.00 N ATOM 429 CA ALA A 31 65.949 2.789 0.988 1.00 1.00 C ATOM 430 C ALA A 31 65.451 2.875 2.426 1.00 1.00 C ATOM 431 O ALA A 31 64.391 2.344 2.756 1.00 1.00 O ATOM 432 CB ALA A 31 67.150 1.833 0.895 1.00 1.00 C ATOM 0 H ALA A 31 67.288 4.184 0.179 1.00 1.00 H new ATOM 0 HA ALA A 31 65.138 2.402 0.371 1.00 1.00 H new ATOM 0 HB1 ALA A 31 66.863 0.851 1.270 1.00 1.00 H new ATOM 0 HB2 ALA A 31 67.466 1.746 -0.144 1.00 1.00 H new ATOM 0 HB3 ALA A 31 67.973 2.224 1.493 1.00 1.00 H new ATOM 438 N GLY A 32 66.217 3.517 3.294 1.00 1.00 N ATOM 439 CA GLY A 32 65.810 3.601 4.690 1.00 1.00 C ATOM 440 C GLY A 32 66.043 2.246 5.333 1.00 1.00 C ATOM 441 O GLY A 32 65.098 1.528 5.655 1.00 1.00 O ATOM 0 H GLY A 32 67.099 3.976 3.068 1.00 1.00 H new ATOM 0 HA2 GLY A 32 66.382 4.371 5.207 1.00 1.00 H new ATOM 0 HA3 GLY A 32 64.759 3.881 4.764 1.00 1.00 H new ATOM 445 N LEU A 33 67.321 1.907 5.453 1.00 1.00 N ATOM 446 CA LEU A 33 67.756 0.616 6.004 1.00 1.00 C ATOM 447 C LEU A 33 67.986 -0.386 4.857 1.00 1.00 C ATOM 448 O LEU A 33 67.105 -1.194 4.568 1.00 1.00 O ATOM 449 CB LEU A 33 66.706 0.045 6.994 1.00 1.00 C ATOM 450 CG LEU A 33 67.360 -0.968 7.965 1.00 1.00 C ATOM 451 CD1 LEU A 33 68.476 -0.295 8.793 1.00 1.00 C ATOM 452 CD2 LEU A 33 66.289 -1.533 8.922 1.00 1.00 C ATOM 0 H LEU A 33 68.090 2.515 5.173 1.00 1.00 H new ATOM 0 HA LEU A 33 68.687 0.774 6.549 1.00 1.00 H new ATOM 0 HB2 LEU A 33 66.254 0.859 7.561 1.00 1.00 H new ATOM 0 HB3 LEU A 33 65.904 -0.442 6.440 1.00 1.00 H new ATOM 0 HG LEU A 33 67.798 -1.774 7.376 1.00 1.00 H new ATOM 0 HD11 LEU A 33 68.920 -1.027 9.468 1.00 1.00 H new ATOM 0 HD12 LEU A 33 69.243 0.093 8.123 1.00 1.00 H new ATOM 0 HD13 LEU A 33 68.054 0.525 9.374 1.00 1.00 H new ATOM 0 HD21 LEU A 33 66.751 -2.246 9.605 1.00 1.00 H new ATOM 0 HD22 LEU A 33 65.846 -0.718 9.494 1.00 1.00 H new ATOM 0 HD23 LEU A 33 65.513 -2.035 8.344 1.00 1.00 H new ATOM 464 N PRO A 34 69.125 -0.357 4.178 1.00 1.00 N ATOM 465 CA PRO A 34 69.389 -1.303 3.041 1.00 1.00 C ATOM 466 C PRO A 34 69.220 -2.787 3.411 1.00 1.00 C ATOM 467 O PRO A 34 69.018 -3.619 2.527 1.00 1.00 O ATOM 468 CB PRO A 34 70.846 -0.996 2.617 1.00 1.00 C ATOM 469 CG PRO A 34 71.433 -0.213 3.747 1.00 1.00 C ATOM 470 CD PRO A 34 70.275 0.559 4.375 1.00 1.00 C ATOM 0 HA PRO A 34 68.664 -1.152 2.241 1.00 1.00 H new ATOM 0 HB2 PRO A 34 71.406 -1.915 2.443 1.00 1.00 H new ATOM 0 HB3 PRO A 34 70.873 -0.426 1.688 1.00 1.00 H new ATOM 0 HG2 PRO A 34 71.902 -0.873 4.476 1.00 1.00 H new ATOM 0 HG3 PRO A 34 72.206 0.467 3.389 1.00 1.00 H new ATOM 0 HD2 PRO A 34 70.452 0.765 5.431 1.00 1.00 H new ATOM 0 HD3 PRO A 34 70.116 1.519 3.885 1.00 1.00 H new ATOM 478 N GLY A 35 69.334 -3.134 4.691 1.00 1.00 N ATOM 479 CA GLY A 35 69.207 -4.555 5.030 1.00 1.00 C ATOM 480 C GLY A 35 67.803 -5.056 4.661 1.00 1.00 C ATOM 481 O GLY A 35 67.660 -5.879 3.766 1.00 1.00 O ATOM 0 H GLY A 35 69.504 -2.498 5.470 1.00 1.00 H new ATOM 0 HA2 GLY A 35 69.961 -5.134 4.497 1.00 1.00 H new ATOM 0 HA3 GLY A 35 69.387 -4.701 6.095 1.00 1.00 H new ATOM 485 N VAL A 36 66.756 -4.495 5.268 1.00 1.00 N ATOM 486 CA VAL A 36 65.386 -4.880 4.902 1.00 1.00 C ATOM 487 C VAL A 36 64.872 -3.873 3.877 1.00 1.00 C ATOM 488 O VAL A 36 65.584 -2.933 3.554 1.00 1.00 O ATOM 489 CB VAL A 36 64.455 -4.903 6.130 1.00 1.00 C ATOM 490 CG1 VAL A 36 64.650 -6.200 6.934 1.00 1.00 C ATOM 491 CG2 VAL A 36 64.777 -3.707 7.012 1.00 1.00 C ATOM 0 H VAL A 36 66.823 -3.788 6.000 1.00 1.00 H new ATOM 0 HA VAL A 36 65.395 -5.888 4.486 1.00 1.00 H new ATOM 0 HB VAL A 36 63.419 -4.857 5.794 1.00 1.00 H new ATOM 0 HG11 VAL A 36 63.984 -6.197 7.797 1.00 1.00 H new ATOM 0 HG12 VAL A 36 64.421 -7.058 6.302 1.00 1.00 H new ATOM 0 HG13 VAL A 36 65.684 -6.265 7.274 1.00 1.00 H new ATOM 0 HG21 VAL A 36 64.124 -3.712 7.885 1.00 1.00 H new ATOM 0 HG22 VAL A 36 65.816 -3.763 7.336 1.00 1.00 H new ATOM 0 HG23 VAL A 36 64.622 -2.787 6.448 1.00 1.00 H new ATOM 501 N ILE A 37 63.640 -4.085 3.399 1.00 1.00 N ATOM 502 CA ILE A 37 62.980 -3.208 2.408 1.00 1.00 C ATOM 503 C ILE A 37 63.004 -3.813 0.997 1.00 1.00 C ATOM 504 O ILE A 37 64.068 -4.082 0.440 1.00 1.00 O ATOM 505 CB ILE A 37 63.595 -1.774 2.350 1.00 1.00 C ATOM 506 CG1 ILE A 37 62.486 -0.762 1.890 1.00 1.00 C ATOM 507 CG2 ILE A 37 64.801 -1.741 1.367 1.00 1.00 C ATOM 508 CD1 ILE A 37 63.042 0.375 1.011 1.00 1.00 C ATOM 0 H ILE A 37 63.063 -4.875 3.688 1.00 1.00 H new ATOM 0 HA ILE A 37 61.949 -3.125 2.752 1.00 1.00 H new ATOM 0 HB ILE A 37 63.957 -1.492 3.339 1.00 1.00 H new ATOM 0 HG12 ILE A 37 61.717 -1.300 1.336 1.00 1.00 H new ATOM 0 HG13 ILE A 37 62.005 -0.333 2.769 1.00 1.00 H new ATOM 0 HG21 ILE A 37 65.219 -0.735 1.337 1.00 1.00 H new ATOM 0 HG22 ILE A 37 65.565 -2.441 1.705 1.00 1.00 H new ATOM 0 HG23 ILE A 37 64.465 -2.024 0.369 1.00 1.00 H new ATOM 0 HD11 ILE A 37 62.230 1.043 0.723 1.00 1.00 H new ATOM 0 HD12 ILE A 37 63.791 0.935 1.571 1.00 1.00 H new ATOM 0 HD13 ILE A 37 63.499 -0.047 0.116 1.00 1.00 H new ATOM 520 N HIS A 38 61.826 -4.005 0.405 1.00 1.00 N ATOM 521 CA HIS A 38 61.735 -4.544 -0.952 1.00 1.00 C ATOM 522 C HIS A 38 60.583 -3.862 -1.683 1.00 1.00 C ATOM 523 O HIS A 38 59.495 -3.712 -1.129 1.00 1.00 O ATOM 524 CB HIS A 38 61.511 -6.055 -0.898 1.00 1.00 C ATOM 525 CG HIS A 38 62.621 -6.682 -0.101 1.00 1.00 C ATOM 526 ND1 HIS A 38 63.805 -7.105 -0.686 1.00 1.00 N ATOM 527 CD2 HIS A 38 62.757 -6.932 1.244 1.00 1.00 C ATOM 528 CE1 HIS A 38 64.596 -7.577 0.295 1.00 1.00 C ATOM 529 NE2 HIS A 38 64.005 -7.494 1.490 1.00 1.00 N ATOM 0 H HIS A 38 60.927 -3.797 0.840 1.00 1.00 H new ATOM 0 HA HIS A 38 62.665 -4.352 -1.488 1.00 1.00 H new ATOM 0 HB2 HIS A 38 60.547 -6.277 -0.441 1.00 1.00 H new ATOM 0 HB3 HIS A 38 61.490 -6.469 -1.906 1.00 1.00 H new ATOM 0 HD1 HIS A 38 64.035 -7.066 -1.679 1.00 1.00 H new ATOM 0 HD2 HIS A 38 62.009 -6.724 1.995 1.00 1.00 H new ATOM 0 HE1 HIS A 38 65.588 -7.974 0.136 1.00 1.00 H new ATOM 537 N THR A 39 60.821 -3.461 -2.931 1.00 1.00 N ATOM 538 CA THR A 39 59.785 -2.798 -3.731 1.00 1.00 C ATOM 539 C THR A 39 58.991 -3.862 -4.523 1.00 1.00 C ATOM 540 O THR A 39 59.561 -4.543 -5.374 1.00 1.00 O ATOM 541 CB THR A 39 60.450 -1.785 -4.702 1.00 1.00 C ATOM 542 OG1 THR A 39 61.860 -1.956 -4.660 1.00 1.00 O ATOM 543 CG2 THR A 39 60.103 -0.341 -4.298 1.00 1.00 C ATOM 0 H THR A 39 61.714 -3.581 -3.410 1.00 1.00 H new ATOM 0 HA THR A 39 59.100 -2.259 -3.077 1.00 1.00 H new ATOM 0 HB THR A 39 60.078 -1.967 -5.710 1.00 1.00 H new ATOM 0 HG1 THR A 39 62.285 -1.320 -5.273 1.00 1.00 H new ATOM 0 HG21 THR A 39 60.578 0.355 -4.990 1.00 1.00 H new ATOM 0 HG22 THR A 39 59.022 -0.204 -4.330 1.00 1.00 H new ATOM 0 HG23 THR A 39 60.463 -0.150 -3.287 1.00 1.00 H new ATOM 551 N PRO A 40 57.708 -4.042 -4.272 1.00 1.00 N ATOM 552 CA PRO A 40 56.903 -5.073 -4.997 1.00 1.00 C ATOM 553 C PRO A 40 57.074 -5.025 -6.519 1.00 1.00 C ATOM 554 O PRO A 40 56.923 -6.046 -7.189 1.00 1.00 O ATOM 555 CB PRO A 40 55.444 -4.746 -4.612 1.00 1.00 C ATOM 556 CG PRO A 40 55.526 -4.023 -3.304 1.00 1.00 C ATOM 557 CD PRO A 40 56.884 -3.309 -3.282 1.00 1.00 C ATOM 0 HA PRO A 40 57.221 -6.078 -4.718 1.00 1.00 H new ATOM 0 HB2 PRO A 40 54.967 -4.128 -5.372 1.00 1.00 H new ATOM 0 HB3 PRO A 40 54.849 -5.655 -4.521 1.00 1.00 H new ATOM 0 HG2 PRO A 40 54.710 -3.307 -3.205 1.00 1.00 H new ATOM 0 HG3 PRO A 40 55.441 -4.720 -2.470 1.00 1.00 H new ATOM 0 HD2 PRO A 40 56.783 -2.257 -3.551 1.00 1.00 H new ATOM 0 HD3 PRO A 40 57.334 -3.343 -2.290 1.00 1.00 H new ATOM 565 N ALA A 41 57.289 -3.829 -7.071 1.00 1.00 N ATOM 566 CA ALA A 41 57.357 -3.681 -8.526 1.00 1.00 C ATOM 567 C ALA A 41 58.735 -3.336 -9.047 1.00 1.00 C ATOM 568 O ALA A 41 59.119 -2.169 -9.131 1.00 1.00 O ATOM 569 CB ALA A 41 56.386 -2.580 -8.943 1.00 1.00 C ATOM 0 H ALA A 41 57.417 -2.965 -6.545 1.00 1.00 H new ATOM 0 HA ALA A 41 57.097 -4.649 -8.955 1.00 1.00 H new ATOM 0 HB1 ALA A 41 56.422 -2.454 -10.025 1.00 1.00 H new ATOM 0 HB2 ALA A 41 55.375 -2.854 -8.643 1.00 1.00 H new ATOM 0 HB3 ALA A 41 56.667 -1.645 -8.459 1.00 1.00 H new ATOM 575 N ARG A 42 59.460 -4.377 -9.415 1.00 1.00 N ATOM 576 CA ARG A 42 60.799 -4.239 -9.964 1.00 1.00 C ATOM 577 C ARG A 42 60.968 -5.267 -11.074 1.00 1.00 C ATOM 578 O ARG A 42 60.426 -6.367 -10.986 1.00 1.00 O ATOM 579 CB ARG A 42 61.868 -4.464 -8.874 1.00 1.00 C ATOM 580 CG ARG A 42 61.225 -4.456 -7.485 1.00 1.00 C ATOM 581 CD ARG A 42 62.322 -4.621 -6.437 1.00 1.00 C ATOM 582 NE ARG A 42 62.938 -5.940 -6.557 1.00 1.00 N ATOM 583 CZ ARG A 42 64.158 -6.176 -6.081 1.00 1.00 C ATOM 584 NH1 ARG A 42 64.823 -5.219 -5.494 1.00 1.00 N ATOM 585 NH2 ARG A 42 64.691 -7.360 -6.205 1.00 1.00 N ATOM 0 H ARG A 42 59.138 -5.342 -9.342 1.00 1.00 H new ATOM 0 HA ARG A 42 60.928 -3.230 -10.355 1.00 1.00 H new ATOM 0 HB2 ARG A 42 62.373 -5.415 -9.042 1.00 1.00 H new ATOM 0 HB3 ARG A 42 62.628 -3.685 -8.934 1.00 1.00 H new ATOM 0 HG2 ARG A 42 60.686 -3.523 -7.324 1.00 1.00 H new ATOM 0 HG3 ARG A 42 60.497 -5.263 -7.401 1.00 1.00 H new ATOM 0 HD2 ARG A 42 63.077 -3.846 -6.565 1.00 1.00 H new ATOM 0 HD3 ARG A 42 61.903 -4.496 -5.438 1.00 1.00 H new ATOM 0 HE ARG A 42 62.424 -6.693 -7.014 1.00 1.00 H new ATOM 0 HH11 ARG A 42 64.408 -4.292 -5.401 1.00 1.00 H new ATOM 0 HH12 ARG A 42 65.758 -5.398 -5.128 1.00 1.00 H new ATOM 0 HH21 ARG A 42 64.173 -8.107 -6.667 1.00 1.00 H new ATOM 0 HH22 ARG A 42 65.626 -7.539 -5.840 1.00 1.00 H new ATOM 599 N ARG A 43 61.671 -4.903 -12.133 1.00 1.00 N ATOM 600 CA ARG A 43 61.825 -5.806 -13.260 1.00 1.00 C ATOM 601 C ARG A 43 62.291 -7.192 -12.789 1.00 1.00 C ATOM 602 O ARG A 43 62.240 -8.163 -13.547 1.00 1.00 O ATOM 603 CB ARG A 43 62.824 -5.170 -14.244 1.00 1.00 C ATOM 604 CG ARG A 43 62.924 -5.988 -15.536 1.00 1.00 C ATOM 605 CD ARG A 43 61.568 -6.021 -16.257 1.00 1.00 C ATOM 606 NE ARG A 43 61.775 -6.206 -17.689 1.00 1.00 N ATOM 607 CZ ARG A 43 62.192 -7.371 -18.175 1.00 1.00 C ATOM 608 NH1 ARG A 43 62.429 -8.367 -17.364 1.00 1.00 N ATOM 609 NH2 ARG A 43 62.375 -7.514 -19.460 1.00 1.00 N ATOM 0 H ARG A 43 62.138 -4.002 -12.236 1.00 1.00 H new ATOM 0 HA ARG A 43 60.869 -5.956 -13.761 1.00 1.00 H new ATOM 0 HB2 ARG A 43 62.511 -4.152 -14.478 1.00 1.00 H new ATOM 0 HB3 ARG A 43 63.806 -5.102 -13.776 1.00 1.00 H new ATOM 0 HG2 ARG A 43 63.680 -5.555 -16.190 1.00 1.00 H new ATOM 0 HG3 ARG A 43 63.246 -7.004 -15.306 1.00 1.00 H new ATOM 0 HD2 ARG A 43 60.955 -6.831 -15.861 1.00 1.00 H new ATOM 0 HD3 ARG A 43 61.026 -5.093 -16.075 1.00 1.00 H new ATOM 0 HE ARG A 43 61.597 -5.430 -18.327 1.00 1.00 H new ATOM 0 HH11 ARG A 43 62.294 -8.250 -16.360 1.00 1.00 H new ATOM 0 HH12 ARG A 43 62.749 -9.262 -17.735 1.00 1.00 H new ATOM 0 HH21 ARG A 43 62.198 -6.732 -20.090 1.00 1.00 H new ATOM 0 HH22 ARG A 43 62.695 -8.408 -19.833 1.00 1.00 H new ATOM 623 N GLY A 44 62.740 -7.289 -11.532 1.00 1.00 N ATOM 624 CA GLY A 44 63.210 -8.564 -10.965 1.00 1.00 C ATOM 625 C GLY A 44 64.654 -8.439 -10.509 1.00 1.00 C ATOM 626 O GLY A 44 65.102 -9.158 -9.616 1.00 1.00 O ATOM 0 H GLY A 44 62.789 -6.501 -10.886 1.00 1.00 H new ATOM 0 HA2 GLY A 44 62.579 -8.850 -10.123 1.00 1.00 H new ATOM 0 HA3 GLY A 44 63.124 -9.355 -11.710 1.00 1.00 H new ATOM 630 N PHE A 45 65.368 -7.485 -11.093 1.00 1.00 N ATOM 631 CA PHE A 45 66.752 -7.216 -10.719 1.00 1.00 C ATOM 632 C PHE A 45 67.057 -5.741 -11.002 1.00 1.00 C ATOM 633 O PHE A 45 66.342 -5.112 -11.780 1.00 1.00 O ATOM 634 CB PHE A 45 67.721 -8.106 -11.512 1.00 1.00 C ATOM 635 CG PHE A 45 67.479 -7.909 -12.986 1.00 1.00 C ATOM 636 CD1 PHE A 45 68.050 -6.819 -13.651 1.00 1.00 C ATOM 637 CD2 PHE A 45 66.670 -8.811 -13.685 1.00 1.00 C ATOM 638 CE1 PHE A 45 67.812 -6.630 -15.016 1.00 1.00 C ATOM 639 CE2 PHE A 45 66.429 -8.622 -15.049 1.00 1.00 C ATOM 640 CZ PHE A 45 67.000 -7.530 -15.716 1.00 1.00 C ATOM 0 H PHE A 45 65.009 -6.881 -11.832 1.00 1.00 H new ATOM 0 HA PHE A 45 66.884 -7.436 -9.660 1.00 1.00 H new ATOM 0 HB2 PHE A 45 68.752 -7.854 -11.263 1.00 1.00 H new ATOM 0 HB3 PHE A 45 67.575 -9.152 -11.244 1.00 1.00 H new ATOM 0 HD1 PHE A 45 68.675 -6.123 -13.110 1.00 1.00 H new ATOM 0 HD2 PHE A 45 66.232 -9.654 -13.171 1.00 1.00 H new ATOM 0 HE1 PHE A 45 68.255 -5.790 -15.530 1.00 1.00 H new ATOM 0 HE2 PHE A 45 65.803 -9.317 -15.588 1.00 1.00 H new ATOM 0 HZ PHE A 45 66.814 -7.383 -16.770 1.00 1.00 H new ATOM 650 N PHE A 46 68.109 -5.223 -10.342 1.00 1.00 N ATOM 651 CA PHE A 46 68.577 -3.817 -10.468 1.00 1.00 C ATOM 652 C PHE A 46 68.455 -3.092 -9.118 1.00 1.00 C ATOM 653 O PHE A 46 67.355 -2.694 -8.731 1.00 1.00 O ATOM 654 CB PHE A 46 67.834 -3.048 -11.592 1.00 1.00 C ATOM 655 CG PHE A 46 68.591 -1.795 -12.017 1.00 1.00 C ATOM 656 CD1 PHE A 46 68.722 -0.710 -11.140 1.00 1.00 C ATOM 657 CD2 PHE A 46 69.155 -1.714 -13.308 1.00 1.00 C ATOM 658 CE1 PHE A 46 69.412 0.442 -11.543 1.00 1.00 C ATOM 659 CE2 PHE A 46 69.844 -0.559 -13.706 1.00 1.00 C ATOM 660 CZ PHE A 46 69.972 0.516 -12.824 1.00 1.00 C ATOM 0 H PHE A 46 68.672 -5.773 -9.693 1.00 1.00 H new ATOM 0 HA PHE A 46 69.628 -3.843 -10.755 1.00 1.00 H new ATOM 0 HB2 PHE A 46 67.702 -3.702 -12.454 1.00 1.00 H new ATOM 0 HB3 PHE A 46 66.838 -2.771 -11.246 1.00 1.00 H new ATOM 0 HD1 PHE A 46 68.290 -0.761 -10.151 1.00 1.00 H new ATOM 0 HD2 PHE A 46 69.056 -2.544 -13.992 1.00 1.00 H new ATOM 0 HE1 PHE A 46 69.512 1.275 -10.863 1.00 1.00 H new ATOM 0 HE2 PHE A 46 70.275 -0.501 -14.694 1.00 1.00 H new ATOM 0 HZ PHE A 46 70.503 1.405 -13.130 1.00 1.00 H new ATOM 670 N ARG A 47 69.615 -2.927 -8.435 1.00 1.00 N ATOM 671 CA ARG A 47 69.737 -2.249 -7.116 1.00 1.00 C ATOM 672 C ARG A 47 70.311 -3.200 -6.078 1.00 1.00 C ATOM 673 O ARG A 47 69.862 -4.340 -5.983 1.00 1.00 O ATOM 674 CB ARG A 47 68.405 -1.709 -6.568 1.00 1.00 C ATOM 675 CG ARG A 47 67.548 -2.844 -5.977 1.00 1.00 C ATOM 676 CD ARG A 47 66.129 -2.336 -5.728 1.00 1.00 C ATOM 677 NE ARG A 47 65.369 -2.274 -6.982 1.00 1.00 N ATOM 678 CZ ARG A 47 65.187 -1.127 -7.642 1.00 1.00 C ATOM 679 NH1 ARG A 47 65.742 -0.023 -7.218 1.00 1.00 N ATOM 680 NH2 ARG A 47 64.454 -1.109 -8.723 1.00 1.00 N ATOM 0 H ARG A 47 70.509 -3.267 -8.790 1.00 1.00 H new ATOM 0 HA ARG A 47 70.399 -1.401 -7.293 1.00 1.00 H new ATOM 0 HB2 ARG A 47 68.601 -0.960 -5.801 1.00 1.00 H new ATOM 0 HB3 ARG A 47 67.855 -1.211 -7.367 1.00 1.00 H new ATOM 0 HG2 ARG A 47 67.527 -3.692 -6.661 1.00 1.00 H new ATOM 0 HG3 ARG A 47 67.988 -3.198 -5.044 1.00 1.00 H new ATOM 0 HD2 ARG A 47 65.621 -2.993 -5.022 1.00 1.00 H new ATOM 0 HD3 ARG A 47 66.167 -1.347 -5.272 1.00 1.00 H new ATOM 0 HE ARG A 47 64.968 -3.132 -7.361 1.00 1.00 H new ATOM 0 HH11 ARG A 47 66.319 -0.033 -6.377 1.00 1.00 H new ATOM 0 HH12 ARG A 47 65.598 0.849 -7.728 1.00 1.00 H new ATOM 0 HH21 ARG A 47 64.022 -1.969 -9.061 1.00 1.00 H new ATOM 0 HH22 ARG A 47 64.313 -0.235 -9.229 1.00 1.00 H new ATOM 694 N CYS A 48 71.264 -2.746 -5.260 1.00 1.00 N ATOM 695 CA CYS A 48 71.803 -3.618 -4.225 1.00 1.00 C ATOM 696 C CYS A 48 72.593 -4.762 -4.857 1.00 1.00 C ATOM 697 O CYS A 48 72.131 -5.888 -4.899 1.00 1.00 O ATOM 698 CB CYS A 48 70.637 -4.147 -3.367 1.00 1.00 C ATOM 699 SG CYS A 48 71.215 -4.523 -1.686 1.00 1.00 S ATOM 0 H CYS A 48 71.665 -1.809 -5.294 1.00 1.00 H new ATOM 0 HA CYS A 48 72.489 -3.062 -3.586 1.00 1.00 H new ATOM 0 HB2 CYS A 48 69.839 -3.405 -3.328 1.00 1.00 H new ATOM 0 HB3 CYS A 48 70.217 -5.043 -3.824 1.00 1.00 H new ATOM 704 N ASN A 49 73.788 -4.458 -5.372 1.00 1.00 N ATOM 705 CA ASN A 49 74.621 -5.474 -6.031 1.00 1.00 C ATOM 706 C ASN A 49 76.076 -5.342 -5.573 1.00 1.00 C ATOM 707 O ASN A 49 76.489 -4.253 -5.180 1.00 1.00 O ATOM 708 CB ASN A 49 74.535 -5.259 -7.546 1.00 1.00 C ATOM 709 CG ASN A 49 74.957 -3.834 -7.887 1.00 1.00 C ATOM 710 OD1 ASN A 49 74.994 -3.461 -9.059 1.00 1.00 O ATOM 711 ND2 ASN A 49 75.283 -3.010 -6.927 1.00 1.00 N ATOM 0 H ASN A 49 74.200 -3.525 -5.347 1.00 1.00 H new ATOM 0 HA ASN A 49 74.265 -6.471 -5.769 1.00 1.00 H new ATOM 0 HB2 ASN A 49 75.178 -5.972 -8.061 1.00 1.00 H new ATOM 0 HB3 ASN A 49 73.517 -5.440 -7.892 1.00 1.00 H new ATOM 0 HD21 ASN A 49 75.569 -2.056 -7.149 1.00 1.00 H new ATOM 0 HD22 ASN A 49 75.252 -3.320 -5.956 1.00 1.00 H new ATOM 718 N PRO A 50 76.857 -6.411 -5.603 1.00 1.00 N ATOM 719 CA PRO A 50 78.306 -6.376 -5.182 1.00 1.00 C ATOM 720 C PRO A 50 79.164 -5.402 -6.024 1.00 1.00 C ATOM 721 O PRO A 50 80.248 -5.754 -6.491 1.00 1.00 O ATOM 722 CB PRO A 50 78.765 -7.842 -5.355 1.00 1.00 C ATOM 723 CG PRO A 50 77.796 -8.429 -6.328 1.00 1.00 C ATOM 724 CD PRO A 50 76.462 -7.775 -6.009 1.00 1.00 C ATOM 0 HA PRO A 50 78.424 -6.004 -4.164 1.00 1.00 H new ATOM 0 HB2 PRO A 50 79.786 -7.896 -5.732 1.00 1.00 H new ATOM 0 HB3 PRO A 50 78.747 -8.377 -4.406 1.00 1.00 H new ATOM 0 HG2 PRO A 50 78.098 -8.226 -7.355 1.00 1.00 H new ATOM 0 HG3 PRO A 50 77.739 -9.512 -6.221 1.00 1.00 H new ATOM 0 HD2 PRO A 50 75.799 -7.764 -6.874 1.00 1.00 H new ATOM 0 HD3 PRO A 50 75.935 -8.298 -5.211 1.00 1.00 H new ATOM 732 N GLU A 51 78.654 -4.176 -6.203 1.00 1.00 N ATOM 733 CA GLU A 51 79.330 -3.118 -6.968 1.00 1.00 C ATOM 734 C GLU A 51 79.332 -3.424 -8.465 1.00 1.00 C ATOM 735 O GLU A 51 79.523 -2.521 -9.281 1.00 1.00 O ATOM 736 CB GLU A 51 80.772 -2.882 -6.490 1.00 1.00 C ATOM 737 CG GLU A 51 80.795 -2.561 -4.990 1.00 1.00 C ATOM 738 CD GLU A 51 80.646 -3.841 -4.179 1.00 1.00 C ATOM 739 OE1 GLU A 51 81.304 -4.811 -4.520 1.00 1.00 O ATOM 740 OE2 GLU A 51 79.873 -3.839 -3.237 1.00 1.00 O ATOM 0 H GLU A 51 77.754 -3.888 -5.818 1.00 1.00 H new ATOM 0 HA GLU A 51 78.760 -2.206 -6.791 1.00 1.00 H new ATOM 0 HB2 GLU A 51 81.376 -3.767 -6.688 1.00 1.00 H new ATOM 0 HB3 GLU A 51 81.217 -2.060 -7.051 1.00 1.00 H new ATOM 0 HG2 GLU A 51 81.730 -2.064 -4.731 1.00 1.00 H new ATOM 0 HG3 GLU A 51 79.988 -1.870 -4.746 1.00 1.00 H new ATOM 747 N ARG A 52 79.105 -4.686 -8.829 1.00 1.00 N ATOM 748 CA ARG A 52 79.079 -5.056 -10.245 1.00 1.00 C ATOM 749 C ARG A 52 78.029 -4.212 -10.973 1.00 1.00 C ATOM 750 O ARG A 52 76.942 -3.966 -10.453 1.00 1.00 O ATOM 751 CB ARG A 52 78.761 -6.568 -10.401 1.00 1.00 C ATOM 752 CG ARG A 52 80.059 -7.431 -10.460 1.00 1.00 C ATOM 753 CD ARG A 52 80.289 -8.153 -9.123 1.00 1.00 C ATOM 754 NE ARG A 52 79.416 -9.321 -9.014 1.00 1.00 N ATOM 755 CZ ARG A 52 79.563 -10.207 -8.029 1.00 1.00 C ATOM 756 NH1 ARG A 52 80.487 -10.036 -7.119 1.00 1.00 N ATOM 757 NH2 ARG A 52 78.778 -11.250 -7.967 1.00 1.00 N ATOM 0 H ARG A 52 78.940 -5.455 -8.180 1.00 1.00 H new ATOM 0 HA ARG A 52 80.058 -4.866 -10.684 1.00 1.00 H new ATOM 0 HB2 ARG A 52 78.143 -6.897 -9.565 1.00 1.00 H new ATOM 0 HB3 ARG A 52 78.179 -6.725 -11.309 1.00 1.00 H new ATOM 0 HG2 ARG A 52 79.980 -8.161 -11.265 1.00 1.00 H new ATOM 0 HG3 ARG A 52 80.915 -6.796 -10.688 1.00 1.00 H new ATOM 0 HD2 ARG A 52 81.331 -8.462 -9.045 1.00 1.00 H new ATOM 0 HD3 ARG A 52 80.096 -7.469 -8.296 1.00 1.00 H new ATOM 0 HE ARG A 52 78.680 -9.461 -9.706 1.00 1.00 H new ATOM 0 HH11 ARG A 52 81.100 -9.221 -7.161 1.00 1.00 H new ATOM 0 HH12 ARG A 52 80.595 -10.717 -6.368 1.00 1.00 H new ATOM 0 HH21 ARG A 52 78.053 -11.386 -8.672 1.00 1.00 H new ATOM 0 HH22 ARG A 52 78.890 -11.928 -7.214 1.00 1.00 H new ATOM 771 N ILE A 53 78.385 -3.764 -12.174 1.00 1.00 N ATOM 772 CA ILE A 53 77.495 -2.930 -12.983 1.00 1.00 C ATOM 773 C ILE A 53 76.182 -3.652 -13.268 1.00 1.00 C ATOM 774 O ILE A 53 76.173 -4.811 -13.681 1.00 1.00 O ATOM 775 CB ILE A 53 78.224 -2.558 -14.287 1.00 1.00 C ATOM 776 CG1 ILE A 53 77.262 -1.925 -15.317 1.00 1.00 C ATOM 777 CG2 ILE A 53 78.873 -3.813 -14.892 1.00 1.00 C ATOM 778 CD1 ILE A 53 76.638 -0.653 -14.745 1.00 1.00 C ATOM 0 H ILE A 53 79.285 -3.964 -12.611 1.00 1.00 H new ATOM 0 HA ILE A 53 77.244 -2.020 -12.437 1.00 1.00 H new ATOM 0 HB ILE A 53 78.990 -1.821 -14.045 1.00 1.00 H new ATOM 0 HG12 ILE A 53 77.802 -1.693 -16.235 1.00 1.00 H new ATOM 0 HG13 ILE A 53 76.479 -2.637 -15.579 1.00 1.00 H new ATOM 0 HG21 ILE A 53 79.388 -3.547 -15.815 1.00 1.00 H new ATOM 0 HG22 ILE A 53 79.589 -4.230 -14.184 1.00 1.00 H new ATOM 0 HG23 ILE A 53 78.102 -4.553 -15.107 1.00 1.00 H new ATOM 0 HD11 ILE A 53 75.962 -0.217 -15.481 1.00 1.00 H new ATOM 0 HD12 ILE A 53 76.081 -0.896 -13.840 1.00 1.00 H new ATOM 0 HD13 ILE A 53 77.425 0.062 -14.506 1.00 1.00 H new ATOM 790 N GLN A 54 75.073 -2.960 -13.008 1.00 1.00 N ATOM 791 CA GLN A 54 73.761 -3.564 -13.201 1.00 1.00 C ATOM 792 C GLN A 54 73.633 -3.978 -14.676 1.00 1.00 C ATOM 793 O GLN A 54 72.984 -3.312 -15.481 1.00 1.00 O ATOM 794 CB GLN A 54 72.688 -2.500 -12.832 1.00 1.00 C ATOM 795 CG GLN A 54 71.974 -2.855 -11.522 1.00 1.00 C ATOM 796 CD GLN A 54 72.870 -2.607 -10.308 1.00 1.00 C ATOM 797 OE1 GLN A 54 72.650 -3.200 -9.254 1.00 1.00 O ATOM 798 NE2 GLN A 54 73.860 -1.757 -10.377 1.00 1.00 N ATOM 0 H GLN A 54 75.058 -1.998 -12.669 1.00 1.00 H new ATOM 0 HA GLN A 54 73.626 -4.445 -12.574 1.00 1.00 H new ATOM 0 HB2 GLN A 54 73.161 -1.522 -12.737 1.00 1.00 H new ATOM 0 HB3 GLN A 54 71.957 -2.424 -13.637 1.00 1.00 H new ATOM 0 HG2 GLN A 54 71.064 -2.262 -11.431 1.00 1.00 H new ATOM 0 HG3 GLN A 54 71.671 -3.902 -11.544 1.00 1.00 H new ATOM 0 HE21 GLN A 54 74.047 -1.262 -11.249 1.00 1.00 H new ATOM 0 HE22 GLN A 54 74.445 -1.589 -9.559 1.00 1.00 H new ATOM 807 N ILE A 55 74.249 -5.121 -14.993 1.00 1.00 N ATOM 808 CA ILE A 55 74.200 -5.677 -16.341 1.00 1.00 C ATOM 809 C ILE A 55 74.400 -7.187 -16.325 1.00 1.00 C ATOM 810 O ILE A 55 74.924 -7.745 -15.363 1.00 1.00 O ATOM 811 CB ILE A 55 75.248 -5.009 -17.242 1.00 1.00 C ATOM 812 CG1 ILE A 55 74.870 -5.237 -18.716 1.00 1.00 C ATOM 813 CG2 ILE A 55 76.650 -5.595 -16.971 1.00 1.00 C ATOM 814 CD1 ILE A 55 75.779 -4.400 -19.609 1.00 1.00 C ATOM 0 H ILE A 55 74.788 -5.678 -14.330 1.00 1.00 H new ATOM 0 HA ILE A 55 73.209 -5.472 -16.747 1.00 1.00 H new ATOM 0 HB ILE A 55 75.270 -3.941 -17.025 1.00 1.00 H new ATOM 0 HG12 ILE A 55 74.967 -6.293 -18.968 1.00 1.00 H new ATOM 0 HG13 ILE A 55 73.828 -4.964 -18.882 1.00 1.00 H new ATOM 0 HG21 ILE A 55 77.379 -5.109 -17.619 1.00 1.00 H new ATOM 0 HG22 ILE A 55 76.920 -5.425 -15.929 1.00 1.00 H new ATOM 0 HG23 ILE A 55 76.642 -6.666 -17.173 1.00 1.00 H new ATOM 0 HD11 ILE A 55 75.512 -4.561 -20.653 1.00 1.00 H new ATOM 0 HD12 ILE A 55 75.660 -3.345 -19.363 1.00 1.00 H new ATOM 0 HD13 ILE A 55 76.816 -4.695 -19.450 1.00 1.00 H new ATOM 826 N GLY A 56 74.035 -7.838 -17.417 1.00 1.00 N ATOM 827 CA GLY A 56 74.228 -9.269 -17.572 1.00 1.00 C ATOM 828 C GLY A 56 72.952 -10.042 -17.321 1.00 1.00 C ATOM 829 O GLY A 56 72.786 -11.138 -17.851 1.00 1.00 O ATOM 0 H GLY A 56 73.596 -7.389 -18.221 1.00 1.00 H new ATOM 0 HA2 GLY A 56 74.588 -9.480 -18.579 1.00 1.00 H new ATOM 0 HA3 GLY A 56 75.000 -9.608 -16.881 1.00 1.00 H new ATOM 833 N ASP A 57 72.050 -9.521 -16.495 1.00 1.00 N ATOM 834 CA ASP A 57 70.845 -10.260 -16.190 1.00 1.00 C ATOM 835 C ASP A 57 69.899 -10.407 -17.379 1.00 1.00 C ATOM 836 O ASP A 57 69.584 -9.462 -18.101 1.00 1.00 O ATOM 837 CB ASP A 57 70.128 -9.587 -15.017 1.00 1.00 C ATOM 838 CG ASP A 57 71.141 -9.274 -13.916 1.00 1.00 C ATOM 839 OD1 ASP A 57 71.747 -10.206 -13.408 1.00 1.00 O ATOM 840 OD2 ASP A 57 71.303 -8.108 -13.605 1.00 1.00 O ATOM 0 H ASP A 57 72.132 -8.613 -16.038 1.00 1.00 H new ATOM 0 HA ASP A 57 71.147 -11.273 -15.925 1.00 1.00 H new ATOM 0 HB2 ASP A 57 69.642 -8.670 -15.351 1.00 1.00 H new ATOM 0 HB3 ASP A 57 69.345 -10.240 -14.631 1.00 1.00 H new ATOM 845 N TRP A 58 69.422 -11.629 -17.495 1.00 1.00 N ATOM 846 CA TRP A 58 68.466 -12.035 -18.492 1.00 1.00 C ATOM 847 C TRP A 58 67.094 -11.551 -18.027 1.00 1.00 C ATOM 848 O TRP A 58 67.009 -10.907 -16.975 1.00 1.00 O ATOM 849 CB TRP A 58 68.552 -13.529 -18.703 1.00 1.00 C ATOM 850 CG TRP A 58 69.768 -13.860 -19.527 1.00 1.00 C ATOM 851 CD1 TRP A 58 70.824 -13.032 -19.747 1.00 1.00 C ATOM 852 CD2 TRP A 58 70.073 -15.096 -20.223 1.00 1.00 C ATOM 853 NE1 TRP A 58 71.761 -13.699 -20.523 1.00 1.00 N ATOM 854 CE2 TRP A 58 71.340 -14.975 -20.845 1.00 1.00 C ATOM 855 CE3 TRP A 58 69.373 -16.302 -20.369 1.00 1.00 C ATOM 856 CZ2 TRP A 58 71.894 -16.029 -21.582 1.00 1.00 C ATOM 857 CZ3 TRP A 58 69.921 -17.358 -21.107 1.00 1.00 C ATOM 858 CH2 TRP A 58 71.179 -17.224 -21.712 1.00 1.00 C ATOM 0 H TRP A 58 69.702 -12.389 -16.875 1.00 1.00 H new ATOM 0 HA TRP A 58 68.668 -11.592 -19.467 1.00 1.00 H new ATOM 0 HB2 TRP A 58 68.604 -14.039 -17.741 1.00 1.00 H new ATOM 0 HB3 TRP A 58 67.653 -13.887 -19.205 1.00 1.00 H new ATOM 0 HD1 TRP A 58 70.918 -12.021 -19.378 1.00 1.00 H new ATOM 0 HE1 TRP A 58 72.651 -13.297 -20.819 1.00 1.00 H new ATOM 0 HE3 TRP A 58 68.403 -16.417 -19.908 1.00 1.00 H new ATOM 0 HZ2 TRP A 58 72.863 -15.920 -22.045 1.00 1.00 H new ATOM 0 HZ3 TRP A 58 69.371 -18.282 -21.211 1.00 1.00 H new ATOM 0 HH2 TRP A 58 71.596 -18.044 -22.278 1.00 1.00 H new ATOM 869 N ARG A 59 66.014 -11.815 -18.768 1.00 1.00 N ATOM 870 CA ARG A 59 64.668 -11.362 -18.361 1.00 1.00 C ATOM 871 C ARG A 59 63.857 -12.498 -17.671 1.00 1.00 C ATOM 872 O ARG A 59 63.346 -12.352 -16.559 1.00 1.00 O ATOM 873 CB ARG A 59 63.902 -10.880 -19.632 1.00 1.00 C ATOM 874 CG ARG A 59 64.864 -10.760 -20.842 1.00 1.00 C ATOM 875 CD ARG A 59 65.130 -12.156 -21.467 1.00 1.00 C ATOM 876 NE ARG A 59 66.510 -12.256 -21.965 1.00 1.00 N ATOM 877 CZ ARG A 59 67.070 -13.444 -22.241 1.00 1.00 C ATOM 878 NH1 ARG A 59 66.406 -14.546 -22.024 1.00 1.00 N ATOM 879 NH2 ARG A 59 68.287 -13.513 -22.725 1.00 1.00 N ATOM 0 H ARG A 59 66.037 -12.334 -19.645 1.00 1.00 H new ATOM 0 HA ARG A 59 64.780 -10.552 -17.640 1.00 1.00 H new ATOM 0 HB2 ARG A 59 63.101 -11.581 -19.867 1.00 1.00 H new ATOM 0 HB3 ARG A 59 63.434 -9.915 -19.436 1.00 1.00 H new ATOM 0 HG2 ARG A 59 64.434 -10.096 -21.591 1.00 1.00 H new ATOM 0 HG3 ARG A 59 65.805 -10.313 -20.523 1.00 1.00 H new ATOM 0 HD2 ARG A 59 64.951 -12.932 -20.723 1.00 1.00 H new ATOM 0 HD3 ARG A 59 64.431 -12.332 -22.285 1.00 1.00 H new ATOM 0 HE ARG A 59 67.053 -11.404 -22.104 1.00 1.00 H new ATOM 0 HH11 ARG A 59 65.460 -14.505 -21.644 1.00 1.00 H new ATOM 0 HH12 ARG A 59 66.833 -15.448 -22.234 1.00 1.00 H new ATOM 0 HH21 ARG A 59 68.817 -12.659 -22.895 1.00 1.00 H new ATOM 0 HH22 ARG A 59 68.703 -14.421 -22.931 1.00 1.00 H new ATOM 893 N TYR A 60 63.732 -13.604 -18.413 1.00 1.00 N ATOM 894 CA TYR A 60 62.986 -14.822 -18.020 1.00 1.00 C ATOM 895 C TYR A 60 63.783 -15.681 -17.053 1.00 1.00 C ATOM 896 O TYR A 60 63.291 -16.674 -16.479 1.00 1.00 O ATOM 897 CB TYR A 60 62.668 -15.664 -19.266 1.00 1.00 C ATOM 898 CG TYR A 60 61.549 -16.633 -18.946 1.00 1.00 C ATOM 899 CD1 TYR A 60 60.219 -16.228 -19.110 1.00 1.00 C ATOM 900 CD2 TYR A 60 61.833 -17.922 -18.473 1.00 1.00 C ATOM 901 CE1 TYR A 60 59.175 -17.107 -18.804 1.00 1.00 C ATOM 902 CE2 TYR A 60 60.787 -18.800 -18.162 1.00 1.00 C ATOM 903 CZ TYR A 60 59.459 -18.394 -18.328 1.00 1.00 C ATOM 904 OH TYR A 60 58.430 -19.260 -18.011 1.00 1.00 O ATOM 0 H TYR A 60 64.159 -13.687 -19.336 1.00 1.00 H new ATOM 0 HA TYR A 60 62.069 -14.497 -17.529 1.00 1.00 H new ATOM 0 HB2 TYR A 60 62.377 -15.015 -20.092 1.00 1.00 H new ATOM 0 HB3 TYR A 60 63.556 -16.209 -19.586 1.00 1.00 H new ATOM 0 HD1 TYR A 60 59.999 -15.235 -19.473 1.00 1.00 H new ATOM 0 HD2 TYR A 60 62.858 -18.238 -18.348 1.00 1.00 H new ATOM 0 HE1 TYR A 60 58.150 -16.794 -18.935 1.00 1.00 H new ATOM 0 HE2 TYR A 60 61.006 -19.791 -17.794 1.00 1.00 H new ATOM 0 HH TYR A 60 58.803 -20.110 -17.697 1.00 1.00 H new ATOM 914 N GLU A 61 65.004 -15.294 -16.857 1.00 1.00 N ATOM 915 CA GLU A 61 65.866 -16.007 -15.969 1.00 1.00 C ATOM 916 C GLU A 61 65.421 -15.773 -14.543 1.00 1.00 C ATOM 917 O GLU A 61 65.876 -16.424 -13.621 1.00 1.00 O ATOM 918 CB GLU A 61 67.297 -15.536 -16.174 1.00 1.00 C ATOM 919 CG GLU A 61 68.285 -16.401 -15.387 1.00 1.00 C ATOM 920 CD GLU A 61 69.692 -15.827 -15.528 1.00 1.00 C ATOM 921 OE1 GLU A 61 69.804 -14.669 -15.889 1.00 1.00 O ATOM 922 OE2 GLU A 61 70.638 -16.549 -15.258 1.00 1.00 O ATOM 0 H GLU A 61 65.429 -14.482 -17.304 1.00 1.00 H new ATOM 0 HA GLU A 61 65.818 -17.076 -16.176 1.00 1.00 H new ATOM 0 HB2 GLU A 61 67.545 -15.570 -17.235 1.00 1.00 H new ATOM 0 HB3 GLU A 61 67.389 -14.497 -15.859 1.00 1.00 H new ATOM 0 HG2 GLU A 61 67.998 -16.434 -14.336 1.00 1.00 H new ATOM 0 HG3 GLU A 61 68.261 -17.426 -15.756 1.00 1.00 H new ATOM 929 N VAL A 62 64.563 -14.782 -14.352 1.00 1.00 N ATOM 930 CA VAL A 62 64.146 -14.409 -12.992 1.00 1.00 C ATOM 931 C VAL A 62 63.836 -15.632 -12.189 1.00 1.00 C ATOM 932 O VAL A 62 64.349 -15.804 -11.091 1.00 1.00 O ATOM 933 CB VAL A 62 62.904 -13.489 -12.998 1.00 1.00 C ATOM 934 CG1 VAL A 62 63.309 -12.097 -13.486 1.00 1.00 C ATOM 935 CG2 VAL A 62 61.794 -14.066 -13.899 1.00 1.00 C ATOM 0 H VAL A 62 64.145 -14.227 -15.098 1.00 1.00 H new ATOM 0 HA VAL A 62 64.977 -13.865 -12.544 1.00 1.00 H new ATOM 0 HB VAL A 62 62.511 -13.422 -11.983 1.00 1.00 H new ATOM 0 HG11 VAL A 62 62.436 -11.445 -13.492 1.00 1.00 H new ATOM 0 HG12 VAL A 62 64.066 -11.684 -12.819 1.00 1.00 H new ATOM 0 HG13 VAL A 62 63.715 -12.169 -14.495 1.00 1.00 H new ATOM 0 HG21 VAL A 62 60.931 -13.400 -13.886 1.00 1.00 H new ATOM 0 HG22 VAL A 62 62.165 -14.159 -14.920 1.00 1.00 H new ATOM 0 HG23 VAL A 62 61.499 -15.048 -13.530 1.00 1.00 H new ATOM 945 N ALA A 63 63.008 -16.484 -12.716 1.00 1.00 N ATOM 946 CA ALA A 63 62.670 -17.676 -12.021 1.00 1.00 C ATOM 947 C ALA A 63 63.903 -18.550 -11.900 1.00 1.00 C ATOM 948 O ALA A 63 64.237 -18.999 -10.811 1.00 1.00 O ATOM 949 CB ALA A 63 61.581 -18.415 -12.799 1.00 1.00 C ATOM 0 H ALA A 63 62.558 -16.370 -13.624 1.00 1.00 H new ATOM 0 HA ALA A 63 62.302 -17.436 -11.023 1.00 1.00 H new ATOM 0 HB1 ALA A 63 61.316 -19.332 -12.272 1.00 1.00 H new ATOM 0 HB2 ALA A 63 60.700 -17.779 -12.886 1.00 1.00 H new ATOM 0 HB3 ALA A 63 61.949 -18.663 -13.795 1.00 1.00 H new ATOM 955 N HIS A 64 64.604 -18.729 -13.031 1.00 1.00 N ATOM 956 CA HIS A 64 65.823 -19.558 -13.026 1.00 1.00 C ATOM 957 C HIS A 64 66.815 -19.051 -11.951 1.00 1.00 C ATOM 958 O HIS A 64 67.169 -19.789 -11.023 1.00 1.00 O ATOM 959 CB HIS A 64 66.473 -19.514 -14.428 1.00 1.00 C ATOM 960 CG HIS A 64 66.120 -20.728 -15.262 1.00 1.00 C ATOM 961 ND1 HIS A 64 67.083 -21.424 -15.979 1.00 1.00 N ATOM 962 CD2 HIS A 64 64.925 -21.355 -15.538 1.00 1.00 C ATOM 963 CE1 HIS A 64 66.463 -22.416 -16.644 1.00 1.00 C ATOM 964 NE2 HIS A 64 65.147 -22.421 -16.412 1.00 1.00 N ATOM 0 H HIS A 64 64.359 -18.325 -13.935 1.00 1.00 H new ATOM 0 HA HIS A 64 65.560 -20.588 -12.784 1.00 1.00 H new ATOM 0 HB2 HIS A 64 66.150 -18.612 -14.948 1.00 1.00 H new ATOM 0 HB3 HIS A 64 67.556 -19.451 -14.322 1.00 1.00 H new ATOM 0 HD2 HIS A 64 63.964 -21.066 -15.139 1.00 1.00 H new ATOM 0 HE1 HIS A 64 66.967 -23.122 -17.287 1.00 1.00 H new ATOM 0 HE2 HIS A 64 64.453 -23.065 -16.792 1.00 1.00 H new ATOM 972 N ASP A 65 67.226 -17.787 -12.054 1.00 1.00 N ATOM 973 CA ASP A 65 68.133 -17.196 -11.071 1.00 1.00 C ATOM 974 C ASP A 65 67.419 -17.066 -9.719 1.00 1.00 C ATOM 975 O ASP A 65 67.889 -17.581 -8.693 1.00 1.00 O ATOM 976 CB ASP A 65 68.624 -15.822 -11.559 1.00 1.00 C ATOM 977 CG ASP A 65 69.440 -15.133 -10.471 1.00 1.00 C ATOM 978 OD1 ASP A 65 70.562 -15.558 -10.239 1.00 1.00 O ATOM 979 OD2 ASP A 65 68.936 -14.187 -9.889 1.00 1.00 O ATOM 0 H ASP A 65 66.947 -17.155 -12.805 1.00 1.00 H new ATOM 0 HA ASP A 65 69.000 -17.845 -10.948 1.00 1.00 H new ATOM 0 HB2 ASP A 65 69.231 -15.943 -12.456 1.00 1.00 H new ATOM 0 HB3 ASP A 65 67.772 -15.200 -11.832 1.00 1.00 H new ATOM 984 N GLY A 66 66.253 -16.429 -9.712 1.00 1.00 N ATOM 985 CA GLY A 66 65.460 -16.288 -8.497 1.00 1.00 C ATOM 986 C GLY A 66 65.002 -17.652 -7.985 1.00 1.00 C ATOM 987 O GLY A 66 63.965 -17.768 -7.338 1.00 1.00 O ATOM 0 H GLY A 66 65.835 -16.001 -10.538 1.00 1.00 H new ATOM 0 HA2 GLY A 66 66.049 -15.786 -7.730 1.00 1.00 H new ATOM 0 HA3 GLY A 66 64.592 -15.659 -8.695 1.00 1.00 H new ATOM 991 N ARG A 67 65.813 -18.671 -8.232 1.00 1.00 N ATOM 992 CA ARG A 67 65.542 -20.000 -7.726 1.00 1.00 C ATOM 993 C ARG A 67 65.993 -20.042 -6.259 1.00 1.00 C ATOM 994 O ARG A 67 65.829 -21.065 -5.605 1.00 1.00 O ATOM 995 CB ARG A 67 66.264 -21.106 -8.518 1.00 1.00 C ATOM 996 CG ARG A 67 65.493 -21.480 -9.783 1.00 1.00 C ATOM 997 CD ARG A 67 64.430 -22.522 -9.453 1.00 1.00 C ATOM 998 NE ARG A 67 65.081 -23.806 -9.264 1.00 1.00 N ATOM 999 CZ ARG A 67 65.502 -24.494 -10.310 1.00 1.00 C ATOM 1000 NH1 ARG A 67 65.319 -24.008 -11.507 1.00 1.00 N ATOM 1001 NH2 ARG A 67 66.113 -25.633 -10.146 1.00 1.00 N ATOM 0 H ARG A 67 66.668 -18.597 -8.784 1.00 1.00 H new ATOM 0 HA ARG A 67 64.474 -20.194 -7.829 1.00 1.00 H new ATOM 0 HB2 ARG A 67 67.265 -20.769 -8.787 1.00 1.00 H new ATOM 0 HB3 ARG A 67 66.383 -21.988 -7.888 1.00 1.00 H new ATOM 0 HG2 ARG A 67 65.025 -20.593 -10.210 1.00 1.00 H new ATOM 0 HG3 ARG A 67 66.178 -21.872 -10.535 1.00 1.00 H new ATOM 0 HD2 ARG A 67 63.888 -22.237 -8.551 1.00 1.00 H new ATOM 0 HD3 ARG A 67 63.698 -22.584 -10.259 1.00 1.00 H new ATOM 0 HE ARG A 67 65.213 -24.177 -8.323 1.00 1.00 H new ATOM 0 HH11 ARG A 67 64.856 -23.107 -11.626 1.00 1.00 H new ATOM 0 HH12 ARG A 67 65.639 -24.529 -12.323 1.00 1.00 H new ATOM 0 HH21 ARG A 67 66.268 -25.998 -9.206 1.00 1.00 H new ATOM 0 HH22 ARG A 67 66.436 -26.160 -10.957 1.00 1.00 H new ATOM 1015 N LEU A 68 66.598 -18.923 -5.770 1.00 1.00 N ATOM 1016 CA LEU A 68 67.100 -18.869 -4.363 1.00 1.00 C ATOM 1017 C LEU A 68 66.133 -19.681 -3.491 1.00 1.00 C ATOM 1018 O LEU A 68 66.526 -20.277 -2.502 1.00 1.00 O ATOM 1019 CB LEU A 68 67.217 -17.404 -3.817 1.00 1.00 C ATOM 1020 CG LEU A 68 67.794 -17.376 -2.349 1.00 1.00 C ATOM 1021 CD1 LEU A 68 68.866 -16.280 -2.191 1.00 1.00 C ATOM 1022 CD2 LEU A 68 66.689 -17.063 -1.321 1.00 1.00 C ATOM 0 H LEU A 68 66.748 -18.070 -6.309 1.00 1.00 H new ATOM 0 HA LEU A 68 68.107 -19.286 -4.335 1.00 1.00 H new ATOM 0 HB2 LEU A 68 67.863 -16.821 -4.474 1.00 1.00 H new ATOM 0 HB3 LEU A 68 66.236 -16.930 -3.832 1.00 1.00 H new ATOM 0 HG LEU A 68 68.220 -18.363 -2.172 1.00 1.00 H new ATOM 0 HD11 LEU A 68 69.244 -16.286 -1.169 1.00 1.00 H new ATOM 0 HD12 LEU A 68 69.686 -16.471 -2.883 1.00 1.00 H new ATOM 0 HD13 LEU A 68 68.426 -15.307 -2.410 1.00 1.00 H new ATOM 0 HD21 LEU A 68 67.117 -17.051 -0.319 1.00 1.00 H new ATOM 0 HD22 LEU A 68 66.253 -16.089 -1.541 1.00 1.00 H new ATOM 0 HD23 LEU A 68 65.914 -17.828 -1.375 1.00 1.00 H new ATOM 1034 N LEU A 69 64.857 -19.734 -3.873 1.00 1.00 N ATOM 1035 CA LEU A 69 63.942 -20.562 -3.056 1.00 1.00 C ATOM 1036 C LEU A 69 64.442 -22.013 -3.156 1.00 1.00 C ATOM 1037 O LEU A 69 64.857 -22.608 -2.157 1.00 1.00 O ATOM 1038 CB LEU A 69 62.442 -20.398 -3.460 1.00 1.00 C ATOM 1039 CG LEU A 69 61.964 -21.412 -4.533 1.00 1.00 C ATOM 1040 CD1 LEU A 69 60.432 -21.364 -4.596 1.00 1.00 C ATOM 1041 CD2 LEU A 69 62.545 -21.027 -5.914 1.00 1.00 C ATOM 0 H LEU A 69 64.447 -19.258 -4.677 1.00 1.00 H new ATOM 0 HA LEU A 69 63.962 -20.231 -2.018 1.00 1.00 H new ATOM 0 HB2 LEU A 69 61.822 -20.507 -2.570 1.00 1.00 H new ATOM 0 HB3 LEU A 69 62.286 -19.387 -3.835 1.00 1.00 H new ATOM 0 HG LEU A 69 62.302 -22.415 -4.273 1.00 1.00 H new ATOM 0 HD11 LEU A 69 60.076 -22.071 -5.346 1.00 1.00 H new ATOM 0 HD12 LEU A 69 60.019 -21.629 -3.623 1.00 1.00 H new ATOM 0 HD13 LEU A 69 60.110 -20.358 -4.865 1.00 1.00 H new ATOM 0 HD21 LEU A 69 62.206 -21.742 -6.663 1.00 1.00 H new ATOM 0 HD22 LEU A 69 62.205 -20.028 -6.186 1.00 1.00 H new ATOM 0 HD23 LEU A 69 63.634 -21.039 -5.867 1.00 1.00 H new ATOM 1053 N ALA A 70 64.434 -22.565 -4.366 1.00 1.00 N ATOM 1054 CA ALA A 70 64.929 -23.923 -4.570 1.00 1.00 C ATOM 1055 C ALA A 70 66.442 -23.839 -4.567 1.00 1.00 C ATOM 1056 O ALA A 70 67.074 -24.245 -3.613 1.00 1.00 O ATOM 1057 CB ALA A 70 64.408 -24.446 -5.905 1.00 1.00 C ATOM 0 H ALA A 70 64.096 -22.101 -5.209 1.00 1.00 H new ATOM 0 HA ALA A 70 64.591 -24.606 -3.791 1.00 1.00 H new ATOM 0 HB1 ALA A 70 64.773 -25.460 -6.066 1.00 1.00 H new ATOM 0 HB2 ALA A 70 63.318 -24.450 -5.894 1.00 1.00 H new ATOM 0 HB3 ALA A 70 64.760 -23.802 -6.711 1.00 1.00 H new ATOM 1063 N ALA A 71 67.006 -23.287 -5.638 1.00 1.00 N ATOM 1064 CA ALA A 71 68.445 -23.073 -5.797 1.00 1.00 C ATOM 1065 C ALA A 71 69.094 -22.491 -4.557 1.00 1.00 C ATOM 1066 O ALA A 71 70.272 -22.141 -4.610 1.00 1.00 O ATOM 1067 CB ALA A 71 68.715 -22.116 -6.950 1.00 1.00 C ATOM 0 H ALA A 71 66.463 -22.968 -6.440 1.00 1.00 H new ATOM 0 HA ALA A 71 68.874 -24.056 -5.989 1.00 1.00 H new ATOM 0 HB1 ALA A 71 69.790 -21.967 -7.055 1.00 1.00 H new ATOM 0 HB2 ALA A 71 68.315 -22.536 -7.873 1.00 1.00 H new ATOM 0 HB3 ALA A 71 68.234 -21.159 -6.749 1.00 1.00 H new ATOM 1073 N HIS A 72 68.329 -22.319 -3.476 1.00 1.00 N ATOM 1074 CA HIS A 72 68.822 -21.705 -2.245 1.00 1.00 C ATOM 1075 C HIS A 72 70.335 -21.784 -2.153 1.00 1.00 C ATOM 1076 O HIS A 72 70.999 -20.754 -2.281 1.00 1.00 O ATOM 1077 CB HIS A 72 68.166 -22.448 -1.069 1.00 1.00 C ATOM 1078 CG HIS A 72 68.130 -23.938 -1.356 1.00 1.00 C ATOM 1079 ND1 HIS A 72 68.999 -24.544 -2.253 1.00 1.00 N ATOM 1080 CD2 HIS A 72 67.314 -24.950 -0.900 1.00 1.00 C ATOM 1081 CE1 HIS A 72 68.693 -25.851 -2.310 1.00 1.00 C ATOM 1082 NE2 HIS A 72 67.673 -26.154 -1.507 1.00 1.00 N ATOM 0 H HIS A 72 67.350 -22.602 -3.432 1.00 1.00 H new ATOM 0 HA HIS A 72 68.564 -20.646 -2.226 1.00 1.00 H new ATOM 0 HB2 HIS A 72 68.723 -22.259 -0.151 1.00 1.00 H new ATOM 0 HB3 HIS A 72 67.154 -22.075 -0.910 1.00 1.00 H new ATOM 0 HD2 HIS A 72 66.517 -24.830 -0.181 1.00 1.00 H new ATOM 0 HE1 HIS A 72 69.210 -26.568 -2.930 1.00 1.00 H new ATOM 0 HE2 HIS A 72 67.246 -27.070 -1.366 1.00 1.00 H new ATOM 1090 N MET A 73 70.900 -22.954 -1.989 1.00 1.00 N ATOM 1091 CA MET A 73 72.339 -23.039 -1.959 1.00 1.00 C ATOM 1092 C MET A 73 72.882 -22.847 -3.374 1.00 1.00 C ATOM 1093 O MET A 73 73.851 -22.112 -3.580 1.00 1.00 O ATOM 1094 CB MET A 73 72.748 -24.375 -1.367 1.00 1.00 C ATOM 1095 CG MET A 73 72.309 -24.389 0.092 1.00 1.00 C ATOM 1096 SD MET A 73 72.901 -25.882 0.911 1.00 1.00 S ATOM 1097 CE MET A 73 72.856 -25.188 2.578 1.00 1.00 C ATOM 0 H MET A 73 70.403 -23.838 -1.877 1.00 1.00 H new ATOM 0 HA MET A 73 72.760 -22.254 -1.331 1.00 1.00 H new ATOM 0 HB2 MET A 73 72.282 -25.195 -1.914 1.00 1.00 H new ATOM 0 HB3 MET A 73 73.827 -24.513 -1.443 1.00 1.00 H new ATOM 0 HG2 MET A 73 72.696 -23.508 0.604 1.00 1.00 H new ATOM 0 HG3 MET A 73 71.222 -24.340 0.152 1.00 1.00 H new ATOM 0 HE1 MET A 73 73.188 -25.940 3.294 1.00 1.00 H new ATOM 0 HE2 MET A 73 73.515 -24.322 2.629 1.00 1.00 H new ATOM 0 HE3 MET A 73 71.837 -24.883 2.818 1.00 1.00 H new ATOM 1107 N VAL A 74 72.301 -23.563 -4.344 1.00 1.00 N ATOM 1108 CA VAL A 74 72.809 -23.508 -5.716 1.00 1.00 C ATOM 1109 C VAL A 74 73.124 -22.068 -6.128 1.00 1.00 C ATOM 1110 O VAL A 74 74.218 -21.835 -6.614 1.00 1.00 O ATOM 1111 CB VAL A 74 71.797 -24.123 -6.683 1.00 1.00 C ATOM 1112 CG1 VAL A 74 72.335 -24.053 -8.105 1.00 1.00 C ATOM 1113 CG2 VAL A 74 71.526 -25.584 -6.316 1.00 1.00 C ATOM 0 H VAL A 74 71.496 -24.174 -4.208 1.00 1.00 H new ATOM 0 HA VAL A 74 73.733 -24.085 -5.757 1.00 1.00 H new ATOM 0 HB VAL A 74 70.866 -23.561 -6.614 1.00 1.00 H new ATOM 0 HG11 VAL A 74 71.610 -24.493 -8.790 1.00 1.00 H new ATOM 0 HG12 VAL A 74 72.507 -23.012 -8.378 1.00 1.00 H new ATOM 0 HG13 VAL A 74 73.273 -24.604 -8.167 1.00 1.00 H new ATOM 0 HG21 VAL A 74 70.804 -26.007 -7.014 1.00 1.00 H new ATOM 0 HG22 VAL A 74 72.456 -26.151 -6.368 1.00 1.00 H new ATOM 0 HG23 VAL A 74 71.126 -25.637 -5.304 1.00 1.00 H new ATOM 1123 N ASN A 75 72.219 -21.092 -5.927 1.00 1.00 N ATOM 1124 CA ASN A 75 72.508 -19.667 -6.270 1.00 1.00 C ATOM 1125 C ASN A 75 73.984 -19.333 -5.971 1.00 1.00 C ATOM 1126 O ASN A 75 74.606 -18.433 -6.561 1.00 1.00 O ATOM 1127 CB ASN A 75 71.600 -18.786 -5.394 1.00 1.00 C ATOM 1128 CG ASN A 75 71.835 -17.299 -5.643 1.00 1.00 C ATOM 1129 OD1 ASN A 75 71.392 -16.757 -6.656 1.00 1.00 O ATOM 1130 ND2 ASN A 75 72.500 -16.598 -4.760 1.00 1.00 N ATOM 0 H ASN A 75 71.291 -21.250 -5.535 1.00 1.00 H new ATOM 0 HA ASN A 75 72.323 -19.491 -7.330 1.00 1.00 H new ATOM 0 HB2 ASN A 75 70.556 -19.027 -5.596 1.00 1.00 H new ATOM 0 HB3 ASN A 75 71.781 -19.011 -4.343 1.00 1.00 H new ATOM 0 HD21 ASN A 75 72.652 -15.601 -4.910 1.00 1.00 H new ATOM 0 HD22 ASN A 75 72.866 -17.049 -3.922 1.00 1.00 H new ATOM 1137 N GLY A 76 74.561 -20.158 -5.122 1.00 1.00 N ATOM 1138 CA GLY A 76 75.966 -20.054 -4.818 1.00 1.00 C ATOM 1139 C GLY A 76 76.730 -19.975 -6.141 1.00 1.00 C ATOM 1140 O GLY A 76 77.869 -19.553 -6.191 1.00 1.00 O ATOM 0 H GLY A 76 74.074 -20.908 -4.631 1.00 1.00 H new ATOM 0 HA2 GLY A 76 76.161 -19.169 -4.212 1.00 1.00 H new ATOM 0 HA3 GLY A 76 76.296 -20.916 -4.238 1.00 1.00 H new ATOM 1144 N ILE A 77 76.084 -20.439 -7.218 1.00 1.00 N ATOM 1145 CA ILE A 77 76.726 -20.456 -8.531 1.00 1.00 C ATOM 1146 C ILE A 77 77.267 -19.080 -8.892 1.00 1.00 C ATOM 1147 O ILE A 77 78.384 -18.980 -9.393 1.00 1.00 O ATOM 1148 CB ILE A 77 75.754 -20.937 -9.644 1.00 1.00 C ATOM 1149 CG1 ILE A 77 75.450 -22.431 -9.492 1.00 1.00 C ATOM 1150 CG2 ILE A 77 76.385 -20.724 -11.022 1.00 1.00 C ATOM 1151 CD1 ILE A 77 74.294 -22.803 -10.430 1.00 1.00 C ATOM 0 H ILE A 77 75.131 -20.802 -7.204 1.00 1.00 H new ATOM 0 HA ILE A 77 77.553 -21.163 -8.467 1.00 1.00 H new ATOM 0 HB ILE A 77 74.834 -20.360 -9.551 1.00 1.00 H new ATOM 0 HG12 ILE A 77 76.334 -23.022 -9.732 1.00 1.00 H new ATOM 0 HG13 ILE A 77 75.185 -22.658 -8.459 1.00 1.00 H new ATOM 0 HG21 ILE A 77 75.695 -21.064 -11.794 1.00 1.00 H new ATOM 0 HG22 ILE A 77 76.596 -19.664 -11.166 1.00 1.00 H new ATOM 0 HG23 ILE A 77 77.313 -21.291 -11.089 1.00 1.00 H new ATOM 0 HD11 ILE A 77 74.071 -23.865 -10.329 1.00 1.00 H new ATOM 0 HD12 ILE A 77 73.411 -22.220 -10.168 1.00 1.00 H new ATOM 0 HD13 ILE A 77 74.578 -22.589 -11.460 1.00 1.00 H new ATOM 1163 N VAL A 78 76.507 -18.013 -8.656 1.00 1.00 N ATOM 1164 CA VAL A 78 76.972 -16.681 -8.993 1.00 1.00 C ATOM 1165 C VAL A 78 78.370 -16.408 -8.444 1.00 1.00 C ATOM 1166 O VAL A 78 79.062 -15.513 -8.931 1.00 1.00 O ATOM 1167 CB VAL A 78 75.991 -15.655 -8.436 1.00 1.00 C ATOM 1168 CG1 VAL A 78 76.417 -14.254 -8.878 1.00 1.00 C ATOM 1169 CG2 VAL A 78 74.585 -15.958 -8.973 1.00 1.00 C ATOM 0 H VAL A 78 75.578 -18.049 -8.237 1.00 1.00 H new ATOM 0 HA VAL A 78 77.027 -16.605 -10.079 1.00 1.00 H new ATOM 0 HB VAL A 78 75.984 -15.705 -7.347 1.00 1.00 H new ATOM 0 HG11 VAL A 78 75.717 -13.519 -8.481 1.00 1.00 H new ATOM 0 HG12 VAL A 78 77.418 -14.042 -8.502 1.00 1.00 H new ATOM 0 HG13 VAL A 78 76.420 -14.201 -9.967 1.00 1.00 H new ATOM 0 HG21 VAL A 78 73.879 -15.227 -8.578 1.00 1.00 H new ATOM 0 HG22 VAL A 78 74.592 -15.904 -10.062 1.00 1.00 H new ATOM 0 HG23 VAL A 78 74.284 -16.958 -8.661 1.00 1.00 H new ATOM 1179 N ILE A 79 78.792 -17.185 -7.442 1.00 1.00 N ATOM 1180 CA ILE A 79 80.142 -16.985 -6.868 1.00 1.00 C ATOM 1181 C ILE A 79 81.199 -17.841 -7.595 1.00 1.00 C ATOM 1182 O ILE A 79 82.328 -17.402 -7.808 1.00 1.00 O ATOM 1183 CB ILE A 79 80.149 -17.277 -5.345 1.00 1.00 C ATOM 1184 CG1 ILE A 79 80.438 -18.777 -5.069 1.00 1.00 C ATOM 1185 CG2 ILE A 79 78.792 -16.865 -4.758 1.00 1.00 C ATOM 1186 CD1 ILE A 79 79.933 -19.192 -3.679 1.00 1.00 C ATOM 0 H ILE A 79 78.247 -17.935 -7.018 1.00 1.00 H new ATOM 0 HA ILE A 79 80.407 -15.938 -7.015 1.00 1.00 H new ATOM 0 HB ILE A 79 80.943 -16.701 -4.868 1.00 1.00 H new ATOM 0 HG12 ILE A 79 79.957 -19.389 -5.832 1.00 1.00 H new ATOM 0 HG13 ILE A 79 81.510 -18.963 -5.140 1.00 1.00 H new ATOM 0 HG21 ILE A 79 78.783 -17.065 -3.687 1.00 1.00 H new ATOM 0 HG22 ILE A 79 78.629 -15.801 -4.930 1.00 1.00 H new ATOM 0 HG23 ILE A 79 77.999 -17.436 -5.240 1.00 1.00 H new ATOM 0 HD11 ILE A 79 80.149 -20.247 -3.514 1.00 1.00 H new ATOM 0 HD12 ILE A 79 80.434 -18.595 -2.917 1.00 1.00 H new ATOM 0 HD13 ILE A 79 78.857 -19.028 -3.619 1.00 1.00 H new ATOM 1198 N ALA A 80 80.825 -19.064 -7.956 1.00 1.00 N ATOM 1199 CA ALA A 80 81.741 -19.987 -8.641 1.00 1.00 C ATOM 1200 C ALA A 80 81.826 -19.739 -10.160 1.00 1.00 C ATOM 1201 O ALA A 80 82.867 -19.998 -10.768 1.00 1.00 O ATOM 1202 CB ALA A 80 81.316 -21.429 -8.356 1.00 1.00 C ATOM 0 H ALA A 80 79.894 -19.445 -7.788 1.00 1.00 H new ATOM 0 HA ALA A 80 82.741 -19.805 -8.247 1.00 1.00 H new ATOM 0 HB1 ALA A 80 81.994 -22.115 -8.863 1.00 1.00 H new ATOM 0 HB2 ALA A 80 81.350 -21.613 -7.282 1.00 1.00 H new ATOM 0 HB3 ALA A 80 80.301 -21.588 -8.719 1.00 1.00 H new ATOM 1208 N GLU A 81 80.757 -19.194 -10.767 1.00 1.00 N ATOM 1209 CA GLU A 81 80.763 -18.889 -12.188 1.00 1.00 C ATOM 1210 C GLU A 81 81.410 -17.509 -12.433 1.00 1.00 C ATOM 1211 O GLU A 81 82.471 -17.435 -13.041 1.00 1.00 O ATOM 1212 CB GLU A 81 79.312 -18.956 -12.748 1.00 1.00 C ATOM 1213 CG GLU A 81 78.555 -17.651 -12.494 1.00 1.00 C ATOM 1214 CD GLU A 81 77.075 -17.810 -12.801 1.00 1.00 C ATOM 1215 OE1 GLU A 81 76.718 -18.817 -13.388 1.00 1.00 O ATOM 1216 OE2 GLU A 81 76.318 -16.937 -12.410 1.00 1.00 O ATOM 0 H GLU A 81 79.887 -18.961 -10.289 1.00 1.00 H new ATOM 0 HA GLU A 81 81.361 -19.630 -12.719 1.00 1.00 H new ATOM 0 HB2 GLU A 81 79.343 -19.158 -13.819 1.00 1.00 H new ATOM 0 HB3 GLU A 81 78.778 -19.785 -12.282 1.00 1.00 H new ATOM 0 HG2 GLU A 81 78.684 -17.348 -11.455 1.00 1.00 H new ATOM 0 HG3 GLU A 81 78.975 -16.857 -13.112 1.00 1.00 H new ATOM 1223 N ASP A 82 80.778 -16.409 -12.000 1.00 1.00 N ATOM 1224 CA ASP A 82 81.325 -15.088 -12.253 1.00 1.00 C ATOM 1225 C ASP A 82 82.614 -14.858 -11.532 1.00 1.00 C ATOM 1226 O ASP A 82 83.388 -14.003 -11.967 1.00 1.00 O ATOM 1227 CB ASP A 82 80.322 -14.023 -11.860 1.00 1.00 C ATOM 1228 CG ASP A 82 79.086 -14.188 -12.730 1.00 1.00 C ATOM 1229 OD1 ASP A 82 79.239 -14.181 -13.942 1.00 1.00 O ATOM 1230 OD2 ASP A 82 78.011 -14.336 -12.179 1.00 1.00 O ATOM 0 H ASP A 82 79.900 -16.416 -11.481 1.00 1.00 H new ATOM 0 HA ASP A 82 81.531 -15.026 -13.322 1.00 1.00 H new ATOM 0 HB2 ASP A 82 80.060 -14.118 -10.806 1.00 1.00 H new ATOM 0 HB3 ASP A 82 80.751 -13.030 -11.994 1.00 1.00 H new ATOM 1235 N ALA A 83 82.895 -15.636 -10.482 1.00 1.00 N ATOM 1236 CA ALA A 83 84.170 -15.527 -9.762 1.00 1.00 C ATOM 1237 C ALA A 83 85.237 -14.811 -10.597 1.00 1.00 C ATOM 1238 O ALA A 83 85.824 -13.842 -10.111 1.00 1.00 O ATOM 1239 CB ALA A 83 84.646 -16.949 -9.357 1.00 1.00 C ATOM 0 H ALA A 83 82.261 -16.345 -10.112 1.00 1.00 H new ATOM 0 HA ALA A 83 84.015 -14.924 -8.868 1.00 1.00 H new ATOM 0 HB1 ALA A 83 85.593 -16.877 -8.822 1.00 1.00 H new ATOM 0 HB2 ALA A 83 83.899 -17.413 -8.713 1.00 1.00 H new ATOM 0 HB3 ALA A 83 84.781 -17.556 -10.252 1.00 1.00 H new ATOM 1245 N LEU A 84 85.539 -15.269 -11.826 1.00 1.00 N ATOM 1246 CA LEU A 84 86.595 -14.643 -12.659 1.00 1.00 C ATOM 1247 C LEU A 84 86.802 -13.160 -12.363 1.00 1.00 C ATOM 1248 O LEU A 84 87.929 -12.740 -12.112 1.00 1.00 O ATOM 1249 CB LEU A 84 86.145 -14.785 -14.155 1.00 1.00 C ATOM 1250 CG LEU A 84 86.700 -16.058 -14.848 1.00 1.00 C ATOM 1251 CD1 LEU A 84 88.215 -15.945 -15.066 1.00 1.00 C ATOM 1252 CD2 LEU A 84 86.392 -17.314 -14.018 1.00 1.00 C ATOM 0 H LEU A 84 85.074 -16.063 -12.266 1.00 1.00 H new ATOM 0 HA LEU A 84 87.538 -15.145 -12.442 1.00 1.00 H new ATOM 0 HB2 LEU A 84 85.056 -14.802 -14.199 1.00 1.00 H new ATOM 0 HB3 LEU A 84 86.473 -13.906 -14.710 1.00 1.00 H new ATOM 0 HG LEU A 84 86.208 -16.146 -15.817 1.00 1.00 H new ATOM 0 HD11 LEU A 84 88.581 -16.849 -15.553 1.00 1.00 H new ATOM 0 HD12 LEU A 84 88.429 -15.082 -15.696 1.00 1.00 H new ATOM 0 HD13 LEU A 84 88.713 -15.824 -14.104 1.00 1.00 H new ATOM 0 HD21 LEU A 84 86.791 -18.192 -14.525 1.00 1.00 H new ATOM 0 HD22 LEU A 84 86.853 -17.222 -13.034 1.00 1.00 H new ATOM 0 HD23 LEU A 84 85.313 -17.420 -13.905 1.00 1.00 H new ATOM 1264 N ILE A 85 85.743 -12.361 -12.414 1.00 1.00 N ATOM 1265 CA ILE A 85 85.878 -10.933 -12.154 1.00 1.00 C ATOM 1266 C ILE A 85 85.658 -10.654 -10.667 1.00 1.00 C ATOM 1267 O ILE A 85 86.282 -9.769 -10.091 1.00 1.00 O ATOM 1268 CB ILE A 85 84.860 -10.166 -13.003 1.00 1.00 C ATOM 1269 CG1 ILE A 85 83.445 -10.535 -12.551 1.00 1.00 C ATOM 1270 CG2 ILE A 85 85.035 -10.552 -14.478 1.00 1.00 C ATOM 1271 CD1 ILE A 85 82.418 -9.883 -13.475 1.00 1.00 C ATOM 0 H ILE A 85 84.795 -12.671 -12.629 1.00 1.00 H new ATOM 0 HA ILE A 85 86.882 -10.603 -12.421 1.00 1.00 H new ATOM 0 HB ILE A 85 85.017 -9.094 -12.883 1.00 1.00 H new ATOM 0 HG12 ILE A 85 83.321 -11.618 -12.562 1.00 1.00 H new ATOM 0 HG13 ILE A 85 83.284 -10.206 -11.524 1.00 1.00 H new ATOM 0 HG21 ILE A 85 84.312 -10.008 -15.085 1.00 1.00 H new ATOM 0 HG22 ILE A 85 86.044 -10.299 -14.803 1.00 1.00 H new ATOM 0 HG23 ILE A 85 84.874 -11.624 -14.595 1.00 1.00 H new ATOM 0 HD11 ILE A 85 81.413 -10.150 -13.148 1.00 1.00 H new ATOM 0 HD12 ILE A 85 82.535 -8.800 -13.442 1.00 1.00 H new ATOM 0 HD13 ILE A 85 82.572 -10.234 -14.495 1.00 1.00 H new ATOM 1283 N ALA A 86 84.750 -11.412 -10.058 1.00 1.00 N ATOM 1284 CA ALA A 86 84.458 -11.219 -8.644 1.00 1.00 C ATOM 1285 C ALA A 86 85.757 -11.270 -7.838 1.00 1.00 C ATOM 1286 O ALA A 86 86.069 -10.336 -7.110 1.00 1.00 O ATOM 1287 CB ALA A 86 83.466 -12.288 -8.140 1.00 1.00 C ATOM 0 H ALA A 86 84.214 -12.151 -10.512 1.00 1.00 H new ATOM 0 HA ALA A 86 83.995 -10.241 -8.511 1.00 1.00 H new ATOM 0 HB1 ALA A 86 83.262 -12.125 -7.082 1.00 1.00 H new ATOM 0 HB2 ALA A 86 82.536 -12.216 -8.704 1.00 1.00 H new ATOM 0 HB3 ALA A 86 83.898 -13.279 -8.278 1.00 1.00 H new ATOM 1293 N GLU A 87 86.526 -12.346 -7.975 1.00 1.00 N ATOM 1294 CA GLU A 87 87.782 -12.443 -7.244 1.00 1.00 C ATOM 1295 C GLU A 87 88.666 -11.255 -7.593 1.00 1.00 C ATOM 1296 O GLU A 87 89.577 -10.905 -6.841 1.00 1.00 O ATOM 1297 CB GLU A 87 88.500 -13.757 -7.594 1.00 1.00 C ATOM 1298 CG GLU A 87 89.724 -13.957 -6.683 1.00 1.00 C ATOM 1299 CD GLU A 87 90.916 -13.147 -7.196 1.00 1.00 C ATOM 1300 OE1 GLU A 87 90.800 -12.556 -8.257 1.00 1.00 O ATOM 1301 OE2 GLU A 87 91.931 -13.135 -6.521 1.00 1.00 O ATOM 0 H GLU A 87 86.308 -13.145 -8.571 1.00 1.00 H new ATOM 0 HA GLU A 87 87.575 -12.435 -6.174 1.00 1.00 H new ATOM 0 HB2 GLU A 87 87.813 -14.596 -7.481 1.00 1.00 H new ATOM 0 HB3 GLU A 87 88.814 -13.741 -8.638 1.00 1.00 H new ATOM 0 HG2 GLU A 87 89.481 -13.651 -5.666 1.00 1.00 H new ATOM 0 HG3 GLU A 87 89.986 -15.014 -6.644 1.00 1.00 H new ATOM 1308 N ALA A 88 88.389 -10.630 -8.737 1.00 1.00 N ATOM 1309 CA ALA A 88 89.171 -9.475 -9.152 1.00 1.00 C ATOM 1310 C ALA A 88 88.806 -8.264 -8.295 1.00 1.00 C ATOM 1311 O ALA A 88 89.500 -7.255 -8.337 1.00 1.00 O ATOM 1312 CB ALA A 88 88.969 -9.177 -10.647 1.00 1.00 C ATOM 0 H ALA A 88 87.644 -10.900 -9.379 1.00 1.00 H new ATOM 0 HA ALA A 88 90.228 -9.699 -9.005 1.00 1.00 H new ATOM 0 HB1 ALA A 88 89.565 -8.309 -10.929 1.00 1.00 H new ATOM 0 HB2 ALA A 88 89.282 -10.039 -11.235 1.00 1.00 H new ATOM 0 HB3 ALA A 88 87.916 -8.971 -10.838 1.00 1.00 H new ATOM 1318 N VAL A 89 87.691 -8.362 -7.545 1.00 1.00 N ATOM 1319 CA VAL A 89 87.214 -7.254 -6.688 1.00 1.00 C ATOM 1320 C VAL A 89 88.319 -6.658 -5.791 1.00 1.00 C ATOM 1321 O VAL A 89 88.022 -5.921 -4.856 1.00 1.00 O ATOM 1322 CB VAL A 89 86.024 -7.694 -5.813 1.00 1.00 C ATOM 1323 CG1 VAL A 89 84.816 -8.074 -6.711 1.00 1.00 C ATOM 1324 CG2 VAL A 89 86.428 -8.896 -4.917 1.00 1.00 C ATOM 0 H VAL A 89 87.103 -9.195 -7.514 1.00 1.00 H new ATOM 0 HA VAL A 89 86.893 -6.472 -7.376 1.00 1.00 H new ATOM 0 HB VAL A 89 85.736 -6.863 -5.168 1.00 1.00 H new ATOM 0 HG11 VAL A 89 83.980 -8.384 -6.084 1.00 1.00 H new ATOM 0 HG12 VAL A 89 84.521 -7.211 -7.309 1.00 1.00 H new ATOM 0 HG13 VAL A 89 85.097 -8.894 -7.372 1.00 1.00 H new ATOM 0 HG21 VAL A 89 85.577 -9.196 -4.305 1.00 1.00 H new ATOM 0 HG22 VAL A 89 86.735 -9.732 -5.546 1.00 1.00 H new ATOM 0 HG23 VAL A 89 87.256 -8.606 -4.270 1.00 1.00 H new ATOM 1334 N GLY A 90 89.579 -7.030 -6.055 1.00 1.00 N ATOM 1335 CA GLY A 90 90.710 -6.573 -5.229 1.00 1.00 C ATOM 1336 C GLY A 90 90.464 -5.137 -4.720 1.00 1.00 C ATOM 1337 O GLY A 90 90.623 -4.917 -3.520 1.00 1.00 O ATOM 0 H GLY A 90 89.842 -7.642 -6.828 1.00 1.00 H new ATOM 0 HA2 GLY A 90 90.845 -7.247 -4.383 1.00 1.00 H new ATOM 0 HA3 GLY A 90 91.630 -6.605 -5.812 1.00 1.00 H new ATOM 1341 N PRO A 91 89.954 -4.201 -5.514 1.00 1.00 N ATOM 1342 CA PRO A 91 89.520 -2.866 -4.984 1.00 1.00 C ATOM 1343 C PRO A 91 88.707 -3.028 -3.675 1.00 1.00 C ATOM 1344 O PRO A 91 88.221 -2.046 -3.119 1.00 1.00 O ATOM 1345 CB PRO A 91 88.623 -2.284 -6.110 1.00 1.00 C ATOM 1346 CG PRO A 91 88.531 -3.364 -7.152 1.00 1.00 C ATOM 1347 CD PRO A 91 89.774 -4.223 -6.976 1.00 1.00 C ATOM 0 HA PRO A 91 90.365 -2.222 -4.741 1.00 1.00 H new ATOM 0 HB2 PRO A 91 87.636 -2.022 -5.729 1.00 1.00 H new ATOM 0 HB3 PRO A 91 89.056 -1.374 -6.526 1.00 1.00 H new ATOM 0 HG2 PRO A 91 87.625 -3.956 -7.021 1.00 1.00 H new ATOM 0 HG3 PRO A 91 88.490 -2.937 -8.154 1.00 1.00 H new ATOM 0 HD2 PRO A 91 89.628 -5.235 -7.354 1.00 1.00 H new ATOM 0 HD3 PRO A 91 90.635 -3.808 -7.500 1.00 1.00 H new ATOM 1355 N HIS A 92 88.528 -4.277 -3.213 1.00 1.00 N ATOM 1356 CA HIS A 92 87.734 -4.540 -2.023 1.00 1.00 C ATOM 1357 C HIS A 92 88.213 -3.652 -0.900 1.00 1.00 C ATOM 1358 O HIS A 92 87.388 -3.095 -0.191 1.00 1.00 O ATOM 1359 CB HIS A 92 87.857 -6.030 -1.607 1.00 1.00 C ATOM 1360 CG HIS A 92 87.358 -6.229 -0.189 1.00 1.00 C ATOM 1361 ND1 HIS A 92 88.221 -6.270 0.899 1.00 1.00 N ATOM 1362 CD2 HIS A 92 86.097 -6.394 0.333 1.00 1.00 C ATOM 1363 CE1 HIS A 92 87.477 -6.453 2.006 1.00 1.00 C ATOM 1364 NE2 HIS A 92 86.174 -6.535 1.719 1.00 1.00 N ATOM 0 H HIS A 92 88.924 -5.109 -3.650 1.00 1.00 H new ATOM 0 HA HIS A 92 86.687 -4.328 -2.238 1.00 1.00 H new ATOM 0 HB2 HIS A 92 87.282 -6.653 -2.292 1.00 1.00 H new ATOM 0 HB3 HIS A 92 88.896 -6.350 -1.681 1.00 1.00 H new ATOM 0 HD2 HIS A 92 85.184 -6.412 -0.243 1.00 1.00 H new ATOM 0 HE1 HIS A 92 87.883 -6.525 3.004 1.00 1.00 H new ATOM 0 HE2 HIS A 92 85.403 -6.671 2.372 1.00 1.00 H new ATOM 1372 N LEU A 93 89.516 -3.472 -0.729 1.00 1.00 N ATOM 1373 CA LEU A 93 90.018 -2.582 0.314 1.00 1.00 C ATOM 1374 C LEU A 93 89.565 -1.152 0.053 1.00 1.00 C ATOM 1375 O LEU A 93 89.243 -0.411 0.988 1.00 1.00 O ATOM 1376 CB LEU A 93 91.546 -2.615 0.280 1.00 1.00 C ATOM 1377 CG LEU A 93 92.140 -1.536 1.193 1.00 1.00 C ATOM 1378 CD1 LEU A 93 91.660 -1.744 2.630 1.00 1.00 C ATOM 1379 CD2 LEU A 93 93.663 -1.634 1.131 1.00 1.00 C ATOM 0 H LEU A 93 90.238 -3.923 -1.290 1.00 1.00 H new ATOM 0 HA LEU A 93 89.637 -2.910 1.281 1.00 1.00 H new ATOM 0 HB2 LEU A 93 91.899 -3.597 0.595 1.00 1.00 H new ATOM 0 HB3 LEU A 93 91.894 -2.463 -0.742 1.00 1.00 H new ATOM 0 HG LEU A 93 91.817 -0.549 0.862 1.00 1.00 H new ATOM 0 HD11 LEU A 93 92.087 -0.973 3.271 1.00 1.00 H new ATOM 0 HD12 LEU A 93 90.572 -1.682 2.663 1.00 1.00 H new ATOM 0 HD13 LEU A 93 91.978 -2.725 2.981 1.00 1.00 H new ATOM 0 HD21 LEU A 93 94.103 -0.873 1.775 1.00 1.00 H new ATOM 0 HD22 LEU A 93 93.978 -2.621 1.468 1.00 1.00 H new ATOM 0 HD23 LEU A 93 93.996 -1.478 0.105 1.00 1.00 H new ATOM 1391 N ALA A 94 89.590 -0.761 -1.224 1.00 1.00 N ATOM 1392 CA ALA A 94 89.188 0.589 -1.564 1.00 1.00 C ATOM 1393 C ALA A 94 87.756 0.712 -1.149 1.00 1.00 C ATOM 1394 O ALA A 94 87.411 1.521 -0.284 1.00 1.00 O ATOM 1395 CB ALA A 94 89.325 0.886 -3.062 1.00 1.00 C ATOM 0 H ALA A 94 89.876 -1.345 -2.010 1.00 1.00 H new ATOM 0 HA ALA A 94 89.833 1.306 -1.056 1.00 1.00 H new ATOM 0 HB1 ALA A 94 89.010 1.911 -3.260 1.00 1.00 H new ATOM 0 HB2 ALA A 94 90.365 0.761 -3.364 1.00 1.00 H new ATOM 0 HB3 ALA A 94 88.697 0.198 -3.628 1.00 1.00 H new ATOM 1401 N ARG A 95 86.923 -0.129 -1.738 1.00 1.00 N ATOM 1402 CA ARG A 95 85.534 -0.139 -1.389 1.00 1.00 C ATOM 1403 C ARG A 95 85.407 -0.407 0.102 1.00 1.00 C ATOM 1404 O ARG A 95 84.429 0.004 0.725 1.00 1.00 O ATOM 1405 CB ARG A 95 84.783 -1.251 -2.140 1.00 1.00 C ATOM 1406 CG ARG A 95 85.093 -1.207 -3.643 1.00 1.00 C ATOM 1407 CD ARG A 95 84.669 0.137 -4.256 1.00 1.00 C ATOM 1408 NE ARG A 95 85.844 0.988 -4.415 1.00 1.00 N ATOM 1409 CZ ARG A 95 85.800 2.306 -4.229 1.00 1.00 C ATOM 1410 NH1 ARG A 95 84.699 2.889 -3.852 1.00 1.00 N ATOM 1411 NH2 ARG A 95 86.875 3.017 -4.415 1.00 1.00 N ATOM 0 H ARG A 95 87.192 -0.804 -2.453 1.00 1.00 H new ATOM 0 HA ARG A 95 85.104 0.826 -1.658 1.00 1.00 H new ATOM 0 HB2 ARG A 95 85.066 -2.223 -1.735 1.00 1.00 H new ATOM 0 HB3 ARG A 95 83.710 -1.140 -1.983 1.00 1.00 H new ATOM 0 HG2 ARG A 95 86.160 -1.362 -3.802 1.00 1.00 H new ATOM 0 HG3 ARG A 95 84.573 -2.021 -4.149 1.00 1.00 H new ATOM 0 HD2 ARG A 95 84.191 -0.026 -5.222 1.00 1.00 H new ATOM 0 HD3 ARG A 95 83.935 0.627 -3.615 1.00 1.00 H new ATOM 0 HE ARG A 95 86.731 0.558 -4.678 1.00 1.00 H new ATOM 0 HH11 ARG A 95 83.857 2.336 -3.695 1.00 1.00 H new ATOM 0 HH12 ARG A 95 84.679 3.899 -3.713 1.00 1.00 H new ATOM 0 HH21 ARG A 95 87.743 2.564 -4.701 1.00 1.00 H new ATOM 0 HH22 ARG A 95 86.849 4.027 -4.275 1.00 1.00 H new ATOM 1425 N ALA A 96 86.357 -1.152 0.681 1.00 1.00 N ATOM 1426 CA ALA A 96 86.207 -1.482 2.115 1.00 1.00 C ATOM 1427 C ALA A 96 86.143 -0.206 2.893 1.00 1.00 C ATOM 1428 O ALA A 96 85.248 -0.005 3.664 1.00 1.00 O ATOM 1429 CB ALA A 96 87.336 -2.350 2.688 1.00 1.00 C ATOM 0 H ALA A 96 87.189 -1.521 0.220 1.00 1.00 H new ATOM 0 HA ALA A 96 85.293 -2.070 2.203 1.00 1.00 H new ATOM 0 HB1 ALA A 96 87.146 -2.544 3.744 1.00 1.00 H new ATOM 0 HB2 ALA A 96 87.378 -3.296 2.147 1.00 1.00 H new ATOM 0 HB3 ALA A 96 88.287 -1.828 2.580 1.00 1.00 H new ATOM 1435 N LEU A 97 87.144 0.626 2.682 1.00 1.00 N ATOM 1436 CA LEU A 97 87.241 1.892 3.404 1.00 1.00 C ATOM 1437 C LEU A 97 85.796 2.443 3.641 1.00 1.00 C ATOM 1438 O LEU A 97 85.485 3.029 4.680 1.00 1.00 O ATOM 1439 CB LEU A 97 88.052 2.872 2.527 1.00 1.00 C ATOM 1440 CG LEU A 97 88.939 3.776 3.390 1.00 1.00 C ATOM 1441 CD1 LEU A 97 89.831 4.622 2.484 1.00 1.00 C ATOM 1442 CD2 LEU A 97 88.061 4.698 4.236 1.00 1.00 C ATOM 0 H LEU A 97 87.902 0.455 2.021 1.00 1.00 H new ATOM 0 HA LEU A 97 87.734 1.765 4.368 1.00 1.00 H new ATOM 0 HB2 LEU A 97 88.671 2.312 1.826 1.00 1.00 H new ATOM 0 HB3 LEU A 97 87.372 3.483 1.934 1.00 1.00 H new ATOM 0 HG LEU A 97 89.556 3.160 4.044 1.00 1.00 H new ATOM 0 HD11 LEU A 97 90.463 5.266 3.095 1.00 1.00 H new ATOM 0 HD12 LEU A 97 90.458 3.968 1.877 1.00 1.00 H new ATOM 0 HD13 LEU A 97 89.210 5.236 1.832 1.00 1.00 H new ATOM 0 HD21 LEU A 97 88.693 5.340 4.849 1.00 1.00 H new ATOM 0 HD22 LEU A 97 87.444 5.314 3.582 1.00 1.00 H new ATOM 0 HD23 LEU A 97 87.419 4.098 4.881 1.00 1.00 H new ATOM 1454 N GLY A 98 84.886 2.091 2.725 1.00 1.00 N ATOM 1455 CA GLY A 98 83.460 2.434 2.894 1.00 1.00 C ATOM 1456 C GLY A 98 82.707 1.340 3.680 1.00 1.00 C ATOM 1457 O GLY A 98 82.039 1.566 4.715 1.00 1.00 O ATOM 0 H GLY A 98 85.101 1.577 1.871 1.00 1.00 H new ATOM 0 HA2 GLY A 98 83.373 3.386 3.418 1.00 1.00 H new ATOM 0 HA3 GLY A 98 82.997 2.565 1.916 1.00 1.00 H new ATOM 1461 N GLN A 99 82.845 0.123 3.191 1.00 1.00 N ATOM 1462 CA GLN A 99 82.240 -1.021 3.806 1.00 1.00 C ATOM 1463 C GLN A 99 83.073 -1.436 5.003 1.00 1.00 C ATOM 1464 O GLN A 99 82.811 -2.465 5.626 1.00 1.00 O ATOM 1465 CB GLN A 99 82.072 -2.166 2.791 1.00 1.00 C ATOM 1466 CG GLN A 99 80.954 -3.130 3.252 1.00 1.00 C ATOM 1467 CD GLN A 99 80.283 -3.790 2.050 1.00 1.00 C ATOM 1468 OE1 GLN A 99 80.616 -4.921 1.699 1.00 1.00 O ATOM 1469 NE2 GLN A 99 79.350 -3.145 1.397 1.00 1.00 N ATOM 0 H GLN A 99 83.384 -0.091 2.352 1.00 1.00 H new ATOM 0 HA GLN A 99 81.239 -0.767 4.153 1.00 1.00 H new ATOM 0 HB2 GLN A 99 81.829 -1.759 1.810 1.00 1.00 H new ATOM 0 HB3 GLN A 99 83.011 -2.710 2.687 1.00 1.00 H new ATOM 0 HG2 GLN A 99 81.373 -3.894 3.906 1.00 1.00 H new ATOM 0 HG3 GLN A 99 80.212 -2.583 3.834 1.00 1.00 H new ATOM 0 HE21 GLN A 99 79.077 -2.207 1.691 1.00 1.00 H new ATOM 0 HE22 GLN A 99 78.896 -3.580 0.594 1.00 1.00 H new ATOM 1478 N ILE A 100 84.094 -0.626 5.337 1.00 1.00 N ATOM 1479 CA ILE A 100 84.961 -0.907 6.455 1.00 1.00 C ATOM 1480 C ILE A 100 84.138 -0.859 7.702 1.00 1.00 C ATOM 1481 O ILE A 100 84.223 -1.750 8.541 1.00 1.00 O ATOM 1482 CB ILE A 100 86.103 0.161 6.509 1.00 1.00 C ATOM 1483 CG1 ILE A 100 87.459 -0.470 6.148 1.00 1.00 C ATOM 1484 CG2 ILE A 100 86.227 0.811 7.908 1.00 1.00 C ATOM 1485 CD1 ILE A 100 87.801 -1.616 7.116 1.00 1.00 C ATOM 0 H ILE A 100 84.325 0.230 4.833 1.00 1.00 H new ATOM 0 HA ILE A 100 85.417 -1.892 6.354 1.00 1.00 H new ATOM 0 HB ILE A 100 85.838 0.930 5.783 1.00 1.00 H new ATOM 0 HG12 ILE A 100 87.429 -0.847 5.126 1.00 1.00 H new ATOM 0 HG13 ILE A 100 88.240 0.289 6.185 1.00 1.00 H new ATOM 0 HG21 ILE A 100 87.032 1.546 7.898 1.00 1.00 H new ATOM 0 HG22 ILE A 100 85.289 1.304 8.165 1.00 1.00 H new ATOM 0 HG23 ILE A 100 86.447 0.042 8.648 1.00 1.00 H new ATOM 0 HD11 ILE A 100 88.764 -2.048 6.843 1.00 1.00 H new ATOM 0 HD12 ILE A 100 87.853 -1.229 8.134 1.00 1.00 H new ATOM 0 HD13 ILE A 100 87.029 -2.384 7.058 1.00 1.00 H new ATOM 1497 N VAL A 101 83.324 0.177 7.849 1.00 1.00 N ATOM 1498 CA VAL A 101 82.521 0.218 9.055 1.00 1.00 C ATOM 1499 C VAL A 101 81.709 -1.081 9.158 1.00 1.00 C ATOM 1500 O VAL A 101 81.789 -1.828 10.141 1.00 1.00 O ATOM 1501 CB VAL A 101 81.586 1.444 9.083 1.00 1.00 C ATOM 1502 CG1 VAL A 101 82.428 2.713 9.233 1.00 1.00 C ATOM 1503 CG2 VAL A 101 80.748 1.524 7.793 1.00 1.00 C ATOM 0 H VAL A 101 83.206 0.951 7.195 1.00 1.00 H new ATOM 0 HA VAL A 101 83.188 0.309 9.912 1.00 1.00 H new ATOM 0 HB VAL A 101 80.903 1.348 9.927 1.00 1.00 H new ATOM 0 HG11 VAL A 101 81.773 3.584 9.253 1.00 1.00 H new ATOM 0 HG12 VAL A 101 82.997 2.665 10.162 1.00 1.00 H new ATOM 0 HG13 VAL A 101 83.115 2.795 8.391 1.00 1.00 H new ATOM 0 HG21 VAL A 101 80.096 2.397 7.836 1.00 1.00 H new ATOM 0 HG22 VAL A 101 81.412 1.609 6.933 1.00 1.00 H new ATOM 0 HG23 VAL A 101 80.142 0.623 7.696 1.00 1.00 H new ATOM 1513 N CYS A 102 80.885 -1.310 8.164 1.00 1.00 N ATOM 1514 CA CYS A 102 79.998 -2.464 8.178 1.00 1.00 C ATOM 1515 C CYS A 102 80.677 -3.749 8.710 1.00 1.00 C ATOM 1516 O CYS A 102 79.993 -4.636 9.199 1.00 1.00 O ATOM 1517 CB CYS A 102 79.557 -2.692 6.722 1.00 1.00 C ATOM 1518 SG CYS A 102 78.351 -4.033 6.601 1.00 1.00 S ATOM 0 H CYS A 102 80.805 -0.720 7.336 1.00 1.00 H new ATOM 0 HA CYS A 102 79.164 -2.261 8.849 1.00 1.00 H new ATOM 0 HB2 CYS A 102 79.124 -1.774 6.323 1.00 1.00 H new ATOM 0 HB3 CYS A 102 80.427 -2.927 6.109 1.00 1.00 H new ATOM 1523 N ARG A 103 82.016 -3.762 8.692 1.00 1.00 N ATOM 1524 CA ARG A 103 82.861 -4.897 9.182 1.00 1.00 C ATOM 1525 C ARG A 103 83.242 -4.813 10.663 1.00 1.00 C ATOM 1526 O ARG A 103 83.344 -5.814 11.376 1.00 1.00 O ATOM 1527 CB ARG A 103 84.162 -4.868 8.366 1.00 1.00 C ATOM 1528 CG ARG A 103 85.055 -6.114 8.620 1.00 1.00 C ATOM 1529 CD ARG A 103 86.503 -5.673 8.901 1.00 1.00 C ATOM 1530 NE ARG A 103 86.569 -4.961 10.171 1.00 1.00 N ATOM 1531 CZ ARG A 103 87.659 -4.289 10.525 1.00 1.00 C ATOM 1532 NH1 ARG A 103 88.678 -4.227 9.712 1.00 1.00 N ATOM 1533 NH2 ARG A 103 87.707 -3.687 11.680 1.00 1.00 N ATOM 0 H ARG A 103 82.566 -2.981 8.335 1.00 1.00 H new ATOM 0 HA ARG A 103 82.278 -5.810 9.063 1.00 1.00 H new ATOM 0 HB2 ARG A 103 83.920 -4.810 7.305 1.00 1.00 H new ATOM 0 HB3 ARG A 103 84.723 -3.967 8.615 1.00 1.00 H new ATOM 0 HG2 ARG A 103 84.668 -6.683 9.466 1.00 1.00 H new ATOM 0 HG3 ARG A 103 85.028 -6.774 7.753 1.00 1.00 H new ATOM 0 HD2 ARG A 103 87.158 -6.544 8.928 1.00 1.00 H new ATOM 0 HD3 ARG A 103 86.859 -5.031 8.096 1.00 1.00 H new ATOM 0 HE ARG A 103 85.765 -4.979 10.798 1.00 1.00 H new ATOM 0 HH11 ARG A 103 88.637 -4.694 8.806 1.00 1.00 H new ATOM 0 HH12 ARG A 103 89.516 -3.711 9.982 1.00 1.00 H new ATOM 0 HH21 ARG A 103 86.908 -3.732 12.312 1.00 1.00 H new ATOM 0 HH22 ARG A 103 88.544 -3.171 11.952 1.00 1.00 H new ATOM 1547 N TYR A 104 83.445 -3.593 11.072 1.00 1.00 N ATOM 1548 CA TYR A 104 83.826 -3.218 12.443 1.00 1.00 C ATOM 1549 C TYR A 104 82.605 -2.732 13.210 1.00 1.00 C ATOM 1550 O TYR A 104 82.734 -2.003 14.196 1.00 1.00 O ATOM 1551 CB TYR A 104 85.027 -2.217 12.491 1.00 1.00 C ATOM 1552 CG TYR A 104 84.597 -0.857 13.010 1.00 1.00 C ATOM 1553 CD1 TYR A 104 83.496 -0.239 12.437 1.00 1.00 C ATOM 1554 CD2 TYR A 104 85.272 -0.235 14.072 1.00 1.00 C ATOM 1555 CE1 TYR A 104 83.056 0.997 12.895 1.00 1.00 C ATOM 1556 CE2 TYR A 104 84.829 1.013 14.541 1.00 1.00 C ATOM 1557 CZ TYR A 104 83.717 1.629 13.943 1.00 1.00 C ATOM 1558 OH TYR A 104 83.267 2.852 14.388 1.00 1.00 O ATOM 0 H TYR A 104 83.351 -2.788 10.452 1.00 1.00 H new ATOM 0 HA TYR A 104 84.198 -4.111 12.946 1.00 1.00 H new ATOM 0 HB2 TYR A 104 85.812 -2.620 13.130 1.00 1.00 H new ATOM 0 HB3 TYR A 104 85.452 -2.109 11.493 1.00 1.00 H new ATOM 0 HD1 TYR A 104 82.974 -0.724 11.625 1.00 1.00 H new ATOM 0 HD2 TYR A 104 86.127 -0.713 14.526 1.00 1.00 H new ATOM 0 HE1 TYR A 104 82.199 1.468 12.436 1.00 1.00 H new ATOM 0 HE2 TYR A 104 85.342 1.497 15.359 1.00 1.00 H new ATOM 0 HH TYR A 104 83.834 3.161 15.125 1.00 1.00 H new ATOM 1568 N GLY A 105 81.408 -3.118 12.805 1.00 1.00 N ATOM 1569 CA GLY A 105 80.220 -2.682 13.515 1.00 1.00 C ATOM 1570 C GLY A 105 79.091 -3.620 13.130 1.00 1.00 C ATOM 1571 O GLY A 105 78.862 -4.625 13.803 1.00 1.00 O ATOM 0 H GLY A 105 81.234 -3.722 12.002 1.00 1.00 H new ATOM 0 HA2 GLY A 105 80.387 -2.704 14.592 1.00 1.00 H new ATOM 0 HA3 GLY A 105 79.971 -1.654 13.252 1.00 1.00 H new ATOM 1575 N ALA A 106 78.386 -3.299 12.046 1.00 1.00 N ATOM 1576 CA ALA A 106 77.299 -4.141 11.593 1.00 1.00 C ATOM 1577 C ALA A 106 76.080 -4.108 12.547 1.00 1.00 C ATOM 1578 O ALA A 106 75.689 -5.140 13.082 1.00 1.00 O ATOM 1579 CB ALA A 106 77.835 -5.582 11.450 1.00 1.00 C ATOM 0 H ALA A 106 78.551 -2.470 11.476 1.00 1.00 H new ATOM 0 HA ALA A 106 76.943 -3.763 10.635 1.00 1.00 H new ATOM 0 HB1 ALA A 106 77.033 -6.236 11.109 1.00 1.00 H new ATOM 0 HB2 ALA A 106 78.649 -5.597 10.725 1.00 1.00 H new ATOM 0 HB3 ALA A 106 78.203 -5.931 12.415 1.00 1.00 H new ATOM 1585 N THR A 107 75.490 -2.920 12.801 1.00 1.00 N ATOM 1586 CA THR A 107 74.317 -2.859 13.701 1.00 1.00 C ATOM 1587 C THR A 107 73.075 -3.364 12.954 1.00 1.00 C ATOM 1588 O THR A 107 72.406 -4.289 13.412 1.00 1.00 O ATOM 1589 CB THR A 107 74.075 -1.436 14.237 1.00 1.00 C ATOM 1590 OG1 THR A 107 75.287 -0.901 14.756 1.00 1.00 O ATOM 1591 CG2 THR A 107 73.028 -1.490 15.355 1.00 1.00 C ATOM 0 H THR A 107 75.790 -2.025 12.415 1.00 1.00 H new ATOM 0 HA THR A 107 74.517 -3.497 14.562 1.00 1.00 H new ATOM 0 HB THR A 107 73.720 -0.801 13.425 1.00 1.00 H new ATOM 0 HG1 THR A 107 75.127 0.005 15.094 1.00 1.00 H new ATOM 0 HG21 THR A 107 72.853 -0.485 15.738 1.00 1.00 H new ATOM 0 HG22 THR A 107 72.096 -1.896 14.961 1.00 1.00 H new ATOM 0 HG23 THR A 107 73.390 -2.128 16.162 1.00 1.00 H new ATOM 1599 N VAL A 108 72.744 -2.727 11.828 1.00 1.00 N ATOM 1600 CA VAL A 108 71.571 -3.121 11.049 1.00 1.00 C ATOM 1601 C VAL A 108 71.794 -4.506 10.403 1.00 1.00 C ATOM 1602 O VAL A 108 70.908 -5.354 10.426 1.00 1.00 O ATOM 1603 CB VAL A 108 71.294 -2.055 9.988 1.00 1.00 C ATOM 1604 CG1 VAL A 108 71.164 -0.687 10.673 1.00 1.00 C ATOM 1605 CG2 VAL A 108 72.453 -2.016 8.993 1.00 1.00 C ATOM 0 H VAL A 108 73.268 -1.943 11.439 1.00 1.00 H new ATOM 0 HA VAL A 108 70.704 -3.200 11.705 1.00 1.00 H new ATOM 0 HB VAL A 108 70.370 -2.292 9.460 1.00 1.00 H new ATOM 0 HG11 VAL A 108 70.966 0.078 9.923 1.00 1.00 H new ATOM 0 HG12 VAL A 108 70.342 -0.715 11.388 1.00 1.00 H new ATOM 0 HG13 VAL A 108 72.091 -0.452 11.195 1.00 1.00 H new ATOM 0 HG21 VAL A 108 72.257 -1.257 8.236 1.00 1.00 H new ATOM 0 HG22 VAL A 108 73.376 -1.774 9.519 1.00 1.00 H new ATOM 0 HG23 VAL A 108 72.553 -2.989 8.513 1.00 1.00 H new ATOM 1615 N ILE A 109 72.978 -4.697 9.812 1.00 1.00 N ATOM 1616 CA ILE A 109 73.310 -5.969 9.130 1.00 1.00 C ATOM 1617 C ILE A 109 72.694 -7.180 9.913 1.00 1.00 C ATOM 1618 O ILE A 109 71.930 -7.946 9.337 1.00 1.00 O ATOM 1619 CB ILE A 109 74.848 -6.083 8.948 1.00 1.00 C ATOM 1620 CG1 ILE A 109 75.291 -5.498 7.584 1.00 1.00 C ATOM 1621 CG2 ILE A 109 75.319 -7.551 9.039 1.00 1.00 C ATOM 1622 CD1 ILE A 109 75.134 -6.522 6.451 1.00 1.00 C ATOM 0 H ILE A 109 73.721 -3.999 9.787 1.00 1.00 H new ATOM 0 HA ILE A 109 72.868 -5.985 8.134 1.00 1.00 H new ATOM 0 HB ILE A 109 75.306 -5.511 9.755 1.00 1.00 H new ATOM 0 HG12 ILE A 109 74.699 -4.611 7.358 1.00 1.00 H new ATOM 0 HG13 ILE A 109 76.331 -5.179 7.645 1.00 1.00 H new ATOM 0 HG21 ILE A 109 76.400 -7.595 8.907 1.00 1.00 H new ATOM 0 HG22 ILE A 109 75.055 -7.958 10.015 1.00 1.00 H new ATOM 0 HG23 ILE A 109 74.834 -8.138 8.259 1.00 1.00 H new ATOM 0 HD11 ILE A 109 75.455 -6.075 5.510 1.00 1.00 H new ATOM 0 HD12 ILE A 109 75.747 -7.398 6.664 1.00 1.00 H new ATOM 0 HD13 ILE A 109 74.089 -6.821 6.373 1.00 1.00 H new ATOM 1634 N PRO A 110 72.952 -7.333 11.203 1.00 1.00 N ATOM 1635 CA PRO A 110 72.338 -8.418 12.045 1.00 1.00 C ATOM 1636 C PRO A 110 70.791 -8.390 12.037 1.00 1.00 C ATOM 1637 O PRO A 110 70.152 -9.404 12.302 1.00 1.00 O ATOM 1638 CB PRO A 110 72.841 -8.135 13.475 1.00 1.00 C ATOM 1639 CG PRO A 110 74.054 -7.293 13.306 1.00 1.00 C ATOM 1640 CD PRO A 110 73.877 -6.532 11.985 1.00 1.00 C ATOM 0 HA PRO A 110 72.620 -9.398 11.660 1.00 1.00 H new ATOM 0 HB2 PRO A 110 72.083 -7.618 14.063 1.00 1.00 H new ATOM 0 HB3 PRO A 110 73.075 -9.061 14.000 1.00 1.00 H new ATOM 0 HG2 PRO A 110 74.165 -6.601 14.141 1.00 1.00 H new ATOM 0 HG3 PRO A 110 74.953 -7.909 13.281 1.00 1.00 H new ATOM 0 HD2 PRO A 110 73.482 -5.531 12.158 1.00 1.00 H new ATOM 0 HD3 PRO A 110 74.829 -6.414 11.468 1.00 1.00 H new ATOM 1648 N ASN A 111 70.194 -7.221 11.764 1.00 1.00 N ATOM 1649 CA ASN A 111 68.727 -7.122 11.773 1.00 1.00 C ATOM 1650 C ASN A 111 68.136 -8.031 10.679 1.00 1.00 C ATOM 1651 O ASN A 111 67.476 -9.027 10.984 1.00 1.00 O ATOM 1652 CB ASN A 111 68.287 -5.635 11.618 1.00 1.00 C ATOM 1653 CG ASN A 111 67.918 -5.277 10.171 1.00 1.00 C ATOM 1654 OD1 ASN A 111 68.709 -4.648 9.468 1.00 1.00 O ATOM 1655 ND2 ASN A 111 66.757 -5.635 9.689 1.00 1.00 N ATOM 0 H ASN A 111 70.685 -6.356 11.541 1.00 1.00 H new ATOM 0 HA ASN A 111 68.338 -7.470 12.730 1.00 1.00 H new ATOM 0 HB2 ASN A 111 67.431 -5.444 12.265 1.00 1.00 H new ATOM 0 HB3 ASN A 111 69.094 -4.984 11.955 1.00 1.00 H new ATOM 0 HD21 ASN A 111 66.506 -5.393 8.730 1.00 1.00 H new ATOM 0 HD22 ASN A 111 66.102 -6.156 10.272 1.00 1.00 H new ATOM 1662 N ILE A 112 68.397 -7.703 9.417 1.00 1.00 N ATOM 1663 CA ILE A 112 67.913 -8.507 8.287 1.00 1.00 C ATOM 1664 C ILE A 112 68.484 -9.914 8.342 1.00 1.00 C ATOM 1665 O ILE A 112 67.921 -10.853 7.787 1.00 1.00 O ATOM 1666 CB ILE A 112 68.374 -7.842 6.959 1.00 1.00 C ATOM 1667 CG1 ILE A 112 68.236 -8.836 5.764 1.00 1.00 C ATOM 1668 CG2 ILE A 112 69.836 -7.390 7.099 1.00 1.00 C ATOM 1669 CD1 ILE A 112 68.704 -8.217 4.440 1.00 1.00 C ATOM 0 H ILE A 112 68.942 -6.885 9.145 1.00 1.00 H new ATOM 0 HA ILE A 112 66.826 -8.560 8.340 1.00 1.00 H new ATOM 0 HB ILE A 112 67.739 -6.979 6.758 1.00 1.00 H new ATOM 0 HG12 ILE A 112 68.820 -9.733 5.970 1.00 1.00 H new ATOM 0 HG13 ILE A 112 67.196 -9.147 5.670 1.00 1.00 H new ATOM 0 HG21 ILE A 112 70.163 -6.923 6.170 1.00 1.00 H new ATOM 0 HG22 ILE A 112 69.918 -6.672 7.915 1.00 1.00 H new ATOM 0 HG23 ILE A 112 70.465 -8.254 7.312 1.00 1.00 H new ATOM 0 HD11 ILE A 112 68.589 -8.945 3.637 1.00 1.00 H new ATOM 0 HD12 ILE A 112 68.103 -7.335 4.218 1.00 1.00 H new ATOM 0 HD13 ILE A 112 69.752 -7.930 4.523 1.00 1.00 H new ATOM 1681 N ASN A 113 69.642 -10.018 8.935 1.00 1.00 N ATOM 1682 CA ASN A 113 70.338 -11.289 8.960 1.00 1.00 C ATOM 1683 C ASN A 113 69.488 -12.369 9.599 1.00 1.00 C ATOM 1684 O ASN A 113 69.103 -13.313 8.944 1.00 1.00 O ATOM 1685 CB ASN A 113 71.639 -11.150 9.745 1.00 1.00 C ATOM 1686 CG ASN A 113 72.754 -10.560 8.875 1.00 1.00 C ATOM 1687 OD1 ASN A 113 73.920 -10.580 9.272 1.00 1.00 O ATOM 1688 ND2 ASN A 113 72.472 -10.037 7.713 1.00 1.00 N ATOM 0 H ASN A 113 70.125 -9.252 9.404 1.00 1.00 H new ATOM 0 HA ASN A 113 70.549 -11.575 7.930 1.00 1.00 H new ATOM 0 HB2 ASN A 113 71.476 -10.511 10.613 1.00 1.00 H new ATOM 0 HB3 ASN A 113 71.946 -12.126 10.120 1.00 1.00 H new ATOM 0 HD21 ASN A 113 73.216 -9.646 7.136 1.00 1.00 H new ATOM 0 HD22 ASN A 113 71.507 -10.019 7.382 1.00 1.00 H new ATOM 1695 N ALA A 114 69.190 -12.230 10.875 1.00 1.00 N ATOM 1696 CA ALA A 114 68.404 -13.227 11.563 1.00 1.00 C ATOM 1697 C ALA A 114 66.964 -13.273 11.058 1.00 1.00 C ATOM 1698 O ALA A 114 66.313 -14.317 11.152 1.00 1.00 O ATOM 1699 CB ALA A 114 68.435 -12.928 13.061 1.00 1.00 C ATOM 0 H ALA A 114 69.480 -11.440 11.452 1.00 1.00 H new ATOM 0 HA ALA A 114 68.838 -14.207 11.365 1.00 1.00 H new ATOM 0 HB1 ALA A 114 67.845 -13.674 13.593 1.00 1.00 H new ATOM 0 HB2 ALA A 114 69.465 -12.959 13.417 1.00 1.00 H new ATOM 0 HB3 ALA A 114 68.018 -11.938 13.243 1.00 1.00 H new ATOM 1705 N ALA A 115 66.470 -12.173 10.477 1.00 1.00 N ATOM 1706 CA ALA A 115 65.113 -12.161 9.956 1.00 1.00 C ATOM 1707 C ALA A 115 64.993 -12.853 8.590 1.00 1.00 C ATOM 1708 O ALA A 115 64.281 -13.856 8.460 1.00 1.00 O ATOM 1709 CB ALA A 115 64.653 -10.705 9.828 1.00 1.00 C ATOM 0 H ALA A 115 66.984 -11.300 10.361 1.00 1.00 H new ATOM 0 HA ALA A 115 64.485 -12.717 10.652 1.00 1.00 H new ATOM 0 HB1 ALA A 115 63.636 -10.678 9.438 1.00 1.00 H new ATOM 0 HB2 ALA A 115 64.679 -10.228 10.808 1.00 1.00 H new ATOM 0 HB3 ALA A 115 65.317 -10.172 9.147 1.00 1.00 H new ATOM 1715 N ILE A 116 65.661 -12.333 7.554 1.00 1.00 N ATOM 1716 CA ILE A 116 65.542 -12.946 6.221 1.00 1.00 C ATOM 1717 C ILE A 116 66.217 -14.308 6.143 1.00 1.00 C ATOM 1718 O ILE A 116 65.672 -15.247 5.575 1.00 1.00 O ATOM 1719 CB ILE A 116 66.134 -11.997 5.140 1.00 1.00 C ATOM 1720 CG1 ILE A 116 65.122 -10.855 4.871 1.00 1.00 C ATOM 1721 CG2 ILE A 116 66.414 -12.772 3.836 1.00 1.00 C ATOM 1722 CD1 ILE A 116 65.616 -9.891 3.775 1.00 1.00 C ATOM 0 H ILE A 116 66.271 -11.517 7.604 1.00 1.00 H new ATOM 0 HA ILE A 116 64.479 -13.101 6.034 1.00 1.00 H new ATOM 0 HB ILE A 116 67.076 -11.582 5.498 1.00 1.00 H new ATOM 0 HG12 ILE A 116 64.164 -11.282 4.573 1.00 1.00 H new ATOM 0 HG13 ILE A 116 64.950 -10.299 5.792 1.00 1.00 H new ATOM 0 HG21 ILE A 116 66.828 -12.093 3.091 1.00 1.00 H new ATOM 0 HG22 ILE A 116 67.128 -13.572 4.034 1.00 1.00 H new ATOM 0 HG23 ILE A 116 65.485 -13.200 3.460 1.00 1.00 H new ATOM 0 HD11 ILE A 116 64.875 -9.107 3.620 1.00 1.00 H new ATOM 0 HD12 ILE A 116 66.560 -9.442 4.084 1.00 1.00 H new ATOM 0 HD13 ILE A 116 65.762 -10.441 2.845 1.00 1.00 H new ATOM 1734 N GLU A 117 67.433 -14.381 6.645 1.00 1.00 N ATOM 1735 CA GLU A 117 68.202 -15.626 6.565 1.00 1.00 C ATOM 1736 C GLU A 117 67.321 -16.762 6.986 1.00 1.00 C ATOM 1737 O GLU A 117 67.067 -17.690 6.204 1.00 1.00 O ATOM 1738 CB GLU A 117 69.438 -15.591 7.454 1.00 1.00 C ATOM 1739 CG GLU A 117 70.383 -14.506 6.934 1.00 1.00 C ATOM 1740 CD GLU A 117 71.516 -14.273 7.922 1.00 1.00 C ATOM 1741 OE1 GLU A 117 71.257 -14.308 9.114 1.00 1.00 O ATOM 1742 OE2 GLU A 117 72.630 -14.056 7.472 1.00 1.00 O ATOM 0 H GLU A 117 67.913 -13.610 7.108 1.00 1.00 H new ATOM 0 HA GLU A 117 68.539 -15.754 5.536 1.00 1.00 H new ATOM 0 HB2 GLU A 117 69.156 -15.384 8.486 1.00 1.00 H new ATOM 0 HB3 GLU A 117 69.936 -16.561 7.448 1.00 1.00 H new ATOM 0 HG2 GLU A 117 70.790 -14.802 5.967 1.00 1.00 H new ATOM 0 HG3 GLU A 117 69.832 -13.579 6.778 1.00 1.00 H new ATOM 1749 N VAL A 118 66.839 -16.681 8.215 1.00 1.00 N ATOM 1750 CA VAL A 118 65.969 -17.708 8.706 1.00 1.00 C ATOM 1751 C VAL A 118 64.789 -17.856 7.762 1.00 1.00 C ATOM 1752 O VAL A 118 64.117 -18.883 7.780 1.00 1.00 O ATOM 1753 CB VAL A 118 65.482 -17.361 10.109 1.00 1.00 C ATOM 1754 CG1 VAL A 118 64.513 -18.442 10.592 1.00 1.00 C ATOM 1755 CG2 VAL A 118 66.680 -17.290 11.057 1.00 1.00 C ATOM 0 H VAL A 118 67.037 -15.926 8.872 1.00 1.00 H new ATOM 0 HA VAL A 118 66.514 -18.651 8.756 1.00 1.00 H new ATOM 0 HB VAL A 118 64.973 -16.398 10.092 1.00 1.00 H new ATOM 0 HG11 VAL A 118 64.164 -18.196 11.595 1.00 1.00 H new ATOM 0 HG12 VAL A 118 63.661 -18.496 9.914 1.00 1.00 H new ATOM 0 HG13 VAL A 118 65.023 -19.405 10.612 1.00 1.00 H new ATOM 0 HG21 VAL A 118 66.335 -17.042 12.061 1.00 1.00 H new ATOM 0 HG22 VAL A 118 67.187 -18.255 11.075 1.00 1.00 H new ATOM 0 HG23 VAL A 118 67.373 -16.523 10.711 1.00 1.00 H new ATOM 1765 N LEU A 119 64.557 -16.859 6.881 1.00 1.00 N ATOM 1766 CA LEU A 119 63.475 -16.989 5.911 1.00 1.00 C ATOM 1767 C LEU A 119 63.941 -17.870 4.744 1.00 1.00 C ATOM 1768 O LEU A 119 63.349 -18.929 4.536 1.00 1.00 O ATOM 1769 CB LEU A 119 63.025 -15.605 5.412 1.00 1.00 C ATOM 1770 CG LEU A 119 61.527 -15.617 5.035 1.00 1.00 C ATOM 1771 CD1 LEU A 119 61.235 -16.766 4.061 1.00 1.00 C ATOM 1772 CD2 LEU A 119 60.647 -15.778 6.299 1.00 1.00 C ATOM 0 H LEU A 119 65.088 -15.990 6.829 1.00 1.00 H new ATOM 0 HA LEU A 119 62.617 -17.461 6.390 1.00 1.00 H new ATOM 0 HB2 LEU A 119 63.204 -14.859 6.186 1.00 1.00 H new ATOM 0 HB3 LEU A 119 63.620 -15.315 4.546 1.00 1.00 H new ATOM 0 HG LEU A 119 61.290 -14.667 4.557 1.00 1.00 H new ATOM 0 HD11 LEU A 119 60.176 -16.764 3.803 1.00 1.00 H new ATOM 0 HD12 LEU A 119 61.829 -16.636 3.157 1.00 1.00 H new ATOM 0 HD13 LEU A 119 61.492 -17.715 4.531 1.00 1.00 H new ATOM 0 HD21 LEU A 119 59.596 -15.784 6.012 1.00 1.00 H new ATOM 0 HD22 LEU A 119 60.893 -16.716 6.796 1.00 1.00 H new ATOM 0 HD23 LEU A 119 60.832 -14.947 6.980 1.00 1.00 H new ATOM 1784 N GLY A 120 64.999 -17.490 3.976 1.00 1.00 N ATOM 1785 CA GLY A 120 65.405 -18.401 2.894 1.00 1.00 C ATOM 1786 C GLY A 120 65.972 -19.709 3.464 1.00 1.00 C ATOM 1787 O GLY A 120 65.267 -20.713 3.590 1.00 1.00 O ATOM 0 H GLY A 120 65.541 -16.632 4.077 1.00 1.00 H new ATOM 0 HA2 GLY A 120 64.549 -18.619 2.256 1.00 1.00 H new ATOM 0 HA3 GLY A 120 66.155 -17.917 2.268 1.00 1.00 H new ATOM 1791 N THR A 121 67.251 -19.672 3.789 1.00 1.00 N ATOM 1792 CA THR A 121 67.964 -20.833 4.340 1.00 1.00 C ATOM 1793 C THR A 121 69.212 -20.329 5.066 1.00 1.00 C ATOM 1794 O THR A 121 69.751 -20.976 5.966 1.00 1.00 O ATOM 1795 CB THR A 121 68.337 -21.816 3.213 1.00 1.00 C ATOM 1796 OG1 THR A 121 68.847 -21.082 2.111 1.00 1.00 O ATOM 1797 CG2 THR A 121 67.100 -22.608 2.752 1.00 1.00 C ATOM 0 H THR A 121 67.834 -18.842 3.682 1.00 1.00 H new ATOM 0 HA THR A 121 67.326 -21.369 5.043 1.00 1.00 H new ATOM 0 HB THR A 121 69.085 -22.514 3.589 1.00 1.00 H new ATOM 0 HG1 THR A 121 68.111 -20.841 1.510 1.00 1.00 H new ATOM 0 HG21 THR A 121 67.384 -23.296 1.956 1.00 1.00 H new ATOM 0 HG22 THR A 121 66.695 -23.172 3.592 1.00 1.00 H new ATOM 0 HG23 THR A 121 66.343 -21.917 2.381 1.00 1.00 H new ATOM 1805 N GLY A 122 69.640 -19.142 4.642 1.00 1.00 N ATOM 1806 CA GLY A 122 70.797 -18.427 5.170 1.00 1.00 C ATOM 1807 C GLY A 122 71.924 -18.334 4.147 1.00 1.00 C ATOM 1808 O GLY A 122 72.606 -17.308 4.108 1.00 1.00 O ATOM 0 H GLY A 122 69.172 -18.633 3.892 1.00 1.00 H new ATOM 0 HA2 GLY A 122 70.497 -17.423 5.472 1.00 1.00 H new ATOM 0 HA3 GLY A 122 71.160 -18.934 6.064 1.00 1.00 H new ATOM 1812 N THR A 123 72.146 -19.375 3.337 1.00 1.00 N ATOM 1813 CA THR A 123 73.234 -19.354 2.345 1.00 1.00 C ATOM 1814 C THR A 123 73.525 -17.952 1.837 1.00 1.00 C ATOM 1815 O THR A 123 72.906 -17.479 0.884 1.00 1.00 O ATOM 1816 CB THR A 123 72.863 -20.228 1.133 1.00 1.00 C ATOM 1817 OG1 THR A 123 73.870 -20.087 0.139 1.00 1.00 O ATOM 1818 CG2 THR A 123 71.507 -19.790 0.537 1.00 1.00 C ATOM 0 H THR A 123 71.596 -20.234 3.345 1.00 1.00 H new ATOM 0 HA THR A 123 74.121 -19.738 2.849 1.00 1.00 H new ATOM 0 HB THR A 123 72.785 -21.266 1.458 1.00 1.00 H new ATOM 0 HG1 THR A 123 73.473 -20.209 -0.749 1.00 1.00 H new ATOM 0 HG21 THR A 123 71.265 -20.421 -0.318 1.00 1.00 H new ATOM 0 HG22 THR A 123 70.728 -19.889 1.293 1.00 1.00 H new ATOM 0 HG23 THR A 123 71.570 -18.751 0.215 1.00 1.00 H new ATOM 1826 N ASP A 124 74.484 -17.293 2.486 1.00 1.00 N ATOM 1827 CA ASP A 124 74.892 -15.945 2.110 1.00 1.00 C ATOM 1828 C ASP A 124 76.388 -15.789 2.371 1.00 1.00 C ATOM 1829 O ASP A 124 76.906 -16.318 3.355 1.00 1.00 O ATOM 1830 CB ASP A 124 74.106 -14.911 2.917 1.00 1.00 C ATOM 1831 CG ASP A 124 72.654 -14.885 2.452 1.00 1.00 C ATOM 1832 OD1 ASP A 124 72.437 -14.562 1.297 1.00 1.00 O ATOM 1833 OD2 ASP A 124 71.782 -15.193 3.250 1.00 1.00 O ATOM 0 H ASP A 124 74.995 -17.677 3.281 1.00 1.00 H new ATOM 0 HA ASP A 124 74.686 -15.783 1.052 1.00 1.00 H new ATOM 0 HB2 ASP A 124 74.153 -15.153 3.979 1.00 1.00 H new ATOM 0 HB3 ASP A 124 74.554 -13.925 2.795 1.00 1.00 H new ATOM 1838 N TYR A 125 77.075 -15.055 1.503 1.00 1.00 N ATOM 1839 CA TYR A 125 78.512 -14.835 1.660 1.00 1.00 C ATOM 1840 C TYR A 125 78.886 -13.450 1.114 1.00 1.00 C ATOM 1841 O TYR A 125 78.296 -12.978 0.144 1.00 1.00 O ATOM 1842 CB TYR A 125 79.297 -15.950 0.912 1.00 1.00 C ATOM 1843 CG TYR A 125 80.012 -15.368 -0.290 1.00 1.00 C ATOM 1844 CD1 TYR A 125 79.296 -15.099 -1.459 1.00 1.00 C ATOM 1845 CD2 TYR A 125 81.371 -15.045 -0.207 1.00 1.00 C ATOM 1846 CE1 TYR A 125 79.942 -14.514 -2.555 1.00 1.00 C ATOM 1847 CE2 TYR A 125 82.014 -14.451 -1.299 1.00 1.00 C ATOM 1848 CZ TYR A 125 81.300 -14.187 -2.472 1.00 1.00 C ATOM 1849 OH TYR A 125 81.935 -13.592 -3.543 1.00 1.00 O ATOM 0 H TYR A 125 76.664 -14.603 0.686 1.00 1.00 H new ATOM 0 HA TYR A 125 78.774 -14.874 2.717 1.00 1.00 H new ATOM 0 HB2 TYR A 125 80.019 -16.411 1.586 1.00 1.00 H new ATOM 0 HB3 TYR A 125 78.612 -16.735 0.592 1.00 1.00 H new ATOM 0 HD1 TYR A 125 78.245 -15.342 -1.517 1.00 1.00 H new ATOM 0 HD2 TYR A 125 81.923 -15.254 0.698 1.00 1.00 H new ATOM 0 HE1 TYR A 125 79.393 -14.315 -3.463 1.00 1.00 H new ATOM 0 HE2 TYR A 125 83.062 -14.197 -1.236 1.00 1.00 H new ATOM 0 HH TYR A 125 82.875 -13.431 -3.318 1.00 1.00 H new ATOM 1859 N ARG A 126 79.883 -12.822 1.727 1.00 1.00 N ATOM 1860 CA ARG A 126 80.357 -11.509 1.286 1.00 1.00 C ATOM 1861 C ARG A 126 81.872 -11.419 1.521 1.00 1.00 C ATOM 1862 O ARG A 126 82.384 -11.975 2.494 1.00 1.00 O ATOM 1863 CB ARG A 126 79.652 -10.395 2.076 1.00 1.00 C ATOM 1864 CG ARG A 126 78.139 -10.665 2.223 1.00 1.00 C ATOM 1865 CD ARG A 126 77.400 -10.446 0.890 1.00 1.00 C ATOM 1866 NE ARG A 126 76.943 -9.065 0.801 1.00 1.00 N ATOM 1867 CZ ARG A 126 76.055 -8.687 -0.113 1.00 1.00 C ATOM 1868 NH1 ARG A 126 75.638 -9.534 -1.021 1.00 1.00 N ATOM 1869 NH2 ARG A 126 75.606 -7.463 -0.107 1.00 1.00 N ATOM 0 H ARG A 126 80.382 -13.199 2.533 1.00 1.00 H new ATOM 0 HA ARG A 126 80.134 -11.385 0.226 1.00 1.00 H new ATOM 0 HB2 ARG A 126 80.103 -10.309 3.064 1.00 1.00 H new ATOM 0 HB3 ARG A 126 79.804 -9.440 1.572 1.00 1.00 H new ATOM 0 HG2 ARG A 126 77.981 -11.688 2.565 1.00 1.00 H new ATOM 0 HG3 ARG A 126 77.722 -10.006 2.985 1.00 1.00 H new ATOM 0 HD2 ARG A 126 78.062 -10.674 0.055 1.00 1.00 H new ATOM 0 HD3 ARG A 126 76.551 -11.125 0.818 1.00 1.00 H new ATOM 0 HE ARG A 126 77.312 -8.374 1.454 1.00 1.00 H new ATOM 0 HH11 ARG A 126 75.995 -10.490 -1.029 1.00 1.00 H new ATOM 0 HH12 ARG A 126 74.956 -9.238 -1.720 1.00 1.00 H new ATOM 0 HH21 ARG A 126 75.936 -6.802 0.596 1.00 1.00 H new ATOM 0 HH22 ARG A 126 74.924 -7.166 -0.806 1.00 1.00 H new ATOM 1883 N PHE A 127 82.587 -10.708 0.643 1.00 1.00 N ATOM 1884 CA PHE A 127 84.045 -10.556 0.790 1.00 1.00 C ATOM 1885 C PHE A 127 84.523 -9.248 0.157 1.00 1.00 C ATOM 1886 O PHE A 127 83.691 -8.526 -0.366 1.00 1.00 O ATOM 1887 CB PHE A 127 84.782 -11.734 0.137 1.00 1.00 C ATOM 1888 CG PHE A 127 86.279 -11.546 0.301 1.00 1.00 C ATOM 1889 CD1 PHE A 127 86.904 -11.901 1.505 1.00 1.00 C ATOM 1890 CD2 PHE A 127 87.041 -11.014 -0.749 1.00 1.00 C ATOM 1891 CE1 PHE A 127 88.287 -11.723 1.657 1.00 1.00 C ATOM 1892 CE2 PHE A 127 88.421 -10.834 -0.594 1.00 1.00 C ATOM 1893 CZ PHE A 127 89.045 -11.188 0.608 1.00 1.00 C ATOM 1894 OXT PHE A 127 85.714 -8.986 0.208 1.00 1.00 O ATOM 0 H PHE A 127 82.190 -10.233 -0.168 1.00 1.00 H new ATOM 0 HA PHE A 127 84.269 -10.539 1.857 1.00 1.00 H new ATOM 0 HB2 PHE A 127 84.470 -12.672 0.596 1.00 1.00 H new ATOM 0 HB3 PHE A 127 84.526 -11.796 -0.921 1.00 1.00 H new ATOM 0 HD1 PHE A 127 86.320 -12.312 2.316 1.00 1.00 H new ATOM 0 HD2 PHE A 127 86.563 -10.743 -1.679 1.00 1.00 H new ATOM 0 HE1 PHE A 127 88.768 -11.999 2.584 1.00 1.00 H new ATOM 0 HE2 PHE A 127 89.005 -10.421 -1.403 1.00 1.00 H new ATOM 0 HZ PHE A 127 90.109 -11.049 0.726 1.00 1.00 H new TER 1904 PHE A 127 HETATM 1905 O1 MTN A 128 66.053 5.112 -10.041 1.00 1.00 O HETATM 1906 N1 MTN A 128 66.123 4.656 -8.862 1.00 1.00 N HETATM 1907 C1 MTN A 128 65.811 3.250 -8.518 1.00 1.00 C HETATM 1908 C2 MTN A 128 66.054 3.286 -7.047 1.00 1.00 C HETATM 1909 C3 MTN A 128 66.428 4.472 -6.595 1.00 1.00 C HETATM 1910 C4 MTN A 128 66.719 4.804 -5.160 1.00 1.00 C HETATM 1911 S1 MTN A 128 65.566 6.001 -4.435 1.00 1.00 S HETATM 1912 C5 MTN A 128 66.524 5.503 -7.698 1.00 1.00 C HETATM 1913 C6 MTN A 128 65.641 6.724 -7.457 1.00 1.00 C HETATM 1914 C7 MTN A 128 67.982 5.915 -7.884 1.00 1.00 C HETATM 1915 C8 MTN A 128 64.361 2.872 -8.824 1.00 1.00 C HETATM 1916 C9 MTN A 128 66.787 2.316 -9.229 1.00 1.00 C HETATM 0 H93 MTN A 128 66.700 2.451 -10.307 1.00 1.00 H new HETATM 0 H92 MTN A 128 67.805 2.546 -8.915 1.00 1.00 H new HETATM 0 H91 MTN A 128 66.554 1.283 -8.973 1.00 1.00 H new HETATM 0 H83 MTN A 128 63.690 3.511 -8.251 1.00 1.00 H new HETATM 0 H82 MTN A 128 64.167 3.005 -9.888 1.00 1.00 H new HETATM 0 H81 MTN A 128 64.191 1.830 -8.551 1.00 1.00 H new HETATM 0 H73 MTN A 128 68.609 5.024 -7.931 1.00 1.00 H new HETATM 0 H72 MTN A 128 68.085 6.480 -8.810 1.00 1.00 H new HETATM 0 H71 MTN A 128 68.295 6.535 -7.044 1.00 1.00 H new HETATM 0 H63 MTN A 128 65.664 7.369 -8.336 1.00 1.00 H new HETATM 0 H62 MTN A 128 64.617 6.401 -7.271 1.00 1.00 H new HETATM 0 H61 MTN A 128 66.011 7.275 -6.592 1.00 1.00 H new HETATM 0 H42 MTN A 128 66.692 3.886 -4.572 1.00 1.00 H new HETATM 0 H41 MTN A 128 67.732 5.200 -5.087 1.00 1.00 H new HETATM 0 H2 MTN A 128 65.934 2.415 -6.403 1.00 1.00 H new HETATM 1932 O1 MTN A 129 71.881 -9.305 -5.815 1.00 1.00 O HETATM 1933 N1 MTN A 129 70.991 -8.627 -5.220 1.00 1.00 N HETATM 1934 C1 MTN A 129 69.861 -7.976 -5.928 1.00 1.00 C HETATM 1935 C2 MTN A 129 69.204 -7.299 -4.788 1.00 1.00 C HETATM 1936 C3 MTN A 129 69.784 -7.516 -3.614 1.00 1.00 C HETATM 1937 C4 MTN A 129 69.299 -6.938 -2.313 1.00 1.00 C HETATM 1938 S1 MTN A 129 70.582 -6.390 -1.152 1.00 1.00 S HETATM 1939 C5 MTN A 129 70.997 -8.421 -3.728 1.00 1.00 C HETATM 1940 C6 MTN A 129 72.299 -7.877 -3.114 1.00 1.00 C HETATM 1941 C7 MTN A 129 70.627 -9.776 -3.095 1.00 1.00 C HETATM 1942 C8 MTN A 129 70.237 -7.019 -7.052 1.00 1.00 C HETATM 1943 C9 MTN A 129 68.927 -9.064 -6.464 1.00 1.00 C HETATM 0 H93 MTN A 129 69.475 -9.707 -7.153 1.00 1.00 H new HETATM 0 H92 MTN A 129 68.549 -9.661 -5.634 1.00 1.00 H new HETATM 0 H91 MTN A 129 68.091 -8.600 -6.987 1.00 1.00 H new HETATM 0 H83 MTN A 129 70.848 -6.210 -6.652 1.00 1.00 H new HETATM 0 H82 MTN A 129 70.801 -7.557 -7.814 1.00 1.00 H new HETATM 0 H81 MTN A 129 69.331 -6.605 -7.495 1.00 1.00 H new HETATM 0 H73 MTN A 129 69.640 -10.082 -3.441 1.00 1.00 H new HETATM 0 H72 MTN A 129 71.362 -10.526 -3.386 1.00 1.00 H new HETATM 0 H71 MTN A 129 70.617 -9.680 -2.009 1.00 1.00 H new HETATM 0 H63 MTN A 129 73.116 -8.568 -3.322 1.00 1.00 H new HETATM 0 H62 MTN A 129 72.528 -6.904 -3.549 1.00 1.00 H new HETATM 0 H61 MTN A 129 72.177 -7.773 -2.036 1.00 1.00 H new HETATM 0 H42 MTN A 129 68.653 -6.089 -2.535 1.00 1.00 H new HETATM 0 H41 MTN A 129 68.683 -7.686 -1.814 1.00 1.00 H new HETATM 0 H2 MTN A 129 68.318 -6.674 -4.903 1.00 1.00 H new HETATM 1959 O1 MTN A 130 82.096 -10.358 4.581 1.00 1.00 O HETATM 1960 N1 MTN A 130 82.047 -9.218 5.128 1.00 1.00 N HETATM 1961 C1 MTN A 130 82.996 -8.782 6.156 1.00 1.00 C HETATM 1962 C2 MTN A 130 82.467 -7.419 6.418 1.00 1.00 C HETATM 1963 C3 MTN A 130 81.416 -7.100 5.692 1.00 1.00 C HETATM 1964 C4 MTN A 130 80.672 -5.807 5.734 1.00 1.00 C HETATM 1965 S1 MTN A 130 79.357 -5.751 6.970 1.00 1.00 S HETATM 1966 C5 MTN A 130 81.007 -8.212 4.764 1.00 1.00 C HETATM 1967 C6 MTN A 130 79.553 -8.693 4.998 1.00 1.00 C HETATM 1968 C7 MTN A 130 81.283 -7.774 3.301 1.00 1.00 C HETATM 1969 C8 MTN A 130 82.953 -9.653 7.408 1.00 1.00 C HETATM 1970 C9 MTN A 130 84.402 -8.738 5.557 1.00 1.00 C HETATM 0 H93 MTN A 130 84.678 -9.731 5.203 1.00 1.00 H new HETATM 0 H92 MTN A 130 84.420 -8.037 4.722 1.00 1.00 H new HETATM 0 H91 MTN A 130 85.112 -8.414 6.318 1.00 1.00 H new HETATM 0 H83 MTN A 130 81.954 -9.618 7.842 1.00 1.00 H new HETATM 0 H82 MTN A 130 83.198 -10.682 7.144 1.00 1.00 H new HETATM 0 H81 MTN A 130 83.677 -9.283 8.134 1.00 1.00 H new HETATM 0 H73 MTN A 130 82.279 -7.336 3.234 1.00 1.00 H new HETATM 0 H72 MTN A 130 81.223 -8.642 2.644 1.00 1.00 H new HETATM 0 H71 MTN A 130 80.541 -7.036 2.996 1.00 1.00 H new HETATM 0 H63 MTN A 130 79.363 -9.582 4.397 1.00 1.00 H new HETATM 0 H62 MTN A 130 79.414 -8.931 6.053 1.00 1.00 H new HETATM 0 H61 MTN A 130 78.858 -7.905 4.709 1.00 1.00 H new HETATM 0 H42 MTN A 130 81.378 -5.001 5.934 1.00 1.00 H new HETATM 0 H41 MTN A 130 80.240 -5.617 4.751 1.00 1.00 H new HETATM 0 H2 MTN A 130 82.910 -6.742 7.148 1.00 1.00 H new