USER MOD reduce.3.24.130724 H: found=0, std=0, add=964, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 955 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 72 HIS : no HD1:sc= -2.74! C(o=-2.7!,f=-11!) USER MOD Set 1.2: A 121 THR OG1 : rot 164:sc= 0.0571 USER MOD Set 2.1: A 49 ASN : amide:sc= -2.54 K(o=-5,f=-5.5) USER MOD Set 2.2: A 54 GLN : amide:sc= -2.41 K(o=-5,f=-14!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 152:sc= 0.709 (180deg=-1.62!) 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 92:sc= 1.2 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 HIS : no HD1:sc= -0.114 X(o=-0.11,f=-0.26) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 CYS SG : rot 4:sc= -3.93! 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=-0.059) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN :FLIP amide:sc= -4.15! C(o=-7.1!,f=-4.2!) USER MOD Single : A 92 HIS : no HE2:sc= -8.92! C(o=-8.9!,f=-12!) USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 CYS SG : rot -173:sc= -4.44! 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 :FLIP amide:sc= 0 F(o=-0.67,f=0) USER MOD Single : A 113 ASN : amide:sc= -2.91! C(o=-2.9!,f=-11!) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 TYR OH : rot 180:sc= -0.0888 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 78.642 23.274 -22.351 1.00 1.00 N ATOM 2 CA MET A 1 78.764 22.333 -23.500 1.00 1.00 C ATOM 3 C MET A 1 77.643 21.290 -23.408 1.00 1.00 C ATOM 4 O MET A 1 76.614 21.534 -22.778 1.00 1.00 O ATOM 5 CB MET A 1 80.150 21.666 -23.452 1.00 1.00 C ATOM 6 CG MET A 1 80.538 21.369 -21.999 1.00 1.00 C ATOM 7 SD MET A 1 81.216 22.864 -21.234 1.00 1.00 S ATOM 8 CE MET A 1 82.956 22.556 -21.628 1.00 1.00 C ATOM 0 H1 MET A 1 79.580 23.657 -22.115 1.00 1.00 H new ATOM 0 H2 MET A 1 78.004 24.054 -22.608 1.00 1.00 H new ATOM 0 H3 MET A 1 78.257 22.769 -21.528 1.00 1.00 H new ATOM 0 HA MET A 1 78.667 22.863 -24.448 1.00 1.00 H new ATOM 0 HB2 MET A 1 80.138 20.742 -24.030 1.00 1.00 H new ATOM 0 HB3 MET A 1 80.893 22.319 -23.909 1.00 1.00 H new ATOM 0 HG2 MET A 1 79.666 21.027 -21.442 1.00 1.00 H new ATOM 0 HG3 MET A 1 81.274 20.565 -21.965 1.00 1.00 H new ATOM 0 HE1 MET A 1 83.567 23.372 -21.241 1.00 1.00 H new ATOM 0 HE2 MET A 1 83.272 21.618 -21.171 1.00 1.00 H new ATOM 0 HE3 MET A 1 83.079 22.493 -22.709 1.00 1.00 H new ATOM 18 N SER A 2 77.846 20.126 -24.026 1.00 1.00 N ATOM 19 CA SER A 2 76.859 19.051 -24.001 1.00 1.00 C ATOM 20 C SER A 2 76.803 18.396 -22.621 1.00 1.00 C ATOM 21 O SER A 2 76.122 17.393 -22.459 1.00 1.00 O ATOM 22 CB SER A 2 77.208 17.996 -25.059 1.00 1.00 C ATOM 23 OG SER A 2 77.157 18.585 -26.353 1.00 1.00 O ATOM 0 H SER A 2 78.691 19.905 -24.553 1.00 1.00 H new ATOM 0 HA SER A 2 75.881 19.479 -24.222 1.00 1.00 H new ATOM 0 HB2 SER A 2 78.203 17.592 -24.871 1.00 1.00 H new ATOM 0 HB3 SER A 2 76.509 17.162 -25.000 1.00 1.00 H new ATOM 0 HG SER A 2 77.382 17.911 -27.028 1.00 1.00 H new ATOM 29 N ASP A 3 77.515 18.992 -21.647 1.00 1.00 N ATOM 30 CA ASP A 3 77.564 18.506 -20.248 1.00 1.00 C ATOM 31 C ASP A 3 78.960 18.728 -19.663 1.00 1.00 C ATOM 32 O ASP A 3 79.967 18.471 -20.324 1.00 1.00 O ATOM 33 CB ASP A 3 77.204 17.005 -20.119 1.00 1.00 C ATOM 34 CG ASP A 3 75.686 16.792 -20.091 1.00 1.00 C ATOM 35 OD1 ASP A 3 74.970 17.739 -19.812 1.00 1.00 O ATOM 36 OD2 ASP A 3 75.263 15.677 -20.354 1.00 1.00 O ATOM 0 H ASP A 3 78.077 19.829 -21.805 1.00 1.00 H new ATOM 0 HA ASP A 3 76.818 19.078 -19.696 1.00 1.00 H new ATOM 0 HB2 ASP A 3 77.635 16.453 -20.955 1.00 1.00 H new ATOM 0 HB3 ASP A 3 77.646 16.601 -19.208 1.00 1.00 H new ATOM 41 N PHE A 4 79.005 19.192 -18.412 1.00 1.00 N ATOM 42 CA PHE A 4 80.278 19.432 -17.728 1.00 1.00 C ATOM 43 C PHE A 4 80.105 19.351 -16.209 1.00 1.00 C ATOM 44 O PHE A 4 79.034 19.657 -15.682 1.00 1.00 O ATOM 45 CB PHE A 4 80.826 20.815 -18.093 1.00 1.00 C ATOM 46 CG PHE A 4 82.133 21.043 -17.369 1.00 1.00 C ATOM 47 CD1 PHE A 4 83.304 20.429 -17.831 1.00 1.00 C ATOM 48 CD2 PHE A 4 82.177 21.865 -16.235 1.00 1.00 C ATOM 49 CE1 PHE A 4 84.517 20.638 -17.162 1.00 1.00 C ATOM 50 CE2 PHE A 4 83.390 22.072 -15.565 1.00 1.00 C ATOM 51 CZ PHE A 4 84.559 21.459 -16.030 1.00 1.00 C ATOM 0 H PHE A 4 78.179 19.408 -17.854 1.00 1.00 H new ATOM 0 HA PHE A 4 80.979 18.662 -18.050 1.00 1.00 H new ATOM 0 HB2 PHE A 4 80.977 20.886 -19.170 1.00 1.00 H new ATOM 0 HB3 PHE A 4 80.107 21.587 -17.820 1.00 1.00 H new ATOM 0 HD1 PHE A 4 83.272 19.794 -18.704 1.00 1.00 H new ATOM 0 HD2 PHE A 4 81.275 22.339 -15.877 1.00 1.00 H new ATOM 0 HE1 PHE A 4 85.420 20.165 -17.520 1.00 1.00 H new ATOM 0 HE2 PHE A 4 83.423 22.704 -14.690 1.00 1.00 H new ATOM 0 HZ PHE A 4 85.494 21.620 -15.515 1.00 1.00 H new ATOM 61 N ASP A 5 81.171 18.945 -15.513 1.00 1.00 N ATOM 62 CA ASP A 5 81.151 18.832 -14.050 1.00 1.00 C ATOM 63 C ASP A 5 82.567 19.087 -13.493 1.00 1.00 C ATOM 64 O ASP A 5 83.558 18.731 -14.130 1.00 1.00 O ATOM 65 CB ASP A 5 80.630 17.436 -13.641 1.00 1.00 C ATOM 66 CG ASP A 5 80.979 16.405 -14.713 1.00 1.00 C ATOM 67 OD1 ASP A 5 80.259 16.340 -15.699 1.00 1.00 O ATOM 68 OD2 ASP A 5 81.951 15.692 -14.532 1.00 1.00 O ATOM 0 H ASP A 5 82.061 18.688 -15.940 1.00 1.00 H new ATOM 0 HA ASP A 5 80.479 19.580 -13.630 1.00 1.00 H new ATOM 0 HB2 ASP A 5 81.068 17.142 -12.687 1.00 1.00 H new ATOM 0 HB3 ASP A 5 79.550 17.471 -13.498 1.00 1.00 H new ATOM 73 N THR A 6 82.658 19.715 -12.311 1.00 1.00 N ATOM 74 CA THR A 6 83.963 20.024 -11.693 1.00 1.00 C ATOM 75 C THR A 6 84.468 18.850 -10.845 1.00 1.00 C ATOM 76 O THR A 6 83.807 17.883 -10.710 1.00 1.00 O ATOM 77 CB THR A 6 83.843 21.308 -10.836 1.00 1.00 C ATOM 78 OG1 THR A 6 82.779 22.098 -11.353 1.00 1.00 O ATOM 79 CG2 THR A 6 85.142 22.132 -10.893 1.00 1.00 C ATOM 0 H THR A 6 81.852 20.018 -11.765 1.00 1.00 H new ATOM 0 HA THR A 6 84.692 20.192 -12.486 1.00 1.00 H new ATOM 0 HB THR A 6 83.655 21.024 -9.801 1.00 1.00 H new ATOM 0 HG1 THR A 6 82.689 22.915 -10.819 1.00 1.00 H new ATOM 0 HG21 THR A 6 85.031 23.028 -10.283 1.00 1.00 H new ATOM 0 HG22 THR A 6 85.969 21.534 -10.512 1.00 1.00 H new ATOM 0 HG23 THR A 6 85.346 22.418 -11.925 1.00 1.00 H new ATOM 87 N GLU A 7 85.652 18.973 -10.294 1.00 1.00 N ATOM 88 CA GLU A 7 86.242 17.905 -9.471 1.00 1.00 C ATOM 89 C GLU A 7 85.353 17.633 -8.271 1.00 1.00 C ATOM 90 O GLU A 7 85.006 16.499 -7.986 1.00 1.00 O ATOM 91 CB GLU A 7 87.662 18.295 -8.980 1.00 1.00 C ATOM 92 CG GLU A 7 88.732 17.674 -9.881 1.00 1.00 C ATOM 93 CD GLU A 7 90.111 18.027 -9.342 1.00 1.00 C ATOM 94 OE1 GLU A 7 90.262 18.048 -8.131 1.00 1.00 O ATOM 95 OE2 GLU A 7 90.994 18.274 -10.145 1.00 1.00 O ATOM 0 H GLU A 7 86.240 19.800 -10.392 1.00 1.00 H new ATOM 0 HA GLU A 7 86.323 17.009 -10.086 1.00 1.00 H new ATOM 0 HB2 GLU A 7 87.766 19.380 -8.977 1.00 1.00 H new ATOM 0 HB3 GLU A 7 87.803 17.958 -7.953 1.00 1.00 H new ATOM 0 HG2 GLU A 7 88.609 16.592 -9.917 1.00 1.00 H new ATOM 0 HG3 GLU A 7 88.623 18.042 -10.901 1.00 1.00 H new ATOM 102 N ARG A 8 85.003 18.689 -7.570 1.00 1.00 N ATOM 103 CA ARG A 8 84.169 18.494 -6.394 1.00 1.00 C ATOM 104 C ARG A 8 82.887 17.797 -6.849 1.00 1.00 C ATOM 105 O ARG A 8 82.549 16.715 -6.402 1.00 1.00 O ATOM 106 CB ARG A 8 83.821 19.841 -5.773 1.00 1.00 C ATOM 107 CG ARG A 8 85.093 20.507 -5.243 1.00 1.00 C ATOM 108 CD ARG A 8 84.866 22.011 -5.101 1.00 1.00 C ATOM 109 NE ARG A 8 83.682 22.271 -4.286 1.00 1.00 N ATOM 110 CZ ARG A 8 82.492 22.542 -4.834 1.00 1.00 C ATOM 111 NH1 ARG A 8 82.342 22.562 -6.134 1.00 1.00 N ATOM 112 NH2 ARG A 8 81.471 22.786 -4.066 1.00 1.00 N ATOM 0 H ARG A 8 85.266 19.653 -7.776 1.00 1.00 H new ATOM 0 HA ARG A 8 84.695 17.895 -5.650 1.00 1.00 H new ATOM 0 HB2 ARG A 8 83.345 20.482 -6.515 1.00 1.00 H new ATOM 0 HB3 ARG A 8 83.105 19.705 -4.962 1.00 1.00 H new ATOM 0 HG2 ARG A 8 85.365 20.078 -4.279 1.00 1.00 H new ATOM 0 HG3 ARG A 8 85.924 20.317 -5.922 1.00 1.00 H new ATOM 0 HD2 ARG A 8 85.740 22.476 -4.644 1.00 1.00 H new ATOM 0 HD3 ARG A 8 84.744 22.462 -6.086 1.00 1.00 H new ATOM 0 HE ARG A 8 83.765 22.245 -3.270 1.00 1.00 H new ATOM 0 HH11 ARG A 8 83.138 22.370 -6.742 1.00 1.00 H new ATOM 0 HH12 ARG A 8 81.429 22.770 -6.539 1.00 1.00 H new ATOM 0 HH21 ARG A 8 81.580 22.770 -3.052 1.00 1.00 H new ATOM 0 HH22 ARG A 8 80.561 22.993 -4.478 1.00 1.00 H new ATOM 126 N VAL A 9 82.201 18.463 -7.754 1.00 1.00 N ATOM 127 CA VAL A 9 80.953 17.922 -8.294 1.00 1.00 C ATOM 128 C VAL A 9 81.261 16.660 -9.119 1.00 1.00 C ATOM 129 O VAL A 9 80.684 15.652 -8.894 1.00 1.00 O ATOM 130 CB VAL A 9 80.168 18.972 -9.117 1.00 1.00 C ATOM 131 CG1 VAL A 9 79.178 19.715 -8.205 1.00 1.00 C ATOM 132 CG2 VAL A 9 81.146 19.976 -9.720 1.00 1.00 C ATOM 0 H VAL A 9 82.475 19.370 -8.133 1.00 1.00 H new ATOM 0 HA VAL A 9 80.303 17.651 -7.462 1.00 1.00 H new ATOM 0 HB VAL A 9 79.619 18.468 -9.912 1.00 1.00 H new ATOM 0 HG11 VAL A 9 78.628 20.453 -8.789 1.00 1.00 H new ATOM 0 HG12 VAL A 9 78.478 19.002 -7.770 1.00 1.00 H new ATOM 0 HG13 VAL A 9 79.725 20.218 -7.408 1.00 1.00 H new ATOM 0 HG21 VAL A 9 80.596 20.717 -10.300 1.00 1.00 H new ATOM 0 HG22 VAL A 9 81.694 20.475 -8.921 1.00 1.00 H new ATOM 0 HG23 VAL A 9 81.848 19.454 -10.370 1.00 1.00 H new ATOM 142 N SER A 10 82.198 16.730 -10.041 1.00 1.00 N ATOM 143 CA SER A 10 82.530 15.516 -10.843 1.00 1.00 C ATOM 144 C SER A 10 83.094 14.423 -9.939 1.00 1.00 C ATOM 145 O SER A 10 82.561 13.327 -9.899 1.00 1.00 O ATOM 146 CB SER A 10 83.580 15.759 -11.957 1.00 1.00 C ATOM 147 OG SER A 10 83.658 14.602 -12.770 1.00 1.00 O ATOM 0 H SER A 10 82.737 17.566 -10.267 1.00 1.00 H new ATOM 0 HA SER A 10 81.590 15.226 -11.312 1.00 1.00 H new ATOM 0 HB2 SER A 10 83.300 16.624 -12.558 1.00 1.00 H new ATOM 0 HB3 SER A 10 84.553 15.978 -11.517 1.00 1.00 H new ATOM 0 HG SER A 10 83.039 14.690 -13.524 1.00 1.00 H new ATOM 153 N ARG A 11 84.226 14.707 -9.283 1.00 1.00 N ATOM 154 CA ARG A 11 84.897 13.705 -8.442 1.00 1.00 C ATOM 155 C ARG A 11 84.081 13.341 -7.198 1.00 1.00 C ATOM 156 O ARG A 11 83.838 12.183 -6.927 1.00 1.00 O ATOM 157 CB ARG A 11 86.288 14.207 -8.000 1.00 1.00 C ATOM 158 CG ARG A 11 87.203 13.001 -7.687 1.00 1.00 C ATOM 159 CD ARG A 11 87.943 12.560 -8.952 1.00 1.00 C ATOM 160 NE ARG A 11 88.589 11.270 -8.732 1.00 1.00 N ATOM 161 CZ ARG A 11 89.795 11.184 -8.174 1.00 1.00 C ATOM 162 NH1 ARG A 11 90.415 12.266 -7.787 1.00 1.00 N ATOM 163 NH2 ARG A 11 90.356 10.018 -8.004 1.00 1.00 N ATOM 0 H ARG A 11 84.694 15.613 -9.317 1.00 1.00 H new ATOM 0 HA ARG A 11 84.999 12.810 -9.055 1.00 1.00 H new ATOM 0 HB2 ARG A 11 86.732 14.818 -8.786 1.00 1.00 H new ATOM 0 HB3 ARG A 11 86.193 14.842 -7.119 1.00 1.00 H new ATOM 0 HG2 ARG A 11 87.920 13.270 -6.912 1.00 1.00 H new ATOM 0 HG3 ARG A 11 86.608 12.175 -7.298 1.00 1.00 H new ATOM 0 HD2 ARG A 11 87.244 12.488 -9.785 1.00 1.00 H new ATOM 0 HD3 ARG A 11 88.688 13.307 -9.225 1.00 1.00 H new ATOM 0 HE ARG A 11 88.106 10.416 -9.012 1.00 1.00 H new ATOM 0 HH11 ARG A 11 89.976 13.178 -7.912 1.00 1.00 H new ATOM 0 HH12 ARG A 11 91.339 12.199 -7.360 1.00 1.00 H new ATOM 0 HH21 ARG A 11 89.871 9.171 -8.299 1.00 1.00 H new ATOM 0 HH22 ARG A 11 91.280 9.954 -7.576 1.00 1.00 H new ATOM 177 N ALA A 12 83.702 14.333 -6.416 1.00 1.00 N ATOM 178 CA ALA A 12 82.953 13.976 -5.195 1.00 1.00 C ATOM 179 C ALA A 12 81.741 13.166 -5.649 1.00 1.00 C ATOM 180 O ALA A 12 81.477 12.077 -5.157 1.00 1.00 O ATOM 181 CB ALA A 12 82.516 15.159 -4.322 1.00 1.00 C ATOM 0 H ALA A 12 83.876 15.326 -6.572 1.00 1.00 H new ATOM 0 HA ALA A 12 83.622 13.411 -4.545 1.00 1.00 H new ATOM 0 HB1 ALA A 12 81.974 14.788 -3.452 1.00 1.00 H new ATOM 0 HB2 ALA A 12 83.395 15.713 -3.993 1.00 1.00 H new ATOM 0 HB3 ALA A 12 81.867 15.818 -4.900 1.00 1.00 H new ATOM 187 N VAL A 13 81.031 13.726 -6.610 1.00 1.00 N ATOM 188 CA VAL A 13 79.873 13.028 -7.138 1.00 1.00 C ATOM 189 C VAL A 13 80.375 11.717 -7.734 1.00 1.00 C ATOM 190 O VAL A 13 79.859 10.700 -7.432 1.00 1.00 O ATOM 191 CB VAL A 13 79.093 13.812 -8.196 1.00 1.00 C ATOM 192 CG1 VAL A 13 77.914 12.981 -8.676 1.00 1.00 C ATOM 193 CG2 VAL A 13 78.577 15.139 -7.602 1.00 1.00 C ATOM 0 H VAL A 13 81.226 14.634 -7.031 1.00 1.00 H new ATOM 0 HA VAL A 13 79.170 12.876 -6.319 1.00 1.00 H new ATOM 0 HB VAL A 13 79.755 14.031 -9.034 1.00 1.00 H new ATOM 0 HG11 VAL A 13 77.358 13.539 -9.430 1.00 1.00 H new ATOM 0 HG12 VAL A 13 78.278 12.049 -9.109 1.00 1.00 H new ATOM 0 HG13 VAL A 13 77.259 12.758 -7.834 1.00 1.00 H new ATOM 0 HG21 VAL A 13 78.024 15.688 -8.364 1.00 1.00 H new ATOM 0 HG22 VAL A 13 77.920 14.929 -6.758 1.00 1.00 H new ATOM 0 HG23 VAL A 13 79.422 15.739 -7.264 1.00 1.00 H new ATOM 203 N ALA A 14 81.417 11.735 -8.551 1.00 1.00 N ATOM 204 CA ALA A 14 81.894 10.447 -9.102 1.00 1.00 C ATOM 205 C ALA A 14 82.291 9.516 -7.962 1.00 1.00 C ATOM 206 O ALA A 14 81.729 8.464 -7.820 1.00 1.00 O ATOM 207 CB ALA A 14 83.106 10.620 -10.030 1.00 1.00 C ATOM 0 H ALA A 14 81.932 12.566 -8.842 1.00 1.00 H new ATOM 0 HA ALA A 14 81.074 10.027 -9.684 1.00 1.00 H new ATOM 0 HB1 ALA A 14 83.417 9.646 -10.408 1.00 1.00 H new ATOM 0 HB2 ALA A 14 82.835 11.264 -10.867 1.00 1.00 H new ATOM 0 HB3 ALA A 14 83.927 11.073 -9.475 1.00 1.00 H new ATOM 213 N ALA A 15 83.275 9.915 -7.171 1.00 1.00 N ATOM 214 CA ALA A 15 83.741 9.059 -6.068 1.00 1.00 C ATOM 215 C ALA A 15 82.531 8.656 -5.218 1.00 1.00 C ATOM 216 O ALA A 15 82.303 7.490 -4.959 1.00 1.00 O ATOM 217 CB ALA A 15 84.783 9.771 -5.189 1.00 1.00 C ATOM 0 H ALA A 15 83.764 10.806 -7.261 1.00 1.00 H new ATOM 0 HA ALA A 15 84.224 8.179 -6.492 1.00 1.00 H new ATOM 0 HB1 ALA A 15 85.100 9.104 -4.387 1.00 1.00 H new ATOM 0 HB2 ALA A 15 85.646 10.044 -5.796 1.00 1.00 H new ATOM 0 HB3 ALA A 15 84.343 10.671 -4.759 1.00 1.00 H new ATOM 223 N ALA A 16 81.780 9.652 -4.783 1.00 1.00 N ATOM 224 CA ALA A 16 80.598 9.381 -3.955 1.00 1.00 C ATOM 225 C ALA A 16 79.544 8.606 -4.778 1.00 1.00 C ATOM 226 O ALA A 16 79.105 7.520 -4.405 1.00 1.00 O ATOM 227 CB ALA A 16 79.989 10.700 -3.459 1.00 1.00 C ATOM 0 H ALA A 16 81.954 10.638 -4.979 1.00 1.00 H new ATOM 0 HA ALA A 16 80.901 8.780 -3.098 1.00 1.00 H new ATOM 0 HB1 ALA A 16 79.113 10.488 -2.846 1.00 1.00 H new ATOM 0 HB2 ALA A 16 80.726 11.240 -2.865 1.00 1.00 H new ATOM 0 HB3 ALA A 16 79.695 11.309 -4.314 1.00 1.00 H new ATOM 233 N LEU A 17 79.150 9.210 -5.893 1.00 1.00 N ATOM 234 CA LEU A 17 78.120 8.591 -6.775 1.00 1.00 C ATOM 235 C LEU A 17 78.603 7.196 -7.154 1.00 1.00 C ATOM 236 O LEU A 17 77.905 6.220 -6.939 1.00 1.00 O ATOM 237 CB LEU A 17 77.874 9.386 -8.077 1.00 1.00 C ATOM 238 CG LEU A 17 76.687 8.823 -8.873 1.00 1.00 C ATOM 239 CD1 LEU A 17 75.360 9.227 -8.221 1.00 1.00 C ATOM 240 CD2 LEU A 17 76.722 9.390 -10.300 1.00 1.00 C ATOM 0 H LEU A 17 79.508 10.108 -6.218 1.00 1.00 H new ATOM 0 HA LEU A 17 77.181 8.575 -6.222 1.00 1.00 H new ATOM 0 HB2 LEU A 17 77.686 10.432 -7.834 1.00 1.00 H new ATOM 0 HB3 LEU A 17 78.772 9.359 -8.695 1.00 1.00 H new ATOM 0 HG LEU A 17 76.763 7.736 -8.889 1.00 1.00 H new ATOM 0 HD11 LEU A 17 74.531 8.819 -8.799 1.00 1.00 H new ATOM 0 HD12 LEU A 17 75.320 8.836 -7.204 1.00 1.00 H new ATOM 0 HD13 LEU A 17 75.283 10.314 -8.195 1.00 1.00 H new ATOM 0 HD21 LEU A 17 75.882 8.994 -10.870 1.00 1.00 H new ATOM 0 HD22 LEU A 17 76.654 10.477 -10.261 1.00 1.00 H new ATOM 0 HD23 LEU A 17 77.656 9.102 -10.783 1.00 1.00 H new ATOM 252 N VAL A 18 79.795 7.100 -7.734 1.00 1.00 N ATOM 253 CA VAL A 18 80.312 5.788 -8.123 1.00 1.00 C ATOM 254 C VAL A 18 80.691 4.978 -6.875 1.00 1.00 C ATOM 255 O VAL A 18 80.180 3.880 -6.667 1.00 1.00 O ATOM 256 CB VAL A 18 81.508 5.913 -9.125 1.00 1.00 C ATOM 257 CG1 VAL A 18 81.294 7.124 -10.084 1.00 1.00 C ATOM 258 CG2 VAL A 18 82.871 6.056 -8.402 1.00 1.00 C ATOM 0 H VAL A 18 80.408 7.888 -7.942 1.00 1.00 H new ATOM 0 HA VAL A 18 79.524 5.249 -8.649 1.00 1.00 H new ATOM 0 HB VAL A 18 81.533 4.988 -9.701 1.00 1.00 H new ATOM 0 HG11 VAL A 18 82.135 7.195 -10.773 1.00 1.00 H new ATOM 0 HG12 VAL A 18 80.373 6.982 -10.649 1.00 1.00 H new ATOM 0 HG13 VAL A 18 81.224 8.042 -9.501 1.00 1.00 H new ATOM 0 HG21 VAL A 18 83.668 6.139 -9.141 1.00 1.00 H new ATOM 0 HG22 VAL A 18 82.860 6.950 -7.778 1.00 1.00 H new ATOM 0 HG23 VAL A 18 83.045 5.180 -7.778 1.00 1.00 H new ATOM 268 N GLY A 19 81.612 5.512 -6.065 1.00 1.00 N ATOM 269 CA GLY A 19 82.081 4.822 -4.865 1.00 1.00 C ATOM 270 C GLY A 19 80.950 4.566 -3.882 1.00 1.00 C ATOM 271 O GLY A 19 79.782 4.584 -4.266 1.00 1.00 O ATOM 0 H GLY A 19 82.046 6.422 -6.222 1.00 1.00 H new ATOM 0 HA2 GLY A 19 82.539 3.874 -5.147 1.00 1.00 H new ATOM 0 HA3 GLY A 19 82.855 5.419 -4.382 1.00 1.00 H new ATOM 275 N PRO A 20 81.279 4.293 -2.635 1.00 1.00 N ATOM 276 CA PRO A 20 80.284 3.981 -1.585 1.00 1.00 C ATOM 277 C PRO A 20 79.621 5.230 -0.969 1.00 1.00 C ATOM 278 O PRO A 20 78.558 5.116 -0.380 1.00 1.00 O ATOM 279 CB PRO A 20 81.103 3.189 -0.557 1.00 1.00 C ATOM 280 CG PRO A 20 82.483 3.754 -0.644 1.00 1.00 C ATOM 281 CD PRO A 20 82.651 4.274 -2.086 1.00 1.00 C ATOM 0 HA PRO A 20 79.432 3.427 -1.980 1.00 1.00 H new ATOM 0 HB2 PRO A 20 80.693 3.302 0.446 1.00 1.00 H new ATOM 0 HB3 PRO A 20 81.098 2.123 -0.785 1.00 1.00 H new ATOM 0 HG2 PRO A 20 82.619 4.560 0.078 1.00 1.00 H new ATOM 0 HG3 PRO A 20 83.229 2.993 -0.416 1.00 1.00 H new ATOM 0 HD2 PRO A 20 83.098 5.268 -2.100 1.00 1.00 H new ATOM 0 HD3 PRO A 20 83.303 3.623 -2.669 1.00 1.00 H new ATOM 289 N GLY A 21 80.282 6.405 -1.048 1.00 1.00 N ATOM 290 CA GLY A 21 79.725 7.619 -0.402 1.00 1.00 C ATOM 291 C GLY A 21 78.381 8.052 -0.999 1.00 1.00 C ATOM 292 O GLY A 21 77.365 8.105 -0.306 1.00 1.00 O ATOM 0 H GLY A 21 81.169 6.541 -1.533 1.00 1.00 H new ATOM 0 HA2 GLY A 21 79.599 7.431 0.664 1.00 1.00 H new ATOM 0 HA3 GLY A 21 80.440 8.436 -0.499 1.00 1.00 H new ATOM 296 N GLY A 22 78.394 8.392 -2.266 1.00 1.00 N ATOM 297 CA GLY A 22 77.163 8.864 -2.905 1.00 1.00 C ATOM 298 C GLY A 22 76.129 7.779 -2.745 1.00 1.00 C ATOM 299 O GLY A 22 75.059 8.004 -2.186 1.00 1.00 O ATOM 0 H GLY A 22 79.214 8.357 -2.872 1.00 1.00 H new ATOM 0 HA2 GLY A 22 76.822 9.791 -2.444 1.00 1.00 H new ATOM 0 HA3 GLY A 22 77.335 9.078 -3.960 1.00 1.00 H new ATOM 303 N VAL A 23 76.450 6.599 -3.239 1.00 1.00 N ATOM 304 CA VAL A 23 75.489 5.498 -3.118 1.00 1.00 C ATOM 305 C VAL A 23 75.139 5.291 -1.639 1.00 1.00 C ATOM 306 O VAL A 23 74.014 4.923 -1.320 1.00 1.00 O ATOM 307 CB VAL A 23 75.989 4.171 -3.708 1.00 1.00 C ATOM 308 CG1 VAL A 23 76.229 4.309 -5.215 1.00 1.00 C ATOM 309 CG2 VAL A 23 77.281 3.772 -3.015 1.00 1.00 C ATOM 0 H VAL A 23 77.326 6.373 -3.710 1.00 1.00 H new ATOM 0 HA VAL A 23 74.612 5.787 -3.698 1.00 1.00 H new ATOM 0 HB VAL A 23 75.232 3.403 -3.549 1.00 1.00 H new ATOM 0 HG11 VAL A 23 76.583 3.359 -5.616 1.00 1.00 H new ATOM 0 HG12 VAL A 23 75.297 4.586 -5.708 1.00 1.00 H new ATOM 0 HG13 VAL A 23 76.978 5.080 -5.395 1.00 1.00 H new ATOM 0 HG21 VAL A 23 77.641 2.830 -3.430 1.00 1.00 H new ATOM 0 HG22 VAL A 23 78.031 4.547 -3.170 1.00 1.00 H new ATOM 0 HG23 VAL A 23 77.099 3.652 -1.947 1.00 1.00 H new ATOM 319 N ALA A 24 76.104 5.550 -0.732 1.00 1.00 N ATOM 320 CA ALA A 24 75.786 5.363 0.692 1.00 1.00 C ATOM 321 C ALA A 24 74.628 6.285 1.100 1.00 1.00 C ATOM 322 O ALA A 24 73.588 5.793 1.535 1.00 1.00 O ATOM 323 CB ALA A 24 76.994 5.628 1.618 1.00 1.00 C ATOM 0 H ALA A 24 77.050 5.869 -0.942 1.00 1.00 H new ATOM 0 HA ALA A 24 75.502 4.317 0.812 1.00 1.00 H new ATOM 0 HB1 ALA A 24 76.698 5.474 2.656 1.00 1.00 H new ATOM 0 HB2 ALA A 24 77.803 4.942 1.366 1.00 1.00 H new ATOM 0 HB3 ALA A 24 77.335 6.655 1.487 1.00 1.00 H new ATOM 329 N LEU A 25 74.800 7.612 1.007 1.00 1.00 N ATOM 330 CA LEU A 25 73.740 8.527 1.443 1.00 1.00 C ATOM 331 C LEU A 25 72.464 8.341 0.650 1.00 1.00 C ATOM 332 O LEU A 25 71.381 8.289 1.229 1.00 1.00 O ATOM 333 CB LEU A 25 74.196 9.983 1.292 1.00 1.00 C ATOM 334 CG LEU A 25 75.345 10.285 2.275 1.00 1.00 C ATOM 335 CD1 LEU A 25 76.176 11.448 1.738 1.00 1.00 C ATOM 336 CD2 LEU A 25 74.786 10.676 3.652 1.00 1.00 C ATOM 0 H LEU A 25 75.639 8.064 0.644 1.00 1.00 H new ATOM 0 HA LEU A 25 73.538 8.296 2.489 1.00 1.00 H new ATOM 0 HB2 LEU A 25 74.526 10.164 0.269 1.00 1.00 H new ATOM 0 HB3 LEU A 25 73.359 10.655 1.481 1.00 1.00 H new ATOM 0 HG LEU A 25 75.960 9.391 2.376 1.00 1.00 H new ATOM 0 HD11 LEU A 25 76.989 11.664 2.431 1.00 1.00 H new ATOM 0 HD12 LEU A 25 76.589 11.181 0.765 1.00 1.00 H new ATOM 0 HD13 LEU A 25 75.544 12.330 1.634 1.00 1.00 H new ATOM 0 HD21 LEU A 25 75.611 10.886 4.333 1.00 1.00 H new ATOM 0 HD22 LEU A 25 74.162 11.565 3.553 1.00 1.00 H new ATOM 0 HD23 LEU A 25 74.188 9.855 4.048 1.00 1.00 H new ATOM 348 N VAL A 26 72.574 8.287 -0.668 1.00 1.00 N ATOM 349 CA VAL A 26 71.375 8.157 -1.476 1.00 1.00 C ATOM 350 C VAL A 26 70.630 6.893 -1.083 1.00 1.00 C ATOM 351 O VAL A 26 69.460 6.954 -0.701 1.00 1.00 O ATOM 352 CB VAL A 26 71.790 8.074 -2.939 1.00 1.00 C ATOM 353 CG1 VAL A 26 70.555 7.863 -3.817 1.00 1.00 C ATOM 354 CG2 VAL A 26 72.496 9.377 -3.319 1.00 1.00 C ATOM 0 H VAL A 26 73.451 8.330 -1.187 1.00 1.00 H new ATOM 0 HA VAL A 26 70.721 9.015 -1.320 1.00 1.00 H new ATOM 0 HB VAL A 26 72.467 7.233 -3.090 1.00 1.00 H new ATOM 0 HG11 VAL A 26 70.858 7.804 -4.863 1.00 1.00 H new ATOM 0 HG12 VAL A 26 70.059 6.936 -3.530 1.00 1.00 H new ATOM 0 HG13 VAL A 26 69.867 8.698 -3.685 1.00 1.00 H new ATOM 0 HG21 VAL A 26 72.800 9.334 -4.365 1.00 1.00 H new ATOM 0 HG22 VAL A 26 71.815 10.216 -3.173 1.00 1.00 H new ATOM 0 HG23 VAL A 26 73.376 9.511 -2.690 1.00 1.00 H new ATOM 364 N VAL A 27 71.289 5.748 -1.208 1.00 1.00 N ATOM 365 CA VAL A 27 70.650 4.482 -0.894 1.00 1.00 C ATOM 366 C VAL A 27 70.145 4.483 0.534 1.00 1.00 C ATOM 367 O VAL A 27 69.092 3.940 0.826 1.00 1.00 O ATOM 368 CB VAL A 27 71.635 3.322 -1.072 1.00 1.00 C ATOM 369 CG1 VAL A 27 70.953 2.015 -0.677 1.00 1.00 C ATOM 370 CG2 VAL A 27 72.079 3.242 -2.536 1.00 1.00 C ATOM 0 H VAL A 27 72.257 5.672 -1.522 1.00 1.00 H new ATOM 0 HA VAL A 27 69.811 4.353 -1.578 1.00 1.00 H new ATOM 0 HB VAL A 27 72.507 3.487 -0.439 1.00 1.00 H new ATOM 0 HG11 VAL A 27 71.651 1.188 -0.803 1.00 1.00 H new ATOM 0 HG12 VAL A 27 70.638 2.069 0.365 1.00 1.00 H new ATOM 0 HG13 VAL A 27 70.081 1.853 -1.311 1.00 1.00 H new ATOM 0 HG21 VAL A 27 72.779 2.416 -2.659 1.00 1.00 H new ATOM 0 HG22 VAL A 27 71.209 3.078 -3.172 1.00 1.00 H new ATOM 0 HG23 VAL A 27 72.565 4.175 -2.820 1.00 1.00 H new ATOM 380 N LYS A 28 70.917 5.072 1.422 1.00 1.00 N ATOM 381 CA LYS A 28 70.518 5.096 2.820 1.00 1.00 C ATOM 382 C LYS A 28 69.269 5.943 2.988 1.00 1.00 C ATOM 383 O LYS A 28 68.272 5.512 3.566 1.00 1.00 O ATOM 384 CB LYS A 28 71.649 5.692 3.672 1.00 1.00 C ATOM 385 CG LYS A 28 71.295 5.612 5.184 1.00 1.00 C ATOM 386 CD LYS A 28 71.478 6.982 5.853 1.00 1.00 C ATOM 387 CE LYS A 28 72.963 7.359 5.891 1.00 1.00 C ATOM 388 NZ LYS A 28 73.135 8.577 6.732 1.00 1.00 N ATOM 0 H LYS A 28 71.804 5.531 1.213 1.00 1.00 H new ATOM 0 HA LYS A 28 70.312 4.076 3.145 1.00 1.00 H new ATOM 0 HB2 LYS A 28 72.578 5.154 3.481 1.00 1.00 H new ATOM 0 HB3 LYS A 28 71.818 6.730 3.387 1.00 1.00 H new ATOM 0 HG2 LYS A 28 70.265 5.276 5.305 1.00 1.00 H new ATOM 0 HG3 LYS A 28 71.930 4.874 5.674 1.00 1.00 H new ATOM 0 HD2 LYS A 28 70.917 7.740 5.306 1.00 1.00 H new ATOM 0 HD3 LYS A 28 71.076 6.957 6.866 1.00 1.00 H new ATOM 0 HE2 LYS A 28 73.550 6.535 6.298 1.00 1.00 H new ATOM 0 HE3 LYS A 28 73.330 7.544 4.881 1.00 1.00 H new ATOM 0 HZ1 LYS A 28 74.141 8.839 6.762 1.00 1.00 H new ATOM 0 HZ2 LYS A 28 72.586 9.360 6.325 1.00 1.00 H new ATOM 0 HZ3 LYS A 28 72.799 8.383 7.697 1.00 1.00 H new ATOM 402 N VAL A 29 69.367 7.174 2.527 1.00 1.00 N ATOM 403 CA VAL A 29 68.256 8.119 2.696 1.00 1.00 C ATOM 404 C VAL A 29 67.025 7.648 1.944 1.00 1.00 C ATOM 405 O VAL A 29 65.936 7.585 2.511 1.00 1.00 O ATOM 406 CB VAL A 29 68.631 9.535 2.226 1.00 1.00 C ATOM 407 CG1 VAL A 29 67.397 10.440 2.325 1.00 1.00 C ATOM 408 CG2 VAL A 29 69.719 10.096 3.140 1.00 1.00 C ATOM 0 H VAL A 29 70.182 7.548 2.041 1.00 1.00 H new ATOM 0 HA VAL A 29 68.036 8.158 3.763 1.00 1.00 H new ATOM 0 HB VAL A 29 68.988 9.496 1.197 1.00 1.00 H new ATOM 0 HG11 VAL A 29 67.656 11.446 1.993 1.00 1.00 H new ATOM 0 HG12 VAL A 29 66.603 10.043 1.693 1.00 1.00 H new ATOM 0 HG13 VAL A 29 67.054 10.476 3.359 1.00 1.00 H new ATOM 0 HG21 VAL A 29 69.989 11.100 2.811 1.00 1.00 H new ATOM 0 HG22 VAL A 29 69.348 10.137 4.164 1.00 1.00 H new ATOM 0 HG23 VAL A 29 70.598 9.452 3.098 1.00 1.00 H new ATOM 418 N CYS A 30 67.190 7.331 0.672 1.00 1.00 N ATOM 419 CA CYS A 30 66.053 6.895 -0.103 1.00 1.00 C ATOM 420 C CYS A 30 65.526 5.584 0.447 1.00 1.00 C ATOM 421 O CYS A 30 64.367 5.491 0.849 1.00 1.00 O ATOM 422 CB CYS A 30 66.512 6.719 -1.552 1.00 1.00 C ATOM 423 SG CYS A 30 65.144 6.157 -2.590 1.00 1.00 S ATOM 0 H CYS A 30 68.076 7.367 0.169 1.00 1.00 H new ATOM 0 HA CYS A 30 65.250 7.630 -0.052 1.00 1.00 H new ATOM 0 HB2 CYS A 30 66.900 7.663 -1.933 1.00 1.00 H new ATOM 0 HB3 CYS A 30 67.328 5.998 -1.595 1.00 1.00 H new ATOM 0 HG CYS A 30 65.557 6.017 -3.815 1.00 1.00 H new ATOM 428 N ALA A 31 66.352 4.557 0.421 1.00 1.00 N ATOM 429 CA ALA A 31 65.926 3.247 0.869 1.00 1.00 C ATOM 430 C ALA A 31 65.474 3.278 2.324 1.00 1.00 C ATOM 431 O ALA A 31 64.362 2.862 2.649 1.00 1.00 O ATOM 432 CB ALA A 31 67.079 2.239 0.669 1.00 1.00 C ATOM 0 H ALA A 31 67.318 4.604 0.096 1.00 1.00 H new ATOM 0 HA ALA A 31 65.068 2.933 0.274 1.00 1.00 H new ATOM 0 HB1 ALA A 31 66.762 1.252 1.005 1.00 1.00 H new ATOM 0 HB2 ALA A 31 67.344 2.195 -0.387 1.00 1.00 H new ATOM 0 HB3 ALA A 31 67.946 2.558 1.248 1.00 1.00 H new ATOM 438 N GLY A 32 66.322 3.783 3.199 1.00 1.00 N ATOM 439 CA GLY A 32 65.967 3.844 4.612 1.00 1.00 C ATOM 440 C GLY A 32 66.187 2.486 5.260 1.00 1.00 C ATOM 441 O GLY A 32 65.231 1.793 5.612 1.00 1.00 O ATOM 0 H GLY A 32 67.245 4.151 2.968 1.00 1.00 H new ATOM 0 HA2 GLY A 32 66.571 4.599 5.115 1.00 1.00 H new ATOM 0 HA3 GLY A 32 64.925 4.144 4.721 1.00 1.00 H new ATOM 445 N LEU A 33 67.466 2.112 5.392 1.00 1.00 N ATOM 446 CA LEU A 33 67.855 0.829 5.993 1.00 1.00 C ATOM 447 C LEU A 33 67.925 -0.276 4.915 1.00 1.00 C ATOM 448 O LEU A 33 66.890 -0.797 4.506 1.00 1.00 O ATOM 449 CB LEU A 33 66.841 0.422 7.091 1.00 1.00 C ATOM 450 CG LEU A 33 67.526 -0.416 8.180 1.00 1.00 C ATOM 451 CD1 LEU A 33 66.530 -0.717 9.300 1.00 1.00 C ATOM 452 CD2 LEU A 33 68.021 -1.732 7.578 1.00 1.00 C ATOM 0 H LEU A 33 68.254 2.684 5.088 1.00 1.00 H new ATOM 0 HA LEU A 33 68.841 0.947 6.442 1.00 1.00 H new ATOM 0 HB2 LEU A 33 66.401 1.315 7.535 1.00 1.00 H new ATOM 0 HB3 LEU A 33 66.025 -0.148 6.646 1.00 1.00 H new ATOM 0 HG LEU A 33 68.371 0.142 8.584 1.00 1.00 H new ATOM 0 HD11 LEU A 33 67.019 -1.312 10.071 1.00 1.00 H new ATOM 0 HD12 LEU A 33 66.176 0.218 9.733 1.00 1.00 H new ATOM 0 HD13 LEU A 33 65.684 -1.273 8.895 1.00 1.00 H new ATOM 0 HD21 LEU A 33 68.507 -2.326 8.352 1.00 1.00 H new ATOM 0 HD22 LEU A 33 67.175 -2.287 7.172 1.00 1.00 H new ATOM 0 HD23 LEU A 33 68.734 -1.522 6.781 1.00 1.00 H new ATOM 464 N PRO A 34 69.107 -0.644 4.448 1.00 1.00 N ATOM 465 CA PRO A 34 69.261 -1.714 3.404 1.00 1.00 C ATOM 466 C PRO A 34 68.538 -3.031 3.747 1.00 1.00 C ATOM 467 O PRO A 34 68.267 -3.832 2.852 1.00 1.00 O ATOM 468 CB PRO A 34 70.783 -1.950 3.340 1.00 1.00 C ATOM 469 CG PRO A 34 71.400 -0.677 3.816 1.00 1.00 C ATOM 470 CD PRO A 34 70.421 -0.077 4.830 1.00 1.00 C ATOM 0 HA PRO A 34 68.814 -1.396 2.462 1.00 1.00 H new ATOM 0 HB2 PRO A 34 71.078 -2.789 3.970 1.00 1.00 H new ATOM 0 HB3 PRO A 34 71.102 -2.186 2.325 1.00 1.00 H new ATOM 0 HG2 PRO A 34 72.370 -0.864 4.276 1.00 1.00 H new ATOM 0 HG3 PRO A 34 71.568 0.008 2.985 1.00 1.00 H new ATOM 0 HD2 PRO A 34 70.690 -0.348 5.851 1.00 1.00 H new ATOM 0 HD3 PRO A 34 70.414 1.012 4.780 1.00 1.00 H new ATOM 478 N GLY A 35 68.259 -3.270 5.036 1.00 1.00 N ATOM 479 CA GLY A 35 67.604 -4.528 5.406 1.00 1.00 C ATOM 480 C GLY A 35 66.231 -4.612 4.750 1.00 1.00 C ATOM 481 O GLY A 35 65.989 -5.486 3.915 1.00 1.00 O ATOM 0 H GLY A 35 68.466 -2.638 5.809 1.00 1.00 H new ATOM 0 HA2 GLY A 35 68.218 -5.373 5.094 1.00 1.00 H new ATOM 0 HA3 GLY A 35 67.503 -4.590 6.490 1.00 1.00 H new ATOM 485 N VAL A 36 65.345 -3.688 5.091 1.00 1.00 N ATOM 486 CA VAL A 36 64.023 -3.676 4.483 1.00 1.00 C ATOM 487 C VAL A 36 64.170 -3.177 3.044 1.00 1.00 C ATOM 488 O VAL A 36 65.229 -3.355 2.449 1.00 1.00 O ATOM 489 CB VAL A 36 63.077 -2.767 5.301 1.00 1.00 C ATOM 490 CG1 VAL A 36 63.429 -1.278 5.061 1.00 1.00 C ATOM 491 CG2 VAL A 36 61.590 -3.029 4.909 1.00 1.00 C ATOM 0 H VAL A 36 65.513 -2.949 5.773 1.00 1.00 H new ATOM 0 HA VAL A 36 63.589 -4.676 4.476 1.00 1.00 H new ATOM 0 HB VAL A 36 63.206 -2.999 6.358 1.00 1.00 H new ATOM 0 HG11 VAL A 36 62.756 -0.647 5.642 1.00 1.00 H new ATOM 0 HG12 VAL A 36 64.458 -1.093 5.370 1.00 1.00 H new ATOM 0 HG13 VAL A 36 63.321 -1.045 4.002 1.00 1.00 H new ATOM 0 HG21 VAL A 36 60.939 -2.380 5.495 1.00 1.00 H new ATOM 0 HG22 VAL A 36 61.451 -2.820 3.848 1.00 1.00 H new ATOM 0 HG23 VAL A 36 61.339 -4.071 5.109 1.00 1.00 H new ATOM 501 N ILE A 37 63.117 -2.573 2.497 1.00 1.00 N ATOM 502 CA ILE A 37 63.140 -2.042 1.121 1.00 1.00 C ATOM 503 C ILE A 37 63.150 -3.146 0.059 1.00 1.00 C ATOM 504 O ILE A 37 64.174 -3.462 -0.545 1.00 1.00 O ATOM 505 CB ILE A 37 64.333 -1.047 0.923 1.00 1.00 C ATOM 506 CG1 ILE A 37 63.908 0.350 1.426 1.00 1.00 C ATOM 507 CG2 ILE A 37 64.794 -0.963 -0.559 1.00 1.00 C ATOM 508 CD1 ILE A 37 63.096 1.119 0.368 1.00 1.00 C ATOM 0 H ILE A 37 62.230 -2.435 2.982 1.00 1.00 H new ATOM 0 HA ILE A 37 62.210 -1.492 0.981 1.00 1.00 H new ATOM 0 HB ILE A 37 65.182 -1.418 1.498 1.00 1.00 H new ATOM 0 HG12 ILE A 37 63.313 0.244 2.333 1.00 1.00 H new ATOM 0 HG13 ILE A 37 64.795 0.925 1.692 1.00 1.00 H new ATOM 0 HG21 ILE A 37 65.623 -0.260 -0.643 1.00 1.00 H new ATOM 0 HG22 ILE A 37 65.118 -1.948 -0.896 1.00 1.00 H new ATOM 0 HG23 ILE A 37 63.965 -0.622 -1.179 1.00 1.00 H new ATOM 0 HD11 ILE A 37 62.817 2.096 0.763 1.00 1.00 H new ATOM 0 HD12 ILE A 37 63.700 1.249 -0.530 1.00 1.00 H new ATOM 0 HD13 ILE A 37 62.195 0.557 0.121 1.00 1.00 H new ATOM 520 N HIS A 38 61.980 -3.700 -0.191 1.00 1.00 N ATOM 521 CA HIS A 38 61.811 -4.715 -1.216 1.00 1.00 C ATOM 522 C HIS A 38 60.553 -4.353 -1.991 1.00 1.00 C ATOM 523 O HIS A 38 59.510 -4.090 -1.393 1.00 1.00 O ATOM 524 CB HIS A 38 61.709 -6.105 -0.586 1.00 1.00 C ATOM 525 CG HIS A 38 63.061 -6.468 -0.035 1.00 1.00 C ATOM 526 ND1 HIS A 38 64.169 -6.598 -0.857 1.00 1.00 N ATOM 527 CD2 HIS A 38 63.514 -6.678 1.244 1.00 1.00 C ATOM 528 CE1 HIS A 38 65.227 -6.868 -0.073 1.00 1.00 C ATOM 529 NE2 HIS A 38 64.884 -6.928 1.217 1.00 1.00 N ATOM 0 H HIS A 38 61.122 -3.462 0.307 1.00 1.00 H new ATOM 0 HA HIS A 38 62.669 -4.746 -1.887 1.00 1.00 H new ATOM 0 HB2 HIS A 38 60.961 -6.110 0.207 1.00 1.00 H new ATOM 0 HB3 HIS A 38 61.391 -6.837 -1.328 1.00 1.00 H new ATOM 0 HD2 HIS A 38 62.902 -6.653 2.134 1.00 1.00 H new ATOM 0 HE1 HIS A 38 66.231 -7.018 -0.441 1.00 1.00 H new ATOM 0 HE2 HIS A 38 65.495 -7.117 2.012 1.00 1.00 H new ATOM 537 N THR A 39 60.658 -4.316 -3.319 1.00 1.00 N ATOM 538 CA THR A 39 59.519 -3.956 -4.167 1.00 1.00 C ATOM 539 C THR A 39 59.192 -5.106 -5.124 1.00 1.00 C ATOM 540 O THR A 39 60.095 -5.647 -5.760 1.00 1.00 O ATOM 541 CB THR A 39 59.867 -2.707 -4.981 1.00 1.00 C ATOM 542 OG1 THR A 39 60.357 -1.690 -4.112 1.00 1.00 O ATOM 543 CG2 THR A 39 58.615 -2.200 -5.694 1.00 1.00 C ATOM 0 H THR A 39 61.515 -4.529 -3.830 1.00 1.00 H new ATOM 0 HA THR A 39 58.653 -3.758 -3.535 1.00 1.00 H new ATOM 0 HB THR A 39 60.632 -2.957 -5.716 1.00 1.00 H new ATOM 0 HG1 THR A 39 60.581 -0.892 -4.635 1.00 1.00 H new ATOM 0 HG21 THR A 39 58.862 -1.311 -6.274 1.00 1.00 H new ATOM 0 HG22 THR A 39 58.237 -2.975 -6.361 1.00 1.00 H new ATOM 0 HG23 THR A 39 57.852 -1.952 -4.957 1.00 1.00 H new ATOM 551 N PRO A 40 57.946 -5.510 -5.255 1.00 1.00 N ATOM 552 CA PRO A 40 57.605 -6.635 -6.171 1.00 1.00 C ATOM 553 C PRO A 40 57.929 -6.303 -7.626 1.00 1.00 C ATOM 554 O PRO A 40 58.927 -6.759 -8.182 1.00 1.00 O ATOM 555 CB PRO A 40 56.088 -6.843 -5.961 1.00 1.00 C ATOM 556 CG PRO A 40 55.584 -5.560 -5.376 1.00 1.00 C ATOM 557 CD PRO A 40 56.745 -4.966 -4.579 1.00 1.00 C ATOM 0 HA PRO A 40 58.184 -7.533 -5.954 1.00 1.00 H new ATOM 0 HB2 PRO A 40 55.589 -7.067 -6.904 1.00 1.00 H new ATOM 0 HB3 PRO A 40 55.896 -7.681 -5.291 1.00 1.00 H new ATOM 0 HG2 PRO A 40 55.261 -4.876 -6.160 1.00 1.00 H new ATOM 0 HG3 PRO A 40 54.722 -5.738 -4.733 1.00 1.00 H new ATOM 0 HD2 PRO A 40 56.731 -3.876 -4.602 1.00 1.00 H new ATOM 0 HD3 PRO A 40 56.706 -5.263 -3.531 1.00 1.00 H new ATOM 565 N ALA A 41 57.053 -5.523 -8.224 1.00 1.00 N ATOM 566 CA ALA A 41 57.179 -5.118 -9.621 1.00 1.00 C ATOM 567 C ALA A 41 58.366 -4.200 -9.804 1.00 1.00 C ATOM 568 O ALA A 41 58.481 -3.171 -9.138 1.00 1.00 O ATOM 569 CB ALA A 41 55.907 -4.389 -10.068 1.00 1.00 C ATOM 0 H ALA A 41 56.227 -5.147 -7.758 1.00 1.00 H new ATOM 0 HA ALA A 41 57.325 -6.013 -10.226 1.00 1.00 H new ATOM 0 HB1 ALA A 41 56.007 -4.089 -11.111 1.00 1.00 H new ATOM 0 HB2 ALA A 41 55.050 -5.054 -9.962 1.00 1.00 H new ATOM 0 HB3 ALA A 41 55.758 -3.504 -9.449 1.00 1.00 H new ATOM 575 N ARG A 42 59.242 -4.568 -10.721 1.00 1.00 N ATOM 576 CA ARG A 42 60.417 -3.759 -10.992 1.00 1.00 C ATOM 577 C ARG A 42 61.169 -4.318 -12.201 1.00 1.00 C ATOM 578 O ARG A 42 60.822 -5.376 -12.725 1.00 1.00 O ATOM 579 CB ARG A 42 61.331 -3.757 -9.750 1.00 1.00 C ATOM 580 CG ARG A 42 62.170 -2.476 -9.701 1.00 1.00 C ATOM 581 CD ARG A 42 63.141 -2.564 -8.530 1.00 1.00 C ATOM 582 NE ARG A 42 64.071 -3.667 -8.752 1.00 1.00 N ATOM 583 CZ ARG A 42 64.608 -4.337 -7.739 1.00 1.00 C ATOM 584 NH1 ARG A 42 64.354 -3.978 -6.510 1.00 1.00 N ATOM 585 NH2 ARG A 42 65.393 -5.352 -7.973 1.00 1.00 N ATOM 0 H ARG A 42 59.164 -5.414 -11.286 1.00 1.00 H new ATOM 0 HA ARG A 42 60.112 -2.737 -11.216 1.00 1.00 H new ATOM 0 HB2 ARG A 42 60.726 -3.837 -8.847 1.00 1.00 H new ATOM 0 HB3 ARG A 42 61.987 -4.627 -9.773 1.00 1.00 H new ATOM 0 HG2 ARG A 42 62.717 -2.348 -10.635 1.00 1.00 H new ATOM 0 HG3 ARG A 42 61.523 -1.606 -9.589 1.00 1.00 H new ATOM 0 HD2 ARG A 42 63.689 -1.627 -8.427 1.00 1.00 H new ATOM 0 HD3 ARG A 42 62.593 -2.717 -7.600 1.00 1.00 H new ATOM 0 HE ARG A 42 64.314 -3.929 -9.707 1.00 1.00 H new ATOM 0 HH11 ARG A 42 63.743 -3.182 -6.327 1.00 1.00 H new ATOM 0 HH12 ARG A 42 64.767 -4.493 -5.733 1.00 1.00 H new ATOM 0 HH21 ARG A 42 65.594 -5.631 -8.933 1.00 1.00 H new ATOM 0 HH22 ARG A 42 65.806 -5.867 -7.196 1.00 1.00 H new ATOM 599 N ARG A 43 62.204 -3.605 -12.627 1.00 1.00 N ATOM 600 CA ARG A 43 62.984 -4.065 -13.764 1.00 1.00 C ATOM 601 C ARG A 43 63.520 -5.465 -13.409 1.00 1.00 C ATOM 602 O ARG A 43 63.447 -6.389 -14.220 1.00 1.00 O ATOM 603 CB ARG A 43 64.110 -3.043 -14.032 1.00 1.00 C ATOM 604 CG ARG A 43 64.481 -2.961 -15.544 1.00 1.00 C ATOM 605 CD ARG A 43 65.841 -3.610 -15.800 1.00 1.00 C ATOM 606 NE ARG A 43 66.150 -3.573 -17.225 1.00 1.00 N ATOM 607 CZ ARG A 43 67.143 -4.295 -17.735 1.00 1.00 C ATOM 608 NH1 ARG A 43 67.862 -5.052 -16.954 1.00 1.00 N ATOM 609 NH2 ARG A 43 67.399 -4.248 -19.016 1.00 1.00 N ATOM 0 H ARG A 43 62.516 -2.727 -12.213 1.00 1.00 H new ATOM 0 HA ARG A 43 62.395 -4.141 -14.678 1.00 1.00 H new ATOM 0 HB2 ARG A 43 63.797 -2.059 -13.682 1.00 1.00 H new ATOM 0 HB3 ARG A 43 64.994 -3.319 -13.457 1.00 1.00 H new ATOM 0 HG2 ARG A 43 63.716 -3.460 -16.139 1.00 1.00 H new ATOM 0 HG3 ARG A 43 64.504 -1.919 -15.863 1.00 1.00 H new ATOM 0 HD2 ARG A 43 66.615 -3.087 -15.238 1.00 1.00 H new ATOM 0 HD3 ARG A 43 65.833 -4.641 -15.448 1.00 1.00 H new ATOM 0 HE ARG A 43 65.593 -2.982 -17.842 1.00 1.00 H new ATOM 0 HH11 ARG A 43 67.662 -5.089 -15.954 1.00 1.00 H new ATOM 0 HH12 ARG A 43 68.624 -5.607 -17.343 1.00 1.00 H new ATOM 0 HH21 ARG A 43 66.836 -3.656 -19.627 1.00 1.00 H new ATOM 0 HH22 ARG A 43 68.162 -4.803 -19.404 1.00 1.00 H new ATOM 623 N GLY A 44 64.043 -5.615 -12.182 1.00 1.00 N ATOM 624 CA GLY A 44 64.575 -6.900 -11.701 1.00 1.00 C ATOM 625 C GLY A 44 66.034 -6.787 -11.245 1.00 1.00 C ATOM 626 O GLY A 44 66.470 -7.557 -10.387 1.00 1.00 O ATOM 0 H GLY A 44 64.109 -4.858 -11.502 1.00 1.00 H new ATOM 0 HA2 GLY A 44 63.964 -7.257 -10.872 1.00 1.00 H new ATOM 0 HA3 GLY A 44 64.501 -7.643 -12.495 1.00 1.00 H new ATOM 630 N PHE A 45 66.771 -5.809 -11.776 1.00 1.00 N ATOM 631 CA PHE A 45 68.170 -5.577 -11.374 1.00 1.00 C ATOM 632 C PHE A 45 68.544 -4.118 -11.674 1.00 1.00 C ATOM 633 O PHE A 45 67.840 -3.469 -12.432 1.00 1.00 O ATOM 634 CB PHE A 45 69.133 -6.535 -12.111 1.00 1.00 C ATOM 635 CG PHE A 45 69.392 -7.790 -11.281 1.00 1.00 C ATOM 636 CD1 PHE A 45 68.546 -8.905 -11.390 1.00 1.00 C ATOM 637 CD2 PHE A 45 70.490 -7.836 -10.403 1.00 1.00 C ATOM 638 CE1 PHE A 45 68.797 -10.057 -10.624 1.00 1.00 C ATOM 639 CE2 PHE A 45 70.738 -8.988 -9.642 1.00 1.00 C ATOM 640 CZ PHE A 45 69.891 -10.098 -9.752 1.00 1.00 C ATOM 0 H PHE A 45 66.427 -5.162 -12.486 1.00 1.00 H new ATOM 0 HA PHE A 45 68.263 -5.772 -10.306 1.00 1.00 H new ATOM 0 HB2 PHE A 45 68.708 -6.813 -13.076 1.00 1.00 H new ATOM 0 HB3 PHE A 45 70.076 -6.026 -12.312 1.00 1.00 H new ATOM 0 HD1 PHE A 45 67.702 -8.878 -12.063 1.00 1.00 H new ATOM 0 HD2 PHE A 45 71.144 -6.981 -10.314 1.00 1.00 H new ATOM 0 HE1 PHE A 45 68.144 -10.913 -10.709 1.00 1.00 H new ATOM 0 HE2 PHE A 45 71.583 -9.019 -8.970 1.00 1.00 H new ATOM 0 HZ PHE A 45 70.082 -10.984 -9.165 1.00 1.00 H new ATOM 650 N PHE A 46 69.651 -3.657 -11.044 1.00 1.00 N ATOM 651 CA PHE A 46 70.216 -2.274 -11.167 1.00 1.00 C ATOM 652 C PHE A 46 70.211 -1.578 -9.829 1.00 1.00 C ATOM 653 O PHE A 46 69.168 -1.123 -9.424 1.00 1.00 O ATOM 654 CB PHE A 46 69.472 -1.345 -12.174 1.00 1.00 C ATOM 655 CG PHE A 46 70.145 -1.411 -13.532 1.00 1.00 C ATOM 656 CD1 PHE A 46 69.767 -2.366 -14.490 1.00 1.00 C ATOM 657 CD2 PHE A 46 71.175 -0.508 -13.822 1.00 1.00 C ATOM 658 CE1 PHE A 46 70.418 -2.412 -15.726 1.00 1.00 C ATOM 659 CE2 PHE A 46 71.823 -0.554 -15.062 1.00 1.00 C ATOM 660 CZ PHE A 46 71.443 -1.508 -16.013 1.00 1.00 C ATOM 0 H PHE A 46 70.198 -4.247 -10.416 1.00 1.00 H new ATOM 0 HA PHE A 46 71.225 -2.433 -11.547 1.00 1.00 H new ATOM 0 HB2 PHE A 46 68.429 -1.649 -12.260 1.00 1.00 H new ATOM 0 HB3 PHE A 46 69.475 -0.319 -11.806 1.00 1.00 H new ATOM 0 HD1 PHE A 46 68.973 -3.065 -14.272 1.00 1.00 H new ATOM 0 HD2 PHE A 46 71.470 0.226 -13.087 1.00 1.00 H new ATOM 0 HE1 PHE A 46 70.128 -3.148 -16.461 1.00 1.00 H new ATOM 0 HE2 PHE A 46 72.615 0.146 -15.285 1.00 1.00 H new ATOM 0 HZ PHE A 46 71.943 -1.545 -16.970 1.00 1.00 H new ATOM 670 N ARG A 47 71.394 -1.479 -9.198 1.00 1.00 N ATOM 671 CA ARG A 47 71.565 -0.797 -7.905 1.00 1.00 C ATOM 672 C ARG A 47 71.576 -1.782 -6.758 1.00 1.00 C ATOM 673 O ARG A 47 71.219 -2.939 -6.940 1.00 1.00 O ATOM 674 CB ARG A 47 70.467 0.273 -7.652 1.00 1.00 C ATOM 675 CG ARG A 47 69.133 -0.370 -7.093 1.00 1.00 C ATOM 676 CD ARG A 47 68.831 0.008 -5.618 1.00 1.00 C ATOM 677 NE ARG A 47 67.454 0.518 -5.523 1.00 1.00 N ATOM 678 CZ ARG A 47 66.529 0.018 -4.673 1.00 1.00 C ATOM 679 NH1 ARG A 47 66.817 -0.929 -3.812 1.00 1.00 N ATOM 680 NH2 ARG A 47 65.312 0.497 -4.701 1.00 1.00 N ATOM 0 H ARG A 47 72.259 -1.870 -9.571 1.00 1.00 H new ATOM 0 HA ARG A 47 72.530 -0.293 -7.956 1.00 1.00 H new ATOM 0 HB2 ARG A 47 70.838 1.013 -6.943 1.00 1.00 H new ATOM 0 HB3 ARG A 47 70.254 0.801 -8.581 1.00 1.00 H new ATOM 0 HG2 ARG A 47 68.298 -0.055 -7.718 1.00 1.00 H new ATOM 0 HG3 ARG A 47 69.201 -1.455 -7.175 1.00 1.00 H new ATOM 0 HD2 ARG A 47 68.955 -0.863 -4.974 1.00 1.00 H new ATOM 0 HD3 ARG A 47 69.536 0.763 -5.272 1.00 1.00 H new ATOM 0 HE ARG A 47 67.183 1.290 -6.131 1.00 1.00 H new ATOM 0 HH11 ARG A 47 67.762 -1.310 -3.770 1.00 1.00 H new ATOM 0 HH12 ARG A 47 66.096 -1.284 -3.184 1.00 1.00 H new ATOM 0 HH21 ARG A 47 65.071 1.239 -5.359 1.00 1.00 H new ATOM 0 HH22 ARG A 47 64.604 0.129 -4.065 1.00 1.00 H new ATOM 694 N CYS A 48 72.078 -1.304 -5.616 1.00 1.00 N ATOM 695 CA CYS A 48 72.230 -2.105 -4.393 1.00 1.00 C ATOM 696 C CYS A 48 73.075 -3.334 -4.663 1.00 1.00 C ATOM 697 O CYS A 48 72.560 -4.420 -4.683 1.00 1.00 O ATOM 698 CB CYS A 48 70.875 -2.557 -3.773 1.00 1.00 C ATOM 699 SG CYS A 48 69.773 -3.305 -5.022 1.00 1.00 S ATOM 0 H CYS A 48 72.394 -0.340 -5.511 1.00 1.00 H new ATOM 0 HA CYS A 48 72.720 -1.450 -3.672 1.00 1.00 H new ATOM 0 HB2 CYS A 48 71.062 -3.277 -2.976 1.00 1.00 H new ATOM 0 HB3 CYS A 48 70.379 -1.699 -3.318 1.00 1.00 H new ATOM 0 HG CYS A 48 70.392 -3.370 -6.163 1.00 1.00 H new ATOM 704 N ASN A 49 74.373 -3.156 -4.855 1.00 1.00 N ATOM 705 CA ASN A 49 75.255 -4.307 -5.117 1.00 1.00 C ATOM 706 C ASN A 49 76.625 -4.088 -4.472 1.00 1.00 C ATOM 707 O ASN A 49 77.003 -2.946 -4.271 1.00 1.00 O ATOM 708 CB ASN A 49 75.409 -4.495 -6.651 1.00 1.00 C ATOM 709 CG ASN A 49 75.141 -5.945 -7.060 1.00 1.00 C ATOM 710 OD1 ASN A 49 75.929 -6.541 -7.795 1.00 1.00 O ATOM 711 ND2 ASN A 49 74.068 -6.549 -6.626 1.00 1.00 N ATOM 0 H ASN A 49 74.841 -2.250 -4.837 1.00 1.00 H new ATOM 0 HA ASN A 49 74.813 -5.204 -4.683 1.00 1.00 H new ATOM 0 HB2 ASN A 49 74.717 -3.833 -7.172 1.00 1.00 H new ATOM 0 HB3 ASN A 49 76.415 -4.208 -6.956 1.00 1.00 H new ATOM 0 HD21 ASN A 49 73.882 -7.515 -6.896 1.00 1.00 H new ATOM 0 HD22 ASN A 49 73.416 -6.055 -6.017 1.00 1.00 H new ATOM 718 N PRO A 50 77.373 -5.145 -4.160 1.00 1.00 N ATOM 719 CA PRO A 50 78.755 -5.019 -3.567 1.00 1.00 C ATOM 720 C PRO A 50 79.656 -4.085 -4.391 1.00 1.00 C ATOM 721 O PRO A 50 80.718 -4.483 -4.855 1.00 1.00 O ATOM 722 CB PRO A 50 79.301 -6.460 -3.614 1.00 1.00 C ATOM 723 CG PRO A 50 78.099 -7.344 -3.600 1.00 1.00 C ATOM 724 CD PRO A 50 76.983 -6.569 -4.313 1.00 1.00 C ATOM 0 HA PRO A 50 78.729 -4.590 -2.565 1.00 1.00 H new ATOM 0 HB2 PRO A 50 79.898 -6.624 -4.511 1.00 1.00 H new ATOM 0 HB3 PRO A 50 79.947 -6.663 -2.760 1.00 1.00 H new ATOM 0 HG2 PRO A 50 78.304 -8.286 -4.109 1.00 1.00 H new ATOM 0 HG3 PRO A 50 77.810 -7.590 -2.578 1.00 1.00 H new ATOM 0 HD2 PRO A 50 76.910 -6.851 -5.363 1.00 1.00 H new ATOM 0 HD3 PRO A 50 76.010 -6.766 -3.862 1.00 1.00 H new ATOM 732 N GLU A 51 79.228 -2.848 -4.568 1.00 1.00 N ATOM 733 CA GLU A 51 79.993 -1.890 -5.346 1.00 1.00 C ATOM 734 C GLU A 51 80.428 -2.521 -6.677 1.00 1.00 C ATOM 735 O GLU A 51 81.285 -1.988 -7.375 1.00 1.00 O ATOM 736 CB GLU A 51 81.216 -1.450 -4.544 1.00 1.00 C ATOM 737 CG GLU A 51 80.758 -0.837 -3.217 1.00 1.00 C ATOM 738 CD GLU A 51 80.057 0.496 -3.461 1.00 1.00 C ATOM 739 OE1 GLU A 51 80.660 1.353 -4.085 1.00 1.00 O ATOM 740 OE2 GLU A 51 78.933 0.643 -3.011 1.00 1.00 O ATOM 0 H GLU A 51 78.356 -2.483 -4.184 1.00 1.00 H new ATOM 0 HA GLU A 51 79.373 -1.020 -5.562 1.00 1.00 H new ATOM 0 HB2 GLU A 51 81.869 -2.303 -4.358 1.00 1.00 H new ATOM 0 HB3 GLU A 51 81.796 -0.723 -5.113 1.00 1.00 H new ATOM 0 HG2 GLU A 51 80.082 -1.523 -2.707 1.00 1.00 H new ATOM 0 HG3 GLU A 51 81.616 -0.689 -2.562 1.00 1.00 H new ATOM 747 N ARG A 52 79.821 -3.673 -7.015 1.00 1.00 N ATOM 748 CA ARG A 52 80.139 -4.394 -8.262 1.00 1.00 C ATOM 749 C ARG A 52 79.107 -4.131 -9.355 1.00 1.00 C ATOM 750 O ARG A 52 77.915 -4.001 -9.087 1.00 1.00 O ATOM 751 CB ARG A 52 80.192 -5.909 -8.010 1.00 1.00 C ATOM 752 CG ARG A 52 81.532 -6.297 -7.397 1.00 1.00 C ATOM 753 CD ARG A 52 81.574 -7.811 -7.143 1.00 1.00 C ATOM 754 NE ARG A 52 81.305 -8.087 -5.738 1.00 1.00 N ATOM 755 CZ ARG A 52 82.290 -8.090 -4.842 1.00 1.00 C ATOM 756 NH1 ARG A 52 83.518 -7.860 -5.221 1.00 1.00 N ATOM 757 NH2 ARG A 52 82.030 -8.322 -3.585 1.00 1.00 N ATOM 0 H ARG A 52 79.108 -4.125 -6.443 1.00 1.00 H new ATOM 0 HA ARG A 52 81.110 -4.026 -8.594 1.00 1.00 H new ATOM 0 HB2 ARG A 52 79.381 -6.202 -7.343 1.00 1.00 H new ATOM 0 HB3 ARG A 52 80.044 -6.446 -8.947 1.00 1.00 H new ATOM 0 HG2 ARG A 52 82.344 -6.009 -8.065 1.00 1.00 H new ATOM 0 HG3 ARG A 52 81.683 -5.759 -6.461 1.00 1.00 H new ATOM 0 HD2 ARG A 52 80.837 -8.314 -7.769 1.00 1.00 H new ATOM 0 HD3 ARG A 52 82.551 -8.208 -7.420 1.00 1.00 H new ATOM 0 HE ARG A 52 80.350 -8.280 -5.437 1.00 1.00 H new ATOM 0 HH11 ARG A 52 83.723 -7.678 -6.203 1.00 1.00 H new ATOM 0 HH12 ARG A 52 84.272 -7.862 -4.535 1.00 1.00 H new ATOM 0 HH21 ARG A 52 81.071 -8.501 -3.287 1.00 1.00 H new ATOM 0 HH22 ARG A 52 82.786 -8.324 -2.900 1.00 1.00 H new ATOM 771 N ILE A 53 79.595 -4.036 -10.592 1.00 1.00 N ATOM 772 CA ILE A 53 78.753 -3.761 -11.735 1.00 1.00 C ATOM 773 C ILE A 53 77.550 -4.711 -11.888 1.00 1.00 C ATOM 774 O ILE A 53 77.610 -5.939 -11.767 1.00 1.00 O ATOM 775 CB ILE A 53 79.593 -3.749 -13.013 1.00 1.00 C ATOM 776 CG1 ILE A 53 78.729 -3.312 -14.213 1.00 1.00 C ATOM 777 CG2 ILE A 53 80.148 -5.148 -13.266 1.00 1.00 C ATOM 778 CD1 ILE A 53 78.291 -1.847 -14.056 1.00 1.00 C ATOM 0 H ILE A 53 80.583 -4.149 -10.820 1.00 1.00 H new ATOM 0 HA ILE A 53 78.321 -2.776 -11.557 1.00 1.00 H new ATOM 0 HB ILE A 53 80.415 -3.043 -12.894 1.00 1.00 H new ATOM 0 HG12 ILE A 53 79.293 -3.432 -15.138 1.00 1.00 H new ATOM 0 HG13 ILE A 53 77.851 -3.954 -14.290 1.00 1.00 H new ATOM 0 HG21 ILE A 53 80.747 -5.143 -14.176 1.00 1.00 H new ATOM 0 HG22 ILE A 53 80.770 -5.450 -12.424 1.00 1.00 H new ATOM 0 HG23 ILE A 53 79.323 -5.852 -13.379 1.00 1.00 H new ATOM 0 HD11 ILE A 53 77.682 -1.556 -14.912 1.00 1.00 H new ATOM 0 HD12 ILE A 53 77.708 -1.738 -13.142 1.00 1.00 H new ATOM 0 HD13 ILE A 53 79.172 -1.208 -14.003 1.00 1.00 H new ATOM 790 N GLN A 54 76.470 -4.026 -12.183 1.00 1.00 N ATOM 791 CA GLN A 54 75.180 -4.681 -12.394 1.00 1.00 C ATOM 792 C GLN A 54 74.942 -5.118 -13.845 1.00 1.00 C ATOM 793 O GLN A 54 74.333 -4.388 -14.628 1.00 1.00 O ATOM 794 CB GLN A 54 73.997 -3.872 -11.877 1.00 1.00 C ATOM 795 CG GLN A 54 72.920 -4.861 -11.345 1.00 1.00 C ATOM 796 CD GLN A 54 73.274 -5.281 -9.927 1.00 1.00 C ATOM 797 OE1 GLN A 54 74.305 -5.935 -9.710 1.00 1.00 O ATOM 798 NE2 GLN A 54 72.502 -4.935 -8.946 1.00 1.00 N ATOM 0 H GLN A 54 76.449 -3.011 -12.285 1.00 1.00 H new ATOM 0 HA GLN A 54 75.244 -5.587 -11.791 1.00 1.00 H new ATOM 0 HB2 GLN A 54 74.317 -3.197 -11.083 1.00 1.00 H new ATOM 0 HB3 GLN A 54 73.583 -3.254 -12.674 1.00 1.00 H new ATOM 0 HG2 GLN A 54 71.938 -4.389 -11.361 1.00 1.00 H new ATOM 0 HG3 GLN A 54 72.864 -5.737 -11.992 1.00 1.00 H new ATOM 0 HE21 GLN A 54 71.655 -4.397 -9.129 1.00 1.00 H new ATOM 0 HE22 GLN A 54 72.741 -5.200 -7.991 1.00 1.00 H new ATOM 807 N ILE A 55 75.395 -6.339 -14.161 1.00 1.00 N ATOM 808 CA ILE A 55 75.198 -6.937 -15.492 1.00 1.00 C ATOM 809 C ILE A 55 74.975 -8.454 -15.351 1.00 1.00 C ATOM 810 O ILE A 55 75.448 -9.053 -14.383 1.00 1.00 O ATOM 811 CB ILE A 55 76.409 -6.693 -16.396 1.00 1.00 C ATOM 812 CG1 ILE A 55 76.121 -7.296 -17.772 1.00 1.00 C ATOM 813 CG2 ILE A 55 77.647 -7.373 -15.801 1.00 1.00 C ATOM 814 CD1 ILE A 55 77.162 -6.802 -18.770 1.00 1.00 C ATOM 0 H ILE A 55 75.904 -6.936 -13.509 1.00 1.00 H new ATOM 0 HA ILE A 55 74.325 -6.467 -15.945 1.00 1.00 H new ATOM 0 HB ILE A 55 76.593 -5.622 -16.481 1.00 1.00 H new ATOM 0 HG12 ILE A 55 76.143 -8.384 -17.716 1.00 1.00 H new ATOM 0 HG13 ILE A 55 75.121 -7.014 -18.103 1.00 1.00 H new ATOM 0 HG21 ILE A 55 78.506 -7.196 -16.448 1.00 1.00 H new ATOM 0 HG22 ILE A 55 77.848 -6.962 -14.812 1.00 1.00 H new ATOM 0 HG23 ILE A 55 77.469 -8.445 -15.719 1.00 1.00 H new ATOM 0 HD11 ILE A 55 76.958 -7.231 -19.751 1.00 1.00 H new ATOM 0 HD12 ILE A 55 77.118 -5.715 -18.833 1.00 1.00 H new ATOM 0 HD13 ILE A 55 78.155 -7.107 -18.440 1.00 1.00 H new ATOM 826 N GLY A 56 74.262 -9.087 -16.304 1.00 1.00 N ATOM 827 CA GLY A 56 74.000 -10.535 -16.245 1.00 1.00 C ATOM 828 C GLY A 56 72.538 -10.810 -15.898 1.00 1.00 C ATOM 829 O GLY A 56 72.131 -11.957 -15.724 1.00 1.00 O ATOM 0 H GLY A 56 73.861 -8.620 -17.117 1.00 1.00 H new ATOM 0 HA2 GLY A 56 74.243 -10.992 -17.204 1.00 1.00 H new ATOM 0 HA3 GLY A 56 74.648 -10.996 -15.499 1.00 1.00 H new ATOM 833 N ASP A 57 71.759 -9.736 -15.777 1.00 1.00 N ATOM 834 CA ASP A 57 70.348 -9.851 -15.424 1.00 1.00 C ATOM 835 C ASP A 57 69.449 -10.063 -16.647 1.00 1.00 C ATOM 836 O ASP A 57 69.119 -9.135 -17.388 1.00 1.00 O ATOM 837 CB ASP A 57 69.923 -8.607 -14.659 1.00 1.00 C ATOM 838 CG ASP A 57 69.882 -7.403 -15.592 1.00 1.00 C ATOM 839 OD1 ASP A 57 70.943 -6.871 -15.896 1.00 1.00 O ATOM 840 OD2 ASP A 57 68.797 -7.029 -15.991 1.00 1.00 O ATOM 0 H ASP A 57 72.082 -8.779 -15.918 1.00 1.00 H new ATOM 0 HA ASP A 57 70.230 -10.735 -14.798 1.00 1.00 H new ATOM 0 HB2 ASP A 57 68.941 -8.764 -14.213 1.00 1.00 H new ATOM 0 HB3 ASP A 57 70.619 -8.419 -13.841 1.00 1.00 H new ATOM 845 N TRP A 58 69.031 -11.310 -16.799 1.00 1.00 N ATOM 846 CA TRP A 58 68.130 -11.758 -17.871 1.00 1.00 C ATOM 847 C TRP A 58 66.708 -11.425 -17.463 1.00 1.00 C ATOM 848 O TRP A 58 66.545 -10.833 -16.391 1.00 1.00 O ATOM 849 CB TRP A 58 68.352 -13.220 -18.142 1.00 1.00 C ATOM 850 CG TRP A 58 69.674 -13.410 -18.830 1.00 1.00 C ATOM 851 CD1 TRP A 58 70.664 -12.479 -18.933 1.00 1.00 C ATOM 852 CD2 TRP A 58 70.166 -14.593 -19.501 1.00 1.00 C ATOM 853 NE1 TRP A 58 71.726 -13.035 -19.618 1.00 1.00 N ATOM 854 CE2 TRP A 58 71.466 -14.340 -19.992 1.00 1.00 C ATOM 855 CE3 TRP A 58 69.603 -15.855 -19.724 1.00 1.00 C ATOM 856 CZ2 TRP A 58 72.189 -15.318 -20.684 1.00 1.00 C ATOM 857 CZ3 TRP A 58 70.318 -16.838 -20.418 1.00 1.00 C ATOM 858 CH2 TRP A 58 71.610 -16.573 -20.898 1.00 1.00 C ATOM 0 H TRP A 58 69.310 -12.063 -16.170 1.00 1.00 H new ATOM 0 HA TRP A 58 68.334 -11.243 -18.810 1.00 1.00 H new ATOM 0 HB2 TRP A 58 68.333 -13.780 -17.207 1.00 1.00 H new ATOM 0 HB3 TRP A 58 67.547 -13.611 -18.764 1.00 1.00 H new ATOM 0 HD1 TRP A 58 70.624 -11.473 -18.543 1.00 1.00 H new ATOM 0 HE1 TRP A 58 72.596 -12.543 -19.823 1.00 1.00 H new ATOM 0 HE3 TRP A 58 68.610 -16.072 -19.358 1.00 1.00 H new ATOM 0 HZ2 TRP A 58 73.183 -15.106 -21.049 1.00 1.00 H new ATOM 0 HZ3 TRP A 58 69.872 -17.807 -20.585 1.00 1.00 H new ATOM 0 HH2 TRP A 58 72.156 -17.337 -21.432 1.00 1.00 H new ATOM 869 N ARG A 59 65.653 -11.753 -18.230 1.00 1.00 N ATOM 870 CA ARG A 59 64.285 -11.443 -17.842 1.00 1.00 C ATOM 871 C ARG A 59 63.570 -12.710 -17.278 1.00 1.00 C ATOM 872 O ARG A 59 63.003 -12.700 -16.188 1.00 1.00 O ATOM 873 CB ARG A 59 63.537 -10.949 -19.134 1.00 1.00 C ATOM 874 CG ARG A 59 64.501 -10.878 -20.364 1.00 1.00 C ATOM 875 CD ARG A 59 64.764 -12.289 -20.971 1.00 1.00 C ATOM 876 NE ARG A 59 65.894 -12.260 -21.921 1.00 1.00 N ATOM 877 CZ ARG A 59 66.567 -13.379 -22.252 1.00 1.00 C ATOM 878 NH1 ARG A 59 66.250 -14.519 -21.703 1.00 1.00 N ATOM 879 NH2 ARG A 59 67.550 -13.340 -23.124 1.00 1.00 N ATOM 0 H ARG A 59 65.733 -12.235 -19.125 1.00 1.00 H new ATOM 0 HA ARG A 59 64.278 -10.681 -17.063 1.00 1.00 H new ATOM 0 HB2 ARG A 59 62.710 -11.623 -19.357 1.00 1.00 H new ATOM 0 HB3 ARG A 59 63.105 -9.965 -18.952 1.00 1.00 H new ATOM 0 HG2 ARG A 59 64.071 -10.228 -21.126 1.00 1.00 H new ATOM 0 HG3 ARG A 59 65.447 -10.430 -20.060 1.00 1.00 H new ATOM 0 HD2 ARG A 59 64.976 -12.998 -20.171 1.00 1.00 H new ATOM 0 HD3 ARG A 59 63.867 -12.642 -21.480 1.00 1.00 H new ATOM 0 HE ARG A 59 66.172 -11.371 -22.337 1.00 1.00 H new ATOM 0 HH11 ARG A 59 65.492 -14.564 -21.022 1.00 1.00 H new ATOM 0 HH12 ARG A 59 66.760 -15.366 -21.955 1.00 1.00 H new ATOM 0 HH21 ARG A 59 67.811 -12.455 -23.559 1.00 1.00 H new ATOM 0 HH22 ARG A 59 68.051 -14.195 -23.366 1.00 1.00 H new ATOM 893 N TYR A 60 63.591 -13.775 -18.114 1.00 1.00 N ATOM 894 CA TYR A 60 62.960 -15.094 -17.854 1.00 1.00 C ATOM 895 C TYR A 60 63.803 -15.964 -16.930 1.00 1.00 C ATOM 896 O TYR A 60 63.334 -16.984 -16.383 1.00 1.00 O ATOM 897 CB TYR A 60 62.786 -15.856 -19.177 1.00 1.00 C ATOM 898 CG TYR A 60 62.193 -17.230 -18.903 1.00 1.00 C ATOM 899 CD1 TYR A 60 60.821 -17.365 -18.666 1.00 1.00 C ATOM 900 CD2 TYR A 60 63.023 -18.364 -18.854 1.00 1.00 C ATOM 901 CE1 TYR A 60 60.275 -18.625 -18.384 1.00 1.00 C ATOM 902 CE2 TYR A 60 62.476 -19.625 -18.564 1.00 1.00 C ATOM 903 CZ TYR A 60 61.101 -19.754 -18.330 1.00 1.00 C ATOM 904 OH TYR A 60 60.564 -20.992 -18.025 1.00 1.00 O ATOM 0 H TYR A 60 64.063 -13.740 -19.018 1.00 1.00 H new ATOM 0 HA TYR A 60 62.000 -14.896 -17.377 1.00 1.00 H new ATOM 0 HB2 TYR A 60 62.135 -15.295 -19.848 1.00 1.00 H new ATOM 0 HB3 TYR A 60 63.748 -15.958 -19.678 1.00 1.00 H new ATOM 0 HD1 TYR A 60 60.181 -16.496 -18.700 1.00 1.00 H new ATOM 0 HD2 TYR A 60 64.082 -18.265 -19.040 1.00 1.00 H new ATOM 0 HE1 TYR A 60 59.214 -18.725 -18.208 1.00 1.00 H new ATOM 0 HE2 TYR A 60 63.115 -20.494 -18.521 1.00 1.00 H new ATOM 0 HH TYR A 60 61.274 -21.667 -18.031 1.00 1.00 H new ATOM 914 N GLU A 61 65.035 -15.578 -16.746 1.00 1.00 N ATOM 915 CA GLU A 61 65.911 -16.329 -15.897 1.00 1.00 C ATOM 916 C GLU A 61 65.469 -16.147 -14.467 1.00 1.00 C ATOM 917 O GLU A 61 65.937 -16.817 -13.566 1.00 1.00 O ATOM 918 CB GLU A 61 67.346 -15.842 -16.048 1.00 1.00 C ATOM 919 CG GLU A 61 68.328 -16.809 -15.383 1.00 1.00 C ATOM 920 CD GLU A 61 69.738 -16.232 -15.471 1.00 1.00 C ATOM 921 OE1 GLU A 61 69.907 -15.080 -15.102 1.00 1.00 O ATOM 922 OE2 GLU A 61 70.623 -16.942 -15.913 1.00 1.00 O ATOM 0 H GLU A 61 65.452 -14.750 -17.172 1.00 1.00 H new ATOM 0 HA GLU A 61 65.870 -17.382 -16.177 1.00 1.00 H new ATOM 0 HB2 GLU A 61 67.590 -15.741 -17.106 1.00 1.00 H new ATOM 0 HB3 GLU A 61 67.447 -14.853 -15.602 1.00 1.00 H new ATOM 0 HG2 GLU A 61 68.051 -16.967 -14.341 1.00 1.00 H new ATOM 0 HG3 GLU A 61 68.289 -17.781 -15.874 1.00 1.00 H new ATOM 929 N VAL A 62 64.618 -15.164 -14.250 1.00 1.00 N ATOM 930 CA VAL A 62 64.218 -14.824 -12.880 1.00 1.00 C ATOM 931 C VAL A 62 63.891 -16.067 -12.121 1.00 1.00 C ATOM 932 O VAL A 62 64.427 -16.294 -11.048 1.00 1.00 O ATOM 933 CB VAL A 62 63.010 -13.872 -12.844 1.00 1.00 C ATOM 934 CG1 VAL A 62 63.452 -12.489 -13.316 1.00 1.00 C ATOM 935 CG2 VAL A 62 61.863 -14.399 -13.730 1.00 1.00 C ATOM 0 H VAL A 62 64.193 -14.592 -14.980 1.00 1.00 H new ATOM 0 HA VAL A 62 65.061 -14.311 -12.417 1.00 1.00 H new ATOM 0 HB VAL A 62 62.637 -13.810 -11.822 1.00 1.00 H new ATOM 0 HG11 VAL A 62 62.601 -11.808 -13.294 1.00 1.00 H new ATOM 0 HG12 VAL A 62 64.235 -12.113 -12.658 1.00 1.00 H new ATOM 0 HG13 VAL A 62 63.835 -12.557 -14.334 1.00 1.00 H new ATOM 0 HG21 VAL A 62 61.022 -13.707 -13.686 1.00 1.00 H new ATOM 0 HG22 VAL A 62 62.209 -14.485 -14.760 1.00 1.00 H new ATOM 0 HG23 VAL A 62 61.546 -15.378 -13.371 1.00 1.00 H new ATOM 945 N ALA A 63 63.023 -16.876 -12.662 1.00 1.00 N ATOM 946 CA ALA A 63 62.670 -18.082 -12.011 1.00 1.00 C ATOM 947 C ALA A 63 63.885 -18.985 -11.956 1.00 1.00 C ATOM 948 O ALA A 63 64.266 -19.448 -10.898 1.00 1.00 O ATOM 949 CB ALA A 63 61.552 -18.746 -12.808 1.00 1.00 C ATOM 0 H ALA A 63 62.553 -16.712 -13.552 1.00 1.00 H new ATOM 0 HA ALA A 63 62.328 -17.889 -10.994 1.00 1.00 H new ATOM 0 HB1 ALA A 63 61.264 -19.679 -12.323 1.00 1.00 H new ATOM 0 HB2 ALA A 63 60.691 -18.079 -12.852 1.00 1.00 H new ATOM 0 HB3 ALA A 63 61.901 -18.955 -13.819 1.00 1.00 H new ATOM 955 N HIS A 64 64.533 -19.176 -13.101 1.00 1.00 N ATOM 956 CA HIS A 64 65.725 -20.041 -13.132 1.00 1.00 C ATOM 957 C HIS A 64 66.731 -19.627 -12.030 1.00 1.00 C ATOM 958 O HIS A 64 67.046 -20.412 -11.127 1.00 1.00 O ATOM 959 CB HIS A 64 66.363 -19.934 -14.537 1.00 1.00 C ATOM 960 CG HIS A 64 66.115 -21.173 -15.362 1.00 1.00 C ATOM 961 ND1 HIS A 64 64.852 -21.723 -15.516 1.00 1.00 N ATOM 962 CD2 HIS A 64 66.956 -21.953 -16.113 1.00 1.00 C ATOM 963 CE1 HIS A 64 64.969 -22.785 -16.335 1.00 1.00 C ATOM 964 NE2 HIS A 64 66.231 -22.968 -16.728 1.00 1.00 N ATOM 0 H HIS A 64 64.271 -18.763 -13.996 1.00 1.00 H new ATOM 0 HA HIS A 64 65.442 -21.075 -12.935 1.00 1.00 H new ATOM 0 HB2 HIS A 64 65.957 -19.065 -15.055 1.00 1.00 H new ATOM 0 HB3 HIS A 64 67.436 -19.773 -14.437 1.00 1.00 H new ATOM 0 HD2 HIS A 64 68.021 -21.802 -16.212 1.00 1.00 H new ATOM 0 HE1 HIS A 64 64.143 -23.412 -16.637 1.00 1.00 H new ATOM 0 HE2 HIS A 64 66.588 -23.696 -17.347 1.00 1.00 H new ATOM 972 N ASP A 65 67.192 -18.384 -12.085 1.00 1.00 N ATOM 973 CA ASP A 65 68.121 -17.873 -11.074 1.00 1.00 C ATOM 974 C ASP A 65 67.426 -17.830 -9.708 1.00 1.00 C ATOM 975 O ASP A 65 67.926 -18.363 -8.705 1.00 1.00 O ATOM 976 CB ASP A 65 68.631 -16.481 -11.467 1.00 1.00 C ATOM 977 CG ASP A 65 69.517 -15.915 -10.361 1.00 1.00 C ATOM 978 OD1 ASP A 65 70.600 -16.443 -10.167 1.00 1.00 O ATOM 979 OD2 ASP A 65 69.099 -14.961 -9.727 1.00 1.00 O ATOM 0 H ASP A 65 66.943 -17.712 -12.811 1.00 1.00 H new ATOM 0 HA ASP A 65 68.980 -18.541 -11.011 1.00 1.00 H new ATOM 0 HB2 ASP A 65 69.193 -16.541 -12.399 1.00 1.00 H new ATOM 0 HB3 ASP A 65 67.788 -15.813 -11.646 1.00 1.00 H new ATOM 984 N GLY A 66 66.245 -17.236 -9.666 1.00 1.00 N ATOM 985 CA GLY A 66 65.457 -17.160 -8.441 1.00 1.00 C ATOM 986 C GLY A 66 65.080 -18.551 -7.912 1.00 1.00 C ATOM 987 O GLY A 66 64.085 -18.696 -7.203 1.00 1.00 O ATOM 0 H GLY A 66 65.805 -16.794 -10.473 1.00 1.00 H new ATOM 0 HA2 GLY A 66 66.022 -16.623 -7.679 1.00 1.00 H new ATOM 0 HA3 GLY A 66 64.550 -16.585 -8.629 1.00 1.00 H new ATOM 991 N ARG A 67 65.915 -19.549 -8.174 1.00 1.00 N ATOM 992 CA ARG A 67 65.708 -20.889 -7.633 1.00 1.00 C ATOM 993 C ARG A 67 66.179 -20.929 -6.209 1.00 1.00 C ATOM 994 O ARG A 67 66.072 -21.973 -5.587 1.00 1.00 O ATOM 995 CB ARG A 67 66.373 -22.008 -8.469 1.00 1.00 C ATOM 996 CG ARG A 67 65.466 -22.612 -9.592 1.00 1.00 C ATOM 997 CD ARG A 67 64.207 -21.778 -9.845 1.00 1.00 C ATOM 998 NE ARG A 67 63.160 -22.116 -8.875 1.00 1.00 N ATOM 999 CZ ARG A 67 61.910 -22.413 -9.217 1.00 1.00 C ATOM 1000 NH1 ARG A 67 61.520 -22.425 -10.465 1.00 1.00 N ATOM 1001 NH2 ARG A 67 61.060 -22.681 -8.270 1.00 1.00 N ATOM 0 H ARG A 67 66.745 -19.456 -8.760 1.00 1.00 H new ATOM 0 HA ARG A 67 64.638 -21.092 -7.679 1.00 1.00 H new ATOM 0 HB2 ARG A 67 67.279 -21.611 -8.927 1.00 1.00 H new ATOM 0 HB3 ARG A 67 66.680 -22.810 -7.798 1.00 1.00 H new ATOM 0 HG2 ARG A 67 66.039 -22.687 -10.516 1.00 1.00 H new ATOM 0 HG3 ARG A 67 65.176 -23.625 -9.314 1.00 1.00 H new ATOM 0 HD2 ARG A 67 64.447 -20.717 -9.774 1.00 1.00 H new ATOM 0 HD3 ARG A 67 63.844 -21.956 -10.857 1.00 1.00 H new ATOM 0 HE ARG A 67 63.404 -22.124 -7.885 1.00 1.00 H new ATOM 0 HH11 ARG A 67 62.182 -22.202 -11.208 1.00 1.00 H new ATOM 0 HH12 ARG A 67 60.554 -22.657 -10.695 1.00 1.00 H new ATOM 0 HH21 ARG A 67 61.359 -22.660 -7.295 1.00 1.00 H new ATOM 0 HH22 ARG A 67 60.094 -22.912 -8.502 1.00 1.00 H new ATOM 1015 N LEU A 68 66.739 -19.811 -5.709 1.00 1.00 N ATOM 1016 CA LEU A 68 67.244 -19.798 -4.312 1.00 1.00 C ATOM 1017 C LEU A 68 66.310 -20.709 -3.485 1.00 1.00 C ATOM 1018 O LEU A 68 66.721 -21.352 -2.533 1.00 1.00 O ATOM 1019 CB LEU A 68 67.253 -18.379 -3.691 1.00 1.00 C ATOM 1020 CG LEU A 68 68.552 -17.652 -4.052 1.00 1.00 C ATOM 1021 CD1 LEU A 68 68.611 -17.473 -5.561 1.00 1.00 C ATOM 1022 CD2 LEU A 68 68.589 -16.276 -3.369 1.00 1.00 C ATOM 0 H LEU A 68 66.853 -18.936 -6.221 1.00 1.00 H new ATOM 0 HA LEU A 68 68.277 -20.147 -4.307 1.00 1.00 H new ATOM 0 HB2 LEU A 68 66.397 -17.810 -4.053 1.00 1.00 H new ATOM 0 HB3 LEU A 68 67.155 -18.448 -2.608 1.00 1.00 H new ATOM 0 HG LEU A 68 69.406 -18.238 -3.712 1.00 1.00 H new ATOM 0 HD11 LEU A 68 69.532 -16.956 -5.830 1.00 1.00 H new ATOM 0 HD12 LEU A 68 68.588 -18.450 -6.044 1.00 1.00 H new ATOM 0 HD13 LEU A 68 67.755 -16.885 -5.891 1.00 1.00 H new ATOM 0 HD21 LEU A 68 69.516 -15.765 -3.630 1.00 1.00 H new ATOM 0 HD22 LEU A 68 67.739 -15.681 -3.704 1.00 1.00 H new ATOM 0 HD23 LEU A 68 68.538 -16.405 -2.288 1.00 1.00 H new ATOM 1034 N LEU A 69 65.054 -20.812 -3.924 1.00 1.00 N ATOM 1035 CA LEU A 69 64.140 -21.736 -3.245 1.00 1.00 C ATOM 1036 C LEU A 69 64.699 -23.161 -3.478 1.00 1.00 C ATOM 1037 O LEU A 69 65.123 -23.819 -2.530 1.00 1.00 O ATOM 1038 CB LEU A 69 62.729 -21.625 -3.839 1.00 1.00 C ATOM 1039 CG LEU A 69 61.693 -22.137 -2.835 1.00 1.00 C ATOM 1040 CD1 LEU A 69 60.297 -21.934 -3.418 1.00 1.00 C ATOM 1041 CD2 LEU A 69 61.913 -23.630 -2.554 1.00 1.00 C ATOM 0 H LEU A 69 64.658 -20.295 -4.709 1.00 1.00 H new ATOM 0 HA LEU A 69 64.071 -21.505 -2.182 1.00 1.00 H new ATOM 0 HB2 LEU A 69 62.515 -20.588 -4.097 1.00 1.00 H new ATOM 0 HB3 LEU A 69 62.668 -22.202 -4.762 1.00 1.00 H new ATOM 0 HG LEU A 69 61.796 -21.585 -1.901 1.00 1.00 H new ATOM 0 HD11 LEU A 69 59.551 -22.296 -2.710 1.00 1.00 H new ATOM 0 HD12 LEU A 69 60.133 -20.873 -3.608 1.00 1.00 H new ATOM 0 HD13 LEU A 69 60.209 -22.488 -4.353 1.00 1.00 H new ATOM 0 HD21 LEU A 69 61.169 -23.979 -1.838 1.00 1.00 H new ATOM 0 HD22 LEU A 69 61.816 -24.193 -3.482 1.00 1.00 H new ATOM 0 HD23 LEU A 69 62.911 -23.779 -2.142 1.00 1.00 H new ATOM 1053 N ALA A 70 64.733 -23.620 -4.751 1.00 1.00 N ATOM 1054 CA ALA A 70 65.301 -24.955 -5.033 1.00 1.00 C ATOM 1055 C ALA A 70 66.826 -24.827 -5.023 1.00 1.00 C ATOM 1056 O ALA A 70 67.478 -25.253 -4.076 1.00 1.00 O ATOM 1057 CB ALA A 70 64.809 -25.465 -6.403 1.00 1.00 C ATOM 0 H ALA A 70 64.390 -23.111 -5.565 1.00 1.00 H new ATOM 0 HA ALA A 70 64.980 -25.672 -4.278 1.00 1.00 H new ATOM 0 HB1 ALA A 70 65.234 -26.449 -6.599 1.00 1.00 H new ATOM 0 HB2 ALA A 70 63.721 -25.535 -6.396 1.00 1.00 H new ATOM 0 HB3 ALA A 70 65.123 -24.772 -7.183 1.00 1.00 H new ATOM 1063 N ALA A 71 67.386 -24.214 -6.073 1.00 1.00 N ATOM 1064 CA ALA A 71 68.827 -23.970 -6.221 1.00 1.00 C ATOM 1065 C ALA A 71 69.458 -23.410 -4.964 1.00 1.00 C ATOM 1066 O ALA A 71 70.642 -23.089 -4.973 1.00 1.00 O ATOM 1067 CB ALA A 71 69.128 -23.026 -7.384 1.00 1.00 C ATOM 0 H ALA A 71 66.839 -23.866 -6.860 1.00 1.00 H new ATOM 0 HA ALA A 71 69.264 -24.948 -6.423 1.00 1.00 H new ATOM 0 HB1 ALA A 71 70.205 -22.872 -7.458 1.00 1.00 H new ATOM 0 HB2 ALA A 71 68.759 -23.463 -8.312 1.00 1.00 H new ATOM 0 HB3 ALA A 71 68.636 -22.069 -7.212 1.00 1.00 H new ATOM 1073 N HIS A 72 68.666 -23.261 -3.905 1.00 1.00 N ATOM 1074 CA HIS A 72 69.123 -22.694 -2.638 1.00 1.00 C ATOM 1075 C HIS A 72 70.636 -22.765 -2.520 1.00 1.00 C ATOM 1076 O HIS A 72 71.301 -21.737 -2.637 1.00 1.00 O ATOM 1077 CB HIS A 72 68.452 -23.536 -1.513 1.00 1.00 C ATOM 1078 CG HIS A 72 67.700 -22.671 -0.544 1.00 1.00 C ATOM 1079 ND1 HIS A 72 68.216 -21.490 -0.039 1.00 1.00 N ATOM 1080 CD2 HIS A 72 66.457 -22.809 0.014 1.00 1.00 C ATOM 1081 CE1 HIS A 72 67.291 -20.968 0.786 1.00 1.00 C ATOM 1082 NE2 HIS A 72 66.198 -21.734 0.851 1.00 1.00 N ATOM 0 H HIS A 72 67.683 -23.532 -3.901 1.00 1.00 H new ATOM 0 HA HIS A 72 68.851 -21.641 -2.566 1.00 1.00 H new ATOM 0 HB2 HIS A 72 67.770 -24.261 -1.958 1.00 1.00 H new ATOM 0 HB3 HIS A 72 69.215 -24.103 -0.979 1.00 1.00 H new ATOM 0 HD2 HIS A 72 65.781 -23.631 -0.170 1.00 1.00 H new ATOM 0 HE1 HIS A 72 67.416 -20.043 1.329 1.00 1.00 H new ATOM 0 HE2 HIS A 72 65.354 -21.564 1.399 1.00 1.00 H new ATOM 1090 N MET A 73 71.196 -23.937 -2.350 1.00 1.00 N ATOM 1091 CA MET A 73 72.637 -24.023 -2.299 1.00 1.00 C ATOM 1092 C MET A 73 73.213 -23.839 -3.706 1.00 1.00 C ATOM 1093 O MET A 73 74.183 -23.103 -3.898 1.00 1.00 O ATOM 1094 CB MET A 73 73.033 -25.359 -1.689 1.00 1.00 C ATOM 1095 CG MET A 73 72.626 -25.359 -0.203 1.00 1.00 C ATOM 1096 SD MET A 73 72.234 -27.047 0.319 1.00 1.00 S ATOM 1097 CE MET A 73 70.457 -26.971 -0.022 1.00 1.00 C ATOM 0 H MET A 73 70.696 -24.820 -2.247 1.00 1.00 H new ATOM 0 HA MET A 73 73.046 -23.231 -1.672 1.00 1.00 H new ATOM 0 HB2 MET A 73 72.541 -26.177 -2.216 1.00 1.00 H new ATOM 0 HB3 MET A 73 74.107 -25.517 -1.787 1.00 1.00 H new ATOM 0 HG2 MET A 73 73.436 -24.958 0.406 1.00 1.00 H new ATOM 0 HG3 MET A 73 71.763 -24.711 -0.052 1.00 1.00 H new ATOM 0 HE1 MET A 73 69.997 -27.926 0.231 1.00 1.00 H new ATOM 0 HE2 MET A 73 70.005 -26.180 0.577 1.00 1.00 H new ATOM 0 HE3 MET A 73 70.298 -26.761 -1.080 1.00 1.00 H new ATOM 1107 N VAL A 74 72.643 -24.557 -4.689 1.00 1.00 N ATOM 1108 CA VAL A 74 73.167 -24.509 -6.054 1.00 1.00 C ATOM 1109 C VAL A 74 73.425 -23.062 -6.492 1.00 1.00 C ATOM 1110 O VAL A 74 74.530 -22.777 -6.953 1.00 1.00 O ATOM 1111 CB VAL A 74 72.200 -25.184 -7.032 1.00 1.00 C ATOM 1112 CG1 VAL A 74 72.846 -25.273 -8.411 1.00 1.00 C ATOM 1113 CG2 VAL A 74 71.837 -26.591 -6.542 1.00 1.00 C ATOM 0 H VAL A 74 71.834 -25.165 -4.563 1.00 1.00 H new ATOM 0 HA VAL A 74 74.113 -25.051 -6.065 1.00 1.00 H new ATOM 0 HB VAL A 74 71.289 -24.588 -7.092 1.00 1.00 H new ATOM 0 HG11 VAL A 74 72.157 -25.753 -9.105 1.00 1.00 H new ATOM 0 HG12 VAL A 74 73.081 -24.270 -8.768 1.00 1.00 H new ATOM 0 HG13 VAL A 74 73.763 -25.859 -8.346 1.00 1.00 H new ATOM 0 HG21 VAL A 74 71.149 -27.056 -7.248 1.00 1.00 H new ATOM 0 HG22 VAL A 74 72.742 -27.194 -6.465 1.00 1.00 H new ATOM 0 HG23 VAL A 74 71.362 -26.524 -5.563 1.00 1.00 H new ATOM 1123 N ASN A 75 72.470 -22.121 -6.316 1.00 1.00 N ATOM 1124 CA ASN A 75 72.669 -20.704 -6.661 1.00 1.00 C ATOM 1125 C ASN A 75 74.089 -20.257 -6.291 1.00 1.00 C ATOM 1126 O ASN A 75 74.645 -19.302 -6.820 1.00 1.00 O ATOM 1127 CB ASN A 75 71.604 -19.964 -5.826 1.00 1.00 C ATOM 1128 CG ASN A 75 71.682 -18.455 -5.949 1.00 1.00 C ATOM 1129 OD1 ASN A 75 71.194 -17.870 -7.004 1.00 1.00 O flip ATOM 1130 ND2 ASN A 75 72.166 -17.785 -5.038 1.00 1.00 N flip ATOM 0 H ASN A 75 71.547 -22.325 -5.933 1.00 1.00 H new ATOM 0 HA ASN A 75 72.564 -20.503 -7.727 1.00 1.00 H new ATOM 0 HB2 ASN A 75 70.614 -20.296 -6.138 1.00 1.00 H new ATOM 0 HB3 ASN A 75 71.717 -20.242 -4.778 1.00 1.00 H new ATOM 0 HD21 ASN A 75 72.548 -18.247 -4.212 1.00 1.00 H new ATOM 0 HD22 ASN A 75 72.186 -16.768 -5.108 1.00 1.00 H new ATOM 1137 N GLY A 76 74.656 -21.013 -5.384 1.00 1.00 N ATOM 1138 CA GLY A 76 76.021 -20.777 -4.905 1.00 1.00 C ATOM 1139 C GLY A 76 76.926 -20.434 -6.101 1.00 1.00 C ATOM 1140 O GLY A 76 78.004 -19.898 -5.936 1.00 1.00 O ATOM 0 H GLY A 76 74.196 -21.812 -4.949 1.00 1.00 H new ATOM 0 HA2 GLY A 76 76.029 -19.961 -4.182 1.00 1.00 H new ATOM 0 HA3 GLY A 76 76.397 -21.662 -4.392 1.00 1.00 H new ATOM 1144 N ILE A 77 76.466 -20.807 -7.286 1.00 1.00 N ATOM 1145 CA ILE A 77 77.221 -20.564 -8.526 1.00 1.00 C ATOM 1146 C ILE A 77 77.201 -19.065 -8.851 1.00 1.00 C ATOM 1147 O ILE A 77 78.179 -18.485 -9.255 1.00 1.00 O ATOM 1148 CB ILE A 77 76.616 -21.381 -9.680 1.00 1.00 C ATOM 1149 CG1 ILE A 77 75.107 -21.107 -9.778 1.00 1.00 C ATOM 1150 CG2 ILE A 77 76.842 -22.871 -9.425 1.00 1.00 C ATOM 1151 CD1 ILE A 77 74.471 -22.051 -10.803 1.00 1.00 C ATOM 0 H ILE A 77 75.573 -21.280 -7.425 1.00 1.00 H new ATOM 0 HA ILE A 77 78.255 -20.880 -8.391 1.00 1.00 H new ATOM 0 HB ILE A 77 77.098 -21.091 -10.614 1.00 1.00 H new ATOM 0 HG12 ILE A 77 74.639 -21.246 -8.803 1.00 1.00 H new ATOM 0 HG13 ILE A 77 74.935 -20.071 -10.069 1.00 1.00 H new ATOM 0 HG21 ILE A 77 76.413 -23.449 -10.243 1.00 1.00 H new ATOM 0 HG22 ILE A 77 77.912 -23.071 -9.361 1.00 1.00 H new ATOM 0 HG23 ILE A 77 76.363 -23.157 -8.489 1.00 1.00 H new ATOM 0 HD11 ILE A 77 73.401 -21.851 -10.867 1.00 1.00 H new ATOM 0 HD12 ILE A 77 74.929 -21.891 -11.779 1.00 1.00 H new ATOM 0 HD13 ILE A 77 74.629 -23.084 -10.493 1.00 1.00 H new ATOM 1163 N VAL A 78 76.009 -18.527 -8.725 1.00 1.00 N ATOM 1164 CA VAL A 78 75.771 -17.122 -9.065 1.00 1.00 C ATOM 1165 C VAL A 78 77.050 -16.327 -8.675 1.00 1.00 C ATOM 1166 O VAL A 78 77.424 -15.366 -9.344 1.00 1.00 O ATOM 1167 CB VAL A 78 74.576 -16.531 -8.327 1.00 1.00 C ATOM 1168 CG1 VAL A 78 73.295 -17.261 -8.749 1.00 1.00 C ATOM 1169 CG2 VAL A 78 74.798 -16.641 -6.801 1.00 1.00 C ATOM 0 H VAL A 78 75.186 -19.029 -8.392 1.00 1.00 H new ATOM 0 HA VAL A 78 75.550 -17.056 -10.130 1.00 1.00 H new ATOM 0 HB VAL A 78 74.472 -15.477 -8.584 1.00 1.00 H new ATOM 0 HG11 VAL A 78 72.443 -16.836 -8.219 1.00 1.00 H new ATOM 0 HG12 VAL A 78 73.148 -17.147 -9.823 1.00 1.00 H new ATOM 0 HG13 VAL A 78 73.382 -18.320 -8.505 1.00 1.00 H new ATOM 0 HG21 VAL A 78 73.941 -16.217 -6.277 1.00 1.00 H new ATOM 0 HG22 VAL A 78 74.910 -17.689 -6.524 1.00 1.00 H new ATOM 0 HG23 VAL A 78 75.699 -16.094 -6.524 1.00 1.00 H new ATOM 1179 N ILE A 79 77.737 -16.786 -7.598 1.00 1.00 N ATOM 1180 CA ILE A 79 79.009 -16.156 -7.144 1.00 1.00 C ATOM 1181 C ILE A 79 80.249 -16.855 -7.771 1.00 1.00 C ATOM 1182 O ILE A 79 81.305 -16.247 -7.959 1.00 1.00 O ATOM 1183 CB ILE A 79 79.119 -16.210 -5.589 1.00 1.00 C ATOM 1184 CG1 ILE A 79 79.640 -17.597 -5.105 1.00 1.00 C ATOM 1185 CG2 ILE A 79 77.739 -15.967 -4.962 1.00 1.00 C ATOM 1186 CD1 ILE A 79 81.154 -17.588 -4.881 1.00 1.00 C ATOM 0 H ILE A 79 77.438 -17.580 -7.032 1.00 1.00 H new ATOM 0 HA ILE A 79 78.993 -15.118 -7.475 1.00 1.00 H new ATOM 0 HB ILE A 79 79.823 -15.437 -5.281 1.00 1.00 H new ATOM 0 HG12 ILE A 79 79.137 -17.871 -4.178 1.00 1.00 H new ATOM 0 HG13 ILE A 79 79.386 -18.358 -5.842 1.00 1.00 H new ATOM 0 HG21 ILE A 79 77.821 -16.006 -3.876 1.00 1.00 H new ATOM 0 HG22 ILE A 79 77.370 -14.987 -5.263 1.00 1.00 H new ATOM 0 HG23 ILE A 79 77.045 -16.736 -5.301 1.00 1.00 H new ATOM 0 HD11 ILE A 79 81.478 -18.573 -4.544 1.00 1.00 H new ATOM 0 HD12 ILE A 79 81.658 -17.340 -5.815 1.00 1.00 H new ATOM 0 HD13 ILE A 79 81.405 -16.845 -4.124 1.00 1.00 H new ATOM 1198 N ALA A 80 80.082 -18.134 -8.102 1.00 1.00 N ATOM 1199 CA ALA A 80 81.132 -18.954 -8.726 1.00 1.00 C ATOM 1200 C ALA A 80 81.155 -18.850 -10.272 1.00 1.00 C ATOM 1201 O ALA A 80 82.161 -19.182 -10.901 1.00 1.00 O ATOM 1202 CB ALA A 80 80.951 -20.419 -8.289 1.00 1.00 C ATOM 0 H ALA A 80 79.210 -18.639 -7.946 1.00 1.00 H new ATOM 0 HA ALA A 80 82.093 -18.569 -8.385 1.00 1.00 H new ATOM 0 HB1 ALA A 80 81.726 -21.034 -8.747 1.00 1.00 H new ATOM 0 HB2 ALA A 80 81.028 -20.487 -7.204 1.00 1.00 H new ATOM 0 HB3 ALA A 80 79.971 -20.775 -8.606 1.00 1.00 H new ATOM 1208 N GLU A 81 80.045 -18.385 -10.862 1.00 1.00 N ATOM 1209 CA GLU A 81 79.926 -18.237 -12.300 1.00 1.00 C ATOM 1210 C GLU A 81 80.559 -16.931 -12.746 1.00 1.00 C ATOM 1211 O GLU A 81 81.619 -16.940 -13.373 1.00 1.00 O ATOM 1212 CB GLU A 81 78.421 -18.230 -12.649 1.00 1.00 C ATOM 1213 CG GLU A 81 77.963 -19.626 -13.080 1.00 1.00 C ATOM 1214 CD GLU A 81 78.432 -19.895 -14.504 1.00 1.00 C ATOM 1215 OE1 GLU A 81 78.223 -19.036 -15.346 1.00 1.00 O ATOM 1216 OE2 GLU A 81 78.997 -20.952 -14.731 1.00 1.00 O ATOM 0 H GLU A 81 79.211 -18.104 -10.347 1.00 1.00 H new ATOM 0 HA GLU A 81 80.436 -19.056 -12.807 1.00 1.00 H new ATOM 0 HB2 GLU A 81 77.843 -17.902 -11.785 1.00 1.00 H new ATOM 0 HB3 GLU A 81 78.231 -17.515 -13.450 1.00 1.00 H new ATOM 0 HG2 GLU A 81 78.368 -20.379 -12.404 1.00 1.00 H new ATOM 0 HG3 GLU A 81 76.877 -19.698 -13.023 1.00 1.00 H new ATOM 1223 N ASP A 82 79.920 -15.801 -12.443 1.00 1.00 N ATOM 1224 CA ASP A 82 80.455 -14.522 -12.846 1.00 1.00 C ATOM 1225 C ASP A 82 81.749 -14.245 -12.121 1.00 1.00 C ATOM 1226 O ASP A 82 82.512 -13.387 -12.565 1.00 1.00 O ATOM 1227 CB ASP A 82 79.447 -13.405 -12.570 1.00 1.00 C ATOM 1228 CG ASP A 82 78.230 -13.571 -13.478 1.00 1.00 C ATOM 1229 OD1 ASP A 82 78.359 -14.221 -14.501 1.00 1.00 O ATOM 1230 OD2 ASP A 82 77.183 -13.042 -13.134 1.00 1.00 O ATOM 0 H ASP A 82 79.042 -15.755 -11.926 1.00 1.00 H new ATOM 0 HA ASP A 82 80.651 -14.554 -13.918 1.00 1.00 H new ATOM 0 HB2 ASP A 82 79.139 -13.431 -11.525 1.00 1.00 H new ATOM 0 HB3 ASP A 82 79.911 -12.434 -12.742 1.00 1.00 H new ATOM 1235 N ALA A 83 82.011 -14.988 -11.019 1.00 1.00 N ATOM 1236 CA ALA A 83 83.256 -14.841 -10.253 1.00 1.00 C ATOM 1237 C ALA A 83 84.343 -14.068 -11.015 1.00 1.00 C ATOM 1238 O ALA A 83 84.939 -13.157 -10.440 1.00 1.00 O ATOM 1239 CB ALA A 83 83.776 -16.244 -9.839 1.00 1.00 C ATOM 0 H ALA A 83 81.373 -15.692 -10.647 1.00 1.00 H new ATOM 0 HA ALA A 83 83.026 -14.250 -9.367 1.00 1.00 H new ATOM 0 HB1 ALA A 83 84.700 -16.136 -9.271 1.00 1.00 H new ATOM 0 HB2 ALA A 83 83.027 -16.743 -9.224 1.00 1.00 H new ATOM 0 HB3 ALA A 83 83.967 -16.839 -10.732 1.00 1.00 H new ATOM 1245 N LEU A 84 84.639 -14.443 -12.283 1.00 1.00 N ATOM 1246 CA LEU A 84 85.708 -13.804 -13.069 1.00 1.00 C ATOM 1247 C LEU A 84 85.968 -12.361 -12.659 1.00 1.00 C ATOM 1248 O LEU A 84 87.118 -11.998 -12.408 1.00 1.00 O ATOM 1249 CB LEU A 84 85.243 -13.826 -14.554 1.00 1.00 C ATOM 1250 CG LEU A 84 86.426 -13.993 -15.530 1.00 1.00 C ATOM 1251 CD1 LEU A 84 87.494 -12.929 -15.251 1.00 1.00 C ATOM 1252 CD2 LEU A 84 87.041 -15.406 -15.409 1.00 1.00 C ATOM 0 H LEU A 84 84.148 -15.187 -12.779 1.00 1.00 H new ATOM 0 HA LEU A 84 86.638 -14.348 -12.904 1.00 1.00 H new ATOM 0 HB2 LEU A 84 84.535 -14.642 -14.700 1.00 1.00 H new ATOM 0 HB3 LEU A 84 84.714 -12.901 -14.781 1.00 1.00 H new ATOM 0 HG LEU A 84 86.053 -13.866 -16.546 1.00 1.00 H new ATOM 0 HD11 LEU A 84 88.324 -13.056 -15.946 1.00 1.00 H new ATOM 0 HD12 LEU A 84 87.062 -11.937 -15.380 1.00 1.00 H new ATOM 0 HD13 LEU A 84 87.856 -13.037 -14.229 1.00 1.00 H new ATOM 0 HD21 LEU A 84 87.873 -15.501 -16.106 1.00 1.00 H new ATOM 0 HD22 LEU A 84 87.400 -15.561 -14.392 1.00 1.00 H new ATOM 0 HD23 LEU A 84 86.284 -16.154 -15.644 1.00 1.00 H new ATOM 1264 N ILE A 85 84.938 -11.538 -12.581 1.00 1.00 N ATOM 1265 CA ILE A 85 85.130 -10.158 -12.179 1.00 1.00 C ATOM 1266 C ILE A 85 85.113 -10.062 -10.660 1.00 1.00 C ATOM 1267 O ILE A 85 85.868 -9.292 -10.079 1.00 1.00 O ATOM 1268 CB ILE A 85 84.026 -9.287 -12.783 1.00 1.00 C ATOM 1269 CG1 ILE A 85 82.663 -9.918 -12.486 1.00 1.00 C ATOM 1270 CG2 ILE A 85 84.223 -9.189 -14.298 1.00 1.00 C ATOM 1271 CD1 ILE A 85 81.555 -8.995 -12.979 1.00 1.00 C ATOM 0 H ILE A 85 83.973 -11.797 -12.788 1.00 1.00 H new ATOM 0 HA ILE A 85 86.094 -9.802 -12.542 1.00 1.00 H new ATOM 0 HB ILE A 85 84.070 -8.289 -12.347 1.00 1.00 H new ATOM 0 HG12 ILE A 85 82.586 -10.889 -12.975 1.00 1.00 H new ATOM 0 HG13 ILE A 85 82.557 -10.091 -11.415 1.00 1.00 H new ATOM 0 HG21 ILE A 85 83.437 -8.569 -14.728 1.00 1.00 H new ATOM 0 HG22 ILE A 85 85.194 -8.742 -14.510 1.00 1.00 H new ATOM 0 HG23 ILE A 85 84.179 -10.186 -14.736 1.00 1.00 H new ATOM 0 HD11 ILE A 85 80.585 -9.445 -12.767 1.00 1.00 H new ATOM 0 HD12 ILE A 85 81.628 -8.034 -12.469 1.00 1.00 H new ATOM 0 HD13 ILE A 85 81.658 -8.845 -14.054 1.00 1.00 H new ATOM 1283 N ALA A 86 84.248 -10.849 -10.014 1.00 1.00 N ATOM 1284 CA ALA A 86 84.159 -10.807 -8.558 1.00 1.00 C ATOM 1285 C ALA A 86 85.545 -10.868 -7.943 1.00 1.00 C ATOM 1286 O ALA A 86 85.889 -9.997 -7.153 1.00 1.00 O ATOM 1287 CB ALA A 86 83.279 -11.935 -8.015 1.00 1.00 C ATOM 0 H ALA A 86 83.614 -11.508 -10.466 1.00 1.00 H new ATOM 0 HA ALA A 86 83.691 -9.863 -8.280 1.00 1.00 H new ATOM 0 HB1 ALA A 86 83.236 -11.872 -6.928 1.00 1.00 H new ATOM 0 HB2 ALA A 86 82.273 -11.841 -8.424 1.00 1.00 H new ATOM 0 HB3 ALA A 86 83.700 -12.897 -8.306 1.00 1.00 H new ATOM 1293 N GLU A 87 86.337 -11.892 -8.289 1.00 1.00 N ATOM 1294 CA GLU A 87 87.691 -12.035 -7.738 1.00 1.00 C ATOM 1295 C GLU A 87 88.384 -10.668 -7.602 1.00 1.00 C ATOM 1296 O GLU A 87 89.374 -10.538 -6.875 1.00 1.00 O ATOM 1297 CB GLU A 87 88.510 -12.981 -8.668 1.00 1.00 C ATOM 1298 CG GLU A 87 89.168 -14.150 -7.877 1.00 1.00 C ATOM 1299 CD GLU A 87 89.158 -15.431 -8.709 1.00 1.00 C ATOM 1300 OE1 GLU A 87 88.086 -15.986 -8.885 1.00 1.00 O ATOM 1301 OE2 GLU A 87 90.219 -15.843 -9.144 1.00 1.00 O ATOM 0 H GLU A 87 86.067 -12.627 -8.942 1.00 1.00 H new ATOM 0 HA GLU A 87 87.630 -12.464 -6.738 1.00 1.00 H new ATOM 0 HB2 GLU A 87 87.855 -13.388 -9.439 1.00 1.00 H new ATOM 0 HB3 GLU A 87 89.284 -12.407 -9.178 1.00 1.00 H new ATOM 0 HG2 GLU A 87 90.193 -13.888 -7.615 1.00 1.00 H new ATOM 0 HG3 GLU A 87 88.631 -14.312 -6.942 1.00 1.00 H new ATOM 1308 N ALA A 88 87.829 -9.643 -8.255 1.00 1.00 N ATOM 1309 CA ALA A 88 88.366 -8.301 -8.147 1.00 1.00 C ATOM 1310 C ALA A 88 88.437 -7.915 -6.666 1.00 1.00 C ATOM 1311 O ALA A 88 88.886 -6.835 -6.326 1.00 1.00 O ATOM 1312 CB ALA A 88 87.503 -7.309 -8.942 1.00 1.00 C ATOM 0 H ALA A 88 87.012 -9.725 -8.859 1.00 1.00 H new ATOM 0 HA ALA A 88 89.369 -8.269 -8.571 1.00 1.00 H new ATOM 0 HB1 ALA A 88 87.922 -6.307 -8.849 1.00 1.00 H new ATOM 0 HB2 ALA A 88 87.488 -7.600 -9.992 1.00 1.00 H new ATOM 0 HB3 ALA A 88 86.486 -7.315 -8.549 1.00 1.00 H new ATOM 1318 N VAL A 89 87.913 -8.792 -5.797 1.00 1.00 N ATOM 1319 CA VAL A 89 87.876 -8.506 -4.351 1.00 1.00 C ATOM 1320 C VAL A 89 89.109 -7.668 -3.924 1.00 1.00 C ATOM 1321 O VAL A 89 89.045 -6.878 -2.986 1.00 1.00 O ATOM 1322 CB VAL A 89 87.866 -9.818 -3.532 1.00 1.00 C ATOM 1323 CG1 VAL A 89 86.812 -10.767 -4.106 1.00 1.00 C ATOM 1324 CG2 VAL A 89 89.258 -10.496 -3.551 1.00 1.00 C ATOM 0 H VAL A 89 87.514 -9.693 -6.062 1.00 1.00 H new ATOM 0 HA VAL A 89 86.964 -7.943 -4.154 1.00 1.00 H new ATOM 0 HB VAL A 89 87.621 -9.581 -2.497 1.00 1.00 H new ATOM 0 HG11 VAL A 89 86.803 -11.692 -3.530 1.00 1.00 H new ATOM 0 HG12 VAL A 89 85.830 -10.296 -4.051 1.00 1.00 H new ATOM 0 HG13 VAL A 89 87.050 -10.989 -5.146 1.00 1.00 H new ATOM 0 HG21 VAL A 89 89.223 -11.416 -2.968 1.00 1.00 H new ATOM 0 HG22 VAL A 89 89.535 -10.729 -4.579 1.00 1.00 H new ATOM 0 HG23 VAL A 89 89.997 -9.821 -3.120 1.00 1.00 H new ATOM 1334 N GLY A 90 90.235 -7.863 -4.597 1.00 1.00 N ATOM 1335 CA GLY A 90 91.449 -7.121 -4.225 1.00 1.00 C ATOM 1336 C GLY A 90 91.160 -5.605 -4.090 1.00 1.00 C ATOM 1337 O GLY A 90 91.025 -5.106 -2.968 1.00 1.00 O ATOM 0 H GLY A 90 90.342 -8.507 -5.381 1.00 1.00 H new ATOM 0 HA2 GLY A 90 91.838 -7.505 -3.282 1.00 1.00 H new ATOM 0 HA3 GLY A 90 92.221 -7.281 -4.978 1.00 1.00 H new ATOM 1341 N PRO A 91 91.001 -4.879 -5.178 1.00 1.00 N ATOM 1342 CA PRO A 91 90.646 -3.418 -5.142 1.00 1.00 C ATOM 1343 C PRO A 91 89.417 -3.169 -4.271 1.00 1.00 C ATOM 1344 O PRO A 91 89.228 -2.072 -3.743 1.00 1.00 O ATOM 1345 CB PRO A 91 90.347 -3.066 -6.622 1.00 1.00 C ATOM 1346 CG PRO A 91 90.276 -4.388 -7.333 1.00 1.00 C ATOM 1347 CD PRO A 91 91.186 -5.328 -6.556 1.00 1.00 C ATOM 0 HA PRO A 91 91.443 -2.810 -4.715 1.00 1.00 H new ATOM 0 HB2 PRO A 91 89.410 -2.518 -6.715 1.00 1.00 H new ATOM 0 HB3 PRO A 91 91.129 -2.434 -7.043 1.00 1.00 H new ATOM 0 HG2 PRO A 91 89.253 -4.765 -7.356 1.00 1.00 H new ATOM 0 HG3 PRO A 91 90.604 -4.293 -8.368 1.00 1.00 H new ATOM 0 HD2 PRO A 91 90.897 -6.371 -6.685 1.00 1.00 H new ATOM 0 HD3 PRO A 91 92.225 -5.243 -6.875 1.00 1.00 H new ATOM 1355 N HIS A 92 88.540 -4.168 -4.190 1.00 1.00 N ATOM 1356 CA HIS A 92 87.306 -3.962 -3.435 1.00 1.00 C ATOM 1357 C HIS A 92 87.696 -3.494 -2.049 1.00 1.00 C ATOM 1358 O HIS A 92 86.887 -2.874 -1.359 1.00 1.00 O ATOM 1359 CB HIS A 92 86.408 -5.205 -3.319 1.00 1.00 C ATOM 1360 CG HIS A 92 85.545 -5.345 -4.542 1.00 1.00 C ATOM 1361 ND1 HIS A 92 85.918 -6.117 -5.628 1.00 1.00 N ATOM 1362 CD2 HIS A 92 84.331 -4.799 -4.869 1.00 1.00 C ATOM 1363 CE1 HIS A 92 84.945 -6.010 -6.547 1.00 1.00 C ATOM 1364 NE2 HIS A 92 83.959 -5.218 -6.137 1.00 1.00 N ATOM 0 H HIS A 92 88.651 -5.088 -4.616 1.00 1.00 H new ATOM 0 HA HIS A 92 86.712 -3.228 -3.979 1.00 1.00 H new ATOM 0 HB2 HIS A 92 87.024 -6.096 -3.197 1.00 1.00 H new ATOM 0 HB3 HIS A 92 85.781 -5.127 -2.431 1.00 1.00 H new ATOM 0 HD1 HIS A 92 86.774 -6.666 -5.714 1.00 1.00 H new ATOM 0 HD2 HIS A 92 83.753 -4.143 -4.236 1.00 1.00 H new ATOM 0 HE1 HIS A 92 84.961 -6.508 -7.505 1.00 1.00 H new ATOM 1372 N LEU A 93 88.957 -3.739 -1.652 1.00 1.00 N ATOM 1373 CA LEU A 93 89.423 -3.259 -0.365 1.00 1.00 C ATOM 1374 C LEU A 93 89.217 -1.752 -0.363 1.00 1.00 C ATOM 1375 O LEU A 93 88.657 -1.189 0.569 1.00 1.00 O ATOM 1376 CB LEU A 93 90.917 -3.589 -0.206 1.00 1.00 C ATOM 1377 CG LEU A 93 91.538 -2.895 1.029 1.00 1.00 C ATOM 1378 CD1 LEU A 93 91.087 -3.578 2.326 1.00 1.00 C ATOM 1379 CD2 LEU A 93 93.057 -2.987 0.926 1.00 1.00 C ATOM 0 H LEU A 93 89.648 -4.255 -2.197 1.00 1.00 H new ATOM 0 HA LEU A 93 88.882 -3.727 0.458 1.00 1.00 H new ATOM 0 HB2 LEU A 93 91.042 -4.668 -0.116 1.00 1.00 H new ATOM 0 HB3 LEU A 93 91.454 -3.280 -1.103 1.00 1.00 H new ATOM 0 HG LEU A 93 91.211 -1.855 1.051 1.00 1.00 H new ATOM 0 HD11 LEU A 93 91.537 -3.071 3.180 1.00 1.00 H new ATOM 0 HD12 LEU A 93 90.001 -3.527 2.405 1.00 1.00 H new ATOM 0 HD13 LEU A 93 91.402 -4.622 2.316 1.00 1.00 H new ATOM 0 HD21 LEU A 93 93.510 -2.502 1.790 1.00 1.00 H new ATOM 0 HD22 LEU A 93 93.357 -4.035 0.899 1.00 1.00 H new ATOM 0 HD23 LEU A 93 93.391 -2.491 0.015 1.00 1.00 H new ATOM 1391 N ALA A 94 89.691 -1.093 -1.426 1.00 1.00 N ATOM 1392 CA ALA A 94 89.544 0.354 -1.489 1.00 1.00 C ATOM 1393 C ALA A 94 88.092 0.658 -1.171 1.00 1.00 C ATOM 1394 O ALA A 94 87.796 1.441 -0.277 1.00 1.00 O ATOM 1395 CB ALA A 94 89.879 0.884 -2.882 1.00 1.00 C ATOM 0 H ALA A 94 90.161 -1.523 -2.223 1.00 1.00 H new ATOM 0 HA ALA A 94 90.225 0.832 -0.784 1.00 1.00 H new ATOM 0 HB1 ALA A 94 89.760 1.967 -2.897 1.00 1.00 H new ATOM 0 HB2 ALA A 94 90.909 0.629 -3.130 1.00 1.00 H new ATOM 0 HB3 ALA A 94 89.207 0.435 -3.613 1.00 1.00 H new ATOM 1401 N ARG A 95 87.189 0.004 -1.871 1.00 1.00 N ATOM 1402 CA ARG A 95 85.785 0.189 -1.590 1.00 1.00 C ATOM 1403 C ARG A 95 85.514 -0.246 -0.150 1.00 1.00 C ATOM 1404 O ARG A 95 84.629 0.302 0.503 1.00 1.00 O ATOM 1405 CB ARG A 95 84.928 -0.668 -2.527 1.00 1.00 C ATOM 1406 CG ARG A 95 85.367 -0.474 -3.981 1.00 1.00 C ATOM 1407 CD ARG A 95 84.870 0.876 -4.538 1.00 1.00 C ATOM 1408 NE ARG A 95 85.942 1.519 -5.286 1.00 1.00 N ATOM 1409 CZ ARG A 95 85.684 2.474 -6.165 1.00 1.00 C ATOM 1410 NH1 ARG A 95 84.449 2.837 -6.376 1.00 1.00 N ATOM 1411 NH2 ARG A 95 86.657 3.046 -6.821 1.00 1.00 N ATOM 0 H ARG A 95 87.398 -0.649 -2.626 1.00 1.00 H new ATOM 0 HA ARG A 95 85.530 1.239 -1.737 1.00 1.00 H new ATOM 0 HB2 ARG A 95 85.016 -1.719 -2.251 1.00 1.00 H new ATOM 0 HB3 ARG A 95 83.878 -0.397 -2.419 1.00 1.00 H new ATOM 0 HG2 ARG A 95 86.454 -0.519 -4.044 1.00 1.00 H new ATOM 0 HG3 ARG A 95 84.978 -1.288 -4.593 1.00 1.00 H new ATOM 0 HD2 ARG A 95 84.006 0.719 -5.183 1.00 1.00 H new ATOM 0 HD3 ARG A 95 84.545 1.521 -3.721 1.00 1.00 H new ATOM 0 HE ARG A 95 86.907 1.228 -5.130 1.00 1.00 H new ATOM 0 HH11 ARG A 95 83.690 2.386 -5.865 1.00 1.00 H new ATOM 0 HH12 ARG A 95 84.242 3.572 -7.052 1.00 1.00 H new ATOM 0 HH21 ARG A 95 87.621 2.757 -6.657 1.00 1.00 H new ATOM 0 HH22 ARG A 95 86.453 3.782 -7.497 1.00 1.00 H new ATOM 1425 N ALA A 96 86.269 -1.252 0.345 1.00 1.00 N ATOM 1426 CA ALA A 96 86.020 -1.717 1.728 1.00 1.00 C ATOM 1427 C ALA A 96 86.139 -0.535 2.640 1.00 1.00 C ATOM 1428 O ALA A 96 85.284 -0.308 3.450 1.00 1.00 O ATOM 1429 CB ALA A 96 86.948 -2.828 2.221 1.00 1.00 C ATOM 0 H ALA A 96 87.014 -1.734 -0.158 1.00 1.00 H new ATOM 0 HA ALA A 96 85.023 -2.157 1.732 1.00 1.00 H new ATOM 0 HB1 ALA A 96 86.683 -3.096 3.244 1.00 1.00 H new ATOM 0 HB2 ALA A 96 86.843 -3.702 1.578 1.00 1.00 H new ATOM 0 HB3 ALA A 96 87.980 -2.479 2.194 1.00 1.00 H new ATOM 1435 N LEU A 97 87.242 0.167 2.503 1.00 1.00 N ATOM 1436 CA LEU A 97 87.524 1.349 3.362 1.00 1.00 C ATOM 1437 C LEU A 97 86.138 2.058 3.672 1.00 1.00 C ATOM 1438 O LEU A 97 85.912 2.627 4.760 1.00 1.00 O ATOM 1439 CB LEU A 97 88.456 2.301 2.571 1.00 1.00 C ATOM 1440 CG LEU A 97 89.676 2.757 3.394 1.00 1.00 C ATOM 1441 CD1 LEU A 97 89.230 3.582 4.612 1.00 1.00 C ATOM 1442 CD2 LEU A 97 90.522 1.546 3.862 1.00 1.00 C ATOM 0 H LEU A 97 87.968 -0.039 1.817 1.00 1.00 H new ATOM 0 HA LEU A 97 88.008 1.069 4.298 1.00 1.00 H new ATOM 0 HB2 LEU A 97 88.800 1.798 1.667 1.00 1.00 H new ATOM 0 HB3 LEU A 97 87.890 3.176 2.253 1.00 1.00 H new ATOM 0 HG LEU A 97 90.294 3.381 2.748 1.00 1.00 H new ATOM 0 HD11 LEU A 97 90.106 3.895 5.180 1.00 1.00 H new ATOM 0 HD12 LEU A 97 88.683 4.462 4.275 1.00 1.00 H new ATOM 0 HD13 LEU A 97 88.584 2.975 5.246 1.00 1.00 H new ATOM 0 HD21 LEU A 97 91.376 1.900 4.440 1.00 1.00 H new ATOM 0 HD22 LEU A 97 89.909 0.892 4.483 1.00 1.00 H new ATOM 0 HD23 LEU A 97 90.877 0.993 2.993 1.00 1.00 H new ATOM 1454 N GLY A 98 85.178 1.857 2.744 1.00 1.00 N ATOM 1455 CA GLY A 98 83.787 2.330 2.928 1.00 1.00 C ATOM 1456 C GLY A 98 82.954 1.283 3.702 1.00 1.00 C ATOM 1457 O GLY A 98 82.341 1.525 4.768 1.00 1.00 O ATOM 0 H GLY A 98 85.339 1.372 1.861 1.00 1.00 H new ATOM 0 HA2 GLY A 98 83.787 3.275 3.470 1.00 1.00 H new ATOM 0 HA3 GLY A 98 83.330 2.520 1.957 1.00 1.00 H new ATOM 1461 N GLN A 99 82.994 0.067 3.187 1.00 1.00 N ATOM 1462 CA GLN A 99 82.339 -1.034 3.795 1.00 1.00 C ATOM 1463 C GLN A 99 83.178 -1.478 4.979 1.00 1.00 C ATOM 1464 O GLN A 99 82.906 -2.509 5.593 1.00 1.00 O ATOM 1465 CB GLN A 99 82.105 -2.160 2.785 1.00 1.00 C ATOM 1466 CG GLN A 99 81.127 -3.169 3.372 1.00 1.00 C ATOM 1467 CD GLN A 99 80.547 -4.041 2.271 1.00 1.00 C ATOM 1468 OE1 GLN A 99 79.686 -3.589 1.520 1.00 1.00 O ATOM 1469 NE2 GLN A 99 80.969 -5.266 2.123 1.00 1.00 N ATOM 0 H GLN A 99 83.491 -0.166 2.327 1.00 1.00 H new ATOM 0 HA GLN A 99 81.349 -0.745 4.149 1.00 1.00 H new ATOM 0 HB2 GLN A 99 81.710 -1.753 1.854 1.00 1.00 H new ATOM 0 HB3 GLN A 99 83.049 -2.649 2.544 1.00 1.00 H new ATOM 0 HG2 GLN A 99 81.634 -3.791 4.109 1.00 1.00 H new ATOM 0 HG3 GLN A 99 80.324 -2.647 3.893 1.00 1.00 H new ATOM 0 HE21 GLN A 99 81.684 -5.638 2.748 1.00 1.00 H new ATOM 0 HE22 GLN A 99 80.584 -5.852 1.382 1.00 1.00 H new ATOM 1478 N ILE A 100 84.222 -0.691 5.302 1.00 1.00 N ATOM 1479 CA ILE A 100 85.095 -0.999 6.408 1.00 1.00 C ATOM 1480 C ILE A 100 84.302 -0.974 7.659 1.00 1.00 C ATOM 1481 O ILE A 100 84.384 -1.882 8.454 1.00 1.00 O ATOM 1482 CB ILE A 100 86.229 0.041 6.507 1.00 1.00 C ATOM 1483 CG1 ILE A 100 87.423 -0.576 7.239 1.00 1.00 C ATOM 1484 CG2 ILE A 100 85.800 1.320 7.256 1.00 1.00 C ATOM 1485 CD1 ILE A 100 88.125 -1.618 6.353 1.00 1.00 C ATOM 0 H ILE A 100 84.467 0.162 4.799 1.00 1.00 H new ATOM 0 HA ILE A 100 85.536 -1.984 6.254 1.00 1.00 H new ATOM 0 HB ILE A 100 86.493 0.323 5.488 1.00 1.00 H new ATOM 0 HG12 ILE A 100 88.129 0.206 7.517 1.00 1.00 H new ATOM 0 HG13 ILE A 100 87.086 -1.045 8.163 1.00 1.00 H new ATOM 0 HG21 ILE A 100 86.637 2.017 7.296 1.00 1.00 H new ATOM 0 HG22 ILE A 100 84.965 1.786 6.732 1.00 1.00 H new ATOM 0 HG23 ILE A 100 85.494 1.063 8.270 1.00 1.00 H new ATOM 0 HD11 ILE A 100 88.971 -2.044 6.893 1.00 1.00 H new ATOM 0 HD12 ILE A 100 87.422 -2.410 6.096 1.00 1.00 H new ATOM 0 HD13 ILE A 100 88.481 -1.139 5.441 1.00 1.00 H new ATOM 1497 N VAL A 101 83.510 0.066 7.854 1.00 1.00 N ATOM 1498 CA VAL A 101 82.714 0.082 9.075 1.00 1.00 C ATOM 1499 C VAL A 101 81.925 -1.225 9.152 1.00 1.00 C ATOM 1500 O VAL A 101 82.025 -1.970 10.123 1.00 1.00 O ATOM 1501 CB VAL A 101 81.743 1.274 9.090 1.00 1.00 C ATOM 1502 CG1 VAL A 101 80.731 1.088 10.228 1.00 1.00 C ATOM 1503 CG2 VAL A 101 82.534 2.560 9.326 1.00 1.00 C ATOM 0 H VAL A 101 83.400 0.865 7.229 1.00 1.00 H new ATOM 0 HA VAL A 101 83.378 0.182 9.933 1.00 1.00 H new ATOM 0 HB VAL A 101 81.217 1.333 8.137 1.00 1.00 H new ATOM 0 HG11 VAL A 101 80.040 1.931 10.242 1.00 1.00 H new ATOM 0 HG12 VAL A 101 80.173 0.165 10.072 1.00 1.00 H new ATOM 0 HG13 VAL A 101 81.259 1.036 11.180 1.00 1.00 H new ATOM 0 HG21 VAL A 101 81.852 3.410 9.338 1.00 1.00 H new ATOM 0 HG22 VAL A 101 83.053 2.498 10.283 1.00 1.00 H new ATOM 0 HG23 VAL A 101 83.263 2.691 8.526 1.00 1.00 H new ATOM 1513 N CYS A 102 81.090 -1.455 8.151 1.00 1.00 N ATOM 1514 CA CYS A 102 80.236 -2.649 8.172 1.00 1.00 C ATOM 1515 C CYS A 102 81.069 -3.928 8.411 1.00 1.00 C ATOM 1516 O CYS A 102 80.615 -4.844 9.077 1.00 1.00 O ATOM 1517 CB CYS A 102 79.404 -2.719 6.853 1.00 1.00 C ATOM 1518 SG CYS A 102 79.817 -4.194 5.877 1.00 1.00 S ATOM 0 H CYS A 102 80.980 -0.855 7.333 1.00 1.00 H new ATOM 0 HA CYS A 102 79.539 -2.579 9.007 1.00 1.00 H new ATOM 0 HB2 CYS A 102 78.341 -2.727 7.093 1.00 1.00 H new ATOM 0 HB3 CYS A 102 79.589 -1.825 6.258 1.00 1.00 H new ATOM 0 HG CYS A 102 79.213 -4.137 4.727 1.00 1.00 H new ATOM 1523 N ARG A 103 82.310 -3.914 7.925 1.00 1.00 N ATOM 1524 CA ARG A 103 83.267 -5.050 8.087 1.00 1.00 C ATOM 1525 C ARG A 103 83.978 -5.045 9.443 1.00 1.00 C ATOM 1526 O ARG A 103 84.044 -6.044 10.152 1.00 1.00 O ATOM 1527 CB ARG A 103 84.300 -4.974 6.945 1.00 1.00 C ATOM 1528 CG ARG A 103 85.147 -6.274 6.850 1.00 1.00 C ATOM 1529 CD ARG A 103 85.402 -6.654 5.375 1.00 1.00 C ATOM 1530 NE ARG A 103 86.430 -5.808 4.769 1.00 1.00 N ATOM 1531 CZ ARG A 103 86.893 -6.075 3.547 1.00 1.00 C ATOM 1532 NH1 ARG A 103 86.367 -7.052 2.858 1.00 1.00 N ATOM 1533 NH2 ARG A 103 87.856 -5.359 3.030 1.00 1.00 N ATOM 0 H ARG A 103 82.696 -3.125 7.407 1.00 1.00 H new ATOM 0 HA ARG A 103 82.701 -5.981 8.045 1.00 1.00 H new ATOM 0 HB2 ARG A 103 83.785 -4.805 5.999 1.00 1.00 H new ATOM 0 HB3 ARG A 103 84.959 -4.121 7.106 1.00 1.00 H new ATOM 0 HG2 ARG A 103 86.098 -6.133 7.364 1.00 1.00 H new ATOM 0 HG3 ARG A 103 84.629 -7.089 7.356 1.00 1.00 H new ATOM 0 HD2 ARG A 103 85.709 -7.698 5.316 1.00 1.00 H new ATOM 0 HD3 ARG A 103 84.475 -6.562 4.810 1.00 1.00 H new ATOM 0 HE ARG A 103 86.796 -5.008 5.285 1.00 1.00 H new ATOM 0 HH11 ARG A 103 85.607 -7.605 3.255 1.00 1.00 H new ATOM 0 HH12 ARG A 103 86.716 -7.262 1.923 1.00 1.00 H new ATOM 0 HH21 ARG A 103 88.260 -4.588 3.562 1.00 1.00 H new ATOM 0 HH22 ARG A 103 88.203 -5.571 2.095 1.00 1.00 H new ATOM 1547 N TYR A 104 84.465 -3.895 9.768 1.00 1.00 N ATOM 1548 CA TYR A 104 85.168 -3.603 11.013 1.00 1.00 C ATOM 1549 C TYR A 104 84.162 -3.106 12.027 1.00 1.00 C ATOM 1550 O TYR A 104 84.525 -2.444 13.001 1.00 1.00 O ATOM 1551 CB TYR A 104 86.301 -2.590 10.854 1.00 1.00 C ATOM 1552 CG TYR A 104 87.094 -2.564 12.146 1.00 1.00 C ATOM 1553 CD1 TYR A 104 87.866 -3.677 12.507 1.00 1.00 C ATOM 1554 CD2 TYR A 104 87.039 -1.450 12.993 1.00 1.00 C ATOM 1555 CE1 TYR A 104 88.579 -3.677 13.713 1.00 1.00 C ATOM 1556 CE2 TYR A 104 87.758 -1.448 14.196 1.00 1.00 C ATOM 1557 CZ TYR A 104 88.525 -2.561 14.557 1.00 1.00 C ATOM 1558 OH TYR A 104 89.220 -2.562 15.751 1.00 1.00 O ATOM 0 H TYR A 104 84.390 -3.082 9.157 1.00 1.00 H new ATOM 0 HA TYR A 104 85.641 -4.526 11.348 1.00 1.00 H new ATOM 0 HB2 TYR A 104 86.944 -2.866 10.018 1.00 1.00 H new ATOM 0 HB3 TYR A 104 85.899 -1.601 10.634 1.00 1.00 H new ATOM 0 HD1 TYR A 104 87.911 -4.536 11.854 1.00 1.00 H new ATOM 0 HD2 TYR A 104 86.442 -0.592 12.719 1.00 1.00 H new ATOM 0 HE1 TYR A 104 89.170 -4.537 13.991 1.00 1.00 H new ATOM 0 HE2 TYR A 104 87.720 -0.586 14.845 1.00 1.00 H new ATOM 0 HH TYR A 104 89.075 -1.711 16.214 1.00 1.00 H new ATOM 1568 N GLY A 105 82.896 -3.454 11.824 1.00 1.00 N ATOM 1569 CA GLY A 105 81.861 -3.056 12.750 1.00 1.00 C ATOM 1570 C GLY A 105 80.637 -3.955 12.596 1.00 1.00 C ATOM 1571 O GLY A 105 80.482 -4.929 13.332 1.00 1.00 O ATOM 0 H GLY A 105 82.571 -4.007 11.031 1.00 1.00 H new ATOM 0 HA2 GLY A 105 82.236 -3.113 13.772 1.00 1.00 H new ATOM 0 HA3 GLY A 105 81.583 -2.018 12.570 1.00 1.00 H new ATOM 1575 N ALA A 106 79.740 -3.601 11.677 1.00 1.00 N ATOM 1576 CA ALA A 106 78.508 -4.366 11.503 1.00 1.00 C ATOM 1577 C ALA A 106 77.750 -4.408 12.830 1.00 1.00 C ATOM 1578 O ALA A 106 78.148 -5.127 13.748 1.00 1.00 O ATOM 1579 CB ALA A 106 78.813 -5.811 11.036 1.00 1.00 C ATOM 0 H ALA A 106 79.841 -2.802 11.051 1.00 1.00 H new ATOM 0 HA ALA A 106 77.901 -3.880 10.739 1.00 1.00 H new ATOM 0 HB1 ALA A 106 77.879 -6.359 10.914 1.00 1.00 H new ATOM 0 HB2 ALA A 106 79.343 -5.781 10.084 1.00 1.00 H new ATOM 0 HB3 ALA A 106 79.432 -6.311 11.781 1.00 1.00 H new ATOM 1585 N THR A 107 76.648 -3.657 12.933 1.00 1.00 N ATOM 1586 CA THR A 107 75.846 -3.648 14.158 1.00 1.00 C ATOM 1587 C THR A 107 74.365 -3.769 13.815 1.00 1.00 C ATOM 1588 O THR A 107 73.721 -4.642 14.339 1.00 1.00 O ATOM 1589 CB THR A 107 76.096 -2.374 14.970 1.00 1.00 C ATOM 1590 OG1 THR A 107 77.497 -2.192 15.162 1.00 1.00 O ATOM 1591 CG2 THR A 107 75.417 -2.506 16.332 1.00 1.00 C ATOM 0 H THR A 107 76.295 -3.054 12.190 1.00 1.00 H new ATOM 0 HA THR A 107 76.144 -4.502 14.766 1.00 1.00 H new ATOM 0 HB THR A 107 75.690 -1.517 14.433 1.00 1.00 H new ATOM 0 HG1 THR A 107 77.653 -1.375 15.681 1.00 1.00 H new ATOM 0 HG21 THR A 107 75.592 -1.602 16.915 1.00 1.00 H new ATOM 0 HG22 THR A 107 74.345 -2.646 16.192 1.00 1.00 H new ATOM 0 HG23 THR A 107 75.829 -3.365 16.862 1.00 1.00 H new ATOM 1599 N VAL A 108 73.825 -2.810 13.055 1.00 1.00 N ATOM 1600 CA VAL A 108 72.404 -2.746 12.720 1.00 1.00 C ATOM 1601 C VAL A 108 72.075 -3.645 11.541 1.00 1.00 C ATOM 1602 O VAL A 108 71.193 -3.337 10.734 1.00 1.00 O ATOM 1603 CB VAL A 108 71.985 -1.297 12.469 1.00 1.00 C ATOM 1604 CG1 VAL A 108 72.751 -0.727 11.273 1.00 1.00 C ATOM 1605 CG2 VAL A 108 70.463 -1.214 12.217 1.00 1.00 C ATOM 0 H VAL A 108 74.372 -2.049 12.652 1.00 1.00 H new ATOM 0 HA VAL A 108 71.829 -3.118 13.568 1.00 1.00 H new ATOM 0 HB VAL A 108 72.224 -0.706 13.353 1.00 1.00 H new ATOM 0 HG11 VAL A 108 72.445 0.305 11.103 1.00 1.00 H new ATOM 0 HG12 VAL A 108 73.821 -0.759 11.478 1.00 1.00 H new ATOM 0 HG13 VAL A 108 72.533 -1.321 10.385 1.00 1.00 H new ATOM 0 HG21 VAL A 108 70.180 -0.176 12.040 1.00 1.00 H new ATOM 0 HG22 VAL A 108 70.205 -1.815 11.345 1.00 1.00 H new ATOM 0 HG23 VAL A 108 69.929 -1.592 13.088 1.00 1.00 H new ATOM 1615 N ILE A 109 72.764 -4.778 11.466 1.00 1.00 N ATOM 1616 CA ILE A 109 72.533 -5.768 10.431 1.00 1.00 C ATOM 1617 C ILE A 109 71.752 -7.007 10.990 1.00 1.00 C ATOM 1618 O ILE A 109 71.149 -7.744 10.211 1.00 1.00 O ATOM 1619 CB ILE A 109 73.904 -6.189 9.845 1.00 1.00 C ATOM 1620 CG1 ILE A 109 74.740 -6.937 10.897 1.00 1.00 C ATOM 1621 CG2 ILE A 109 74.686 -4.935 9.417 1.00 1.00 C ATOM 1622 CD1 ILE A 109 75.915 -7.636 10.217 1.00 1.00 C ATOM 0 H ILE A 109 73.500 -5.033 12.125 1.00 1.00 H new ATOM 0 HA ILE A 109 71.913 -5.337 9.645 1.00 1.00 H new ATOM 0 HB ILE A 109 73.722 -6.842 8.992 1.00 1.00 H new ATOM 0 HG12 ILE A 109 75.106 -6.238 11.649 1.00 1.00 H new ATOM 0 HG13 ILE A 109 74.120 -7.668 11.416 1.00 1.00 H new ATOM 0 HG21 ILE A 109 75.651 -5.231 9.005 1.00 1.00 H new ATOM 0 HG22 ILE A 109 74.119 -4.393 8.660 1.00 1.00 H new ATOM 0 HG23 ILE A 109 74.843 -4.291 10.282 1.00 1.00 H new ATOM 0 HD11 ILE A 109 76.506 -8.165 10.965 1.00 1.00 H new ATOM 0 HD12 ILE A 109 75.539 -8.347 9.482 1.00 1.00 H new ATOM 0 HD13 ILE A 109 76.540 -6.895 9.719 1.00 1.00 H new ATOM 1634 N PRO A 110 71.783 -7.284 12.301 1.00 1.00 N ATOM 1635 CA PRO A 110 71.118 -8.467 12.899 1.00 1.00 C ATOM 1636 C PRO A 110 69.596 -8.351 12.957 1.00 1.00 C ATOM 1637 O PRO A 110 68.906 -9.342 13.192 1.00 1.00 O ATOM 1638 CB PRO A 110 71.727 -8.595 14.296 1.00 1.00 C ATOM 1639 CG PRO A 110 72.078 -7.210 14.675 1.00 1.00 C ATOM 1640 CD PRO A 110 72.412 -6.491 13.362 1.00 1.00 C ATOM 0 HA PRO A 110 71.286 -9.352 12.285 1.00 1.00 H new ATOM 0 HB2 PRO A 110 71.018 -9.031 15.000 1.00 1.00 H new ATOM 0 HB3 PRO A 110 72.606 -9.239 14.288 1.00 1.00 H new ATOM 0 HG2 PRO A 110 71.249 -6.723 15.188 1.00 1.00 H new ATOM 0 HG3 PRO A 110 72.928 -7.194 15.357 1.00 1.00 H new ATOM 0 HD2 PRO A 110 72.029 -5.470 13.367 1.00 1.00 H new ATOM 0 HD3 PRO A 110 73.490 -6.426 13.215 1.00 1.00 H new ATOM 1648 N ASN A 111 69.075 -7.138 12.786 1.00 1.00 N ATOM 1649 CA ASN A 111 67.631 -6.936 12.872 1.00 1.00 C ATOM 1650 C ASN A 111 66.912 -7.744 11.789 1.00 1.00 C ATOM 1651 O ASN A 111 66.224 -8.728 12.085 1.00 1.00 O ATOM 1652 CB ASN A 111 67.347 -5.444 12.687 1.00 1.00 C ATOM 1653 CG ASN A 111 65.850 -5.193 12.647 1.00 1.00 C ATOM 1654 OD1 ASN A 111 65.228 -5.228 11.503 1.00 1.00 O flip ATOM 1655 ND2 ASN A 111 65.230 -4.964 13.686 1.00 1.00 N flip ATOM 0 H ASN A 111 69.618 -6.297 12.591 1.00 1.00 H new ATOM 0 HA ASN A 111 67.267 -7.274 13.842 1.00 1.00 H new ATOM 0 HB2 ASN A 111 67.796 -4.878 13.503 1.00 1.00 H new ATOM 0 HB3 ASN A 111 67.806 -5.091 11.764 1.00 1.00 H new ATOM 0 HD21 ASN A 111 65.723 -4.938 14.579 1.00 1.00 H new ATOM 0 HD22 ASN A 111 64.224 -4.800 13.654 1.00 1.00 H new ATOM 1662 N ILE A 112 67.088 -7.335 10.536 1.00 1.00 N ATOM 1663 CA ILE A 112 66.470 -8.015 9.401 1.00 1.00 C ATOM 1664 C ILE A 112 67.041 -9.416 9.261 1.00 1.00 C ATOM 1665 O ILE A 112 66.420 -10.317 8.719 1.00 1.00 O ATOM 1666 CB ILE A 112 66.765 -7.186 8.119 1.00 1.00 C ATOM 1667 CG1 ILE A 112 66.628 -8.055 6.833 1.00 1.00 C ATOM 1668 CG2 ILE A 112 68.183 -6.578 8.222 1.00 1.00 C ATOM 1669 CD1 ILE A 112 67.975 -8.697 6.422 1.00 1.00 C ATOM 0 H ILE A 112 67.658 -6.529 10.279 1.00 1.00 H new ATOM 0 HA ILE A 112 65.394 -8.098 9.553 1.00 1.00 H new ATOM 0 HB ILE A 112 66.030 -6.384 8.043 1.00 1.00 H new ATOM 0 HG12 ILE A 112 65.889 -8.839 7.002 1.00 1.00 H new ATOM 0 HG13 ILE A 112 66.256 -7.437 6.016 1.00 1.00 H new ATOM 0 HG21 ILE A 112 68.395 -5.996 7.325 1.00 1.00 H new ATOM 0 HG22 ILE A 112 68.239 -5.930 9.097 1.00 1.00 H new ATOM 0 HG23 ILE A 112 68.916 -7.379 8.316 1.00 1.00 H new ATOM 0 HD11 ILE A 112 67.834 -9.294 5.521 1.00 1.00 H new ATOM 0 HD12 ILE A 112 68.707 -7.913 6.227 1.00 1.00 H new ATOM 0 HD13 ILE A 112 68.334 -9.337 7.228 1.00 1.00 H new ATOM 1681 N ASN A 113 68.265 -9.560 9.692 1.00 1.00 N ATOM 1682 CA ASN A 113 68.940 -10.836 9.545 1.00 1.00 C ATOM 1683 C ASN A 113 68.125 -11.941 10.172 1.00 1.00 C ATOM 1684 O ASN A 113 67.646 -12.825 9.484 1.00 1.00 O ATOM 1685 CB ASN A 113 70.293 -10.808 10.226 1.00 1.00 C ATOM 1686 CG ASN A 113 70.983 -12.155 10.057 1.00 1.00 C ATOM 1687 OD1 ASN A 113 70.702 -12.879 9.106 1.00 1.00 O ATOM 1688 ND2 ASN A 113 71.866 -12.540 10.936 1.00 1.00 N ATOM 0 H ASN A 113 68.814 -8.827 10.142 1.00 1.00 H new ATOM 0 HA ASN A 113 69.064 -11.019 8.478 1.00 1.00 H new ATOM 0 HB2 ASN A 113 70.909 -10.017 9.798 1.00 1.00 H new ATOM 0 HB3 ASN A 113 70.173 -10.581 11.285 1.00 1.00 H new ATOM 0 HD21 ASN A 113 72.326 -13.445 10.835 1.00 1.00 H new ATOM 0 HD22 ASN A 113 72.097 -11.936 11.725 1.00 1.00 H new ATOM 1695 N ALA A 114 67.939 -11.875 11.467 1.00 1.00 N ATOM 1696 CA ALA A 114 67.167 -12.888 12.158 1.00 1.00 C ATOM 1697 C ALA A 114 65.733 -12.932 11.654 1.00 1.00 C ATOM 1698 O ALA A 114 65.075 -13.973 11.751 1.00 1.00 O ATOM 1699 CB ALA A 114 67.182 -12.616 13.663 1.00 1.00 C ATOM 0 H ALA A 114 68.308 -11.136 12.065 1.00 1.00 H new ATOM 0 HA ALA A 114 67.624 -13.857 11.957 1.00 1.00 H new ATOM 0 HB1 ALA A 114 66.600 -13.381 14.177 1.00 1.00 H new ATOM 0 HB2 ALA A 114 68.209 -12.637 14.026 1.00 1.00 H new ATOM 0 HB3 ALA A 114 66.747 -11.636 13.860 1.00 1.00 H new ATOM 1705 N ALA A 115 65.257 -11.826 11.071 1.00 1.00 N ATOM 1706 CA ALA A 115 63.904 -11.794 10.537 1.00 1.00 C ATOM 1707 C ALA A 115 63.798 -12.475 9.164 1.00 1.00 C ATOM 1708 O ALA A 115 63.033 -13.423 9.000 1.00 1.00 O ATOM 1709 CB ALA A 115 63.431 -10.344 10.428 1.00 1.00 C ATOM 0 H ALA A 115 65.783 -10.959 10.961 1.00 1.00 H new ATOM 0 HA ALA A 115 63.268 -12.350 11.226 1.00 1.00 H new ATOM 0 HB1 ALA A 115 62.417 -10.321 10.028 1.00 1.00 H new ATOM 0 HB2 ALA A 115 63.442 -9.883 11.415 1.00 1.00 H new ATOM 0 HB3 ALA A 115 64.096 -9.793 9.763 1.00 1.00 H new ATOM 1715 N ILE A 116 64.528 -11.994 8.153 1.00 1.00 N ATOM 1716 CA ILE A 116 64.427 -12.583 6.814 1.00 1.00 C ATOM 1717 C ILE A 116 65.043 -13.978 6.750 1.00 1.00 C ATOM 1718 O ILE A 116 64.459 -14.898 6.196 1.00 1.00 O ATOM 1719 CB ILE A 116 65.157 -11.644 5.814 1.00 1.00 C ATOM 1720 CG1 ILE A 116 64.268 -10.422 5.471 1.00 1.00 C ATOM 1721 CG2 ILE A 116 65.542 -12.395 4.527 1.00 1.00 C ATOM 1722 CD1 ILE A 116 63.252 -10.751 4.368 1.00 1.00 C ATOM 0 H ILE A 116 65.182 -11.215 8.232 1.00 1.00 H new ATOM 0 HA ILE A 116 63.372 -12.686 6.559 1.00 1.00 H new ATOM 0 HB ILE A 116 66.072 -11.294 6.292 1.00 1.00 H new ATOM 0 HG12 ILE A 116 63.740 -10.093 6.366 1.00 1.00 H new ATOM 0 HG13 ILE A 116 64.898 -9.592 5.150 1.00 1.00 H new ATOM 0 HG21 ILE A 116 66.051 -11.713 3.846 1.00 1.00 H new ATOM 0 HG22 ILE A 116 66.206 -13.224 4.774 1.00 1.00 H new ATOM 0 HG23 ILE A 116 64.642 -12.781 4.048 1.00 1.00 H new ATOM 0 HD11 ILE A 116 62.647 -9.869 4.156 1.00 1.00 H new ATOM 0 HD12 ILE A 116 63.781 -11.054 3.465 1.00 1.00 H new ATOM 0 HD13 ILE A 116 62.605 -11.563 4.700 1.00 1.00 H new ATOM 1734 N GLU A 117 66.251 -14.112 7.256 1.00 1.00 N ATOM 1735 CA GLU A 117 66.959 -15.394 7.182 1.00 1.00 C ATOM 1736 C GLU A 117 66.016 -16.494 7.608 1.00 1.00 C ATOM 1737 O GLU A 117 65.706 -17.394 6.812 1.00 1.00 O ATOM 1738 CB GLU A 117 68.237 -15.397 8.047 1.00 1.00 C ATOM 1739 CG GLU A 117 69.429 -14.799 7.258 1.00 1.00 C ATOM 1740 CD GLU A 117 69.242 -13.307 6.983 1.00 1.00 C ATOM 1741 OE1 GLU A 117 68.173 -12.796 7.237 1.00 1.00 O ATOM 1742 OE2 GLU A 117 70.185 -12.696 6.521 1.00 1.00 O ATOM 0 H GLU A 117 66.767 -13.364 7.720 1.00 1.00 H new ATOM 0 HA GLU A 117 67.280 -15.560 6.154 1.00 1.00 H new ATOM 0 HB2 GLU A 117 68.069 -14.820 8.956 1.00 1.00 H new ATOM 0 HB3 GLU A 117 68.472 -16.416 8.355 1.00 1.00 H new ATOM 0 HG2 GLU A 117 70.350 -14.951 7.821 1.00 1.00 H new ATOM 0 HG3 GLU A 117 69.542 -15.331 6.313 1.00 1.00 H new ATOM 1749 N VAL A 118 65.554 -16.420 8.853 1.00 1.00 N ATOM 1750 CA VAL A 118 64.633 -17.419 9.339 1.00 1.00 C ATOM 1751 C VAL A 118 63.468 -17.547 8.354 1.00 1.00 C ATOM 1752 O VAL A 118 62.762 -18.556 8.364 1.00 1.00 O ATOM 1753 CB VAL A 118 64.129 -17.050 10.754 1.00 1.00 C ATOM 1754 CG1 VAL A 118 62.959 -16.055 10.663 1.00 1.00 C ATOM 1755 CG2 VAL A 118 63.662 -18.311 11.493 1.00 1.00 C ATOM 0 H VAL A 118 65.801 -15.692 9.524 1.00 1.00 H new ATOM 0 HA VAL A 118 65.142 -18.380 9.413 1.00 1.00 H new ATOM 0 HB VAL A 118 64.951 -16.590 11.302 1.00 1.00 H new ATOM 0 HG11 VAL A 118 62.615 -15.805 11.667 1.00 1.00 H new ATOM 0 HG12 VAL A 118 63.291 -15.149 10.157 1.00 1.00 H new ATOM 0 HG13 VAL A 118 62.141 -16.506 10.101 1.00 1.00 H new ATOM 0 HG21 VAL A 118 63.309 -18.040 12.488 1.00 1.00 H new ATOM 0 HG22 VAL A 118 62.851 -18.780 10.936 1.00 1.00 H new ATOM 0 HG23 VAL A 118 64.494 -19.010 11.581 1.00 1.00 H new ATOM 1765 N LEU A 119 63.290 -16.553 7.449 1.00 1.00 N ATOM 1766 CA LEU A 119 62.237 -16.666 6.447 1.00 1.00 C ATOM 1767 C LEU A 119 62.713 -17.605 5.334 1.00 1.00 C ATOM 1768 O LEU A 119 62.083 -18.645 5.126 1.00 1.00 O ATOM 1769 CB LEU A 119 61.870 -15.279 5.875 1.00 1.00 C ATOM 1770 CG LEU A 119 60.404 -15.244 5.390 1.00 1.00 C ATOM 1771 CD1 LEU A 119 60.162 -16.353 4.356 1.00 1.00 C ATOM 1772 CD2 LEU A 119 59.427 -15.423 6.575 1.00 1.00 C ATOM 0 H LEU A 119 63.847 -15.699 7.402 1.00 1.00 H new ATOM 0 HA LEU A 119 61.339 -17.075 6.909 1.00 1.00 H new ATOM 0 HB2 LEU A 119 62.021 -14.516 6.639 1.00 1.00 H new ATOM 0 HB3 LEU A 119 62.536 -15.037 5.047 1.00 1.00 H new ATOM 0 HG LEU A 119 60.224 -14.272 4.930 1.00 1.00 H new ATOM 0 HD11 LEU A 119 59.125 -16.319 4.021 1.00 1.00 H new ATOM 0 HD12 LEU A 119 60.824 -16.205 3.503 1.00 1.00 H new ATOM 0 HD13 LEU A 119 60.365 -17.323 4.809 1.00 1.00 H new ATOM 0 HD21 LEU A 119 58.401 -15.395 6.208 1.00 1.00 H new ATOM 0 HD22 LEU A 119 59.613 -16.382 7.058 1.00 1.00 H new ATOM 0 HD23 LEU A 119 59.577 -14.619 7.295 1.00 1.00 H new ATOM 1784 N GLY A 120 63.829 -17.297 4.608 1.00 1.00 N ATOM 1785 CA GLY A 120 64.235 -18.260 3.583 1.00 1.00 C ATOM 1786 C GLY A 120 64.734 -19.567 4.229 1.00 1.00 C ATOM 1787 O GLY A 120 63.994 -20.544 4.355 1.00 1.00 O ATOM 0 H GLY A 120 64.407 -16.463 4.709 1.00 1.00 H new ATOM 0 HA2 GLY A 120 63.394 -18.473 2.924 1.00 1.00 H new ATOM 0 HA3 GLY A 120 65.023 -17.830 2.965 1.00 1.00 H new ATOM 1791 N THR A 121 66.000 -19.563 4.629 1.00 1.00 N ATOM 1792 CA THR A 121 66.631 -20.738 5.259 1.00 1.00 C ATOM 1793 C THR A 121 67.860 -20.292 6.038 1.00 1.00 C ATOM 1794 O THR A 121 68.365 -20.989 6.920 1.00 1.00 O ATOM 1795 CB THR A 121 67.010 -21.764 4.188 1.00 1.00 C ATOM 1796 OG1 THR A 121 65.904 -21.954 3.324 1.00 1.00 O ATOM 1797 CG2 THR A 121 67.380 -23.099 4.840 1.00 1.00 C ATOM 0 H THR A 121 66.620 -18.759 4.532 1.00 1.00 H new ATOM 0 HA THR A 121 65.929 -21.208 5.948 1.00 1.00 H new ATOM 0 HB THR A 121 67.869 -21.397 3.626 1.00 1.00 H new ATOM 0 HG1 THR A 121 66.204 -22.392 2.500 1.00 1.00 H new ATOM 0 HG21 THR A 121 67.647 -23.820 4.067 1.00 1.00 H new ATOM 0 HG22 THR A 121 68.227 -22.954 5.510 1.00 1.00 H new ATOM 0 HG23 THR A 121 66.529 -23.475 5.408 1.00 1.00 H new ATOM 1805 N GLY A 122 68.307 -19.108 5.675 1.00 1.00 N ATOM 1806 CA GLY A 122 69.460 -18.432 6.251 1.00 1.00 C ATOM 1807 C GLY A 122 70.618 -18.334 5.266 1.00 1.00 C ATOM 1808 O GLY A 122 71.324 -17.335 5.288 1.00 1.00 O ATOM 0 H GLY A 122 67.860 -18.563 4.938 1.00 1.00 H new ATOM 0 HA2 GLY A 122 69.171 -17.431 6.570 1.00 1.00 H new ATOM 0 HA3 GLY A 122 69.787 -18.969 7.142 1.00 1.00 H new ATOM 1812 N THR A 123 70.842 -19.348 4.433 1.00 1.00 N ATOM 1813 CA THR A 123 71.972 -19.327 3.482 1.00 1.00 C ATOM 1814 C THR A 123 72.313 -17.906 3.011 1.00 1.00 C ATOM 1815 O THR A 123 71.726 -17.397 2.056 1.00 1.00 O ATOM 1816 CB THR A 123 71.618 -20.182 2.248 1.00 1.00 C ATOM 1817 OG1 THR A 123 71.310 -21.509 2.660 1.00 1.00 O ATOM 1818 CG2 THR A 123 72.803 -20.218 1.273 1.00 1.00 C ATOM 0 H THR A 123 70.268 -20.190 4.390 1.00 1.00 H new ATOM 0 HA THR A 123 72.841 -19.729 4.003 1.00 1.00 H new ATOM 0 HB THR A 123 70.755 -19.741 1.749 1.00 1.00 H new ATOM 0 HG1 THR A 123 71.084 -22.051 1.875 1.00 1.00 H new ATOM 0 HG21 THR A 123 72.542 -20.824 0.406 1.00 1.00 H new ATOM 0 HG22 THR A 123 73.039 -19.204 0.949 1.00 1.00 H new ATOM 0 HG23 THR A 123 73.671 -20.651 1.771 1.00 1.00 H new ATOM 1826 N ASP A 124 73.295 -17.275 3.684 1.00 1.00 N ATOM 1827 CA ASP A 124 73.748 -15.927 3.327 1.00 1.00 C ATOM 1828 C ASP A 124 75.257 -15.837 3.604 1.00 1.00 C ATOM 1829 O ASP A 124 75.760 -16.426 4.562 1.00 1.00 O ATOM 1830 CB ASP A 124 72.945 -14.843 4.116 1.00 1.00 C ATOM 1831 CG ASP A 124 73.843 -13.976 5.010 1.00 1.00 C ATOM 1832 OD1 ASP A 124 74.313 -12.956 4.533 1.00 1.00 O ATOM 1833 OD2 ASP A 124 74.032 -14.342 6.160 1.00 1.00 O ATOM 0 H ASP A 124 73.787 -17.683 4.479 1.00 1.00 H new ATOM 0 HA ASP A 124 73.567 -15.737 2.269 1.00 1.00 H new ATOM 0 HB2 ASP A 124 72.415 -14.203 3.410 1.00 1.00 H new ATOM 0 HB3 ASP A 124 72.190 -15.332 4.731 1.00 1.00 H new ATOM 1838 N TYR A 125 75.966 -15.098 2.764 1.00 1.00 N ATOM 1839 CA TYR A 125 77.408 -14.934 2.927 1.00 1.00 C ATOM 1840 C TYR A 125 77.842 -13.561 2.397 1.00 1.00 C ATOM 1841 O TYR A 125 77.273 -13.057 1.432 1.00 1.00 O ATOM 1842 CB TYR A 125 78.146 -16.065 2.156 1.00 1.00 C ATOM 1843 CG TYR A 125 78.457 -15.613 0.744 1.00 1.00 C ATOM 1844 CD1 TYR A 125 77.411 -15.348 -0.140 1.00 1.00 C ATOM 1845 CD2 TYR A 125 79.786 -15.403 0.343 1.00 1.00 C ATOM 1846 CE1 TYR A 125 77.684 -14.878 -1.427 1.00 1.00 C ATOM 1847 CE2 TYR A 125 80.060 -14.921 -0.939 1.00 1.00 C ATOM 1848 CZ TYR A 125 79.012 -14.658 -1.826 1.00 1.00 C ATOM 1849 OH TYR A 125 79.291 -14.161 -3.082 1.00 1.00 O ATOM 0 H TYR A 125 75.571 -14.603 1.965 1.00 1.00 H new ATOM 0 HA TYR A 125 77.663 -14.995 3.985 1.00 1.00 H new ATOM 0 HB2 TYR A 125 79.068 -16.327 2.674 1.00 1.00 H new ATOM 0 HB3 TYR A 125 77.528 -16.963 2.131 1.00 1.00 H new ATOM 0 HD1 TYR A 125 76.389 -15.506 0.171 1.00 1.00 H new ATOM 0 HD2 TYR A 125 80.596 -15.614 1.025 1.00 1.00 H new ATOM 0 HE1 TYR A 125 76.874 -14.684 -2.115 1.00 1.00 H new ATOM 0 HE2 TYR A 125 81.082 -14.751 -1.245 1.00 1.00 H new ATOM 0 HH TYR A 125 80.261 -14.070 -3.190 1.00 1.00 H new ATOM 1859 N ARG A 126 78.884 -12.986 2.994 1.00 1.00 N ATOM 1860 CA ARG A 126 79.412 -11.705 2.518 1.00 1.00 C ATOM 1861 C ARG A 126 80.929 -11.674 2.733 1.00 1.00 C ATOM 1862 O ARG A 126 81.443 -12.315 3.652 1.00 1.00 O ATOM 1863 CB ARG A 126 78.770 -10.484 3.221 1.00 1.00 C ATOM 1864 CG ARG A 126 77.299 -10.719 3.617 1.00 1.00 C ATOM 1865 CD ARG A 126 76.354 -10.571 2.393 1.00 1.00 C ATOM 1866 NE ARG A 126 77.098 -10.589 1.142 1.00 1.00 N ATOM 1867 CZ ARG A 126 76.476 -10.752 -0.021 1.00 1.00 C ATOM 1868 NH1 ARG A 126 75.178 -10.874 -0.059 1.00 1.00 N ATOM 1869 NH2 ARG A 126 77.162 -10.780 -1.129 1.00 1.00 N ATOM 0 H ARG A 126 79.375 -13.378 3.797 1.00 1.00 H new ATOM 0 HA ARG A 126 79.165 -11.630 1.459 1.00 1.00 H new ATOM 0 HB2 ARG A 126 79.346 -10.242 4.114 1.00 1.00 H new ATOM 0 HB3 ARG A 126 78.828 -9.619 2.560 1.00 1.00 H new ATOM 0 HG2 ARG A 126 77.190 -11.716 4.045 1.00 1.00 H new ATOM 0 HG3 ARG A 126 77.010 -10.007 4.390 1.00 1.00 H new ATOM 0 HD2 ARG A 126 75.624 -11.380 2.395 1.00 1.00 H new ATOM 0 HD3 ARG A 126 75.796 -9.638 2.473 1.00 1.00 H new ATOM 0 HE ARG A 126 78.111 -10.475 1.158 1.00 1.00 H new ATOM 0 HH11 ARG A 126 74.637 -10.844 0.805 1.00 1.00 H new ATOM 0 HH12 ARG A 126 74.703 -10.999 -0.953 1.00 1.00 H new ATOM 0 HH21 ARG A 126 78.176 -10.677 -1.103 1.00 1.00 H new ATOM 0 HH22 ARG A 126 76.684 -10.905 -2.022 1.00 1.00 H new ATOM 1883 N PHE A 127 81.640 -10.957 1.863 1.00 1.00 N ATOM 1884 CA PHE A 127 83.098 -10.878 1.946 1.00 1.00 C ATOM 1885 C PHE A 127 83.643 -9.788 1.021 1.00 1.00 C ATOM 1886 O PHE A 127 84.752 -9.950 0.535 1.00 1.00 O ATOM 1887 CB PHE A 127 83.718 -12.236 1.574 1.00 1.00 C ATOM 1888 CG PHE A 127 83.680 -12.476 0.068 1.00 1.00 C ATOM 1889 CD1 PHE A 127 82.546 -12.142 -0.698 1.00 1.00 C ATOM 1890 CD2 PHE A 127 84.791 -13.054 -0.561 1.00 1.00 C ATOM 1891 CE1 PHE A 127 82.533 -12.383 -2.074 1.00 1.00 C ATOM 1892 CE2 PHE A 127 84.771 -13.296 -1.940 1.00 1.00 C ATOM 1893 CZ PHE A 127 83.642 -12.960 -2.695 1.00 1.00 C ATOM 1894 OXT PHE A 127 82.948 -8.806 0.815 1.00 1.00 O ATOM 0 H PHE A 127 81.232 -10.424 1.095 1.00 1.00 H new ATOM 0 HA PHE A 127 83.368 -10.623 2.971 1.00 1.00 H new ATOM 0 HB2 PHE A 127 84.750 -12.274 1.923 1.00 1.00 H new ATOM 0 HB3 PHE A 127 83.180 -13.035 2.084 1.00 1.00 H new ATOM 0 HD1 PHE A 127 81.685 -11.699 -0.220 1.00 1.00 H new ATOM 0 HD2 PHE A 127 85.664 -13.313 0.019 1.00 1.00 H new ATOM 0 HE1 PHE A 127 81.663 -12.122 -2.659 1.00 1.00 H new ATOM 0 HE2 PHE A 127 85.628 -13.743 -2.422 1.00 1.00 H new ATOM 0 HZ PHE A 127 83.629 -13.147 -3.759 1.00 1.00 H new