USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 883 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 71 GLN : amide:sc= -0.432 K(o=-0.99,f=-0.05) USER MOD Set 1.2: A 99 ASN : amide:sc= -0.555 K(o=-0.99,f=-1.7) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl -165:sc=-0.00559 (180deg=-0.135) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -0.0824 X(o=-0.082,f=0) USER MOD Single : A 25 ASN : amide:sc= 0.0905 X(o=0.091,f=0) USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 SER OG : rot 180:sc= -0.0243 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 82:sc= 1.06 USER MOD Single : A 36 LYS NZ :NH3+ 151:sc= -0.12 (180deg=-0.569) USER MOD Single : A 38 HIS : no HE2:sc= -1.36 K(o=-1.4,f=-2.9!) USER MOD Single : A 43 THR OG1 : rot -103:sc= 0.73 USER MOD Single : A 44 GLN : amide:sc= -0.0835 X(o=-0.083,f=0) USER MOD Single : A 46 HIS : no HD1:sc= -0.0483 X(o=-0.048,f=-0.52) USER MOD Single : A 54 SER OG : rot -99:sc= 0.22 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -1.68 X(o=-1.7,f=-1.3) USER MOD Single : A 62 SER OG : rot -6:sc= 0.0984 USER MOD Single : A 63 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00173) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl -126:sc= -0.025 (180deg=-1.29) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= -1.19 USER MOD Single : A 80 SER OG : rot 180:sc= -1.66 USER MOD Single : A 84 MET CE :methyl -117:sc= -2.13 (180deg=-3.94!) USER MOD Single : A 85 ASN : amide:sc= -0.157 X(o=-0.16,f=0) USER MOD Single : A 87 MET CE :methyl 150:sc= -1.72 (180deg=-3.87!) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 ASN : amide:sc= -0.0972 X(o=-0.097,f=0) USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 CYS SG : rot 180:sc= 0 USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 HIS : no HD1:sc= -0.322 X(o=-0.32,f=-0.59) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -17.234 13.635 3.369 1.00 0.00 N ATOM 2 CA GLY A 1 -17.445 12.762 2.181 1.00 0.00 C ATOM 3 C GLY A 1 -18.048 11.421 2.547 1.00 0.00 C ATOM 4 O GLY A 1 -17.443 10.375 2.310 1.00 0.00 O ATOM 0 H1 GLY A 1 -16.820 14.540 3.066 1.00 0.00 H new ATOM 0 H2 GLY A 1 -18.146 13.811 3.837 1.00 0.00 H new ATOM 0 H3 GLY A 1 -16.588 13.165 4.035 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -18.099 13.270 1.472 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -16.492 12.603 1.677 1.00 0.00 H new ATOM 10 N SER A 2 -19.243 11.450 3.127 1.00 0.00 N ATOM 11 CA SER A 2 -19.929 10.226 3.526 1.00 0.00 C ATOM 12 C SER A 2 -20.248 9.361 2.311 1.00 0.00 C ATOM 13 O SER A 2 -20.200 9.828 1.175 1.00 0.00 O ATOM 14 CB SER A 2 -21.217 10.562 4.280 1.00 0.00 C ATOM 15 OG SER A 2 -20.996 11.580 5.241 1.00 0.00 O ATOM 0 H SER A 2 -19.757 12.307 3.331 1.00 0.00 H new ATOM 0 HA SER A 2 -19.266 9.665 4.185 1.00 0.00 H new ATOM 0 HB2 SER A 2 -21.982 10.885 3.574 1.00 0.00 H new ATOM 0 HB3 SER A 2 -21.596 9.668 4.774 1.00 0.00 H new ATOM 0 HG SER A 2 -21.835 11.777 5.708 1.00 0.00 H new ATOM 21 N SER A 3 -20.575 8.096 2.562 1.00 0.00 N ATOM 22 CA SER A 3 -20.901 7.165 1.489 1.00 0.00 C ATOM 23 C SER A 3 -22.310 6.605 1.665 1.00 0.00 C ATOM 24 O SER A 3 -22.982 6.891 2.656 1.00 0.00 O ATOM 25 CB SER A 3 -19.887 6.020 1.452 1.00 0.00 C ATOM 26 OG SER A 3 -18.560 6.513 1.520 1.00 0.00 O ATOM 0 H SER A 3 -20.621 7.694 3.498 1.00 0.00 H new ATOM 0 HA SER A 3 -20.859 7.709 0.545 1.00 0.00 H new ATOM 0 HB2 SER A 3 -20.069 5.341 2.285 1.00 0.00 H new ATOM 0 HB3 SER A 3 -20.018 5.443 0.536 1.00 0.00 H new ATOM 0 HG SER A 3 -17.931 5.762 1.496 1.00 0.00 H new ATOM 32 N GLY A 4 -22.749 5.808 0.697 1.00 0.00 N ATOM 33 CA GLY A 4 -24.074 5.221 0.764 1.00 0.00 C ATOM 34 C GLY A 4 -24.065 3.835 1.377 1.00 0.00 C ATOM 35 O GLY A 4 -24.663 2.905 0.834 1.00 0.00 O ATOM 0 H GLY A 4 -22.211 5.558 -0.133 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -24.726 5.869 1.350 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -24.495 5.168 -0.240 1.00 0.00 H new ATOM 39 N SER A 5 -23.386 3.695 2.510 1.00 0.00 N ATOM 40 CA SER A 5 -23.301 2.411 3.197 1.00 0.00 C ATOM 41 C SER A 5 -22.643 1.361 2.309 1.00 0.00 C ATOM 42 O SER A 5 -23.316 0.668 1.545 1.00 0.00 O ATOM 43 CB SER A 5 -24.695 1.940 3.616 1.00 0.00 C ATOM 44 OG SER A 5 -24.663 1.320 4.890 1.00 0.00 O ATOM 0 H SER A 5 -22.886 4.455 2.972 1.00 0.00 H new ATOM 0 HA SER A 5 -22.687 2.544 4.088 1.00 0.00 H new ATOM 0 HB2 SER A 5 -25.378 2.789 3.639 1.00 0.00 H new ATOM 0 HB3 SER A 5 -25.083 1.239 2.877 1.00 0.00 H new ATOM 0 HG SER A 5 -25.566 1.030 5.135 1.00 0.00 H new ATOM 50 N SER A 6 -21.322 1.248 2.414 1.00 0.00 N ATOM 51 CA SER A 6 -20.573 0.282 1.620 1.00 0.00 C ATOM 52 C SER A 6 -20.666 -1.113 2.230 1.00 0.00 C ATOM 53 O SER A 6 -20.803 -2.106 1.516 1.00 0.00 O ATOM 54 CB SER A 6 -19.108 0.708 1.510 1.00 0.00 C ATOM 55 OG SER A 6 -18.592 0.438 0.217 1.00 0.00 O ATOM 0 H SER A 6 -20.750 1.813 3.041 1.00 0.00 H new ATOM 0 HA SER A 6 -21.011 0.251 0.622 1.00 0.00 H new ATOM 0 HB2 SER A 6 -19.019 1.773 1.725 1.00 0.00 H new ATOM 0 HB3 SER A 6 -18.516 0.181 2.258 1.00 0.00 H new ATOM 0 HG SER A 6 -17.655 0.721 0.173 1.00 0.00 H new ATOM 61 N GLY A 7 -20.591 -1.179 3.556 1.00 0.00 N ATOM 62 CA GLY A 7 -20.668 -2.457 4.241 1.00 0.00 C ATOM 63 C GLY A 7 -19.397 -2.787 4.997 1.00 0.00 C ATOM 64 O GLY A 7 -18.680 -1.890 5.441 1.00 0.00 O ATOM 0 H GLY A 7 -20.478 -0.371 4.168 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -21.507 -2.443 4.936 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -20.869 -3.244 3.514 1.00 0.00 H new ATOM 68 N MET A 8 -19.117 -4.078 5.144 1.00 0.00 N ATOM 69 CA MET A 8 -17.923 -4.524 5.853 1.00 0.00 C ATOM 70 C MET A 8 -16.660 -4.022 5.162 1.00 0.00 C ATOM 71 O MET A 8 -16.212 -4.597 4.169 1.00 0.00 O ATOM 72 CB MET A 8 -17.898 -6.052 5.939 1.00 0.00 C ATOM 73 CG MET A 8 -16.975 -6.585 7.023 1.00 0.00 C ATOM 74 SD MET A 8 -15.375 -7.109 6.377 1.00 0.00 S ATOM 75 CE MET A 8 -15.829 -8.626 5.538 1.00 0.00 C ATOM 0 H MET A 8 -19.700 -4.833 4.782 1.00 0.00 H new ATOM 0 HA MET A 8 -17.953 -4.110 6.861 1.00 0.00 H new ATOM 0 HB2 MET A 8 -18.909 -6.414 6.124 1.00 0.00 H new ATOM 0 HB3 MET A 8 -17.586 -6.457 4.976 1.00 0.00 H new ATOM 0 HG2 MET A 8 -16.823 -5.813 7.777 1.00 0.00 H new ATOM 0 HG3 MET A 8 -17.455 -7.427 7.521 1.00 0.00 H new ATOM 0 HE1 MET A 8 -14.931 -9.203 5.318 1.00 0.00 H new ATOM 0 HE2 MET A 8 -16.489 -9.212 6.177 1.00 0.00 H new ATOM 0 HE3 MET A 8 -16.343 -8.387 4.607 1.00 0.00 H new ATOM 85 N ALA A 9 -16.090 -2.945 5.692 1.00 0.00 N ATOM 86 CA ALA A 9 -14.878 -2.365 5.126 1.00 0.00 C ATOM 87 C ALA A 9 -13.644 -2.798 5.910 1.00 0.00 C ATOM 88 O ALA A 9 -12.664 -2.057 6.002 1.00 0.00 O ATOM 89 CB ALA A 9 -14.983 -0.848 5.100 1.00 0.00 C ATOM 0 H ALA A 9 -16.448 -2.456 6.513 1.00 0.00 H new ATOM 0 HA ALA A 9 -14.773 -2.729 4.104 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -14.072 -0.427 4.675 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -15.837 -0.553 4.491 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -15.116 -0.475 6.116 1.00 0.00 H new ATOM 95 N LEU A 10 -13.698 -4.002 6.472 1.00 0.00 N ATOM 96 CA LEU A 10 -12.585 -4.538 7.250 1.00 0.00 C ATOM 97 C LEU A 10 -12.328 -3.688 8.492 1.00 0.00 C ATOM 98 O LEU A 10 -12.741 -4.046 9.595 1.00 0.00 O ATOM 99 CB LEU A 10 -11.320 -4.611 6.390 1.00 0.00 C ATOM 100 CG LEU A 10 -11.085 -5.955 5.698 1.00 0.00 C ATOM 101 CD1 LEU A 10 -9.961 -5.842 4.680 1.00 0.00 C ATOM 102 CD2 LEU A 10 -10.770 -7.033 6.725 1.00 0.00 C ATOM 0 H LEU A 10 -14.502 -4.626 6.403 1.00 0.00 H new ATOM 0 HA LEU A 10 -12.851 -5.544 7.573 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -11.370 -3.832 5.629 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -10.458 -4.388 7.019 1.00 0.00 H new ATOM 0 HG LEU A 10 -11.997 -6.236 5.171 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -9.808 -6.808 4.198 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -10.225 -5.099 3.928 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -9.043 -5.539 5.184 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -10.605 -7.983 6.217 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -9.872 -6.757 7.278 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -11.606 -7.132 7.417 1.00 0.00 H new ATOM 114 N ALA A 11 -11.644 -2.564 8.307 1.00 0.00 N ATOM 115 CA ALA A 11 -11.334 -1.667 9.413 1.00 0.00 C ATOM 116 C ALA A 11 -11.081 -0.248 8.916 1.00 0.00 C ATOM 117 O ALA A 11 -11.151 0.022 7.718 1.00 0.00 O ATOM 118 CB ALA A 11 -10.128 -2.180 10.186 1.00 0.00 C ATOM 0 H ALA A 11 -11.294 -2.253 7.401 1.00 0.00 H new ATOM 0 HA ALA A 11 -12.196 -1.642 10.080 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -9.908 -1.500 11.009 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -10.345 -3.172 10.582 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -9.266 -2.236 9.521 1.00 0.00 H new ATOM 124 N ARG A 12 -10.788 0.656 9.846 1.00 0.00 N ATOM 125 CA ARG A 12 -10.524 2.049 9.501 1.00 0.00 C ATOM 126 C ARG A 12 -9.101 2.443 9.883 1.00 0.00 C ATOM 127 O ARG A 12 -8.645 2.164 10.993 1.00 0.00 O ATOM 128 CB ARG A 12 -11.526 2.968 10.203 1.00 0.00 C ATOM 129 CG ARG A 12 -11.341 4.438 9.867 1.00 0.00 C ATOM 130 CD ARG A 12 -12.018 4.802 8.555 1.00 0.00 C ATOM 131 NE ARG A 12 -11.798 6.200 8.195 1.00 0.00 N ATOM 132 CZ ARG A 12 -11.996 6.691 6.974 1.00 0.00 C ATOM 133 NH1 ARG A 12 -12.415 5.901 5.993 1.00 0.00 N ATOM 134 NH2 ARG A 12 -11.774 7.976 6.733 1.00 0.00 N ATOM 0 H ARG A 12 -10.727 0.449 10.843 1.00 0.00 H new ATOM 0 HA ARG A 12 -10.635 2.158 8.422 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -12.537 2.666 9.930 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -11.434 2.836 11.281 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -11.751 5.050 10.671 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -10.277 4.666 9.804 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -11.639 4.159 7.761 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -13.088 4.612 8.635 1.00 0.00 H new ATOM 0 HE ARG A 12 -11.474 6.838 8.922 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -12.587 4.912 6.173 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -12.565 6.283 5.059 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -11.452 8.587 7.483 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -11.926 8.353 5.797 1.00 0.00 H new ATOM 148 N ALA A 13 -8.404 3.094 8.958 1.00 0.00 N ATOM 149 CA ALA A 13 -7.034 3.527 9.198 1.00 0.00 C ATOM 150 C ALA A 13 -6.990 4.980 9.662 1.00 0.00 C ATOM 151 O ALA A 13 -8.027 5.625 9.813 1.00 0.00 O ATOM 152 CB ALA A 13 -6.196 3.348 7.941 1.00 0.00 C ATOM 0 H ALA A 13 -8.766 3.333 8.035 1.00 0.00 H new ATOM 0 HA ALA A 13 -6.617 2.906 9.991 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -5.175 3.676 8.135 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -6.191 2.297 7.653 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -6.621 3.943 7.133 1.00 0.00 H new ATOM 158 N ASN A 14 -5.782 5.487 9.887 1.00 0.00 N ATOM 159 CA ASN A 14 -5.603 6.864 10.333 1.00 0.00 C ATOM 160 C ASN A 14 -4.602 7.597 9.446 1.00 0.00 C ATOM 161 O ASN A 14 -4.935 8.602 8.817 1.00 0.00 O ATOM 162 CB ASN A 14 -5.129 6.892 11.787 1.00 0.00 C ATOM 163 CG ASN A 14 -5.775 8.008 12.585 1.00 0.00 C ATOM 164 OD1 ASN A 14 -5.424 9.178 12.434 1.00 0.00 O ATOM 165 ND2 ASN A 14 -6.726 7.651 13.440 1.00 0.00 N ATOM 0 H ASN A 14 -4.913 4.966 9.768 1.00 0.00 H new ATOM 0 HA ASN A 14 -6.565 7.372 10.261 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -5.354 5.935 12.258 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -4.046 7.012 11.811 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -7.197 8.359 14.004 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -6.986 6.669 13.533 1.00 0.00 H new ATOM 172 N SER A 15 -3.375 7.088 9.400 1.00 0.00 N ATOM 173 CA SER A 15 -2.325 7.694 8.590 1.00 0.00 C ATOM 174 C SER A 15 -1.940 6.781 7.427 1.00 0.00 C ATOM 175 O SER A 15 -2.244 5.588 7.437 1.00 0.00 O ATOM 176 CB SER A 15 -1.095 7.990 9.451 1.00 0.00 C ATOM 177 OG SER A 15 -1.423 7.988 10.830 1.00 0.00 O ATOM 0 H SER A 15 -3.084 6.257 9.915 1.00 0.00 H new ATOM 0 HA SER A 15 -2.708 8.630 8.183 1.00 0.00 H new ATOM 0 HB2 SER A 15 -0.324 7.245 9.257 1.00 0.00 H new ATOM 0 HB3 SER A 15 -0.679 8.959 9.175 1.00 0.00 H new ATOM 0 HG SER A 15 -0.619 8.178 11.358 1.00 0.00 H new ATOM 183 N PRO A 16 -1.262 7.332 6.405 1.00 0.00 N ATOM 184 CA PRO A 16 -0.836 6.560 5.233 1.00 0.00 C ATOM 185 C PRO A 16 0.213 5.510 5.582 1.00 0.00 C ATOM 186 O PRO A 16 0.330 4.487 4.908 1.00 0.00 O ATOM 187 CB PRO A 16 -0.244 7.619 4.299 1.00 0.00 C ATOM 188 CG PRO A 16 0.144 8.745 5.193 1.00 0.00 C ATOM 189 CD PRO A 16 -0.858 8.747 6.313 1.00 0.00 C ATOM 0 HA PRO A 16 -1.662 6.002 4.793 1.00 0.00 H new ATOM 0 HB2 PRO A 16 0.618 7.230 3.757 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -0.972 7.939 3.553 1.00 0.00 H new ATOM 0 HG2 PRO A 16 1.156 8.610 5.575 1.00 0.00 H new ATOM 0 HG3 PRO A 16 0.130 9.693 4.655 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -0.419 9.102 7.245 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -1.707 9.395 6.093 1.00 0.00 H new ATOM 197 N GLN A 17 0.975 5.770 6.640 1.00 0.00 N ATOM 198 CA GLN A 17 2.015 4.847 7.078 1.00 0.00 C ATOM 199 C GLN A 17 1.405 3.554 7.610 1.00 0.00 C ATOM 200 O GLN A 17 1.966 2.473 7.432 1.00 0.00 O ATOM 201 CB GLN A 17 2.881 5.498 8.158 1.00 0.00 C ATOM 202 CG GLN A 17 3.705 6.672 7.652 1.00 0.00 C ATOM 203 CD GLN A 17 3.537 7.914 8.505 1.00 0.00 C ATOM 204 OE1 GLN A 17 4.356 8.197 9.379 1.00 0.00 O ATOM 205 NE2 GLN A 17 2.470 8.665 8.254 1.00 0.00 N ATOM 0 H GLN A 17 0.891 6.612 7.209 1.00 0.00 H new ATOM 0 HA GLN A 17 2.639 4.606 6.217 1.00 0.00 H new ATOM 0 HB2 GLN A 17 2.239 5.839 8.970 1.00 0.00 H new ATOM 0 HB3 GLN A 17 3.552 4.747 8.576 1.00 0.00 H new ATOM 0 HG2 GLN A 17 4.758 6.390 7.631 1.00 0.00 H new ATOM 0 HG3 GLN A 17 3.415 6.899 6.626 1.00 0.00 H new ATOM 0 HE21 GLN A 17 1.816 8.393 7.520 1.00 0.00 H new ATOM 0 HE22 GLN A 17 2.305 9.513 8.795 1.00 0.00 H new ATOM 214 N GLU A 18 0.254 3.674 8.263 1.00 0.00 N ATOM 215 CA GLU A 18 -0.433 2.515 8.821 1.00 0.00 C ATOM 216 C GLU A 18 -1.251 1.800 7.750 1.00 0.00 C ATOM 217 O GLU A 18 -1.257 0.571 7.677 1.00 0.00 O ATOM 218 CB GLU A 18 -1.342 2.942 9.975 1.00 0.00 C ATOM 219 CG GLU A 18 -1.355 1.959 11.134 1.00 0.00 C ATOM 220 CD GLU A 18 -2.713 1.862 11.802 1.00 0.00 C ATOM 221 OE1 GLU A 18 -3.733 2.039 11.101 1.00 0.00 O ATOM 222 OE2 GLU A 18 -2.757 1.611 13.024 1.00 0.00 O ATOM 0 H GLU A 18 -0.223 4.562 8.419 1.00 0.00 H new ATOM 0 HA GLU A 18 0.320 1.823 9.198 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -1.019 3.917 10.340 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -2.358 3.063 9.600 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -1.061 0.974 10.773 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -0.612 2.263 11.872 1.00 0.00 H new ATOM 229 N ALA A 19 -1.941 2.578 6.923 1.00 0.00 N ATOM 230 CA ALA A 19 -2.763 2.020 5.856 1.00 0.00 C ATOM 231 C ALA A 19 -1.922 1.191 4.891 1.00 0.00 C ATOM 232 O ALA A 19 -2.406 0.223 4.304 1.00 0.00 O ATOM 233 CB ALA A 19 -3.484 3.131 5.110 1.00 0.00 C ATOM 0 H ALA A 19 -1.947 3.597 6.971 1.00 0.00 H new ATOM 0 HA ALA A 19 -3.504 1.361 6.309 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -4.094 2.700 4.316 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -4.124 3.679 5.802 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -2.752 3.812 4.676 1.00 0.00 H new ATOM 239 N LEU A 20 -0.661 1.577 4.731 1.00 0.00 N ATOM 240 CA LEU A 20 0.249 0.870 3.838 1.00 0.00 C ATOM 241 C LEU A 20 0.724 -0.435 4.467 1.00 0.00 C ATOM 242 O LEU A 20 0.754 -1.477 3.813 1.00 0.00 O ATOM 243 CB LEU A 20 1.450 1.754 3.495 1.00 0.00 C ATOM 244 CG LEU A 20 2.501 1.100 2.596 1.00 0.00 C ATOM 245 CD1 LEU A 20 2.005 1.028 1.161 1.00 0.00 C ATOM 246 CD2 LEU A 20 3.814 1.865 2.671 1.00 0.00 C ATOM 0 H LEU A 20 -0.246 2.377 5.209 1.00 0.00 H new ATOM 0 HA LEU A 20 -0.291 0.633 2.921 1.00 0.00 H new ATOM 0 HB2 LEU A 20 1.088 2.658 3.006 1.00 0.00 H new ATOM 0 HB3 LEU A 20 1.930 2.064 4.423 1.00 0.00 H new ATOM 0 HG LEU A 20 2.674 0.084 2.950 1.00 0.00 H new ATOM 0 HD11 LEU A 20 2.766 0.560 0.536 1.00 0.00 H new ATOM 0 HD12 LEU A 20 1.090 0.438 1.122 1.00 0.00 H new ATOM 0 HD13 LEU A 20 1.804 2.035 0.795 1.00 0.00 H new ATOM 0 HD21 LEU A 20 4.551 1.387 2.026 1.00 0.00 H new ATOM 0 HD22 LEU A 20 3.656 2.892 2.342 1.00 0.00 H new ATOM 0 HD23 LEU A 20 4.177 1.865 3.699 1.00 0.00 H new ATOM 258 N LEU A 21 1.096 -0.370 5.742 1.00 0.00 N ATOM 259 CA LEU A 21 1.570 -1.546 6.461 1.00 0.00 C ATOM 260 C LEU A 21 0.442 -2.555 6.657 1.00 0.00 C ATOM 261 O LEU A 21 0.668 -3.765 6.640 1.00 0.00 O ATOM 262 CB LEU A 21 2.150 -1.141 7.817 1.00 0.00 C ATOM 263 CG LEU A 21 2.633 -2.302 8.689 1.00 0.00 C ATOM 264 CD1 LEU A 21 3.828 -2.989 8.047 1.00 0.00 C ATOM 265 CD2 LEU A 21 2.986 -1.808 10.084 1.00 0.00 C ATOM 0 H LEU A 21 1.078 0.485 6.298 1.00 0.00 H new ATOM 0 HA LEU A 21 2.353 -2.015 5.865 1.00 0.00 H new ATOM 0 HB2 LEU A 21 2.985 -0.461 7.649 1.00 0.00 H new ATOM 0 HB3 LEU A 21 1.392 -0.584 8.368 1.00 0.00 H new ATOM 0 HG LEU A 21 1.825 -3.029 8.775 1.00 0.00 H new ATOM 0 HD11 LEU A 21 4.158 -3.812 8.681 1.00 0.00 H new ATOM 0 HD12 LEU A 21 3.543 -3.376 7.069 1.00 0.00 H new ATOM 0 HD13 LEU A 21 4.641 -2.272 7.931 1.00 0.00 H new ATOM 0 HD21 LEU A 21 3.328 -2.646 10.691 1.00 0.00 H new ATOM 0 HD22 LEU A 21 3.778 -1.062 10.016 1.00 0.00 H new ATOM 0 HD23 LEU A 21 2.105 -1.361 10.545 1.00 0.00 H new ATOM 277 N TRP A 22 -0.772 -2.048 6.842 1.00 0.00 N ATOM 278 CA TRP A 22 -1.935 -2.904 7.042 1.00 0.00 C ATOM 279 C TRP A 22 -2.276 -3.664 5.764 1.00 0.00 C ATOM 280 O TRP A 22 -2.779 -4.787 5.813 1.00 0.00 O ATOM 281 CB TRP A 22 -3.137 -2.071 7.489 1.00 0.00 C ATOM 282 CG TRP A 22 -4.186 -2.875 8.196 1.00 0.00 C ATOM 283 CD1 TRP A 22 -4.228 -3.181 9.526 1.00 0.00 C ATOM 284 CD2 TRP A 22 -5.345 -3.476 7.608 1.00 0.00 C ATOM 285 NE1 TRP A 22 -5.342 -3.935 9.801 1.00 0.00 N ATOM 286 CE2 TRP A 22 -6.044 -4.131 8.641 1.00 0.00 C ATOM 287 CE3 TRP A 22 -5.861 -3.526 6.310 1.00 0.00 C ATOM 288 CZ2 TRP A 22 -7.230 -4.825 8.413 1.00 0.00 C ATOM 289 CZ3 TRP A 22 -7.038 -4.215 6.087 1.00 0.00 C ATOM 290 CH2 TRP A 22 -7.711 -4.856 7.134 1.00 0.00 C ATOM 0 H TRP A 22 -0.976 -1.049 6.858 1.00 0.00 H new ATOM 0 HA TRP A 22 -1.693 -3.627 7.821 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -2.793 -1.275 8.149 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -3.583 -1.592 6.617 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -3.492 -2.875 10.255 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -5.604 -4.291 10.720 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -5.349 -3.035 5.496 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 -7.751 -5.321 9.218 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -7.446 -4.260 5.088 1.00 0.00 H new ATOM 0 HH2 TRP A 22 -8.629 -5.386 6.927 1.00 0.00 H new ATOM 301 N ALA A 23 -2.001 -3.046 4.621 1.00 0.00 N ATOM 302 CA ALA A 23 -2.278 -3.663 3.331 1.00 0.00 C ATOM 303 C ALA A 23 -1.324 -4.821 3.058 1.00 0.00 C ATOM 304 O ALA A 23 -1.712 -5.836 2.479 1.00 0.00 O ATOM 305 CB ALA A 23 -2.186 -2.628 2.220 1.00 0.00 C ATOM 0 H ALA A 23 -1.586 -2.116 4.562 1.00 0.00 H new ATOM 0 HA ALA A 23 -3.292 -4.062 3.358 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -2.395 -3.103 1.262 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -2.914 -1.836 2.399 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -1.183 -2.202 2.202 1.00 0.00 H new ATOM 311 N LEU A 24 -0.073 -4.661 3.478 1.00 0.00 N ATOM 312 CA LEU A 24 0.938 -5.695 3.277 1.00 0.00 C ATOM 313 C LEU A 24 0.690 -6.884 4.199 1.00 0.00 C ATOM 314 O LEU A 24 0.893 -8.035 3.811 1.00 0.00 O ATOM 315 CB LEU A 24 2.335 -5.124 3.523 1.00 0.00 C ATOM 316 CG LEU A 24 2.679 -3.878 2.705 1.00 0.00 C ATOM 317 CD1 LEU A 24 3.989 -3.270 3.182 1.00 0.00 C ATOM 318 CD2 LEU A 24 2.756 -4.219 1.224 1.00 0.00 C ATOM 0 H LEU A 24 0.265 -3.827 3.959 1.00 0.00 H new ATOM 0 HA LEU A 24 0.871 -6.040 2.245 1.00 0.00 H new ATOM 0 HB2 LEU A 24 2.431 -4.883 4.582 1.00 0.00 H new ATOM 0 HB3 LEU A 24 3.071 -5.898 3.304 1.00 0.00 H new ATOM 0 HG LEU A 24 1.888 -3.142 2.849 1.00 0.00 H new ATOM 0 HD11 LEU A 24 4.217 -2.385 2.588 1.00 0.00 H new ATOM 0 HD12 LEU A 24 3.899 -2.990 4.231 1.00 0.00 H new ATOM 0 HD13 LEU A 24 4.791 -3.999 3.069 1.00 0.00 H new ATOM 0 HD21 LEU A 24 3.002 -3.322 0.656 1.00 0.00 H new ATOM 0 HD22 LEU A 24 3.527 -4.972 1.064 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.794 -4.608 0.890 1.00 0.00 H new ATOM 330 N ASN A 25 0.252 -6.599 5.421 1.00 0.00 N ATOM 331 CA ASN A 25 -0.023 -7.646 6.398 1.00 0.00 C ATOM 332 C ASN A 25 -1.313 -8.384 6.054 1.00 0.00 C ATOM 333 O ASN A 25 -1.454 -9.574 6.337 1.00 0.00 O ATOM 334 CB ASN A 25 -0.121 -7.048 7.803 1.00 0.00 C ATOM 335 CG ASN A 25 1.191 -7.129 8.558 1.00 0.00 C ATOM 336 OD1 ASN A 25 1.517 -8.158 9.151 1.00 0.00 O ATOM 337 ND2 ASN A 25 1.952 -6.041 8.541 1.00 0.00 N ATOM 0 H ASN A 25 0.080 -5.652 5.758 1.00 0.00 H new ATOM 0 HA ASN A 25 0.800 -8.360 6.372 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -0.432 -6.006 7.730 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -0.894 -7.573 8.365 1.00 0.00 H new ATOM 0 HD21 ASN A 25 2.846 -6.036 9.032 1.00 0.00 H new ATOM 0 HD22 ASN A 25 1.643 -5.210 8.037 1.00 0.00 H new ATOM 344 N ASP A 26 -2.253 -7.670 5.442 1.00 0.00 N ATOM 345 CA ASP A 26 -3.533 -8.256 5.058 1.00 0.00 C ATOM 346 C ASP A 26 -3.385 -9.135 3.818 1.00 0.00 C ATOM 347 O ASP A 26 -4.224 -9.996 3.555 1.00 0.00 O ATOM 348 CB ASP A 26 -4.563 -7.157 4.799 1.00 0.00 C ATOM 349 CG ASP A 26 -5.985 -7.632 5.025 1.00 0.00 C ATOM 350 OD1 ASP A 26 -6.341 -7.904 6.190 1.00 0.00 O ATOM 351 OD2 ASP A 26 -6.741 -7.732 4.037 1.00 0.00 O ATOM 0 H ASP A 26 -2.152 -6.684 5.201 1.00 0.00 H new ATOM 0 HA ASP A 26 -3.877 -8.881 5.882 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -4.358 -6.309 5.453 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -4.460 -6.801 3.774 1.00 0.00 H new ATOM 356 N LEU A 27 -2.317 -8.912 3.056 1.00 0.00 N ATOM 357 CA LEU A 27 -2.065 -9.684 1.843 1.00 0.00 C ATOM 358 C LEU A 27 -2.094 -11.183 2.129 1.00 0.00 C ATOM 359 O LEU A 27 -2.191 -11.604 3.283 1.00 0.00 O ATOM 360 CB LEU A 27 -0.714 -9.295 1.238 1.00 0.00 C ATOM 361 CG LEU A 27 -0.752 -8.097 0.289 1.00 0.00 C ATOM 362 CD1 LEU A 27 0.658 -7.608 -0.008 1.00 0.00 C ATOM 363 CD2 LEU A 27 -1.474 -8.461 -0.999 1.00 0.00 C ATOM 0 H LEU A 27 -1.612 -8.203 3.258 1.00 0.00 H new ATOM 0 HA LEU A 27 -2.857 -9.456 1.129 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -0.020 -9.075 2.049 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -0.313 -10.154 0.699 1.00 0.00 H new ATOM 0 HG LEU A 27 -1.301 -7.290 0.774 1.00 0.00 H new ATOM 0 HD11 LEU A 27 0.612 -6.755 -0.685 1.00 0.00 H new ATOM 0 HD12 LEU A 27 1.142 -7.308 0.921 1.00 0.00 H new ATOM 0 HD13 LEU A 27 1.231 -8.410 -0.473 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -1.492 -7.597 -1.663 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -0.953 -9.284 -1.488 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -2.496 -8.764 -0.770 1.00 0.00 H new ATOM 375 N GLU A 28 -2.008 -11.983 1.071 1.00 0.00 N ATOM 376 CA GLU A 28 -2.025 -13.436 1.208 1.00 0.00 C ATOM 377 C GLU A 28 -0.616 -14.010 1.099 1.00 0.00 C ATOM 378 O GLU A 28 0.363 -13.268 1.007 1.00 0.00 O ATOM 379 CB GLU A 28 -2.926 -14.058 0.140 1.00 0.00 C ATOM 380 CG GLU A 28 -4.357 -13.547 0.179 1.00 0.00 C ATOM 381 CD GLU A 28 -5.166 -14.166 1.302 1.00 0.00 C ATOM 382 OE1 GLU A 28 -4.629 -14.289 2.423 1.00 0.00 O ATOM 383 OE2 GLU A 28 -6.336 -14.528 1.061 1.00 0.00 O ATOM 0 H GLU A 28 -1.926 -11.651 0.110 1.00 0.00 H new ATOM 0 HA GLU A 28 -2.420 -13.679 2.194 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -2.503 -13.855 -0.844 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -2.932 -15.141 0.267 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -4.349 -12.463 0.296 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -4.842 -13.761 -0.774 1.00 0.00 H new ATOM 390 N GLU A 29 -0.520 -15.335 1.110 1.00 0.00 N ATOM 391 CA GLU A 29 0.768 -16.010 1.011 1.00 0.00 C ATOM 392 C GLU A 29 1.243 -16.070 -0.437 1.00 0.00 C ATOM 393 O GLU A 29 2.418 -15.840 -0.726 1.00 0.00 O ATOM 394 CB GLU A 29 0.672 -17.425 1.587 1.00 0.00 C ATOM 395 CG GLU A 29 -0.296 -18.324 0.835 1.00 0.00 C ATOM 396 CD GLU A 29 -0.851 -19.437 1.701 1.00 0.00 C ATOM 397 OE1 GLU A 29 -1.506 -19.128 2.719 1.00 0.00 O ATOM 398 OE2 GLU A 29 -0.634 -20.619 1.361 1.00 0.00 O ATOM 0 H GLU A 29 -1.320 -15.963 1.187 1.00 0.00 H new ATOM 0 HA GLU A 29 1.494 -15.438 1.589 1.00 0.00 H new ATOM 0 HB2 GLU A 29 1.662 -17.881 1.575 1.00 0.00 H new ATOM 0 HB3 GLU A 29 0.362 -17.363 2.630 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -1.120 -17.723 0.450 1.00 0.00 H new ATOM 0 HG3 GLU A 29 0.212 -18.758 -0.027 1.00 0.00 H new ATOM 405 N ASN A 30 0.323 -16.381 -1.344 1.00 0.00 N ATOM 406 CA ASN A 30 0.649 -16.471 -2.763 1.00 0.00 C ATOM 407 C ASN A 30 0.679 -15.087 -3.402 1.00 0.00 C ATOM 408 O ASN A 30 1.459 -14.833 -4.320 1.00 0.00 O ATOM 409 CB ASN A 30 -0.367 -17.359 -3.485 1.00 0.00 C ATOM 410 CG ASN A 30 0.087 -18.802 -3.575 1.00 0.00 C ATOM 411 OD1 ASN A 30 0.818 -19.179 -4.491 1.00 0.00 O ATOM 412 ND2 ASN A 30 -0.346 -19.619 -2.622 1.00 0.00 N ATOM 0 H ASN A 30 -0.654 -16.575 -1.122 1.00 0.00 H new ATOM 0 HA ASN A 30 1.640 -16.915 -2.857 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -1.322 -17.314 -2.961 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -0.536 -16.971 -4.489 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -0.074 -20.602 -2.630 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -0.951 -19.264 -1.881 1.00 0.00 H new ATOM 419 N SER A 31 -0.175 -14.195 -2.911 1.00 0.00 N ATOM 420 CA SER A 31 -0.247 -12.836 -3.434 1.00 0.00 C ATOM 421 C SER A 31 1.009 -12.046 -3.078 1.00 0.00 C ATOM 422 O SER A 31 1.426 -11.157 -3.819 1.00 0.00 O ATOM 423 CB SER A 31 -1.485 -12.121 -2.888 1.00 0.00 C ATOM 424 OG SER A 31 -2.661 -12.865 -3.151 1.00 0.00 O ATOM 0 H SER A 31 -0.827 -14.389 -2.151 1.00 0.00 H new ATOM 0 HA SER A 31 -0.320 -12.896 -4.520 1.00 0.00 H new ATOM 0 HB2 SER A 31 -1.378 -11.972 -1.814 1.00 0.00 H new ATOM 0 HB3 SER A 31 -1.567 -11.133 -3.341 1.00 0.00 H new ATOM 0 HG SER A 31 -3.437 -12.388 -2.791 1.00 0.00 H new ATOM 430 N PHE A 32 1.607 -12.376 -1.937 1.00 0.00 N ATOM 431 CA PHE A 32 2.814 -11.697 -1.483 1.00 0.00 C ATOM 432 C PHE A 32 4.057 -12.307 -2.123 1.00 0.00 C ATOM 433 O PHE A 32 4.996 -11.596 -2.482 1.00 0.00 O ATOM 434 CB PHE A 32 2.923 -11.770 0.040 1.00 0.00 C ATOM 435 CG PHE A 32 3.876 -10.766 0.623 1.00 0.00 C ATOM 436 CD1 PHE A 32 3.773 -9.423 0.297 1.00 0.00 C ATOM 437 CD2 PHE A 32 4.875 -11.165 1.497 1.00 0.00 C ATOM 438 CE1 PHE A 32 4.649 -8.497 0.831 1.00 0.00 C ATOM 439 CE2 PHE A 32 5.754 -10.244 2.034 1.00 0.00 C ATOM 440 CZ PHE A 32 5.640 -8.908 1.701 1.00 0.00 C ATOM 0 H PHE A 32 1.275 -13.109 -1.311 1.00 0.00 H new ATOM 0 HA PHE A 32 2.748 -10.652 -1.786 1.00 0.00 H new ATOM 0 HB2 PHE A 32 1.935 -11.616 0.474 1.00 0.00 H new ATOM 0 HB3 PHE A 32 3.244 -12.772 0.325 1.00 0.00 H new ATOM 0 HD1 PHE A 32 2.999 -9.096 -0.382 1.00 0.00 H new ATOM 0 HD2 PHE A 32 4.967 -12.208 1.761 1.00 0.00 H new ATOM 0 HE1 PHE A 32 4.559 -7.453 0.568 1.00 0.00 H new ATOM 0 HE2 PHE A 32 6.529 -10.568 2.713 1.00 0.00 H new ATOM 0 HZ PHE A 32 6.325 -8.186 2.120 1.00 0.00 H new ATOM 450 N LYS A 33 4.058 -13.629 -2.261 1.00 0.00 N ATOM 451 CA LYS A 33 5.186 -14.335 -2.855 1.00 0.00 C ATOM 452 C LYS A 33 5.439 -13.857 -4.282 1.00 0.00 C ATOM 453 O LYS A 33 6.570 -13.542 -4.650 1.00 0.00 O ATOM 454 CB LYS A 33 4.931 -15.844 -2.849 1.00 0.00 C ATOM 455 CG LYS A 33 5.434 -16.540 -1.596 1.00 0.00 C ATOM 456 CD LYS A 33 4.738 -17.874 -1.381 1.00 0.00 C ATOM 457 CE LYS A 33 4.456 -18.125 0.091 1.00 0.00 C ATOM 458 NZ LYS A 33 5.571 -18.857 0.753 1.00 0.00 N ATOM 0 H LYS A 33 3.289 -14.233 -1.969 1.00 0.00 H new ATOM 0 HA LYS A 33 6.071 -14.120 -2.257 1.00 0.00 H new ATOM 0 HB2 LYS A 33 3.861 -16.024 -2.950 1.00 0.00 H new ATOM 0 HB3 LYS A 33 5.412 -16.289 -3.720 1.00 0.00 H new ATOM 0 HG2 LYS A 33 6.510 -16.698 -1.674 1.00 0.00 H new ATOM 0 HG3 LYS A 33 5.268 -15.898 -0.731 1.00 0.00 H new ATOM 0 HD2 LYS A 33 3.802 -17.891 -1.940 1.00 0.00 H new ATOM 0 HD3 LYS A 33 5.360 -18.678 -1.775 1.00 0.00 H new ATOM 0 HE2 LYS A 33 4.295 -17.173 0.597 1.00 0.00 H new ATOM 0 HE3 LYS A 33 3.535 -18.699 0.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 5.340 -19.008 1.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 5.708 -19.776 0.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 6.445 -18.298 0.680 1.00 0.00 H new ATOM 472 N THR A 34 4.378 -13.807 -5.081 1.00 0.00 N ATOM 473 CA THR A 34 4.485 -13.367 -6.468 1.00 0.00 C ATOM 474 C THR A 34 4.740 -11.866 -6.546 1.00 0.00 C ATOM 475 O THR A 34 5.541 -11.403 -7.358 1.00 0.00 O ATOM 476 CB THR A 34 3.211 -13.720 -7.237 1.00 0.00 C ATOM 477 OG1 THR A 34 2.645 -14.923 -6.744 1.00 0.00 O ATOM 478 CG2 THR A 34 3.436 -13.894 -8.723 1.00 0.00 C ATOM 0 H THR A 34 3.435 -14.066 -4.792 1.00 0.00 H new ATOM 0 HA THR A 34 5.330 -13.884 -6.922 1.00 0.00 H new ATOM 0 HB THR A 34 2.539 -12.875 -7.085 1.00 0.00 H new ATOM 0 HG1 THR A 34 2.114 -14.731 -5.943 1.00 0.00 H new ATOM 0 HG21 THR A 34 2.492 -14.143 -9.207 1.00 0.00 H new ATOM 0 HG22 THR A 34 3.826 -12.967 -9.143 1.00 0.00 H new ATOM 0 HG23 THR A 34 4.153 -14.698 -8.891 1.00 0.00 H new ATOM 486 N LEU A 35 4.052 -11.109 -5.697 1.00 0.00 N ATOM 487 CA LEU A 35 4.203 -9.659 -5.670 1.00 0.00 C ATOM 488 C LEU A 35 5.612 -9.262 -5.237 1.00 0.00 C ATOM 489 O LEU A 35 6.104 -8.193 -5.596 1.00 0.00 O ATOM 490 CB LEU A 35 3.173 -9.035 -4.727 1.00 0.00 C ATOM 491 CG LEU A 35 3.137 -7.507 -4.726 1.00 0.00 C ATOM 492 CD1 LEU A 35 2.463 -6.988 -5.988 1.00 0.00 C ATOM 493 CD2 LEU A 35 2.422 -6.991 -3.487 1.00 0.00 C ATOM 0 H LEU A 35 3.384 -11.476 -5.019 1.00 0.00 H new ATOM 0 HA LEU A 35 4.036 -9.285 -6.680 1.00 0.00 H new ATOM 0 HB2 LEU A 35 2.184 -9.406 -4.997 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.376 -9.379 -3.713 1.00 0.00 H new ATOM 0 HG LEU A 35 4.163 -7.139 -4.709 1.00 0.00 H new ATOM 0 HD11 LEU A 35 2.446 -5.898 -5.970 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.017 -7.328 -6.863 1.00 0.00 H new ATOM 0 HD13 LEU A 35 1.442 -7.366 -6.037 1.00 0.00 H new ATOM 0 HD21 LEU A 35 2.406 -5.901 -3.503 1.00 0.00 H new ATOM 0 HD22 LEU A 35 1.400 -7.369 -3.473 1.00 0.00 H new ATOM 0 HD23 LEU A 35 2.947 -7.333 -2.595 1.00 0.00 H new ATOM 505 N LYS A 36 6.256 -10.130 -4.460 1.00 0.00 N ATOM 506 CA LYS A 36 7.608 -9.867 -3.977 1.00 0.00 C ATOM 507 C LYS A 36 8.565 -9.613 -5.138 1.00 0.00 C ATOM 508 O LYS A 36 9.476 -8.792 -5.034 1.00 0.00 O ATOM 509 CB LYS A 36 8.107 -11.045 -3.137 1.00 0.00 C ATOM 510 CG LYS A 36 7.855 -10.880 -1.647 1.00 0.00 C ATOM 511 CD LYS A 36 9.000 -11.444 -0.821 1.00 0.00 C ATOM 512 CE LYS A 36 8.492 -12.179 0.408 1.00 0.00 C ATOM 513 NZ LYS A 36 7.674 -13.370 0.046 1.00 0.00 N ATOM 0 H LYS A 36 5.864 -11.020 -4.152 1.00 0.00 H new ATOM 0 HA LYS A 36 7.577 -8.971 -3.356 1.00 0.00 H new ATOM 0 HB2 LYS A 36 7.620 -11.958 -3.481 1.00 0.00 H new ATOM 0 HB3 LYS A 36 9.177 -11.172 -3.304 1.00 0.00 H new ATOM 0 HG2 LYS A 36 7.724 -9.823 -1.414 1.00 0.00 H new ATOM 0 HG3 LYS A 36 6.927 -11.384 -1.376 1.00 0.00 H new ATOM 0 HD2 LYS A 36 9.592 -12.124 -1.434 1.00 0.00 H new ATOM 0 HD3 LYS A 36 9.662 -10.634 -0.514 1.00 0.00 H new ATOM 0 HE2 LYS A 36 9.339 -12.492 1.019 1.00 0.00 H new ATOM 0 HE3 LYS A 36 7.894 -11.500 1.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 7.756 -14.088 0.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 6.678 -13.089 -0.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 8.016 -13.766 -0.853 1.00 0.00 H new ATOM 527 N PHE A 37 8.353 -10.323 -6.242 1.00 0.00 N ATOM 528 CA PHE A 37 9.200 -10.173 -7.420 1.00 0.00 C ATOM 529 C PHE A 37 8.800 -8.940 -8.225 1.00 0.00 C ATOM 530 O PHE A 37 9.642 -8.293 -8.847 1.00 0.00 O ATOM 531 CB PHE A 37 9.112 -11.423 -8.298 1.00 0.00 C ATOM 532 CG PHE A 37 10.440 -11.866 -8.843 1.00 0.00 C ATOM 533 CD1 PHE A 37 11.157 -11.051 -9.704 1.00 0.00 C ATOM 534 CD2 PHE A 37 10.970 -13.097 -8.494 1.00 0.00 C ATOM 535 CE1 PHE A 37 12.380 -11.455 -10.206 1.00 0.00 C ATOM 536 CE2 PHE A 37 12.193 -13.508 -8.993 1.00 0.00 C ATOM 537 CZ PHE A 37 12.897 -12.686 -9.851 1.00 0.00 C ATOM 0 H PHE A 37 7.603 -11.007 -6.345 1.00 0.00 H new ATOM 0 HA PHE A 37 10.229 -10.045 -7.084 1.00 0.00 H new ATOM 0 HB2 PHE A 37 8.677 -12.236 -7.717 1.00 0.00 H new ATOM 0 HB3 PHE A 37 8.434 -11.227 -9.129 1.00 0.00 H new ATOM 0 HD1 PHE A 37 10.756 -10.089 -9.986 1.00 0.00 H new ATOM 0 HD2 PHE A 37 10.422 -13.744 -7.825 1.00 0.00 H new ATOM 0 HE1 PHE A 37 12.930 -10.810 -10.874 1.00 0.00 H new ATOM 0 HE2 PHE A 37 12.596 -14.470 -8.712 1.00 0.00 H new ATOM 0 HZ PHE A 37 13.851 -13.005 -10.244 1.00 0.00 H new ATOM 547 N HIS A 38 7.510 -8.621 -8.207 1.00 0.00 N ATOM 548 CA HIS A 38 6.998 -7.466 -8.936 1.00 0.00 C ATOM 549 C HIS A 38 7.574 -6.167 -8.376 1.00 0.00 C ATOM 550 O HIS A 38 7.671 -5.165 -9.084 1.00 0.00 O ATOM 551 CB HIS A 38 5.470 -7.433 -8.871 1.00 0.00 C ATOM 552 CG HIS A 38 4.810 -7.759 -10.175 1.00 0.00 C ATOM 553 ND1 HIS A 38 4.996 -7.036 -11.332 1.00 0.00 N ATOM 554 CD2 HIS A 38 3.947 -8.758 -10.494 1.00 0.00 C ATOM 555 CE1 HIS A 38 4.259 -7.604 -12.296 1.00 0.00 C ATOM 556 NE2 HIS A 38 3.604 -8.654 -11.838 1.00 0.00 N ATOM 0 H HIS A 38 6.800 -9.146 -7.696 1.00 0.00 H new ATOM 0 HA HIS A 38 7.308 -7.558 -9.977 1.00 0.00 H new ATOM 0 HB2 HIS A 38 5.131 -8.141 -8.114 1.00 0.00 H new ATOM 0 HB3 HIS A 38 5.149 -6.443 -8.548 1.00 0.00 H new ATOM 0 HD1 HIS A 38 5.590 -6.213 -11.437 1.00 0.00 H new ATOM 0 HD2 HIS A 38 3.585 -9.513 -9.812 1.00 0.00 H new ATOM 0 HE1 HIS A 38 4.208 -7.249 -13.315 1.00 0.00 H new ATOM 564 N LEU A 39 7.952 -6.190 -7.101 1.00 0.00 N ATOM 565 CA LEU A 39 8.516 -5.014 -6.448 1.00 0.00 C ATOM 566 C LEU A 39 9.737 -4.498 -7.205 1.00 0.00 C ATOM 567 O LEU A 39 10.024 -3.301 -7.197 1.00 0.00 O ATOM 568 CB LEU A 39 8.899 -5.342 -5.003 1.00 0.00 C ATOM 569 CG LEU A 39 7.727 -5.701 -4.088 1.00 0.00 C ATOM 570 CD1 LEU A 39 8.232 -6.260 -2.768 1.00 0.00 C ATOM 571 CD2 LEU A 39 6.845 -4.485 -3.852 1.00 0.00 C ATOM 0 H LEU A 39 7.878 -7.011 -6.500 1.00 0.00 H new ATOM 0 HA LEU A 39 7.756 -4.232 -6.449 1.00 0.00 H new ATOM 0 HB2 LEU A 39 9.603 -6.174 -5.010 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.422 -4.485 -4.579 1.00 0.00 H new ATOM 0 HG LEU A 39 7.129 -6.469 -4.578 1.00 0.00 H new ATOM 0 HD11 LEU A 39 7.384 -6.510 -2.130 1.00 0.00 H new ATOM 0 HD12 LEU A 39 8.822 -7.157 -2.955 1.00 0.00 H new ATOM 0 HD13 LEU A 39 8.853 -5.515 -2.271 1.00 0.00 H new ATOM 0 HD21 LEU A 39 6.016 -4.758 -3.199 1.00 0.00 H new ATOM 0 HD22 LEU A 39 7.432 -3.695 -3.383 1.00 0.00 H new ATOM 0 HD23 LEU A 39 6.454 -4.129 -4.805 1.00 0.00 H new ATOM 583 N ARG A 40 10.453 -5.409 -7.856 1.00 0.00 N ATOM 584 CA ARG A 40 11.644 -5.045 -8.617 1.00 0.00 C ATOM 585 C ARG A 40 11.274 -4.204 -9.835 1.00 0.00 C ATOM 586 O ARG A 40 12.054 -3.358 -10.276 1.00 0.00 O ATOM 587 CB ARG A 40 12.397 -6.301 -9.059 1.00 0.00 C ATOM 588 CG ARG A 40 13.852 -6.045 -9.416 1.00 0.00 C ATOM 589 CD ARG A 40 14.576 -7.335 -9.768 1.00 0.00 C ATOM 590 NE ARG A 40 15.749 -7.095 -10.604 1.00 0.00 N ATOM 591 CZ ARG A 40 15.692 -6.866 -11.915 1.00 0.00 C ATOM 592 NH1 ARG A 40 14.523 -6.844 -12.541 1.00 0.00 N ATOM 593 NH2 ARG A 40 16.808 -6.657 -12.600 1.00 0.00 N ATOM 0 H ARG A 40 10.230 -6.404 -7.872 1.00 0.00 H new ATOM 0 HA ARG A 40 12.291 -4.452 -7.971 1.00 0.00 H new ATOM 0 HB2 ARG A 40 12.353 -7.041 -8.260 1.00 0.00 H new ATOM 0 HB3 ARG A 40 11.891 -6.733 -9.922 1.00 0.00 H new ATOM 0 HG2 ARG A 40 13.905 -5.356 -10.259 1.00 0.00 H new ATOM 0 HG3 ARG A 40 14.354 -5.562 -8.577 1.00 0.00 H new ATOM 0 HD2 ARG A 40 14.881 -7.841 -8.852 1.00 0.00 H new ATOM 0 HD3 ARG A 40 13.891 -8.004 -10.288 1.00 0.00 H new ATOM 0 HE ARG A 40 16.666 -7.103 -10.158 1.00 0.00 H new ATOM 0 HH11 ARG A 40 13.662 -7.003 -12.018 1.00 0.00 H new ATOM 0 HH12 ARG A 40 14.485 -6.668 -13.545 1.00 0.00 H new ATOM 0 HH21 ARG A 40 17.709 -6.672 -12.123 1.00 0.00 H new ATOM 0 HH22 ARG A 40 16.765 -6.482 -13.604 1.00 0.00 H new ATOM 607 N ASP A 41 10.084 -4.440 -10.374 1.00 0.00 N ATOM 608 CA ASP A 41 9.612 -3.706 -11.542 1.00 0.00 C ATOM 609 C ASP A 41 9.235 -2.275 -11.171 1.00 0.00 C ATOM 610 O ASP A 41 9.646 -1.322 -11.833 1.00 0.00 O ATOM 611 CB ASP A 41 8.409 -4.416 -12.167 1.00 0.00 C ATOM 612 CG ASP A 41 8.431 -4.366 -13.682 1.00 0.00 C ATOM 613 OD1 ASP A 41 8.496 -3.249 -14.238 1.00 0.00 O ATOM 614 OD2 ASP A 41 8.383 -5.443 -14.313 1.00 0.00 O ATOM 0 H ASP A 41 9.427 -5.135 -10.020 1.00 0.00 H new ATOM 0 HA ASP A 41 10.423 -3.672 -12.269 1.00 0.00 H new ATOM 0 HB2 ASP A 41 8.395 -5.456 -11.841 1.00 0.00 H new ATOM 0 HB3 ASP A 41 7.490 -3.955 -11.804 1.00 0.00 H new ATOM 619 N VAL A 42 8.447 -2.131 -10.110 1.00 0.00 N ATOM 620 CA VAL A 42 8.013 -0.816 -9.653 1.00 0.00 C ATOM 621 C VAL A 42 9.183 -0.006 -9.106 1.00 0.00 C ATOM 622 O VAL A 42 9.231 1.214 -9.260 1.00 0.00 O ATOM 623 CB VAL A 42 6.929 -0.929 -8.565 1.00 0.00 C ATOM 624 CG1 VAL A 42 5.601 -1.351 -9.175 1.00 0.00 C ATOM 625 CG2 VAL A 42 7.361 -1.906 -7.481 1.00 0.00 C ATOM 0 H VAL A 42 8.096 -2.909 -9.551 1.00 0.00 H new ATOM 0 HA VAL A 42 7.596 -0.304 -10.520 1.00 0.00 H new ATOM 0 HB VAL A 42 6.796 0.051 -8.107 1.00 0.00 H new ATOM 0 HG11 VAL A 42 4.848 -1.425 -8.391 1.00 0.00 H new ATOM 0 HG12 VAL A 42 5.287 -0.611 -9.911 1.00 0.00 H new ATOM 0 HG13 VAL A 42 5.715 -2.320 -9.661 1.00 0.00 H new ATOM 0 HG21 VAL A 42 6.583 -1.973 -6.721 1.00 0.00 H new ATOM 0 HG22 VAL A 42 7.524 -2.890 -7.922 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.286 -1.556 -7.023 1.00 0.00 H new ATOM 635 N THR A 43 10.126 -0.692 -8.467 1.00 0.00 N ATOM 636 CA THR A 43 11.296 -0.033 -7.898 1.00 0.00 C ATOM 637 C THR A 43 12.346 0.236 -8.972 1.00 0.00 C ATOM 638 O THR A 43 12.615 1.387 -9.315 1.00 0.00 O ATOM 639 CB THR A 43 11.898 -0.891 -6.783 1.00 0.00 C ATOM 640 OG1 THR A 43 12.311 -2.149 -7.286 1.00 0.00 O ATOM 641 CG2 THR A 43 10.940 -1.144 -5.639 1.00 0.00 C ATOM 0 H THR A 43 10.103 -1.703 -8.331 1.00 0.00 H new ATOM 0 HA THR A 43 10.977 0.922 -7.481 1.00 0.00 H new ATOM 0 HB THR A 43 12.746 -0.320 -6.405 1.00 0.00 H new ATOM 0 HG1 THR A 43 11.654 -2.832 -7.037 1.00 0.00 H new ATOM 0 HG21 THR A 43 11.430 -1.758 -4.883 1.00 0.00 H new ATOM 0 HG22 THR A 43 10.642 -0.193 -5.197 1.00 0.00 H new ATOM 0 HG23 THR A 43 10.057 -1.663 -6.012 1.00 0.00 H new ATOM 649 N GLN A 44 12.934 -0.832 -9.499 1.00 0.00 N ATOM 650 CA GLN A 44 13.954 -0.711 -10.534 1.00 0.00 C ATOM 651 C GLN A 44 15.160 0.070 -10.022 1.00 0.00 C ATOM 652 O GLN A 44 15.780 0.831 -10.766 1.00 0.00 O ATOM 653 CB GLN A 44 13.374 -0.025 -11.772 1.00 0.00 C ATOM 654 CG GLN A 44 14.172 -0.281 -13.040 1.00 0.00 C ATOM 655 CD GLN A 44 13.629 -1.447 -13.845 1.00 0.00 C ATOM 656 OE1 GLN A 44 12.946 -1.256 -14.851 1.00 0.00 O ATOM 657 NE2 GLN A 44 13.930 -2.662 -13.403 1.00 0.00 N ATOM 0 H GLN A 44 12.722 -1.792 -9.226 1.00 0.00 H new ATOM 0 HA GLN A 44 14.283 -1.714 -10.804 1.00 0.00 H new ATOM 0 HB2 GLN A 44 12.350 -0.369 -11.921 1.00 0.00 H new ATOM 0 HB3 GLN A 44 13.327 1.049 -11.593 1.00 0.00 H new ATOM 0 HG2 GLN A 44 14.164 0.617 -13.658 1.00 0.00 H new ATOM 0 HG3 GLN A 44 15.211 -0.478 -12.777 1.00 0.00 H new ATOM 0 HE21 GLN A 44 14.500 -2.773 -12.564 1.00 0.00 H new ATOM 0 HE22 GLN A 44 13.592 -3.485 -13.902 1.00 0.00 H new ATOM 666 N PHE A 45 15.488 -0.123 -8.749 1.00 0.00 N ATOM 667 CA PHE A 45 16.620 0.564 -8.140 1.00 0.00 C ATOM 668 C PHE A 45 17.848 -0.340 -8.099 1.00 0.00 C ATOM 669 O PHE A 45 18.836 -0.095 -8.791 1.00 0.00 O ATOM 670 CB PHE A 45 16.263 1.025 -6.725 1.00 0.00 C ATOM 671 CG PHE A 45 16.910 2.324 -6.336 1.00 0.00 C ATOM 672 CD1 PHE A 45 18.264 2.527 -6.542 1.00 0.00 C ATOM 673 CD2 PHE A 45 16.162 3.340 -5.764 1.00 0.00 C ATOM 674 CE1 PHE A 45 18.862 3.721 -6.184 1.00 0.00 C ATOM 675 CE2 PHE A 45 16.754 4.536 -5.404 1.00 0.00 C ATOM 676 CZ PHE A 45 18.105 4.727 -5.615 1.00 0.00 C ATOM 0 H PHE A 45 14.986 -0.749 -8.120 1.00 0.00 H new ATOM 0 HA PHE A 45 16.854 1.436 -8.750 1.00 0.00 H new ATOM 0 HB2 PHE A 45 15.181 1.130 -6.648 1.00 0.00 H new ATOM 0 HB3 PHE A 45 16.560 0.253 -6.014 1.00 0.00 H new ATOM 0 HD1 PHE A 45 18.860 1.744 -6.987 1.00 0.00 H new ATOM 0 HD2 PHE A 45 15.105 3.196 -5.598 1.00 0.00 H new ATOM 0 HE1 PHE A 45 19.919 3.867 -6.349 1.00 0.00 H new ATOM 0 HE2 PHE A 45 16.160 5.320 -4.958 1.00 0.00 H new ATOM 0 HZ PHE A 45 18.569 5.661 -5.336 1.00 0.00 H new ATOM 686 N HIS A 46 17.778 -1.387 -7.284 1.00 0.00 N ATOM 687 CA HIS A 46 18.885 -2.329 -7.154 1.00 0.00 C ATOM 688 C HIS A 46 18.520 -3.470 -6.208 1.00 0.00 C ATOM 689 O HIS A 46 19.356 -3.943 -5.438 1.00 0.00 O ATOM 690 CB HIS A 46 20.136 -1.612 -6.646 1.00 0.00 C ATOM 691 CG HIS A 46 21.412 -2.311 -7.001 1.00 0.00 C ATOM 692 ND1 HIS A 46 21.476 -3.610 -7.453 1.00 0.00 N ATOM 693 CD2 HIS A 46 22.693 -1.864 -6.964 1.00 0.00 C ATOM 694 CE1 HIS A 46 22.764 -3.906 -7.672 1.00 0.00 C ATOM 695 NE2 HIS A 46 23.544 -2.881 -7.390 1.00 0.00 N ATOM 0 H HIS A 46 16.968 -1.605 -6.704 1.00 0.00 H new ATOM 0 HA HIS A 46 19.090 -2.748 -8.139 1.00 0.00 H new ATOM 0 HB2 HIS A 46 20.158 -0.602 -7.056 1.00 0.00 H new ATOM 0 HB3 HIS A 46 20.074 -1.514 -5.562 1.00 0.00 H new ATOM 0 HD2 HIS A 46 23.003 -0.877 -6.654 1.00 0.00 H new ATOM 0 HE1 HIS A 46 23.118 -4.861 -8.033 1.00 0.00 H new ATOM 0 HE2 HIS A 46 24.560 -2.841 -7.468 1.00 0.00 H new ATOM 703 N LEU A 47 17.266 -3.907 -6.273 1.00 0.00 N ATOM 704 CA LEU A 47 16.791 -4.993 -5.422 1.00 0.00 C ATOM 705 C LEU A 47 16.583 -6.269 -6.234 1.00 0.00 C ATOM 706 O LEU A 47 15.451 -6.705 -6.444 1.00 0.00 O ATOM 707 CB LEU A 47 15.486 -4.592 -4.731 1.00 0.00 C ATOM 708 CG LEU A 47 15.538 -3.268 -3.970 1.00 0.00 C ATOM 709 CD1 LEU A 47 14.137 -2.827 -3.571 1.00 0.00 C ATOM 710 CD2 LEU A 47 16.428 -3.393 -2.742 1.00 0.00 C ATOM 0 H LEU A 47 16.561 -3.527 -6.905 1.00 0.00 H new ATOM 0 HA LEU A 47 17.549 -5.188 -4.664 1.00 0.00 H new ATOM 0 HB2 LEU A 47 14.699 -4.531 -5.482 1.00 0.00 H new ATOM 0 HB3 LEU A 47 15.203 -5.382 -4.036 1.00 0.00 H new ATOM 0 HG LEU A 47 15.963 -2.510 -4.627 1.00 0.00 H new ATOM 0 HD11 LEU A 47 14.193 -1.882 -3.030 1.00 0.00 H new ATOM 0 HD12 LEU A 47 13.528 -2.697 -4.466 1.00 0.00 H new ATOM 0 HD13 LEU A 47 13.685 -3.585 -2.931 1.00 0.00 H new ATOM 0 HD21 LEU A 47 16.453 -2.441 -2.212 1.00 0.00 H new ATOM 0 HD22 LEU A 47 16.031 -4.165 -2.082 1.00 0.00 H new ATOM 0 HD23 LEU A 47 17.438 -3.663 -3.051 1.00 0.00 H new ATOM 722 N ALA A 48 17.682 -6.861 -6.687 1.00 0.00 N ATOM 723 CA ALA A 48 17.622 -8.085 -7.475 1.00 0.00 C ATOM 724 C ALA A 48 17.658 -9.317 -6.575 1.00 0.00 C ATOM 725 O ALA A 48 16.774 -10.172 -6.641 1.00 0.00 O ATOM 726 CB ALA A 48 18.766 -8.124 -8.478 1.00 0.00 C ATOM 0 H ALA A 48 18.626 -6.512 -6.522 1.00 0.00 H new ATOM 0 HA ALA A 48 16.678 -8.093 -8.020 1.00 0.00 H new ATOM 0 HB1 ALA A 48 18.709 -9.044 -9.060 1.00 0.00 H new ATOM 0 HB2 ALA A 48 18.693 -7.267 -9.147 1.00 0.00 H new ATOM 0 HB3 ALA A 48 19.717 -8.089 -7.947 1.00 0.00 H new ATOM 732 N ARG A 49 18.686 -9.401 -5.737 1.00 0.00 N ATOM 733 CA ARG A 49 18.837 -10.528 -4.823 1.00 0.00 C ATOM 734 C ARG A 49 19.669 -10.134 -3.608 1.00 0.00 C ATOM 735 O ARG A 49 20.633 -9.377 -3.721 1.00 0.00 O ATOM 736 CB ARG A 49 19.489 -11.710 -5.542 1.00 0.00 C ATOM 737 CG ARG A 49 20.676 -11.319 -6.407 1.00 0.00 C ATOM 738 CD ARG A 49 21.275 -12.525 -7.112 1.00 0.00 C ATOM 739 NE ARG A 49 22.505 -12.979 -6.469 1.00 0.00 N ATOM 740 CZ ARG A 49 23.690 -12.397 -6.639 1.00 0.00 C ATOM 741 NH1 ARG A 49 23.810 -11.340 -7.432 1.00 0.00 N ATOM 742 NH2 ARG A 49 24.759 -12.873 -6.015 1.00 0.00 N ATOM 0 H ARG A 49 19.427 -8.703 -5.672 1.00 0.00 H new ATOM 0 HA ARG A 49 17.845 -10.823 -4.481 1.00 0.00 H new ATOM 0 HB2 ARG A 49 19.815 -12.440 -4.801 1.00 0.00 H new ATOM 0 HB3 ARG A 49 18.742 -12.201 -6.166 1.00 0.00 H new ATOM 0 HG2 ARG A 49 20.361 -10.583 -7.147 1.00 0.00 H new ATOM 0 HG3 ARG A 49 21.437 -10.843 -5.788 1.00 0.00 H new ATOM 0 HD2 ARG A 49 20.549 -13.338 -7.120 1.00 0.00 H new ATOM 0 HD3 ARG A 49 21.482 -12.272 -8.152 1.00 0.00 H new ATOM 0 HE ARG A 49 22.453 -13.790 -5.853 1.00 0.00 H new ATOM 0 HH11 ARG A 49 22.992 -10.969 -7.915 1.00 0.00 H new ATOM 0 HH12 ARG A 49 24.721 -10.898 -7.558 1.00 0.00 H new ATOM 0 HH21 ARG A 49 24.673 -13.686 -5.404 1.00 0.00 H new ATOM 0 HH22 ARG A 49 25.667 -12.427 -6.146 1.00 0.00 H new ATOM 756 N GLY A 50 19.290 -10.654 -2.444 1.00 0.00 N ATOM 757 CA GLY A 50 20.013 -10.345 -1.224 1.00 0.00 C ATOM 758 C GLY A 50 19.351 -9.243 -0.421 1.00 0.00 C ATOM 759 O GLY A 50 19.398 -9.248 0.809 1.00 0.00 O ATOM 0 H GLY A 50 18.496 -11.283 -2.324 1.00 0.00 H new ATOM 0 HA2 GLY A 50 20.086 -11.243 -0.611 1.00 0.00 H new ATOM 0 HA3 GLY A 50 21.031 -10.047 -1.474 1.00 0.00 H new ATOM 763 N GLU A 51 18.734 -8.294 -1.117 1.00 0.00 N ATOM 764 CA GLU A 51 18.061 -7.179 -0.461 1.00 0.00 C ATOM 765 C GLU A 51 16.551 -7.265 -0.653 1.00 0.00 C ATOM 766 O GLU A 51 15.780 -6.885 0.228 1.00 0.00 O ATOM 767 CB GLU A 51 18.581 -5.849 -1.010 1.00 0.00 C ATOM 768 CG GLU A 51 20.087 -5.684 -0.879 1.00 0.00 C ATOM 769 CD GLU A 51 20.667 -4.765 -1.937 1.00 0.00 C ATOM 770 OE1 GLU A 51 20.401 -4.997 -3.135 1.00 0.00 O ATOM 771 OE2 GLU A 51 21.385 -3.812 -1.566 1.00 0.00 O ATOM 0 H GLU A 51 18.686 -8.275 -2.136 1.00 0.00 H new ATOM 0 HA GLU A 51 18.277 -7.234 0.606 1.00 0.00 H new ATOM 0 HB2 GLU A 51 18.305 -5.766 -2.061 1.00 0.00 H new ATOM 0 HB3 GLU A 51 18.087 -5.031 -0.486 1.00 0.00 H new ATOM 0 HG2 GLU A 51 20.321 -5.288 0.109 1.00 0.00 H new ATOM 0 HG3 GLU A 51 20.564 -6.662 -0.951 1.00 0.00 H new ATOM 778 N LEU A 52 16.133 -7.765 -1.811 1.00 0.00 N ATOM 779 CA LEU A 52 14.715 -7.901 -2.120 1.00 0.00 C ATOM 780 C LEU A 52 14.093 -9.051 -1.334 1.00 0.00 C ATOM 781 O LEU A 52 12.931 -8.986 -0.932 1.00 0.00 O ATOM 782 CB LEU A 52 14.515 -8.127 -3.620 1.00 0.00 C ATOM 783 CG LEU A 52 13.061 -8.088 -4.093 1.00 0.00 C ATOM 784 CD1 LEU A 52 12.640 -6.660 -4.405 1.00 0.00 C ATOM 785 CD2 LEU A 52 12.875 -8.979 -5.312 1.00 0.00 C ATOM 0 H LEU A 52 16.758 -8.083 -2.552 1.00 0.00 H new ATOM 0 HA LEU A 52 14.218 -6.975 -1.830 1.00 0.00 H new ATOM 0 HB2 LEU A 52 15.078 -7.369 -4.164 1.00 0.00 H new ATOM 0 HB3 LEU A 52 14.942 -9.094 -3.886 1.00 0.00 H new ATOM 0 HG LEU A 52 12.426 -8.465 -3.291 1.00 0.00 H new ATOM 0 HD11 LEU A 52 11.603 -6.651 -4.740 1.00 0.00 H new ATOM 0 HD12 LEU A 52 12.737 -6.048 -3.508 1.00 0.00 H new ATOM 0 HD13 LEU A 52 13.278 -6.256 -5.191 1.00 0.00 H new ATOM 0 HD21 LEU A 52 11.835 -8.940 -5.636 1.00 0.00 H new ATOM 0 HD22 LEU A 52 13.520 -8.631 -6.119 1.00 0.00 H new ATOM 0 HD23 LEU A 52 13.137 -10.006 -5.056 1.00 0.00 H new ATOM 797 N GLU A 53 14.875 -10.104 -1.118 1.00 0.00 N ATOM 798 CA GLU A 53 14.401 -11.269 -0.380 1.00 0.00 C ATOM 799 C GLU A 53 14.414 -11.005 1.123 1.00 0.00 C ATOM 800 O GLU A 53 13.509 -11.423 1.845 1.00 0.00 O ATOM 801 CB GLU A 53 15.264 -12.490 -0.702 1.00 0.00 C ATOM 802 CG GLU A 53 15.017 -13.061 -2.089 1.00 0.00 C ATOM 803 CD GLU A 53 16.211 -12.900 -3.010 1.00 0.00 C ATOM 804 OE1 GLU A 53 17.034 -11.994 -2.761 1.00 0.00 O ATOM 805 OE2 GLU A 53 16.322 -13.679 -3.979 1.00 0.00 O ATOM 0 H GLU A 53 15.839 -10.174 -1.443 1.00 0.00 H new ATOM 0 HA GLU A 53 13.374 -11.468 -0.687 1.00 0.00 H new ATOM 0 HB2 GLU A 53 16.315 -12.215 -0.613 1.00 0.00 H new ATOM 0 HB3 GLU A 53 15.073 -13.265 0.040 1.00 0.00 H new ATOM 0 HG2 GLU A 53 14.770 -14.119 -2.003 1.00 0.00 H new ATOM 0 HG3 GLU A 53 14.152 -12.567 -2.532 1.00 0.00 H new ATOM 812 N SER A 54 15.446 -10.309 1.587 1.00 0.00 N ATOM 813 CA SER A 54 15.579 -9.988 3.004 1.00 0.00 C ATOM 814 C SER A 54 14.430 -9.099 3.470 1.00 0.00 C ATOM 815 O SER A 54 14.027 -9.148 4.632 1.00 0.00 O ATOM 816 CB SER A 54 16.916 -9.293 3.268 1.00 0.00 C ATOM 817 OG SER A 54 17.369 -8.602 2.117 1.00 0.00 O ATOM 0 H SER A 54 16.203 -9.956 1.002 1.00 0.00 H new ATOM 0 HA SER A 54 15.545 -10.921 3.567 1.00 0.00 H new ATOM 0 HB2 SER A 54 16.808 -8.593 4.097 1.00 0.00 H new ATOM 0 HB3 SER A 54 17.660 -10.031 3.569 1.00 0.00 H new ATOM 0 HG SER A 54 18.033 -9.149 1.648 1.00 0.00 H new ATOM 823 N LEU A 55 13.907 -8.287 2.557 1.00 0.00 N ATOM 824 CA LEU A 55 12.803 -7.387 2.876 1.00 0.00 C ATOM 825 C LEU A 55 11.595 -8.165 3.386 1.00 0.00 C ATOM 826 O LEU A 55 11.159 -9.133 2.763 1.00 0.00 O ATOM 827 CB LEU A 55 12.415 -6.566 1.644 1.00 0.00 C ATOM 828 CG LEU A 55 13.145 -5.229 1.502 1.00 0.00 C ATOM 829 CD1 LEU A 55 12.952 -4.664 0.102 1.00 0.00 C ATOM 830 CD2 LEU A 55 12.658 -4.240 2.552 1.00 0.00 C ATOM 0 H LEU A 55 14.229 -8.233 1.591 1.00 0.00 H new ATOM 0 HA LEU A 55 13.134 -6.711 3.665 1.00 0.00 H new ATOM 0 HB2 LEU A 55 12.606 -7.164 0.753 1.00 0.00 H new ATOM 0 HB3 LEU A 55 11.342 -6.376 1.676 1.00 0.00 H new ATOM 0 HG LEU A 55 14.210 -5.398 1.660 1.00 0.00 H new ATOM 0 HD11 LEU A 55 13.478 -3.713 0.018 1.00 0.00 H new ATOM 0 HD12 LEU A 55 13.351 -5.365 -0.631 1.00 0.00 H new ATOM 0 HD13 LEU A 55 11.889 -4.509 -0.084 1.00 0.00 H new ATOM 0 HD21 LEU A 55 13.188 -3.295 2.435 1.00 0.00 H new ATOM 0 HD22 LEU A 55 11.588 -4.074 2.427 1.00 0.00 H new ATOM 0 HD23 LEU A 55 12.848 -4.643 3.547 1.00 0.00 H new ATOM 842 N SER A 56 11.058 -7.735 4.523 1.00 0.00 N ATOM 843 CA SER A 56 9.899 -8.391 5.118 1.00 0.00 C ATOM 844 C SER A 56 8.637 -7.560 4.907 1.00 0.00 C ATOM 845 O SER A 56 8.666 -6.529 4.235 1.00 0.00 O ATOM 846 CB SER A 56 10.128 -8.623 6.612 1.00 0.00 C ATOM 847 OG SER A 56 11.268 -9.436 6.834 1.00 0.00 O ATOM 0 H SER A 56 11.407 -6.935 5.051 1.00 0.00 H new ATOM 0 HA SER A 56 9.765 -9.354 4.626 1.00 0.00 H new ATOM 0 HB2 SER A 56 10.257 -7.665 7.116 1.00 0.00 H new ATOM 0 HB3 SER A 56 9.249 -9.097 7.048 1.00 0.00 H new ATOM 0 HG SER A 56 11.393 -9.568 7.797 1.00 0.00 H new ATOM 853 N GLN A 57 7.531 -8.014 5.487 1.00 0.00 N ATOM 854 CA GLN A 57 6.259 -7.313 5.364 1.00 0.00 C ATOM 855 C GLN A 57 6.275 -6.014 6.163 1.00 0.00 C ATOM 856 O GLN A 57 5.625 -5.037 5.791 1.00 0.00 O ATOM 857 CB GLN A 57 5.112 -8.206 5.840 1.00 0.00 C ATOM 858 CG GLN A 57 3.837 -8.043 5.030 1.00 0.00 C ATOM 859 CD GLN A 57 3.152 -9.366 4.750 1.00 0.00 C ATOM 860 OE1 GLN A 57 3.116 -9.831 3.610 1.00 0.00 O ATOM 861 NE2 GLN A 57 2.604 -9.981 5.792 1.00 0.00 N ATOM 0 H GLN A 57 7.490 -8.865 6.047 1.00 0.00 H new ATOM 0 HA GLN A 57 6.107 -7.069 4.313 1.00 0.00 H new ATOM 0 HB2 GLN A 57 5.431 -9.247 5.794 1.00 0.00 H new ATOM 0 HB3 GLN A 57 4.899 -7.983 6.886 1.00 0.00 H new ATOM 0 HG2 GLN A 57 3.150 -7.389 5.568 1.00 0.00 H new ATOM 0 HG3 GLN A 57 4.071 -7.552 4.085 1.00 0.00 H new ATOM 0 HE21 GLN A 57 2.658 -9.559 6.719 1.00 0.00 H new ATOM 0 HE22 GLN A 57 2.130 -10.875 5.665 1.00 0.00 H new ATOM 870 N VAL A 58 7.020 -6.010 7.263 1.00 0.00 N ATOM 871 CA VAL A 58 7.120 -4.831 8.115 1.00 0.00 C ATOM 872 C VAL A 58 8.174 -3.862 7.591 1.00 0.00 C ATOM 873 O VAL A 58 8.014 -2.645 7.684 1.00 0.00 O ATOM 874 CB VAL A 58 7.467 -5.214 9.567 1.00 0.00 C ATOM 875 CG1 VAL A 58 7.411 -3.992 10.471 1.00 0.00 C ATOM 876 CG2 VAL A 58 6.532 -6.303 10.074 1.00 0.00 C ATOM 0 H VAL A 58 7.564 -6.810 7.586 1.00 0.00 H new ATOM 0 HA VAL A 58 6.144 -4.346 8.099 1.00 0.00 H new ATOM 0 HB VAL A 58 8.484 -5.605 9.584 1.00 0.00 H new ATOM 0 HG11 VAL A 58 7.659 -4.283 11.492 1.00 0.00 H new ATOM 0 HG12 VAL A 58 8.127 -3.248 10.122 1.00 0.00 H new ATOM 0 HG13 VAL A 58 6.407 -3.568 10.448 1.00 0.00 H new ATOM 0 HG21 VAL A 58 6.794 -6.559 11.101 1.00 0.00 H new ATOM 0 HG22 VAL A 58 5.503 -5.944 10.041 1.00 0.00 H new ATOM 0 HG23 VAL A 58 6.628 -7.187 9.444 1.00 0.00 H new ATOM 886 N ASP A 59 9.252 -4.409 7.041 1.00 0.00 N ATOM 887 CA ASP A 59 10.334 -3.593 6.503 1.00 0.00 C ATOM 888 C ASP A 59 9.955 -3.012 5.144 1.00 0.00 C ATOM 889 O ASP A 59 10.407 -1.928 4.774 1.00 0.00 O ATOM 890 CB ASP A 59 11.613 -4.423 6.376 1.00 0.00 C ATOM 891 CG ASP A 59 12.858 -3.615 6.682 1.00 0.00 C ATOM 892 OD1 ASP A 59 12.879 -2.408 6.360 1.00 0.00 O ATOM 893 OD2 ASP A 59 13.816 -4.188 7.243 1.00 0.00 O ATOM 0 H ASP A 59 9.400 -5.415 6.956 1.00 0.00 H new ATOM 0 HA ASP A 59 10.511 -2.769 7.194 1.00 0.00 H new ATOM 0 HB2 ASP A 59 11.560 -5.274 7.055 1.00 0.00 H new ATOM 0 HB3 ASP A 59 11.683 -4.825 5.365 1.00 0.00 H new ATOM 898 N LEU A 60 9.122 -3.738 4.405 1.00 0.00 N ATOM 899 CA LEU A 60 8.683 -3.293 3.087 1.00 0.00 C ATOM 900 C LEU A 60 7.958 -1.954 3.177 1.00 0.00 C ATOM 901 O LEU A 60 8.315 -0.996 2.491 1.00 0.00 O ATOM 902 CB LEU A 60 7.767 -4.341 2.452 1.00 0.00 C ATOM 903 CG LEU A 60 7.247 -3.988 1.057 1.00 0.00 C ATOM 904 CD1 LEU A 60 8.375 -4.041 0.038 1.00 0.00 C ATOM 905 CD2 LEU A 60 6.120 -4.926 0.656 1.00 0.00 C ATOM 0 H LEU A 60 8.738 -4.637 4.696 1.00 0.00 H new ATOM 0 HA LEU A 60 9.566 -3.165 2.461 1.00 0.00 H new ATOM 0 HB2 LEU A 60 8.308 -5.286 2.393 1.00 0.00 H new ATOM 0 HB3 LEU A 60 6.914 -4.502 3.111 1.00 0.00 H new ATOM 0 HG LEU A 60 6.855 -2.971 1.082 1.00 0.00 H new ATOM 0 HD11 LEU A 60 7.987 -3.787 -0.948 1.00 0.00 H new ATOM 0 HD12 LEU A 60 9.151 -3.328 0.317 1.00 0.00 H new ATOM 0 HD13 LEU A 60 8.797 -5.046 0.014 1.00 0.00 H new ATOM 0 HD21 LEU A 60 5.762 -4.660 -0.339 1.00 0.00 H new ATOM 0 HD22 LEU A 60 6.487 -5.952 0.648 1.00 0.00 H new ATOM 0 HD23 LEU A 60 5.302 -4.839 1.371 1.00 0.00 H new ATOM 917 N ALA A 61 6.937 -1.896 4.026 1.00 0.00 N ATOM 918 CA ALA A 61 6.161 -0.674 4.205 1.00 0.00 C ATOM 919 C ALA A 61 7.036 0.472 4.701 1.00 0.00 C ATOM 920 O ALA A 61 6.748 1.640 4.446 1.00 0.00 O ATOM 921 CB ALA A 61 5.011 -0.920 5.171 1.00 0.00 C ATOM 0 H ALA A 61 6.628 -2.680 4.600 1.00 0.00 H new ATOM 0 HA ALA A 61 5.755 -0.387 3.235 1.00 0.00 H new ATOM 0 HB1 ALA A 61 4.439 -0.001 5.297 1.00 0.00 H new ATOM 0 HB2 ALA A 61 4.362 -1.700 4.773 1.00 0.00 H new ATOM 0 HB3 ALA A 61 5.408 -1.236 6.136 1.00 0.00 H new ATOM 927 N SER A 62 8.105 0.131 5.415 1.00 0.00 N ATOM 928 CA SER A 62 9.018 1.136 5.947 1.00 0.00 C ATOM 929 C SER A 62 10.079 1.515 4.919 1.00 0.00 C ATOM 930 O SER A 62 10.579 2.639 4.914 1.00 0.00 O ATOM 931 CB SER A 62 9.689 0.619 7.222 1.00 0.00 C ATOM 932 OG SER A 62 10.510 -0.503 6.948 1.00 0.00 O ATOM 0 H SER A 62 8.359 -0.831 5.638 1.00 0.00 H new ATOM 0 HA SER A 62 8.436 2.027 6.183 1.00 0.00 H new ATOM 0 HB2 SER A 62 10.289 1.412 7.668 1.00 0.00 H new ATOM 0 HB3 SER A 62 8.927 0.346 7.952 1.00 0.00 H new ATOM 0 HG SER A 62 10.396 -0.771 6.012 1.00 0.00 H new ATOM 938 N LYS A 63 10.420 0.569 4.049 1.00 0.00 N ATOM 939 CA LYS A 63 11.424 0.806 3.018 1.00 0.00 C ATOM 940 C LYS A 63 10.882 1.728 1.929 1.00 0.00 C ATOM 941 O LYS A 63 11.623 2.523 1.350 1.00 0.00 O ATOM 942 CB LYS A 63 11.877 -0.521 2.403 1.00 0.00 C ATOM 943 CG LYS A 63 13.330 -0.862 2.696 1.00 0.00 C ATOM 944 CD LYS A 63 14.162 -0.911 1.424 1.00 0.00 C ATOM 945 CE LYS A 63 15.165 -2.052 1.457 1.00 0.00 C ATOM 946 NZ LYS A 63 16.195 -1.856 2.514 1.00 0.00 N ATOM 0 H LYS A 63 10.016 -0.368 4.038 1.00 0.00 H new ATOM 0 HA LYS A 63 12.280 1.293 3.485 1.00 0.00 H new ATOM 0 HB2 LYS A 63 11.241 -1.322 2.779 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.732 -0.480 1.323 1.00 0.00 H new ATOM 0 HG2 LYS A 63 13.748 -0.120 3.376 1.00 0.00 H new ATOM 0 HG3 LYS A 63 13.383 -1.825 3.203 1.00 0.00 H new ATOM 0 HD2 LYS A 63 13.505 -1.028 0.563 1.00 0.00 H new ATOM 0 HD3 LYS A 63 14.689 0.034 1.296 1.00 0.00 H new ATOM 0 HE2 LYS A 63 14.640 -2.991 1.631 1.00 0.00 H new ATOM 0 HE3 LYS A 63 15.653 -2.135 0.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 16.870 -2.647 2.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 16.702 -0.964 2.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 15.734 -1.820 3.446 1.00 0.00 H new ATOM 960 N LEU A 64 9.587 1.617 1.654 1.00 0.00 N ATOM 961 CA LEU A 64 8.948 2.440 0.635 1.00 0.00 C ATOM 962 C LEU A 64 8.799 3.881 1.111 1.00 0.00 C ATOM 963 O LEU A 64 8.833 4.816 0.311 1.00 0.00 O ATOM 964 CB LEU A 64 7.578 1.866 0.270 1.00 0.00 C ATOM 965 CG LEU A 64 7.600 0.440 -0.284 1.00 0.00 C ATOM 966 CD1 LEU A 64 6.184 -0.089 -0.450 1.00 0.00 C ATOM 967 CD2 LEU A 64 8.347 0.396 -1.608 1.00 0.00 C ATOM 0 H LEU A 64 8.959 0.964 2.123 1.00 0.00 H new ATOM 0 HA LEU A 64 9.584 2.434 -0.250 1.00 0.00 H new ATOM 0 HB2 LEU A 64 6.945 1.885 1.157 1.00 0.00 H new ATOM 0 HB3 LEU A 64 7.112 2.519 -0.468 1.00 0.00 H new ATOM 0 HG LEU A 64 8.123 -0.199 0.427 1.00 0.00 H new ATOM 0 HD11 LEU A 64 6.219 -1.104 -0.845 1.00 0.00 H new ATOM 0 HD12 LEU A 64 5.681 -0.093 0.517 1.00 0.00 H new ATOM 0 HD13 LEU A 64 5.635 0.551 -1.141 1.00 0.00 H new ATOM 0 HD21 LEU A 64 8.353 -0.625 -1.988 1.00 0.00 H new ATOM 0 HD22 LEU A 64 7.851 1.048 -2.327 1.00 0.00 H new ATOM 0 HD23 LEU A 64 9.372 0.734 -1.459 1.00 0.00 H new ATOM 979 N ILE A 65 8.634 4.054 2.419 1.00 0.00 N ATOM 980 CA ILE A 65 8.479 5.382 3.000 1.00 0.00 C ATOM 981 C ILE A 65 9.834 6.031 3.257 1.00 0.00 C ATOM 982 O ILE A 65 9.985 7.247 3.130 1.00 0.00 O ATOM 983 CB ILE A 65 7.687 5.329 4.321 1.00 0.00 C ATOM 984 CG1 ILE A 65 6.394 4.536 4.133 1.00 0.00 C ATOM 985 CG2 ILE A 65 7.386 6.736 4.817 1.00 0.00 C ATOM 986 CD1 ILE A 65 5.780 4.064 5.433 1.00 0.00 C ATOM 0 H ILE A 65 8.604 3.291 3.096 1.00 0.00 H new ATOM 0 HA ILE A 65 7.924 5.981 2.277 1.00 0.00 H new ATOM 0 HB ILE A 65 8.295 4.824 5.072 1.00 0.00 H new ATOM 0 HG12 ILE A 65 5.671 5.156 3.603 1.00 0.00 H new ATOM 0 HG13 ILE A 65 6.596 3.671 3.501 1.00 0.00 H new ATOM 0 HG21 ILE A 65 6.826 6.681 5.751 1.00 0.00 H new ATOM 0 HG22 ILE A 65 8.321 7.270 4.986 1.00 0.00 H new ATOM 0 HG23 ILE A 65 6.795 7.266 4.070 1.00 0.00 H new ATOM 0 HD11 ILE A 65 4.866 3.509 5.223 1.00 0.00 H new ATOM 0 HD12 ILE A 65 6.486 3.418 5.955 1.00 0.00 H new ATOM 0 HD13 ILE A 65 5.546 4.925 6.059 1.00 0.00 H new ATOM 998 N SER A 66 10.817 5.214 3.619 1.00 0.00 N ATOM 999 CA SER A 66 12.161 5.710 3.894 1.00 0.00 C ATOM 1000 C SER A 66 12.904 6.031 2.601 1.00 0.00 C ATOM 1001 O SER A 66 13.841 6.829 2.595 1.00 0.00 O ATOM 1002 CB SER A 66 12.948 4.680 4.707 1.00 0.00 C ATOM 1003 OG SER A 66 14.023 5.292 5.400 1.00 0.00 O ATOM 0 H SER A 66 10.709 4.206 3.729 1.00 0.00 H new ATOM 0 HA SER A 66 12.069 6.629 4.472 1.00 0.00 H new ATOM 0 HB2 SER A 66 12.284 4.190 5.419 1.00 0.00 H new ATOM 0 HB3 SER A 66 13.333 3.905 4.044 1.00 0.00 H new ATOM 0 HG SER A 66 14.510 4.614 5.913 1.00 0.00 H new ATOM 1009 N MET A 67 12.486 5.401 1.506 1.00 0.00 N ATOM 1010 CA MET A 67 13.117 5.622 0.210 1.00 0.00 C ATOM 1011 C MET A 67 12.394 6.710 -0.576 1.00 0.00 C ATOM 1012 O MET A 67 13.017 7.658 -1.057 1.00 0.00 O ATOM 1013 CB MET A 67 13.137 4.322 -0.597 1.00 0.00 C ATOM 1014 CG MET A 67 14.182 3.326 -0.122 1.00 0.00 C ATOM 1015 SD MET A 67 14.772 2.254 -1.446 1.00 0.00 S ATOM 1016 CE MET A 67 13.268 1.376 -1.866 1.00 0.00 C ATOM 0 H MET A 67 11.714 4.734 1.491 1.00 0.00 H new ATOM 0 HA MET A 67 14.141 5.951 0.387 1.00 0.00 H new ATOM 0 HB2 MET A 67 12.153 3.856 -0.544 1.00 0.00 H new ATOM 0 HB3 MET A 67 13.322 4.558 -1.645 1.00 0.00 H new ATOM 0 HG2 MET A 67 15.026 3.867 0.306 1.00 0.00 H new ATOM 0 HG3 MET A 67 13.759 2.714 0.675 1.00 0.00 H new ATOM 0 HE1 MET A 67 13.448 0.302 -1.817 1.00 0.00 H new ATOM 0 HE2 MET A 67 12.481 1.644 -1.161 1.00 0.00 H new ATOM 0 HE3 MET A 67 12.959 1.647 -2.876 1.00 0.00 H new ATOM 1026 N TYR A 68 11.079 6.569 -0.709 1.00 0.00 N ATOM 1027 CA TYR A 68 10.277 7.541 -1.444 1.00 0.00 C ATOM 1028 C TYR A 68 9.429 8.385 -0.496 1.00 0.00 C ATOM 1029 O TYR A 68 9.678 9.578 -0.322 1.00 0.00 O ATOM 1030 CB TYR A 68 9.379 6.830 -2.458 1.00 0.00 C ATOM 1031 CG TYR A 68 10.108 5.801 -3.293 1.00 0.00 C ATOM 1032 CD1 TYR A 68 10.239 4.490 -2.856 1.00 0.00 C ATOM 1033 CD2 TYR A 68 10.662 6.141 -4.521 1.00 0.00 C ATOM 1034 CE1 TYR A 68 10.904 3.547 -3.616 1.00 0.00 C ATOM 1035 CE2 TYR A 68 11.328 5.203 -5.288 1.00 0.00 C ATOM 1036 CZ TYR A 68 11.446 3.908 -4.831 1.00 0.00 C ATOM 1037 OH TYR A 68 12.108 2.972 -5.591 1.00 0.00 O ATOM 0 H TYR A 68 10.546 5.792 -0.318 1.00 0.00 H new ATOM 0 HA TYR A 68 10.958 8.206 -1.975 1.00 0.00 H new ATOM 0 HB2 TYR A 68 8.561 6.342 -1.928 1.00 0.00 H new ATOM 0 HB3 TYR A 68 8.932 7.573 -3.119 1.00 0.00 H new ATOM 0 HD1 TYR A 68 9.814 4.202 -1.906 1.00 0.00 H new ATOM 0 HD2 TYR A 68 10.571 7.155 -4.882 1.00 0.00 H new ATOM 0 HE1 TYR A 68 10.999 2.532 -3.260 1.00 0.00 H new ATOM 0 HE2 TYR A 68 11.754 5.484 -6.240 1.00 0.00 H new ATOM 0 HH TYR A 68 12.428 3.389 -6.418 1.00 0.00 H new ATOM 1047 N GLY A 69 8.425 7.760 0.114 1.00 0.00 N ATOM 1048 CA GLY A 69 7.559 8.474 1.033 1.00 0.00 C ATOM 1049 C GLY A 69 6.333 7.670 1.420 1.00 0.00 C ATOM 1050 O GLY A 69 6.175 6.524 1.001 1.00 0.00 O ATOM 0 H GLY A 69 8.197 6.774 -0.012 1.00 0.00 H new ATOM 0 HA2 GLY A 69 8.120 8.729 1.932 1.00 0.00 H new ATOM 0 HA3 GLY A 69 7.245 9.412 0.576 1.00 0.00 H new ATOM 1054 N ALA A 70 5.463 8.273 2.224 1.00 0.00 N ATOM 1055 CA ALA A 70 4.246 7.606 2.672 1.00 0.00 C ATOM 1056 C ALA A 70 3.176 7.626 1.586 1.00 0.00 C ATOM 1057 O ALA A 70 2.465 6.641 1.384 1.00 0.00 O ATOM 1058 CB ALA A 70 3.723 8.262 3.941 1.00 0.00 C ATOM 0 H ALA A 70 5.578 9.222 2.579 1.00 0.00 H new ATOM 0 HA ALA A 70 4.490 6.565 2.886 1.00 0.00 H new ATOM 0 HB1 ALA A 70 2.814 7.755 4.265 1.00 0.00 H new ATOM 0 HB2 ALA A 70 4.477 8.191 4.725 1.00 0.00 H new ATOM 0 HB3 ALA A 70 3.502 9.311 3.744 1.00 0.00 H new ATOM 1064 N GLN A 71 3.065 8.752 0.890 1.00 0.00 N ATOM 1065 CA GLN A 71 2.079 8.898 -0.175 1.00 0.00 C ATOM 1066 C GLN A 71 2.564 8.238 -1.462 1.00 0.00 C ATOM 1067 O GLN A 71 1.764 7.759 -2.266 1.00 0.00 O ATOM 1068 CB GLN A 71 1.786 10.379 -0.426 1.00 0.00 C ATOM 1069 CG GLN A 71 0.612 10.911 0.380 1.00 0.00 C ATOM 1070 CD GLN A 71 0.561 12.425 0.404 1.00 0.00 C ATOM 1071 OE1 GLN A 71 0.427 13.037 1.464 1.00 0.00 O ATOM 1072 NE2 GLN A 71 0.666 13.040 -0.768 1.00 0.00 N ATOM 0 H GLN A 71 3.645 9.577 1.044 1.00 0.00 H new ATOM 0 HA GLN A 71 1.162 8.401 0.142 1.00 0.00 H new ATOM 0 HB2 GLN A 71 2.675 10.963 -0.186 1.00 0.00 H new ATOM 0 HB3 GLN A 71 1.584 10.526 -1.487 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -0.317 10.526 -0.041 1.00 0.00 H new ATOM 0 HG3 GLN A 71 0.678 10.537 1.402 1.00 0.00 H new ATOM 0 HE21 GLN A 71 0.776 12.494 -1.622 1.00 0.00 H new ATOM 0 HE22 GLN A 71 0.637 14.059 -0.814 1.00 0.00 H new ATOM 1081 N GLU A 72 3.879 8.217 -1.651 1.00 0.00 N ATOM 1082 CA GLU A 72 4.469 7.616 -2.841 1.00 0.00 C ATOM 1083 C GLU A 72 4.530 6.096 -2.715 1.00 0.00 C ATOM 1084 O GLU A 72 4.485 5.379 -3.713 1.00 0.00 O ATOM 1085 CB GLU A 72 5.874 8.179 -3.075 1.00 0.00 C ATOM 1086 CG GLU A 72 6.094 8.696 -4.487 1.00 0.00 C ATOM 1087 CD GLU A 72 5.833 10.184 -4.610 1.00 0.00 C ATOM 1088 OE1 GLU A 72 4.765 10.639 -4.150 1.00 0.00 O ATOM 1089 OE2 GLU A 72 6.696 10.894 -5.168 1.00 0.00 O ATOM 0 H GLU A 72 4.556 8.609 -0.996 1.00 0.00 H new ATOM 0 HA GLU A 72 3.837 7.863 -3.694 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.054 8.989 -2.368 1.00 0.00 H new ATOM 0 HB3 GLU A 72 6.608 7.402 -2.863 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.119 8.484 -4.792 1.00 0.00 H new ATOM 0 HG3 GLU A 72 5.440 8.158 -5.173 1.00 0.00 H new ATOM 1096 N ALA A 73 4.634 5.611 -1.481 1.00 0.00 N ATOM 1097 CA ALA A 73 4.703 4.178 -1.227 1.00 0.00 C ATOM 1098 C ALA A 73 3.352 3.507 -1.455 1.00 0.00 C ATOM 1099 O ALA A 73 3.285 2.346 -1.860 1.00 0.00 O ATOM 1100 CB ALA A 73 5.187 3.918 0.192 1.00 0.00 C ATOM 0 H ALA A 73 4.672 6.190 -0.642 1.00 0.00 H new ATOM 0 HA ALA A 73 5.414 3.747 -1.931 1.00 0.00 H new ATOM 0 HB1 ALA A 73 5.234 2.844 0.369 1.00 0.00 H new ATOM 0 HB2 ALA A 73 6.179 4.351 0.323 1.00 0.00 H new ATOM 0 HB3 ALA A 73 4.495 4.373 0.901 1.00 0.00 H new ATOM 1106 N VAL A 74 2.277 4.243 -1.189 1.00 0.00 N ATOM 1107 CA VAL A 74 0.928 3.716 -1.362 1.00 0.00 C ATOM 1108 C VAL A 74 0.599 3.499 -2.836 1.00 0.00 C ATOM 1109 O VAL A 74 -0.213 2.639 -3.178 1.00 0.00 O ATOM 1110 CB VAL A 74 -0.125 4.657 -0.745 1.00 0.00 C ATOM 1111 CG1 VAL A 74 -1.508 4.026 -0.803 1.00 0.00 C ATOM 1112 CG2 VAL A 74 0.247 5.012 0.687 1.00 0.00 C ATOM 0 H VAL A 74 2.314 5.205 -0.853 1.00 0.00 H new ATOM 0 HA VAL A 74 0.898 2.757 -0.845 1.00 0.00 H new ATOM 0 HB VAL A 74 -0.147 5.577 -1.329 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -2.237 4.706 -0.362 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.775 3.830 -1.841 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.504 3.089 -0.247 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -0.509 5.677 1.105 1.00 0.00 H new ATOM 0 HG22 VAL A 74 0.301 4.102 1.285 1.00 0.00 H new ATOM 0 HG23 VAL A 74 1.216 5.511 0.698 1.00 0.00 H new ATOM 1122 N ARG A 75 1.228 4.285 -3.705 1.00 0.00 N ATOM 1123 CA ARG A 75 0.992 4.175 -5.140 1.00 0.00 C ATOM 1124 C ARG A 75 1.895 3.117 -5.769 1.00 0.00 C ATOM 1125 O ARG A 75 1.538 2.504 -6.775 1.00 0.00 O ATOM 1126 CB ARG A 75 1.217 5.527 -5.821 1.00 0.00 C ATOM 1127 CG ARG A 75 2.584 6.131 -5.542 1.00 0.00 C ATOM 1128 CD ARG A 75 2.822 7.376 -6.381 1.00 0.00 C ATOM 1129 NE ARG A 75 3.213 7.047 -7.750 1.00 0.00 N ATOM 1130 CZ ARG A 75 3.120 7.895 -8.772 1.00 0.00 C ATOM 1131 NH1 ARG A 75 2.651 9.123 -8.585 1.00 0.00 N ATOM 1132 NH2 ARG A 75 3.496 7.514 -9.985 1.00 0.00 N ATOM 0 H ARG A 75 1.903 5.003 -3.441 1.00 0.00 H new ATOM 0 HA ARG A 75 -0.044 3.869 -5.286 1.00 0.00 H new ATOM 0 HB2 ARG A 75 1.096 5.406 -6.897 1.00 0.00 H new ATOM 0 HB3 ARG A 75 0.447 6.224 -5.489 1.00 0.00 H new ATOM 0 HG2 ARG A 75 2.663 6.383 -4.484 1.00 0.00 H new ATOM 0 HG3 ARG A 75 3.359 5.394 -5.753 1.00 0.00 H new ATOM 0 HD2 ARG A 75 1.915 7.980 -6.398 1.00 0.00 H new ATOM 0 HD3 ARG A 75 3.600 7.982 -5.917 1.00 0.00 H new ATOM 0 HE ARG A 75 3.579 6.113 -7.933 1.00 0.00 H new ATOM 0 HH11 ARG A 75 2.360 9.421 -7.654 1.00 0.00 H new ATOM 0 HH12 ARG A 75 2.582 9.768 -9.372 1.00 0.00 H new ATOM 0 HH21 ARG A 75 3.856 6.572 -10.135 1.00 0.00 H new ATOM 0 HH22 ARG A 75 3.425 8.163 -10.768 1.00 0.00 H new ATOM 1146 N VAL A 76 3.065 2.907 -5.173 1.00 0.00 N ATOM 1147 CA VAL A 76 4.012 1.921 -5.681 1.00 0.00 C ATOM 1148 C VAL A 76 3.485 0.502 -5.486 1.00 0.00 C ATOM 1149 O VAL A 76 3.690 -0.368 -6.333 1.00 0.00 O ATOM 1150 CB VAL A 76 5.384 2.050 -4.991 1.00 0.00 C ATOM 1151 CG1 VAL A 76 6.386 1.082 -5.605 1.00 0.00 C ATOM 1152 CG2 VAL A 76 5.894 3.481 -5.077 1.00 0.00 C ATOM 0 H VAL A 76 3.379 3.405 -4.340 1.00 0.00 H new ATOM 0 HA VAL A 76 4.132 2.117 -6.746 1.00 0.00 H new ATOM 0 HB VAL A 76 5.264 1.794 -3.938 1.00 0.00 H new ATOM 0 HG11 VAL A 76 7.348 1.188 -5.104 1.00 0.00 H new ATOM 0 HG12 VAL A 76 6.025 0.060 -5.485 1.00 0.00 H new ATOM 0 HG13 VAL A 76 6.503 1.303 -6.666 1.00 0.00 H new ATOM 0 HG21 VAL A 76 6.864 3.552 -4.584 1.00 0.00 H new ATOM 0 HG22 VAL A 76 5.997 3.768 -6.123 1.00 0.00 H new ATOM 0 HG23 VAL A 76 5.187 4.149 -4.585 1.00 0.00 H new ATOM 1162 N VAL A 77 2.807 0.276 -4.366 1.00 0.00 N ATOM 1163 CA VAL A 77 2.252 -1.038 -4.062 1.00 0.00 C ATOM 1164 C VAL A 77 0.976 -1.293 -4.856 1.00 0.00 C ATOM 1165 O VAL A 77 0.717 -2.416 -5.289 1.00 0.00 O ATOM 1166 CB VAL A 77 1.947 -1.185 -2.559 1.00 0.00 C ATOM 1167 CG1 VAL A 77 1.563 -2.620 -2.231 1.00 0.00 C ATOM 1168 CG2 VAL A 77 3.139 -0.738 -1.725 1.00 0.00 C ATOM 0 H VAL A 77 2.629 0.985 -3.654 1.00 0.00 H new ATOM 0 HA VAL A 77 3.006 -1.773 -4.345 1.00 0.00 H new ATOM 0 HB VAL A 77 1.102 -0.542 -2.313 1.00 0.00 H new ATOM 0 HG11 VAL A 77 1.351 -2.705 -1.165 1.00 0.00 H new ATOM 0 HG12 VAL A 77 0.677 -2.899 -2.801 1.00 0.00 H new ATOM 0 HG13 VAL A 77 2.386 -3.286 -2.492 1.00 0.00 H new ATOM 0 HG21 VAL A 77 2.905 -0.849 -0.666 1.00 0.00 H new ATOM 0 HG22 VAL A 77 4.006 -1.351 -1.971 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.362 0.307 -1.939 1.00 0.00 H new ATOM 1178 N SER A 78 0.180 -0.246 -5.042 1.00 0.00 N ATOM 1179 CA SER A 78 -1.070 -0.358 -5.784 1.00 0.00 C ATOM 1180 C SER A 78 -0.806 -0.553 -7.273 1.00 0.00 C ATOM 1181 O SER A 78 -1.580 -1.210 -7.970 1.00 0.00 O ATOM 1182 CB SER A 78 -1.929 0.889 -5.565 1.00 0.00 C ATOM 1183 OG SER A 78 -3.306 0.556 -5.501 1.00 0.00 O ATOM 0 H SER A 78 0.378 0.690 -4.689 1.00 0.00 H new ATOM 0 HA SER A 78 -1.606 -1.231 -5.413 1.00 0.00 H new ATOM 0 HB2 SER A 78 -1.628 1.384 -4.642 1.00 0.00 H new ATOM 0 HB3 SER A 78 -1.760 1.597 -6.376 1.00 0.00 H new ATOM 0 HG SER A 78 -3.833 1.370 -5.359 1.00 0.00 H new ATOM 1189 N ARG A 79 0.290 0.021 -7.755 1.00 0.00 N ATOM 1190 CA ARG A 79 0.656 -0.090 -9.164 1.00 0.00 C ATOM 1191 C ARG A 79 0.987 -1.535 -9.527 1.00 0.00 C ATOM 1192 O ARG A 79 0.768 -1.966 -10.660 1.00 0.00 O ATOM 1193 CB ARG A 79 1.849 0.817 -9.475 1.00 0.00 C ATOM 1194 CG ARG A 79 1.481 2.042 -10.298 1.00 0.00 C ATOM 1195 CD ARG A 79 2.145 2.019 -11.665 1.00 0.00 C ATOM 1196 NE ARG A 79 1.395 1.211 -12.625 1.00 0.00 N ATOM 1197 CZ ARG A 79 1.911 0.734 -13.756 1.00 0.00 C ATOM 1198 NH1 ARG A 79 3.177 0.980 -14.072 1.00 0.00 N ATOM 1199 NH2 ARG A 79 1.159 0.009 -14.573 1.00 0.00 N ATOM 0 H ARG A 79 0.941 0.568 -7.192 1.00 0.00 H new ATOM 0 HA ARG A 79 -0.197 0.228 -9.763 1.00 0.00 H new ATOM 0 HB2 ARG A 79 2.303 1.141 -8.538 1.00 0.00 H new ATOM 0 HB3 ARG A 79 2.603 0.241 -10.012 1.00 0.00 H new ATOM 0 HG2 ARG A 79 0.399 2.087 -10.420 1.00 0.00 H new ATOM 0 HG3 ARG A 79 1.780 2.943 -9.763 1.00 0.00 H new ATOM 0 HD2 ARG A 79 2.235 3.038 -12.041 1.00 0.00 H new ATOM 0 HD3 ARG A 79 3.156 1.623 -11.570 1.00 0.00 H new ATOM 0 HE ARG A 79 0.419 1.000 -12.416 1.00 0.00 H new ATOM 0 HH11 ARG A 79 3.760 1.537 -13.447 1.00 0.00 H new ATOM 0 HH12 ARG A 79 3.567 0.612 -14.940 1.00 0.00 H new ATOM 0 HH21 ARG A 79 0.186 -0.183 -14.335 1.00 0.00 H new ATOM 0 HH22 ARG A 79 1.554 -0.357 -15.440 1.00 0.00 H new ATOM 1213 N SER A 80 1.516 -2.277 -8.560 1.00 0.00 N ATOM 1214 CA SER A 80 1.878 -3.673 -8.781 1.00 0.00 C ATOM 1215 C SER A 80 0.657 -4.579 -8.655 1.00 0.00 C ATOM 1216 O SER A 80 0.583 -5.628 -9.294 1.00 0.00 O ATOM 1217 CB SER A 80 2.953 -4.106 -7.783 1.00 0.00 C ATOM 1218 OG SER A 80 4.209 -3.538 -8.108 1.00 0.00 O ATOM 0 H SER A 80 1.704 -1.936 -7.617 1.00 0.00 H new ATOM 0 HA SER A 80 2.272 -3.764 -9.793 1.00 0.00 H new ATOM 0 HB2 SER A 80 2.663 -3.803 -6.777 1.00 0.00 H new ATOM 0 HB3 SER A 80 3.032 -5.193 -7.778 1.00 0.00 H new ATOM 0 HG SER A 80 4.879 -3.829 -7.454 1.00 0.00 H new ATOM 1224 N LEU A 81 -0.298 -4.167 -7.827 1.00 0.00 N ATOM 1225 CA LEU A 81 -1.516 -4.942 -7.618 1.00 0.00 C ATOM 1226 C LEU A 81 -2.260 -5.157 -8.933 1.00 0.00 C ATOM 1227 O LEU A 81 -2.927 -6.173 -9.121 1.00 0.00 O ATOM 1228 CB LEU A 81 -2.428 -4.235 -6.614 1.00 0.00 C ATOM 1229 CG LEU A 81 -1.979 -4.328 -5.155 1.00 0.00 C ATOM 1230 CD1 LEU A 81 -2.718 -3.307 -4.303 1.00 0.00 C ATOM 1231 CD2 LEU A 81 -2.201 -5.733 -4.616 1.00 0.00 C ATOM 0 H LEU A 81 -0.252 -3.301 -7.290 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.232 -5.916 -7.220 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.500 -3.183 -6.890 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -3.430 -4.656 -6.697 1.00 0.00 H new ATOM 0 HG LEU A 81 -0.913 -4.107 -5.109 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -2.386 -3.388 -3.268 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -2.509 -2.304 -4.674 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -3.790 -3.497 -4.356 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -1.876 -5.780 -3.577 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -3.260 -5.983 -4.676 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -1.626 -6.445 -5.208 1.00 0.00 H new ATOM 1243 N LEU A 82 -2.143 -4.190 -9.838 1.00 0.00 N ATOM 1244 CA LEU A 82 -2.804 -4.273 -11.134 1.00 0.00 C ATOM 1245 C LEU A 82 -2.311 -5.483 -11.922 1.00 0.00 C ATOM 1246 O LEU A 82 -3.069 -6.097 -12.674 1.00 0.00 O ATOM 1247 CB LEU A 82 -2.562 -2.993 -11.937 1.00 0.00 C ATOM 1248 CG LEU A 82 -3.527 -1.847 -11.633 1.00 0.00 C ATOM 1249 CD1 LEU A 82 -3.171 -0.617 -12.455 1.00 0.00 C ATOM 1250 CD2 LEU A 82 -4.962 -2.273 -11.901 1.00 0.00 C ATOM 0 H LEU A 82 -1.597 -3.340 -9.697 1.00 0.00 H new ATOM 0 HA LEU A 82 -3.874 -4.388 -10.960 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.544 -2.651 -11.748 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -2.627 -3.230 -12.999 1.00 0.00 H new ATOM 0 HG LEU A 82 -3.437 -1.592 -10.577 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -3.869 0.188 -12.225 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -2.157 -0.299 -12.213 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -3.232 -0.858 -13.516 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -5.635 -1.445 -11.679 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -5.068 -2.556 -12.948 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -5.213 -3.124 -11.268 1.00 0.00 H new ATOM 1262 N ALA A 83 -1.038 -5.819 -11.746 1.00 0.00 N ATOM 1263 CA ALA A 83 -0.445 -6.956 -12.440 1.00 0.00 C ATOM 1264 C ALA A 83 -1.155 -8.254 -12.075 1.00 0.00 C ATOM 1265 O ALA A 83 -1.302 -9.149 -12.908 1.00 0.00 O ATOM 1266 CB ALA A 83 1.038 -7.054 -12.119 1.00 0.00 C ATOM 0 H ALA A 83 -0.397 -5.320 -11.129 1.00 0.00 H new ATOM 0 HA ALA A 83 -0.564 -6.798 -13.512 1.00 0.00 H new ATOM 0 HB1 ALA A 83 1.468 -7.907 -12.644 1.00 0.00 H new ATOM 0 HB2 ALA A 83 1.540 -6.141 -12.438 1.00 0.00 H new ATOM 0 HB3 ALA A 83 1.170 -7.184 -11.045 1.00 0.00 H new ATOM 1272 N MET A 84 -1.595 -8.351 -10.824 1.00 0.00 N ATOM 1273 CA MET A 84 -2.291 -9.541 -10.348 1.00 0.00 C ATOM 1274 C MET A 84 -3.806 -9.331 -10.327 1.00 0.00 C ATOM 1275 O MET A 84 -4.561 -10.249 -10.008 1.00 0.00 O ATOM 1276 CB MET A 84 -1.800 -9.915 -8.948 1.00 0.00 C ATOM 1277 CG MET A 84 -0.325 -10.283 -8.898 1.00 0.00 C ATOM 1278 SD MET A 84 0.046 -11.489 -7.610 1.00 0.00 S ATOM 1279 CE MET A 84 -0.645 -10.673 -6.174 1.00 0.00 C ATOM 0 H MET A 84 -1.482 -7.620 -10.122 1.00 0.00 H new ATOM 0 HA MET A 84 -2.070 -10.354 -11.039 1.00 0.00 H new ATOM 0 HB2 MET A 84 -1.980 -9.078 -8.273 1.00 0.00 H new ATOM 0 HB3 MET A 84 -2.388 -10.755 -8.578 1.00 0.00 H new ATOM 0 HG2 MET A 84 -0.022 -10.685 -9.865 1.00 0.00 H new ATOM 0 HG3 MET A 84 0.265 -9.382 -8.728 1.00 0.00 H new ATOM 0 HE1 MET A 84 0.151 -10.455 -5.462 1.00 0.00 H new ATOM 0 HE2 MET A 84 -1.124 -9.743 -6.479 1.00 0.00 H new ATOM 0 HE3 MET A 84 -1.383 -11.324 -5.706 1.00 0.00 H new ATOM 1289 N ASN A 85 -4.246 -8.121 -10.668 1.00 0.00 N ATOM 1290 CA ASN A 85 -5.670 -7.805 -10.685 1.00 0.00 C ATOM 1291 C ASN A 85 -6.281 -7.977 -9.298 1.00 0.00 C ATOM 1292 O ASN A 85 -6.747 -9.060 -8.943 1.00 0.00 O ATOM 1293 CB ASN A 85 -6.400 -8.697 -11.691 1.00 0.00 C ATOM 1294 CG ASN A 85 -6.036 -8.367 -13.126 1.00 0.00 C ATOM 1295 OD1 ASN A 85 -6.815 -7.747 -13.848 1.00 0.00 O ATOM 1296 ND2 ASN A 85 -4.847 -8.783 -13.544 1.00 0.00 N ATOM 0 H ASN A 85 -3.638 -7.347 -10.935 1.00 0.00 H new ATOM 0 HA ASN A 85 -5.782 -6.763 -10.986 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -6.159 -9.741 -11.489 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -7.476 -8.586 -11.557 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -4.547 -8.591 -14.500 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -4.234 -9.294 -12.909 1.00 0.00 H new ATOM 1303 N LEU A 86 -6.276 -6.901 -8.517 1.00 0.00 N ATOM 1304 CA LEU A 86 -6.831 -6.931 -7.168 1.00 0.00 C ATOM 1305 C LEU A 86 -7.347 -5.555 -6.762 1.00 0.00 C ATOM 1306 O LEU A 86 -6.671 -4.813 -6.050 1.00 0.00 O ATOM 1307 CB LEU A 86 -5.774 -7.409 -6.171 1.00 0.00 C ATOM 1308 CG LEU A 86 -5.324 -8.860 -6.349 1.00 0.00 C ATOM 1309 CD1 LEU A 86 -4.105 -9.151 -5.488 1.00 0.00 C ATOM 1310 CD2 LEU A 86 -6.460 -9.814 -6.007 1.00 0.00 C ATOM 0 H LEU A 86 -5.894 -5.997 -8.795 1.00 0.00 H new ATOM 0 HA LEU A 86 -7.668 -7.629 -7.161 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -4.901 -6.761 -6.252 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -6.168 -7.288 -5.162 1.00 0.00 H new ATOM 0 HG LEU A 86 -5.049 -9.010 -7.393 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.800 -10.188 -5.628 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -3.288 -8.490 -5.778 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -4.352 -8.984 -4.440 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -6.124 -10.842 -6.139 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -6.764 -9.661 -4.971 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -7.307 -9.622 -6.666 1.00 0.00 H new ATOM 1322 N MET A 87 -8.550 -5.222 -7.218 1.00 0.00 N ATOM 1323 CA MET A 87 -9.158 -3.935 -6.903 1.00 0.00 C ATOM 1324 C MET A 87 -9.514 -3.841 -5.420 1.00 0.00 C ATOM 1325 O MET A 87 -9.674 -2.747 -4.880 1.00 0.00 O ATOM 1326 CB MET A 87 -10.412 -3.719 -7.753 1.00 0.00 C ATOM 1327 CG MET A 87 -10.125 -3.604 -9.242 1.00 0.00 C ATOM 1328 SD MET A 87 -10.102 -1.894 -9.815 1.00 0.00 S ATOM 1329 CE MET A 87 -8.583 -1.307 -9.069 1.00 0.00 C ATOM 0 H MET A 87 -9.123 -5.826 -7.807 1.00 0.00 H new ATOM 0 HA MET A 87 -8.430 -3.156 -7.131 1.00 0.00 H new ATOM 0 HB2 MET A 87 -11.101 -4.547 -7.587 1.00 0.00 H new ATOM 0 HB3 MET A 87 -10.917 -2.813 -7.418 1.00 0.00 H new ATOM 0 HG2 MET A 87 -9.164 -4.069 -9.460 1.00 0.00 H new ATOM 0 HG3 MET A 87 -10.881 -4.159 -9.798 1.00 0.00 H new ATOM 0 HE1 MET A 87 -8.147 -0.529 -9.695 1.00 0.00 H new ATOM 0 HE2 MET A 87 -8.797 -0.900 -8.080 1.00 0.00 H new ATOM 0 HE3 MET A 87 -7.880 -2.134 -8.977 1.00 0.00 H new ATOM 1339 N GLU A 88 -9.641 -4.994 -4.767 1.00 0.00 N ATOM 1340 CA GLU A 88 -9.980 -5.039 -3.348 1.00 0.00 C ATOM 1341 C GLU A 88 -9.002 -4.205 -2.525 1.00 0.00 C ATOM 1342 O GLU A 88 -9.380 -3.593 -1.526 1.00 0.00 O ATOM 1343 CB GLU A 88 -9.979 -6.484 -2.848 1.00 0.00 C ATOM 1344 CG GLU A 88 -11.105 -7.328 -3.424 1.00 0.00 C ATOM 1345 CD GLU A 88 -11.173 -8.710 -2.806 1.00 0.00 C ATOM 1346 OE1 GLU A 88 -11.599 -8.816 -1.636 1.00 0.00 O ATOM 1347 OE2 GLU A 88 -10.800 -9.687 -3.490 1.00 0.00 O ATOM 0 H GLU A 88 -9.514 -5.909 -5.199 1.00 0.00 H new ATOM 0 HA GLU A 88 -10.978 -4.619 -3.227 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -9.024 -6.946 -3.100 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -10.056 -6.484 -1.761 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -12.055 -6.817 -3.266 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -10.969 -7.422 -4.501 1.00 0.00 H new ATOM 1354 N LEU A 89 -7.743 -4.186 -2.951 1.00 0.00 N ATOM 1355 CA LEU A 89 -6.712 -3.428 -2.253 1.00 0.00 C ATOM 1356 C LEU A 89 -6.449 -2.098 -2.952 1.00 0.00 C ATOM 1357 O LEU A 89 -6.153 -1.093 -2.305 1.00 0.00 O ATOM 1358 CB LEU A 89 -5.417 -4.240 -2.174 1.00 0.00 C ATOM 1359 CG LEU A 89 -5.426 -5.377 -1.152 1.00 0.00 C ATOM 1360 CD1 LEU A 89 -4.214 -6.276 -1.342 1.00 0.00 C ATOM 1361 CD2 LEU A 89 -5.461 -4.820 0.264 1.00 0.00 C ATOM 0 H LEU A 89 -7.413 -4.687 -3.776 1.00 0.00 H new ATOM 0 HA LEU A 89 -7.067 -3.224 -1.243 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -5.208 -4.659 -3.158 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -4.596 -3.564 -1.935 1.00 0.00 H new ATOM 0 HG LEU A 89 -6.324 -5.974 -1.310 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -4.238 -7.079 -0.606 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -4.231 -6.703 -2.345 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -3.303 -5.691 -1.212 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -5.467 -5.643 0.979 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -4.581 -4.199 0.433 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -6.360 -4.218 0.396 1.00 0.00 H new ATOM 1373 N VAL A 90 -6.557 -2.100 -4.276 1.00 0.00 N ATOM 1374 CA VAL A 90 -6.330 -0.895 -5.063 1.00 0.00 C ATOM 1375 C VAL A 90 -7.420 0.142 -4.810 1.00 0.00 C ATOM 1376 O VAL A 90 -7.175 1.346 -4.891 1.00 0.00 O ATOM 1377 CB VAL A 90 -6.277 -1.212 -6.571 1.00 0.00 C ATOM 1378 CG1 VAL A 90 -5.887 0.025 -7.368 1.00 0.00 C ATOM 1379 CG2 VAL A 90 -5.313 -2.357 -6.844 1.00 0.00 C ATOM 0 H VAL A 90 -6.800 -2.923 -4.826 1.00 0.00 H new ATOM 0 HA VAL A 90 -5.368 -0.489 -4.750 1.00 0.00 H new ATOM 0 HB VAL A 90 -7.272 -1.521 -6.891 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -5.856 -0.221 -8.429 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -6.621 0.813 -7.200 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -4.904 0.370 -7.046 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -5.290 -2.566 -7.914 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -4.314 -2.080 -6.506 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.644 -3.247 -6.308 1.00 0.00 H new ATOM 1389 N ASP A 91 -8.623 -0.333 -4.501 1.00 0.00 N ATOM 1390 CA ASP A 91 -9.749 0.555 -4.236 1.00 0.00 C ATOM 1391 C ASP A 91 -9.604 1.226 -2.873 1.00 0.00 C ATOM 1392 O ASP A 91 -9.981 2.385 -2.697 1.00 0.00 O ATOM 1393 CB ASP A 91 -11.064 -0.224 -4.296 1.00 0.00 C ATOM 1394 CG ASP A 91 -12.274 0.688 -4.337 1.00 0.00 C ATOM 1395 OD1 ASP A 91 -12.145 1.825 -4.839 1.00 0.00 O ATOM 1396 OD2 ASP A 91 -13.352 0.266 -3.867 1.00 0.00 O ATOM 0 H ASP A 91 -8.842 -1.326 -4.428 1.00 0.00 H new ATOM 0 HA ASP A 91 -9.757 1.329 -5.003 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -11.064 -0.864 -5.179 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -11.135 -0.879 -3.428 1.00 0.00 H new ATOM 1401 N TYR A 92 -9.058 0.489 -1.912 1.00 0.00 N ATOM 1402 CA TYR A 92 -8.864 1.011 -0.564 1.00 0.00 C ATOM 1403 C TYR A 92 -7.688 1.983 -0.520 1.00 0.00 C ATOM 1404 O TYR A 92 -7.812 3.098 -0.014 1.00 0.00 O ATOM 1405 CB TYR A 92 -8.629 -0.136 0.420 1.00 0.00 C ATOM 1406 CG TYR A 92 -8.582 0.303 1.865 1.00 0.00 C ATOM 1407 CD1 TYR A 92 -9.714 0.807 2.496 1.00 0.00 C ATOM 1408 CD2 TYR A 92 -7.408 0.214 2.601 1.00 0.00 C ATOM 1409 CE1 TYR A 92 -9.675 1.209 3.817 1.00 0.00 C ATOM 1410 CE2 TYR A 92 -7.361 0.614 3.923 1.00 0.00 C ATOM 1411 CZ TYR A 92 -8.497 1.110 4.526 1.00 0.00 C ATOM 1412 OH TYR A 92 -8.455 1.510 5.843 1.00 0.00 O ATOM 0 H TYR A 92 -8.742 -0.472 -2.041 1.00 0.00 H new ATOM 0 HA TYR A 92 -9.767 1.549 -0.276 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -9.422 -0.874 0.299 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -7.691 -0.631 0.169 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -10.639 0.885 1.944 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -6.516 -0.175 2.132 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -10.563 1.599 4.292 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -6.439 0.538 4.481 1.00 0.00 H new ATOM 0 HH TYR A 92 -7.552 1.374 6.198 1.00 0.00 H new ATOM 1422 N LEU A 93 -6.550 1.551 -1.051 1.00 0.00 N ATOM 1423 CA LEU A 93 -5.352 2.382 -1.071 1.00 0.00 C ATOM 1424 C LEU A 93 -5.601 3.684 -1.825 1.00 0.00 C ATOM 1425 O LEU A 93 -5.055 4.730 -1.474 1.00 0.00 O ATOM 1426 CB LEU A 93 -4.190 1.621 -1.715 1.00 0.00 C ATOM 1427 CG LEU A 93 -3.786 0.331 -0.999 1.00 0.00 C ATOM 1428 CD1 LEU A 93 -2.814 -0.469 -1.851 1.00 0.00 C ATOM 1429 CD2 LEU A 93 -3.176 0.644 0.359 1.00 0.00 C ATOM 0 H LEU A 93 -6.432 0.630 -1.473 1.00 0.00 H new ATOM 0 HA LEU A 93 -5.094 2.626 -0.040 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -4.459 1.379 -2.743 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -3.324 2.281 -1.759 1.00 0.00 H new ATOM 0 HG LEU A 93 -4.681 -0.272 -0.842 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -2.537 -1.383 -1.326 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -3.286 -0.724 -2.800 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -1.920 0.126 -2.039 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -2.894 -0.285 0.854 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -2.291 1.267 0.226 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -3.905 1.175 0.971 1.00 0.00 H new ATOM 1441 N ASN A 94 -6.429 3.614 -2.862 1.00 0.00 N ATOM 1442 CA ASN A 94 -6.751 4.788 -3.665 1.00 0.00 C ATOM 1443 C ASN A 94 -7.514 5.819 -2.838 1.00 0.00 C ATOM 1444 O ASN A 94 -7.395 7.023 -3.066 1.00 0.00 O ATOM 1445 CB ASN A 94 -7.576 4.385 -4.888 1.00 0.00 C ATOM 1446 CG ASN A 94 -6.722 4.218 -6.130 1.00 0.00 C ATOM 1447 OD1 ASN A 94 -7.094 4.660 -7.218 1.00 0.00 O ATOM 1448 ND2 ASN A 94 -5.569 3.577 -5.975 1.00 0.00 N ATOM 0 H ASN A 94 -6.889 2.756 -3.166 1.00 0.00 H new ATOM 0 HA ASN A 94 -5.816 5.237 -4.000 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -8.097 3.450 -4.680 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -8.339 5.141 -5.074 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -4.953 3.435 -6.775 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -5.300 3.227 -5.056 1.00 0.00 H new ATOM 1455 N GLN A 95 -8.296 5.338 -1.878 1.00 0.00 N ATOM 1456 CA GLN A 95 -9.079 6.219 -1.017 1.00 0.00 C ATOM 1457 C GLN A 95 -8.200 6.852 0.058 1.00 0.00 C ATOM 1458 O GLN A 95 -8.421 7.993 0.462 1.00 0.00 O ATOM 1459 CB GLN A 95 -10.223 5.442 -0.364 1.00 0.00 C ATOM 1460 CG GLN A 95 -11.504 6.250 -0.225 1.00 0.00 C ATOM 1461 CD GLN A 95 -12.422 5.705 0.851 1.00 0.00 C ATOM 1462 OE1 GLN A 95 -12.734 4.514 0.874 1.00 0.00 O ATOM 1463 NE2 GLN A 95 -12.862 6.577 1.751 1.00 0.00 N ATOM 0 H GLN A 95 -8.405 4.344 -1.676 1.00 0.00 H new ATOM 0 HA GLN A 95 -9.495 7.015 -1.635 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -10.428 4.549 -0.954 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -9.906 5.106 0.623 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -11.253 7.285 0.006 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -12.031 6.255 -1.179 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -12.578 7.555 1.695 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -13.484 6.269 2.499 1.00 0.00 H new ATOM 1472 N VAL A 96 -7.203 6.102 0.516 1.00 0.00 N ATOM 1473 CA VAL A 96 -6.291 6.589 1.545 1.00 0.00 C ATOM 1474 C VAL A 96 -5.373 7.677 0.998 1.00 0.00 C ATOM 1475 O VAL A 96 -4.946 8.569 1.730 1.00 0.00 O ATOM 1476 CB VAL A 96 -5.430 5.448 2.118 1.00 0.00 C ATOM 1477 CG1 VAL A 96 -4.633 5.932 3.320 1.00 0.00 C ATOM 1478 CG2 VAL A 96 -6.300 4.257 2.490 1.00 0.00 C ATOM 0 H VAL A 96 -7.006 5.155 0.191 1.00 0.00 H new ATOM 0 HA VAL A 96 -6.908 7.005 2.342 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.726 5.128 1.350 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -4.031 5.112 3.711 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -3.979 6.750 3.018 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.317 6.281 4.094 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -5.674 3.461 2.893 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.030 4.560 3.241 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -6.820 3.896 1.603 1.00 0.00 H new ATOM 1488 N CYS A 97 -5.074 7.597 -0.295 1.00 0.00 N ATOM 1489 CA CYS A 97 -4.207 8.577 -0.939 1.00 0.00 C ATOM 1490 C CYS A 97 -4.933 9.903 -1.134 1.00 0.00 C ATOM 1491 O CYS A 97 -5.257 10.289 -2.257 1.00 0.00 O ATOM 1492 CB CYS A 97 -3.717 8.045 -2.289 1.00 0.00 C ATOM 1493 SG CYS A 97 -2.184 8.808 -2.871 1.00 0.00 S ATOM 0 H CYS A 97 -5.419 6.865 -0.916 1.00 0.00 H new ATOM 0 HA CYS A 97 -3.348 8.748 -0.290 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -3.567 6.968 -2.210 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -4.496 8.205 -3.035 1.00 0.00 H new ATOM 0 HG CYS A 97 -1.850 8.292 -4.017 1.00 0.00 H new ATOM 1499 N LEU A 98 -5.189 10.598 -0.030 1.00 0.00 N ATOM 1500 CA LEU A 98 -5.878 11.883 -0.077 1.00 0.00 C ATOM 1501 C LEU A 98 -4.895 13.036 0.096 1.00 0.00 C ATOM 1502 O LEU A 98 -4.320 13.218 1.170 1.00 0.00 O ATOM 1503 CB LEU A 98 -6.955 11.948 1.008 1.00 0.00 C ATOM 1504 CG LEU A 98 -7.939 10.774 1.017 1.00 0.00 C ATOM 1505 CD1 LEU A 98 -7.771 9.943 2.280 1.00 0.00 C ATOM 1506 CD2 LEU A 98 -9.371 11.275 0.893 1.00 0.00 C ATOM 0 H LEU A 98 -4.930 10.293 0.908 1.00 0.00 H new ATOM 0 HA LEU A 98 -6.350 11.977 -1.055 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -6.466 12.000 1.981 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -7.518 12.873 0.884 1.00 0.00 H new ATOM 0 HG LEU A 98 -7.722 10.139 0.158 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -8.479 9.114 2.267 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -6.755 9.552 2.325 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -7.959 10.567 3.154 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -10.055 10.427 0.901 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -9.600 11.934 1.731 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -9.485 11.824 -0.042 1.00 0.00 H new ATOM 1518 N ASN A 99 -4.707 13.810 -0.966 1.00 0.00 N ATOM 1519 CA ASN A 99 -3.793 14.946 -0.931 1.00 0.00 C ATOM 1520 C ASN A 99 -4.192 15.998 -1.961 1.00 0.00 C ATOM 1521 O ASN A 99 -3.858 15.884 -3.140 1.00 0.00 O ATOM 1522 CB ASN A 99 -2.358 14.483 -1.188 1.00 0.00 C ATOM 1523 CG ASN A 99 -1.336 15.556 -0.866 1.00 0.00 C ATOM 1524 OD1 ASN A 99 -0.741 15.559 0.213 1.00 0.00 O ATOM 1525 ND2 ASN A 99 -1.129 16.476 -1.801 1.00 0.00 N ATOM 0 H ASN A 99 -5.175 13.672 -1.862 1.00 0.00 H new ATOM 0 HA ASN A 99 -3.850 15.394 0.061 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -2.152 13.597 -0.587 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -2.256 14.190 -2.233 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -0.455 17.224 -1.640 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -1.644 16.435 -2.680 1.00 0.00 H new ATOM 1532 N ASP A 100 -4.906 17.023 -1.508 1.00 0.00 N ATOM 1533 CA ASP A 100 -5.349 18.096 -2.390 1.00 0.00 C ATOM 1534 C ASP A 100 -4.231 19.105 -2.623 1.00 0.00 C ATOM 1535 O ASP A 100 -3.292 19.200 -1.833 1.00 0.00 O ATOM 1536 CB ASP A 100 -6.572 18.799 -1.797 1.00 0.00 C ATOM 1537 CG ASP A 100 -7.862 18.059 -2.087 1.00 0.00 C ATOM 1538 OD1 ASP A 100 -7.956 16.866 -1.730 1.00 0.00 O ATOM 1539 OD2 ASP A 100 -8.780 18.672 -2.673 1.00 0.00 O ATOM 0 H ASP A 100 -5.190 17.133 -0.535 1.00 0.00 H new ATOM 0 HA ASP A 100 -5.621 17.656 -3.349 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -6.446 18.894 -0.719 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -6.638 19.810 -2.200 1.00 0.00 H new ATOM 1544 N TYR A 101 -4.337 19.858 -3.714 1.00 0.00 N ATOM 1545 CA TYR A 101 -3.334 20.861 -4.052 1.00 0.00 C ATOM 1546 C TYR A 101 -3.894 22.269 -3.885 1.00 0.00 C ATOM 1547 O TYR A 101 -3.450 23.027 -3.022 1.00 0.00 O ATOM 1548 CB TYR A 101 -2.844 20.660 -5.487 1.00 0.00 C ATOM 1549 CG TYR A 101 -1.414 21.101 -5.707 1.00 0.00 C ATOM 1550 CD1 TYR A 101 -0.392 20.640 -4.887 1.00 0.00 C ATOM 1551 CD2 TYR A 101 -1.088 21.978 -6.734 1.00 0.00 C ATOM 1552 CE1 TYR A 101 0.916 21.041 -5.084 1.00 0.00 C ATOM 1553 CE2 TYR A 101 0.218 22.383 -6.938 1.00 0.00 C ATOM 1554 CZ TYR A 101 1.216 21.911 -6.111 1.00 0.00 C ATOM 1555 OH TYR A 101 2.516 22.313 -6.311 1.00 0.00 O ATOM 0 H TYR A 101 -5.108 19.792 -4.379 1.00 0.00 H new ATOM 0 HA TYR A 101 -2.493 20.742 -3.369 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -2.934 19.606 -5.748 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -3.494 21.213 -6.165 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -0.623 19.957 -4.083 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -1.867 22.349 -7.383 1.00 0.00 H new ATOM 0 HE1 TYR A 101 1.699 20.675 -4.437 1.00 0.00 H new ATOM 0 HE2 TYR A 101 0.456 23.065 -7.741 1.00 0.00 H new ATOM 0 HH TYR A 101 2.555 22.925 -7.076 1.00 0.00 H new ATOM 1565 N ARG A 102 -4.872 22.614 -4.717 1.00 0.00 N ATOM 1566 CA ARG A 102 -5.493 23.933 -4.663 1.00 0.00 C ATOM 1567 C ARG A 102 -6.935 23.834 -4.174 1.00 0.00 C ATOM 1568 O ARG A 102 -7.616 22.838 -4.415 1.00 0.00 O ATOM 1569 CB ARG A 102 -5.452 24.596 -6.039 1.00 0.00 C ATOM 1570 CG ARG A 102 -4.098 25.192 -6.389 1.00 0.00 C ATOM 1571 CD ARG A 102 -4.006 26.650 -5.971 1.00 0.00 C ATOM 1572 NE ARG A 102 -4.323 27.556 -7.073 1.00 0.00 N ATOM 1573 CZ ARG A 102 -3.989 28.845 -7.092 1.00 0.00 C ATOM 1574 NH1 ARG A 102 -3.329 29.382 -6.073 1.00 0.00 N ATOM 1575 NH2 ARG A 102 -4.315 29.598 -8.133 1.00 0.00 N ATOM 0 H ARG A 102 -5.251 21.999 -5.436 1.00 0.00 H new ATOM 0 HA ARG A 102 -4.930 24.545 -3.958 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -5.722 23.859 -6.796 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -6.206 25.382 -6.077 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -3.310 24.621 -5.898 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -3.929 25.109 -7.463 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -4.690 26.834 -5.142 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -3.000 26.860 -5.607 1.00 0.00 H new ATOM 0 HE ARG A 102 -4.830 27.179 -7.874 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -3.075 28.807 -5.270 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -3.076 30.370 -6.093 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -4.821 29.190 -8.919 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -4.060 30.585 -8.148 1.00 0.00 H new ATOM 1589 N GLU A 103 -7.393 24.875 -3.486 1.00 0.00 N ATOM 1590 CA GLU A 103 -8.754 24.906 -2.964 1.00 0.00 C ATOM 1591 C GLU A 103 -9.358 26.301 -3.100 1.00 0.00 C ATOM 1592 O GLU A 103 -8.696 27.233 -3.557 1.00 0.00 O ATOM 1593 CB GLU A 103 -8.770 24.472 -1.498 1.00 0.00 C ATOM 1594 CG GLU A 103 -10.052 23.765 -1.087 1.00 0.00 C ATOM 1595 CD GLU A 103 -9.832 22.758 0.024 1.00 0.00 C ATOM 1596 OE1 GLU A 103 -9.389 21.630 -0.276 1.00 0.00 O ATOM 1597 OE2 GLU A 103 -10.102 23.097 1.196 1.00 0.00 O ATOM 0 H GLU A 103 -6.842 25.708 -3.277 1.00 0.00 H new ATOM 0 HA GLU A 103 -9.356 24.210 -3.548 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -7.924 23.809 -1.315 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -8.630 25.349 -0.866 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -10.783 24.506 -0.762 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -10.477 23.258 -1.953 1.00 0.00 H new ATOM 1604 N ILE A 104 -10.618 26.436 -2.700 1.00 0.00 N ATOM 1605 CA ILE A 104 -11.311 27.716 -2.776 1.00 0.00 C ATOM 1606 C ILE A 104 -11.297 28.430 -1.430 1.00 0.00 C ATOM 1607 O ILE A 104 -12.223 29.172 -1.100 1.00 0.00 O ATOM 1608 CB ILE A 104 -12.771 27.538 -3.236 1.00 0.00 C ATOM 1609 CG1 ILE A 104 -13.507 26.571 -2.307 1.00 0.00 C ATOM 1610 CG2 ILE A 104 -12.817 27.041 -4.673 1.00 0.00 C ATOM 1611 CD1 ILE A 104 -14.938 26.974 -2.026 1.00 0.00 C ATOM 0 H ILE A 104 -11.180 25.674 -2.320 1.00 0.00 H new ATOM 0 HA ILE A 104 -10.778 28.321 -3.510 1.00 0.00 H new ATOM 0 HB ILE A 104 -13.271 28.505 -3.191 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -13.499 25.576 -2.752 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -12.965 26.503 -1.364 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -13.855 26.920 -4.983 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -12.325 27.764 -5.324 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -12.304 26.082 -4.743 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -15.398 26.243 -1.361 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -14.953 27.956 -1.552 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -15.495 27.014 -2.962 1.00 0.00 H new ATOM 1623 N TYR A 105 -10.243 28.201 -0.654 1.00 0.00 N ATOM 1624 CA TYR A 105 -10.110 28.824 0.658 1.00 0.00 C ATOM 1625 C TYR A 105 -9.806 30.313 0.523 1.00 0.00 C ATOM 1626 O TYR A 105 -8.846 30.703 -0.141 1.00 0.00 O ATOM 1627 CB TYR A 105 -9.005 28.136 1.462 1.00 0.00 C ATOM 1628 CG TYR A 105 -9.268 28.108 2.951 1.00 0.00 C ATOM 1629 CD1 TYR A 105 -10.147 27.184 3.503 1.00 0.00 C ATOM 1630 CD2 TYR A 105 -8.639 29.007 3.804 1.00 0.00 C ATOM 1631 CE1 TYR A 105 -10.390 27.156 4.864 1.00 0.00 C ATOM 1632 CE2 TYR A 105 -8.878 28.984 5.165 1.00 0.00 C ATOM 1633 CZ TYR A 105 -9.753 28.057 5.689 1.00 0.00 C ATOM 1634 OH TYR A 105 -9.993 28.032 7.044 1.00 0.00 O ATOM 0 H TYR A 105 -9.469 27.589 -0.911 1.00 0.00 H new ATOM 0 HA TYR A 105 -11.057 28.711 1.186 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -8.889 27.114 1.103 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -8.061 28.648 1.278 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -10.648 26.477 2.859 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -7.953 29.735 3.397 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -11.076 26.432 5.278 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -8.381 29.689 5.815 1.00 0.00 H new ATOM 0 HH TYR A 105 -9.465 28.731 7.483 1.00 0.00 H new ATOM 1644 N ARG A 106 -10.631 31.139 1.158 1.00 0.00 N ATOM 1645 CA ARG A 106 -10.450 32.586 1.109 1.00 0.00 C ATOM 1646 C ARG A 106 -10.541 33.096 -0.326 1.00 0.00 C ATOM 1647 O ARG A 106 -9.902 34.085 -0.685 1.00 0.00 O ATOM 1648 CB ARG A 106 -9.101 32.972 1.717 1.00 0.00 C ATOM 1649 CG ARG A 106 -9.176 33.316 3.196 1.00 0.00 C ATOM 1650 CD ARG A 106 -8.034 34.227 3.619 1.00 0.00 C ATOM 1651 NE ARG A 106 -7.163 33.592 4.604 1.00 0.00 N ATOM 1652 CZ ARG A 106 -6.242 32.680 4.301 1.00 0.00 C ATOM 1653 NH1 ARG A 106 -6.069 32.294 3.042 1.00 0.00 N ATOM 1654 NH2 ARG A 106 -5.491 32.153 5.258 1.00 0.00 N ATOM 0 H ARG A 106 -11.431 30.832 1.712 1.00 0.00 H new ATOM 0 HA ARG A 106 -11.247 33.048 1.691 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -8.401 32.148 1.579 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -8.698 33.827 1.174 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -10.128 33.803 3.409 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -9.148 32.399 3.785 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -7.448 34.505 2.743 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -8.441 35.149 4.035 1.00 0.00 H new ATOM 0 HE ARG A 106 -7.266 33.863 5.582 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -6.643 32.697 2.302 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -5.362 31.595 2.816 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -5.619 32.446 6.226 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -4.785 31.454 5.026 1.00 0.00 H new ATOM 1668 N GLU A 107 -11.340 32.416 -1.141 1.00 0.00 N ATOM 1669 CA GLU A 107 -11.515 32.801 -2.537 1.00 0.00 C ATOM 1670 C GLU A 107 -12.895 32.397 -3.043 1.00 0.00 C ATOM 1671 O GLU A 107 -13.092 31.275 -3.512 1.00 0.00 O ATOM 1672 CB GLU A 107 -10.432 32.157 -3.404 1.00 0.00 C ATOM 1673 CG GLU A 107 -10.459 32.619 -4.852 1.00 0.00 C ATOM 1674 CD GLU A 107 -9.495 33.759 -5.118 1.00 0.00 C ATOM 1675 OE1 GLU A 107 -8.498 33.879 -4.375 1.00 0.00 O ATOM 1676 OE2 GLU A 107 -9.736 34.531 -6.070 1.00 0.00 O ATOM 0 H GLU A 107 -11.877 31.596 -0.859 1.00 0.00 H new ATOM 0 HA GLU A 107 -11.427 33.885 -2.603 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -9.455 32.382 -2.977 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -10.551 31.074 -3.374 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -10.212 31.780 -5.502 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -11.470 32.935 -5.110 1.00 0.00 H new ATOM 1683 N HIS A 108 -13.848 33.317 -2.947 1.00 0.00 N ATOM 1684 CA HIS A 108 -15.212 33.056 -3.395 1.00 0.00 C ATOM 1685 C HIS A 108 -15.264 32.901 -4.912 1.00 0.00 C ATOM 1686 O HIS A 108 -14.449 33.478 -5.633 1.00 0.00 O ATOM 1687 CB HIS A 108 -16.142 34.187 -2.949 1.00 0.00 C ATOM 1688 CG HIS A 108 -17.254 33.730 -2.058 1.00 0.00 C ATOM 1689 ND1 HIS A 108 -17.175 32.631 -1.233 1.00 0.00 N ATOM 1690 CD2 HIS A 108 -18.494 34.251 -1.869 1.00 0.00 C ATOM 1691 CE1 HIS A 108 -18.342 32.518 -0.584 1.00 0.00 C ATOM 1692 NE2 HIS A 108 -19.176 33.478 -0.934 1.00 0.00 N ATOM 0 H HIS A 108 -13.702 34.251 -2.563 1.00 0.00 H new ATOM 0 HA HIS A 108 -15.547 32.123 -2.942 1.00 0.00 H new ATOM 0 HB2 HIS A 108 -15.556 34.943 -2.427 1.00 0.00 H new ATOM 0 HB3 HIS A 108 -16.567 34.666 -3.831 1.00 0.00 H new ATOM 0 HD2 HIS A 108 -18.888 35.126 -2.365 1.00 0.00 H new ATOM 0 HE1 HIS A 108 -18.570 31.742 0.132 1.00 0.00 H new ATOM 0 HE2 HIS A 108 -20.125 33.624 -0.590 1.00 0.00 H new ATOM 1700 N VAL A 109 -16.226 32.120 -5.390 1.00 0.00 N ATOM 1701 CA VAL A 109 -16.385 31.889 -6.820 1.00 0.00 C ATOM 1702 C VAL A 109 -16.994 33.107 -7.507 1.00 0.00 C ATOM 1703 O VAL A 109 -17.789 33.836 -6.912 1.00 0.00 O ATOM 1704 CB VAL A 109 -17.272 30.660 -7.097 1.00 0.00 C ATOM 1705 CG1 VAL A 109 -17.298 30.344 -8.586 1.00 0.00 C ATOM 1706 CG2 VAL A 109 -16.787 29.459 -6.299 1.00 0.00 C ATOM 0 H VAL A 109 -16.908 31.636 -4.807 1.00 0.00 H new ATOM 0 HA VAL A 109 -15.389 31.706 -7.224 1.00 0.00 H new ATOM 0 HB VAL A 109 -18.289 30.891 -6.780 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -17.929 29.473 -8.762 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -17.698 31.198 -9.132 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -16.286 30.134 -8.931 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -17.426 28.601 -6.508 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -15.761 29.225 -6.582 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -16.826 29.690 -5.234 1.00 0.00 H new ATOM 1716 N SER A 110 -16.617 33.322 -8.764 1.00 0.00 N ATOM 1717 CA SER A 110 -17.127 34.452 -9.532 1.00 0.00 C ATOM 1718 C SER A 110 -17.614 34.001 -10.906 1.00 0.00 C ATOM 1719 O SER A 110 -17.158 32.988 -11.435 1.00 0.00 O ATOM 1720 CB SER A 110 -16.042 35.520 -9.688 1.00 0.00 C ATOM 1721 OG SER A 110 -16.594 36.822 -9.613 1.00 0.00 O ATOM 0 H SER A 110 -15.961 32.729 -9.272 1.00 0.00 H new ATOM 0 HA SER A 110 -17.971 34.877 -8.989 1.00 0.00 H new ATOM 0 HB2 SER A 110 -15.290 35.395 -8.909 1.00 0.00 H new ATOM 0 HB3 SER A 110 -15.535 35.391 -10.644 1.00 0.00 H new ATOM 0 HG SER A 110 -15.880 37.486 -9.714 1.00 0.00 H new ATOM 1727 N GLY A 111 -18.542 34.762 -11.477 1.00 0.00 N ATOM 1728 CA GLY A 111 -19.075 34.423 -12.784 1.00 0.00 C ATOM 1729 C GLY A 111 -20.245 33.461 -12.703 1.00 0.00 C ATOM 1730 O GLY A 111 -20.449 32.815 -11.675 1.00 0.00 O ATOM 0 H GLY A 111 -18.934 35.606 -11.059 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -19.393 35.334 -13.291 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -18.286 33.979 -13.391 1.00 0.00 H new ATOM 1734 N PRO A 112 -21.038 33.341 -13.781 1.00 0.00 N ATOM 1735 CA PRO A 112 -22.196 32.442 -13.814 1.00 0.00 C ATOM 1736 C PRO A 112 -21.788 30.974 -13.833 1.00 0.00 C ATOM 1737 O PRO A 112 -22.355 30.151 -13.114 1.00 0.00 O ATOM 1738 CB PRO A 112 -22.903 32.818 -15.118 1.00 0.00 C ATOM 1739 CG PRO A 112 -21.828 33.383 -15.981 1.00 0.00 C ATOM 1740 CD PRO A 112 -20.870 34.073 -15.051 1.00 0.00 C ATOM 0 HA PRO A 112 -22.822 32.552 -12.929 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -23.367 31.948 -15.582 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -23.695 33.547 -14.943 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -21.326 32.596 -16.545 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -22.239 34.084 -16.708 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -19.844 34.015 -15.415 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -21.109 35.131 -14.940 1.00 0.00 H new ATOM 1748 N SER A 113 -20.799 30.651 -14.661 1.00 0.00 N ATOM 1749 CA SER A 113 -20.315 29.280 -14.775 1.00 0.00 C ATOM 1750 C SER A 113 -18.954 29.238 -15.461 1.00 0.00 C ATOM 1751 O SER A 113 -18.658 30.063 -16.326 1.00 0.00 O ATOM 1752 CB SER A 113 -21.317 28.424 -15.551 1.00 0.00 C ATOM 1753 OG SER A 113 -22.065 29.214 -16.460 1.00 0.00 O ATOM 0 H SER A 113 -20.318 31.320 -15.262 1.00 0.00 H new ATOM 0 HA SER A 113 -20.207 28.876 -13.768 1.00 0.00 H new ATOM 0 HB2 SER A 113 -20.788 27.641 -16.094 1.00 0.00 H new ATOM 0 HB3 SER A 113 -21.992 27.927 -14.854 1.00 0.00 H new ATOM 0 HG SER A 113 -22.697 28.644 -16.945 1.00 0.00 H new ATOM 1759 N SER A 114 -18.128 28.273 -15.071 1.00 0.00 N ATOM 1760 CA SER A 114 -16.797 28.125 -15.650 1.00 0.00 C ATOM 1761 C SER A 114 -16.471 26.655 -15.892 1.00 0.00 C ATOM 1762 O SER A 114 -16.732 25.802 -15.044 1.00 0.00 O ATOM 1763 CB SER A 114 -15.746 28.747 -14.729 1.00 0.00 C ATOM 1764 OG SER A 114 -16.159 30.025 -14.273 1.00 0.00 O ATOM 0 H SER A 114 -18.356 27.582 -14.357 1.00 0.00 H new ATOM 0 HA SER A 114 -16.784 28.645 -16.608 1.00 0.00 H new ATOM 0 HB2 SER A 114 -15.572 28.092 -13.876 1.00 0.00 H new ATOM 0 HB3 SER A 114 -14.799 28.836 -15.261 1.00 0.00 H new ATOM 0 HG SER A 114 -15.471 30.401 -13.685 1.00 0.00 H new ATOM 1770 N GLY A 115 -15.898 26.365 -17.055 1.00 0.00 N ATOM 1771 CA GLY A 115 -15.545 24.998 -17.389 1.00 0.00 C ATOM 1772 C GLY A 115 -14.053 24.747 -17.301 1.00 0.00 C ATOM 1773 O GLY A 115 -13.289 25.465 -17.980 1.00 0.00 O ATOM 1774 OXT GLY A 115 -13.647 23.831 -16.555 1.00 0.00 O ATOM 0 H GLY A 115 -15.672 27.053 -17.773 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -16.065 24.317 -16.716 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -15.889 24.773 -18.399 1.00 0.00 H new TER 1778 GLY A 115