USER MOD reduce.3.24.130724 H: found=0, std=0, add=1160, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1160 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 145 SER OG : rot -151:sc= -0.0661 USER MOD Set 1.2: A 148 THR OG1 : rot 78:sc= -0.374 USER MOD Set 2.1: A 94 HIS : no HD1:sc= 0.761 K(o=0.58,f=-4.4) USER MOD Set 2.2: A 137 TYR OH : rot 14:sc= -0.18 USER MOD Set 3.1: A 86 ASN : amide:sc= -0.723 X(o=-1.7,f=-2.1) USER MOD Set 3.2: A 89 SER OG : rot -72:sc= -0.971 USER MOD Set 4.1: A 87 THR OG1 : rot -14:sc= 0.523 USER MOD Set 4.2: A 124 THR OG1 : rot -60:sc= 1.6 USER MOD Set 5.1: A 67 MET CE :methyl -147:sc= -0.518 (180deg=-1.75!) USER MOD Set 5.2: A 71 TYR OH : rot 180:sc= 0 USER MOD Set 6.1: A 16 LYS NZ :NH3+ -178:sc= 0.921 (180deg=0.442) USER MOD Set 6.2: A 58 THR OG1 : rot 180:sc= 0.435 USER MOD Set 7.1: A 4 TYR OH : rot 180:sc= 0 USER MOD Set 7.2: A 51 CYS SG : rot 12:sc= -0.293 USER MOD Single : A 1 MET CE :methyl -152:sc= -0.622 (180deg=-2.5!) USER MOD Single : A 1 MET N :NH3+ -121:sc= 0.905 (180deg=-0.372) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 153:sc= 0 (180deg=-0.0722) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 68:sc= 0.0994 USER MOD Single : A 22 GLN : amide:sc= -0.262 K(o=-0.26,f=-1.4) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ -162:sc= 1.27 (180deg=1.19) USER MOD Single : A 43 GLN : amide:sc= -0.141 X(o=-0.14,f=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= -0.576 K(o=-0.58,f=-4.1!) USER MOD Single : A 72 MET CE :methyl -138:sc= -0.268 (180deg=-2.06!) USER MOD Single : A 74 THR OG1 : rot -108:sc= -0.951 USER MOD Single : A 80 CYS SG : rot 180:sc= -0.497 USER MOD Single : A 85 ASN : amide:sc= -4.89! C(o=-4.9!,f=-5.7!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -0.954 K(o=-0.95,f=-2.8!) USER MOD Single : A 96 TYR OH : rot -71:sc= -0.0168 USER MOD Single : A 99 GLN : amide:sc= -0.08 X(o=-0.08,f=0) USER MOD Single : A 101 LYS NZ :NH3+ -122:sc= 0.056 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 111 MET CE :methyl -170:sc= -5.08! (180deg=-5.87!) USER MOD Single : A 116 ASN : amide:sc= -0.988 K(o=-0.99,f=-13!) USER MOD Single : A 117 LYS NZ :NH3+ 144:sc= 0.269 (180deg=-0.575) USER MOD Single : A 118 CYS SG : rot -47:sc= -0.44 USER MOD Single : A 127 SER OG : rot 180:sc= -0.0822 USER MOD Single : A 129 GLN : amide:sc= -0.157 X(o=-0.16,f=0) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 141 TYR OH : rot 30:sc= 0 USER MOD Single : A 144 THR OG1 : rot -38:sc=-0.00426 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 TYR OH : rot 144:sc= 0.778 USER MOD Single : A 158 THR OG1 : rot 62:sc= 0.327 USER MOD Single : A 165 GLN : amide:sc= -0.231 X(o=-0.23,f=0) USER MOD Single : A 166 HIS : no HE2:sc= 0.184 K(o=0.18,f=-4.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.103 -3.718 22.443 1.00 12.42 N ATOM 2 CA MET A 1 -1.744 -2.887 21.390 1.00 52.33 C ATOM 3 C MET A 1 -2.226 -3.746 20.226 1.00 53.14 C ATOM 4 O MET A 1 -1.679 -4.816 19.964 1.00 51.22 O ATOM 5 CB MET A 1 -0.727 -1.855 20.898 1.00 31.10 C ATOM 6 CG MET A 1 0.616 -2.456 20.518 1.00 22.02 C ATOM 7 SD MET A 1 1.797 -2.433 21.881 1.00 23.14 S ATOM 8 CE MET A 1 1.834 -0.685 22.266 1.00 13.52 C ATOM 0 H1 MET A 1 -1.611 -3.592 23.342 1.00 12.42 H new ATOM 0 H2 MET A 1 -1.137 -4.719 22.163 1.00 12.42 H new ATOM 0 H3 MET A 1 -0.112 -3.425 22.561 1.00 12.42 H new ATOM 0 HA MET A 1 -2.616 -2.386 21.811 1.00 52.33 H new ATOM 0 HB2 MET A 1 -1.140 -1.334 20.034 1.00 31.10 H new ATOM 0 HB3 MET A 1 -0.574 -1.108 21.677 1.00 31.10 H new ATOM 0 HG2 MET A 1 0.469 -3.484 20.187 1.00 22.02 H new ATOM 0 HG3 MET A 1 1.031 -1.905 19.674 1.00 22.02 H new ATOM 0 HE1 MET A 1 2.804 -0.426 22.691 1.00 13.52 H new ATOM 0 HE2 MET A 1 1.671 -0.108 21.355 1.00 13.52 H new ATOM 0 HE3 MET A 1 1.049 -0.454 22.986 1.00 13.52 H new ATOM 18 N THR A 2 -3.253 -3.268 19.531 1.00 44.10 N ATOM 19 CA THR A 2 -3.808 -3.993 18.394 1.00 43.22 C ATOM 20 C THR A 2 -2.787 -4.075 17.260 1.00 34.23 C ATOM 21 O THR A 2 -1.953 -3.185 17.098 1.00 32.32 O ATOM 22 CB THR A 2 -5.107 -3.320 17.921 1.00 32.23 C ATOM 23 OG1 THR A 2 -6.197 -4.218 18.025 1.00 33.50 O ATOM 24 CG2 THR A 2 -5.067 -2.820 16.490 1.00 72.33 C ATOM 0 H THR A 2 -3.717 -2.383 19.735 1.00 44.10 H new ATOM 0 HA THR A 2 -4.043 -5.011 18.706 1.00 43.22 H new ATOM 0 HB THR A 2 -5.225 -2.457 18.576 1.00 32.23 H new ATOM 0 HG1 THR A 2 -7.017 -3.774 17.722 1.00 33.50 H new ATOM 0 HG21 THR A 2 -6.023 -2.360 16.239 1.00 72.33 H new ATOM 0 HG22 THR A 2 -4.270 -2.084 16.384 1.00 72.33 H new ATOM 0 HG23 THR A 2 -4.879 -3.657 15.817 1.00 72.33 H new ATOM 32 N GLU A 3 -2.862 -5.147 16.480 1.00 3.34 N ATOM 33 CA GLU A 3 -1.945 -5.342 15.363 1.00 50.33 C ATOM 34 C GLU A 3 -2.650 -5.113 14.032 1.00 63.01 C ATOM 35 O GLU A 3 -3.615 -5.801 13.701 1.00 63.33 O ATOM 36 CB GLU A 3 -1.350 -6.752 15.404 1.00 14.11 C ATOM 37 CG GLU A 3 0.014 -6.818 16.072 1.00 25.13 C ATOM 38 CD GLU A 3 0.213 -8.094 16.866 1.00 25.22 C ATOM 39 OE1 GLU A 3 0.594 -9.118 16.260 1.00 73.45 O ATOM 40 OE2 GLU A 3 -0.010 -8.070 18.095 1.00 40.43 O ATOM 0 H GLU A 3 -3.547 -5.893 16.600 1.00 3.34 H new ATOM 0 HA GLU A 3 -1.140 -4.613 15.456 1.00 50.33 H new ATOM 0 HB2 GLU A 3 -2.037 -7.412 15.934 1.00 14.11 H new ATOM 0 HB3 GLU A 3 -1.265 -7.131 14.386 1.00 14.11 H new ATOM 0 HG2 GLU A 3 0.791 -6.743 15.311 1.00 25.13 H new ATOM 0 HG3 GLU A 3 0.132 -5.960 16.734 1.00 25.13 H new ATOM 47 N TYR A 4 -2.160 -4.140 13.273 1.00 31.23 N ATOM 48 CA TYR A 4 -2.738 -3.816 11.976 1.00 20.22 C ATOM 49 C TYR A 4 -1.821 -4.269 10.846 1.00 34.42 C ATOM 50 O TYR A 4 -0.759 -3.686 10.624 1.00 32.41 O ATOM 51 CB TYR A 4 -2.990 -2.312 11.872 1.00 74.31 C ATOM 52 CG TYR A 4 -4.170 -1.839 12.689 1.00 33.25 C ATOM 53 CD1 TYR A 4 -5.438 -2.365 12.478 1.00 32.03 C ATOM 54 CD2 TYR A 4 -4.017 -0.867 13.669 1.00 72.22 C ATOM 55 CE1 TYR A 4 -6.521 -1.935 13.221 1.00 13.12 C ATOM 56 CE2 TYR A 4 -5.095 -0.432 14.417 1.00 42.11 C ATOM 57 CZ TYR A 4 -6.344 -0.969 14.189 1.00 45.02 C ATOM 58 OH TYR A 4 -7.420 -0.538 14.932 1.00 3.24 O ATOM 0 H TYR A 4 -1.362 -3.561 13.535 1.00 31.23 H new ATOM 0 HA TYR A 4 -3.687 -4.344 11.884 1.00 20.22 H new ATOM 0 HB2 TYR A 4 -2.097 -1.779 12.197 1.00 74.31 H new ATOM 0 HB3 TYR A 4 -3.154 -2.051 10.827 1.00 74.31 H new ATOM 0 HD1 TYR A 4 -5.580 -3.122 11.721 1.00 32.03 H new ATOM 0 HD2 TYR A 4 -3.040 -0.444 13.850 1.00 72.22 H new ATOM 0 HE1 TYR A 4 -7.501 -2.353 13.044 1.00 13.12 H new ATOM 0 HE2 TYR A 4 -4.959 0.324 15.176 1.00 42.11 H new ATOM 0 HH TYR A 4 -7.124 0.144 15.571 1.00 3.24 H new ATOM 68 N LYS A 5 -2.234 -5.313 10.136 1.00 72.34 N ATOM 69 CA LYS A 5 -1.444 -5.842 9.032 1.00 25.00 C ATOM 70 C LYS A 5 -1.857 -5.205 7.709 1.00 24.45 C ATOM 71 O LYS A 5 -2.840 -5.613 7.090 1.00 75.53 O ATOM 72 CB LYS A 5 -1.588 -7.363 8.953 1.00 11.20 C ATOM 73 CG LYS A 5 -0.260 -8.098 9.014 1.00 72.00 C ATOM 74 CD LYS A 5 0.014 -8.862 7.730 1.00 0.24 C ATOM 75 CE LYS A 5 0.667 -10.202 8.017 1.00 21.42 C ATOM 76 NZ LYS A 5 2.153 -10.103 8.056 1.00 0.41 N ATOM 0 H LYS A 5 -3.109 -5.808 10.305 1.00 72.34 H new ATOM 0 HA LYS A 5 -0.399 -5.596 9.218 1.00 25.00 H new ATOM 0 HB2 LYS A 5 -2.221 -7.704 9.772 1.00 11.20 H new ATOM 0 HB3 LYS A 5 -2.098 -7.625 8.026 1.00 11.20 H new ATOM 0 HG2 LYS A 5 0.544 -7.384 9.192 1.00 72.00 H new ATOM 0 HG3 LYS A 5 -0.264 -8.790 9.856 1.00 72.00 H new ATOM 0 HD2 LYS A 5 -0.920 -9.018 7.190 1.00 0.24 H new ATOM 0 HD3 LYS A 5 0.661 -8.270 7.083 1.00 0.24 H new ATOM 0 HE2 LYS A 5 0.304 -10.585 8.971 1.00 21.42 H new ATOM 0 HE3 LYS A 5 0.372 -10.920 7.252 1.00 21.42 H new ATOM 0 HZ1 LYS A 5 2.535 -10.850 8.671 1.00 0.41 H new ATOM 0 HZ2 LYS A 5 2.534 -10.217 7.095 1.00 0.41 H new ATOM 0 HZ3 LYS A 5 2.429 -9.173 8.430 1.00 0.41 H new ATOM 90 N LEU A 6 -1.097 -4.202 7.282 1.00 11.32 N ATOM 91 CA LEU A 6 -1.380 -3.507 6.032 1.00 15.35 C ATOM 92 C LEU A 6 -0.690 -4.196 4.861 1.00 11.44 C ATOM 93 O LEU A 6 0.528 -4.104 4.705 1.00 32.11 O ATOM 94 CB LEU A 6 -0.920 -2.050 6.120 1.00 2.12 C ATOM 95 CG LEU A 6 -1.390 -1.294 7.364 1.00 13.23 C ATOM 96 CD1 LEU A 6 -0.878 0.137 7.344 1.00 62.05 C ATOM 97 CD2 LEU A 6 -2.908 -1.318 7.459 1.00 12.41 C ATOM 0 H LEU A 6 -0.280 -3.852 7.783 1.00 11.32 H new ATOM 0 HA LEU A 6 -2.457 -3.533 5.866 1.00 15.35 H new ATOM 0 HB2 LEU A 6 0.169 -2.027 6.090 1.00 2.12 H new ATOM 0 HB3 LEU A 6 -1.274 -1.520 5.236 1.00 2.12 H new ATOM 0 HG LEU A 6 -0.982 -1.791 8.244 1.00 13.23 H new ATOM 0 HD11 LEU A 6 -1.222 0.659 8.237 1.00 62.05 H new ATOM 0 HD12 LEU A 6 0.212 0.133 7.324 1.00 62.05 H new ATOM 0 HD13 LEU A 6 -1.256 0.646 6.457 1.00 62.05 H new ATOM 0 HD21 LEU A 6 -3.225 -0.776 8.350 1.00 12.41 H new ATOM 0 HD22 LEU A 6 -3.335 -0.845 6.575 1.00 12.41 H new ATOM 0 HD23 LEU A 6 -3.252 -2.350 7.521 1.00 12.41 H new ATOM 109 N VAL A 7 -1.473 -4.887 4.039 1.00 13.22 N ATOM 110 CA VAL A 7 -0.934 -5.588 2.884 1.00 34.12 C ATOM 111 C VAL A 7 -0.698 -4.627 1.724 1.00 10.31 C ATOM 112 O VAL A 7 -1.635 -4.234 1.029 1.00 0.11 O ATOM 113 CB VAL A 7 -1.880 -6.714 2.425 1.00 23.43 C ATOM 114 CG1 VAL A 7 -1.258 -7.507 1.289 1.00 62.43 C ATOM 115 CG2 VAL A 7 -2.230 -7.625 3.592 1.00 74.51 C ATOM 0 H VAL A 7 -2.483 -4.975 4.153 1.00 13.22 H new ATOM 0 HA VAL A 7 0.017 -6.025 3.187 1.00 34.12 H new ATOM 0 HB VAL A 7 -2.801 -6.261 2.057 1.00 23.43 H new ATOM 0 HG11 VAL A 7 -1.942 -8.297 0.980 1.00 62.43 H new ATOM 0 HG12 VAL A 7 -1.064 -6.844 0.446 1.00 62.43 H new ATOM 0 HG13 VAL A 7 -0.320 -7.950 1.625 1.00 62.43 H new ATOM 0 HG21 VAL A 7 -2.899 -8.414 3.249 1.00 74.51 H new ATOM 0 HG22 VAL A 7 -1.319 -8.070 3.992 1.00 74.51 H new ATOM 0 HG23 VAL A 7 -2.723 -7.044 4.372 1.00 74.51 H new ATOM 125 N VAL A 8 0.560 -4.250 1.524 1.00 43.41 N ATOM 126 CA VAL A 8 0.923 -3.334 0.454 1.00 21.04 C ATOM 127 C VAL A 8 1.063 -4.065 -0.876 1.00 52.12 C ATOM 128 O VAL A 8 1.846 -5.007 -0.998 1.00 63.42 O ATOM 129 CB VAL A 8 2.243 -2.607 0.768 1.00 10.14 C ATOM 130 CG1 VAL A 8 2.505 -1.517 -0.255 1.00 33.14 C ATOM 131 CG2 VAL A 8 2.215 -2.033 2.177 1.00 23.34 C ATOM 0 H VAL A 8 1.346 -4.567 2.092 1.00 43.41 H new ATOM 0 HA VAL A 8 0.119 -2.602 0.377 1.00 21.04 H new ATOM 0 HB VAL A 8 3.058 -3.329 0.713 1.00 10.14 H new ATOM 0 HG11 VAL A 8 3.442 -1.013 -0.018 1.00 33.14 H new ATOM 0 HG12 VAL A 8 2.572 -1.959 -1.249 1.00 33.14 H new ATOM 0 HG13 VAL A 8 1.689 -0.794 -0.234 1.00 33.14 H new ATOM 0 HG21 VAL A 8 3.156 -1.523 2.381 1.00 23.34 H new ATOM 0 HG22 VAL A 8 1.392 -1.324 2.265 1.00 23.34 H new ATOM 0 HG23 VAL A 8 2.077 -2.840 2.896 1.00 23.34 H new ATOM 141 N VAL A 9 0.302 -3.623 -1.871 1.00 30.33 N ATOM 142 CA VAL A 9 0.343 -4.233 -3.194 1.00 33.33 C ATOM 143 C VAL A 9 0.703 -3.202 -4.259 1.00 61.02 C ATOM 144 O VAL A 9 0.400 -2.017 -4.118 1.00 74.10 O ATOM 145 CB VAL A 9 -1.005 -4.888 -3.554 1.00 73.33 C ATOM 146 CG1 VAL A 9 -1.368 -5.956 -2.534 1.00 24.42 C ATOM 147 CG2 VAL A 9 -2.105 -3.841 -3.652 1.00 33.45 C ATOM 0 H VAL A 9 -0.351 -2.844 -1.786 1.00 30.33 H new ATOM 0 HA VAL A 9 1.112 -5.005 -3.166 1.00 33.33 H new ATOM 0 HB VAL A 9 -0.904 -5.365 -4.529 1.00 73.33 H new ATOM 0 HG11 VAL A 9 -2.323 -6.408 -2.804 1.00 24.42 H new ATOM 0 HG12 VAL A 9 -0.594 -6.724 -2.520 1.00 24.42 H new ATOM 0 HG13 VAL A 9 -1.448 -5.503 -1.546 1.00 24.42 H new ATOM 0 HG21 VAL A 9 -3.047 -4.326 -3.907 1.00 33.45 H new ATOM 0 HG22 VAL A 9 -2.207 -3.330 -2.695 1.00 33.45 H new ATOM 0 HG23 VAL A 9 -1.849 -3.116 -4.425 1.00 33.45 H new ATOM 157 N GLY A 10 1.351 -3.660 -5.325 1.00 44.11 N ATOM 158 CA GLY A 10 1.741 -2.762 -6.396 1.00 2.15 C ATOM 159 C GLY A 10 2.684 -3.416 -7.386 1.00 41.45 C ATOM 160 O GLY A 10 3.082 -4.567 -7.208 1.00 53.12 O ATOM 0 H GLY A 10 1.613 -4.636 -5.466 1.00 44.11 H new ATOM 0 HA2 GLY A 10 0.850 -2.418 -6.921 1.00 2.15 H new ATOM 0 HA3 GLY A 10 2.220 -1.880 -5.970 1.00 2.15 H new ATOM 164 N ALA A 11 3.041 -2.681 -8.434 1.00 4.13 N ATOM 165 CA ALA A 11 3.941 -3.196 -9.458 1.00 22.42 C ATOM 166 C ALA A 11 5.377 -2.747 -9.207 1.00 75.33 C ATOM 167 O ALA A 11 5.629 -1.584 -8.892 1.00 13.22 O ATOM 168 CB ALA A 11 3.481 -2.747 -10.837 1.00 22.33 C ATOM 0 H ALA A 11 2.720 -1.726 -8.596 1.00 4.13 H new ATOM 0 HA ALA A 11 3.916 -4.285 -9.413 1.00 22.42 H new ATOM 0 HB1 ALA A 11 4.162 -3.138 -11.593 1.00 22.33 H new ATOM 0 HB2 ALA A 11 2.475 -3.123 -11.025 1.00 22.33 H new ATOM 0 HB3 ALA A 11 3.476 -1.658 -10.882 1.00 22.33 H new ATOM 174 N GLY A 12 6.316 -3.679 -9.350 1.00 21.13 N ATOM 175 CA GLY A 12 7.720 -3.365 -9.138 1.00 55.31 C ATOM 176 C GLY A 12 8.151 -2.101 -9.859 1.00 1.51 C ATOM 177 O GLY A 12 8.153 -2.049 -11.089 1.00 41.14 O ATOM 0 H GLY A 12 6.130 -4.648 -9.609 1.00 21.13 H new ATOM 0 HA2 GLY A 12 7.906 -3.251 -8.070 1.00 55.31 H new ATOM 0 HA3 GLY A 12 8.331 -4.200 -9.480 1.00 55.31 H new ATOM 181 N GLY A 13 8.512 -1.081 -9.089 1.00 24.21 N ATOM 182 CA GLY A 13 8.936 0.178 -9.674 1.00 45.35 C ATOM 183 C GLY A 13 7.922 1.287 -9.459 1.00 70.12 C ATOM 184 O GLY A 13 8.012 2.347 -10.079 1.00 52.31 O ATOM 0 H GLY A 13 8.519 -1.103 -8.069 1.00 24.21 H new ATOM 0 HA2 GLY A 13 9.891 0.474 -9.240 1.00 45.35 H new ATOM 0 HA3 GLY A 13 9.100 0.042 -10.743 1.00 45.35 H new ATOM 188 N VAL A 14 6.956 1.043 -8.578 1.00 35.42 N ATOM 189 CA VAL A 14 5.922 2.026 -8.281 1.00 14.03 C ATOM 190 C VAL A 14 6.244 2.795 -7.004 1.00 22.24 C ATOM 191 O VAL A 14 5.813 3.935 -6.829 1.00 42.41 O ATOM 192 CB VAL A 14 4.542 1.357 -8.129 1.00 4.23 C ATOM 193 CG1 VAL A 14 4.088 0.762 -9.453 1.00 34.22 C ATOM 194 CG2 VAL A 14 4.578 0.292 -7.040 1.00 31.22 C ATOM 0 H VAL A 14 6.869 0.171 -8.057 1.00 35.42 H new ATOM 0 HA VAL A 14 5.893 2.720 -9.121 1.00 14.03 H new ATOM 0 HB VAL A 14 3.821 2.119 -7.833 1.00 4.23 H new ATOM 0 HG11 VAL A 14 3.112 0.294 -9.326 1.00 34.22 H new ATOM 0 HG12 VAL A 14 4.017 1.551 -10.201 1.00 34.22 H new ATOM 0 HG13 VAL A 14 4.809 0.014 -9.782 1.00 34.22 H new ATOM 0 HG21 VAL A 14 3.594 -0.168 -6.948 1.00 31.22 H new ATOM 0 HG22 VAL A 14 5.312 -0.470 -7.301 1.00 31.22 H new ATOM 0 HG23 VAL A 14 4.853 0.751 -6.091 1.00 31.22 H new ATOM 204 N GLY A 15 7.004 2.165 -6.114 1.00 13.22 N ATOM 205 CA GLY A 15 7.370 2.806 -4.865 1.00 14.23 C ATOM 206 C GLY A 15 6.509 2.350 -3.701 1.00 34.41 C ATOM 207 O GLY A 15 6.495 2.986 -2.647 1.00 61.05 O ATOM 0 H GLY A 15 7.373 1.222 -6.236 1.00 13.22 H new ATOM 0 HA2 GLY A 15 8.416 2.593 -4.644 1.00 14.23 H new ATOM 0 HA3 GLY A 15 7.282 3.887 -4.976 1.00 14.23 H new ATOM 211 N LYS A 16 5.790 1.246 -3.888 1.00 4.32 N ATOM 212 CA LYS A 16 4.926 0.712 -2.841 1.00 2.44 C ATOM 213 C LYS A 16 5.745 0.304 -1.621 1.00 40.43 C ATOM 214 O LYS A 16 5.332 0.523 -0.482 1.00 4.22 O ATOM 215 CB LYS A 16 4.133 -0.487 -3.364 1.00 2.21 C ATOM 216 CG LYS A 16 5.002 -1.578 -3.971 1.00 3.25 C ATOM 217 CD LYS A 16 5.235 -2.718 -2.991 1.00 15.51 C ATOM 218 CE LYS A 16 5.055 -4.073 -3.657 1.00 54.41 C ATOM 219 NZ LYS A 16 4.439 -5.068 -2.736 1.00 72.24 N ATOM 0 H LYS A 16 5.789 0.706 -4.753 1.00 4.32 H new ATOM 0 HA LYS A 16 4.228 1.495 -2.544 1.00 2.44 H new ATOM 0 HB2 LYS A 16 3.551 -0.911 -2.546 1.00 2.21 H new ATOM 0 HB3 LYS A 16 3.422 -0.142 -4.115 1.00 2.21 H new ATOM 0 HG2 LYS A 16 4.526 -1.964 -4.872 1.00 3.25 H new ATOM 0 HG3 LYS A 16 5.960 -1.155 -4.273 1.00 3.25 H new ATOM 0 HD2 LYS A 16 6.242 -2.645 -2.579 1.00 15.51 H new ATOM 0 HD3 LYS A 16 4.541 -2.628 -2.155 1.00 15.51 H new ATOM 0 HE2 LYS A 16 4.429 -3.962 -4.542 1.00 54.41 H new ATOM 0 HE3 LYS A 16 6.023 -4.442 -3.995 1.00 54.41 H new ATOM 0 HZ1 LYS A 16 4.365 -5.987 -3.217 1.00 72.24 H new ATOM 0 HZ2 LYS A 16 5.031 -5.169 -1.887 1.00 72.24 H new ATOM 0 HZ3 LYS A 16 3.490 -4.744 -2.460 1.00 72.24 H new ATOM 233 N SER A 17 6.907 -0.290 -1.869 1.00 52.13 N ATOM 234 CA SER A 17 7.788 -0.729 -0.793 1.00 51.20 C ATOM 235 C SER A 17 8.618 0.434 -0.263 1.00 64.42 C ATOM 236 O SER A 17 8.961 0.479 0.918 1.00 63.13 O ATOM 237 CB SER A 17 8.711 -1.845 -1.286 1.00 51.23 C ATOM 238 OG SER A 17 9.561 -1.383 -2.322 1.00 60.42 O ATOM 0 H SER A 17 7.261 -0.479 -2.807 1.00 52.13 H new ATOM 0 HA SER A 17 7.168 -1.110 0.019 1.00 51.20 H new ATOM 0 HB2 SER A 17 9.312 -2.217 -0.456 1.00 51.23 H new ATOM 0 HB3 SER A 17 8.114 -2.682 -1.647 1.00 51.23 H new ATOM 0 HG SER A 17 10.142 -2.114 -2.619 1.00 60.42 H new ATOM 244 N ALA A 18 8.940 1.374 -1.147 1.00 42.03 N ATOM 245 CA ALA A 18 9.732 2.539 -0.772 1.00 42.42 C ATOM 246 C ALA A 18 9.057 3.332 0.342 1.00 23.25 C ATOM 247 O ALA A 18 9.684 3.667 1.347 1.00 15.50 O ATOM 248 CB ALA A 18 9.970 3.426 -1.985 1.00 20.42 C ATOM 0 H ALA A 18 8.664 1.351 -2.129 1.00 42.03 H new ATOM 0 HA ALA A 18 10.693 2.187 -0.397 1.00 42.42 H new ATOM 0 HB1 ALA A 18 10.563 4.292 -1.691 1.00 20.42 H new ATOM 0 HB2 ALA A 18 10.505 2.862 -2.749 1.00 20.42 H new ATOM 0 HB3 ALA A 18 9.013 3.760 -2.385 1.00 20.42 H new ATOM 254 N LEU A 19 7.775 3.632 0.157 1.00 3.04 N ATOM 255 CA LEU A 19 7.017 4.390 1.146 1.00 22.52 C ATOM 256 C LEU A 19 6.985 3.663 2.488 1.00 75.22 C ATOM 257 O LEU A 19 6.905 4.293 3.543 1.00 52.12 O ATOM 258 CB LEU A 19 5.590 4.632 0.652 1.00 61.32 C ATOM 259 CG LEU A 19 5.463 5.640 -0.492 1.00 33.15 C ATOM 260 CD1 LEU A 19 4.075 5.573 -1.109 1.00 3.40 C ATOM 261 CD2 LEU A 19 5.761 7.047 0.003 1.00 52.34 C ATOM 0 H LEU A 19 7.240 3.362 -0.668 1.00 3.04 H new ATOM 0 HA LEU A 19 7.515 5.350 1.286 1.00 22.52 H new ATOM 0 HB2 LEU A 19 5.168 3.681 0.327 1.00 61.32 H new ATOM 0 HB3 LEU A 19 4.985 4.979 1.490 1.00 61.32 H new ATOM 0 HG LEU A 19 6.193 5.384 -1.260 1.00 33.15 H new ATOM 0 HD11 LEU A 19 4.002 6.297 -1.921 1.00 3.40 H new ATOM 0 HD12 LEU A 19 3.898 4.571 -1.499 1.00 3.40 H new ATOM 0 HD13 LEU A 19 3.328 5.804 -0.350 1.00 3.40 H new ATOM 0 HD21 LEU A 19 5.666 7.751 -0.824 1.00 52.34 H new ATOM 0 HD22 LEU A 19 5.055 7.313 0.789 1.00 52.34 H new ATOM 0 HD23 LEU A 19 6.776 7.086 0.398 1.00 52.34 H new ATOM 273 N THR A 20 7.048 2.336 2.442 1.00 2.14 N ATOM 274 CA THR A 20 7.024 1.529 3.656 1.00 64.21 C ATOM 275 C THR A 20 8.235 1.827 4.535 1.00 34.41 C ATOM 276 O THR A 20 8.091 2.230 5.688 1.00 11.43 O ATOM 277 CB THR A 20 6.987 0.040 3.307 1.00 22.51 C ATOM 278 OG1 THR A 20 5.860 -0.259 2.503 1.00 10.52 O ATOM 279 CG2 THR A 20 6.934 -0.859 4.524 1.00 54.13 C ATOM 0 H THR A 20 7.116 1.798 1.578 1.00 2.14 H new ATOM 0 HA THR A 20 6.122 1.787 4.212 1.00 64.21 H new ATOM 0 HB THR A 20 7.917 -0.154 2.772 1.00 22.51 H new ATOM 0 HG1 THR A 20 5.963 0.164 1.625 1.00 10.52 H new ATOM 0 HG21 THR A 20 6.910 -1.901 4.206 1.00 54.13 H new ATOM 0 HG22 THR A 20 7.816 -0.689 5.141 1.00 54.13 H new ATOM 0 HG23 THR A 20 6.038 -0.635 5.103 1.00 54.13 H new ATOM 287 N ILE A 21 9.427 1.626 3.982 1.00 24.41 N ATOM 288 CA ILE A 21 10.658 1.869 4.708 1.00 11.13 C ATOM 289 C ILE A 21 10.742 3.322 5.177 1.00 42.52 C ATOM 290 O ILE A 21 11.369 3.620 6.193 1.00 75.31 O ATOM 291 CB ILE A 21 11.877 1.525 3.825 1.00 52.23 C ATOM 292 CG1 ILE A 21 12.085 0.011 3.775 1.00 45.25 C ATOM 293 CG2 ILE A 21 13.128 2.214 4.333 1.00 75.42 C ATOM 294 CD1 ILE A 21 10.920 -0.741 3.169 1.00 41.12 C ATOM 0 H ILE A 21 9.561 1.293 3.027 1.00 24.41 H new ATOM 0 HA ILE A 21 10.663 1.226 5.588 1.00 11.13 H new ATOM 0 HB ILE A 21 11.679 1.886 2.816 1.00 52.23 H new ATOM 0 HG12 ILE A 21 12.985 -0.205 3.199 1.00 45.25 H new ATOM 0 HG13 ILE A 21 12.258 -0.357 4.786 1.00 45.25 H new ATOM 0 HG21 ILE A 21 13.972 1.955 3.693 1.00 75.42 H new ATOM 0 HG22 ILE A 21 12.980 3.294 4.319 1.00 75.42 H new ATOM 0 HG23 ILE A 21 13.333 1.890 5.353 1.00 75.42 H new ATOM 0 HD11 ILE A 21 11.138 -1.809 3.166 1.00 41.12 H new ATOM 0 HD12 ILE A 21 10.022 -0.556 3.758 1.00 41.12 H new ATOM 0 HD13 ILE A 21 10.760 -0.401 2.146 1.00 41.12 H new ATOM 306 N GLN A 22 10.104 4.220 4.433 1.00 53.31 N ATOM 307 CA GLN A 22 10.108 5.637 4.779 1.00 23.34 C ATOM 308 C GLN A 22 9.517 5.857 6.168 1.00 21.42 C ATOM 309 O GLN A 22 10.094 6.560 6.997 1.00 61.21 O ATOM 310 CB GLN A 22 9.320 6.440 3.742 1.00 3.32 C ATOM 311 CG GLN A 22 10.180 6.989 2.616 1.00 21.53 C ATOM 312 CD GLN A 22 11.251 7.941 3.112 1.00 5.43 C ATOM 313 OE1 GLN A 22 11.177 8.449 4.232 1.00 10.13 O ATOM 314 NE2 GLN A 22 12.255 8.188 2.279 1.00 21.23 N ATOM 0 H GLN A 22 9.579 3.992 3.589 1.00 53.31 H new ATOM 0 HA GLN A 22 11.142 5.982 4.784 1.00 23.34 H new ATOM 0 HB2 GLN A 22 8.542 5.805 3.318 1.00 3.32 H new ATOM 0 HB3 GLN A 22 8.818 7.269 4.241 1.00 3.32 H new ATOM 0 HG2 GLN A 22 10.652 6.161 2.087 1.00 21.53 H new ATOM 0 HG3 GLN A 22 9.544 7.506 1.897 1.00 21.53 H new ATOM 0 HE21 GLN A 22 12.276 7.745 1.360 1.00 21.23 H new ATOM 0 HE22 GLN A 22 13.005 8.820 2.558 1.00 21.23 H new ATOM 323 N LEU A 23 8.363 5.247 6.414 1.00 72.50 N ATOM 324 CA LEU A 23 7.689 5.369 7.703 1.00 61.33 C ATOM 325 C LEU A 23 8.374 4.513 8.769 1.00 60.23 C ATOM 326 O LEU A 23 8.070 4.627 9.957 1.00 3.22 O ATOM 327 CB LEU A 23 6.221 4.959 7.567 1.00 63.04 C ATOM 328 CG LEU A 23 5.376 5.130 8.831 1.00 31.12 C ATOM 329 CD1 LEU A 23 5.243 6.602 9.190 1.00 11.15 C ATOM 330 CD2 LEU A 23 4.004 4.501 8.639 1.00 45.31 C ATOM 0 H LEU A 23 7.873 4.662 5.737 1.00 72.50 H new ATOM 0 HA LEU A 23 7.746 6.411 8.017 1.00 61.33 H new ATOM 0 HB2 LEU A 23 5.770 5.544 6.766 1.00 63.04 H new ATOM 0 HB3 LEU A 23 6.179 3.914 7.260 1.00 63.04 H new ATOM 0 HG LEU A 23 5.878 4.621 9.654 1.00 31.12 H new ATOM 0 HD11 LEU A 23 4.639 6.703 10.091 1.00 11.15 H new ATOM 0 HD12 LEU A 23 6.232 7.024 9.367 1.00 11.15 H new ATOM 0 HD13 LEU A 23 4.763 7.135 8.369 1.00 11.15 H new ATOM 0 HD21 LEU A 23 3.414 4.630 9.546 1.00 45.31 H new ATOM 0 HD22 LEU A 23 3.496 4.984 7.804 1.00 45.31 H new ATOM 0 HD23 LEU A 23 4.118 3.438 8.429 1.00 45.31 H new ATOM 342 N ILE A 24 9.296 3.654 8.341 1.00 23.41 N ATOM 343 CA ILE A 24 10.015 2.780 9.262 1.00 51.15 C ATOM 344 C ILE A 24 11.397 3.339 9.594 1.00 24.35 C ATOM 345 O ILE A 24 11.648 3.769 10.720 1.00 31.20 O ATOM 346 CB ILE A 24 10.168 1.361 8.675 1.00 43.44 C ATOM 347 CG1 ILE A 24 8.794 0.782 8.331 1.00 20.34 C ATOM 348 CG2 ILE A 24 10.908 0.450 9.647 1.00 73.14 C ATOM 349 CD1 ILE A 24 7.976 0.389 9.543 1.00 42.15 C ATOM 0 H ILE A 24 9.562 3.545 7.362 1.00 23.41 H new ATOM 0 HA ILE A 24 9.426 2.728 10.177 1.00 51.15 H new ATOM 0 HB ILE A 24 10.758 1.426 7.761 1.00 43.44 H new ATOM 0 HG12 ILE A 24 8.236 1.516 7.750 1.00 20.34 H new ATOM 0 HG13 ILE A 24 8.928 -0.093 7.695 1.00 20.34 H new ATOM 0 HG21 ILE A 24 11.004 -0.545 9.212 1.00 73.14 H new ATOM 0 HG22 ILE A 24 11.900 0.857 9.844 1.00 73.14 H new ATOM 0 HG23 ILE A 24 10.350 0.385 10.581 1.00 73.14 H new ATOM 0 HD11 ILE A 24 7.016 -0.013 9.219 1.00 42.15 H new ATOM 0 HD12 ILE A 24 8.513 -0.369 10.114 1.00 42.15 H new ATOM 0 HD13 ILE A 24 7.810 1.265 10.170 1.00 42.15 H new ATOM 361 N GLN A 25 12.291 3.323 8.611 1.00 25.53 N ATOM 362 CA GLN A 25 13.649 3.821 8.805 1.00 40.23 C ATOM 363 C GLN A 25 13.786 5.258 8.309 1.00 63.01 C ATOM 364 O GLN A 25 14.631 6.012 8.792 1.00 42.20 O ATOM 365 CB GLN A 25 14.656 2.926 8.077 1.00 35.44 C ATOM 366 CG GLN A 25 14.309 1.446 8.128 1.00 31.20 C ATOM 367 CD GLN A 25 15.387 0.574 7.515 1.00 42.34 C ATOM 368 OE1 GLN A 25 16.531 0.569 7.970 1.00 24.52 O ATOM 369 NE2 GLN A 25 15.027 -0.171 6.476 1.00 53.02 N ATOM 0 H GLN A 25 12.101 2.971 7.673 1.00 25.53 H new ATOM 0 HA GLN A 25 13.859 3.803 9.874 1.00 40.23 H new ATOM 0 HB2 GLN A 25 14.720 3.239 7.035 1.00 35.44 H new ATOM 0 HB3 GLN A 25 15.643 3.074 8.515 1.00 35.44 H new ATOM 0 HG2 GLN A 25 14.152 1.149 9.165 1.00 31.20 H new ATOM 0 HG3 GLN A 25 13.369 1.279 7.603 1.00 31.20 H new ATOM 0 HE21 GLN A 25 14.068 -0.136 6.131 1.00 53.02 H new ATOM 0 HE22 GLN A 25 15.710 -0.778 6.023 1.00 53.02 H new ATOM 588 N TYR A 40 7.516 -4.567 7.928 1.00 64.24 N ATOM 589 CA TYR A 40 7.968 -3.675 8.989 1.00 60.44 C ATOM 590 C TYR A 40 6.791 -3.180 9.823 1.00 34.53 C ATOM 591 O TYR A 40 5.802 -2.685 9.284 1.00 12.10 O ATOM 592 CB TYR A 40 8.720 -2.484 8.395 1.00 15.31 C ATOM 593 CG TYR A 40 9.720 -2.869 7.328 1.00 50.53 C ATOM 594 CD1 TYR A 40 11.035 -3.172 7.658 1.00 31.54 C ATOM 595 CD2 TYR A 40 9.347 -2.931 5.992 1.00 24.43 C ATOM 596 CE1 TYR A 40 11.951 -3.525 6.685 1.00 51.31 C ATOM 597 CE2 TYR A 40 10.257 -3.284 5.013 1.00 73.01 C ATOM 598 CZ TYR A 40 11.557 -3.580 5.364 1.00 50.04 C ATOM 599 OH TYR A 40 12.465 -3.932 4.393 1.00 74.23 O ATOM 0 HA TYR A 40 8.640 -4.236 9.638 1.00 60.44 H new ATOM 0 HB2 TYR A 40 7.999 -1.785 7.970 1.00 15.31 H new ATOM 0 HB3 TYR A 40 9.240 -1.958 9.195 1.00 15.31 H new ATOM 0 HD1 TYR A 40 11.347 -3.131 8.691 1.00 31.54 H new ATOM 0 HD2 TYR A 40 8.330 -2.700 5.713 1.00 24.43 H new ATOM 0 HE1 TYR A 40 12.970 -3.757 6.957 1.00 51.31 H new ATOM 0 HE2 TYR A 40 9.951 -3.328 3.978 1.00 73.01 H new ATOM 0 HH TYR A 40 12.027 -3.924 3.517 1.00 74.23 H new ATOM 609 N ARG A 41 6.905 -3.317 11.140 1.00 24.43 N ATOM 610 CA ARG A 41 5.848 -2.883 12.046 1.00 34.12 C ATOM 611 C ARG A 41 6.297 -1.682 12.875 1.00 22.24 C ATOM 612 O ARG A 41 7.431 -1.633 13.349 1.00 21.22 O ATOM 613 CB ARG A 41 5.434 -4.031 12.968 1.00 5.51 C ATOM 614 CG ARG A 41 6.475 -4.378 14.019 1.00 14.05 C ATOM 615 CD ARG A 41 6.088 -5.628 14.790 1.00 43.34 C ATOM 616 NE ARG A 41 6.676 -5.649 16.128 1.00 45.31 N ATOM 617 CZ ARG A 41 6.595 -6.687 16.958 1.00 14.34 C ATOM 618 NH1 ARG A 41 5.950 -7.788 16.594 1.00 41.21 N ATOM 619 NH2 ARG A 41 7.159 -6.622 18.156 1.00 14.14 N ATOM 0 H ARG A 41 7.717 -3.724 11.603 1.00 24.43 H new ATOM 0 HA ARG A 41 4.990 -2.583 11.445 1.00 34.12 H new ATOM 0 HB2 ARG A 41 4.502 -3.766 13.467 1.00 5.51 H new ATOM 0 HB3 ARG A 41 5.232 -4.915 12.364 1.00 5.51 H new ATOM 0 HG2 ARG A 41 7.442 -4.529 13.539 1.00 14.05 H new ATOM 0 HG3 ARG A 41 6.589 -3.543 14.710 1.00 14.05 H new ATOM 0 HD2 ARG A 41 5.002 -5.683 14.870 1.00 43.34 H new ATOM 0 HD3 ARG A 41 6.412 -6.510 14.237 1.00 43.34 H new ATOM 0 HE ARG A 41 7.178 -4.819 16.445 1.00 45.31 H new ATOM 0 HH11 ARG A 41 5.513 -7.842 15.674 1.00 41.21 H new ATOM 0 HH12 ARG A 41 5.891 -8.580 17.234 1.00 41.21 H new ATOM 0 HH21 ARG A 41 7.654 -5.777 18.441 1.00 14.14 H new ATOM 0 HH22 ARG A 41 7.097 -7.417 18.792 1.00 14.14 H new ATOM 633 N LYS A 42 5.397 -0.720 13.048 1.00 62.20 N ATOM 634 CA LYS A 42 5.699 0.476 13.825 1.00 64.02 C ATOM 635 C LYS A 42 4.573 0.785 14.802 1.00 73.53 C ATOM 636 O LYS A 42 3.403 0.539 14.517 1.00 42.42 O ATOM 637 CB LYS A 42 5.926 1.672 12.901 1.00 32.11 C ATOM 638 CG LYS A 42 6.490 2.891 13.611 1.00 23.52 C ATOM 639 CD LYS A 42 6.846 3.993 12.626 1.00 4.43 C ATOM 640 CE LYS A 42 7.981 4.861 13.147 1.00 3.11 C ATOM 641 NZ LYS A 42 8.252 6.018 12.250 1.00 11.41 N ATOM 0 H LYS A 42 4.454 -0.745 12.661 1.00 62.20 H new ATOM 0 HA LYS A 42 6.611 0.287 14.391 1.00 64.02 H new ATOM 0 HB2 LYS A 42 6.608 1.379 12.103 1.00 32.11 H new ATOM 0 HB3 LYS A 42 4.981 1.941 12.430 1.00 32.11 H new ATOM 0 HG2 LYS A 42 5.761 3.265 14.329 1.00 23.52 H new ATOM 0 HG3 LYS A 42 7.377 2.606 14.177 1.00 23.52 H new ATOM 0 HD2 LYS A 42 7.133 3.551 11.672 1.00 4.43 H new ATOM 0 HD3 LYS A 42 5.969 4.613 12.439 1.00 4.43 H new ATOM 0 HE2 LYS A 42 7.732 5.225 14.144 1.00 3.11 H new ATOM 0 HE3 LYS A 42 8.884 4.258 13.245 1.00 3.11 H new ATOM 0 HZ1 LYS A 42 9.196 6.403 12.455 1.00 11.41 H new ATOM 0 HZ2 LYS A 42 8.214 5.705 11.259 1.00 11.41 H new ATOM 0 HZ3 LYS A 42 7.536 6.755 12.408 1.00 11.41 H new ATOM 655 N GLN A 43 4.937 1.326 15.956 1.00 21.11 N ATOM 656 CA GLN A 43 3.958 1.671 16.981 1.00 4.42 C ATOM 657 C GLN A 43 3.576 3.145 16.890 1.00 61.44 C ATOM 658 O GLN A 43 4.428 4.024 17.015 1.00 63.14 O ATOM 659 CB GLN A 43 4.515 1.360 18.372 1.00 22.42 C ATOM 660 CG GLN A 43 3.458 1.359 19.464 1.00 12.32 C ATOM 661 CD GLN A 43 4.013 1.775 20.812 1.00 2.12 C ATOM 662 OE1 GLN A 43 4.962 1.176 21.318 1.00 45.04 O ATOM 663 NE2 GLN A 43 3.422 2.807 21.403 1.00 21.11 N ATOM 0 H GLN A 43 5.903 1.536 16.207 1.00 21.11 H new ATOM 0 HA GLN A 43 3.064 1.071 16.814 1.00 4.42 H new ATOM 0 HB2 GLN A 43 5.003 0.386 18.349 1.00 22.42 H new ATOM 0 HB3 GLN A 43 5.281 2.095 18.620 1.00 22.42 H new ATOM 0 HG2 GLN A 43 2.650 2.035 19.183 1.00 12.32 H new ATOM 0 HG3 GLN A 43 3.026 0.362 19.545 1.00 12.32 H new ATOM 0 HE21 GLN A 43 2.638 3.275 20.948 1.00 21.11 H new ATOM 0 HE22 GLN A 43 3.752 3.132 22.312 1.00 21.11 H new ATOM 672 N VAL A 44 2.293 3.408 16.671 1.00 44.54 N ATOM 673 CA VAL A 44 1.804 4.778 16.561 1.00 40.32 C ATOM 674 C VAL A 44 0.508 4.968 17.343 1.00 2.12 C ATOM 675 O VAL A 44 -0.034 4.019 17.908 1.00 51.41 O ATOM 676 CB VAL A 44 1.566 5.172 15.091 1.00 31.50 C ATOM 677 CG1 VAL A 44 2.868 5.121 14.306 1.00 64.22 C ATOM 678 CG2 VAL A 44 0.518 4.269 14.457 1.00 42.43 C ATOM 0 H VAL A 44 1.573 2.693 16.566 1.00 44.54 H new ATOM 0 HA VAL A 44 2.575 5.422 16.983 1.00 40.32 H new ATOM 0 HB VAL A 44 1.193 6.196 15.066 1.00 31.50 H new ATOM 0 HG11 VAL A 44 2.679 5.402 13.270 1.00 64.22 H new ATOM 0 HG12 VAL A 44 3.585 5.814 14.746 1.00 64.22 H new ATOM 0 HG13 VAL A 44 3.273 4.110 14.339 1.00 64.22 H new ATOM 0 HG21 VAL A 44 0.364 4.563 13.419 1.00 42.43 H new ATOM 0 HG22 VAL A 44 0.859 3.234 14.494 1.00 42.43 H new ATOM 0 HG23 VAL A 44 -0.421 4.362 15.003 1.00 42.43 H new ATOM 688 N VAL A 45 0.017 6.203 17.367 1.00 60.44 N ATOM 689 CA VAL A 45 -1.217 6.523 18.074 1.00 65.31 C ATOM 690 C VAL A 45 -2.241 7.141 17.128 1.00 41.23 C ATOM 691 O VAL A 45 -2.165 8.326 16.803 1.00 70.33 O ATOM 692 CB VAL A 45 -0.959 7.493 19.242 1.00 61.50 C ATOM 693 CG1 VAL A 45 -2.226 7.696 20.060 1.00 54.24 C ATOM 694 CG2 VAL A 45 0.174 6.982 20.120 1.00 0.34 C ATOM 0 H VAL A 45 0.456 6.999 16.904 1.00 60.44 H new ATOM 0 HA VAL A 45 -1.610 5.587 18.472 1.00 65.31 H new ATOM 0 HB VAL A 45 -0.663 8.457 18.829 1.00 61.50 H new ATOM 0 HG11 VAL A 45 -2.023 8.384 20.880 1.00 54.24 H new ATOM 0 HG12 VAL A 45 -3.008 8.111 19.423 1.00 54.24 H new ATOM 0 HG13 VAL A 45 -2.556 6.739 20.463 1.00 54.24 H new ATOM 0 HG21 VAL A 45 0.342 7.680 20.940 1.00 0.34 H new ATOM 0 HG22 VAL A 45 -0.091 6.005 20.524 1.00 0.34 H new ATOM 0 HG23 VAL A 45 1.084 6.894 19.526 1.00 0.34 H new ATOM 704 N ILE A 46 -3.197 6.330 16.689 1.00 61.20 N ATOM 705 CA ILE A 46 -4.236 6.795 15.778 1.00 31.03 C ATOM 706 C ILE A 46 -5.614 6.711 16.426 1.00 12.44 C ATOM 707 O ILE A 46 -5.970 5.695 17.023 1.00 41.55 O ATOM 708 CB ILE A 46 -4.242 5.977 14.472 1.00 21.33 C ATOM 709 CG1 ILE A 46 -2.830 5.901 13.888 1.00 71.14 C ATOM 710 CG2 ILE A 46 -5.205 6.588 13.465 1.00 62.42 C ATOM 711 CD1 ILE A 46 -2.686 4.874 12.787 1.00 63.31 C ATOM 0 H ILE A 46 -3.274 5.347 16.949 1.00 61.20 H new ATOM 0 HA ILE A 46 -4.012 7.836 15.545 1.00 31.03 H new ATOM 0 HB ILE A 46 -4.579 4.965 14.697 1.00 21.33 H new ATOM 0 HG12 ILE A 46 -2.554 6.881 13.498 1.00 71.14 H new ATOM 0 HG13 ILE A 46 -2.127 5.666 14.687 1.00 71.14 H new ATOM 0 HG21 ILE A 46 -5.196 5.998 12.549 1.00 62.42 H new ATOM 0 HG22 ILE A 46 -6.212 6.595 13.883 1.00 62.42 H new ATOM 0 HG23 ILE A 46 -4.898 7.610 13.241 1.00 62.42 H new ATOM 0 HD11 ILE A 46 -1.660 4.875 12.420 1.00 63.31 H new ATOM 0 HD12 ILE A 46 -2.931 3.886 13.177 1.00 63.31 H new ATOM 0 HD13 ILE A 46 -3.364 5.120 11.969 1.00 63.31 H new ATOM 723 N ASP A 47 -6.385 7.787 16.304 1.00 42.40 N ATOM 724 CA ASP A 47 -7.726 7.838 16.877 1.00 21.22 C ATOM 725 C ASP A 47 -7.673 7.718 18.397 1.00 1.14 C ATOM 726 O ASP A 47 -8.549 7.111 19.012 1.00 70.15 O ATOM 727 CB ASP A 47 -8.598 6.724 16.292 1.00 54.15 C ATOM 728 CG ASP A 47 -9.918 7.245 15.758 1.00 11.33 C ATOM 729 OD1 ASP A 47 -9.895 8.101 14.850 1.00 23.13 O ATOM 730 OD2 ASP A 47 -10.976 6.795 16.249 1.00 31.33 O ATOM 0 H ASP A 47 -6.104 8.636 15.813 1.00 42.40 H new ATOM 0 HA ASP A 47 -8.166 8.802 16.623 1.00 21.22 H new ATOM 0 HB2 ASP A 47 -8.055 6.225 15.489 1.00 54.15 H new ATOM 0 HB3 ASP A 47 -8.790 5.975 17.060 1.00 54.15 H new ATOM 735 N GLY A 48 -6.639 8.300 18.996 1.00 23.20 N ATOM 736 CA GLY A 48 -6.490 8.246 20.439 1.00 74.43 C ATOM 737 C GLY A 48 -6.425 6.825 20.964 1.00 14.20 C ATOM 738 O GLY A 48 -6.932 6.533 22.047 1.00 44.22 O ATOM 0 H GLY A 48 -5.901 8.808 18.508 1.00 23.20 H new ATOM 0 HA2 GLY A 48 -5.583 8.778 20.727 1.00 74.43 H new ATOM 0 HA3 GLY A 48 -7.327 8.765 20.907 1.00 74.43 H new ATOM 742 N GLU A 49 -5.801 5.941 20.194 1.00 73.32 N ATOM 743 CA GLU A 49 -5.672 4.542 20.587 1.00 14.43 C ATOM 744 C GLU A 49 -4.364 3.951 20.071 1.00 3.44 C ATOM 745 O GLU A 49 -4.195 3.748 18.868 1.00 43.31 O ATOM 746 CB GLU A 49 -6.857 3.732 20.057 1.00 34.43 C ATOM 747 CG GLU A 49 -6.793 2.254 20.412 1.00 64.10 C ATOM 748 CD GLU A 49 -8.056 1.761 21.090 1.00 11.41 C ATOM 749 OE1 GLU A 49 -9.153 1.976 20.532 1.00 4.04 O ATOM 750 OE2 GLU A 49 -7.949 1.158 22.179 1.00 4.51 O ATOM 0 H GLU A 49 -5.377 6.168 19.295 1.00 73.32 H new ATOM 0 HA GLU A 49 -5.666 4.494 21.676 1.00 14.43 H new ATOM 0 HB2 GLU A 49 -7.781 4.153 20.455 1.00 34.43 H new ATOM 0 HB3 GLU A 49 -6.901 3.835 18.973 1.00 34.43 H new ATOM 0 HG2 GLU A 49 -6.622 1.674 19.505 1.00 64.10 H new ATOM 0 HG3 GLU A 49 -5.941 2.079 21.068 1.00 64.10 H new ATOM 757 N THR A 50 -3.443 3.672 20.988 1.00 73.21 N ATOM 758 CA THR A 50 -2.151 3.101 20.625 1.00 55.43 C ATOM 759 C THR A 50 -2.332 1.768 19.906 1.00 65.20 C ATOM 760 O THR A 50 -2.901 0.826 20.458 1.00 30.01 O ATOM 761 CB THR A 50 -1.287 2.909 21.873 1.00 44.22 C ATOM 762 OG1 THR A 50 -1.083 4.144 22.537 1.00 11.51 O ATOM 763 CG2 THR A 50 0.075 2.318 21.574 1.00 52.42 C ATOM 0 H THR A 50 -3.567 3.832 21.988 1.00 73.21 H new ATOM 0 HA THR A 50 -1.650 3.794 19.949 1.00 55.43 H new ATOM 0 HB THR A 50 -1.839 2.209 22.501 1.00 44.22 H new ATOM 0 HG1 THR A 50 -0.530 4.000 23.333 1.00 11.51 H new ATOM 0 HG21 THR A 50 0.636 2.208 22.502 1.00 52.42 H new ATOM 0 HG22 THR A 50 -0.047 1.341 21.106 1.00 52.42 H new ATOM 0 HG23 THR A 50 0.618 2.979 20.898 1.00 52.42 H new ATOM 771 N CYS A 51 -1.848 1.697 18.671 1.00 71.33 N ATOM 772 CA CYS A 51 -1.959 0.479 17.878 1.00 43.14 C ATOM 773 C CYS A 51 -0.703 0.253 17.042 1.00 53.33 C ATOM 774 O CYS A 51 -0.044 1.204 16.623 1.00 31.20 O ATOM 775 CB CYS A 51 -3.186 0.551 16.966 1.00 62.42 C ATOM 776 SG CYS A 51 -4.763 0.422 17.841 1.00 73.44 S ATOM 0 H CYS A 51 -1.376 2.468 18.198 1.00 71.33 H new ATOM 0 HA CYS A 51 -2.071 -0.361 18.564 1.00 43.14 H new ATOM 0 HB2 CYS A 51 -3.163 1.492 16.417 1.00 62.42 H new ATOM 0 HB3 CYS A 51 -3.125 -0.249 16.229 1.00 62.42 H new ATOM 0 HG CYS A 51 -4.560 0.533 19.120 1.00 73.44 H new ATOM 782 N LEU A 52 -0.380 -1.014 16.805 1.00 5.33 N ATOM 783 CA LEU A 52 0.795 -1.371 16.019 1.00 72.13 C ATOM 784 C LEU A 52 0.466 -1.380 14.528 1.00 35.30 C ATOM 785 O LEU A 52 -0.590 -1.862 14.119 1.00 10.43 O ATOM 786 CB LEU A 52 1.318 -2.744 16.451 1.00 32.31 C ATOM 787 CG LEU A 52 2.804 -2.793 16.810 1.00 51.15 C ATOM 788 CD1 LEU A 52 3.659 -2.515 15.584 1.00 63.32 C ATOM 789 CD2 LEU A 52 3.119 -1.802 17.922 1.00 4.00 C ATOM 0 H LEU A 52 -0.916 -1.812 17.147 1.00 5.33 H new ATOM 0 HA LEU A 52 1.568 -0.623 16.196 1.00 72.13 H new ATOM 0 HB2 LEU A 52 0.741 -3.080 17.313 1.00 32.31 H new ATOM 0 HB3 LEU A 52 1.132 -3.455 15.646 1.00 32.31 H new ATOM 0 HG LEU A 52 3.038 -3.795 17.170 1.00 51.15 H new ATOM 0 HD11 LEU A 52 4.713 -2.554 15.859 1.00 63.32 H new ATOM 0 HD12 LEU A 52 3.455 -3.266 14.820 1.00 63.32 H new ATOM 0 HD13 LEU A 52 3.423 -1.526 15.192 1.00 63.32 H new ATOM 0 HD21 LEU A 52 4.181 -1.852 18.164 1.00 4.00 H new ATOM 0 HD22 LEU A 52 2.868 -0.794 17.592 1.00 4.00 H new ATOM 0 HD23 LEU A 52 2.534 -2.050 18.807 1.00 4.00 H new ATOM 801 N LEU A 53 1.375 -0.843 13.723 1.00 74.11 N ATOM 802 CA LEU A 53 1.181 -0.787 12.279 1.00 4.24 C ATOM 803 C LEU A 53 2.097 -1.776 11.566 1.00 52.31 C ATOM 804 O LEU A 53 3.114 -1.391 10.989 1.00 54.24 O ATOM 805 CB LEU A 53 1.442 0.630 11.762 1.00 14.51 C ATOM 806 CG LEU A 53 0.299 1.621 11.985 1.00 5.22 C ATOM 807 CD1 LEU A 53 0.635 2.970 11.367 1.00 44.22 C ATOM 808 CD2 LEU A 53 -0.998 1.075 11.407 1.00 22.45 C ATOM 0 H LEU A 53 2.254 -0.440 14.046 1.00 74.11 H new ATOM 0 HA LEU A 53 0.147 -1.060 12.067 1.00 4.24 H new ATOM 0 HB2 LEU A 53 2.338 1.018 12.246 1.00 14.51 H new ATOM 0 HB3 LEU A 53 1.654 0.577 10.694 1.00 14.51 H new ATOM 0 HG LEU A 53 0.166 1.759 13.058 1.00 5.22 H new ATOM 0 HD11 LEU A 53 -0.190 3.663 11.535 1.00 44.22 H new ATOM 0 HD12 LEU A 53 1.541 3.365 11.827 1.00 44.22 H new ATOM 0 HD13 LEU A 53 0.795 2.850 10.296 1.00 44.22 H new ATOM 0 HD21 LEU A 53 -1.801 1.792 11.574 1.00 22.45 H new ATOM 0 HD22 LEU A 53 -0.877 0.908 10.337 1.00 22.45 H new ATOM 0 HD23 LEU A 53 -1.246 0.133 11.896 1.00 22.45 H new ATOM 820 N ASP A 54 1.729 -3.051 11.608 1.00 13.14 N ATOM 821 CA ASP A 54 2.517 -4.094 10.963 1.00 53.52 C ATOM 822 C ASP A 54 2.409 -3.995 9.445 1.00 12.01 C ATOM 823 O ASP A 54 1.519 -4.587 8.836 1.00 12.00 O ATOM 824 CB ASP A 54 2.054 -5.475 11.429 1.00 13.12 C ATOM 825 CG ASP A 54 2.686 -5.884 12.745 1.00 1.24 C ATOM 826 OD1 ASP A 54 2.150 -5.500 13.806 1.00 62.41 O ATOM 827 OD2 ASP A 54 3.717 -6.588 12.715 1.00 74.43 O ATOM 0 H ASP A 54 0.891 -3.387 12.082 1.00 13.14 H new ATOM 0 HA ASP A 54 3.560 -3.954 11.246 1.00 53.52 H new ATOM 0 HB2 ASP A 54 0.969 -5.475 11.535 1.00 13.12 H new ATOM 0 HB3 ASP A 54 2.300 -6.214 10.666 1.00 13.12 H new ATOM 832 N ILE A 55 3.322 -3.242 8.839 1.00 62.35 N ATOM 833 CA ILE A 55 3.327 -3.067 7.392 1.00 70.01 C ATOM 834 C ILE A 55 3.902 -4.295 6.694 1.00 31.43 C ATOM 835 O ILE A 55 5.090 -4.593 6.819 1.00 22.23 O ATOM 836 CB ILE A 55 4.141 -1.826 6.978 1.00 12.33 C ATOM 837 CG1 ILE A 55 3.738 -0.615 7.822 1.00 60.04 C ATOM 838 CG2 ILE A 55 3.945 -1.535 5.498 1.00 42.34 C ATOM 839 CD1 ILE A 55 2.262 -0.289 7.747 1.00 20.34 C ATOM 0 H ILE A 55 4.066 -2.744 9.327 1.00 62.35 H new ATOM 0 HA ILE A 55 2.290 -2.929 7.086 1.00 70.01 H new ATOM 0 HB ILE A 55 5.197 -2.030 7.153 1.00 12.33 H new ATOM 0 HG12 ILE A 55 4.008 -0.801 8.861 1.00 60.04 H new ATOM 0 HG13 ILE A 55 4.310 0.253 7.494 1.00 60.04 H new ATOM 0 HG21 ILE A 55 4.526 -0.656 5.220 1.00 42.34 H new ATOM 0 HG22 ILE A 55 4.279 -2.391 4.912 1.00 42.34 H new ATOM 0 HG23 ILE A 55 2.889 -1.350 5.300 1.00 42.34 H new ATOM 0 HD11 ILE A 55 2.049 0.580 8.370 1.00 20.34 H new ATOM 0 HD12 ILE A 55 1.990 -0.071 6.714 1.00 20.34 H new ATOM 0 HD13 ILE A 55 1.683 -1.141 8.103 1.00 20.34 H new ATOM 851 N LEU A 56 3.051 -5.004 5.960 1.00 40.22 N ATOM 852 CA LEU A 56 3.471 -6.200 5.242 1.00 11.14 C ATOM 853 C LEU A 56 3.559 -5.919 3.745 1.00 60.41 C ATOM 854 O LEU A 56 2.553 -5.640 3.093 1.00 31.32 O ATOM 855 CB LEU A 56 2.488 -7.345 5.528 1.00 70.31 C ATOM 856 CG LEU A 56 2.614 -8.591 4.641 1.00 34.31 C ATOM 857 CD1 LEU A 56 1.957 -8.356 3.289 1.00 62.21 C ATOM 858 CD2 LEU A 56 4.072 -9.007 4.473 1.00 54.44 C ATOM 0 H LEU A 56 2.065 -4.770 5.847 1.00 40.22 H new ATOM 0 HA LEU A 56 4.462 -6.496 5.586 1.00 11.14 H new ATOM 0 HB2 LEU A 56 2.613 -7.651 6.567 1.00 70.31 H new ATOM 0 HB3 LEU A 56 1.474 -6.957 5.430 1.00 70.31 H new ATOM 0 HG LEU A 56 2.093 -9.409 5.137 1.00 34.31 H new ATOM 0 HD11 LEU A 56 2.057 -9.251 2.675 1.00 62.21 H new ATOM 0 HD12 LEU A 56 0.900 -8.131 3.432 1.00 62.21 H new ATOM 0 HD13 LEU A 56 2.442 -7.517 2.790 1.00 62.21 H new ATOM 0 HD21 LEU A 56 4.127 -9.892 3.840 1.00 54.44 H new ATOM 0 HD22 LEU A 56 4.631 -8.194 4.010 1.00 54.44 H new ATOM 0 HD23 LEU A 56 4.501 -9.232 5.449 1.00 54.44 H new ATOM 870 N ASP A 57 4.773 -5.984 3.206 1.00 70.04 N ATOM 871 CA ASP A 57 4.993 -5.731 1.787 1.00 30.03 C ATOM 872 C ASP A 57 5.434 -7.003 1.072 1.00 1.42 C ATOM 873 O ASP A 57 6.287 -7.739 1.567 1.00 44.54 O ATOM 874 CB ASP A 57 6.044 -4.635 1.599 1.00 74.43 C ATOM 875 CG ASP A 57 5.953 -3.975 0.236 1.00 21.31 C ATOM 876 OD1 ASP A 57 6.589 -4.481 -0.712 1.00 43.22 O ATOM 877 OD2 ASP A 57 5.246 -2.952 0.118 1.00 61.24 O ATOM 0 H ASP A 57 5.618 -6.210 3.730 1.00 70.04 H new ATOM 0 HA ASP A 57 4.051 -5.398 1.352 1.00 30.03 H new ATOM 0 HB2 ASP A 57 5.920 -3.879 2.375 1.00 74.43 H new ATOM 0 HB3 ASP A 57 7.038 -5.063 1.727 1.00 74.43 H new ATOM 882 N THR A 58 4.848 -7.255 -0.093 1.00 74.31 N ATOM 883 CA THR A 58 5.182 -8.439 -0.875 1.00 73.52 C ATOM 884 C THR A 58 6.472 -8.224 -1.661 1.00 71.32 C ATOM 885 O THR A 58 7.148 -7.208 -1.498 1.00 52.42 O ATOM 886 CB THR A 58 4.042 -8.790 -1.833 1.00 71.44 C ATOM 887 OG1 THR A 58 4.091 -7.977 -2.992 1.00 60.01 O ATOM 888 CG2 THR A 58 2.667 -8.631 -1.220 1.00 23.24 C ATOM 0 H THR A 58 4.140 -6.655 -0.516 1.00 74.31 H new ATOM 0 HA THR A 58 5.330 -9.268 -0.182 1.00 73.52 H new ATOM 0 HB THR A 58 4.191 -9.841 -2.079 1.00 71.44 H new ATOM 0 HG1 THR A 58 3.355 -8.218 -3.592 1.00 60.01 H new ATOM 0 HG21 THR A 58 1.908 -8.897 -1.956 1.00 23.24 H new ATOM 0 HG22 THR A 58 2.577 -9.286 -0.353 1.00 23.24 H new ATOM 0 HG23 THR A 58 2.525 -7.596 -0.909 1.00 23.24 H new ATOM 896 N ALA A 59 6.809 -9.188 -2.512 1.00 11.50 N ATOM 897 CA ALA A 59 8.018 -9.104 -3.322 1.00 64.34 C ATOM 898 C ALA A 59 7.683 -8.942 -4.800 1.00 51.04 C ATOM 899 O ALA A 59 6.568 -9.235 -5.231 1.00 21.33 O ATOM 900 CB ALA A 59 8.879 -10.340 -3.116 1.00 54.52 C ATOM 0 H ALA A 59 6.262 -10.036 -2.658 1.00 11.50 H new ATOM 0 HA ALA A 59 8.574 -8.223 -3.001 1.00 64.34 H new ATOM 0 HB1 ALA A 59 9.778 -10.263 -3.727 1.00 54.52 H new ATOM 0 HB2 ALA A 59 9.160 -10.417 -2.066 1.00 54.52 H new ATOM 0 HB3 ALA A 59 8.317 -11.227 -3.407 1.00 54.52 H new ATOM 1002 N MET A 67 2.595 -16.327 -3.010 1.00 11.42 N ATOM 1003 CA MET A 67 2.629 -15.892 -1.618 1.00 23.05 C ATOM 1004 C MET A 67 1.522 -14.879 -1.338 1.00 25.23 C ATOM 1005 O MET A 67 1.107 -14.701 -0.192 1.00 5.13 O ATOM 1006 CB MET A 67 3.996 -15.285 -1.291 1.00 1.41 C ATOM 1007 CG MET A 67 5.167 -16.028 -1.924 1.00 73.12 C ATOM 1008 SD MET A 67 5.971 -17.168 -0.782 1.00 22.14 S ATOM 1009 CE MET A 67 6.413 -16.053 0.545 1.00 21.32 C ATOM 0 HA MET A 67 2.464 -16.762 -0.982 1.00 23.05 H new ATOM 0 HB2 MET A 67 4.012 -14.248 -1.626 1.00 1.41 H new ATOM 0 HB3 MET A 67 4.128 -15.272 -0.209 1.00 1.41 H new ATOM 0 HG2 MET A 67 4.813 -16.582 -2.793 1.00 73.12 H new ATOM 0 HG3 MET A 67 5.899 -15.305 -2.283 1.00 73.12 H new ATOM 0 HE1 MET A 67 7.346 -16.383 1.002 1.00 21.32 H new ATOM 0 HE2 MET A 67 6.540 -15.046 0.147 1.00 21.32 H new ATOM 0 HE3 MET A 67 5.623 -16.049 1.296 1.00 21.32 H new ATOM 1019 N ARG A 68 1.046 -14.218 -2.390 1.00 14.22 N ATOM 1020 CA ARG A 68 -0.014 -13.224 -2.256 1.00 14.10 C ATOM 1021 C ARG A 68 -1.224 -13.810 -1.534 1.00 54.15 C ATOM 1022 O ARG A 68 -1.767 -13.197 -0.616 1.00 41.30 O ATOM 1023 CB ARG A 68 -0.431 -12.703 -3.633 1.00 11.21 C ATOM 1024 CG ARG A 68 -0.713 -11.209 -3.657 1.00 25.41 C ATOM 1025 CD ARG A 68 0.130 -10.498 -4.704 1.00 64.52 C ATOM 1026 NE ARG A 68 -0.124 -11.008 -6.050 1.00 42.03 N ATOM 1027 CZ ARG A 68 0.433 -10.509 -7.151 1.00 2.30 C ATOM 1028 NH1 ARG A 68 1.278 -9.488 -7.072 1.00 33.21 N ATOM 1029 NH2 ARG A 68 0.146 -11.033 -8.335 1.00 11.21 N ATOM 0 H ARG A 68 1.378 -14.353 -3.345 1.00 14.22 H new ATOM 0 HA ARG A 68 0.374 -12.396 -1.663 1.00 14.10 H new ATOM 0 HB2 ARG A 68 0.357 -12.927 -4.351 1.00 11.21 H new ATOM 0 HB3 ARG A 68 -1.322 -13.238 -3.960 1.00 11.21 H new ATOM 0 HG2 ARG A 68 -1.770 -11.041 -3.864 1.00 25.41 H new ATOM 0 HG3 ARG A 68 -0.509 -10.784 -2.674 1.00 25.41 H new ATOM 0 HD2 ARG A 68 -0.082 -9.429 -4.675 1.00 64.52 H new ATOM 0 HD3 ARG A 68 1.186 -10.620 -4.463 1.00 64.52 H new ATOM 0 HE ARG A 68 -0.767 -11.793 -6.152 1.00 42.03 H new ATOM 0 HH11 ARG A 68 1.504 -9.082 -6.164 1.00 33.21 H new ATOM 0 HH12 ARG A 68 1.702 -9.110 -7.919 1.00 33.21 H new ATOM 0 HH21 ARG A 68 -0.502 -11.818 -8.402 1.00 11.21 H new ATOM 0 HH22 ARG A 68 0.573 -10.651 -9.179 1.00 11.21 H new ATOM 1043 N ASP A 69 -1.639 -15.003 -1.954 1.00 10.11 N ATOM 1044 CA ASP A 69 -2.782 -15.674 -1.343 1.00 21.13 C ATOM 1045 C ASP A 69 -2.612 -15.762 0.171 1.00 41.01 C ATOM 1046 O ASP A 69 -3.591 -15.782 0.918 1.00 14.24 O ATOM 1047 CB ASP A 69 -2.952 -17.075 -1.936 1.00 32.15 C ATOM 1048 CG ASP A 69 -4.176 -17.182 -2.824 1.00 74.34 C ATOM 1049 OD1 ASP A 69 -4.410 -16.254 -3.627 1.00 34.24 O ATOM 1050 OD2 ASP A 69 -4.901 -18.193 -2.716 1.00 73.10 O ATOM 0 H ASP A 69 -1.201 -15.524 -2.714 1.00 10.11 H new ATOM 0 HA ASP A 69 -3.676 -15.088 -1.555 1.00 21.13 H new ATOM 0 HB2 ASP A 69 -2.064 -17.332 -2.513 1.00 32.15 H new ATOM 0 HB3 ASP A 69 -3.028 -17.802 -1.127 1.00 32.15 H new ATOM 1055 N GLN A 70 -1.360 -15.810 0.612 1.00 41.04 N ATOM 1056 CA GLN A 70 -1.046 -15.890 2.033 1.00 72.11 C ATOM 1057 C GLN A 70 -1.083 -14.502 2.671 1.00 60.34 C ATOM 1058 O GLN A 70 -1.669 -14.315 3.738 1.00 15.22 O ATOM 1059 CB GLN A 70 0.332 -16.529 2.226 1.00 64.42 C ATOM 1060 CG GLN A 70 0.826 -16.509 3.663 1.00 23.34 C ATOM 1061 CD GLN A 70 0.061 -17.464 4.558 1.00 21.42 C ATOM 1062 OE1 GLN A 70 -0.995 -17.975 4.183 1.00 62.14 O ATOM 1063 NE2 GLN A 70 0.592 -17.709 5.750 1.00 54.23 N ATOM 0 H GLN A 70 -0.543 -15.795 0.002 1.00 41.04 H new ATOM 0 HA GLN A 70 -1.796 -16.510 2.523 1.00 72.11 H new ATOM 0 HB2 GLN A 70 0.294 -17.562 1.880 1.00 64.42 H new ATOM 0 HB3 GLN A 70 1.054 -16.008 1.597 1.00 64.42 H new ATOM 0 HG2 GLN A 70 1.885 -16.768 3.683 1.00 23.34 H new ATOM 0 HG3 GLN A 70 0.738 -15.497 4.059 1.00 23.34 H new ATOM 0 HE21 GLN A 70 1.469 -17.263 6.019 1.00 54.23 H new ATOM 0 HE22 GLN A 70 0.123 -18.343 6.397 1.00 54.23 H new ATOM 1072 N TYR A 71 -0.456 -13.531 2.009 1.00 20.51 N ATOM 1073 CA TYR A 71 -0.419 -12.160 2.510 1.00 44.11 C ATOM 1074 C TYR A 71 -1.829 -11.622 2.727 1.00 71.41 C ATOM 1075 O TYR A 71 -2.091 -10.916 3.700 1.00 34.52 O ATOM 1076 CB TYR A 71 0.346 -11.257 1.541 1.00 1.20 C ATOM 1077 CG TYR A 71 1.835 -11.502 1.554 1.00 35.11 C ATOM 1078 CD1 TYR A 71 2.594 -11.229 2.685 1.00 73.31 C ATOM 1079 CD2 TYR A 71 2.480 -12.021 0.441 1.00 13.31 C ATOM 1080 CE1 TYR A 71 3.954 -11.468 2.704 1.00 33.05 C ATOM 1081 CE2 TYR A 71 3.840 -12.261 0.452 1.00 22.30 C ATOM 1082 CZ TYR A 71 4.572 -11.983 1.585 1.00 33.12 C ATOM 1083 OH TYR A 71 5.926 -12.226 1.602 1.00 42.34 O ATOM 0 H TYR A 71 0.033 -13.669 1.125 1.00 20.51 H new ATOM 0 HA TYR A 71 0.098 -12.165 3.469 1.00 44.11 H new ATOM 0 HB2 TYR A 71 -0.033 -11.414 0.531 1.00 1.20 H new ATOM 0 HB3 TYR A 71 0.153 -10.215 1.796 1.00 1.20 H new ATOM 0 HD1 TYR A 71 2.113 -10.824 3.563 1.00 73.31 H new ATOM 0 HD2 TYR A 71 1.909 -12.241 -0.449 1.00 13.31 H new ATOM 0 HE1 TYR A 71 4.530 -11.252 3.591 1.00 33.05 H new ATOM 0 HE2 TYR A 71 4.327 -12.665 -0.423 1.00 22.30 H new ATOM 0 HH TYR A 71 6.204 -12.589 0.735 1.00 42.34 H new ATOM 1093 N MET A 72 -2.736 -11.969 1.819 1.00 53.04 N ATOM 1094 CA MET A 72 -4.122 -11.527 1.922 1.00 51.23 C ATOM 1095 C MET A 72 -4.803 -12.202 3.106 1.00 24.33 C ATOM 1096 O MET A 72 -5.379 -11.539 3.968 1.00 20.14 O ATOM 1097 CB MET A 72 -4.881 -11.845 0.632 1.00 40.13 C ATOM 1098 CG MET A 72 -4.143 -11.425 -0.629 1.00 20.11 C ATOM 1099 SD MET A 72 -5.209 -10.578 -1.811 1.00 25.21 S ATOM 1100 CE MET A 72 -4.005 -9.611 -2.718 1.00 54.54 C ATOM 0 H MET A 72 -2.537 -12.553 1.007 1.00 53.04 H new ATOM 0 HA MET A 72 -4.130 -10.448 2.076 1.00 51.23 H new ATOM 0 HB2 MET A 72 -5.075 -12.917 0.589 1.00 40.13 H new ATOM 0 HB3 MET A 72 -5.850 -11.347 0.659 1.00 40.13 H new ATOM 0 HG2 MET A 72 -3.315 -10.770 -0.359 1.00 20.11 H new ATOM 0 HG3 MET A 72 -3.711 -12.307 -1.103 1.00 20.11 H new ATOM 0 HE1 MET A 72 -4.400 -8.610 -2.893 1.00 54.54 H new ATOM 0 HE2 MET A 72 -3.084 -9.542 -2.140 1.00 54.54 H new ATOM 0 HE3 MET A 72 -3.798 -10.092 -3.674 1.00 54.54 H new ATOM 1110 N ARG A 73 -4.723 -13.528 3.141 1.00 1.23 N ATOM 1111 CA ARG A 73 -5.321 -14.306 4.219 1.00 34.25 C ATOM 1112 C ARG A 73 -4.647 -14.003 5.557 1.00 3.03 C ATOM 1113 O ARG A 73 -5.190 -14.310 6.618 1.00 75.45 O ATOM 1114 CB ARG A 73 -5.214 -15.798 3.910 1.00 71.11 C ATOM 1115 CG ARG A 73 -6.216 -16.271 2.873 1.00 23.14 C ATOM 1116 CD ARG A 73 -6.224 -17.783 2.763 1.00 31.11 C ATOM 1117 NE ARG A 73 -6.804 -18.416 3.945 1.00 53.04 N ATOM 1118 CZ ARG A 73 -8.102 -18.389 4.240 1.00 34.21 C ATOM 1119 NH1 ARG A 73 -8.958 -17.765 3.440 1.00 13.11 N ATOM 1120 NH2 ARG A 73 -8.546 -18.986 5.338 1.00 63.01 N ATOM 0 H ARG A 73 -4.248 -14.087 2.433 1.00 1.23 H new ATOM 0 HA ARG A 73 -6.372 -14.027 4.295 1.00 34.25 H new ATOM 0 HB2 ARG A 73 -4.206 -16.017 3.557 1.00 71.11 H new ATOM 0 HB3 ARG A 73 -5.360 -16.364 4.830 1.00 71.11 H new ATOM 0 HG2 ARG A 73 -7.212 -15.919 3.140 1.00 23.14 H new ATOM 0 HG3 ARG A 73 -5.973 -15.835 1.904 1.00 23.14 H new ATOM 0 HD2 ARG A 73 -6.789 -18.079 1.879 1.00 31.11 H new ATOM 0 HD3 ARG A 73 -5.204 -18.142 2.624 1.00 31.11 H new ATOM 0 HE ARG A 73 -6.177 -18.908 4.582 1.00 53.04 H new ATOM 0 HH11 ARG A 73 -8.622 -17.303 2.595 1.00 13.11 H new ATOM 0 HH12 ARG A 73 -9.951 -17.747 3.671 1.00 13.11 H new ATOM 0 HH21 ARG A 73 -7.893 -19.466 5.957 1.00 63.01 H new ATOM 0 HH22 ARG A 73 -9.541 -18.965 5.563 1.00 63.01 H new ATOM 1134 N THR A 74 -3.463 -13.397 5.499 1.00 42.32 N ATOM 1135 CA THR A 74 -2.719 -13.054 6.705 1.00 52.21 C ATOM 1136 C THR A 74 -2.833 -11.562 7.017 1.00 73.53 C ATOM 1137 O THR A 74 -2.275 -11.084 8.005 1.00 2.33 O ATOM 1138 CB THR A 74 -1.244 -13.432 6.543 1.00 13.21 C ATOM 1139 OG1 THR A 74 -0.683 -12.775 5.422 1.00 5.13 O ATOM 1140 CG2 THR A 74 -1.011 -14.919 6.362 1.00 4.13 C ATOM 0 H THR A 74 -3.000 -13.134 4.629 1.00 42.32 H new ATOM 0 HA THR A 74 -3.149 -13.616 7.534 1.00 52.21 H new ATOM 0 HB THR A 74 -0.767 -13.121 7.473 1.00 13.21 H new ATOM 0 HG1 THR A 74 -0.527 -13.425 4.706 1.00 5.13 H new ATOM 0 HG21 THR A 74 0.057 -15.109 6.254 1.00 4.13 H new ATOM 0 HG22 THR A 74 -1.389 -15.455 7.233 1.00 4.13 H new ATOM 0 HG23 THR A 74 -1.533 -15.263 5.469 1.00 4.13 H new ATOM 1148 N GLY A 75 -3.550 -10.826 6.169 1.00 3.11 N ATOM 1149 CA GLY A 75 -3.705 -9.400 6.380 1.00 71.53 C ATOM 1150 C GLY A 75 -5.146 -8.990 6.612 1.00 14.41 C ATOM 1151 O GLY A 75 -6.073 -9.698 6.217 1.00 42.53 O ATOM 0 H GLY A 75 -4.024 -11.193 5.343 1.00 3.11 H new ATOM 0 HA2 GLY A 75 -3.104 -9.098 7.238 1.00 71.53 H new ATOM 0 HA3 GLY A 75 -3.316 -8.865 5.514 1.00 71.53 H new ATOM 1155 N GLU A 76 -5.333 -7.839 7.252 1.00 11.44 N ATOM 1156 CA GLU A 76 -6.669 -7.326 7.535 1.00 32.13 C ATOM 1157 C GLU A 76 -7.080 -6.274 6.507 1.00 40.01 C ATOM 1158 O GLU A 76 -8.262 -5.964 6.363 1.00 44.45 O ATOM 1159 CB GLU A 76 -6.726 -6.722 8.942 1.00 40.05 C ATOM 1160 CG GLU A 76 -5.972 -7.529 9.988 1.00 53.42 C ATOM 1161 CD GLU A 76 -6.811 -7.823 11.217 1.00 23.12 C ATOM 1162 OE1 GLU A 76 -8.050 -7.916 11.083 1.00 62.44 O ATOM 1163 OE2 GLU A 76 -6.230 -7.962 12.314 1.00 2.32 O ATOM 0 H GLU A 76 -4.575 -7.244 7.585 1.00 11.44 H new ATOM 0 HA GLU A 76 -7.366 -8.162 7.477 1.00 32.13 H new ATOM 0 HB2 GLU A 76 -6.316 -5.712 8.911 1.00 40.05 H new ATOM 0 HB3 GLU A 76 -7.769 -6.633 9.247 1.00 40.05 H new ATOM 0 HG2 GLU A 76 -5.640 -8.469 9.546 1.00 53.42 H new ATOM 0 HG3 GLU A 76 -5.077 -6.983 10.286 1.00 53.42 H new ATOM 1170 N GLY A 77 -6.096 -5.725 5.798 1.00 32.43 N ATOM 1171 CA GLY A 77 -6.379 -4.713 4.797 1.00 5.01 C ATOM 1172 C GLY A 77 -5.367 -4.719 3.668 1.00 25.43 C ATOM 1173 O GLY A 77 -4.393 -5.471 3.704 1.00 75.10 O ATOM 0 H GLY A 77 -5.109 -5.963 5.900 1.00 32.43 H new ATOM 0 HA2 GLY A 77 -7.376 -4.878 4.389 1.00 5.01 H new ATOM 0 HA3 GLY A 77 -6.387 -3.731 5.269 1.00 5.01 H new ATOM 1177 N PHE A 78 -5.597 -3.882 2.661 1.00 71.03 N ATOM 1178 CA PHE A 78 -4.694 -3.801 1.518 1.00 41.33 C ATOM 1179 C PHE A 78 -4.529 -2.359 1.048 1.00 21.21 C ATOM 1180 O PHE A 78 -5.490 -1.589 1.021 1.00 52.43 O ATOM 1181 CB PHE A 78 -5.214 -4.668 0.371 1.00 33.23 C ATOM 1182 CG PHE A 78 -5.487 -6.090 0.772 1.00 72.30 C ATOM 1183 CD1 PHE A 78 -6.632 -6.416 1.482 1.00 13.44 C ATOM 1184 CD2 PHE A 78 -4.599 -7.100 0.440 1.00 51.20 C ATOM 1185 CE1 PHE A 78 -6.885 -7.723 1.853 1.00 22.02 C ATOM 1186 CE2 PHE A 78 -4.847 -8.408 0.808 1.00 33.11 C ATOM 1187 CZ PHE A 78 -5.991 -8.720 1.516 1.00 62.24 C ATOM 0 H PHE A 78 -6.398 -3.252 2.613 1.00 71.03 H new ATOM 0 HA PHE A 78 -3.718 -4.171 1.833 1.00 41.33 H new ATOM 0 HB2 PHE A 78 -6.130 -4.227 -0.021 1.00 33.23 H new ATOM 0 HB3 PHE A 78 -4.485 -4.661 -0.439 1.00 33.23 H new ATOM 0 HD1 PHE A 78 -7.334 -5.640 1.748 1.00 13.44 H new ATOM 0 HD2 PHE A 78 -3.702 -6.862 -0.113 1.00 51.20 H new ATOM 0 HE1 PHE A 78 -7.781 -7.964 2.406 1.00 22.02 H new ATOM 0 HE2 PHE A 78 -4.147 -9.186 0.542 1.00 33.11 H new ATOM 0 HZ PHE A 78 -6.186 -9.742 1.806 1.00 62.24 H new ATOM 1197 N LEU A 79 -3.303 -2.001 0.678 1.00 5.12 N ATOM 1198 CA LEU A 79 -3.006 -0.653 0.208 1.00 60.45 C ATOM 1199 C LEU A 79 -2.461 -0.684 -1.217 1.00 55.44 C ATOM 1200 O LEU A 79 -1.444 -1.323 -1.489 1.00 40.32 O ATOM 1201 CB LEU A 79 -1.994 0.020 1.138 1.00 43.43 C ATOM 1202 CG LEU A 79 -2.181 1.530 1.320 1.00 53.25 C ATOM 1203 CD1 LEU A 79 -2.568 1.853 2.755 1.00 11.45 C ATOM 1204 CD2 LEU A 79 -0.914 2.276 0.929 1.00 54.11 C ATOM 0 H LEU A 79 -2.498 -2.627 0.695 1.00 5.12 H new ATOM 0 HA LEU A 79 -3.932 -0.079 0.212 1.00 60.45 H new ATOM 0 HB2 LEU A 79 -2.050 -0.458 2.116 1.00 43.43 H new ATOM 0 HB3 LEU A 79 -0.991 -0.162 0.751 1.00 43.43 H new ATOM 0 HG LEU A 79 -2.989 1.856 0.665 1.00 53.25 H new ATOM 0 HD11 LEU A 79 -2.696 2.930 2.864 1.00 11.45 H new ATOM 0 HD12 LEU A 79 -3.503 1.350 3.002 1.00 11.45 H new ATOM 0 HD13 LEU A 79 -1.783 1.511 3.429 1.00 11.45 H new ATOM 0 HD21 LEU A 79 -1.066 3.347 1.065 1.00 54.11 H new ATOM 0 HD22 LEU A 79 -0.088 1.944 1.557 1.00 54.11 H new ATOM 0 HD23 LEU A 79 -0.680 2.072 -0.116 1.00 54.11 H new ATOM 1216 N CYS A 80 -3.142 0.010 -2.124 1.00 4.10 N ATOM 1217 CA CYS A 80 -2.724 0.059 -3.520 1.00 10.15 C ATOM 1218 C CYS A 80 -1.892 1.308 -3.796 1.00 75.04 C ATOM 1219 O CYS A 80 -2.395 2.429 -3.725 1.00 51.41 O ATOM 1220 CB CYS A 80 -3.944 0.033 -4.442 1.00 30.40 C ATOM 1221 SG CYS A 80 -4.704 -1.599 -4.614 1.00 4.34 S ATOM 0 H CYS A 80 -3.985 0.546 -1.917 1.00 4.10 H new ATOM 0 HA CYS A 80 -2.108 -0.818 -3.718 1.00 10.15 H new ATOM 0 HB2 CYS A 80 -4.689 0.731 -4.060 1.00 30.40 H new ATOM 0 HB3 CYS A 80 -3.648 0.390 -5.428 1.00 30.40 H new ATOM 0 HG CYS A 80 -5.728 -1.519 -5.410 1.00 4.34 H new ATOM 1227 N VAL A 81 -0.618 1.106 -4.114 1.00 41.44 N ATOM 1228 CA VAL A 81 0.283 2.215 -4.404 1.00 0.04 C ATOM 1229 C VAL A 81 0.717 2.200 -5.865 1.00 54.52 C ATOM 1230 O VAL A 81 1.420 1.290 -6.305 1.00 63.15 O ATOM 1231 CB VAL A 81 1.534 2.173 -3.504 1.00 50.23 C ATOM 1232 CG1 VAL A 81 2.426 3.377 -3.767 1.00 12.01 C ATOM 1233 CG2 VAL A 81 1.132 2.109 -2.038 1.00 32.35 C ATOM 0 H VAL A 81 -0.186 0.184 -4.177 1.00 41.44 H new ATOM 0 HA VAL A 81 -0.268 3.134 -4.201 1.00 0.04 H new ATOM 0 HB VAL A 81 2.101 1.273 -3.744 1.00 50.23 H new ATOM 0 HG11 VAL A 81 3.303 3.328 -3.122 1.00 12.01 H new ATOM 0 HG12 VAL A 81 2.742 3.374 -4.810 1.00 12.01 H new ATOM 0 HG13 VAL A 81 1.873 4.292 -3.558 1.00 12.01 H new ATOM 0 HG21 VAL A 81 2.027 2.080 -1.416 1.00 32.35 H new ATOM 0 HG22 VAL A 81 0.542 2.990 -1.784 1.00 32.35 H new ATOM 0 HG23 VAL A 81 0.539 1.212 -1.862 1.00 32.35 H new ATOM 1243 N PHE A 82 0.294 3.214 -6.613 1.00 74.23 N ATOM 1244 CA PHE A 82 0.639 3.318 -8.025 1.00 71.24 C ATOM 1245 C PHE A 82 1.232 4.689 -8.340 1.00 13.15 C ATOM 1246 O PHE A 82 0.813 5.701 -7.777 1.00 34.13 O ATOM 1247 CB PHE A 82 -0.596 3.061 -8.895 1.00 51.51 C ATOM 1248 CG PHE A 82 -1.561 4.213 -8.938 1.00 74.42 C ATOM 1249 CD1 PHE A 82 -2.349 4.516 -7.839 1.00 73.13 C ATOM 1250 CD2 PHE A 82 -1.676 4.993 -10.077 1.00 53.30 C ATOM 1251 CE1 PHE A 82 -3.235 5.576 -7.877 1.00 14.43 C ATOM 1252 CE2 PHE A 82 -2.560 6.054 -10.120 1.00 55.12 C ATOM 1253 CZ PHE A 82 -3.340 6.345 -9.019 1.00 12.24 C ATOM 0 H PHE A 82 -0.288 3.975 -6.264 1.00 74.23 H new ATOM 0 HA PHE A 82 1.391 2.561 -8.249 1.00 71.24 H new ATOM 0 HB2 PHE A 82 -0.272 2.833 -9.910 1.00 51.51 H new ATOM 0 HB3 PHE A 82 -1.115 2.179 -8.520 1.00 51.51 H new ATOM 0 HD1 PHE A 82 -2.270 3.918 -6.943 1.00 73.13 H new ATOM 0 HD2 PHE A 82 -1.068 4.769 -10.941 1.00 53.30 H new ATOM 0 HE1 PHE A 82 -3.844 5.803 -7.015 1.00 14.43 H new ATOM 0 HE2 PHE A 82 -2.641 6.655 -11.014 1.00 55.12 H new ATOM 0 HZ PHE A 82 -4.032 7.174 -9.051 1.00 12.24 H new ATOM 1263 N ALA A 83 2.207 4.715 -9.241 1.00 30.41 N ATOM 1264 CA ALA A 83 2.855 5.962 -9.629 1.00 41.34 C ATOM 1265 C ALA A 83 2.096 6.645 -10.761 1.00 33.15 C ATOM 1266 O ALA A 83 1.863 6.049 -11.813 1.00 5.23 O ATOM 1267 CB ALA A 83 4.295 5.701 -10.040 1.00 62.21 C ATOM 0 H ALA A 83 2.566 3.887 -9.716 1.00 30.41 H new ATOM 0 HA ALA A 83 2.849 6.630 -8.768 1.00 41.34 H new ATOM 0 HB1 ALA A 83 4.767 6.640 -10.327 1.00 62.21 H new ATOM 0 HB2 ALA A 83 4.839 5.263 -9.203 1.00 62.21 H new ATOM 0 HB3 ALA A 83 4.313 5.012 -10.885 1.00 62.21 H new ATOM 1273 N ILE A 84 1.715 7.900 -10.542 1.00 53.44 N ATOM 1274 CA ILE A 84 0.986 8.662 -11.547 1.00 34.44 C ATOM 1275 C ILE A 84 1.785 8.762 -12.840 1.00 22.11 C ATOM 1276 O ILE A 84 1.219 8.824 -13.932 1.00 74.34 O ATOM 1277 CB ILE A 84 0.656 10.081 -11.047 1.00 12.10 C ATOM 1278 CG1 ILE A 84 1.911 10.761 -10.498 1.00 32.10 C ATOM 1279 CG2 ILE A 84 -0.423 10.022 -9.981 1.00 54.12 C ATOM 1280 CD1 ILE A 84 1.875 12.269 -10.605 1.00 44.13 C ATOM 0 H ILE A 84 1.899 8.409 -9.678 1.00 53.44 H new ATOM 0 HA ILE A 84 0.054 8.129 -11.737 1.00 34.44 H new ATOM 0 HB ILE A 84 0.286 10.669 -11.887 1.00 12.10 H new ATOM 0 HG12 ILE A 84 2.038 10.482 -9.452 1.00 32.10 H new ATOM 0 HG13 ILE A 84 2.782 10.387 -11.036 1.00 32.10 H new ATOM 0 HG21 ILE A 84 -0.648 11.031 -9.635 1.00 54.12 H new ATOM 0 HG22 ILE A 84 -1.324 9.572 -10.399 1.00 54.12 H new ATOM 0 HG23 ILE A 84 -0.073 9.420 -9.142 1.00 54.12 H new ATOM 0 HD11 ILE A 84 2.796 12.685 -10.197 1.00 44.13 H new ATOM 0 HD12 ILE A 84 1.779 12.557 -11.652 1.00 44.13 H new ATOM 0 HD13 ILE A 84 1.024 12.653 -10.043 1.00 44.13 H new ATOM 1292 N ASN A 85 3.106 8.773 -12.706 1.00 62.33 N ATOM 1293 CA ASN A 85 3.993 8.859 -13.861 1.00 42.13 C ATOM 1294 C ASN A 85 3.915 7.590 -14.708 1.00 30.05 C ATOM 1295 O ASN A 85 4.325 7.582 -15.869 1.00 13.44 O ATOM 1296 CB ASN A 85 5.434 9.094 -13.405 1.00 25.14 C ATOM 1297 CG ASN A 85 5.691 10.538 -13.020 1.00 32.34 C ATOM 1298 OD1 ASN A 85 4.921 11.139 -12.271 1.00 12.43 O ATOM 1299 ND2 ASN A 85 6.778 11.103 -13.533 1.00 11.14 N ATOM 0 H ASN A 85 3.587 8.723 -11.808 1.00 62.33 H new ATOM 0 HA ASN A 85 3.669 9.701 -14.473 1.00 42.13 H new ATOM 0 HB2 ASN A 85 5.652 8.450 -12.553 1.00 25.14 H new ATOM 0 HB3 ASN A 85 6.117 8.807 -14.205 1.00 25.14 H new ATOM 0 HD21 ASN A 85 7.002 12.073 -13.310 1.00 11.14 H new ATOM 0 HD22 ASN A 85 7.389 10.567 -14.150 1.00 11.14 H new ATOM 1306 N ASN A 86 3.388 6.518 -14.121 1.00 50.35 N ATOM 1307 CA ASN A 86 3.257 5.247 -14.824 1.00 54.31 C ATOM 1308 C ASN A 86 1.796 4.814 -14.893 1.00 23.32 C ATOM 1309 O ASN A 86 1.197 4.454 -13.879 1.00 4.51 O ATOM 1310 CB ASN A 86 4.089 4.169 -14.126 1.00 31.13 C ATOM 1311 CG ASN A 86 4.553 3.087 -15.082 1.00 24.15 C ATOM 1312 OD1 ASN A 86 5.126 3.375 -16.133 1.00 62.41 O ATOM 1313 ND2 ASN A 86 4.308 1.833 -14.720 1.00 52.41 N ATOM 0 H ASN A 86 3.045 6.506 -13.160 1.00 50.35 H new ATOM 0 HA ASN A 86 3.626 5.380 -15.841 1.00 54.31 H new ATOM 0 HB2 ASN A 86 4.957 4.631 -13.656 1.00 31.13 H new ATOM 0 HB3 ASN A 86 3.498 3.717 -13.329 1.00 31.13 H new ATOM 0 HD21 ASN A 86 4.598 1.062 -15.322 1.00 52.41 H new ATOM 0 HD22 ASN A 86 3.830 1.640 -13.840 1.00 52.41 H new ATOM 1320 N THR A 87 1.227 4.853 -16.093 1.00 50.21 N ATOM 1321 CA THR A 87 -0.166 4.468 -16.291 1.00 21.42 C ATOM 1322 C THR A 87 -0.355 2.966 -16.098 1.00 35.14 C ATOM 1323 O THR A 87 -1.445 2.509 -15.755 1.00 53.52 O ATOM 1324 CB THR A 87 -0.637 4.875 -17.688 1.00 52.44 C ATOM 1325 OG1 THR A 87 -0.172 6.172 -18.016 1.00 75.03 O ATOM 1326 CG2 THR A 87 -2.144 4.877 -17.832 1.00 71.10 C ATOM 0 H THR A 87 1.708 5.147 -16.943 1.00 50.21 H new ATOM 0 HA THR A 87 -0.766 4.989 -15.544 1.00 21.42 H new ATOM 0 HB THR A 87 -0.224 4.126 -18.363 1.00 52.44 H new ATOM 0 HG1 THR A 87 0.160 6.615 -17.207 1.00 75.03 H new ATOM 0 HG21 THR A 87 -2.412 5.174 -18.846 1.00 71.10 H new ATOM 0 HG22 THR A 87 -2.530 3.877 -17.633 1.00 71.10 H new ATOM 0 HG23 THR A 87 -2.577 5.581 -17.121 1.00 71.10 H new ATOM 1334 N LYS A 88 0.711 2.202 -16.319 1.00 63.50 N ATOM 1335 CA LYS A 88 0.658 0.758 -16.167 1.00 5.45 C ATOM 1336 C LYS A 88 0.311 0.380 -14.729 1.00 4.12 C ATOM 1337 O LYS A 88 -0.490 -0.524 -14.491 1.00 60.24 O ATOM 1338 CB LYS A 88 2.001 0.146 -16.576 1.00 61.51 C ATOM 1339 CG LYS A 88 2.183 -1.291 -16.124 1.00 52.25 C ATOM 1340 CD LYS A 88 2.795 -2.151 -17.218 1.00 23.34 C ATOM 1341 CE LYS A 88 4.222 -1.729 -17.526 1.00 62.23 C ATOM 1342 NZ LYS A 88 5.056 -2.876 -17.979 1.00 53.31 N ATOM 0 H LYS A 88 1.621 2.563 -16.604 1.00 63.50 H new ATOM 0 HA LYS A 88 -0.123 0.363 -16.816 1.00 5.45 H new ATOM 0 HB2 LYS A 88 2.094 0.190 -17.661 1.00 61.51 H new ATOM 0 HB3 LYS A 88 2.807 0.752 -16.162 1.00 61.51 H new ATOM 0 HG2 LYS A 88 2.821 -1.317 -15.241 1.00 52.25 H new ATOM 0 HG3 LYS A 88 1.218 -1.706 -15.832 1.00 52.25 H new ATOM 0 HD2 LYS A 88 2.782 -3.197 -16.910 1.00 23.34 H new ATOM 0 HD3 LYS A 88 2.190 -2.077 -18.121 1.00 23.34 H new ATOM 0 HE2 LYS A 88 4.214 -0.959 -18.298 1.00 62.23 H new ATOM 0 HE3 LYS A 88 4.669 -1.284 -16.637 1.00 62.23 H new ATOM 0 HZ1 LYS A 88 6.022 -2.546 -18.179 1.00 53.31 H new ATOM 0 HZ2 LYS A 88 5.085 -3.600 -17.233 1.00 53.31 H new ATOM 0 HZ3 LYS A 88 4.645 -3.285 -18.842 1.00 53.31 H new ATOM 1356 N SER A 89 0.916 1.080 -13.776 1.00 42.41 N ATOM 1357 CA SER A 89 0.668 0.819 -12.363 1.00 15.33 C ATOM 1358 C SER A 89 -0.794 1.082 -12.013 1.00 74.43 C ATOM 1359 O SER A 89 -1.364 0.422 -11.145 1.00 1.24 O ATOM 1360 CB SER A 89 1.578 1.689 -11.494 1.00 42.42 C ATOM 1361 OG SER A 89 2.830 1.902 -12.121 1.00 73.43 O ATOM 0 H SER A 89 1.581 1.832 -13.956 1.00 42.41 H new ATOM 0 HA SER A 89 0.888 -0.230 -12.167 1.00 15.33 H new ATOM 0 HB2 SER A 89 1.096 2.648 -11.303 1.00 42.42 H new ATOM 0 HB3 SER A 89 1.729 1.210 -10.527 1.00 42.42 H new ATOM 0 HG SER A 89 3.353 1.073 -12.098 1.00 73.43 H new ATOM 1367 N PHE A 90 -1.394 2.050 -12.699 1.00 25.53 N ATOM 1368 CA PHE A 90 -2.791 2.400 -12.465 1.00 63.34 C ATOM 1369 C PHE A 90 -3.707 1.229 -12.808 1.00 1.03 C ATOM 1370 O PHE A 90 -4.542 0.823 -12.001 1.00 21.11 O ATOM 1371 CB PHE A 90 -3.176 3.627 -13.295 1.00 53.14 C ATOM 1372 CG PHE A 90 -4.608 4.047 -13.122 1.00 10.05 C ATOM 1373 CD1 PHE A 90 -5.155 4.190 -11.857 1.00 44.30 C ATOM 1374 CD2 PHE A 90 -5.407 4.300 -14.226 1.00 4.42 C ATOM 1375 CE1 PHE A 90 -6.472 4.576 -11.696 1.00 45.12 C ATOM 1376 CE2 PHE A 90 -6.724 4.686 -14.072 1.00 44.22 C ATOM 1377 CZ PHE A 90 -7.258 4.825 -12.805 1.00 4.35 C ATOM 0 H PHE A 90 -0.935 2.606 -13.421 1.00 25.53 H new ATOM 0 HA PHE A 90 -2.911 2.635 -11.407 1.00 63.34 H new ATOM 0 HB2 PHE A 90 -2.527 4.459 -13.021 1.00 53.14 H new ATOM 0 HB3 PHE A 90 -2.994 3.414 -14.348 1.00 53.14 H new ATOM 0 HD1 PHE A 90 -4.545 3.998 -10.987 1.00 44.30 H new ATOM 0 HD2 PHE A 90 -4.995 4.194 -15.219 1.00 4.42 H new ATOM 0 HE1 PHE A 90 -6.887 4.683 -10.705 1.00 45.12 H new ATOM 0 HE2 PHE A 90 -7.336 4.879 -14.941 1.00 44.22 H new ATOM 0 HZ PHE A 90 -8.287 5.128 -12.682 1.00 4.35 H new ATOM 1387 N GLU A 91 -3.542 0.691 -14.013 1.00 71.13 N ATOM 1388 CA GLU A 91 -4.353 -0.433 -14.467 1.00 24.12 C ATOM 1389 C GLU A 91 -4.210 -1.626 -13.525 1.00 23.44 C ATOM 1390 O GLU A 91 -5.121 -2.444 -13.403 1.00 74.13 O ATOM 1391 CB GLU A 91 -3.950 -0.838 -15.886 1.00 74.43 C ATOM 1392 CG GLU A 91 -3.808 0.340 -16.837 1.00 61.24 C ATOM 1393 CD GLU A 91 -4.288 0.018 -18.239 1.00 31.21 C ATOM 1394 OE1 GLU A 91 -5.505 0.139 -18.491 1.00 30.51 O ATOM 1395 OE2 GLU A 91 -3.447 -0.353 -19.084 1.00 15.53 O ATOM 0 H GLU A 91 -2.854 1.016 -14.692 1.00 71.13 H new ATOM 0 HA GLU A 91 -5.397 -0.118 -14.468 1.00 24.12 H new ATOM 0 HB2 GLU A 91 -3.004 -1.378 -15.846 1.00 74.43 H new ATOM 0 HB3 GLU A 91 -4.695 -1.528 -16.284 1.00 74.43 H new ATOM 0 HG2 GLU A 91 -4.374 1.186 -16.448 1.00 61.24 H new ATOM 0 HG3 GLU A 91 -2.763 0.647 -16.876 1.00 61.24 H new ATOM 1402 N ASP A 92 -3.061 -1.720 -12.862 1.00 23.52 N ATOM 1403 CA ASP A 92 -2.802 -2.813 -11.933 1.00 61.42 C ATOM 1404 C ASP A 92 -3.653 -2.671 -10.674 1.00 65.44 C ATOM 1405 O ASP A 92 -4.082 -3.664 -10.088 1.00 24.34 O ATOM 1406 CB ASP A 92 -1.319 -2.854 -11.559 1.00 11.44 C ATOM 1407 CG ASP A 92 -0.415 -2.869 -12.777 1.00 52.35 C ATOM 1408 OD1 ASP A 92 -0.926 -3.089 -13.895 1.00 62.15 O ATOM 1409 OD2 ASP A 92 0.806 -2.660 -12.612 1.00 34.13 O ATOM 0 H ASP A 92 -2.295 -1.052 -12.951 1.00 23.52 H new ATOM 0 HA ASP A 92 -3.070 -3.747 -12.427 1.00 61.42 H new ATOM 0 HB2 ASP A 92 -1.079 -1.988 -10.942 1.00 11.44 H new ATOM 0 HB3 ASP A 92 -1.124 -3.740 -10.954 1.00 11.44 H new ATOM 1414 N ILE A 93 -3.895 -1.430 -10.265 1.00 42.52 N ATOM 1415 CA ILE A 93 -4.698 -1.164 -9.077 1.00 34.21 C ATOM 1416 C ILE A 93 -6.106 -1.734 -9.231 1.00 32.03 C ATOM 1417 O ILE A 93 -6.763 -2.063 -8.243 1.00 31.31 O ATOM 1418 CB ILE A 93 -4.789 0.350 -8.787 1.00 63.54 C ATOM 1419 CG1 ILE A 93 -3.397 0.957 -8.633 1.00 34.11 C ATOM 1420 CG2 ILE A 93 -5.606 0.611 -7.536 1.00 63.50 C ATOM 1421 CD1 ILE A 93 -2.503 0.203 -7.671 1.00 61.11 C ATOM 0 H ILE A 93 -3.548 -0.595 -10.737 1.00 42.52 H new ATOM 0 HA ILE A 93 -4.202 -1.653 -8.239 1.00 34.21 H new ATOM 0 HB ILE A 93 -5.286 0.822 -9.635 1.00 63.54 H new ATOM 0 HG12 ILE A 93 -2.916 0.991 -9.610 1.00 34.11 H new ATOM 0 HG13 ILE A 93 -3.496 1.987 -8.290 1.00 34.11 H new ATOM 0 HG21 ILE A 93 -5.656 1.684 -7.352 1.00 63.50 H new ATOM 0 HG22 ILE A 93 -6.614 0.218 -7.671 1.00 63.50 H new ATOM 0 HG23 ILE A 93 -5.136 0.118 -6.685 1.00 63.50 H new ATOM 0 HD11 ILE A 93 -1.532 0.695 -7.615 1.00 61.11 H new ATOM 0 HD12 ILE A 93 -2.961 0.191 -6.682 1.00 61.11 H new ATOM 0 HD13 ILE A 93 -2.372 -0.820 -8.022 1.00 61.11 H new ATOM 1433 N HIS A 94 -6.562 -1.849 -10.474 1.00 72.44 N ATOM 1434 CA HIS A 94 -7.891 -2.381 -10.754 1.00 10.13 C ATOM 1435 C HIS A 94 -7.919 -3.896 -10.563 1.00 21.41 C ATOM 1436 O HIS A 94 -8.730 -4.421 -9.801 1.00 10.43 O ATOM 1437 CB HIS A 94 -8.313 -2.019 -12.183 1.00 33.12 C ATOM 1438 CG HIS A 94 -9.519 -2.764 -12.669 1.00 52.03 C ATOM 1439 ND1 HIS A 94 -10.801 -2.484 -12.244 1.00 30.04 N ATOM 1440 CD2 HIS A 94 -9.632 -3.786 -13.551 1.00 72.25 C ATOM 1441 CE1 HIS A 94 -11.649 -3.303 -12.841 1.00 34.32 C ATOM 1442 NE2 HIS A 94 -10.965 -4.102 -13.639 1.00 53.31 N ATOM 0 H HIS A 94 -6.031 -1.581 -11.303 1.00 72.44 H new ATOM 0 HA HIS A 94 -8.596 -1.935 -10.052 1.00 10.13 H new ATOM 0 HB2 HIS A 94 -8.516 -0.949 -12.231 1.00 33.12 H new ATOM 0 HB3 HIS A 94 -7.480 -2.216 -12.858 1.00 33.12 H new ATOM 0 HD2 HIS A 94 -8.824 -4.263 -14.085 1.00 72.25 H new ATOM 0 HE1 HIS A 94 -12.720 -3.316 -12.700 1.00 34.32 H new ATOM 0 HE2 HIS A 94 -11.363 -4.835 -14.226 1.00 53.31 H new ATOM 1451 N GLN A 95 -7.028 -4.592 -11.261 1.00 44.44 N ATOM 1452 CA GLN A 95 -6.952 -6.045 -11.169 1.00 4.31 C ATOM 1453 C GLN A 95 -6.514 -6.484 -9.775 1.00 63.53 C ATOM 1454 O GLN A 95 -6.869 -7.569 -9.316 1.00 22.21 O ATOM 1455 CB GLN A 95 -5.985 -6.596 -12.218 1.00 11.20 C ATOM 1456 CG GLN A 95 -4.581 -6.031 -12.108 1.00 61.24 C ATOM 1457 CD GLN A 95 -3.695 -6.846 -11.186 1.00 63.51 C ATOM 1458 OE1 GLN A 95 -4.000 -7.995 -10.869 1.00 61.32 O ATOM 1459 NE2 GLN A 95 -2.591 -6.251 -10.749 1.00 64.11 N ATOM 0 H GLN A 95 -6.349 -4.173 -11.896 1.00 44.44 H new ATOM 0 HA GLN A 95 -7.948 -6.445 -11.358 1.00 4.31 H new ATOM 0 HB2 GLN A 95 -5.939 -7.681 -12.123 1.00 11.20 H new ATOM 0 HB3 GLN A 95 -6.378 -6.379 -13.211 1.00 11.20 H new ATOM 0 HG2 GLN A 95 -4.130 -5.993 -13.100 1.00 61.24 H new ATOM 0 HG3 GLN A 95 -4.634 -5.005 -11.742 1.00 61.24 H new ATOM 0 HE21 GLN A 95 -2.378 -5.296 -11.038 1.00 64.11 H new ATOM 0 HE22 GLN A 95 -1.956 -6.749 -10.125 1.00 64.11 H new ATOM 1468 N TYR A 96 -5.741 -5.634 -9.106 1.00 2.14 N ATOM 1469 CA TYR A 96 -5.256 -5.936 -7.764 1.00 15.15 C ATOM 1470 C TYR A 96 -6.419 -6.166 -6.804 1.00 31.52 C ATOM 1471 O TYR A 96 -6.346 -7.018 -5.918 1.00 43.55 O ATOM 1472 CB TYR A 96 -4.370 -4.800 -7.250 1.00 4.41 C ATOM 1473 CG TYR A 96 -2.903 -4.990 -7.559 1.00 1.31 C ATOM 1474 CD1 TYR A 96 -2.257 -6.180 -7.248 1.00 43.00 C ATOM 1475 CD2 TYR A 96 -2.163 -3.980 -8.162 1.00 52.33 C ATOM 1476 CE1 TYR A 96 -0.916 -6.358 -7.530 1.00 2.21 C ATOM 1477 CE2 TYR A 96 -0.822 -4.151 -8.448 1.00 33.54 C ATOM 1478 CZ TYR A 96 -0.203 -5.341 -8.130 1.00 44.02 C ATOM 1479 OH TYR A 96 1.132 -5.516 -8.413 1.00 63.23 O ATOM 0 H TYR A 96 -5.437 -4.731 -9.471 1.00 2.14 H new ATOM 0 HA TYR A 96 -4.666 -6.851 -7.816 1.00 15.15 H new ATOM 0 HB2 TYR A 96 -4.707 -3.861 -7.689 1.00 4.41 H new ATOM 0 HB3 TYR A 96 -4.497 -4.711 -6.171 1.00 4.41 H new ATOM 0 HD1 TYR A 96 -2.812 -6.979 -6.778 1.00 43.00 H new ATOM 0 HD2 TYR A 96 -2.644 -3.046 -8.411 1.00 52.33 H new ATOM 0 HE1 TYR A 96 -0.428 -7.289 -7.282 1.00 2.21 H new ATOM 0 HE2 TYR A 96 -0.262 -3.356 -8.918 1.00 33.54 H new ATOM 0 HH TYR A 96 1.645 -5.525 -7.578 1.00 63.23 H new ATOM 1489 N ARG A 97 -7.493 -5.404 -6.987 1.00 41.23 N ATOM 1490 CA ARG A 97 -8.672 -5.528 -6.139 1.00 71.31 C ATOM 1491 C ARG A 97 -9.341 -6.885 -6.340 1.00 3.13 C ATOM 1492 O ARG A 97 -9.868 -7.475 -5.397 1.00 71.34 O ATOM 1493 CB ARG A 97 -9.665 -4.400 -6.440 1.00 2.02 C ATOM 1494 CG ARG A 97 -11.004 -4.555 -5.731 1.00 33.14 C ATOM 1495 CD ARG A 97 -11.385 -3.297 -4.965 1.00 54.11 C ATOM 1496 NE ARG A 97 -12.762 -2.890 -5.234 1.00 12.13 N ATOM 1497 CZ ARG A 97 -13.473 -2.099 -4.433 1.00 0.34 C ATOM 1498 NH1 ARG A 97 -12.940 -1.622 -3.314 1.00 21.34 N ATOM 1499 NH2 ARG A 97 -14.720 -1.782 -4.752 1.00 62.15 N ATOM 0 H ARG A 97 -7.570 -4.694 -7.715 1.00 41.23 H new ATOM 0 HA ARG A 97 -8.355 -5.450 -5.099 1.00 71.31 H new ATOM 0 HB2 ARG A 97 -9.219 -3.449 -6.150 1.00 2.02 H new ATOM 0 HB3 ARG A 97 -9.837 -4.357 -7.516 1.00 2.02 H new ATOM 0 HG2 ARG A 97 -11.779 -4.784 -6.463 1.00 33.14 H new ATOM 0 HG3 ARG A 97 -10.956 -5.399 -5.043 1.00 33.14 H new ATOM 0 HD2 ARG A 97 -11.260 -3.471 -3.896 1.00 54.11 H new ATOM 0 HD3 ARG A 97 -10.708 -2.487 -5.237 1.00 54.11 H new ATOM 0 HE ARG A 97 -13.205 -3.232 -6.086 1.00 12.13 H new ATOM 0 HH11 ARG A 97 -11.981 -1.861 -3.064 1.00 21.34 H new ATOM 0 HH12 ARG A 97 -13.490 -1.017 -2.705 1.00 21.34 H new ATOM 0 HH21 ARG A 97 -15.134 -2.144 -5.611 1.00 62.15 H new ATOM 0 HH22 ARG A 97 -15.265 -1.176 -4.139 1.00 62.15 H new ATOM 1513 N GLU A 98 -9.316 -7.373 -7.576 1.00 2.43 N ATOM 1514 CA GLU A 98 -9.919 -8.661 -7.903 1.00 64.03 C ATOM 1515 C GLU A 98 -9.306 -9.778 -7.065 1.00 23.13 C ATOM 1516 O GLU A 98 -9.968 -10.766 -6.749 1.00 61.53 O ATOM 1517 CB GLU A 98 -9.742 -8.967 -9.391 1.00 11.11 C ATOM 1518 CG GLU A 98 -10.434 -7.967 -10.305 1.00 72.41 C ATOM 1519 CD GLU A 98 -11.494 -8.610 -11.178 1.00 21.11 C ATOM 1520 OE1 GLU A 98 -11.129 -9.426 -12.050 1.00 44.12 O ATOM 1521 OE2 GLU A 98 -12.688 -8.296 -10.991 1.00 73.53 O ATOM 0 H GLU A 98 -8.885 -6.896 -8.368 1.00 2.43 H new ATOM 0 HA GLU A 98 -10.983 -8.604 -7.675 1.00 64.03 H new ATOM 0 HB2 GLU A 98 -8.678 -8.985 -9.626 1.00 11.11 H new ATOM 0 HB3 GLU A 98 -10.131 -9.964 -9.597 1.00 11.11 H new ATOM 0 HG2 GLU A 98 -10.893 -7.185 -9.700 1.00 72.41 H new ATOM 0 HG3 GLU A 98 -9.690 -7.485 -10.939 1.00 72.41 H new ATOM 1528 N GLN A 99 -8.037 -9.612 -6.705 1.00 4.14 N ATOM 1529 CA GLN A 99 -7.335 -10.606 -5.902 1.00 14.20 C ATOM 1530 C GLN A 99 -7.767 -10.525 -4.441 1.00 15.21 C ATOM 1531 O GLN A 99 -7.886 -11.545 -3.761 1.00 43.40 O ATOM 1532 CB GLN A 99 -5.822 -10.404 -6.011 1.00 73.20 C ATOM 1533 CG GLN A 99 -5.203 -11.093 -7.216 1.00 24.13 C ATOM 1534 CD GLN A 99 -4.642 -12.462 -6.881 1.00 52.11 C ATOM 1535 OE1 GLN A 99 -5.096 -13.477 -7.408 1.00 62.31 O ATOM 1536 NE2 GLN A 99 -3.650 -12.495 -5.999 1.00 70.32 N ATOM 0 H GLN A 99 -7.475 -8.799 -6.957 1.00 4.14 H new ATOM 0 HA GLN A 99 -7.590 -11.594 -6.285 1.00 14.20 H new ATOM 0 HB2 GLN A 99 -5.609 -9.336 -6.064 1.00 73.20 H new ATOM 0 HB3 GLN A 99 -5.347 -10.779 -5.104 1.00 73.20 H new ATOM 0 HG2 GLN A 99 -5.955 -11.194 -7.998 1.00 24.13 H new ATOM 0 HG3 GLN A 99 -4.407 -10.467 -7.619 1.00 24.13 H new ATOM 0 HE21 GLN A 99 -3.305 -11.628 -5.587 1.00 70.32 H new ATOM 0 HE22 GLN A 99 -3.233 -13.387 -5.734 1.00 70.32 H new ATOM 1545 N ILE A 100 -8.002 -9.307 -3.966 1.00 73.20 N ATOM 1546 CA ILE A 100 -8.423 -9.091 -2.587 1.00 20.14 C ATOM 1547 C ILE A 100 -9.847 -9.591 -2.366 1.00 40.34 C ATOM 1548 O ILE A 100 -10.127 -10.286 -1.389 1.00 25.32 O ATOM 1549 CB ILE A 100 -8.345 -7.600 -2.203 1.00 72.24 C ATOM 1550 CG1 ILE A 100 -6.945 -7.052 -2.485 1.00 5.50 C ATOM 1551 CG2 ILE A 100 -8.709 -7.406 -0.737 1.00 52.30 C ATOM 1552 CD1 ILE A 100 -6.878 -5.540 -2.487 1.00 4.12 C ATOM 0 H ILE A 100 -7.908 -8.453 -4.516 1.00 73.20 H new ATOM 0 HA ILE A 100 -7.740 -9.656 -1.953 1.00 20.14 H new ATOM 0 HB ILE A 100 -9.063 -7.048 -2.810 1.00 72.24 H new ATOM 0 HG12 ILE A 100 -6.255 -7.437 -1.735 1.00 5.50 H new ATOM 0 HG13 ILE A 100 -6.606 -7.424 -3.452 1.00 5.50 H new ATOM 0 HG21 ILE A 100 -8.648 -6.347 -0.484 1.00 52.30 H new ATOM 0 HG22 ILE A 100 -9.724 -7.763 -0.564 1.00 52.30 H new ATOM 0 HG23 ILE A 100 -8.015 -7.969 -0.112 1.00 52.30 H new ATOM 0 HD11 ILE A 100 -5.856 -5.221 -2.693 1.00 4.12 H new ATOM 0 HD12 ILE A 100 -7.543 -5.147 -3.256 1.00 4.12 H new ATOM 0 HD13 ILE A 100 -7.186 -5.161 -1.513 1.00 4.12 H new ATOM 1564 N LYS A 101 -10.743 -9.232 -3.279 1.00 62.32 N ATOM 1565 CA LYS A 101 -12.139 -9.645 -3.185 1.00 13.42 C ATOM 1566 C LYS A 101 -12.256 -11.165 -3.129 1.00 60.53 C ATOM 1567 O LYS A 101 -13.136 -11.705 -2.459 1.00 14.11 O ATOM 1568 CB LYS A 101 -12.934 -9.101 -4.373 1.00 10.40 C ATOM 1569 CG LYS A 101 -12.986 -7.583 -4.426 1.00 73.41 C ATOM 1570 CD LYS A 101 -13.241 -7.083 -5.838 1.00 1.22 C ATOM 1571 CE LYS A 101 -14.603 -7.525 -6.346 1.00 50.34 C ATOM 1572 NZ LYS A 101 -15.222 -6.505 -7.236 1.00 44.13 N ATOM 0 H LYS A 101 -10.528 -8.656 -4.093 1.00 62.32 H new ATOM 0 HA LYS A 101 -12.552 -9.235 -2.263 1.00 13.42 H new ATOM 0 HB2 LYS A 101 -12.491 -9.474 -5.297 1.00 10.40 H new ATOM 0 HB3 LYS A 101 -13.951 -9.490 -4.327 1.00 10.40 H new ATOM 0 HG2 LYS A 101 -13.772 -7.222 -3.763 1.00 73.41 H new ATOM 0 HG3 LYS A 101 -12.046 -7.173 -4.058 1.00 73.41 H new ATOM 0 HD2 LYS A 101 -13.180 -5.995 -5.857 1.00 1.22 H new ATOM 0 HD3 LYS A 101 -12.464 -7.458 -6.504 1.00 1.22 H new ATOM 0 HE2 LYS A 101 -14.501 -8.465 -6.888 1.00 50.34 H new ATOM 0 HE3 LYS A 101 -15.262 -7.715 -5.499 1.00 50.34 H new ATOM 0 HZ1 LYS A 101 -16.143 -6.217 -6.847 1.00 44.13 H new ATOM 0 HZ2 LYS A 101 -14.598 -5.675 -7.299 1.00 44.13 H new ATOM 0 HZ3 LYS A 101 -15.358 -6.909 -8.185 1.00 44.13 H new ATOM 1586 N ARG A 102 -11.362 -11.849 -3.837 1.00 44.24 N ATOM 1587 CA ARG A 102 -11.364 -13.305 -3.867 1.00 22.15 C ATOM 1588 C ARG A 102 -11.065 -13.880 -2.486 1.00 55.33 C ATOM 1589 O ARG A 102 -11.868 -14.625 -1.926 1.00 71.41 O ATOM 1590 CB ARG A 102 -10.336 -13.811 -4.880 1.00 43.41 C ATOM 1591 CG ARG A 102 -10.895 -14.843 -5.841 1.00 62.25 C ATOM 1592 CD ARG A 102 -10.078 -14.915 -7.121 1.00 51.32 C ATOM 1593 NE ARG A 102 -10.099 -16.252 -7.709 1.00 4.22 N ATOM 1594 CZ ARG A 102 -11.152 -16.768 -8.339 1.00 44.31 C ATOM 1595 NH1 ARG A 102 -12.270 -16.064 -8.464 1.00 71.32 N ATOM 1596 NH2 ARG A 102 -11.087 -17.992 -8.845 1.00 44.52 N ATOM 0 H ARG A 102 -10.627 -11.417 -4.397 1.00 44.24 H new ATOM 0 HA ARG A 102 -12.357 -13.639 -4.168 1.00 22.15 H new ATOM 0 HB2 ARG A 102 -9.952 -12.965 -5.450 1.00 43.41 H new ATOM 0 HB3 ARG A 102 -9.491 -14.244 -4.344 1.00 43.41 H new ATOM 0 HG2 ARG A 102 -10.906 -15.821 -5.360 1.00 62.25 H new ATOM 0 HG3 ARG A 102 -11.929 -14.595 -6.082 1.00 62.25 H new ATOM 0 HD2 ARG A 102 -10.468 -14.196 -7.841 1.00 51.32 H new ATOM 0 HD3 ARG A 102 -9.048 -14.628 -6.910 1.00 51.32 H new ATOM 0 HE ARG A 102 -9.258 -16.824 -7.632 1.00 4.22 H new ATOM 0 HH11 ARG A 102 -12.326 -15.122 -8.076 1.00 71.32 H new ATOM 0 HH12 ARG A 102 -13.074 -16.465 -8.948 1.00 71.32 H new ATOM 0 HH21 ARG A 102 -10.230 -18.538 -8.751 1.00 44.52 H new ATOM 0 HH22 ARG A 102 -11.894 -18.388 -9.328 1.00 44.52 H new ATOM 1610 N VAL A 103 -9.904 -13.528 -1.943 1.00 1.02 N ATOM 1611 CA VAL A 103 -9.500 -14.007 -0.630 1.00 74.11 C ATOM 1612 C VAL A 103 -10.470 -13.531 0.447 1.00 22.33 C ATOM 1613 O VAL A 103 -10.981 -14.328 1.234 1.00 32.14 O ATOM 1614 CB VAL A 103 -8.078 -13.532 -0.277 1.00 30.30 C ATOM 1615 CG1 VAL A 103 -7.629 -14.118 1.052 1.00 74.42 C ATOM 1616 CG2 VAL A 103 -7.103 -13.898 -1.386 1.00 44.31 C ATOM 0 H VAL A 103 -9.227 -12.912 -2.394 1.00 1.02 H new ATOM 0 HA VAL A 103 -9.511 -15.096 -0.667 1.00 74.11 H new ATOM 0 HB VAL A 103 -8.093 -12.446 -0.179 1.00 30.30 H new ATOM 0 HG11 VAL A 103 -6.622 -13.769 1.282 1.00 74.42 H new ATOM 0 HG12 VAL A 103 -8.312 -13.799 1.839 1.00 74.42 H new ATOM 0 HG13 VAL A 103 -7.631 -15.206 0.989 1.00 74.42 H new ATOM 0 HG21 VAL A 103 -6.103 -13.555 -1.120 1.00 44.31 H new ATOM 0 HG22 VAL A 103 -7.092 -14.980 -1.518 1.00 44.31 H new ATOM 0 HG23 VAL A 103 -7.414 -13.422 -2.316 1.00 44.31 H new ATOM 1626 N LYS A 104 -10.718 -12.226 0.475 1.00 60.13 N ATOM 1627 CA LYS A 104 -11.627 -11.641 1.454 1.00 22.11 C ATOM 1628 C LYS A 104 -13.053 -12.139 1.238 1.00 52.11 C ATOM 1629 O LYS A 104 -13.854 -12.182 2.172 1.00 24.34 O ATOM 1630 CB LYS A 104 -11.589 -10.114 1.368 1.00 62.44 C ATOM 1631 CG LYS A 104 -10.191 -9.530 1.491 1.00 45.24 C ATOM 1632 CD LYS A 104 -9.606 -9.769 2.874 1.00 1.23 C ATOM 1633 CE LYS A 104 -9.886 -8.603 3.810 1.00 14.34 C ATOM 1634 NZ LYS A 104 -10.708 -9.016 4.981 1.00 72.31 N ATOM 0 H LYS A 104 -10.302 -11.553 -0.169 1.00 60.13 H new ATOM 0 HA LYS A 104 -11.300 -11.950 2.447 1.00 22.11 H new ATOM 0 HB2 LYS A 104 -12.021 -9.802 0.417 1.00 62.44 H new ATOM 0 HB3 LYS A 104 -12.217 -9.699 2.156 1.00 62.44 H new ATOM 0 HG2 LYS A 104 -9.542 -9.977 0.738 1.00 45.24 H new ATOM 0 HG3 LYS A 104 -10.224 -8.459 1.289 1.00 45.24 H new ATOM 0 HD2 LYS A 104 -10.026 -10.683 3.294 1.00 1.23 H new ATOM 0 HD3 LYS A 104 -8.530 -9.921 2.793 1.00 1.23 H new ATOM 0 HE2 LYS A 104 -8.943 -8.183 4.159 1.00 14.34 H new ATOM 0 HE3 LYS A 104 -10.403 -7.815 3.263 1.00 14.34 H new ATOM 0 HZ1 LYS A 104 -10.877 -8.193 5.594 1.00 72.31 H new ATOM 0 HZ2 LYS A 104 -11.619 -9.394 4.650 1.00 72.31 H new ATOM 0 HZ3 LYS A 104 -10.203 -9.750 5.518 1.00 72.31 H new ATOM 1648 N ASP A 105 -13.364 -12.515 0.000 1.00 3.13 N ATOM 1649 CA ASP A 105 -14.694 -13.011 -0.337 1.00 44.35 C ATOM 1650 C ASP A 105 -15.747 -11.924 -0.141 1.00 53.44 C ATOM 1651 O ASP A 105 -16.829 -12.180 0.387 1.00 21.35 O ATOM 1652 CB ASP A 105 -15.038 -14.234 0.516 1.00 51.12 C ATOM 1653 CG ASP A 105 -16.083 -15.121 -0.135 1.00 21.43 C ATOM 1654 OD1 ASP A 105 -16.706 -14.678 -1.123 1.00 64.51 O ATOM 1655 OD2 ASP A 105 -16.279 -16.257 0.345 1.00 60.21 O ATOM 0 H ASP A 105 -12.713 -12.485 -0.785 1.00 3.13 H new ATOM 0 HA ASP A 105 -14.690 -13.301 -1.388 1.00 44.35 H new ATOM 0 HB2 ASP A 105 -14.133 -14.815 0.694 1.00 51.12 H new ATOM 0 HB3 ASP A 105 -15.402 -13.904 1.489 1.00 51.12 H new ATOM 1660 N SER A 106 -15.421 -10.709 -0.570 1.00 63.14 N ATOM 1661 CA SER A 106 -16.337 -9.582 -0.443 1.00 0.44 C ATOM 1662 C SER A 106 -15.893 -8.419 -1.324 1.00 51.01 C ATOM 1663 O SER A 106 -14.713 -8.290 -1.650 1.00 74.50 O ATOM 1664 CB SER A 106 -16.421 -9.128 1.016 1.00 74.34 C ATOM 1665 OG SER A 106 -17.561 -8.316 1.233 1.00 24.24 O ATOM 0 H SER A 106 -14.529 -10.480 -1.009 1.00 63.14 H new ATOM 0 HA SER A 106 -17.323 -9.909 -0.772 1.00 0.44 H new ATOM 0 HB2 SER A 106 -16.462 -9.999 1.669 1.00 74.34 H new ATOM 0 HB3 SER A 106 -15.520 -8.574 1.280 1.00 74.34 H new ATOM 0 HG SER A 106 -17.592 -8.041 2.173 1.00 24.24 H new ATOM 1671 N ASP A 107 -16.846 -7.576 -1.708 1.00 74.32 N ATOM 1672 CA ASP A 107 -16.552 -6.424 -2.552 1.00 52.40 C ATOM 1673 C ASP A 107 -16.113 -5.231 -1.710 1.00 73.11 C ATOM 1674 O ASP A 107 -15.186 -4.508 -2.076 1.00 20.30 O ATOM 1675 CB ASP A 107 -17.779 -6.051 -3.386 1.00 71.43 C ATOM 1676 CG ASP A 107 -17.940 -6.938 -4.606 1.00 62.22 C ATOM 1677 OD1 ASP A 107 -17.929 -8.176 -4.445 1.00 22.34 O ATOM 1678 OD2 ASP A 107 -18.078 -6.393 -5.721 1.00 65.15 O ATOM 0 H ASP A 107 -17.828 -7.669 -1.448 1.00 74.32 H new ATOM 0 HA ASP A 107 -15.735 -6.694 -3.221 1.00 52.40 H new ATOM 0 HB2 ASP A 107 -18.672 -6.125 -2.766 1.00 71.43 H new ATOM 0 HB3 ASP A 107 -17.697 -5.012 -3.704 1.00 71.43 H new ATOM 1683 N ASP A 108 -16.784 -5.031 -0.581 1.00 62.54 N ATOM 1684 CA ASP A 108 -16.464 -3.924 0.313 1.00 23.35 C ATOM 1685 C ASP A 108 -15.436 -4.348 1.358 1.00 24.21 C ATOM 1686 O ASP A 108 -15.794 -4.795 2.448 1.00 71.25 O ATOM 1687 CB ASP A 108 -17.730 -3.416 1.006 1.00 61.21 C ATOM 1688 CG ASP A 108 -18.885 -3.232 0.040 1.00 74.34 C ATOM 1689 OD1 ASP A 108 -18.924 -2.190 -0.647 1.00 62.23 O ATOM 1690 OD2 ASP A 108 -19.750 -4.130 -0.028 1.00 74.13 O ATOM 0 H ASP A 108 -17.553 -5.621 -0.263 1.00 62.54 H new ATOM 0 HA ASP A 108 -16.038 -3.119 -0.286 1.00 23.35 H new ATOM 0 HB2 ASP A 108 -18.021 -4.120 1.786 1.00 61.21 H new ATOM 0 HB3 ASP A 108 -17.516 -2.467 1.497 1.00 61.21 H new ATOM 1695 N VAL A 109 -14.159 -4.205 1.018 1.00 60.13 N ATOM 1696 CA VAL A 109 -13.082 -4.573 1.928 1.00 41.34 C ATOM 1697 C VAL A 109 -12.264 -3.349 2.338 1.00 21.31 C ATOM 1698 O VAL A 109 -12.196 -2.364 1.603 1.00 53.23 O ATOM 1699 CB VAL A 109 -12.143 -5.621 1.296 1.00 14.54 C ATOM 1700 CG1 VAL A 109 -12.917 -6.877 0.926 1.00 63.12 C ATOM 1701 CG2 VAL A 109 -11.436 -5.044 0.078 1.00 21.03 C ATOM 0 H VAL A 109 -13.846 -3.837 0.120 1.00 60.13 H new ATOM 0 HA VAL A 109 -13.550 -5.005 2.813 1.00 41.34 H new ATOM 0 HB VAL A 109 -11.385 -5.891 2.031 1.00 14.54 H new ATOM 0 HG11 VAL A 109 -12.238 -7.605 0.482 1.00 63.12 H new ATOM 0 HG12 VAL A 109 -13.370 -7.302 1.822 1.00 63.12 H new ATOM 0 HG13 VAL A 109 -13.699 -6.625 0.209 1.00 63.12 H new ATOM 0 HG21 VAL A 109 -10.779 -5.799 -0.353 1.00 21.03 H new ATOM 0 HG22 VAL A 109 -12.176 -4.742 -0.663 1.00 21.03 H new ATOM 0 HG23 VAL A 109 -10.846 -4.177 0.376 1.00 21.03 H new ATOM 1711 N PRO A 110 -11.630 -3.397 3.522 1.00 71.43 N ATOM 1712 CA PRO A 110 -10.815 -2.288 4.027 1.00 62.44 C ATOM 1713 C PRO A 110 -9.516 -2.124 3.247 1.00 70.54 C ATOM 1714 O PRO A 110 -8.573 -2.896 3.422 1.00 52.14 O ATOM 1715 CB PRO A 110 -10.522 -2.689 5.473 1.00 43.12 C ATOM 1716 CG PRO A 110 -10.622 -4.175 5.486 1.00 4.33 C ATOM 1717 CD PRO A 110 -11.660 -4.536 4.460 1.00 45.21 C ATOM 0 HA PRO A 110 -11.328 -1.331 3.933 1.00 62.44 H new ATOM 0 HB2 PRO A 110 -9.531 -2.357 5.782 1.00 43.12 H new ATOM 0 HB3 PRO A 110 -11.238 -2.239 6.161 1.00 43.12 H new ATOM 0 HG2 PRO A 110 -9.662 -4.632 5.245 1.00 4.33 H new ATOM 0 HG3 PRO A 110 -10.909 -4.537 6.473 1.00 4.33 H new ATOM 0 HD2 PRO A 110 -11.420 -5.474 3.960 1.00 45.21 H new ATOM 0 HD3 PRO A 110 -12.645 -4.658 4.911 1.00 45.21 H new ATOM 1725 N MET A 111 -9.472 -1.113 2.386 1.00 4.41 N ATOM 1726 CA MET A 111 -8.287 -0.846 1.579 1.00 31.45 C ATOM 1727 C MET A 111 -8.205 0.630 1.205 1.00 41.30 C ATOM 1728 O MET A 111 -9.156 1.385 1.407 1.00 12.50 O ATOM 1729 CB MET A 111 -8.301 -1.706 0.314 1.00 21.04 C ATOM 1730 CG MET A 111 -9.477 -1.417 -0.604 1.00 20.03 C ATOM 1731 SD MET A 111 -9.175 -1.938 -2.302 1.00 71.50 S ATOM 1732 CE MET A 111 -9.498 -3.694 -2.175 1.00 61.31 C ATOM 0 H MET A 111 -10.244 -0.465 2.229 1.00 4.41 H new ATOM 0 HA MET A 111 -7.409 -1.101 2.172 1.00 31.45 H new ATOM 0 HB2 MET A 111 -7.374 -1.545 -0.235 1.00 21.04 H new ATOM 0 HB3 MET A 111 -8.323 -2.758 0.600 1.00 21.04 H new ATOM 0 HG2 MET A 111 -10.363 -1.925 -0.224 1.00 20.03 H new ATOM 0 HG3 MET A 111 -9.691 -0.348 -0.588 1.00 20.03 H new ATOM 0 HE1 MET A 111 -9.185 -4.189 -3.094 1.00 61.31 H new ATOM 0 HE2 MET A 111 -8.942 -4.106 -1.333 1.00 61.31 H new ATOM 0 HE3 MET A 111 -10.565 -3.858 -2.020 1.00 61.31 H new ATOM 1742 N VAL A 112 -7.062 1.035 0.663 1.00 63.12 N ATOM 1743 CA VAL A 112 -6.855 2.420 0.265 1.00 1.13 C ATOM 1744 C VAL A 112 -6.007 2.510 -1.000 1.00 10.43 C ATOM 1745 O VAL A 112 -5.145 1.665 -1.243 1.00 42.02 O ATOM 1746 CB VAL A 112 -6.173 3.224 1.387 1.00 34.11 C ATOM 1747 CG1 VAL A 112 -6.063 4.691 1.005 1.00 11.23 C ATOM 1748 CG2 VAL A 112 -6.934 3.058 2.694 1.00 20.12 C ATOM 0 H VAL A 112 -6.265 0.423 0.490 1.00 63.12 H new ATOM 0 HA VAL A 112 -7.839 2.845 0.066 1.00 1.13 H new ATOM 0 HB VAL A 112 -5.164 2.837 1.527 1.00 34.11 H new ATOM 0 HG11 VAL A 112 -5.578 5.242 1.811 1.00 11.23 H new ATOM 0 HG12 VAL A 112 -5.472 4.786 0.094 1.00 11.23 H new ATOM 0 HG13 VAL A 112 -7.060 5.099 0.835 1.00 11.23 H new ATOM 0 HG21 VAL A 112 -6.440 3.632 3.478 1.00 20.12 H new ATOM 0 HG22 VAL A 112 -7.955 3.418 2.569 1.00 20.12 H new ATOM 0 HG23 VAL A 112 -6.953 2.004 2.973 1.00 20.12 H new ATOM 1758 N LEU A 113 -6.256 3.541 -1.800 1.00 22.44 N ATOM 1759 CA LEU A 113 -5.516 3.746 -3.039 1.00 43.35 C ATOM 1760 C LEU A 113 -4.633 4.986 -2.944 1.00 14.22 C ATOM 1761 O LEU A 113 -5.130 6.112 -2.906 1.00 12.32 O ATOM 1762 CB LEU A 113 -6.483 3.880 -4.220 1.00 33.22 C ATOM 1763 CG LEU A 113 -5.834 4.210 -5.570 1.00 12.24 C ATOM 1764 CD1 LEU A 113 -4.508 3.480 -5.727 1.00 45.51 C ATOM 1765 CD2 LEU A 113 -6.775 3.853 -6.709 1.00 41.23 C ATOM 0 H LEU A 113 -6.966 4.249 -1.612 1.00 22.44 H new ATOM 0 HA LEU A 113 -4.877 2.878 -3.201 1.00 43.35 H new ATOM 0 HB2 LEU A 113 -7.037 2.947 -4.321 1.00 33.22 H new ATOM 0 HB3 LEU A 113 -7.209 4.658 -3.986 1.00 33.22 H new ATOM 0 HG LEU A 113 -5.637 5.282 -5.602 1.00 12.24 H new ATOM 0 HD11 LEU A 113 -4.067 3.730 -6.692 1.00 45.51 H new ATOM 0 HD12 LEU A 113 -3.830 3.782 -4.929 1.00 45.51 H new ATOM 0 HD13 LEU A 113 -4.676 2.404 -5.673 1.00 45.51 H new ATOM 0 HD21 LEU A 113 -6.301 4.093 -7.661 1.00 41.23 H new ATOM 0 HD22 LEU A 113 -7.001 2.787 -6.674 1.00 41.23 H new ATOM 0 HD23 LEU A 113 -7.699 4.423 -6.610 1.00 41.23 H new ATOM 1777 N VAL A 114 -3.323 4.772 -2.902 1.00 23.21 N ATOM 1778 CA VAL A 114 -2.372 5.873 -2.809 1.00 72.42 C ATOM 1779 C VAL A 114 -1.788 6.215 -4.175 1.00 23.13 C ATOM 1780 O VAL A 114 -1.738 5.370 -5.069 1.00 33.11 O ATOM 1781 CB VAL A 114 -1.220 5.540 -1.841 1.00 31.03 C ATOM 1782 CG1 VAL A 114 -0.374 6.775 -1.574 1.00 0.13 C ATOM 1783 CG2 VAL A 114 -1.762 4.964 -0.542 1.00 25.25 C ATOM 0 H VAL A 114 -2.895 3.846 -2.931 1.00 23.21 H new ATOM 0 HA VAL A 114 -2.922 6.733 -2.427 1.00 72.42 H new ATOM 0 HB VAL A 114 -0.585 4.787 -2.307 1.00 31.03 H new ATOM 0 HG11 VAL A 114 0.434 6.521 -0.889 1.00 0.13 H new ATOM 0 HG12 VAL A 114 0.046 7.138 -2.512 1.00 0.13 H new ATOM 0 HG13 VAL A 114 -0.995 7.553 -1.130 1.00 0.13 H new ATOM 0 HG21 VAL A 114 -0.933 4.735 0.128 1.00 25.25 H new ATOM 0 HG22 VAL A 114 -2.422 5.691 -0.069 1.00 25.25 H new ATOM 0 HG23 VAL A 114 -2.320 4.052 -0.753 1.00 25.25 H new ATOM 1793 N GLY A 115 -1.347 7.459 -4.328 1.00 24.12 N ATOM 1794 CA GLY A 115 -0.771 7.894 -5.587 1.00 42.24 C ATOM 1795 C GLY A 115 0.670 8.342 -5.439 1.00 60.45 C ATOM 1796 O GLY A 115 0.950 9.538 -5.363 1.00 35.34 O ATOM 0 H GLY A 115 -1.378 8.175 -3.602 1.00 24.12 H new ATOM 0 HA2 GLY A 115 -0.823 7.078 -6.308 1.00 42.24 H new ATOM 0 HA3 GLY A 115 -1.364 8.715 -5.991 1.00 42.24 H new ATOM 1800 N ASN A 116 1.585 7.380 -5.396 1.00 34.31 N ATOM 1801 CA ASN A 116 3.005 7.680 -5.254 1.00 4.41 C ATOM 1802 C ASN A 116 3.498 8.558 -6.400 1.00 20.22 C ATOM 1803 O ASN A 116 2.809 8.728 -7.406 1.00 21.31 O ATOM 1804 CB ASN A 116 3.818 6.386 -5.202 1.00 75.52 C ATOM 1805 CG ASN A 116 5.131 6.557 -4.464 1.00 12.32 C ATOM 1806 OD1 ASN A 116 5.607 7.676 -4.272 1.00 41.30 O ATOM 1807 ND2 ASN A 116 5.723 5.445 -4.045 1.00 62.02 N ATOM 0 H ASN A 116 1.369 6.385 -5.457 1.00 34.31 H new ATOM 0 HA ASN A 116 3.141 8.226 -4.321 1.00 4.41 H new ATOM 0 HB2 ASN A 116 3.229 5.609 -4.714 1.00 75.52 H new ATOM 0 HB3 ASN A 116 4.017 6.044 -6.218 1.00 75.52 H new ATOM 0 HD21 ASN A 116 6.609 5.497 -3.542 1.00 62.02 H new ATOM 0 HD22 ASN A 116 5.292 4.538 -4.226 1.00 62.02 H new ATOM 1814 N LYS A 117 4.696 9.112 -6.240 1.00 31.34 N ATOM 1815 CA LYS A 117 5.284 9.972 -7.261 1.00 15.22 C ATOM 1816 C LYS A 117 4.414 11.202 -7.506 1.00 53.00 C ATOM 1817 O LYS A 117 3.886 11.395 -8.601 1.00 53.43 O ATOM 1818 CB LYS A 117 5.475 9.194 -8.565 1.00 31.22 C ATOM 1819 CG LYS A 117 6.867 8.603 -8.723 1.00 12.43 C ATOM 1820 CD LYS A 117 6.912 7.154 -8.265 1.00 22.40 C ATOM 1821 CE LYS A 117 7.749 6.299 -9.204 1.00 11.02 C ATOM 1822 NZ LYS A 117 7.614 4.848 -8.901 1.00 74.43 N ATOM 0 H LYS A 117 5.278 8.981 -5.413 1.00 31.34 H new ATOM 0 HA LYS A 117 6.257 10.307 -6.902 1.00 15.22 H new ATOM 0 HB2 LYS A 117 4.741 8.390 -8.609 1.00 31.22 H new ATOM 0 HB3 LYS A 117 5.273 9.857 -9.407 1.00 31.22 H new ATOM 0 HG2 LYS A 117 7.174 8.665 -9.767 1.00 12.43 H new ATOM 0 HG3 LYS A 117 7.581 9.191 -8.146 1.00 12.43 H new ATOM 0 HD2 LYS A 117 7.326 7.102 -7.258 1.00 22.40 H new ATOM 0 HD3 LYS A 117 5.899 6.756 -8.214 1.00 22.40 H new ATOM 0 HE2 LYS A 117 7.444 6.485 -10.234 1.00 11.02 H new ATOM 0 HE3 LYS A 117 8.796 6.591 -9.124 1.00 11.02 H new ATOM 0 HZ1 LYS A 117 7.637 4.305 -9.787 1.00 74.43 H new ATOM 0 HZ2 LYS A 117 8.399 4.546 -8.290 1.00 74.43 H new ATOM 0 HZ3 LYS A 117 6.711 4.678 -8.414 1.00 74.43 H new ATOM 1836 N CYS A 118 4.269 12.032 -6.479 1.00 44.13 N ATOM 1837 CA CYS A 118 3.463 13.243 -6.584 1.00 63.40 C ATOM 1838 C CYS A 118 4.341 14.492 -6.673 1.00 0.54 C ATOM 1839 O CYS A 118 3.836 15.615 -6.663 1.00 41.22 O ATOM 1840 CB CYS A 118 2.519 13.357 -5.386 1.00 24.02 C ATOM 1841 SG CYS A 118 1.029 14.329 -5.710 1.00 30.12 S ATOM 0 H CYS A 118 4.699 11.889 -5.565 1.00 44.13 H new ATOM 0 HA CYS A 118 2.877 13.173 -7.500 1.00 63.40 H new ATOM 0 HB2 CYS A 118 2.225 12.355 -5.072 1.00 24.02 H new ATOM 0 HB3 CYS A 118 3.059 13.807 -4.553 1.00 24.02 H new ATOM 0 HG CYS A 118 1.356 15.440 -6.301 1.00 30.12 H new ATOM 1847 N ASP A 119 5.654 14.293 -6.761 1.00 23.52 N ATOM 1848 CA ASP A 119 6.590 15.409 -6.853 1.00 75.52 C ATOM 1849 C ASP A 119 7.204 15.491 -8.247 1.00 5.32 C ATOM 1850 O ASP A 119 7.556 16.573 -8.719 1.00 51.41 O ATOM 1851 CB ASP A 119 7.695 15.265 -5.804 1.00 70.21 C ATOM 1852 CG ASP A 119 8.546 14.030 -6.024 1.00 34.11 C ATOM 1853 OD1 ASP A 119 8.026 12.910 -5.838 1.00 45.44 O ATOM 1854 OD2 ASP A 119 9.733 14.183 -6.382 1.00 45.50 O ATOM 0 H ASP A 119 6.092 13.372 -6.770 1.00 23.52 H new ATOM 0 HA ASP A 119 6.038 16.329 -6.664 1.00 75.52 H new ATOM 0 HB2 ASP A 119 8.331 16.150 -5.827 1.00 70.21 H new ATOM 0 HB3 ASP A 119 7.246 15.221 -4.812 1.00 70.21 H new ATOM 1859 N LEU A 120 7.330 14.340 -8.902 1.00 51.20 N ATOM 1860 CA LEU A 120 7.901 14.278 -10.243 1.00 20.23 C ATOM 1861 C LEU A 120 7.152 15.200 -11.201 1.00 42.52 C ATOM 1862 O LEU A 120 5.957 15.444 -11.036 1.00 54.44 O ATOM 1863 CB LEU A 120 7.865 12.842 -10.766 1.00 22.10 C ATOM 1864 CG LEU A 120 8.912 11.907 -10.158 1.00 55.32 C ATOM 1865 CD1 LEU A 120 8.846 10.536 -10.811 1.00 23.13 C ATOM 1866 CD2 LEU A 120 10.304 12.503 -10.302 1.00 23.33 C ATOM 0 H LEU A 120 7.044 13.437 -8.525 1.00 51.20 H new ATOM 0 HA LEU A 120 8.937 14.613 -10.185 1.00 20.23 H new ATOM 0 HB2 LEU A 120 6.875 12.427 -10.577 1.00 22.10 H new ATOM 0 HB3 LEU A 120 8.001 12.861 -11.847 1.00 22.10 H new ATOM 0 HG LEU A 120 8.696 11.791 -9.096 1.00 55.32 H new ATOM 0 HD11 LEU A 120 9.598 9.884 -10.366 1.00 23.13 H new ATOM 0 HD12 LEU A 120 7.856 10.107 -10.656 1.00 23.13 H new ATOM 0 HD13 LEU A 120 9.037 10.633 -11.880 1.00 23.13 H new ATOM 0 HD21 LEU A 120 11.037 11.825 -9.864 1.00 23.33 H new ATOM 0 HD22 LEU A 120 10.530 12.649 -11.358 1.00 23.33 H new ATOM 0 HD23 LEU A 120 10.344 13.463 -9.787 1.00 23.33 H new ATOM 1878 N ALA A 121 7.864 15.710 -12.201 1.00 1.53 N ATOM 1879 CA ALA A 121 7.266 16.606 -13.184 1.00 34.13 C ATOM 1880 C ALA A 121 6.960 15.871 -14.484 1.00 40.00 C ATOM 1881 O ALA A 121 7.088 16.433 -15.571 1.00 22.12 O ATOM 1882 CB ALA A 121 8.187 17.787 -13.448 1.00 60.24 C ATOM 0 H ALA A 121 8.854 15.518 -12.352 1.00 1.53 H new ATOM 0 HA ALA A 121 6.325 16.976 -12.777 1.00 34.13 H new ATOM 0 HB1 ALA A 121 7.729 18.448 -14.184 1.00 60.24 H new ATOM 0 HB2 ALA A 121 8.351 18.335 -12.520 1.00 60.24 H new ATOM 0 HB3 ALA A 121 9.142 17.426 -13.830 1.00 60.24 H new ATOM 1888 N ALA A 122 6.555 14.611 -14.365 1.00 62.33 N ATOM 1889 CA ALA A 122 6.230 13.799 -15.530 1.00 23.15 C ATOM 1890 C ALA A 122 5.047 12.879 -15.247 1.00 33.11 C ATOM 1891 O ALA A 122 5.124 11.668 -15.456 1.00 3.44 O ATOM 1892 CB ALA A 122 7.444 12.989 -15.959 1.00 53.25 C ATOM 0 H ALA A 122 6.444 14.130 -13.472 1.00 62.33 H new ATOM 0 HA ALA A 122 5.946 14.467 -16.343 1.00 23.15 H new ATOM 0 HB1 ALA A 122 7.190 12.386 -16.831 1.00 53.25 H new ATOM 0 HB2 ALA A 122 8.261 13.664 -16.211 1.00 53.25 H new ATOM 0 HB3 ALA A 122 7.752 12.335 -15.143 1.00 53.25 H new ATOM 1898 N ARG A 123 3.952 13.461 -14.768 1.00 21.55 N ATOM 1899 CA ARG A 123 2.754 12.692 -14.455 1.00 61.14 C ATOM 1900 C ARG A 123 2.020 12.284 -15.729 1.00 22.03 C ATOM 1901 O ARG A 123 1.902 13.071 -16.669 1.00 1.30 O ATOM 1902 CB ARG A 123 1.822 13.503 -13.550 1.00 63.44 C ATOM 1903 CG ARG A 123 1.166 14.684 -14.248 1.00 74.04 C ATOM 1904 CD ARG A 123 0.129 15.352 -13.360 1.00 44.44 C ATOM 1905 NE ARG A 123 0.673 15.702 -12.050 1.00 55.04 N ATOM 1906 CZ ARG A 123 1.537 16.694 -11.847 1.00 44.04 C ATOM 1907 NH1 ARG A 123 1.956 17.437 -12.864 1.00 45.11 N ATOM 1908 NH2 ARG A 123 1.982 16.945 -10.623 1.00 73.34 N ATOM 0 H ARG A 123 3.870 14.462 -14.588 1.00 21.55 H new ATOM 0 HA ARG A 123 3.061 11.788 -13.930 1.00 61.14 H new ATOM 0 HB2 ARG A 123 1.045 12.845 -13.161 1.00 63.44 H new ATOM 0 HB3 ARG A 123 2.389 13.868 -12.693 1.00 63.44 H new ATOM 0 HG2 ARG A 123 1.928 15.411 -14.529 1.00 74.04 H new ATOM 0 HG3 ARG A 123 0.693 14.346 -15.170 1.00 74.04 H new ATOM 0 HD2 ARG A 123 -0.242 16.252 -13.850 1.00 44.44 H new ATOM 0 HD3 ARG A 123 -0.723 14.684 -13.232 1.00 44.44 H new ATOM 0 HE ARG A 123 0.373 15.154 -11.244 1.00 55.04 H new ATOM 0 HH11 ARG A 123 1.616 17.249 -13.807 1.00 45.11 H new ATOM 0 HH12 ARG A 123 2.618 18.196 -12.702 1.00 45.11 H new ATOM 0 HH21 ARG A 123 1.662 16.378 -9.838 1.00 73.34 H new ATOM 0 HH22 ARG A 123 2.644 17.705 -10.467 1.00 73.34 H new ATOM 1922 N THR A 124 1.525 11.052 -15.751 1.00 4.01 N ATOM 1923 CA THR A 124 0.799 10.540 -16.907 1.00 3.22 C ATOM 1924 C THR A 124 -0.674 10.333 -16.572 1.00 41.51 C ATOM 1925 O THR A 124 -1.552 10.594 -17.395 1.00 43.21 O ATOM 1926 CB THR A 124 1.415 9.223 -17.381 1.00 61.31 C ATOM 1927 OG1 THR A 124 1.086 8.168 -16.495 1.00 22.12 O ATOM 1928 CG2 THR A 124 2.924 9.275 -17.493 1.00 50.43 C ATOM 0 H THR A 124 1.613 10.389 -14.981 1.00 4.01 H new ATOM 0 HA THR A 124 0.873 11.276 -17.708 1.00 3.22 H new ATOM 0 HB THR A 124 0.999 9.049 -18.373 1.00 61.31 H new ATOM 0 HG1 THR A 124 1.425 8.376 -15.599 1.00 22.12 H new ATOM 0 HG21 THR A 124 3.297 8.309 -17.834 1.00 50.43 H new ATOM 0 HG22 THR A 124 3.209 10.047 -18.208 1.00 50.43 H new ATOM 0 HG23 THR A 124 3.353 9.506 -16.518 1.00 50.43 H new ATOM 1936 N VAL A 125 -0.935 9.862 -15.358 1.00 34.33 N ATOM 1937 CA VAL A 125 -2.294 9.618 -14.906 1.00 65.44 C ATOM 1938 C VAL A 125 -2.745 10.699 -13.927 1.00 51.22 C ATOM 1939 O VAL A 125 -2.433 10.642 -12.738 1.00 62.21 O ATOM 1940 CB VAL A 125 -2.410 8.239 -14.232 1.00 72.44 C ATOM 1941 CG1 VAL A 125 -3.826 7.996 -13.744 1.00 34.30 C ATOM 1942 CG2 VAL A 125 -1.973 7.140 -15.189 1.00 11.40 C ATOM 0 H VAL A 125 -0.217 9.641 -14.668 1.00 34.33 H new ATOM 0 HA VAL A 125 -2.939 9.641 -15.784 1.00 65.44 H new ATOM 0 HB VAL A 125 -1.747 8.223 -13.367 1.00 72.44 H new ATOM 0 HG11 VAL A 125 -3.885 7.016 -13.271 1.00 34.30 H new ATOM 0 HG12 VAL A 125 -4.099 8.765 -13.021 1.00 34.30 H new ATOM 0 HG13 VAL A 125 -4.513 8.033 -14.589 1.00 34.30 H new ATOM 0 HG21 VAL A 125 -2.061 6.172 -14.696 1.00 11.40 H new ATOM 0 HG22 VAL A 125 -2.608 7.155 -16.075 1.00 11.40 H new ATOM 0 HG23 VAL A 125 -0.936 7.304 -15.483 1.00 11.40 H new ATOM 1952 N GLU A 126 -3.479 11.683 -14.437 1.00 3.43 N ATOM 1953 CA GLU A 126 -3.973 12.779 -13.609 1.00 35.41 C ATOM 1954 C GLU A 126 -4.716 12.251 -12.384 1.00 64.52 C ATOM 1955 O GLU A 126 -5.169 11.106 -12.365 1.00 40.34 O ATOM 1956 CB GLU A 126 -4.889 13.695 -14.425 1.00 32.54 C ATOM 1957 CG GLU A 126 -5.946 12.950 -15.226 1.00 41.41 C ATOM 1958 CD GLU A 126 -6.926 13.886 -15.905 1.00 73.30 C ATOM 1959 OE1 GLU A 126 -7.038 15.050 -15.466 1.00 14.41 O ATOM 1960 OE2 GLU A 126 -7.583 13.455 -16.876 1.00 3.21 O ATOM 0 H GLU A 126 -3.745 11.744 -15.420 1.00 3.43 H new ATOM 0 HA GLU A 126 -3.113 13.353 -13.266 1.00 35.41 H new ATOM 0 HB2 GLU A 126 -5.383 14.394 -13.750 1.00 32.54 H new ATOM 0 HB3 GLU A 126 -4.280 14.288 -15.107 1.00 32.54 H new ATOM 0 HG2 GLU A 126 -5.458 12.332 -15.979 1.00 41.41 H new ATOM 0 HG3 GLU A 126 -6.491 12.276 -14.565 1.00 41.41 H new ATOM 1967 N SER A 127 -4.831 13.092 -11.362 1.00 72.14 N ATOM 1968 CA SER A 127 -5.510 12.714 -10.127 1.00 71.20 C ATOM 1969 C SER A 127 -6.954 12.297 -10.393 1.00 72.41 C ATOM 1970 O SER A 127 -7.408 11.259 -9.912 1.00 55.04 O ATOM 1971 CB SER A 127 -5.476 13.874 -9.129 1.00 42.34 C ATOM 1972 OG SER A 127 -6.484 13.734 -8.142 1.00 71.42 O ATOM 0 H SER A 127 -4.462 14.043 -11.364 1.00 72.14 H new ATOM 0 HA SER A 127 -4.983 11.859 -9.703 1.00 71.20 H new ATOM 0 HB2 SER A 127 -4.498 13.916 -8.650 1.00 42.34 H new ATOM 0 HB3 SER A 127 -5.612 14.817 -9.659 1.00 42.34 H new ATOM 0 HG SER A 127 -6.437 14.488 -7.518 1.00 71.42 H new ATOM 1978 N ARG A 128 -7.675 13.115 -11.154 1.00 23.33 N ATOM 1979 CA ARG A 128 -9.071 12.831 -11.476 1.00 41.11 C ATOM 1980 C ARG A 128 -9.235 11.415 -12.026 1.00 64.25 C ATOM 1981 O ARG A 128 -10.246 10.757 -11.781 1.00 51.21 O ATOM 1982 CB ARG A 128 -9.603 13.854 -12.484 1.00 63.10 C ATOM 1983 CG ARG A 128 -9.123 13.620 -13.908 1.00 73.32 C ATOM 1984 CD ARG A 128 -10.148 12.842 -14.718 1.00 34.35 C ATOM 1985 NE ARG A 128 -10.972 13.719 -15.548 1.00 44.24 N ATOM 1986 CZ ARG A 128 -12.164 13.378 -16.032 1.00 4.03 C ATOM 1987 NH1 ARG A 128 -12.676 12.180 -15.776 1.00 23.23 N ATOM 1988 NH2 ARG A 128 -12.847 14.237 -16.776 1.00 11.44 N ATOM 0 H ARG A 128 -7.317 13.980 -11.559 1.00 23.33 H new ATOM 0 HA ARG A 128 -9.649 12.905 -10.555 1.00 41.11 H new ATOM 0 HB2 ARG A 128 -10.693 13.831 -12.470 1.00 63.10 H new ATOM 0 HB3 ARG A 128 -9.301 14.852 -12.168 1.00 63.10 H new ATOM 0 HG2 ARG A 128 -8.927 14.578 -14.390 1.00 73.32 H new ATOM 0 HG3 ARG A 128 -8.180 13.074 -13.891 1.00 73.32 H new ATOM 0 HD2 ARG A 128 -9.635 12.119 -15.353 1.00 34.35 H new ATOM 0 HD3 ARG A 128 -10.789 12.275 -14.043 1.00 34.35 H new ATOM 0 HE ARG A 128 -10.612 14.647 -15.769 1.00 44.24 H new ATOM 0 HH11 ARG A 128 -12.155 11.514 -15.205 1.00 23.23 H new ATOM 0 HH12 ARG A 128 -13.590 11.925 -16.150 1.00 23.23 H new ATOM 0 HH21 ARG A 128 -12.459 15.159 -16.977 1.00 11.44 H new ATOM 0 HH22 ARG A 128 -13.761 13.976 -17.147 1.00 11.44 H new ATOM 2002 N GLN A 129 -8.233 10.953 -12.768 1.00 71.11 N ATOM 2003 CA GLN A 129 -8.269 9.616 -13.349 1.00 65.34 C ATOM 2004 C GLN A 129 -8.281 8.555 -12.255 1.00 70.25 C ATOM 2005 O GLN A 129 -8.906 7.505 -12.400 1.00 24.01 O ATOM 2006 CB GLN A 129 -7.068 9.403 -14.271 1.00 31.43 C ATOM 2007 CG GLN A 129 -7.326 8.399 -15.382 1.00 21.44 C ATOM 2008 CD GLN A 129 -6.905 8.915 -16.744 1.00 31.31 C ATOM 2009 OE1 GLN A 129 -7.684 8.894 -17.697 1.00 12.03 O ATOM 2010 NE2 GLN A 129 -5.666 9.381 -16.843 1.00 33.20 N ATOM 0 H GLN A 129 -7.388 11.484 -12.980 1.00 71.11 H new ATOM 0 HA GLN A 129 -9.184 9.523 -13.934 1.00 65.34 H new ATOM 0 HB2 GLN A 129 -6.786 10.358 -14.714 1.00 31.43 H new ATOM 0 HB3 GLN A 129 -6.219 9.065 -13.676 1.00 31.43 H new ATOM 0 HG2 GLN A 129 -6.788 7.476 -15.165 1.00 21.44 H new ATOM 0 HG3 GLN A 129 -8.387 8.151 -15.404 1.00 21.44 H new ATOM 0 HE21 GLN A 129 -5.054 9.380 -16.027 1.00 33.20 H new ATOM 0 HE22 GLN A 129 -5.326 9.741 -17.735 1.00 33.20 H new ATOM 2019 N ALA A 130 -7.587 8.839 -11.159 1.00 15.21 N ATOM 2020 CA ALA A 130 -7.519 7.911 -10.037 1.00 65.42 C ATOM 2021 C ALA A 130 -8.779 7.997 -9.185 1.00 14.43 C ATOM 2022 O ALA A 130 -9.242 6.996 -8.639 1.00 1.12 O ATOM 2023 CB ALA A 130 -6.288 8.191 -9.188 1.00 14.45 C ATOM 0 H ALA A 130 -7.064 9.704 -11.024 1.00 15.21 H new ATOM 0 HA ALA A 130 -7.445 6.900 -10.438 1.00 65.42 H new ATOM 0 HB1 ALA A 130 -6.253 7.489 -8.355 1.00 14.45 H new ATOM 0 HB2 ALA A 130 -5.392 8.076 -9.797 1.00 14.45 H new ATOM 0 HB3 ALA A 130 -6.336 9.209 -8.802 1.00 14.45 H new ATOM 2029 N GLN A 131 -9.332 9.201 -9.078 1.00 44.34 N ATOM 2030 CA GLN A 131 -10.541 9.419 -8.295 1.00 42.31 C ATOM 2031 C GLN A 131 -11.725 8.683 -8.915 1.00 15.34 C ATOM 2032 O GLN A 131 -12.611 8.204 -8.207 1.00 62.31 O ATOM 2033 CB GLN A 131 -10.847 10.915 -8.194 1.00 70.24 C ATOM 2034 CG GLN A 131 -10.377 11.544 -6.892 1.00 2.34 C ATOM 2035 CD GLN A 131 -11.526 11.940 -5.986 1.00 13.23 C ATOM 2036 OE1 GLN A 131 -11.904 13.109 -5.918 1.00 71.42 O ATOM 2037 NE2 GLN A 131 -12.087 10.963 -5.283 1.00 64.14 N ATOM 0 H GLN A 131 -8.961 10.040 -9.524 1.00 44.34 H new ATOM 0 HA GLN A 131 -10.374 9.024 -7.293 1.00 42.31 H new ATOM 0 HB2 GLN A 131 -10.374 11.432 -9.029 1.00 70.24 H new ATOM 0 HB3 GLN A 131 -11.922 11.065 -8.294 1.00 70.24 H new ATOM 0 HG2 GLN A 131 -9.731 10.841 -6.366 1.00 2.34 H new ATOM 0 HG3 GLN A 131 -9.775 12.425 -7.115 1.00 2.34 H new ATOM 0 HE21 GLN A 131 -11.741 10.008 -5.371 1.00 64.14 H new ATOM 0 HE22 GLN A 131 -12.864 11.168 -4.655 1.00 64.14 H new ATOM 2046 N ASP A 132 -11.730 8.594 -10.241 1.00 54.12 N ATOM 2047 CA ASP A 132 -12.802 7.914 -10.958 1.00 30.31 C ATOM 2048 C ASP A 132 -12.908 6.459 -10.515 1.00 5.44 C ATOM 2049 O ASP A 132 -13.999 5.960 -10.241 1.00 64.34 O ATOM 2050 CB ASP A 132 -12.560 7.984 -12.467 1.00 23.33 C ATOM 2051 CG ASP A 132 -13.733 7.451 -13.266 1.00 31.33 C ATOM 2052 OD1 ASP A 132 -13.783 6.225 -13.502 1.00 2.31 O ATOM 2053 OD2 ASP A 132 -14.602 8.259 -13.657 1.00 61.44 O ATOM 0 H ASP A 132 -11.003 8.985 -10.841 1.00 54.12 H new ATOM 0 HA ASP A 132 -13.740 8.418 -10.726 1.00 30.31 H new ATOM 0 HB2 ASP A 132 -12.368 9.018 -12.754 1.00 23.33 H new ATOM 0 HB3 ASP A 132 -11.665 7.413 -12.716 1.00 23.33 H new ATOM 2058 N LEU A 133 -11.765 5.785 -10.443 1.00 14.14 N ATOM 2059 CA LEU A 133 -11.726 4.389 -10.027 1.00 74.50 C ATOM 2060 C LEU A 133 -12.010 4.265 -8.534 1.00 52.51 C ATOM 2061 O LEU A 133 -12.796 3.419 -8.109 1.00 30.43 O ATOM 2062 CB LEU A 133 -10.361 3.775 -10.353 1.00 12.21 C ATOM 2063 CG LEU A 133 -10.147 2.350 -9.838 1.00 11.34 C ATOM 2064 CD1 LEU A 133 -10.642 1.334 -10.856 1.00 12.04 C ATOM 2065 CD2 LEU A 133 -8.679 2.115 -9.517 1.00 2.10 C ATOM 0 H LEU A 133 -10.853 6.184 -10.668 1.00 14.14 H new ATOM 0 HA LEU A 133 -12.498 3.847 -10.574 1.00 74.50 H new ATOM 0 HB2 LEU A 133 -10.229 3.777 -11.435 1.00 12.21 H new ATOM 0 HB3 LEU A 133 -9.584 4.415 -9.936 1.00 12.21 H new ATOM 0 HG LEU A 133 -10.723 2.225 -8.921 1.00 11.34 H new ATOM 0 HD11 LEU A 133 -10.481 0.327 -10.472 1.00 12.04 H new ATOM 0 HD12 LEU A 133 -11.706 1.488 -11.036 1.00 12.04 H new ATOM 0 HD13 LEU A 133 -10.094 1.458 -11.790 1.00 12.04 H new ATOM 0 HD21 LEU A 133 -8.545 1.097 -9.152 1.00 2.10 H new ATOM 0 HD22 LEU A 133 -8.082 2.259 -10.417 1.00 2.10 H new ATOM 0 HD23 LEU A 133 -8.357 2.820 -8.751 1.00 2.10 H new ATOM 2077 N ALA A 134 -11.364 5.117 -7.744 1.00 0.31 N ATOM 2078 CA ALA A 134 -11.546 5.106 -6.299 1.00 50.20 C ATOM 2079 C ALA A 134 -13.003 5.360 -5.929 1.00 43.24 C ATOM 2080 O ALA A 134 -13.554 4.704 -5.045 1.00 54.24 O ATOM 2081 CB ALA A 134 -10.645 6.143 -5.646 1.00 15.50 C ATOM 0 H ALA A 134 -10.710 5.823 -8.081 1.00 0.31 H new ATOM 0 HA ALA A 134 -11.271 4.118 -5.930 1.00 50.20 H new ATOM 0 HB1 ALA A 134 -10.791 6.124 -4.566 1.00 15.50 H new ATOM 0 HB2 ALA A 134 -9.604 5.916 -5.875 1.00 15.50 H new ATOM 0 HB3 ALA A 134 -10.893 7.133 -6.028 1.00 15.50 H new ATOM 2087 N ARG A 135 -13.623 6.318 -6.612 1.00 1.21 N ATOM 2088 CA ARG A 135 -15.017 6.661 -6.357 1.00 34.44 C ATOM 2089 C ARG A 135 -15.920 5.448 -6.560 1.00 43.55 C ATOM 2090 O ARG A 135 -16.848 5.216 -5.785 1.00 0.42 O ATOM 2091 CB ARG A 135 -15.460 7.800 -7.277 1.00 34.52 C ATOM 2092 CG ARG A 135 -16.903 8.229 -7.065 1.00 53.11 C ATOM 2093 CD ARG A 135 -17.081 9.723 -7.284 1.00 10.14 C ATOM 2094 NE ARG A 135 -18.143 10.013 -8.245 1.00 12.43 N ATOM 2095 CZ ARG A 135 -18.044 9.779 -9.552 1.00 61.11 C ATOM 2096 NH1 ARG A 135 -16.935 9.254 -10.057 1.00 0.21 N ATOM 2097 NH2 ARG A 135 -19.057 10.072 -10.355 1.00 75.12 N ATOM 0 H ARG A 135 -13.181 6.870 -7.347 1.00 1.21 H new ATOM 0 HA ARG A 135 -15.102 6.987 -5.320 1.00 34.44 H new ATOM 0 HB2 ARG A 135 -14.808 8.659 -7.118 1.00 34.52 H new ATOM 0 HB3 ARG A 135 -15.331 7.489 -8.314 1.00 34.52 H new ATOM 0 HG2 ARG A 135 -17.550 7.681 -7.749 1.00 53.11 H new ATOM 0 HG3 ARG A 135 -17.216 7.969 -6.054 1.00 53.11 H new ATOM 0 HD2 ARG A 135 -17.311 10.204 -6.333 1.00 10.14 H new ATOM 0 HD3 ARG A 135 -16.144 10.152 -7.639 1.00 10.14 H new ATOM 0 HE ARG A 135 -19.011 10.418 -7.894 1.00 12.43 H new ATOM 0 HH11 ARG A 135 -16.153 9.027 -9.443 1.00 0.21 H new ATOM 0 HH12 ARG A 135 -16.865 9.077 -11.059 1.00 0.21 H new ATOM 0 HH21 ARG A 135 -19.911 10.476 -9.972 1.00 75.12 H new ATOM 0 HH22 ARG A 135 -18.982 9.893 -11.356 1.00 75.12 H new ATOM 2111 N SER A 136 -15.638 4.677 -7.604 1.00 54.32 N ATOM 2112 CA SER A 136 -16.422 3.485 -7.907 1.00 22.44 C ATOM 2113 C SER A 136 -16.108 2.367 -6.919 1.00 33.22 C ATOM 2114 O SER A 136 -16.963 1.536 -6.613 1.00 12.24 O ATOM 2115 CB SER A 136 -16.142 3.014 -9.335 1.00 44.54 C ATOM 2116 OG SER A 136 -17.261 2.334 -9.877 1.00 15.11 O ATOM 0 H SER A 136 -14.873 4.856 -8.255 1.00 54.32 H new ATOM 0 HA SER A 136 -17.478 3.740 -7.818 1.00 22.44 H new ATOM 0 HB2 SER A 136 -15.895 3.871 -9.962 1.00 44.54 H new ATOM 0 HB3 SER A 136 -15.274 2.354 -9.340 1.00 44.54 H new ATOM 0 HG SER A 136 -17.057 2.045 -10.791 1.00 15.11 H new ATOM 2122 N TYR A 137 -14.876 2.356 -6.422 1.00 72.32 N ATOM 2123 CA TYR A 137 -14.445 1.344 -5.466 1.00 22.32 C ATOM 2124 C TYR A 137 -14.982 1.645 -4.070 1.00 21.42 C ATOM 2125 O TYR A 137 -15.129 0.745 -3.243 1.00 41.24 O ATOM 2126 CB TYR A 137 -12.918 1.264 -5.436 1.00 73.45 C ATOM 2127 CG TYR A 137 -12.339 0.389 -6.525 1.00 31.42 C ATOM 2128 CD1 TYR A 137 -12.983 0.252 -7.749 1.00 52.23 C ATOM 2129 CD2 TYR A 137 -11.151 -0.301 -6.328 1.00 60.12 C ATOM 2130 CE1 TYR A 137 -12.459 -0.548 -8.745 1.00 32.41 C ATOM 2131 CE2 TYR A 137 -10.620 -1.103 -7.320 1.00 23.32 C ATOM 2132 CZ TYR A 137 -11.278 -1.224 -8.526 1.00 10.54 C ATOM 2133 OH TYR A 137 -10.752 -2.022 -9.515 1.00 62.03 O ATOM 0 H TYR A 137 -14.158 3.038 -6.666 1.00 72.32 H new ATOM 0 HA TYR A 137 -14.847 0.382 -5.785 1.00 22.32 H new ATOM 0 HB2 TYR A 137 -12.507 2.269 -5.532 1.00 73.45 H new ATOM 0 HB3 TYR A 137 -12.601 0.881 -4.466 1.00 73.45 H new ATOM 0 HD1 TYR A 137 -13.909 0.780 -7.924 1.00 52.23 H new ATOM 0 HD2 TYR A 137 -10.633 -0.210 -5.384 1.00 60.12 H new ATOM 0 HE1 TYR A 137 -12.972 -0.644 -9.691 1.00 32.41 H new ATOM 0 HE2 TYR A 137 -9.694 -1.633 -7.152 1.00 23.32 H new ATOM 0 HH TYR A 137 -11.202 -1.830 -10.364 1.00 62.03 H new ATOM 2143 N GLY A 138 -15.273 2.917 -3.814 1.00 23.55 N ATOM 2144 CA GLY A 138 -15.791 3.314 -2.518 1.00 51.43 C ATOM 2145 C GLY A 138 -14.694 3.537 -1.494 1.00 53.31 C ATOM 2146 O GLY A 138 -14.956 3.558 -0.291 1.00 4.42 O ATOM 0 H GLY A 138 -15.159 3.680 -4.482 1.00 23.55 H new ATOM 0 HA2 GLY A 138 -16.372 4.230 -2.628 1.00 51.43 H new ATOM 0 HA3 GLY A 138 -16.473 2.546 -2.153 1.00 51.43 H new ATOM 2150 N ILE A 139 -13.462 3.702 -1.969 1.00 5.41 N ATOM 2151 CA ILE A 139 -12.327 3.923 -1.082 1.00 2.31 C ATOM 2152 C ILE A 139 -11.726 5.311 -1.277 1.00 13.23 C ATOM 2153 O ILE A 139 -11.884 5.924 -2.333 1.00 22.13 O ATOM 2154 CB ILE A 139 -11.232 2.872 -1.296 1.00 43.32 C ATOM 2155 CG1 ILE A 139 -11.026 2.614 -2.783 1.00 12.41 C ATOM 2156 CG2 ILE A 139 -11.591 1.584 -0.572 1.00 64.53 C ATOM 2157 CD1 ILE A 139 -9.927 1.625 -3.058 1.00 23.23 C ATOM 0 H ILE A 139 -13.226 3.687 -2.961 1.00 5.41 H new ATOM 0 HA ILE A 139 -12.710 3.838 -0.065 1.00 2.31 H new ATOM 0 HB ILE A 139 -10.297 3.251 -0.883 1.00 43.32 H new ATOM 0 HG12 ILE A 139 -11.956 2.245 -3.215 1.00 12.41 H new ATOM 0 HG13 ILE A 139 -10.794 3.555 -3.281 1.00 12.41 H new ATOM 0 HG21 ILE A 139 -10.805 0.846 -0.732 1.00 64.53 H new ATOM 0 HG22 ILE A 139 -11.691 1.782 0.495 1.00 64.53 H new ATOM 0 HG23 ILE A 139 -12.534 1.200 -0.960 1.00 64.53 H new ATOM 0 HD11 ILE A 139 -9.827 1.482 -4.134 1.00 23.23 H new ATOM 0 HD12 ILE A 139 -8.988 2.003 -2.653 1.00 23.23 H new ATOM 0 HD13 ILE A 139 -10.168 0.672 -2.586 1.00 23.23 H new ATOM 2169 N PRO A 140 -11.022 5.827 -0.254 1.00 63.00 N ATOM 2170 CA PRO A 140 -10.394 7.150 -0.317 1.00 25.05 C ATOM 2171 C PRO A 140 -9.192 7.176 -1.254 1.00 25.01 C ATOM 2172 O PRO A 140 -8.564 6.147 -1.504 1.00 1.11 O ATOM 2173 CB PRO A 140 -9.950 7.403 1.125 1.00 40.15 C ATOM 2174 CG PRO A 140 -9.768 6.045 1.711 1.00 10.11 C ATOM 2175 CD PRO A 140 -10.785 5.161 1.041 1.00 13.34 C ATOM 0 HA PRO A 140 -11.076 7.906 -0.706 1.00 25.05 H new ATOM 0 HB2 PRO A 140 -9.023 7.976 1.159 1.00 40.15 H new ATOM 0 HB3 PRO A 140 -10.698 7.974 1.675 1.00 40.15 H new ATOM 0 HG2 PRO A 140 -8.757 5.678 1.536 1.00 10.11 H new ATOM 0 HG3 PRO A 140 -9.918 6.063 2.790 1.00 10.11 H new ATOM 0 HD2 PRO A 140 -10.409 4.147 0.908 1.00 13.34 H new ATOM 0 HD3 PRO A 140 -11.701 5.087 1.628 1.00 13.34 H new ATOM 2183 N TYR A 141 -8.875 8.359 -1.767 1.00 5.14 N ATOM 2184 CA TYR A 141 -7.746 8.522 -2.675 1.00 21.34 C ATOM 2185 C TYR A 141 -6.765 9.559 -2.133 1.00 52.22 C ATOM 2186 O TYR A 141 -7.111 10.729 -1.969 1.00 12.31 O ATOM 2187 CB TYR A 141 -8.238 8.931 -4.067 1.00 63.12 C ATOM 2188 CG TYR A 141 -7.127 9.326 -5.015 1.00 51.10 C ATOM 2189 CD1 TYR A 141 -6.179 8.398 -5.428 1.00 60.23 C ATOM 2190 CD2 TYR A 141 -7.026 10.626 -5.493 1.00 63.25 C ATOM 2191 CE1 TYR A 141 -5.161 8.755 -6.291 1.00 33.21 C ATOM 2192 CE2 TYR A 141 -6.011 10.991 -6.357 1.00 43.11 C ATOM 2193 CZ TYR A 141 -5.081 10.052 -6.752 1.00 73.44 C ATOM 2194 OH TYR A 141 -4.069 10.412 -7.613 1.00 23.33 O ATOM 0 H TYR A 141 -9.384 9.220 -1.569 1.00 5.14 H new ATOM 0 HA TYR A 141 -7.227 7.567 -2.754 1.00 21.34 H new ATOM 0 HB2 TYR A 141 -8.797 8.103 -4.502 1.00 63.12 H new ATOM 0 HB3 TYR A 141 -8.931 9.766 -3.966 1.00 63.12 H new ATOM 0 HD1 TYR A 141 -6.239 7.381 -5.069 1.00 60.23 H new ATOM 0 HD2 TYR A 141 -7.752 11.363 -5.185 1.00 63.25 H new ATOM 0 HE1 TYR A 141 -4.432 8.022 -6.603 1.00 33.21 H new ATOM 0 HE2 TYR A 141 -5.946 12.006 -6.721 1.00 43.11 H new ATOM 0 HH TYR A 141 -3.810 9.638 -8.156 1.00 23.33 H new ATOM 2204 N ILE A 142 -5.543 9.119 -1.851 1.00 3.23 N ATOM 2205 CA ILE A 142 -4.514 9.999 -1.323 1.00 12.32 C ATOM 2206 C ILE A 142 -3.282 10.007 -2.223 1.00 61.40 C ATOM 2207 O ILE A 142 -3.002 9.030 -2.918 1.00 15.44 O ATOM 2208 CB ILE A 142 -4.099 9.566 0.094 1.00 14.12 C ATOM 2209 CG1 ILE A 142 -5.336 9.374 0.975 1.00 23.31 C ATOM 2210 CG2 ILE A 142 -3.158 10.588 0.703 1.00 15.32 C ATOM 2211 CD1 ILE A 142 -5.731 7.924 1.154 1.00 72.44 C ATOM 0 H ILE A 142 -5.243 8.153 -1.981 1.00 3.23 H new ATOM 0 HA ILE A 142 -4.935 11.004 -1.286 1.00 12.32 H new ATOM 0 HB ILE A 142 -3.574 8.613 0.030 1.00 14.12 H new ATOM 0 HG12 ILE A 142 -5.147 9.814 1.954 1.00 23.31 H new ATOM 0 HG13 ILE A 142 -6.172 9.919 0.537 1.00 23.31 H new ATOM 0 HG21 ILE A 142 -2.873 10.268 1.705 1.00 15.32 H new ATOM 0 HG22 ILE A 142 -2.266 10.676 0.083 1.00 15.32 H new ATOM 0 HG23 ILE A 142 -3.658 11.555 0.759 1.00 15.32 H new ATOM 0 HD11 ILE A 142 -6.615 7.863 1.789 1.00 72.44 H new ATOM 0 HD12 ILE A 142 -5.952 7.484 0.181 1.00 72.44 H new ATOM 0 HD13 ILE A 142 -4.911 7.378 1.621 1.00 72.44 H new ATOM 2223 N GLU A 143 -2.548 11.115 -2.204 1.00 3.51 N ATOM 2224 CA GLU A 143 -1.344 11.250 -3.017 1.00 61.32 C ATOM 2225 C GLU A 143 -0.112 11.417 -2.135 1.00 45.45 C ATOM 2226 O GLU A 143 -0.115 12.208 -1.192 1.00 30.11 O ATOM 2227 CB GLU A 143 -1.473 12.446 -3.963 1.00 2.42 C ATOM 2228 CG GLU A 143 -2.807 12.508 -4.687 1.00 1.13 C ATOM 2229 CD GLU A 143 -3.000 13.809 -5.441 1.00 75.21 C ATOM 2230 OE1 GLU A 143 -3.206 14.851 -4.784 1.00 32.43 O ATOM 2231 OE2 GLU A 143 -2.945 13.786 -6.689 1.00 33.41 O ATOM 0 H GLU A 143 -2.766 11.933 -1.634 1.00 3.51 H new ATOM 0 HA GLU A 143 -1.229 10.341 -3.607 1.00 61.32 H new ATOM 0 HB2 GLU A 143 -1.335 13.365 -3.394 1.00 2.42 H new ATOM 0 HB3 GLU A 143 -0.671 12.404 -4.700 1.00 2.42 H new ATOM 0 HG2 GLU A 143 -2.877 11.674 -5.385 1.00 1.13 H new ATOM 0 HG3 GLU A 143 -3.614 12.387 -3.965 1.00 1.13 H new ATOM 2238 N THR A 144 0.942 10.668 -2.445 1.00 40.03 N ATOM 2239 CA THR A 144 2.177 10.739 -1.674 1.00 41.41 C ATOM 2240 C THR A 144 3.400 10.628 -2.578 1.00 65.23 C ATOM 2241 O THR A 144 3.280 10.373 -3.776 1.00 65.52 O ATOM 2242 CB THR A 144 2.207 9.632 -0.619 1.00 50.13 C ATOM 2243 OG1 THR A 144 2.329 8.360 -1.230 1.00 21.24 O ATOM 2244 CG2 THR A 144 0.972 9.606 0.255 1.00 55.30 C ATOM 0 H THR A 144 0.965 10.007 -3.222 1.00 40.03 H new ATOM 0 HA THR A 144 2.206 11.709 -1.178 1.00 41.41 H new ATOM 0 HB THR A 144 3.071 9.853 0.008 1.00 50.13 H new ATOM 0 HG1 THR A 144 1.798 8.340 -2.053 1.00 21.24 H new ATOM 0 HG21 THR A 144 1.057 8.798 0.981 1.00 55.30 H new ATOM 0 HG22 THR A 144 0.877 10.557 0.779 1.00 55.30 H new ATOM 0 HG23 THR A 144 0.091 9.444 -0.365 1.00 55.30 H new ATOM 2252 N SER A 145 4.577 10.821 -1.991 1.00 32.15 N ATOM 2253 CA SER A 145 5.829 10.743 -2.735 1.00 25.20 C ATOM 2254 C SER A 145 6.911 10.066 -1.899 1.00 24.25 C ATOM 2255 O SER A 145 7.275 10.550 -0.828 1.00 24.10 O ATOM 2256 CB SER A 145 6.288 12.142 -3.150 1.00 13.22 C ATOM 2257 OG SER A 145 5.781 13.129 -2.268 1.00 13.13 O ATOM 0 H SER A 145 4.690 11.033 -1.000 1.00 32.15 H new ATOM 0 HA SER A 145 5.657 10.146 -3.631 1.00 25.20 H new ATOM 0 HB2 SER A 145 7.377 12.183 -3.159 1.00 13.22 H new ATOM 0 HB3 SER A 145 5.953 12.351 -4.166 1.00 13.22 H new ATOM 0 HG SER A 145 5.673 13.975 -2.751 1.00 13.13 H new ATOM 2263 N ALA A 146 7.417 8.941 -2.394 1.00 71.20 N ATOM 2264 CA ALA A 146 8.455 8.195 -1.690 1.00 31.23 C ATOM 2265 C ALA A 146 9.801 8.913 -1.753 1.00 51.21 C ATOM 2266 O ALA A 146 10.680 8.673 -0.925 1.00 33.05 O ATOM 2267 CB ALA A 146 8.575 6.791 -2.267 1.00 73.32 C ATOM 0 H ALA A 146 7.126 8.526 -3.279 1.00 71.20 H new ATOM 0 HA ALA A 146 8.166 8.126 -0.641 1.00 31.23 H new ATOM 0 HB1 ALA A 146 9.352 6.244 -1.734 1.00 73.32 H new ATOM 0 HB2 ALA A 146 7.624 6.270 -2.157 1.00 73.32 H new ATOM 0 HB3 ALA A 146 8.835 6.853 -3.324 1.00 73.32 H new ATOM 2273 N LYS A 147 9.959 9.791 -2.739 1.00 13.04 N ATOM 2274 CA LYS A 147 11.203 10.536 -2.905 1.00 61.20 C ATOM 2275 C LYS A 147 11.237 11.762 -1.996 1.00 71.13 C ATOM 2276 O LYS A 147 12.191 11.963 -1.245 1.00 50.24 O ATOM 2277 CB LYS A 147 11.374 10.964 -4.363 1.00 34.35 C ATOM 2278 CG LYS A 147 12.785 11.414 -4.704 1.00 43.43 C ATOM 2279 CD LYS A 147 13.707 10.227 -4.941 1.00 62.22 C ATOM 2280 CE LYS A 147 15.130 10.674 -5.238 1.00 43.21 C ATOM 2281 NZ LYS A 147 15.631 10.116 -6.525 1.00 40.04 N ATOM 0 H LYS A 147 9.243 10.004 -3.434 1.00 13.04 H new ATOM 0 HA LYS A 147 12.027 9.879 -2.625 1.00 61.20 H new ATOM 0 HB2 LYS A 147 11.100 10.132 -5.012 1.00 34.35 H new ATOM 0 HB3 LYS A 147 10.680 11.777 -4.578 1.00 34.35 H new ATOM 0 HG2 LYS A 147 12.762 12.042 -5.595 1.00 43.43 H new ATOM 0 HG3 LYS A 147 13.179 12.026 -3.892 1.00 43.43 H new ATOM 0 HD2 LYS A 147 13.704 9.582 -4.062 1.00 62.22 H new ATOM 0 HD3 LYS A 147 13.330 9.633 -5.774 1.00 62.22 H new ATOM 0 HE2 LYS A 147 15.168 11.763 -5.275 1.00 43.21 H new ATOM 0 HE3 LYS A 147 15.786 10.360 -4.426 1.00 43.21 H new ATOM 0 HZ1 LYS A 147 16.604 10.444 -6.690 1.00 40.04 H new ATOM 0 HZ2 LYS A 147 15.619 9.077 -6.481 1.00 40.04 H new ATOM 0 HZ3 LYS A 147 15.020 10.437 -7.303 1.00 40.04 H new ATOM 2295 N THR A 148 10.192 12.580 -2.072 1.00 51.00 N ATOM 2296 CA THR A 148 10.107 13.789 -1.259 1.00 24.13 C ATOM 2297 C THR A 148 9.486 13.500 0.106 1.00 0.12 C ATOM 2298 O THR A 148 9.640 14.283 1.043 1.00 52.22 O ATOM 2299 CB THR A 148 9.291 14.862 -1.983 1.00 65.15 C ATOM 2300 OG1 THR A 148 8.234 14.277 -2.724 1.00 20.30 O ATOM 2301 CG2 THR A 148 10.116 15.701 -2.936 1.00 51.41 C ATOM 0 H THR A 148 9.393 12.428 -2.687 1.00 51.00 H new ATOM 0 HA THR A 148 11.122 14.153 -1.102 1.00 24.13 H new ATOM 0 HB THR A 148 8.906 15.511 -1.196 1.00 65.15 H new ATOM 0 HG1 THR A 148 7.505 14.033 -2.117 1.00 20.30 H new ATOM 0 HG21 THR A 148 9.476 16.442 -3.416 1.00 51.41 H new ATOM 0 HG22 THR A 148 10.907 16.208 -2.383 1.00 51.41 H new ATOM 0 HG23 THR A 148 10.560 15.058 -3.696 1.00 51.41 H new ATOM 2309 N ARG A 149 8.779 12.378 0.213 1.00 62.34 N ATOM 2310 CA ARG A 149 8.134 12.000 1.467 1.00 62.43 C ATOM 2311 C ARG A 149 7.073 13.025 1.857 1.00 72.11 C ATOM 2312 O ARG A 149 7.187 13.695 2.884 1.00 74.35 O ATOM 2313 CB ARG A 149 9.174 11.869 2.583 1.00 12.41 C ATOM 2314 CG ARG A 149 8.876 10.746 3.564 1.00 62.31 C ATOM 2315 CD ARG A 149 7.642 11.049 4.399 1.00 25.35 C ATOM 2316 NE ARG A 149 7.795 12.274 5.180 1.00 4.13 N ATOM 2317 CZ ARG A 149 8.547 12.366 6.275 1.00 4.10 C ATOM 2318 NH1 ARG A 149 9.212 11.308 6.723 1.00 62.53 N ATOM 2319 NH2 ARG A 149 8.633 13.518 6.925 1.00 22.21 N ATOM 0 H ARG A 149 8.639 11.717 -0.551 1.00 62.34 H new ATOM 0 HA ARG A 149 7.648 11.035 1.324 1.00 62.43 H new ATOM 0 HB2 ARG A 149 10.154 11.700 2.137 1.00 12.41 H new ATOM 0 HB3 ARG A 149 9.230 12.811 3.128 1.00 12.41 H new ATOM 0 HG2 ARG A 149 8.728 9.814 3.018 1.00 62.31 H new ATOM 0 HG3 ARG A 149 9.733 10.598 4.220 1.00 62.31 H new ATOM 0 HD2 ARG A 149 6.776 11.143 3.744 1.00 25.35 H new ATOM 0 HD3 ARG A 149 7.445 10.213 5.071 1.00 25.35 H new ATOM 0 HE ARG A 149 7.297 13.108 4.868 1.00 4.13 H new ATOM 0 HH11 ARG A 149 9.149 10.419 6.228 1.00 62.53 H new ATOM 0 HH12 ARG A 149 9.786 11.385 7.562 1.00 62.53 H new ATOM 0 HH21 ARG A 149 8.123 14.334 6.586 1.00 22.21 H new ATOM 0 HH22 ARG A 149 9.209 13.589 7.764 1.00 22.21 H new ATOM 2333 N GLN A 150 6.042 13.145 1.027 1.00 65.45 N ATOM 2334 CA GLN A 150 4.961 14.090 1.281 1.00 15.24 C ATOM 2335 C GLN A 150 3.627 13.367 1.434 1.00 3.51 C ATOM 2336 O GLN A 150 3.151 12.719 0.503 1.00 71.25 O ATOM 2337 CB GLN A 150 4.875 15.111 0.143 1.00 42.10 C ATOM 2338 CG GLN A 150 3.738 16.108 0.300 1.00 55.10 C ATOM 2339 CD GLN A 150 4.151 17.523 -0.048 1.00 5.31 C ATOM 2340 OE1 GLN A 150 4.288 18.377 0.828 1.00 15.42 O ATOM 2341 NE2 GLN A 150 4.350 17.778 -1.335 1.00 23.00 N ATOM 0 H GLN A 150 5.932 12.599 0.172 1.00 65.45 H new ATOM 0 HA GLN A 150 5.177 14.610 2.214 1.00 15.24 H new ATOM 0 HB2 GLN A 150 5.818 15.655 0.083 1.00 42.10 H new ATOM 0 HB3 GLN A 150 4.753 14.580 -0.801 1.00 42.10 H new ATOM 0 HG2 GLN A 150 2.907 15.809 -0.338 1.00 55.10 H new ATOM 0 HG3 GLN A 150 3.376 16.082 1.328 1.00 55.10 H new ATOM 0 HE21 GLN A 150 4.225 17.039 -2.027 1.00 23.00 H new ATOM 0 HE22 GLN A 150 4.628 18.713 -1.633 1.00 23.00 H new ATOM 2350 N GLY A 151 3.026 13.487 2.614 1.00 64.23 N ATOM 2351 CA GLY A 151 1.750 12.843 2.867 1.00 73.34 C ATOM 2352 C GLY A 151 1.846 11.329 2.904 1.00 44.53 C ATOM 2353 O GLY A 151 0.827 10.639 2.900 1.00 61.42 O ATOM 0 H GLY A 151 3.400 14.019 3.400 1.00 64.23 H new ATOM 0 HA2 GLY A 151 1.352 13.199 3.817 1.00 73.34 H new ATOM 0 HA3 GLY A 151 1.041 13.138 2.093 1.00 73.34 H new ATOM 2357 N VAL A 152 3.070 10.808 2.944 1.00 52.21 N ATOM 2358 CA VAL A 152 3.291 9.377 2.985 1.00 4.22 C ATOM 2359 C VAL A 152 2.583 8.741 4.177 1.00 31.10 C ATOM 2360 O VAL A 152 1.993 7.666 4.061 1.00 15.23 O ATOM 2361 CB VAL A 152 4.795 9.073 3.063 1.00 34.04 C ATOM 2362 CG1 VAL A 152 5.036 7.583 2.993 1.00 51.31 C ATOM 2363 CG2 VAL A 152 5.543 9.794 1.952 1.00 14.14 C ATOM 0 H VAL A 152 3.924 11.365 2.949 1.00 52.21 H new ATOM 0 HA VAL A 152 2.879 8.952 2.070 1.00 4.22 H new ATOM 0 HB VAL A 152 5.173 9.436 4.019 1.00 34.04 H new ATOM 0 HG11 VAL A 152 6.106 7.384 3.049 1.00 51.31 H new ATOM 0 HG12 VAL A 152 4.532 7.093 3.826 1.00 51.31 H new ATOM 0 HG13 VAL A 152 4.644 7.195 2.053 1.00 51.31 H new ATOM 0 HG21 VAL A 152 6.607 9.567 2.023 1.00 14.14 H new ATOM 0 HG22 VAL A 152 5.165 9.463 0.985 1.00 14.14 H new ATOM 0 HG23 VAL A 152 5.394 10.869 2.051 1.00 14.14 H new ATOM 2373 N GLU A 153 2.644 9.412 5.322 1.00 23.34 N ATOM 2374 CA GLU A 153 2.007 8.914 6.535 1.00 31.23 C ATOM 2375 C GLU A 153 0.487 8.983 6.419 1.00 72.13 C ATOM 2376 O GLU A 153 -0.227 8.166 7.000 1.00 33.23 O ATOM 2377 CB GLU A 153 2.476 9.717 7.750 1.00 4.15 C ATOM 2378 CG GLU A 153 3.971 9.990 7.760 1.00 14.40 C ATOM 2379 CD GLU A 153 4.582 9.841 9.140 1.00 3.11 C ATOM 2380 OE1 GLU A 153 3.825 9.889 10.133 1.00 71.22 O ATOM 2381 OE2 GLU A 153 5.817 9.677 9.228 1.00 20.23 O ATOM 0 H GLU A 153 3.128 10.302 5.435 1.00 23.34 H new ATOM 0 HA GLU A 153 2.296 7.871 6.665 1.00 31.23 H new ATOM 0 HB2 GLU A 153 1.942 10.667 7.775 1.00 4.15 H new ATOM 0 HB3 GLU A 153 2.208 9.176 8.658 1.00 4.15 H new ATOM 0 HG2 GLU A 153 4.466 9.305 7.072 1.00 14.40 H new ATOM 0 HG3 GLU A 153 4.155 11.000 7.392 1.00 14.40 H new ATOM 2388 N ASP A 154 0.000 9.962 5.663 1.00 14.01 N ATOM 2389 CA ASP A 154 -1.435 10.137 5.470 1.00 22.43 C ATOM 2390 C ASP A 154 -2.048 8.910 4.802 1.00 54.13 C ATOM 2391 O ASP A 154 -2.987 8.309 5.324 1.00 12.51 O ATOM 2392 CB ASP A 154 -1.708 11.384 4.624 1.00 30.25 C ATOM 2393 CG ASP A 154 -2.680 12.335 5.294 1.00 51.34 C ATOM 2394 OD1 ASP A 154 -3.887 12.015 5.342 1.00 61.04 O ATOM 2395 OD2 ASP A 154 -2.236 13.401 5.770 1.00 10.02 O ATOM 0 H ASP A 154 0.578 10.646 5.174 1.00 14.01 H new ATOM 0 HA ASP A 154 -1.896 10.263 6.450 1.00 22.43 H new ATOM 0 HB2 ASP A 154 -0.769 11.903 4.433 1.00 30.25 H new ATOM 0 HB3 ASP A 154 -2.108 11.083 3.656 1.00 30.25 H new ATOM 2400 N ALA A 155 -1.509 8.545 3.642 1.00 35.23 N ATOM 2401 CA ALA A 155 -1.999 7.391 2.896 1.00 4.24 C ATOM 2402 C ALA A 155 -2.044 6.141 3.771 1.00 3.32 C ATOM 2403 O ALA A 155 -3.004 5.371 3.721 1.00 72.12 O ATOM 2404 CB ALA A 155 -1.127 7.153 1.671 1.00 32.05 C ATOM 0 H ALA A 155 -0.731 9.033 3.198 1.00 35.23 H new ATOM 0 HA ALA A 155 -3.018 7.604 2.572 1.00 4.24 H new ATOM 0 HB1 ALA A 155 -1.501 6.290 1.121 1.00 32.05 H new ATOM 0 HB2 ALA A 155 -1.155 8.033 1.028 1.00 32.05 H new ATOM 0 HB3 ALA A 155 -0.100 6.966 1.986 1.00 32.05 H new ATOM 2410 N PHE A 156 -1.001 5.945 4.571 1.00 32.14 N ATOM 2411 CA PHE A 156 -0.923 4.787 5.455 1.00 73.25 C ATOM 2412 C PHE A 156 -1.985 4.863 6.548 1.00 1.01 C ATOM 2413 O PHE A 156 -2.732 3.910 6.768 1.00 15.21 O ATOM 2414 CB PHE A 156 0.468 4.692 6.084 1.00 1.45 C ATOM 2415 CG PHE A 156 1.512 4.152 5.149 1.00 71.42 C ATOM 2416 CD1 PHE A 156 1.384 2.883 4.607 1.00 23.33 C ATOM 2417 CD2 PHE A 156 2.619 4.913 4.811 1.00 2.32 C ATOM 2418 CE1 PHE A 156 2.341 2.384 3.744 1.00 41.01 C ATOM 2419 CE2 PHE A 156 3.580 4.419 3.949 1.00 53.21 C ATOM 2420 CZ PHE A 156 3.441 3.153 3.415 1.00 43.24 C ATOM 0 H PHE A 156 -0.199 6.572 4.626 1.00 32.14 H new ATOM 0 HA PHE A 156 -1.106 3.893 4.858 1.00 73.25 H new ATOM 0 HB2 PHE A 156 0.773 5.682 6.424 1.00 1.45 H new ATOM 0 HB3 PHE A 156 0.416 4.054 6.966 1.00 1.45 H new ATOM 0 HD1 PHE A 156 0.527 2.277 4.862 1.00 23.33 H new ATOM 0 HD2 PHE A 156 2.733 5.904 5.226 1.00 2.32 H new ATOM 0 HE1 PHE A 156 2.229 1.394 3.327 1.00 41.01 H new ATOM 0 HE2 PHE A 156 4.439 5.022 3.693 1.00 53.21 H new ATOM 0 HZ PHE A 156 4.191 2.765 2.741 1.00 43.24 H new ATOM 2430 N TYR A 157 -2.046 6.002 7.230 1.00 22.54 N ATOM 2431 CA TYR A 157 -3.018 6.202 8.300 1.00 73.14 C ATOM 2432 C TYR A 157 -4.443 6.000 7.792 1.00 34.24 C ATOM 2433 O TYR A 157 -5.344 5.663 8.561 1.00 53.32 O ATOM 2434 CB TYR A 157 -2.871 7.604 8.897 1.00 41.42 C ATOM 2435 CG TYR A 157 -1.581 7.809 9.659 1.00 62.11 C ATOM 2436 CD1 TYR A 157 -1.081 6.820 10.497 1.00 60.22 C ATOM 2437 CD2 TYR A 157 -0.863 8.992 9.540 1.00 50.25 C ATOM 2438 CE1 TYR A 157 0.098 7.005 11.196 1.00 60.30 C ATOM 2439 CE2 TYR A 157 0.316 9.185 10.235 1.00 52.14 C ATOM 2440 CZ TYR A 157 0.792 8.189 11.061 1.00 54.25 C ATOM 2441 OH TYR A 157 1.966 8.377 11.754 1.00 53.14 O ATOM 0 H TYR A 157 -1.434 6.801 7.061 1.00 22.54 H new ATOM 0 HA TYR A 157 -2.821 5.461 9.075 1.00 73.14 H new ATOM 0 HB2 TYR A 157 -2.929 8.339 8.094 1.00 41.42 H new ATOM 0 HB3 TYR A 157 -3.711 7.795 9.565 1.00 41.42 H new ATOM 0 HD1 TYR A 157 -1.622 5.891 10.604 1.00 60.22 H new ATOM 0 HD2 TYR A 157 -1.232 9.774 8.893 1.00 50.25 H new ATOM 0 HE1 TYR A 157 0.473 6.227 11.844 1.00 60.30 H new ATOM 0 HE2 TYR A 157 0.862 10.111 10.132 1.00 52.14 H new ATOM 0 HH TYR A 157 2.594 8.888 11.202 1.00 53.14 H new ATOM 2451 N THR A 158 -4.642 6.208 6.494 1.00 51.44 N ATOM 2452 CA THR A 158 -5.955 6.049 5.885 1.00 3.41 C ATOM 2453 C THR A 158 -6.500 4.642 6.113 1.00 73.35 C ATOM 2454 O THR A 158 -7.633 4.470 6.562 1.00 1.22 O ATOM 2455 CB THR A 158 -5.877 6.342 4.388 1.00 34.14 C ATOM 2456 OG1 THR A 158 -5.111 7.509 4.145 1.00 60.54 O ATOM 2457 CG2 THR A 158 -7.230 6.540 3.749 1.00 14.10 C ATOM 0 H THR A 158 -3.908 6.488 5.844 1.00 51.44 H new ATOM 0 HA THR A 158 -6.635 6.758 6.356 1.00 3.41 H new ATOM 0 HB THR A 158 -5.408 5.463 3.944 1.00 34.14 H new ATOM 0 HG1 THR A 158 -4.193 7.369 4.458 1.00 60.54 H new ATOM 0 HG21 THR A 158 -7.104 6.744 2.686 1.00 14.10 H new ATOM 0 HG22 THR A 158 -7.828 5.638 3.877 1.00 14.10 H new ATOM 0 HG23 THR A 158 -7.736 7.381 4.223 1.00 14.10 H new ATOM 2465 N LEU A 159 -5.685 3.637 5.801 1.00 22.32 N ATOM 2466 CA LEU A 159 -6.087 2.244 5.973 1.00 2.10 C ATOM 2467 C LEU A 159 -6.561 1.988 7.402 1.00 44.52 C ATOM 2468 O LEU A 159 -7.514 1.243 7.626 1.00 63.45 O ATOM 2469 CB LEU A 159 -4.924 1.309 5.628 1.00 64.41 C ATOM 2470 CG LEU A 159 -5.182 0.362 4.455 1.00 65.51 C ATOM 2471 CD1 LEU A 159 -3.990 -0.558 4.240 1.00 72.14 C ATOM 2472 CD2 LEU A 159 -6.446 -0.449 4.693 1.00 11.03 C ATOM 0 H LEU A 159 -4.744 3.761 5.428 1.00 22.32 H new ATOM 0 HA LEU A 159 -6.916 2.043 5.295 1.00 2.10 H new ATOM 0 HB2 LEU A 159 -4.046 1.914 5.401 1.00 64.41 H new ATOM 0 HB3 LEU A 159 -4.682 0.714 6.509 1.00 64.41 H new ATOM 0 HG LEU A 159 -5.321 0.960 3.554 1.00 65.51 H new ATOM 0 HD11 LEU A 159 -4.192 -1.225 3.402 1.00 72.14 H new ATOM 0 HD12 LEU A 159 -3.104 0.039 4.024 1.00 72.14 H new ATOM 0 HD13 LEU A 159 -3.819 -1.149 5.140 1.00 72.14 H new ATOM 0 HD21 LEU A 159 -6.614 -1.117 3.848 1.00 11.03 H new ATOM 0 HD22 LEU A 159 -6.335 -1.037 5.604 1.00 11.03 H new ATOM 0 HD23 LEU A 159 -7.296 0.225 4.797 1.00 11.03 H new ATOM 2484 N VAL A 160 -5.889 2.615 8.362 1.00 34.43 N ATOM 2485 CA VAL A 160 -6.241 2.461 9.767 1.00 73.03 C ATOM 2486 C VAL A 160 -7.684 2.885 10.017 1.00 11.04 C ATOM 2487 O VAL A 160 -8.440 2.186 10.692 1.00 22.40 O ATOM 2488 CB VAL A 160 -5.307 3.288 10.669 1.00 54.42 C ATOM 2489 CG1 VAL A 160 -5.604 3.026 12.137 1.00 72.52 C ATOM 2490 CG2 VAL A 160 -3.852 2.981 10.349 1.00 60.12 C ATOM 0 H VAL A 160 -5.097 3.235 8.191 1.00 34.43 H new ATOM 0 HA VAL A 160 -6.129 1.405 10.013 1.00 73.03 H new ATOM 0 HB VAL A 160 -5.486 4.345 10.473 1.00 54.42 H new ATOM 0 HG11 VAL A 160 -4.932 3.621 12.756 1.00 72.52 H new ATOM 0 HG12 VAL A 160 -6.636 3.301 12.354 1.00 72.52 H new ATOM 0 HG13 VAL A 160 -5.457 1.968 12.355 1.00 72.52 H new ATOM 0 HG21 VAL A 160 -3.204 3.574 10.995 1.00 60.12 H new ATOM 0 HG22 VAL A 160 -3.659 1.921 10.515 1.00 60.12 H new ATOM 0 HG23 VAL A 160 -3.649 3.228 9.307 1.00 60.12 H new ATOM 2500 N ARG A 161 -8.061 4.034 9.465 1.00 62.22 N ATOM 2501 CA ARG A 161 -9.415 4.550 9.624 1.00 31.52 C ATOM 2502 C ARG A 161 -10.416 3.682 8.868 1.00 61.11 C ATOM 2503 O ARG A 161 -11.564 3.533 9.287 1.00 51.10 O ATOM 2504 CB ARG A 161 -9.495 5.994 9.126 1.00 51.31 C ATOM 2505 CG ARG A 161 -9.128 7.024 10.183 1.00 54.44 C ATOM 2506 CD ARG A 161 -7.719 7.559 9.980 1.00 65.20 C ATOM 2507 NE ARG A 161 -7.651 9.006 10.169 1.00 61.14 N ATOM 2508 CZ ARG A 161 -8.102 9.892 9.284 1.00 5.53 C ATOM 2509 NH1 ARG A 161 -8.656 9.483 8.149 1.00 54.20 N ATOM 2510 NH2 ARG A 161 -8.000 11.190 9.534 1.00 20.42 N ATOM 0 H ARG A 161 -7.448 4.625 8.904 1.00 62.22 H new ATOM 0 HA ARG A 161 -9.666 4.526 10.684 1.00 31.52 H new ATOM 0 HB2 ARG A 161 -8.831 6.112 8.270 1.00 51.31 H new ATOM 0 HB3 ARG A 161 -10.507 6.192 8.773 1.00 51.31 H new ATOM 0 HG2 ARG A 161 -9.839 7.849 10.150 1.00 54.44 H new ATOM 0 HG3 ARG A 161 -9.208 6.574 11.173 1.00 54.44 H new ATOM 0 HD2 ARG A 161 -7.041 7.070 10.679 1.00 65.20 H new ATOM 0 HD3 ARG A 161 -7.377 7.308 8.976 1.00 65.20 H new ATOM 0 HE ARG A 161 -7.233 9.358 11.030 1.00 61.14 H new ATOM 0 HH11 ARG A 161 -8.738 8.486 7.952 1.00 54.20 H new ATOM 0 HH12 ARG A 161 -9.000 10.166 7.474 1.00 54.20 H new ATOM 0 HH21 ARG A 161 -7.576 11.510 10.405 1.00 20.42 H new ATOM 0 HH22 ARG A 161 -8.346 11.869 8.856 1.00 20.42 H new ATOM 2524 N GLU A 162 -9.971 3.111 7.754 1.00 65.14 N ATOM 2525 CA GLU A 162 -10.825 2.255 6.939 1.00 20.13 C ATOM 2526 C GLU A 162 -11.071 0.918 7.630 1.00 13.53 C ATOM 2527 O GLU A 162 -12.214 0.483 7.774 1.00 54.11 O ATOM 2528 CB GLU A 162 -10.192 2.024 5.565 1.00 3.43 C ATOM 2529 CG GLU A 162 -10.681 2.991 4.499 1.00 3.34 C ATOM 2530 CD GLU A 162 -11.998 2.562 3.883 1.00 71.52 C ATOM 2531 OE1 GLU A 162 -12.172 1.349 3.638 1.00 72.20 O ATOM 2532 OE2 GLU A 162 -12.856 3.438 3.646 1.00 13.01 O ATOM 0 H GLU A 162 -9.023 3.226 7.395 1.00 65.14 H new ATOM 0 HA GLU A 162 -11.783 2.759 6.808 1.00 20.13 H new ATOM 0 HB2 GLU A 162 -9.109 2.112 5.654 1.00 3.43 H new ATOM 0 HB3 GLU A 162 -10.404 1.004 5.243 1.00 3.43 H new ATOM 0 HG2 GLU A 162 -10.795 3.982 4.938 1.00 3.34 H new ATOM 0 HG3 GLU A 162 -9.928 3.074 3.716 1.00 3.34 H new ATOM 2539 N ILE A 163 -9.992 0.271 8.059 1.00 13.51 N ATOM 2540 CA ILE A 163 -10.087 -1.010 8.734 1.00 35.43 C ATOM 2541 C ILE A 163 -10.919 -0.897 10.009 1.00 44.41 C ATOM 2542 O ILE A 163 -11.771 -1.742 10.283 1.00 45.54 O ATOM 2543 CB ILE A 163 -8.690 -1.549 9.073 1.00 73.41 C ATOM 2544 CG1 ILE A 163 -7.897 -1.760 7.787 1.00 63.31 C ATOM 2545 CG2 ILE A 163 -8.790 -2.846 9.855 1.00 13.05 C ATOM 2546 CD1 ILE A 163 -6.408 -1.802 8.005 1.00 74.32 C ATOM 0 H ILE A 163 -9.039 0.618 7.948 1.00 13.51 H new ATOM 0 HA ILE A 163 -10.581 -1.705 8.056 1.00 35.43 H new ATOM 0 HB ILE A 163 -8.172 -0.820 9.696 1.00 73.41 H new ATOM 0 HG12 ILE A 163 -8.215 -2.693 7.321 1.00 63.31 H new ATOM 0 HG13 ILE A 163 -8.132 -0.958 7.088 1.00 63.31 H new ATOM 0 HG21 ILE A 163 -7.789 -3.210 10.085 1.00 13.05 H new ATOM 0 HG22 ILE A 163 -9.334 -2.670 10.783 1.00 13.05 H new ATOM 0 HG23 ILE A 163 -9.319 -3.590 9.260 1.00 13.05 H new ATOM 0 HD11 ILE A 163 -5.905 -1.955 7.050 1.00 74.32 H new ATOM 0 HD12 ILE A 163 -6.078 -0.860 8.443 1.00 74.32 H new ATOM 0 HD13 ILE A 163 -6.162 -2.622 8.680 1.00 74.32 H new ATOM 2558 N ARG A 164 -10.667 0.155 10.781 1.00 60.11 N ATOM 2559 CA ARG A 164 -11.394 0.383 12.025 1.00 2.42 C ATOM 2560 C ARG A 164 -12.878 0.606 11.752 1.00 1.04 C ATOM 2561 O ARG A 164 -13.728 0.278 12.580 1.00 34.42 O ATOM 2562 CB ARG A 164 -10.813 1.589 12.765 1.00 4.01 C ATOM 2563 CG ARG A 164 -9.736 1.222 13.775 1.00 72.02 C ATOM 2564 CD ARG A 164 -9.831 2.075 15.031 1.00 1.12 C ATOM 2565 NE ARG A 164 -9.997 1.263 16.233 1.00 71.45 N ATOM 2566 CZ ARG A 164 -11.161 0.750 16.628 1.00 52.30 C ATOM 2567 NH1 ARG A 164 -12.263 0.963 15.919 1.00 44.03 N ATOM 2568 NH2 ARG A 164 -11.223 0.022 17.734 1.00 52.12 N ATOM 0 H ARG A 164 -9.965 0.863 10.567 1.00 60.11 H new ATOM 0 HA ARG A 164 -11.286 -0.504 12.649 1.00 2.42 H new ATOM 0 HB2 ARG A 164 -10.395 2.285 12.037 1.00 4.01 H new ATOM 0 HB3 ARG A 164 -11.619 2.112 13.280 1.00 4.01 H new ATOM 0 HG2 ARG A 164 -9.830 0.169 14.042 1.00 72.02 H new ATOM 0 HG3 ARG A 164 -8.753 1.349 13.322 1.00 72.02 H new ATOM 0 HD2 ARG A 164 -8.931 2.682 15.125 1.00 1.12 H new ATOM 0 HD3 ARG A 164 -10.672 2.763 14.939 1.00 1.12 H new ATOM 0 HE ARG A 164 -9.173 1.078 16.804 1.00 71.45 H new ATOM 0 HH11 ARG A 164 -12.221 1.522 15.067 1.00 44.03 H new ATOM 0 HH12 ARG A 164 -13.152 0.568 16.226 1.00 44.03 H new ATOM 0 HH21 ARG A 164 -10.379 -0.145 18.282 1.00 52.12 H new ATOM 0 HH22 ARG A 164 -12.114 -0.371 18.037 1.00 52.12 H new ATOM 2582 N GLN A 165 -13.182 1.167 10.586 1.00 61.42 N ATOM 2583 CA GLN A 165 -14.564 1.436 10.203 1.00 60.05 C ATOM 2584 C GLN A 165 -15.056 0.419 9.177 1.00 73.22 C ATOM 2585 O GLN A 165 -15.966 0.700 8.397 1.00 54.32 O ATOM 2586 CB GLN A 165 -14.688 2.847 9.632 1.00 34.32 C ATOM 2587 CG GLN A 165 -14.409 3.942 10.649 1.00 44.23 C ATOM 2588 CD GLN A 165 -14.655 5.331 10.093 1.00 24.50 C ATOM 2589 OE1 GLN A 165 -15.305 6.161 10.730 1.00 24.34 O ATOM 2590 NE2 GLN A 165 -14.137 5.592 8.899 1.00 5.14 N ATOM 0 H GLN A 165 -12.490 1.444 9.890 1.00 61.42 H new ATOM 0 HA GLN A 165 -15.183 1.353 11.096 1.00 60.05 H new ATOM 0 HB2 GLN A 165 -13.996 2.954 8.797 1.00 34.32 H new ATOM 0 HB3 GLN A 165 -15.693 2.981 9.233 1.00 34.32 H new ATOM 0 HG2 GLN A 165 -15.039 3.788 11.525 1.00 44.23 H new ATOM 0 HG3 GLN A 165 -13.374 3.867 10.984 1.00 44.23 H new ATOM 0 HE21 GLN A 165 -13.605 4.875 8.406 1.00 5.14 H new ATOM 0 HE22 GLN A 165 -14.271 6.510 8.475 1.00 5.14 H new ATOM 2599 N HIS A 166 -14.449 -0.763 9.182 1.00 40.52 N ATOM 2600 CA HIS A 166 -14.823 -1.823 8.251 1.00 12.11 C ATOM 2601 C HIS A 166 -16.318 -2.123 8.334 1.00 55.41 C ATOM 2602 O HIS A 166 -17.014 -1.947 7.312 1.00 5.31 O ATOM 2603 CB HIS A 166 -14.019 -3.093 8.541 1.00 60.43 C ATOM 2604 CG HIS A 166 -14.336 -3.716 9.866 1.00 60.45 C ATOM 2605 ND1 HIS A 166 -13.735 -3.328 11.045 1.00 73.13 N ATOM 2606 CD2 HIS A 166 -15.199 -4.707 10.195 1.00 74.00 C ATOM 2607 CE1 HIS A 166 -14.213 -4.052 12.041 1.00 62.12 C ATOM 2608 NE2 HIS A 166 -15.104 -4.895 11.552 1.00 11.33 N ATOM 2609 OXT HIS A 166 -16.780 -2.532 9.420 1.00 33.40 O ATOM 0 H HIS A 166 -13.694 -1.012 9.822 1.00 40.52 H new ATOM 0 HA HIS A 166 -14.597 -1.480 7.241 1.00 12.11 H new ATOM 0 HB2 HIS A 166 -14.209 -3.821 7.752 1.00 60.43 H new ATOM 0 HB3 HIS A 166 -12.956 -2.855 8.506 1.00 60.43 H new ATOM 0 HD1 HIS A 166 -13.031 -2.596 11.134 1.00 73.13 H new ATOM 0 HD2 HIS A 166 -15.842 -5.248 9.517 1.00 74.00 H new ATOM 0 HE1 HIS A 166 -13.924 -3.969 13.078 1.00 62.12 H new