USER MOD reduce.3.24.130724 H: found=0, std=0, add=1160, rem=0, adj=35 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 127 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 141 TYR OH : rot 180:sc= -0.0359 USER MOD Set 2.1: A 94 HIS : no HE2:sc= 0.472 K(o=-1,f=-7.9!) USER MOD Set 2.2: A 137 TYR OH : rot -17:sc= -1.49! USER MOD Set 3.1: A 87 THR OG1 : rot 180:sc= 0.0567 USER MOD Set 3.2: A 124 THR OG1 : rot 180:sc= -0.595 USER MOD Set 4.1: A 16 LYS NZ :NH3+ -173:sc= -0.0722 (180deg=-0.0979) USER MOD Set 4.2: A 58 THR OG1 : rot 180:sc= 0.00573 USER MOD Single : A 1 MET CE :methyl -152:sc= -0.413 (180deg=-1.58!) USER MOD Single : A 1 MET N :NH3+ -121:sc= 1.39 (180deg=-0.17) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0.0731 USER MOD Single : A 20 THR OG1 : rot 83:sc= 0.346 USER MOD Single : A 22 GLN : amide:sc= -0.897 K(o=-0.9,f=-3.4!) USER MOD Single : A 25 GLN : amide:sc= -1.21 K(o=-1.2,f=-2.4) USER MOD Single : A 40 TYR OH : rot 180:sc= -0.812 USER MOD Single : A 42 LYS NZ :NH3+ -165:sc= 0.567 (180deg=0.362) USER MOD Single : A 43 GLN : amide:sc= -0.782 K(o=-0.78,f=-4.9!) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 2:sc= -1.39 USER MOD Single : A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 GLN : amide:sc= -3.67 K(o=-3.7,f=-6.7!) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl -159:sc= -1.46! (180deg=-2.21!) USER MOD Single : A 74 THR OG1 : rot -1:sc= -0.976 USER MOD Single : A 80 CYS SG : rot 180:sc= -0.0212 USER MOD Single : A 85 ASN : amide:sc= -2.62 K(o=-2.6,f=-7.2!) USER MOD Single : A 86 ASN : amide:sc= -0.211 K(o=-0.21,f=-2.2!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot -88:sc= 0.657 USER MOD Single : A 95 GLN : amide:sc= -0.907 K(o=-0.91,f=-2.6!) USER MOD Single : A 96 TYR OH : rot -86:sc= 1.22 USER MOD Single : A 99 GLN : amide:sc= -0.423 K(o=-0.42,f=-2.1!) USER MOD Single : A 101 LYS NZ :NH3+ -126:sc= 0 (180deg=-1.78!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 55:sc=0.000489 USER MOD Single : A 111 MET CE :methyl -162:sc= -2.92! (180deg=-4.61!) USER MOD Single : A 116 ASN : amide:sc= 0.215 K(o=0.22,f=-12!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 CYS SG : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 SER OG : rot -80:sc= 1.1 USER MOD Single : A 144 THR OG1 : rot 180:sc= 0 USER MOD Single : A 145 SER OG : rot -130:sc= 1.29 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 THR OG1 : rot 146:sc= -1.15 USER MOD Single : A 150 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 THR OG1 : rot -110:sc= -0.0151 USER MOD Single : A 165 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 166 HIS : no HE2:sc= -2.07 K(o=-2.1,f=-2.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -5.408 -2.759 22.549 1.00 72.42 N ATOM 2 CA MET A 1 -5.493 -2.246 21.157 1.00 23.52 C ATOM 3 C MET A 1 -5.512 -3.385 20.147 1.00 44.32 C ATOM 4 O MET A 1 -4.847 -4.405 20.328 1.00 54.40 O ATOM 5 CB MET A 1 -4.295 -1.330 20.899 1.00 1.45 C ATOM 6 CG MET A 1 -2.952 -2.026 21.050 1.00 32.50 C ATOM 7 SD MET A 1 -2.395 -2.095 22.763 1.00 13.54 S ATOM 8 CE MET A 1 -2.323 -0.352 23.165 1.00 11.01 C ATOM 0 H1 MET A 1 -6.232 -2.429 23.092 1.00 72.42 H new ATOM 0 H2 MET A 1 -5.396 -3.799 22.536 1.00 72.42 H new ATOM 0 H3 MET A 1 -4.536 -2.409 22.995 1.00 72.42 H new ATOM 0 HA MET A 1 -6.423 -1.690 21.039 1.00 23.52 H new ATOM 0 HB2 MET A 1 -4.371 -0.921 19.891 1.00 1.45 H new ATOM 0 HB3 MET A 1 -4.338 -0.487 21.589 1.00 1.45 H new ATOM 0 HG2 MET A 1 -3.026 -3.039 20.655 1.00 32.50 H new ATOM 0 HG3 MET A 1 -2.207 -1.503 20.450 1.00 32.50 H new ATOM 0 HE1 MET A 1 -1.571 -0.187 23.937 1.00 11.01 H new ATOM 0 HE2 MET A 1 -2.058 0.216 22.273 1.00 11.01 H new ATOM 0 HE3 MET A 1 -3.296 -0.022 23.530 1.00 11.01 H new ATOM 18 N THR A 2 -6.284 -3.200 19.085 1.00 41.42 N ATOM 19 CA THR A 2 -6.405 -4.203 18.038 1.00 73.35 C ATOM 20 C THR A 2 -5.185 -4.177 17.117 1.00 61.22 C ATOM 21 O THR A 2 -4.602 -3.122 16.871 1.00 3.31 O ATOM 22 CB THR A 2 -7.697 -3.968 17.246 1.00 72.31 C ATOM 23 OG1 THR A 2 -8.689 -4.906 17.620 1.00 1.12 O ATOM 24 CG2 THR A 2 -7.523 -4.065 15.748 1.00 21.25 C ATOM 0 H THR A 2 -6.839 -2.359 18.926 1.00 41.42 H new ATOM 0 HA THR A 2 -6.449 -5.191 18.497 1.00 73.35 H new ATOM 0 HB THR A 2 -7.995 -2.948 17.490 1.00 72.31 H new ATOM 0 HG1 THR A 2 -9.507 -4.740 17.106 1.00 1.12 H new ATOM 0 HG21 THR A 2 -8.480 -3.887 15.258 1.00 21.25 H new ATOM 0 HG22 THR A 2 -6.801 -3.318 15.416 1.00 21.25 H new ATOM 0 HG23 THR A 2 -7.162 -5.060 15.487 1.00 21.25 H new ATOM 32 N GLU A 3 -4.810 -5.348 16.610 1.00 71.42 N ATOM 33 CA GLU A 3 -3.666 -5.463 15.714 1.00 1.31 C ATOM 34 C GLU A 3 -4.123 -5.495 14.259 1.00 12.45 C ATOM 35 O GLU A 3 -4.969 -6.305 13.882 1.00 72.42 O ATOM 36 CB GLU A 3 -2.860 -6.723 16.042 1.00 44.13 C ATOM 37 CG GLU A 3 -1.384 -6.455 16.283 1.00 50.34 C ATOM 38 CD GLU A 3 -0.546 -7.718 16.229 1.00 12.33 C ATOM 39 OE1 GLU A 3 -0.652 -8.541 17.163 1.00 11.34 O ATOM 40 OE2 GLU A 3 0.218 -7.883 15.255 1.00 44.14 O ATOM 0 H GLU A 3 -5.283 -6.231 16.805 1.00 71.42 H new ATOM 0 HA GLU A 3 -3.029 -4.590 15.857 1.00 1.31 H new ATOM 0 HB2 GLU A 3 -3.284 -7.195 16.928 1.00 44.13 H new ATOM 0 HB3 GLU A 3 -2.963 -7.434 15.222 1.00 44.13 H new ATOM 0 HG2 GLU A 3 -1.020 -5.749 15.536 1.00 50.34 H new ATOM 0 HG3 GLU A 3 -1.259 -5.981 17.257 1.00 50.34 H new ATOM 47 N TYR A 4 -3.560 -4.605 13.447 1.00 42.24 N ATOM 48 CA TYR A 4 -3.914 -4.530 12.035 1.00 4.22 C ATOM 49 C TYR A 4 -2.702 -4.798 11.150 1.00 65.23 C ATOM 50 O TYR A 4 -1.672 -4.136 11.273 1.00 33.42 O ATOM 51 CB TYR A 4 -4.503 -3.156 11.711 1.00 73.31 C ATOM 52 CG TYR A 4 -5.927 -2.979 12.188 1.00 51.40 C ATOM 53 CD1 TYR A 4 -6.938 -3.822 11.744 1.00 62.14 C ATOM 54 CD2 TYR A 4 -6.260 -1.970 13.083 1.00 43.53 C ATOM 55 CE1 TYR A 4 -8.241 -3.664 12.177 1.00 33.12 C ATOM 56 CE2 TYR A 4 -7.560 -1.805 13.521 1.00 42.31 C ATOM 57 CZ TYR A 4 -8.547 -2.654 13.065 1.00 22.02 C ATOM 58 OH TYR A 4 -9.843 -2.494 13.499 1.00 50.01 O ATOM 0 H TYR A 4 -2.858 -3.927 13.743 1.00 42.24 H new ATOM 0 HA TYR A 4 -4.661 -5.298 11.833 1.00 4.22 H new ATOM 0 HB2 TYR A 4 -3.879 -2.386 12.165 1.00 73.31 H new ATOM 0 HB3 TYR A 4 -4.468 -3.000 10.633 1.00 73.31 H new ATOM 0 HD1 TYR A 4 -6.702 -4.614 11.049 1.00 62.14 H new ATOM 0 HD2 TYR A 4 -5.490 -1.303 13.442 1.00 43.53 H new ATOM 0 HE1 TYR A 4 -9.015 -4.328 11.822 1.00 33.12 H new ATOM 0 HE2 TYR A 4 -7.802 -1.015 14.217 1.00 42.31 H new ATOM 0 HH TYR A 4 -9.889 -1.739 14.122 1.00 50.01 H new ATOM 68 N LYS A 5 -2.835 -5.770 10.254 1.00 31.32 N ATOM 69 CA LYS A 5 -1.755 -6.125 9.342 1.00 12.44 C ATOM 70 C LYS A 5 -2.001 -5.531 7.959 1.00 73.32 C ATOM 71 O LYS A 5 -2.863 -5.999 7.216 1.00 42.42 O ATOM 72 CB LYS A 5 -1.621 -7.645 9.243 1.00 74.23 C ATOM 73 CG LYS A 5 -0.627 -8.233 10.232 1.00 31.11 C ATOM 74 CD LYS A 5 0.748 -8.403 9.606 1.00 52.13 C ATOM 75 CE LYS A 5 1.272 -9.817 9.792 1.00 65.11 C ATOM 76 NZ LYS A 5 1.757 -10.049 11.181 1.00 11.32 N ATOM 0 H LYS A 5 -3.682 -6.327 10.140 1.00 31.32 H new ATOM 0 HA LYS A 5 -0.826 -5.713 9.736 1.00 12.44 H new ATOM 0 HB2 LYS A 5 -2.598 -8.099 9.409 1.00 74.23 H new ATOM 0 HB3 LYS A 5 -1.314 -7.909 8.231 1.00 74.23 H new ATOM 0 HG2 LYS A 5 -0.553 -7.584 11.104 1.00 31.11 H new ATOM 0 HG3 LYS A 5 -0.990 -9.199 10.583 1.00 31.11 H new ATOM 0 HD2 LYS A 5 0.696 -8.170 8.543 1.00 52.13 H new ATOM 0 HD3 LYS A 5 1.444 -7.694 10.055 1.00 52.13 H new ATOM 0 HE2 LYS A 5 0.482 -10.531 9.559 1.00 65.11 H new ATOM 0 HE3 LYS A 5 2.084 -9.999 9.088 1.00 65.11 H new ATOM 0 HZ1 LYS A 5 2.106 -11.025 11.268 1.00 11.32 H new ATOM 0 HZ2 LYS A 5 2.528 -9.385 11.395 1.00 11.32 H new ATOM 0 HZ3 LYS A 5 0.976 -9.900 11.851 1.00 11.32 H new ATOM 90 N LEU A 6 -1.241 -4.494 7.622 1.00 33.51 N ATOM 91 CA LEU A 6 -1.382 -3.833 6.330 1.00 4.04 C ATOM 92 C LEU A 6 -0.345 -4.346 5.336 1.00 63.51 C ATOM 93 O LEU A 6 0.843 -4.047 5.453 1.00 45.42 O ATOM 94 CB LEU A 6 -1.243 -2.319 6.495 1.00 15.13 C ATOM 95 CG LEU A 6 -2.110 -1.708 7.596 1.00 24.01 C ATOM 96 CD1 LEU A 6 -1.831 -0.220 7.732 1.00 60.33 C ATOM 97 CD2 LEU A 6 -3.584 -1.954 7.307 1.00 12.14 C ATOM 0 H LEU A 6 -0.522 -4.094 8.225 1.00 33.51 H new ATOM 0 HA LEU A 6 -2.373 -4.062 5.939 1.00 4.04 H new ATOM 0 HB2 LEU A 6 -0.199 -2.085 6.704 1.00 15.13 H new ATOM 0 HB3 LEU A 6 -1.494 -1.841 5.548 1.00 15.13 H new ATOM 0 HG LEU A 6 -1.859 -2.189 8.541 1.00 24.01 H new ATOM 0 HD11 LEU A 6 -2.458 0.197 8.520 1.00 60.33 H new ATOM 0 HD12 LEU A 6 -0.781 -0.068 7.984 1.00 60.33 H new ATOM 0 HD13 LEU A 6 -2.054 0.280 6.789 1.00 60.33 H new ATOM 0 HD21 LEU A 6 -4.189 -1.513 8.100 1.00 12.14 H new ATOM 0 HD22 LEU A 6 -3.849 -1.499 6.353 1.00 12.14 H new ATOM 0 HD23 LEU A 6 -3.772 -3.027 7.261 1.00 12.14 H new ATOM 109 N VAL A 7 -0.804 -5.117 4.355 1.00 30.31 N ATOM 110 CA VAL A 7 0.082 -5.668 3.340 1.00 64.45 C ATOM 111 C VAL A 7 0.279 -4.681 2.194 1.00 34.04 C ATOM 112 O VAL A 7 -0.589 -4.532 1.333 1.00 51.12 O ATOM 113 CB VAL A 7 -0.472 -6.991 2.779 1.00 43.13 C ATOM 114 CG1 VAL A 7 0.498 -7.596 1.779 1.00 23.53 C ATOM 115 CG2 VAL A 7 -0.763 -7.969 3.908 1.00 41.11 C ATOM 0 H VAL A 7 -1.785 -5.373 4.243 1.00 30.31 H new ATOM 0 HA VAL A 7 1.042 -5.859 3.819 1.00 64.45 H new ATOM 0 HB VAL A 7 -1.407 -6.780 2.260 1.00 43.13 H new ATOM 0 HG11 VAL A 7 0.088 -8.530 1.394 1.00 23.53 H new ATOM 0 HG12 VAL A 7 0.652 -6.900 0.954 1.00 23.53 H new ATOM 0 HG13 VAL A 7 1.451 -7.793 2.270 1.00 23.53 H new ATOM 0 HG21 VAL A 7 -1.154 -8.898 3.493 1.00 41.11 H new ATOM 0 HG22 VAL A 7 0.156 -8.175 4.457 1.00 41.11 H new ATOM 0 HG23 VAL A 7 -1.500 -7.535 4.584 1.00 41.11 H new ATOM 125 N VAL A 8 1.425 -4.008 2.190 1.00 43.44 N ATOM 126 CA VAL A 8 1.736 -3.035 1.154 1.00 62.22 C ATOM 127 C VAL A 8 2.310 -3.714 -0.086 1.00 4.02 C ATOM 128 O VAL A 8 3.112 -4.642 0.017 1.00 2.31 O ATOM 129 CB VAL A 8 2.739 -1.983 1.664 1.00 61.41 C ATOM 130 CG1 VAL A 8 2.983 -0.919 0.608 1.00 41.22 C ATOM 131 CG2 VAL A 8 2.241 -1.355 2.957 1.00 63.25 C ATOM 0 H VAL A 8 2.154 -4.120 2.895 1.00 43.44 H new ATOM 0 HA VAL A 8 0.802 -2.540 0.889 1.00 62.22 H new ATOM 0 HB VAL A 8 3.686 -2.482 1.868 1.00 61.41 H new ATOM 0 HG11 VAL A 8 3.694 -0.186 0.988 1.00 41.22 H new ATOM 0 HG12 VAL A 8 3.387 -1.384 -0.291 1.00 41.22 H new ATOM 0 HG13 VAL A 8 2.043 -0.422 0.368 1.00 41.22 H new ATOM 0 HG21 VAL A 8 2.962 -0.614 3.303 1.00 63.25 H new ATOM 0 HG22 VAL A 8 1.280 -0.871 2.780 1.00 63.25 H new ATOM 0 HG23 VAL A 8 2.123 -2.129 3.716 1.00 63.25 H new ATOM 141 N VAL A 9 1.892 -3.243 -1.256 1.00 2.15 N ATOM 142 CA VAL A 9 2.363 -3.799 -2.518 1.00 74.02 C ATOM 143 C VAL A 9 2.658 -2.693 -3.524 1.00 20.34 C ATOM 144 O VAL A 9 2.126 -1.589 -3.419 1.00 72.45 O ATOM 145 CB VAL A 9 1.333 -4.768 -3.127 1.00 45.23 C ATOM 146 CG1 VAL A 9 1.203 -6.018 -2.271 1.00 22.35 C ATOM 147 CG2 VAL A 9 -0.014 -4.081 -3.291 1.00 14.51 C ATOM 0 H VAL A 9 1.227 -2.476 -1.356 1.00 2.15 H new ATOM 0 HA VAL A 9 3.279 -4.348 -2.300 1.00 74.02 H new ATOM 0 HB VAL A 9 1.684 -5.069 -4.114 1.00 45.23 H new ATOM 0 HG11 VAL A 9 0.471 -6.690 -2.718 1.00 22.35 H new ATOM 0 HG12 VAL A 9 2.168 -6.521 -2.212 1.00 22.35 H new ATOM 0 HG13 VAL A 9 0.877 -5.740 -1.269 1.00 22.35 H new ATOM 0 HG21 VAL A 9 -0.729 -4.781 -3.723 1.00 14.51 H new ATOM 0 HG22 VAL A 9 -0.374 -3.749 -2.317 1.00 14.51 H new ATOM 0 HG23 VAL A 9 0.095 -3.220 -3.951 1.00 14.51 H new ATOM 157 N GLY A 10 3.509 -2.996 -4.499 1.00 24.13 N ATOM 158 CA GLY A 10 3.858 -2.013 -5.508 1.00 5.11 C ATOM 159 C GLY A 10 4.842 -2.550 -6.528 1.00 1.14 C ATOM 160 O GLY A 10 5.301 -3.686 -6.420 1.00 13.54 O ATOM 0 H GLY A 10 3.962 -3.903 -4.608 1.00 24.13 H new ATOM 0 HA2 GLY A 10 2.953 -1.685 -6.019 1.00 5.11 H new ATOM 0 HA3 GLY A 10 4.286 -1.136 -5.023 1.00 5.11 H new ATOM 164 N ALA A 11 5.165 -1.729 -7.523 1.00 52.31 N ATOM 165 CA ALA A 11 6.100 -2.125 -8.569 1.00 0.01 C ATOM 166 C ALA A 11 7.506 -1.610 -8.277 1.00 25.12 C ATOM 167 O ALA A 11 8.311 -1.428 -9.190 1.00 75.41 O ATOM 168 CB ALA A 11 5.621 -1.618 -9.921 1.00 31.14 C ATOM 0 H ALA A 11 4.792 -0.785 -7.626 1.00 52.31 H new ATOM 0 HA ALA A 11 6.140 -3.214 -8.592 1.00 0.01 H new ATOM 0 HB1 ALA A 11 6.328 -1.920 -10.694 1.00 31.14 H new ATOM 0 HB2 ALA A 11 4.640 -2.040 -10.141 1.00 31.14 H new ATOM 0 HB3 ALA A 11 5.551 -0.530 -9.898 1.00 31.14 H new ATOM 174 N GLY A 12 7.796 -1.378 -7.000 1.00 21.32 N ATOM 175 CA GLY A 12 9.107 -0.888 -6.616 1.00 15.43 C ATOM 176 C GLY A 12 9.262 0.603 -6.849 1.00 22.32 C ATOM 177 O GLY A 12 9.174 1.396 -5.912 1.00 74.23 O ATOM 0 H GLY A 12 7.147 -1.520 -6.226 1.00 21.32 H new ATOM 0 HA2 GLY A 12 9.279 -1.107 -5.562 1.00 15.43 H new ATOM 0 HA3 GLY A 12 9.871 -1.422 -7.181 1.00 15.43 H new ATOM 181 N GLY A 13 9.497 0.984 -8.101 1.00 62.50 N ATOM 182 CA GLY A 13 9.663 2.388 -8.433 1.00 13.41 C ATOM 183 C GLY A 13 8.486 3.238 -7.992 1.00 43.20 C ATOM 184 O GLY A 13 8.625 4.445 -7.795 1.00 4.14 O ATOM 0 H GLY A 13 9.576 0.345 -8.892 1.00 62.50 H new ATOM 0 HA2 GLY A 13 10.573 2.763 -7.964 1.00 13.41 H new ATOM 0 HA3 GLY A 13 9.795 2.489 -9.510 1.00 13.41 H new ATOM 188 N VAL A 14 7.324 2.609 -7.839 1.00 61.34 N ATOM 189 CA VAL A 14 6.119 3.316 -7.420 1.00 34.51 C ATOM 190 C VAL A 14 6.353 4.094 -6.128 1.00 61.32 C ATOM 191 O VAL A 14 5.863 5.212 -5.968 1.00 1.51 O ATOM 192 CB VAL A 14 4.942 2.344 -7.215 1.00 4.53 C ATOM 193 CG1 VAL A 14 4.475 1.782 -8.549 1.00 33.41 C ATOM 194 CG2 VAL A 14 5.335 1.224 -6.264 1.00 3.44 C ATOM 0 H VAL A 14 7.192 1.610 -7.999 1.00 61.34 H new ATOM 0 HA VAL A 14 5.871 4.015 -8.219 1.00 34.51 H new ATOM 0 HB VAL A 14 4.113 2.894 -6.769 1.00 4.53 H new ATOM 0 HG11 VAL A 14 3.643 1.097 -8.384 1.00 33.41 H new ATOM 0 HG12 VAL A 14 4.151 2.598 -9.194 1.00 33.41 H new ATOM 0 HG13 VAL A 14 5.296 1.247 -9.026 1.00 33.41 H new ATOM 0 HG21 VAL A 14 4.491 0.547 -6.131 1.00 3.44 H new ATOM 0 HG22 VAL A 14 6.180 0.674 -6.679 1.00 3.44 H new ATOM 0 HG23 VAL A 14 5.616 1.647 -5.300 1.00 3.44 H new ATOM 204 N GLY A 15 7.106 3.496 -5.210 1.00 42.31 N ATOM 205 CA GLY A 15 7.393 4.150 -3.946 1.00 31.23 C ATOM 206 C GLY A 15 6.503 3.659 -2.820 1.00 73.11 C ATOM 207 O GLY A 15 5.895 4.459 -2.108 1.00 52.03 O ATOM 0 H GLY A 15 7.522 2.571 -5.319 1.00 42.31 H new ATOM 0 HA2 GLY A 15 8.436 3.978 -3.681 1.00 31.23 H new ATOM 0 HA3 GLY A 15 7.266 5.226 -4.061 1.00 31.23 H new ATOM 211 N LYS A 16 6.428 2.342 -2.657 1.00 22.43 N ATOM 212 CA LYS A 16 5.607 1.748 -1.609 1.00 70.01 C ATOM 213 C LYS A 16 6.293 1.862 -0.250 1.00 52.32 C ATOM 214 O LYS A 16 5.632 1.962 0.784 1.00 61.32 O ATOM 215 CB LYS A 16 5.317 0.278 -1.929 1.00 62.04 C ATOM 216 CG LYS A 16 6.549 -0.613 -1.884 1.00 73.54 C ATOM 217 CD LYS A 16 6.392 -1.830 -2.784 1.00 13.23 C ATOM 218 CE LYS A 16 6.592 -3.126 -2.013 1.00 32.13 C ATOM 219 NZ LYS A 16 6.194 -4.317 -2.813 1.00 53.13 N ATOM 0 H LYS A 16 6.926 1.667 -3.237 1.00 22.43 H new ATOM 0 HA LYS A 16 4.665 2.294 -1.566 1.00 70.01 H new ATOM 0 HB2 LYS A 16 4.580 -0.100 -1.220 1.00 62.04 H new ATOM 0 HB3 LYS A 16 4.869 0.213 -2.920 1.00 62.04 H new ATOM 0 HG2 LYS A 16 7.424 -0.041 -2.193 1.00 73.54 H new ATOM 0 HG3 LYS A 16 6.727 -0.938 -0.859 1.00 73.54 H new ATOM 0 HD2 LYS A 16 5.400 -1.824 -3.235 1.00 13.23 H new ATOM 0 HD3 LYS A 16 7.113 -1.776 -3.599 1.00 13.23 H new ATOM 0 HE2 LYS A 16 7.639 -3.217 -1.723 1.00 32.13 H new ATOM 0 HE3 LYS A 16 6.008 -3.095 -1.093 1.00 32.13 H new ATOM 0 HZ1 LYS A 16 6.233 -5.166 -2.214 1.00 53.13 H new ATOM 0 HZ2 LYS A 16 5.225 -4.188 -3.169 1.00 53.13 H new ATOM 0 HZ3 LYS A 16 6.846 -4.430 -3.616 1.00 53.13 H new ATOM 233 N SER A 17 7.623 1.848 -0.260 1.00 31.35 N ATOM 234 CA SER A 17 8.398 1.952 0.972 1.00 64.34 C ATOM 235 C SER A 17 8.386 3.382 1.503 1.00 62.14 C ATOM 236 O SER A 17 8.424 3.607 2.712 1.00 33.21 O ATOM 237 CB SER A 17 9.840 1.494 0.736 1.00 32.22 C ATOM 238 OG SER A 17 9.961 0.793 -0.488 1.00 61.34 O ATOM 0 H SER A 17 8.186 1.766 -1.107 1.00 31.35 H new ATOM 0 HA SER A 17 7.937 1.303 1.716 1.00 64.34 H new ATOM 0 HB2 SER A 17 10.503 2.359 0.729 1.00 32.22 H new ATOM 0 HB3 SER A 17 10.160 0.854 1.558 1.00 32.22 H new ATOM 0 HG SER A 17 10.892 0.514 -0.614 1.00 61.34 H new ATOM 244 N ALA A 18 8.331 4.344 0.587 1.00 34.44 N ATOM 245 CA ALA A 18 8.313 5.755 0.957 1.00 52.51 C ATOM 246 C ALA A 18 7.194 6.051 1.951 1.00 52.55 C ATOM 247 O ALA A 18 7.431 6.620 3.016 1.00 62.44 O ATOM 248 CB ALA A 18 8.162 6.621 -0.285 1.00 14.00 C ATOM 0 H ALA A 18 8.298 4.172 -0.418 1.00 34.44 H new ATOM 0 HA ALA A 18 9.261 5.991 1.440 1.00 52.51 H new ATOM 0 HB1 ALA A 18 8.150 7.672 0.004 1.00 14.00 H new ATOM 0 HB2 ALA A 18 8.999 6.439 -0.959 1.00 14.00 H new ATOM 0 HB3 ALA A 18 7.229 6.373 -0.790 1.00 14.00 H new ATOM 254 N LEU A 19 5.975 5.656 1.596 1.00 61.22 N ATOM 255 CA LEU A 19 4.819 5.875 2.458 1.00 60.42 C ATOM 256 C LEU A 19 4.977 5.127 3.778 1.00 14.15 C ATOM 257 O LEU A 19 4.597 5.627 4.837 1.00 51.34 O ATOM 258 CB LEU A 19 3.539 5.425 1.751 1.00 52.44 C ATOM 259 CG LEU A 19 3.362 5.962 0.330 1.00 31.22 C ATOM 260 CD1 LEU A 19 2.063 5.455 -0.275 1.00 72.23 C ATOM 261 CD2 LEU A 19 3.396 7.483 0.329 1.00 73.32 C ATOM 0 H LEU A 19 5.763 5.183 0.718 1.00 61.22 H new ATOM 0 HA LEU A 19 4.751 6.942 2.672 1.00 60.42 H new ATOM 0 HB2 LEU A 19 3.525 4.336 1.716 1.00 52.44 H new ATOM 0 HB3 LEU A 19 2.683 5.736 2.350 1.00 52.44 H new ATOM 0 HG LEU A 19 4.188 5.599 -0.282 1.00 31.22 H new ATOM 0 HD11 LEU A 19 1.955 5.848 -1.286 1.00 72.23 H new ATOM 0 HD12 LEU A 19 2.078 4.366 -0.309 1.00 72.23 H new ATOM 0 HD13 LEU A 19 1.223 5.788 0.335 1.00 72.23 H new ATOM 0 HD21 LEU A 19 3.269 7.849 -0.690 1.00 73.32 H new ATOM 0 HD22 LEU A 19 2.590 7.865 0.955 1.00 73.32 H new ATOM 0 HD23 LEU A 19 4.354 7.826 0.721 1.00 73.32 H new ATOM 273 N THR A 20 5.540 3.925 3.707 1.00 63.51 N ATOM 274 CA THR A 20 5.749 3.107 4.897 1.00 42.51 C ATOM 275 C THR A 20 6.706 3.795 5.867 1.00 63.00 C ATOM 276 O THR A 20 6.357 4.054 7.019 1.00 71.44 O ATOM 277 CB THR A 20 6.297 1.732 4.506 1.00 14.42 C ATOM 278 OG1 THR A 20 5.372 1.037 3.690 1.00 44.20 O ATOM 279 CG2 THR A 20 6.612 0.850 5.696 1.00 31.10 C ATOM 0 H THR A 20 5.860 3.496 2.839 1.00 63.51 H new ATOM 0 HA THR A 20 4.788 2.978 5.394 1.00 42.51 H new ATOM 0 HB THR A 20 7.224 1.934 3.970 1.00 14.42 H new ATOM 0 HG1 THR A 20 5.472 1.329 2.760 1.00 44.20 H new ATOM 0 HG21 THR A 20 6.996 -0.109 5.347 1.00 31.10 H new ATOM 0 HG22 THR A 20 7.362 1.336 6.320 1.00 31.10 H new ATOM 0 HG23 THR A 20 5.705 0.687 6.278 1.00 31.10 H new ATOM 287 N ILE A 21 7.912 4.088 5.392 1.00 62.34 N ATOM 288 CA ILE A 21 8.917 4.744 6.209 1.00 44.35 C ATOM 289 C ILE A 21 8.456 6.143 6.617 1.00 2.12 C ATOM 290 O ILE A 21 8.833 6.648 7.675 1.00 55.42 O ATOM 291 CB ILE A 21 10.263 4.823 5.451 1.00 63.03 C ATOM 292 CG1 ILE A 21 11.050 3.523 5.633 1.00 44.43 C ATOM 293 CG2 ILE A 21 11.090 6.010 5.916 1.00 20.01 C ATOM 294 CD1 ILE A 21 10.279 2.286 5.225 1.00 13.23 C ATOM 0 H ILE A 21 8.215 3.879 4.441 1.00 62.34 H new ATOM 0 HA ILE A 21 9.059 4.152 7.113 1.00 44.35 H new ATOM 0 HB ILE A 21 10.045 4.961 4.392 1.00 63.03 H new ATOM 0 HG12 ILE A 21 11.968 3.579 5.047 1.00 44.43 H new ATOM 0 HG13 ILE A 21 11.344 3.429 6.678 1.00 44.43 H new ATOM 0 HG21 ILE A 21 12.030 6.037 5.364 1.00 20.01 H new ATOM 0 HG22 ILE A 21 10.537 6.932 5.736 1.00 20.01 H new ATOM 0 HG23 ILE A 21 11.298 5.914 6.982 1.00 20.01 H new ATOM 0 HD11 ILE A 21 10.899 1.403 5.381 1.00 13.23 H new ATOM 0 HD12 ILE A 21 9.374 2.206 5.828 1.00 13.23 H new ATOM 0 HD13 ILE A 21 10.008 2.357 4.172 1.00 13.23 H new ATOM 306 N GLN A 22 7.636 6.762 5.773 1.00 34.43 N ATOM 307 CA GLN A 22 7.124 8.099 6.049 1.00 13.42 C ATOM 308 C GLN A 22 6.105 8.064 7.184 1.00 21.12 C ATOM 309 O GLN A 22 6.136 8.900 8.086 1.00 11.20 O ATOM 310 CB GLN A 22 6.485 8.694 4.793 1.00 41.34 C ATOM 311 CG GLN A 22 7.470 9.436 3.904 1.00 15.23 C ATOM 312 CD GLN A 22 8.143 10.591 4.619 1.00 60.13 C ATOM 313 OE1 GLN A 22 7.824 10.895 5.768 1.00 42.22 O ATOM 314 NE2 GLN A 22 9.081 11.241 3.940 1.00 12.34 N ATOM 0 H GLN A 22 7.313 6.359 4.893 1.00 34.43 H new ATOM 0 HA GLN A 22 7.961 8.727 6.353 1.00 13.42 H new ATOM 0 HB2 GLN A 22 6.020 7.893 4.217 1.00 41.34 H new ATOM 0 HB3 GLN A 22 5.689 9.377 5.089 1.00 41.34 H new ATOM 0 HG2 GLN A 22 8.230 8.740 3.550 1.00 15.23 H new ATOM 0 HG3 GLN A 22 6.948 9.812 3.024 1.00 15.23 H new ATOM 0 HE21 GLN A 22 9.313 10.954 2.989 1.00 12.34 H new ATOM 0 HE22 GLN A 22 9.569 12.027 4.369 1.00 12.34 H new ATOM 323 N LEU A 23 5.204 7.088 7.132 1.00 70.34 N ATOM 324 CA LEU A 23 4.176 6.940 8.156 1.00 32.31 C ATOM 325 C LEU A 23 4.743 6.324 9.436 1.00 24.12 C ATOM 326 O LEU A 23 4.039 6.205 10.438 1.00 3.15 O ATOM 327 CB LEU A 23 3.026 6.080 7.629 1.00 71.34 C ATOM 328 CG LEU A 23 1.825 5.970 8.570 1.00 14.14 C ATOM 329 CD1 LEU A 23 0.540 6.345 7.850 1.00 20.44 C ATOM 330 CD2 LEU A 23 1.726 4.566 9.142 1.00 72.21 C ATOM 0 H LEU A 23 5.165 6.388 6.391 1.00 70.34 H new ATOM 0 HA LEU A 23 3.803 7.935 8.398 1.00 32.31 H new ATOM 0 HB2 LEU A 23 2.688 6.492 6.678 1.00 71.34 H new ATOM 0 HB3 LEU A 23 3.404 5.078 7.426 1.00 71.34 H new ATOM 0 HG LEU A 23 1.970 6.670 9.393 1.00 14.14 H new ATOM 0 HD11 LEU A 23 -0.301 6.260 8.538 1.00 20.44 H new ATOM 0 HD12 LEU A 23 0.611 7.371 7.490 1.00 20.44 H new ATOM 0 HD13 LEU A 23 0.387 5.673 7.005 1.00 20.44 H new ATOM 0 HD21 LEU A 23 0.866 4.505 9.809 1.00 72.21 H new ATOM 0 HD22 LEU A 23 1.606 3.850 8.329 1.00 72.21 H new ATOM 0 HD23 LEU A 23 2.634 4.335 9.698 1.00 72.21 H new ATOM 342 N ILE A 24 6.016 5.933 9.401 1.00 11.22 N ATOM 343 CA ILE A 24 6.661 5.333 10.563 1.00 73.42 C ATOM 344 C ILE A 24 7.835 6.182 11.043 1.00 0.31 C ATOM 345 O ILE A 24 7.776 6.794 12.110 1.00 75.13 O ATOM 346 CB ILE A 24 7.161 3.906 10.251 1.00 30.14 C ATOM 347 CG1 ILE A 24 5.998 3.027 9.785 1.00 62.21 C ATOM 348 CG2 ILE A 24 7.837 3.295 11.471 1.00 71.40 C ATOM 349 CD1 ILE A 24 5.012 2.696 10.884 1.00 3.32 C ATOM 0 H ILE A 24 6.618 6.021 8.582 1.00 11.22 H new ATOM 0 HA ILE A 24 5.911 5.283 11.352 1.00 73.42 H new ATOM 0 HB ILE A 24 7.896 3.965 9.448 1.00 30.14 H new ATOM 0 HG12 ILE A 24 5.472 3.534 8.976 1.00 62.21 H new ATOM 0 HG13 ILE A 24 6.396 2.099 9.374 1.00 62.21 H new ATOM 0 HG21 ILE A 24 8.182 2.290 11.230 1.00 71.40 H new ATOM 0 HG22 ILE A 24 8.688 3.911 11.762 1.00 71.40 H new ATOM 0 HG23 ILE A 24 7.125 3.247 12.295 1.00 71.40 H new ATOM 0 HD11 ILE A 24 4.215 2.071 10.482 1.00 3.32 H new ATOM 0 HD12 ILE A 24 5.524 2.161 11.684 1.00 3.32 H new ATOM 0 HD13 ILE A 24 4.585 3.618 11.280 1.00 3.32 H new ATOM 361 N GLN A 25 8.902 6.210 10.252 1.00 73.34 N ATOM 362 CA GLN A 25 10.092 6.979 10.598 1.00 4.30 C ATOM 363 C GLN A 25 9.900 8.460 10.283 1.00 12.03 C ATOM 364 O GLN A 25 10.456 9.325 10.959 1.00 11.32 O ATOM 365 CB GLN A 25 11.308 6.432 9.848 1.00 21.52 C ATOM 366 CG GLN A 25 12.140 5.454 10.663 1.00 71.24 C ATOM 367 CD GLN A 25 11.300 4.391 11.345 1.00 4.21 C ATOM 368 OE1 GLN A 25 10.799 4.594 12.451 1.00 63.41 O ATOM 369 NE2 GLN A 25 11.142 3.250 10.686 1.00 1.24 N ATOM 0 H GLN A 25 8.967 5.709 9.366 1.00 73.34 H new ATOM 0 HA GLN A 25 10.261 6.881 11.670 1.00 4.30 H new ATOM 0 HB2 GLN A 25 10.970 5.937 8.938 1.00 21.52 H new ATOM 0 HB3 GLN A 25 11.940 7.266 9.542 1.00 21.52 H new ATOM 0 HG2 GLN A 25 12.868 4.972 10.010 1.00 71.24 H new ATOM 0 HG3 GLN A 25 12.703 6.004 11.417 1.00 71.24 H new ATOM 0 HE21 GLN A 25 11.576 3.125 9.771 1.00 1.24 H new ATOM 0 HE22 GLN A 25 10.587 2.498 11.094 1.00 1.24 H new ATOM 588 N TYR A 40 7.139 -2.492 10.581 1.00 21.25 N ATOM 589 CA TYR A 40 7.015 -1.520 11.661 1.00 63.30 C ATOM 590 C TYR A 40 5.661 -1.644 12.352 1.00 13.42 C ATOM 591 O TYR A 40 4.736 -2.260 11.822 1.00 64.13 O ATOM 592 CB TYR A 40 7.196 -0.100 11.122 1.00 0.40 C ATOM 593 CG TYR A 40 8.313 0.024 10.111 1.00 60.23 C ATOM 594 CD1 TYR A 40 8.078 -0.194 8.760 1.00 24.43 C ATOM 595 CD2 TYR A 40 9.601 0.359 10.508 1.00 34.24 C ATOM 596 CE1 TYR A 40 9.096 -0.083 7.832 1.00 63.21 C ATOM 597 CE2 TYR A 40 10.624 0.473 9.586 1.00 34.25 C ATOM 598 CZ TYR A 40 10.366 0.251 8.250 1.00 14.43 C ATOM 599 OH TYR A 40 11.383 0.363 7.329 1.00 21.23 O ATOM 0 HA TYR A 40 7.797 -1.726 12.392 1.00 63.30 H new ATOM 0 HB2 TYR A 40 6.263 0.227 10.663 1.00 0.40 H new ATOM 0 HB3 TYR A 40 7.395 0.574 11.955 1.00 0.40 H new ATOM 0 HD1 TYR A 40 7.084 -0.455 8.429 1.00 24.43 H new ATOM 0 HD2 TYR A 40 9.806 0.533 11.554 1.00 34.24 H new ATOM 0 HE1 TYR A 40 8.897 -0.257 6.785 1.00 63.21 H new ATOM 0 HE2 TYR A 40 11.620 0.735 9.910 1.00 34.25 H new ATOM 0 HH TYR A 40 12.214 0.606 7.788 1.00 21.23 H new ATOM 609 N ARG A 41 5.552 -1.053 13.536 1.00 61.05 N ATOM 610 CA ARG A 41 4.310 -1.094 14.299 1.00 74.45 C ATOM 611 C ARG A 41 4.077 0.225 15.027 1.00 53.13 C ATOM 612 O ARG A 41 4.743 0.525 16.018 1.00 73.15 O ATOM 613 CB ARG A 41 4.341 -2.248 15.303 1.00 71.32 C ATOM 614 CG ARG A 41 4.269 -3.619 14.651 1.00 20.31 C ATOM 615 CD ARG A 41 4.907 -4.686 15.526 1.00 52.51 C ATOM 616 NE ARG A 41 6.313 -4.400 15.800 1.00 72.14 N ATOM 617 CZ ARG A 41 7.131 -5.239 16.431 1.00 14.33 C ATOM 618 NH1 ARG A 41 6.688 -6.417 16.853 1.00 14.00 N ATOM 619 NH2 ARG A 41 8.396 -4.900 16.640 1.00 73.31 N ATOM 0 H ARG A 41 6.308 -0.540 13.989 1.00 61.05 H new ATOM 0 HA ARG A 41 3.488 -1.253 13.601 1.00 74.45 H new ATOM 0 HB2 ARG A 41 5.255 -2.182 15.893 1.00 71.32 H new ATOM 0 HB3 ARG A 41 3.507 -2.139 15.996 1.00 71.32 H new ATOM 0 HG2 ARG A 41 3.228 -3.878 14.460 1.00 20.31 H new ATOM 0 HG3 ARG A 41 4.772 -3.590 13.685 1.00 20.31 H new ATOM 0 HD2 ARG A 41 4.361 -4.757 16.467 1.00 52.51 H new ATOM 0 HD3 ARG A 41 4.823 -5.655 15.035 1.00 52.51 H new ATOM 0 HE ARG A 41 6.690 -3.505 15.489 1.00 72.14 H new ATOM 0 HH11 ARG A 41 5.716 -6.683 16.694 1.00 14.00 H new ATOM 0 HH12 ARG A 41 7.319 -7.056 17.336 1.00 14.00 H new ATOM 0 HH21 ARG A 41 8.742 -3.996 16.317 1.00 73.31 H new ATOM 0 HH22 ARG A 41 9.023 -5.543 17.124 1.00 73.31 H new ATOM 633 N LYS A 42 3.129 1.010 14.526 1.00 13.44 N ATOM 634 CA LYS A 42 2.808 2.299 15.125 1.00 33.41 C ATOM 635 C LYS A 42 1.416 2.280 15.747 1.00 42.25 C ATOM 636 O LYS A 42 0.509 1.619 15.243 1.00 73.12 O ATOM 637 CB LYS A 42 2.892 3.407 14.074 1.00 12.23 C ATOM 638 CG LYS A 42 3.396 4.731 14.625 1.00 64.34 C ATOM 639 CD LYS A 42 3.634 5.741 13.515 1.00 23.54 C ATOM 640 CE LYS A 42 2.355 6.041 12.749 1.00 13.14 C ATOM 641 NZ LYS A 42 2.329 7.440 12.240 1.00 32.41 N ATOM 0 H LYS A 42 2.570 0.775 13.706 1.00 13.44 H new ATOM 0 HA LYS A 42 3.535 2.496 15.912 1.00 33.41 H new ATOM 0 HB2 LYS A 42 3.552 3.083 13.269 1.00 12.23 H new ATOM 0 HB3 LYS A 42 1.905 3.557 13.637 1.00 12.23 H new ATOM 0 HG2 LYS A 42 2.671 5.131 15.333 1.00 64.34 H new ATOM 0 HG3 LYS A 42 4.323 4.568 15.175 1.00 64.34 H new ATOM 0 HD2 LYS A 42 4.029 6.664 13.940 1.00 23.54 H new ATOM 0 HD3 LYS A 42 4.389 5.357 12.829 1.00 23.54 H new ATOM 0 HE2 LYS A 42 2.262 5.348 11.913 1.00 13.14 H new ATOM 0 HE3 LYS A 42 1.495 5.875 13.398 1.00 13.14 H new ATOM 0 HZ1 LYS A 42 1.361 7.687 11.952 1.00 32.41 H new ATOM 0 HZ2 LYS A 42 2.643 8.088 12.990 1.00 32.41 H new ATOM 0 HZ3 LYS A 42 2.965 7.523 11.421 1.00 32.41 H new ATOM 655 N GLN A 43 1.256 3.008 16.846 1.00 14.14 N ATOM 656 CA GLN A 43 -0.021 3.077 17.540 1.00 2.51 C ATOM 657 C GLN A 43 -0.710 4.411 17.277 1.00 44.13 C ATOM 658 O GLN A 43 -0.094 5.472 17.387 1.00 70.25 O ATOM 659 CB GLN A 43 0.188 2.886 19.041 1.00 24.30 C ATOM 660 CG GLN A 43 -1.103 2.892 19.837 1.00 55.24 C ATOM 661 CD GLN A 43 -1.352 4.214 20.536 1.00 45.13 C ATOM 662 OE1 GLN A 43 -1.345 5.273 19.907 1.00 45.13 O ATOM 663 NE2 GLN A 43 -1.575 4.160 21.844 1.00 44.04 N ATOM 0 H GLN A 43 1.998 3.560 17.276 1.00 14.14 H new ATOM 0 HA GLN A 43 -0.660 2.279 17.162 1.00 2.51 H new ATOM 0 HB2 GLN A 43 0.706 1.942 19.210 1.00 24.30 H new ATOM 0 HB3 GLN A 43 0.839 3.678 19.413 1.00 24.30 H new ATOM 0 HG2 GLN A 43 -1.937 2.675 19.170 1.00 55.24 H new ATOM 0 HG3 GLN A 43 -1.072 2.094 20.578 1.00 55.24 H new ATOM 0 HE21 GLN A 43 -1.572 3.261 22.325 1.00 44.04 H new ATOM 0 HE22 GLN A 43 -1.750 5.018 22.367 1.00 44.04 H new ATOM 672 N VAL A 44 -1.991 4.352 16.929 1.00 5.42 N ATOM 673 CA VAL A 44 -2.762 5.557 16.651 1.00 31.42 C ATOM 674 C VAL A 44 -4.205 5.405 17.116 1.00 62.34 C ATOM 675 O VAL A 44 -4.616 4.333 17.562 1.00 13.51 O ATOM 676 CB VAL A 44 -2.751 5.898 15.149 1.00 74.40 C ATOM 677 CG1 VAL A 44 -1.334 6.185 14.677 1.00 3.43 C ATOM 678 CG2 VAL A 44 -3.372 4.770 14.338 1.00 41.14 C ATOM 0 H VAL A 44 -2.516 3.483 16.833 1.00 5.42 H new ATOM 0 HA VAL A 44 -2.289 6.369 17.203 1.00 31.42 H new ATOM 0 HB VAL A 44 -3.350 6.796 14.996 1.00 74.40 H new ATOM 0 HG11 VAL A 44 -1.346 6.424 13.614 1.00 3.43 H new ATOM 0 HG12 VAL A 44 -0.929 7.030 15.234 1.00 3.43 H new ATOM 0 HG13 VAL A 44 -0.710 5.307 14.845 1.00 3.43 H new ATOM 0 HG21 VAL A 44 -3.355 5.030 13.280 1.00 41.14 H new ATOM 0 HG22 VAL A 44 -2.804 3.853 14.495 1.00 41.14 H new ATOM 0 HG23 VAL A 44 -4.403 4.617 14.657 1.00 41.14 H new ATOM 688 N VAL A 45 -4.972 6.484 17.006 1.00 74.21 N ATOM 689 CA VAL A 45 -6.371 6.472 17.413 1.00 61.23 C ATOM 690 C VAL A 45 -7.288 6.696 16.216 1.00 2.12 C ATOM 691 O VAL A 45 -7.471 7.827 15.764 1.00 12.12 O ATOM 692 CB VAL A 45 -6.659 7.549 18.475 1.00 22.32 C ATOM 693 CG1 VAL A 45 -8.063 7.386 19.035 1.00 54.03 C ATOM 694 CG2 VAL A 45 -5.623 7.489 19.588 1.00 22.00 C ATOM 0 H VAL A 45 -4.648 7.378 16.638 1.00 74.21 H new ATOM 0 HA VAL A 45 -6.568 5.490 17.844 1.00 61.23 H new ATOM 0 HB VAL A 45 -6.595 8.528 18.001 1.00 22.32 H new ATOM 0 HG11 VAL A 45 -8.248 8.156 19.784 1.00 54.03 H new ATOM 0 HG12 VAL A 45 -8.790 7.482 18.228 1.00 54.03 H new ATOM 0 HG13 VAL A 45 -8.159 6.402 19.495 1.00 54.03 H new ATOM 0 HG21 VAL A 45 -5.841 8.257 20.330 1.00 22.00 H new ATOM 0 HG22 VAL A 45 -5.654 6.508 20.061 1.00 22.00 H new ATOM 0 HG23 VAL A 45 -4.631 7.659 19.171 1.00 22.00 H new ATOM 704 N ILE A 46 -7.862 5.611 15.707 1.00 62.41 N ATOM 705 CA ILE A 46 -8.759 5.688 14.561 1.00 2.41 C ATOM 706 C ILE A 46 -10.178 5.286 14.949 1.00 62.35 C ATOM 707 O ILE A 46 -10.382 4.329 15.695 1.00 63.22 O ATOM 708 CB ILE A 46 -8.274 4.786 13.408 1.00 64.21 C ATOM 709 CG1 ILE A 46 -6.808 5.083 13.085 1.00 34.32 C ATOM 710 CG2 ILE A 46 -9.145 4.982 12.175 1.00 35.12 C ATOM 711 CD1 ILE A 46 -6.257 4.247 11.950 1.00 23.22 C ATOM 0 H ILE A 46 -7.722 4.668 16.070 1.00 62.41 H new ATOM 0 HA ILE A 46 -8.758 6.725 14.224 1.00 2.41 H new ATOM 0 HB ILE A 46 -8.356 3.745 13.721 1.00 64.21 H new ATOM 0 HG12 ILE A 46 -6.707 6.138 12.830 1.00 34.32 H new ATOM 0 HG13 ILE A 46 -6.206 4.911 13.977 1.00 34.32 H new ATOM 0 HG21 ILE A 46 -8.788 4.338 11.371 1.00 35.12 H new ATOM 0 HG22 ILE A 46 -10.177 4.726 12.414 1.00 35.12 H new ATOM 0 HG23 ILE A 46 -9.094 6.023 11.855 1.00 35.12 H new ATOM 0 HD11 ILE A 46 -5.214 4.511 11.777 1.00 23.22 H new ATOM 0 HD12 ILE A 46 -6.325 3.191 12.210 1.00 23.22 H new ATOM 0 HD13 ILE A 46 -6.834 4.436 11.045 1.00 23.22 H new ATOM 723 N ASP A 47 -11.156 6.027 14.437 1.00 32.40 N ATOM 724 CA ASP A 47 -12.559 5.752 14.729 1.00 53.15 C ATOM 725 C ASP A 47 -12.861 5.935 16.216 1.00 34.21 C ATOM 726 O ASP A 47 -13.879 5.454 16.713 1.00 0.32 O ATOM 727 CB ASP A 47 -12.925 4.331 14.295 1.00 34.01 C ATOM 728 CG ASP A 47 -14.397 4.189 13.962 1.00 34.40 C ATOM 729 OD1 ASP A 47 -15.041 5.218 13.668 1.00 2.13 O ATOM 730 OD2 ASP A 47 -14.906 3.049 13.995 1.00 13.04 O ATOM 0 H ASP A 47 -11.003 6.823 13.818 1.00 32.40 H new ATOM 0 HA ASP A 47 -13.162 6.465 14.167 1.00 53.15 H new ATOM 0 HB2 ASP A 47 -12.330 4.056 13.424 1.00 34.01 H new ATOM 0 HB3 ASP A 47 -12.667 3.633 15.091 1.00 34.01 H new ATOM 735 N GLY A 48 -11.976 6.636 16.920 1.00 63.13 N ATOM 736 CA GLY A 48 -12.176 6.869 18.339 1.00 3.03 C ATOM 737 C GLY A 48 -11.504 5.822 19.209 1.00 15.32 C ATOM 738 O GLY A 48 -11.245 6.062 20.388 1.00 63.10 O ATOM 0 H GLY A 48 -11.126 7.046 16.534 1.00 63.13 H new ATOM 0 HA2 GLY A 48 -11.788 7.854 18.599 1.00 3.03 H new ATOM 0 HA3 GLY A 48 -13.245 6.881 18.553 1.00 3.03 H new ATOM 742 N GLU A 49 -11.224 4.657 18.631 1.00 5.33 N ATOM 743 CA GLU A 49 -10.582 3.575 19.369 1.00 14.34 C ATOM 744 C GLU A 49 -9.098 3.481 19.026 1.00 73.20 C ATOM 745 O GLU A 49 -8.671 3.897 17.949 1.00 53.34 O ATOM 746 CB GLU A 49 -11.275 2.243 19.069 1.00 51.22 C ATOM 747 CG GLU A 49 -11.017 1.720 17.664 1.00 21.45 C ATOM 748 CD GLU A 49 -11.814 0.469 17.352 1.00 44.00 C ATOM 749 OE1 GLU A 49 -11.515 -0.589 17.946 1.00 43.43 O ATOM 750 OE2 GLU A 49 -12.737 0.546 16.514 1.00 55.23 O ATOM 0 H GLU A 49 -11.431 4.439 17.656 1.00 5.33 H new ATOM 0 HA GLU A 49 -10.674 3.793 20.433 1.00 14.34 H new ATOM 0 HB2 GLU A 49 -10.939 1.499 19.791 1.00 51.22 H new ATOM 0 HB3 GLU A 49 -12.349 2.363 19.211 1.00 51.22 H new ATOM 0 HG2 GLU A 49 -11.267 2.496 16.940 1.00 21.45 H new ATOM 0 HG3 GLU A 49 -9.954 1.507 17.549 1.00 21.45 H new ATOM 757 N THR A 50 -8.319 2.927 19.949 1.00 10.11 N ATOM 758 CA THR A 50 -6.883 2.772 19.747 1.00 34.20 C ATOM 759 C THR A 50 -6.568 1.409 19.136 1.00 70.22 C ATOM 760 O THR A 50 -7.052 0.381 19.609 1.00 64.45 O ATOM 761 CB THR A 50 -6.142 2.933 21.075 1.00 42.14 C ATOM 762 OG1 THR A 50 -6.378 4.215 21.629 1.00 72.32 O ATOM 763 CG2 THR A 50 -4.643 2.755 20.953 1.00 25.23 C ATOM 0 H THR A 50 -8.658 2.578 20.845 1.00 10.11 H new ATOM 0 HA THR A 50 -6.549 3.547 19.057 1.00 34.20 H new ATOM 0 HB THR A 50 -6.533 2.145 21.719 1.00 42.14 H new ATOM 0 HG1 THR A 50 -5.897 4.298 22.479 1.00 72.32 H new ATOM 0 HG21 THR A 50 -4.181 2.882 21.932 1.00 25.23 H new ATOM 0 HG22 THR A 50 -4.425 1.756 20.576 1.00 25.23 H new ATOM 0 HG23 THR A 50 -4.243 3.498 20.263 1.00 25.23 H new ATOM 771 N CYS A 51 -5.756 1.409 18.085 1.00 63.31 N ATOM 772 CA CYS A 51 -5.379 0.170 17.413 1.00 62.22 C ATOM 773 C CYS A 51 -3.958 0.256 16.867 1.00 30.22 C ATOM 774 O CYS A 51 -3.505 1.322 16.449 1.00 15.15 O ATOM 775 CB CYS A 51 -6.355 -0.137 16.276 1.00 44.42 C ATOM 776 SG CYS A 51 -8.063 -0.386 16.815 1.00 34.54 S ATOM 0 H CYS A 51 -5.347 2.251 17.680 1.00 63.31 H new ATOM 0 HA CYS A 51 -5.420 -0.636 18.146 1.00 62.22 H new ATOM 0 HB2 CYS A 51 -6.328 0.682 15.557 1.00 44.42 H new ATOM 0 HB3 CYS A 51 -6.017 -1.031 15.753 1.00 44.42 H new ATOM 0 HG CYS A 51 -8.141 -0.215 18.101 1.00 34.54 H new ATOM 782 N LEU A 52 -3.261 -0.875 16.869 1.00 63.42 N ATOM 783 CA LEU A 52 -1.892 -0.932 16.370 1.00 75.10 C ATOM 784 C LEU A 52 -1.877 -0.984 14.845 1.00 75.43 C ATOM 785 O LEU A 52 -2.775 -1.554 14.225 1.00 72.00 O ATOM 786 CB LEU A 52 -1.170 -2.155 16.945 1.00 0.32 C ATOM 787 CG LEU A 52 0.041 -1.840 17.827 1.00 4.13 C ATOM 788 CD1 LEU A 52 1.191 -1.311 16.983 1.00 11.01 C ATOM 789 CD2 LEU A 52 -0.333 -0.841 18.914 1.00 65.10 C ATOM 0 H LEU A 52 -3.622 -1.766 17.211 1.00 63.42 H new ATOM 0 HA LEU A 52 -1.371 -0.030 16.691 1.00 75.10 H new ATOM 0 HB2 LEU A 52 -1.883 -2.737 17.529 1.00 0.32 H new ATOM 0 HB3 LEU A 52 -0.843 -2.786 16.119 1.00 0.32 H new ATOM 0 HG LEU A 52 0.365 -2.762 18.309 1.00 4.13 H new ATOM 0 HD11 LEU A 52 2.044 -1.092 17.626 1.00 11.01 H new ATOM 0 HD12 LEU A 52 1.476 -2.061 16.245 1.00 11.01 H new ATOM 0 HD13 LEU A 52 0.879 -0.400 16.472 1.00 11.01 H new ATOM 0 HD21 LEU A 52 0.541 -0.630 19.530 1.00 65.10 H new ATOM 0 HD22 LEU A 52 -0.684 0.083 18.454 1.00 65.10 H new ATOM 0 HD23 LEU A 52 -1.124 -1.260 19.537 1.00 65.10 H new ATOM 801 N LEU A 53 -0.854 -0.384 14.245 1.00 61.03 N ATOM 802 CA LEU A 53 -0.726 -0.363 12.793 1.00 32.35 C ATOM 803 C LEU A 53 0.550 -1.074 12.350 1.00 4.22 C ATOM 804 O LEU A 53 1.655 -0.573 12.558 1.00 55.20 O ATOM 805 CB LEU A 53 -0.728 1.080 12.282 1.00 32.24 C ATOM 806 CG LEU A 53 -2.070 1.806 12.403 1.00 34.33 C ATOM 807 CD1 LEU A 53 -1.970 3.212 11.831 1.00 23.35 C ATOM 808 CD2 LEU A 53 -3.166 1.020 11.700 1.00 72.15 C ATOM 0 H LEU A 53 -0.102 0.094 14.742 1.00 61.03 H new ATOM 0 HA LEU A 53 -1.579 -0.891 12.368 1.00 32.35 H new ATOM 0 HB2 LEU A 53 0.025 1.645 12.831 1.00 32.24 H new ATOM 0 HB3 LEU A 53 -0.425 1.079 11.235 1.00 32.24 H new ATOM 0 HG LEU A 53 -2.326 1.883 13.460 1.00 34.33 H new ATOM 0 HD11 LEU A 53 -2.934 3.713 11.926 1.00 23.35 H new ATOM 0 HD12 LEU A 53 -1.213 3.774 12.378 1.00 23.35 H new ATOM 0 HD13 LEU A 53 -1.691 3.158 10.779 1.00 23.35 H new ATOM 0 HD21 LEU A 53 -4.113 1.551 11.796 1.00 72.15 H new ATOM 0 HD22 LEU A 53 -2.916 0.912 10.645 1.00 72.15 H new ATOM 0 HD23 LEU A 53 -3.255 0.033 12.155 1.00 72.15 H new ATOM 820 N ASP A 54 0.389 -2.247 11.744 1.00 43.00 N ATOM 821 CA ASP A 54 1.527 -3.031 11.277 1.00 40.33 C ATOM 822 C ASP A 54 1.689 -2.919 9.763 1.00 41.41 C ATOM 823 O ASP A 54 1.117 -3.705 9.008 1.00 73.34 O ATOM 824 CB ASP A 54 1.357 -4.500 11.672 1.00 2.25 C ATOM 825 CG ASP A 54 1.281 -4.690 13.174 1.00 51.22 C ATOM 826 OD1 ASP A 54 0.800 -3.769 13.866 1.00 42.14 O ATOM 827 OD2 ASP A 54 1.703 -5.762 13.658 1.00 54.42 O ATOM 0 H ASP A 54 -0.519 -2.675 11.565 1.00 43.00 H new ATOM 0 HA ASP A 54 2.425 -2.632 11.750 1.00 40.33 H new ATOM 0 HB2 ASP A 54 0.451 -4.894 11.212 1.00 2.25 H new ATOM 0 HB3 ASP A 54 2.192 -5.078 11.277 1.00 2.25 H new ATOM 832 N ILE A 55 2.476 -1.940 9.327 1.00 13.31 N ATOM 833 CA ILE A 55 2.717 -1.730 7.903 1.00 12.44 C ATOM 834 C ILE A 55 3.765 -2.711 7.382 1.00 20.21 C ATOM 835 O ILE A 55 4.923 -2.681 7.800 1.00 10.11 O ATOM 836 CB ILE A 55 3.175 -0.279 7.620 1.00 35.30 C ATOM 837 CG1 ILE A 55 2.011 0.696 7.813 1.00 21.14 C ATOM 838 CG2 ILE A 55 3.740 -0.151 6.210 1.00 44.41 C ATOM 839 CD1 ILE A 55 1.426 0.679 9.208 1.00 62.45 C ATOM 0 H ILE A 55 2.957 -1.280 9.938 1.00 13.31 H new ATOM 0 HA ILE A 55 1.775 -1.904 7.382 1.00 12.44 H new ATOM 0 HB ILE A 55 3.964 -0.030 8.329 1.00 35.30 H new ATOM 0 HG12 ILE A 55 2.353 1.705 7.585 1.00 21.14 H new ATOM 0 HG13 ILE A 55 1.225 0.456 7.097 1.00 21.14 H new ATOM 0 HG21 ILE A 55 4.055 0.878 6.036 1.00 44.41 H new ATOM 0 HG22 ILE A 55 4.597 -0.816 6.100 1.00 44.41 H new ATOM 0 HG23 ILE A 55 2.973 -0.423 5.485 1.00 44.41 H new ATOM 0 HD11 ILE A 55 0.607 1.395 9.268 1.00 62.45 H new ATOM 0 HD12 ILE A 55 1.052 -0.320 9.434 1.00 62.45 H new ATOM 0 HD13 ILE A 55 2.197 0.949 9.929 1.00 62.45 H new ATOM 851 N LEU A 56 3.348 -3.581 6.468 1.00 41.44 N ATOM 852 CA LEU A 56 4.244 -4.576 5.887 1.00 73.14 C ATOM 853 C LEU A 56 5.054 -3.980 4.740 1.00 53.52 C ATOM 854 O LEU A 56 4.496 -3.404 3.806 1.00 60.42 O ATOM 855 CB LEU A 56 3.441 -5.776 5.388 1.00 73.03 C ATOM 856 CG LEU A 56 4.272 -6.982 4.946 1.00 50.42 C ATOM 857 CD1 LEU A 56 5.312 -7.339 5.999 1.00 10.43 C ATOM 858 CD2 LEU A 56 3.366 -8.171 4.665 1.00 23.43 C ATOM 0 H LEU A 56 2.393 -3.617 6.112 1.00 41.44 H new ATOM 0 HA LEU A 56 4.937 -4.903 6.662 1.00 73.14 H new ATOM 0 HB2 LEU A 56 2.763 -6.094 6.181 1.00 73.03 H new ATOM 0 HB3 LEU A 56 2.823 -5.455 4.550 1.00 73.03 H new ATOM 0 HG LEU A 56 4.798 -6.719 4.028 1.00 50.42 H new ATOM 0 HD11 LEU A 56 5.890 -8.199 5.662 1.00 10.43 H new ATOM 0 HD12 LEU A 56 5.979 -6.491 6.153 1.00 10.43 H new ATOM 0 HD13 LEU A 56 4.812 -7.583 6.936 1.00 10.43 H new ATOM 0 HD21 LEU A 56 3.970 -9.022 4.351 1.00 23.43 H new ATOM 0 HD22 LEU A 56 2.815 -8.430 5.569 1.00 23.43 H new ATOM 0 HD23 LEU A 56 2.663 -7.913 3.873 1.00 23.43 H new ATOM 870 N ASP A 57 6.374 -4.123 4.816 1.00 24.42 N ATOM 871 CA ASP A 57 7.260 -3.600 3.782 1.00 14.41 C ATOM 872 C ASP A 57 7.930 -4.735 3.013 1.00 33.11 C ATOM 873 O ASP A 57 9.091 -5.064 3.257 1.00 11.44 O ATOM 874 CB ASP A 57 8.324 -2.693 4.403 1.00 24.22 C ATOM 875 CG ASP A 57 8.884 -1.696 3.407 1.00 10.21 C ATOM 876 OD1 ASP A 57 8.180 -1.377 2.426 1.00 61.52 O ATOM 877 OD2 ASP A 57 10.027 -1.234 3.608 1.00 31.11 O ATOM 0 H ASP A 57 6.853 -4.596 5.582 1.00 24.42 H new ATOM 0 HA ASP A 57 6.658 -3.018 3.084 1.00 14.41 H new ATOM 0 HB2 ASP A 57 7.892 -2.156 5.247 1.00 24.22 H new ATOM 0 HB3 ASP A 57 9.136 -3.305 4.796 1.00 24.22 H new ATOM 882 N THR A 58 7.189 -5.329 2.083 1.00 44.43 N ATOM 883 CA THR A 58 7.708 -6.428 1.276 1.00 43.14 C ATOM 884 C THR A 58 8.572 -5.904 0.132 1.00 24.11 C ATOM 885 O THR A 58 8.850 -4.708 0.048 1.00 3.22 O ATOM 886 CB THR A 58 6.556 -7.266 0.719 1.00 3.52 C ATOM 887 OG1 THR A 58 5.929 -6.600 -0.363 1.00 34.50 O ATOM 888 CG2 THR A 58 5.490 -7.578 1.747 1.00 53.40 C ATOM 0 H THR A 58 6.226 -5.068 1.869 1.00 44.43 H new ATOM 0 HA THR A 58 8.328 -7.055 1.916 1.00 43.14 H new ATOM 0 HB THR A 58 7.010 -8.203 0.396 1.00 3.52 H new ATOM 0 HG1 THR A 58 5.196 -7.152 -0.707 1.00 34.50 H new ATOM 0 HG21 THR A 58 4.703 -8.175 1.286 1.00 53.40 H new ATOM 0 HG22 THR A 58 5.932 -8.136 2.572 1.00 53.40 H new ATOM 0 HG23 THR A 58 5.066 -6.648 2.125 1.00 53.40 H new ATOM 896 N ALA A 59 8.994 -6.809 -0.746 1.00 0.42 N ATOM 897 CA ALA A 59 9.826 -6.439 -1.885 1.00 50.40 C ATOM 898 C ALA A 59 9.030 -6.455 -3.180 1.00 25.54 C ATOM 899 O ALA A 59 7.954 -7.047 -3.256 1.00 31.33 O ATOM 900 CB ALA A 59 11.017 -7.375 -2.005 1.00 55.42 C ATOM 0 H ALA A 59 8.773 -7.803 -0.690 1.00 0.42 H new ATOM 0 HA ALA A 59 10.184 -5.424 -1.712 1.00 50.40 H new ATOM 0 HB1 ALA A 59 11.625 -7.082 -2.861 1.00 55.42 H new ATOM 0 HB2 ALA A 59 11.617 -7.318 -1.097 1.00 55.42 H new ATOM 0 HB3 ALA A 59 10.664 -8.397 -2.144 1.00 55.42 H new ATOM 1002 N MET A 67 7.171 -15.733 0.174 1.00 4.14 N ATOM 1003 CA MET A 67 6.809 -14.798 1.231 1.00 31.20 C ATOM 1004 C MET A 67 5.585 -13.981 0.835 1.00 14.05 C ATOM 1005 O MET A 67 4.688 -13.751 1.644 1.00 55.20 O ATOM 1006 CB MET A 67 7.984 -13.861 1.533 1.00 30.43 C ATOM 1007 CG MET A 67 9.168 -14.543 2.209 1.00 75.34 C ATOM 1008 SD MET A 67 9.929 -15.822 1.189 1.00 72.32 S ATOM 1009 CE MET A 67 9.536 -17.292 2.137 1.00 22.41 C ATOM 0 HA MET A 67 6.569 -15.372 2.126 1.00 31.20 H new ATOM 0 HB2 MET A 67 8.323 -13.409 0.601 1.00 30.43 H new ATOM 0 HB3 MET A 67 7.633 -13.050 2.171 1.00 30.43 H new ATOM 0 HG2 MET A 67 9.918 -13.792 2.458 1.00 75.34 H new ATOM 0 HG3 MET A 67 8.836 -14.986 3.148 1.00 75.34 H new ATOM 0 HE1 MET A 67 9.941 -18.169 1.633 1.00 22.41 H new ATOM 0 HE2 MET A 67 9.974 -17.211 3.132 1.00 22.41 H new ATOM 0 HE3 MET A 67 8.454 -17.391 2.223 1.00 22.41 H new ATOM 1019 N ARG A 68 5.560 -13.542 -0.418 1.00 4.22 N ATOM 1020 CA ARG A 68 4.453 -12.743 -0.927 1.00 73.23 C ATOM 1021 C ARG A 68 3.116 -13.447 -0.713 1.00 63.23 C ATOM 1022 O ARG A 68 2.140 -12.829 -0.289 1.00 74.23 O ATOM 1023 CB ARG A 68 4.653 -12.450 -2.414 1.00 71.22 C ATOM 1024 CG ARG A 68 3.828 -11.278 -2.917 1.00 71.14 C ATOM 1025 CD ARG A 68 4.372 -10.737 -4.230 1.00 73.25 C ATOM 1026 NE ARG A 68 4.555 -11.795 -5.221 1.00 71.30 N ATOM 1027 CZ ARG A 68 4.834 -11.571 -6.504 1.00 42.43 C ATOM 1028 NH1 ARG A 68 4.976 -10.330 -6.954 1.00 34.42 N ATOM 1029 NH2 ARG A 68 4.974 -12.592 -7.338 1.00 60.41 N ATOM 0 H ARG A 68 6.295 -13.727 -1.101 1.00 4.22 H new ATOM 0 HA ARG A 68 4.436 -11.805 -0.373 1.00 73.23 H new ATOM 0 HB2 ARG A 68 5.708 -12.247 -2.597 1.00 71.22 H new ATOM 0 HB3 ARG A 68 4.395 -13.339 -2.989 1.00 71.22 H new ATOM 0 HG2 ARG A 68 2.793 -11.592 -3.052 1.00 71.14 H new ATOM 0 HG3 ARG A 68 3.826 -10.485 -2.169 1.00 71.14 H new ATOM 0 HD2 ARG A 68 3.688 -9.985 -4.624 1.00 73.25 H new ATOM 0 HD3 ARG A 68 5.325 -10.239 -4.051 1.00 73.25 H new ATOM 0 HE ARG A 68 4.464 -12.763 -4.912 1.00 71.30 H new ATOM 0 HH11 ARG A 68 4.871 -9.541 -6.316 1.00 34.42 H new ATOM 0 HH12 ARG A 68 5.190 -10.166 -7.938 1.00 34.42 H new ATOM 0 HH21 ARG A 68 4.868 -13.547 -6.997 1.00 60.41 H new ATOM 0 HH22 ARG A 68 5.188 -12.422 -8.321 1.00 60.41 H new ATOM 1043 N ASP A 69 3.076 -14.740 -1.014 1.00 71.02 N ATOM 1044 CA ASP A 69 1.855 -15.522 -0.858 1.00 72.35 C ATOM 1045 C ASP A 69 1.473 -15.658 0.613 1.00 10.10 C ATOM 1046 O ASP A 69 0.294 -15.751 0.953 1.00 21.12 O ATOM 1047 CB ASP A 69 2.028 -16.907 -1.485 1.00 62.32 C ATOM 1048 CG ASP A 69 1.362 -17.011 -2.843 1.00 41.14 C ATOM 1049 OD1 ASP A 69 1.520 -16.074 -3.654 1.00 34.24 O ATOM 1050 OD2 ASP A 69 0.680 -18.027 -3.094 1.00 13.53 O ATOM 0 H ASP A 69 3.874 -15.268 -1.367 1.00 71.02 H new ATOM 0 HA ASP A 69 1.051 -14.996 -1.372 1.00 72.35 H new ATOM 0 HB2 ASP A 69 3.091 -17.127 -1.586 1.00 62.32 H new ATOM 0 HB3 ASP A 69 1.608 -17.660 -0.818 1.00 62.32 H new ATOM 1055 N GLN A 70 2.478 -15.673 1.481 1.00 23.51 N ATOM 1056 CA GLN A 70 2.250 -15.801 2.915 1.00 34.53 C ATOM 1057 C GLN A 70 1.737 -14.492 3.511 1.00 74.35 C ATOM 1058 O GLN A 70 0.896 -14.496 4.410 1.00 13.13 O ATOM 1059 CB GLN A 70 3.544 -16.229 3.615 1.00 44.32 C ATOM 1060 CG GLN A 70 3.499 -16.102 5.131 1.00 71.35 C ATOM 1061 CD GLN A 70 2.497 -17.046 5.766 1.00 1.14 C ATOM 1062 OE1 GLN A 70 1.698 -17.680 5.076 1.00 22.35 O ATOM 1063 NE2 GLN A 70 2.534 -17.144 7.090 1.00 14.05 N ATOM 0 H GLN A 70 3.460 -15.598 1.216 1.00 23.51 H new ATOM 0 HA GLN A 70 1.488 -16.564 3.072 1.00 34.53 H new ATOM 0 HB2 GLN A 70 3.761 -17.265 3.354 1.00 44.32 H new ATOM 0 HB3 GLN A 70 4.368 -15.625 3.234 1.00 44.32 H new ATOM 0 HG2 GLN A 70 4.490 -16.303 5.538 1.00 71.35 H new ATOM 0 HG3 GLN A 70 3.246 -15.076 5.399 1.00 71.35 H new ATOM 0 HE21 GLN A 70 3.213 -16.600 7.623 1.00 14.05 H new ATOM 0 HE22 GLN A 70 1.884 -17.763 7.574 1.00 14.05 H new ATOM 1072 N TYR A 71 2.252 -13.374 3.011 1.00 71.31 N ATOM 1073 CA TYR A 71 1.849 -12.061 3.504 1.00 15.43 C ATOM 1074 C TYR A 71 0.349 -11.846 3.334 1.00 62.11 C ATOM 1075 O TYR A 71 -0.302 -11.250 4.191 1.00 54.42 O ATOM 1076 CB TYR A 71 2.627 -10.964 2.782 1.00 41.53 C ATOM 1077 CG TYR A 71 4.087 -10.935 3.164 1.00 20.22 C ATOM 1078 CD1 TYR A 71 4.473 -10.931 4.497 1.00 74.33 C ATOM 1079 CD2 TYR A 71 5.078 -10.923 2.195 1.00 31.42 C ATOM 1080 CE1 TYR A 71 5.805 -10.913 4.856 1.00 13.34 C ATOM 1081 CE2 TYR A 71 6.413 -10.908 2.543 1.00 35.34 C ATOM 1082 CZ TYR A 71 6.773 -10.902 3.874 1.00 64.33 C ATOM 1083 OH TYR A 71 8.105 -10.886 4.220 1.00 31.13 O ATOM 0 H TYR A 71 2.948 -13.350 2.266 1.00 71.31 H new ATOM 0 HA TYR A 71 2.077 -12.015 4.569 1.00 15.43 H new ATOM 0 HB2 TYR A 71 2.541 -11.112 1.706 1.00 41.53 H new ATOM 0 HB3 TYR A 71 2.178 -9.997 3.008 1.00 41.53 H new ATOM 0 HD1 TYR A 71 3.717 -10.942 5.268 1.00 74.33 H new ATOM 0 HD2 TYR A 71 4.801 -10.925 1.151 1.00 31.42 H new ATOM 0 HE1 TYR A 71 6.087 -10.908 5.898 1.00 13.34 H new ATOM 0 HE2 TYR A 71 7.173 -10.901 1.776 1.00 35.34 H new ATOM 0 HH TYR A 71 8.654 -10.881 3.408 1.00 31.13 H new ATOM 1093 N MET A 72 -0.195 -12.342 2.228 1.00 63.20 N ATOM 1094 CA MET A 72 -1.621 -12.209 1.956 1.00 23.51 C ATOM 1095 C MET A 72 -2.427 -13.039 2.945 1.00 61.42 C ATOM 1096 O MET A 72 -3.514 -12.645 3.366 1.00 51.23 O ATOM 1097 CB MET A 72 -1.938 -12.651 0.526 1.00 12.52 C ATOM 1098 CG MET A 72 -0.915 -12.186 -0.497 1.00 33.34 C ATOM 1099 SD MET A 72 -1.631 -11.958 -2.135 1.00 24.34 S ATOM 1100 CE MET A 72 -0.841 -10.433 -2.641 1.00 2.32 C ATOM 0 H MET A 72 0.329 -12.839 1.507 1.00 63.20 H new ATOM 0 HA MET A 72 -1.895 -11.160 2.067 1.00 23.51 H new ATOM 0 HB2 MET A 72 -2.000 -13.739 0.496 1.00 12.52 H new ATOM 0 HB3 MET A 72 -2.919 -12.268 0.246 1.00 12.52 H new ATOM 0 HG2 MET A 72 -0.473 -11.247 -0.163 1.00 33.34 H new ATOM 0 HG3 MET A 72 -0.107 -12.915 -0.556 1.00 33.34 H new ATOM 0 HE1 MET A 72 -1.427 -9.964 -3.432 1.00 2.32 H new ATOM 0 HE2 MET A 72 -0.776 -9.757 -1.789 1.00 2.32 H new ATOM 0 HE3 MET A 72 0.161 -10.648 -3.011 1.00 2.32 H new ATOM 1110 N ARG A 73 -1.880 -14.191 3.312 1.00 0.42 N ATOM 1111 CA ARG A 73 -2.536 -15.084 4.256 1.00 51.22 C ATOM 1112 C ARG A 73 -2.295 -14.639 5.698 1.00 14.50 C ATOM 1113 O ARG A 73 -2.980 -15.088 6.616 1.00 45.32 O ATOM 1114 CB ARG A 73 -2.038 -16.510 4.056 1.00 23.51 C ATOM 1115 CG ARG A 73 -2.389 -17.071 2.692 1.00 21.11 C ATOM 1116 CD ARG A 73 -2.039 -18.540 2.593 1.00 40.52 C ATOM 1117 NE ARG A 73 -2.920 -19.374 3.406 1.00 75.02 N ATOM 1118 CZ ARG A 73 -2.707 -20.666 3.641 1.00 51.13 C ATOM 1119 NH1 ARG A 73 -1.646 -21.274 3.124 1.00 62.42 N ATOM 1120 NH2 ARG A 73 -3.555 -21.353 4.394 1.00 43.43 N ATOM 0 H ARG A 73 -0.981 -14.529 2.969 1.00 0.42 H new ATOM 0 HA ARG A 73 -3.609 -15.048 4.068 1.00 51.22 H new ATOM 0 HB2 ARG A 73 -0.956 -16.533 4.185 1.00 23.51 H new ATOM 0 HB3 ARG A 73 -2.465 -17.150 4.828 1.00 23.51 H new ATOM 0 HG2 ARG A 73 -3.454 -16.936 2.504 1.00 21.11 H new ATOM 0 HG3 ARG A 73 -1.856 -16.516 1.920 1.00 21.11 H new ATOM 0 HD2 ARG A 73 -2.101 -18.857 1.552 1.00 40.52 H new ATOM 0 HD3 ARG A 73 -1.007 -18.688 2.911 1.00 40.52 H new ATOM 0 HE ARG A 73 -3.747 -18.941 3.818 1.00 75.02 H new ATOM 0 HH11 ARG A 73 -0.990 -20.750 2.544 1.00 62.42 H new ATOM 0 HH12 ARG A 73 -1.487 -22.265 3.307 1.00 62.42 H new ATOM 0 HH21 ARG A 73 -4.372 -20.891 4.794 1.00 43.43 H new ATOM 0 HH22 ARG A 73 -3.391 -22.344 4.573 1.00 43.43 H new ATOM 1134 N THR A 74 -1.316 -13.755 5.891 1.00 13.12 N ATOM 1135 CA THR A 74 -0.988 -13.257 7.223 1.00 23.00 C ATOM 1136 C THR A 74 -1.497 -11.831 7.431 1.00 14.04 C ATOM 1137 O THR A 74 -1.389 -11.283 8.528 1.00 43.35 O ATOM 1138 CB THR A 74 0.525 -13.294 7.448 1.00 44.43 C ATOM 1139 OG1 THR A 74 1.189 -12.443 6.530 1.00 72.53 O ATOM 1140 CG2 THR A 74 1.124 -14.677 7.306 1.00 10.12 C ATOM 0 H THR A 74 -0.739 -13.371 5.143 1.00 13.12 H new ATOM 0 HA THR A 74 -1.482 -13.908 7.945 1.00 23.00 H new ATOM 0 HB THR A 74 0.669 -12.960 8.476 1.00 44.43 H new ATOM 0 HG1 THR A 74 0.531 -12.025 5.936 1.00 72.53 H new ATOM 0 HG21 THR A 74 2.199 -14.627 7.479 1.00 10.12 H new ATOM 0 HG22 THR A 74 0.670 -15.347 8.036 1.00 10.12 H new ATOM 0 HG23 THR A 74 0.935 -15.054 6.301 1.00 10.12 H new ATOM 1148 N GLY A 75 -2.043 -11.229 6.377 1.00 15.22 N ATOM 1149 CA GLY A 75 -2.542 -9.871 6.483 1.00 72.21 C ATOM 1150 C GLY A 75 -4.054 -9.790 6.428 1.00 14.43 C ATOM 1151 O GLY A 75 -4.718 -10.714 5.959 1.00 72.41 O ATOM 0 H GLY A 75 -2.148 -11.656 5.457 1.00 15.22 H new ATOM 0 HA2 GLY A 75 -2.194 -9.434 7.419 1.00 72.21 H new ATOM 0 HA3 GLY A 75 -2.122 -9.271 5.676 1.00 72.21 H new ATOM 1155 N GLU A 76 -4.596 -8.674 6.908 1.00 14.23 N ATOM 1156 CA GLU A 76 -6.039 -8.457 6.915 1.00 42.22 C ATOM 1157 C GLU A 76 -6.455 -7.492 5.805 1.00 70.41 C ATOM 1158 O GLU A 76 -7.634 -7.396 5.466 1.00 51.13 O ATOM 1159 CB GLU A 76 -6.488 -7.904 8.268 1.00 62.33 C ATOM 1160 CG GLU A 76 -5.849 -8.600 9.459 1.00 34.22 C ATOM 1161 CD GLU A 76 -6.869 -9.278 10.353 1.00 54.54 C ATOM 1162 OE1 GLU A 76 -7.796 -9.919 9.814 1.00 63.23 O ATOM 1163 OE2 GLU A 76 -6.742 -9.167 11.590 1.00 34.20 O ATOM 0 H GLU A 76 -4.054 -7.903 7.299 1.00 14.23 H new ATOM 0 HA GLU A 76 -6.521 -9.419 6.740 1.00 42.22 H new ATOM 0 HB2 GLU A 76 -6.253 -6.841 8.311 1.00 62.33 H new ATOM 0 HB3 GLU A 76 -7.572 -7.994 8.345 1.00 62.33 H new ATOM 0 HG2 GLU A 76 -5.134 -9.341 9.102 1.00 34.22 H new ATOM 0 HG3 GLU A 76 -5.287 -7.871 10.043 1.00 34.22 H new ATOM 1170 N GLY A 77 -5.483 -6.774 5.247 1.00 1.21 N ATOM 1171 CA GLY A 77 -5.777 -5.826 4.188 1.00 1.03 C ATOM 1172 C GLY A 77 -4.630 -5.675 3.209 1.00 30.32 C ATOM 1173 O GLY A 77 -3.552 -6.233 3.415 1.00 4.34 O ATOM 0 H GLY A 77 -4.499 -6.832 5.510 1.00 1.21 H new ATOM 0 HA2 GLY A 77 -6.668 -6.151 3.651 1.00 1.03 H new ATOM 0 HA3 GLY A 77 -6.006 -4.855 4.627 1.00 1.03 H new ATOM 1177 N PHE A 78 -4.860 -4.918 2.141 1.00 0.02 N ATOM 1178 CA PHE A 78 -3.834 -4.699 1.129 1.00 34.12 C ATOM 1179 C PHE A 78 -3.905 -3.280 0.574 1.00 73.31 C ATOM 1180 O PHE A 78 -4.987 -2.765 0.290 1.00 0.12 O ATOM 1181 CB PHE A 78 -3.984 -5.711 -0.008 1.00 74.33 C ATOM 1182 CG PHE A 78 -3.928 -7.141 0.451 1.00 52.43 C ATOM 1183 CD1 PHE A 78 -5.051 -7.757 0.979 1.00 20.04 C ATOM 1184 CD2 PHE A 78 -2.753 -7.869 0.351 1.00 75.31 C ATOM 1185 CE1 PHE A 78 -5.003 -9.072 1.399 1.00 14.14 C ATOM 1186 CE2 PHE A 78 -2.699 -9.185 0.771 1.00 21.51 C ATOM 1187 CZ PHE A 78 -3.826 -9.787 1.295 1.00 21.21 C ATOM 0 H PHE A 78 -5.745 -4.447 1.955 1.00 0.02 H new ATOM 0 HA PHE A 78 -2.862 -4.835 1.602 1.00 34.12 H new ATOM 0 HB2 PHE A 78 -4.933 -5.537 -0.515 1.00 74.33 H new ATOM 0 HB3 PHE A 78 -3.195 -5.542 -0.741 1.00 74.33 H new ATOM 0 HD1 PHE A 78 -5.974 -7.203 1.063 1.00 20.04 H new ATOM 0 HD2 PHE A 78 -1.870 -7.403 -0.060 1.00 75.31 H new ATOM 0 HE1 PHE A 78 -5.886 -9.541 1.809 1.00 14.14 H new ATOM 0 HE2 PHE A 78 -1.777 -9.741 0.689 1.00 21.51 H new ATOM 0 HZ PHE A 78 -3.787 -10.815 1.623 1.00 21.21 H new ATOM 1197 N LEU A 79 -2.743 -2.653 0.424 1.00 0.34 N ATOM 1198 CA LEU A 79 -2.666 -1.293 -0.096 1.00 10.42 C ATOM 1199 C LEU A 79 -1.876 -1.257 -1.401 1.00 21.22 C ATOM 1200 O LEU A 79 -0.686 -1.571 -1.426 1.00 12.31 O ATOM 1201 CB LEU A 79 -2.015 -0.369 0.936 1.00 63.03 C ATOM 1202 CG LEU A 79 -2.585 1.052 0.985 1.00 35.10 C ATOM 1203 CD1 LEU A 79 -3.258 1.315 2.325 1.00 35.53 C ATOM 1204 CD2 LEU A 79 -1.491 2.077 0.729 1.00 72.24 C ATOM 0 H LEU A 79 -1.840 -3.066 0.656 1.00 0.34 H new ATOM 0 HA LEU A 79 -3.679 -0.945 -0.296 1.00 10.42 H new ATOM 0 HB2 LEU A 79 -2.120 -0.820 1.923 1.00 63.03 H new ATOM 0 HB3 LEU A 79 -0.947 -0.309 0.725 1.00 63.03 H new ATOM 0 HG LEU A 79 -3.335 1.145 0.200 1.00 35.10 H new ATOM 0 HD11 LEU A 79 -3.656 2.330 2.339 1.00 35.53 H new ATOM 0 HD12 LEU A 79 -4.071 0.604 2.469 1.00 35.53 H new ATOM 0 HD13 LEU A 79 -2.529 1.200 3.127 1.00 35.53 H new ATOM 0 HD21 LEU A 79 -1.916 3.080 0.768 1.00 72.24 H new ATOM 0 HD22 LEU A 79 -0.717 1.981 1.490 1.00 72.24 H new ATOM 0 HD23 LEU A 79 -1.055 1.906 -0.255 1.00 72.24 H new ATOM 1216 N CYS A 80 -2.545 -0.874 -2.485 1.00 21.42 N ATOM 1217 CA CYS A 80 -1.902 -0.800 -3.792 1.00 12.22 C ATOM 1218 C CYS A 80 -1.463 0.627 -4.102 1.00 35.31 C ATOM 1219 O CYS A 80 -2.275 1.552 -4.096 1.00 22.50 O ATOM 1220 CB CYS A 80 -2.852 -1.305 -4.880 1.00 44.45 C ATOM 1221 SG CYS A 80 -2.604 -3.038 -5.330 1.00 63.21 S ATOM 0 H CYS A 80 -3.530 -0.611 -2.484 1.00 21.42 H new ATOM 0 HA CYS A 80 -1.016 -1.435 -3.771 1.00 12.22 H new ATOM 0 HB2 CYS A 80 -3.879 -1.172 -4.541 1.00 44.45 H new ATOM 0 HB3 CYS A 80 -2.728 -0.688 -5.770 1.00 44.45 H new ATOM 0 HG CYS A 80 -3.455 -3.372 -6.254 1.00 63.21 H new ATOM 1227 N VAL A 81 -0.174 0.797 -4.376 1.00 53.20 N ATOM 1228 CA VAL A 81 0.373 2.111 -4.691 1.00 41.11 C ATOM 1229 C VAL A 81 0.662 2.239 -6.183 1.00 65.35 C ATOM 1230 O VAL A 81 1.285 1.363 -6.782 1.00 30.22 O ATOM 1231 CB VAL A 81 1.666 2.390 -3.897 1.00 15.03 C ATOM 1232 CG1 VAL A 81 1.409 2.277 -2.402 1.00 60.21 C ATOM 1233 CG2 VAL A 81 2.778 1.443 -4.324 1.00 71.35 C ATOM 0 H VAL A 81 0.511 0.041 -4.386 1.00 53.20 H new ATOM 0 HA VAL A 81 -0.380 2.846 -4.405 1.00 41.11 H new ATOM 0 HB VAL A 81 1.987 3.409 -4.115 1.00 15.03 H new ATOM 0 HG11 VAL A 81 2.332 2.477 -1.858 1.00 60.21 H new ATOM 0 HG12 VAL A 81 0.650 3.002 -2.107 1.00 60.21 H new ATOM 0 HG13 VAL A 81 1.060 1.271 -2.168 1.00 60.21 H new ATOM 0 HG21 VAL A 81 3.680 1.659 -3.751 1.00 71.35 H new ATOM 0 HG22 VAL A 81 2.469 0.414 -4.141 1.00 71.35 H new ATOM 0 HG23 VAL A 81 2.983 1.578 -5.386 1.00 71.35 H new ATOM 1243 N PHE A 82 0.202 3.334 -6.778 1.00 0.53 N ATOM 1244 CA PHE A 82 0.410 3.575 -8.200 1.00 35.42 C ATOM 1245 C PHE A 82 1.015 4.958 -8.432 1.00 11.32 C ATOM 1246 O PHE A 82 0.507 5.961 -7.932 1.00 41.25 O ATOM 1247 CB PHE A 82 -0.920 3.422 -8.958 1.00 70.23 C ATOM 1248 CG PHE A 82 -1.278 4.590 -9.839 1.00 40.43 C ATOM 1249 CD1 PHE A 82 -0.728 4.713 -11.105 1.00 44.12 C ATOM 1250 CD2 PHE A 82 -2.161 5.562 -9.397 1.00 4.40 C ATOM 1251 CE1 PHE A 82 -1.055 5.785 -11.915 1.00 2.54 C ATOM 1252 CE2 PHE A 82 -2.491 6.635 -10.203 1.00 51.20 C ATOM 1253 CZ PHE A 82 -1.937 6.747 -11.463 1.00 44.23 C ATOM 0 H PHE A 82 -0.317 4.069 -6.297 1.00 0.53 H new ATOM 0 HA PHE A 82 1.115 2.836 -8.582 1.00 35.42 H new ATOM 0 HB2 PHE A 82 -0.872 2.522 -9.572 1.00 70.23 H new ATOM 0 HB3 PHE A 82 -1.721 3.271 -8.234 1.00 70.23 H new ATOM 0 HD1 PHE A 82 -0.037 3.964 -11.463 1.00 44.12 H new ATOM 0 HD2 PHE A 82 -2.596 5.480 -8.412 1.00 4.40 H new ATOM 0 HE1 PHE A 82 -0.621 5.870 -12.900 1.00 2.54 H new ATOM 0 HE2 PHE A 82 -3.182 7.385 -9.848 1.00 51.20 H new ATOM 0 HZ PHE A 82 -2.193 7.585 -12.094 1.00 44.23 H new ATOM 1263 N ALA A 83 2.102 5.000 -9.195 1.00 1.33 N ATOM 1264 CA ALA A 83 2.774 6.257 -9.495 1.00 74.34 C ATOM 1265 C ALA A 83 2.207 6.890 -10.761 1.00 31.32 C ATOM 1266 O ALA A 83 2.194 6.271 -11.825 1.00 11.24 O ATOM 1267 CB ALA A 83 4.271 6.033 -9.640 1.00 54.54 C ATOM 0 H ALA A 83 2.535 4.178 -9.616 1.00 1.33 H new ATOM 0 HA ALA A 83 2.600 6.943 -8.666 1.00 74.34 H new ATOM 0 HB1 ALA A 83 4.761 6.981 -9.864 1.00 54.54 H new ATOM 0 HB2 ALA A 83 4.670 5.629 -8.710 1.00 54.54 H new ATOM 0 HB3 ALA A 83 4.457 5.328 -10.450 1.00 54.54 H new ATOM 1273 N ILE A 84 1.740 8.128 -10.640 1.00 34.33 N ATOM 1274 CA ILE A 84 1.174 8.845 -11.777 1.00 23.21 C ATOM 1275 C ILE A 84 2.230 9.103 -12.848 1.00 31.52 C ATOM 1276 O ILE A 84 1.904 9.317 -14.015 1.00 42.20 O ATOM 1277 CB ILE A 84 0.556 10.190 -11.347 1.00 11.11 C ATOM 1278 CG1 ILE A 84 1.515 10.950 -10.430 1.00 33.44 C ATOM 1279 CG2 ILE A 84 -0.779 9.962 -10.654 1.00 5.12 C ATOM 1280 CD1 ILE A 84 1.535 12.443 -10.679 1.00 4.24 C ATOM 0 H ILE A 84 1.742 8.655 -9.767 1.00 34.33 H new ATOM 0 HA ILE A 84 0.390 8.210 -12.189 1.00 23.21 H new ATOM 0 HB ILE A 84 0.383 10.793 -12.238 1.00 11.11 H new ATOM 0 HG12 ILE A 84 1.235 10.767 -9.393 1.00 33.44 H new ATOM 0 HG13 ILE A 84 2.522 10.554 -10.563 1.00 33.44 H new ATOM 0 HG21 ILE A 84 -1.203 10.921 -10.356 1.00 5.12 H new ATOM 0 HG22 ILE A 84 -1.463 9.460 -11.338 1.00 5.12 H new ATOM 0 HG23 ILE A 84 -0.629 9.342 -9.770 1.00 5.12 H new ATOM 0 HD11 ILE A 84 2.237 12.917 -9.993 1.00 4.24 H new ATOM 0 HD12 ILE A 84 1.845 12.636 -11.706 1.00 4.24 H new ATOM 0 HD13 ILE A 84 0.538 12.852 -10.518 1.00 4.24 H new ATOM 1292 N ASN A 85 3.497 9.082 -12.444 1.00 4.32 N ATOM 1293 CA ASN A 85 4.601 9.315 -13.371 1.00 5.40 C ATOM 1294 C ASN A 85 5.066 8.010 -14.018 1.00 32.01 C ATOM 1295 O ASN A 85 6.083 7.983 -14.712 1.00 13.21 O ATOM 1296 CB ASN A 85 5.777 9.979 -12.648 1.00 3.14 C ATOM 1297 CG ASN A 85 5.332 10.915 -11.541 1.00 64.43 C ATOM 1298 OD1 ASN A 85 4.739 10.486 -10.550 1.00 51.41 O ATOM 1299 ND2 ASN A 85 5.617 12.201 -11.702 1.00 52.35 N ATOM 0 H ASN A 85 3.785 8.906 -11.481 1.00 4.32 H new ATOM 0 HA ASN A 85 4.239 9.980 -14.155 1.00 5.40 H new ATOM 0 HB2 ASN A 85 6.422 9.207 -12.228 1.00 3.14 H new ATOM 0 HB3 ASN A 85 6.374 10.535 -13.370 1.00 3.14 H new ATOM 0 HD21 ASN A 85 5.343 12.877 -10.989 1.00 52.35 H new ATOM 0 HD22 ASN A 85 6.110 12.513 -12.539 1.00 52.35 H new ATOM 1306 N ASN A 86 4.323 6.930 -13.788 1.00 62.51 N ATOM 1307 CA ASN A 86 4.672 5.631 -14.351 1.00 0.35 C ATOM 1308 C ASN A 86 3.430 4.907 -14.861 1.00 5.25 C ATOM 1309 O ASN A 86 2.615 4.423 -14.076 1.00 35.10 O ATOM 1310 CB ASN A 86 5.384 4.775 -13.301 1.00 24.24 C ATOM 1311 CG ASN A 86 6.716 4.243 -13.794 1.00 22.10 C ATOM 1312 OD1 ASN A 86 6.998 4.257 -14.992 1.00 10.35 O ATOM 1313 ND2 ASN A 86 7.542 3.768 -12.869 1.00 20.03 N ATOM 0 H ASN A 86 3.478 6.930 -13.217 1.00 62.51 H new ATOM 0 HA ASN A 86 5.344 5.794 -15.194 1.00 0.35 H new ATOM 0 HB2 ASN A 86 5.544 5.368 -12.400 1.00 24.24 H new ATOM 0 HB3 ASN A 86 4.743 3.939 -13.022 1.00 24.24 H new ATOM 0 HD21 ASN A 86 8.452 3.395 -13.141 1.00 20.03 H new ATOM 0 HD22 ASN A 86 7.267 3.776 -11.887 1.00 20.03 H new ATOM 1320 N THR A 87 3.293 4.833 -16.181 1.00 1.41 N ATOM 1321 CA THR A 87 2.151 4.164 -16.794 1.00 73.21 C ATOM 1322 C THR A 87 2.116 2.688 -16.409 1.00 15.30 C ATOM 1323 O THR A 87 1.047 2.086 -16.314 1.00 41.14 O ATOM 1324 CB THR A 87 2.206 4.305 -18.316 1.00 34.34 C ATOM 1325 OG1 THR A 87 2.858 5.508 -18.685 1.00 70.35 O ATOM 1326 CG2 THR A 87 0.840 4.305 -18.967 1.00 13.11 C ATOM 0 H THR A 87 3.958 5.228 -16.846 1.00 1.41 H new ATOM 0 HA THR A 87 1.242 4.640 -16.426 1.00 73.21 H new ATOM 0 HB THR A 87 2.758 3.433 -18.667 1.00 34.34 H new ATOM 0 HG1 THR A 87 2.885 5.579 -19.662 1.00 70.35 H new ATOM 0 HG21 THR A 87 0.951 4.408 -20.046 1.00 13.11 H new ATOM 0 HG22 THR A 87 0.330 3.368 -18.743 1.00 13.11 H new ATOM 0 HG23 THR A 87 0.253 5.139 -18.581 1.00 13.11 H new ATOM 1334 N LYS A 88 3.294 2.111 -16.188 1.00 62.55 N ATOM 1335 CA LYS A 88 3.396 0.706 -15.812 1.00 22.33 C ATOM 1336 C LYS A 88 2.807 0.471 -14.426 1.00 13.44 C ATOM 1337 O LYS A 88 2.147 -0.541 -14.184 1.00 3.34 O ATOM 1338 CB LYS A 88 4.857 0.252 -15.842 1.00 1.41 C ATOM 1339 CG LYS A 88 5.452 0.209 -17.240 1.00 24.32 C ATOM 1340 CD LYS A 88 6.678 -0.688 -17.297 1.00 23.35 C ATOM 1341 CE LYS A 88 6.305 -2.154 -17.144 1.00 65.20 C ATOM 1342 NZ LYS A 88 7.071 -3.023 -18.080 1.00 71.54 N ATOM 0 H LYS A 88 4.189 2.594 -16.263 1.00 62.55 H new ATOM 0 HA LYS A 88 2.827 0.120 -16.534 1.00 22.33 H new ATOM 0 HB2 LYS A 88 5.451 0.925 -15.224 1.00 1.41 H new ATOM 0 HB3 LYS A 88 4.930 -0.739 -15.394 1.00 1.41 H new ATOM 0 HG2 LYS A 88 4.703 -0.152 -17.944 1.00 24.32 H new ATOM 0 HG3 LYS A 88 5.723 1.218 -17.552 1.00 24.32 H new ATOM 0 HD2 LYS A 88 7.194 -0.540 -18.246 1.00 23.35 H new ATOM 0 HD3 LYS A 88 7.374 -0.405 -16.508 1.00 23.35 H new ATOM 0 HE2 LYS A 88 6.493 -2.471 -16.118 1.00 65.20 H new ATOM 0 HE3 LYS A 88 5.237 -2.278 -17.325 1.00 65.20 H new ATOM 0 HZ1 LYS A 88 6.787 -4.014 -17.944 1.00 71.54 H new ATOM 0 HZ2 LYS A 88 6.872 -2.737 -19.060 1.00 71.54 H new ATOM 0 HZ3 LYS A 88 8.089 -2.925 -17.890 1.00 71.54 H new ATOM 1356 N SER A 89 3.045 1.412 -13.517 1.00 4.22 N ATOM 1357 CA SER A 89 2.534 1.307 -12.155 1.00 60.33 C ATOM 1358 C SER A 89 1.012 1.212 -12.157 1.00 41.21 C ATOM 1359 O SER A 89 0.426 0.446 -11.391 1.00 54.10 O ATOM 1360 CB SER A 89 2.981 2.510 -11.322 1.00 12.11 C ATOM 1361 OG SER A 89 2.303 3.688 -11.722 1.00 43.01 O ATOM 0 H SER A 89 3.589 2.256 -13.699 1.00 4.22 H new ATOM 0 HA SER A 89 2.940 0.399 -11.709 1.00 60.33 H new ATOM 0 HB2 SER A 89 2.789 2.317 -10.267 1.00 12.11 H new ATOM 0 HB3 SER A 89 4.056 2.651 -11.430 1.00 12.11 H new ATOM 0 HG SER A 89 2.802 4.124 -12.444 1.00 43.01 H new ATOM 1367 N PHE A 90 0.377 1.994 -13.024 1.00 32.15 N ATOM 1368 CA PHE A 90 -1.077 1.997 -13.131 1.00 2.31 C ATOM 1369 C PHE A 90 -1.588 0.634 -13.589 1.00 75.21 C ATOM 1370 O PHE A 90 -2.629 0.163 -13.130 1.00 64.44 O ATOM 1371 CB PHE A 90 -1.533 3.087 -14.107 1.00 44.42 C ATOM 1372 CG PHE A 90 -3.011 3.076 -14.382 1.00 71.32 C ATOM 1373 CD1 PHE A 90 -3.919 2.876 -13.355 1.00 43.53 C ATOM 1374 CD2 PHE A 90 -3.490 3.264 -15.669 1.00 2.31 C ATOM 1375 CE1 PHE A 90 -5.278 2.864 -13.606 1.00 5.34 C ATOM 1376 CE2 PHE A 90 -4.848 3.252 -15.926 1.00 74.52 C ATOM 1377 CZ PHE A 90 -5.743 3.052 -14.893 1.00 20.21 C ATOM 0 H PHE A 90 0.848 2.634 -13.663 1.00 32.15 H new ATOM 0 HA PHE A 90 -1.493 2.207 -12.146 1.00 2.31 H new ATOM 0 HB2 PHE A 90 -1.255 4.061 -13.705 1.00 44.42 H new ATOM 0 HB3 PHE A 90 -0.997 2.966 -15.048 1.00 44.42 H new ATOM 0 HD1 PHE A 90 -3.561 2.728 -12.347 1.00 43.53 H new ATOM 0 HD2 PHE A 90 -2.794 3.422 -16.480 1.00 2.31 H new ATOM 0 HE1 PHE A 90 -5.976 2.708 -12.797 1.00 5.34 H new ATOM 0 HE2 PHE A 90 -5.209 3.399 -16.933 1.00 74.52 H new ATOM 0 HZ PHE A 90 -6.805 3.043 -15.091 1.00 20.21 H new ATOM 1387 N GLU A 91 -0.848 0.007 -14.497 1.00 52.21 N ATOM 1388 CA GLU A 91 -1.225 -1.301 -15.021 1.00 60.34 C ATOM 1389 C GLU A 91 -0.906 -2.406 -14.017 1.00 24.54 C ATOM 1390 O GLU A 91 -1.544 -3.459 -14.017 1.00 13.02 O ATOM 1391 CB GLU A 91 -0.500 -1.570 -16.341 1.00 72.34 C ATOM 1392 CG GLU A 91 -0.731 -0.496 -17.392 1.00 73.30 C ATOM 1393 CD GLU A 91 -1.250 -1.059 -18.701 1.00 0.03 C ATOM 1394 OE1 GLU A 91 -2.484 -1.189 -18.843 1.00 55.12 O ATOM 1395 OE2 GLU A 91 -0.423 -1.369 -19.583 1.00 40.20 O ATOM 0 H GLU A 91 0.017 0.383 -14.886 1.00 52.21 H new ATOM 0 HA GLU A 91 -2.301 -1.298 -15.197 1.00 60.34 H new ATOM 0 HB2 GLU A 91 0.570 -1.654 -16.148 1.00 72.34 H new ATOM 0 HB3 GLU A 91 -0.829 -2.531 -16.737 1.00 72.34 H new ATOM 0 HG2 GLU A 91 -1.443 0.235 -17.008 1.00 73.30 H new ATOM 0 HG3 GLU A 91 0.203 0.035 -17.575 1.00 73.30 H new ATOM 1402 N ASP A 92 0.084 -2.161 -13.165 1.00 31.02 N ATOM 1403 CA ASP A 92 0.487 -3.137 -12.159 1.00 72.24 C ATOM 1404 C ASP A 92 -0.575 -3.270 -11.070 1.00 63.10 C ATOM 1405 O ASP A 92 -0.783 -4.352 -10.521 1.00 12.45 O ATOM 1406 CB ASP A 92 1.828 -2.737 -11.539 1.00 62.42 C ATOM 1407 CG ASP A 92 2.958 -3.652 -11.967 1.00 53.41 C ATOM 1408 OD1 ASP A 92 2.888 -4.197 -13.089 1.00 20.01 O ATOM 1409 OD2 ASP A 92 3.913 -3.824 -11.181 1.00 73.42 O ATOM 0 H ASP A 92 0.622 -1.295 -13.151 1.00 31.02 H new ATOM 0 HA ASP A 92 0.597 -4.104 -12.650 1.00 72.24 H new ATOM 0 HB2 ASP A 92 2.066 -1.712 -11.824 1.00 62.42 H new ATOM 0 HB3 ASP A 92 1.742 -2.754 -10.453 1.00 62.42 H new ATOM 1414 N ILE A 93 -1.246 -2.165 -10.763 1.00 22.41 N ATOM 1415 CA ILE A 93 -2.286 -2.164 -9.742 1.00 44.33 C ATOM 1416 C ILE A 93 -3.416 -3.120 -10.116 1.00 42.24 C ATOM 1417 O ILE A 93 -4.071 -3.693 -9.245 1.00 62.40 O ATOM 1418 CB ILE A 93 -2.864 -0.745 -9.528 1.00 44.32 C ATOM 1419 CG1 ILE A 93 -1.801 0.191 -8.962 1.00 25.11 C ATOM 1420 CG2 ILE A 93 -4.064 -0.780 -8.599 1.00 23.02 C ATOM 1421 CD1 ILE A 93 -1.087 -0.360 -7.745 1.00 13.44 C ATOM 0 H ILE A 93 -1.088 -1.260 -11.206 1.00 22.41 H new ATOM 0 HA ILE A 93 -1.825 -2.498 -8.812 1.00 44.33 H new ATOM 0 HB ILE A 93 -3.186 -0.369 -10.499 1.00 44.32 H new ATOM 0 HG12 ILE A 93 -1.066 0.402 -9.738 1.00 25.11 H new ATOM 0 HG13 ILE A 93 -2.269 1.140 -8.699 1.00 25.11 H new ATOM 0 HG21 ILE A 93 -4.451 0.230 -8.466 1.00 23.02 H new ATOM 0 HG22 ILE A 93 -4.840 -1.412 -9.031 1.00 23.02 H new ATOM 0 HG23 ILE A 93 -3.764 -1.184 -7.632 1.00 23.02 H new ATOM 0 HD11 ILE A 93 -0.346 0.362 -7.400 1.00 13.44 H new ATOM 0 HD12 ILE A 93 -1.811 -0.545 -6.951 1.00 13.44 H new ATOM 0 HD13 ILE A 93 -0.589 -1.294 -8.007 1.00 13.44 H new ATOM 1433 N HIS A 94 -3.639 -3.285 -11.415 1.00 63.24 N ATOM 1434 CA HIS A 94 -4.690 -4.169 -11.902 1.00 54.13 C ATOM 1435 C HIS A 94 -4.312 -5.633 -11.687 1.00 2.41 C ATOM 1436 O HIS A 94 -5.055 -6.391 -11.064 1.00 71.12 O ATOM 1437 CB HIS A 94 -4.957 -3.904 -13.387 1.00 42.22 C ATOM 1438 CG HIS A 94 -5.886 -4.894 -14.022 1.00 24.52 C ATOM 1439 ND1 HIS A 94 -7.259 -4.797 -13.944 1.00 3.32 N ATOM 1440 CD2 HIS A 94 -5.630 -6.008 -14.748 1.00 62.21 C ATOM 1441 CE1 HIS A 94 -7.807 -5.808 -14.594 1.00 42.25 C ATOM 1442 NE2 HIS A 94 -6.840 -6.557 -15.091 1.00 41.55 N ATOM 0 H HIS A 94 -3.106 -2.818 -12.149 1.00 63.24 H new ATOM 0 HA HIS A 94 -5.599 -3.964 -11.336 1.00 54.13 H new ATOM 0 HB2 HIS A 94 -5.376 -2.904 -13.498 1.00 42.22 H new ATOM 0 HB3 HIS A 94 -4.009 -3.914 -13.924 1.00 42.22 H new ATOM 0 HD1 HIS A 94 -7.772 -4.060 -13.460 1.00 3.32 H new ATOM 0 HD2 HIS A 94 -4.655 -6.393 -15.009 1.00 62.21 H new ATOM 0 HE1 HIS A 94 -8.866 -5.991 -14.701 1.00 42.25 H new ATOM 1451 N GLN A 95 -3.155 -6.023 -12.210 1.00 3.24 N ATOM 1452 CA GLN A 95 -2.682 -7.397 -12.078 1.00 1.21 C ATOM 1453 C GLN A 95 -2.362 -7.729 -10.624 1.00 32.31 C ATOM 1454 O GLN A 95 -2.508 -8.873 -10.193 1.00 32.32 O ATOM 1455 CB GLN A 95 -1.444 -7.619 -12.950 1.00 25.03 C ATOM 1456 CG GLN A 95 -0.298 -6.674 -12.633 1.00 1.35 C ATOM 1457 CD GLN A 95 0.672 -7.253 -11.621 1.00 10.40 C ATOM 1458 OE1 GLN A 95 0.746 -8.469 -11.441 1.00 21.14 O ATOM 1459 NE2 GLN A 95 1.421 -6.383 -10.955 1.00 75.42 N ATOM 0 H GLN A 95 -2.528 -5.408 -12.729 1.00 3.24 H new ATOM 0 HA GLN A 95 -3.478 -8.061 -12.414 1.00 1.21 H new ATOM 0 HB2 GLN A 95 -1.102 -8.646 -12.825 1.00 25.03 H new ATOM 0 HB3 GLN A 95 -1.722 -7.501 -13.997 1.00 25.03 H new ATOM 0 HG2 GLN A 95 0.239 -6.439 -13.552 1.00 1.35 H new ATOM 0 HG3 GLN A 95 -0.700 -5.736 -12.250 1.00 1.35 H new ATOM 0 HE21 GLN A 95 1.326 -5.384 -11.137 1.00 75.42 H new ATOM 0 HE22 GLN A 95 2.092 -6.714 -10.261 1.00 75.42 H new ATOM 1468 N TYR A 96 -1.925 -6.724 -9.873 1.00 30.34 N ATOM 1469 CA TYR A 96 -1.585 -6.914 -8.467 1.00 10.21 C ATOM 1470 C TYR A 96 -2.800 -7.381 -7.672 1.00 22.04 C ATOM 1471 O TYR A 96 -2.720 -8.339 -6.903 1.00 43.41 O ATOM 1472 CB TYR A 96 -1.037 -5.615 -7.872 1.00 4.32 C ATOM 1473 CG TYR A 96 0.466 -5.489 -7.982 1.00 61.45 C ATOM 1474 CD1 TYR A 96 1.297 -6.549 -7.639 1.00 54.32 C ATOM 1475 CD2 TYR A 96 1.054 -4.313 -8.430 1.00 23.35 C ATOM 1476 CE1 TYR A 96 2.670 -6.440 -7.739 1.00 0.10 C ATOM 1477 CE2 TYR A 96 2.427 -4.197 -8.534 1.00 14.52 C ATOM 1478 CZ TYR A 96 3.230 -5.262 -8.187 1.00 74.25 C ATOM 1479 OH TYR A 96 4.598 -5.151 -8.290 1.00 41.02 O ATOM 0 H TYR A 96 -1.798 -5.771 -10.213 1.00 30.34 H new ATOM 0 HA TYR A 96 -0.816 -7.684 -8.406 1.00 10.21 H new ATOM 0 HB2 TYR A 96 -1.503 -4.769 -8.377 1.00 4.32 H new ATOM 0 HB3 TYR A 96 -1.323 -5.557 -6.822 1.00 4.32 H new ATOM 0 HD1 TYR A 96 0.862 -7.473 -7.288 1.00 54.32 H new ATOM 0 HD2 TYR A 96 0.428 -3.476 -8.701 1.00 23.35 H new ATOM 0 HE1 TYR A 96 3.302 -7.273 -7.468 1.00 0.10 H new ATOM 0 HE2 TYR A 96 2.869 -3.276 -8.885 1.00 14.52 H new ATOM 0 HH TYR A 96 4.970 -4.879 -7.425 1.00 41.02 H new ATOM 1489 N ARG A 97 -3.924 -6.698 -7.862 1.00 11.03 N ATOM 1490 CA ARG A 97 -5.156 -7.045 -7.163 1.00 74.13 C ATOM 1491 C ARG A 97 -5.573 -8.480 -7.471 1.00 45.43 C ATOM 1492 O ARG A 97 -6.107 -9.180 -6.611 1.00 2.31 O ATOM 1493 CB ARG A 97 -6.277 -6.081 -7.556 1.00 32.03 C ATOM 1494 CG ARG A 97 -7.567 -6.303 -6.782 1.00 52.25 C ATOM 1495 CD ARG A 97 -8.785 -6.186 -7.683 1.00 11.20 C ATOM 1496 NE ARG A 97 -10.033 -6.279 -6.929 1.00 12.22 N ATOM 1497 CZ ARG A 97 -11.212 -6.564 -7.477 1.00 21.15 C ATOM 1498 NH1 ARG A 97 -11.309 -6.783 -8.783 1.00 43.31 N ATOM 1499 NH2 ARG A 97 -12.297 -6.630 -6.718 1.00 11.32 N ATOM 0 H ARG A 97 -4.007 -5.902 -8.494 1.00 11.03 H new ATOM 0 HA ARG A 97 -4.972 -6.962 -6.092 1.00 74.13 H new ATOM 0 HB2 ARG A 97 -5.938 -5.057 -7.396 1.00 32.03 H new ATOM 0 HB3 ARG A 97 -6.479 -6.187 -8.622 1.00 32.03 H new ATOM 0 HG2 ARG A 97 -7.549 -7.290 -6.319 1.00 52.25 H new ATOM 0 HG3 ARG A 97 -7.639 -5.573 -5.975 1.00 52.25 H new ATOM 0 HD2 ARG A 97 -8.753 -5.235 -8.215 1.00 11.20 H new ATOM 0 HD3 ARG A 97 -8.756 -6.974 -8.436 1.00 11.20 H new ATOM 0 HE ARG A 97 -9.999 -6.116 -5.923 1.00 12.22 H new ATOM 0 HH11 ARG A 97 -10.477 -6.733 -9.372 1.00 43.31 H new ATOM 0 HH12 ARG A 97 -12.215 -7.001 -9.198 1.00 43.31 H new ATOM 0 HH21 ARG A 97 -12.228 -6.462 -5.714 1.00 11.32 H new ATOM 0 HH22 ARG A 97 -13.201 -6.848 -7.138 1.00 11.32 H new ATOM 1513 N GLU A 98 -5.323 -8.910 -8.703 1.00 42.44 N ATOM 1514 CA GLU A 98 -5.669 -10.262 -9.126 1.00 20.30 C ATOM 1515 C GLU A 98 -4.951 -11.303 -8.272 1.00 61.04 C ATOM 1516 O GLU A 98 -5.432 -12.424 -8.107 1.00 33.24 O ATOM 1517 CB GLU A 98 -5.316 -10.465 -10.601 1.00 0.34 C ATOM 1518 CG GLU A 98 -6.028 -9.500 -11.535 1.00 31.44 C ATOM 1519 CD GLU A 98 -5.576 -9.643 -12.976 1.00 14.44 C ATOM 1520 OE1 GLU A 98 -4.499 -10.233 -13.205 1.00 52.51 O ATOM 1521 OE2 GLU A 98 -6.300 -9.166 -13.875 1.00 54.14 O ATOM 0 H GLU A 98 -4.882 -8.342 -9.426 1.00 42.44 H new ATOM 0 HA GLU A 98 -6.743 -10.391 -8.995 1.00 20.30 H new ATOM 0 HB2 GLU A 98 -4.239 -10.352 -10.727 1.00 0.34 H new ATOM 0 HB3 GLU A 98 -5.565 -11.486 -10.888 1.00 0.34 H new ATOM 0 HG2 GLU A 98 -7.103 -9.670 -11.477 1.00 31.44 H new ATOM 0 HG3 GLU A 98 -5.848 -8.478 -11.201 1.00 31.44 H new ATOM 1528 N GLN A 99 -3.797 -10.925 -7.732 1.00 75.25 N ATOM 1529 CA GLN A 99 -3.012 -11.820 -6.897 1.00 41.01 C ATOM 1530 C GLN A 99 -3.618 -11.915 -5.497 1.00 71.30 C ATOM 1531 O GLN A 99 -3.584 -12.972 -4.866 1.00 25.42 O ATOM 1532 CB GLN A 99 -1.561 -11.326 -6.834 1.00 12.34 C ATOM 1533 CG GLN A 99 -0.765 -11.870 -5.660 1.00 64.11 C ATOM 1534 CD GLN A 99 -0.523 -13.364 -5.756 1.00 2.50 C ATOM 1535 OE1 GLN A 99 -1.458 -14.148 -5.919 1.00 23.55 O ATOM 1536 NE2 GLN A 99 0.740 -13.765 -5.655 1.00 62.30 N ATOM 0 H GLN A 99 -3.385 -10.001 -7.860 1.00 75.25 H new ATOM 0 HA GLN A 99 -3.023 -12.819 -7.334 1.00 41.01 H new ATOM 0 HB2 GLN A 99 -1.055 -11.602 -7.759 1.00 12.34 H new ATOM 0 HB3 GLN A 99 -1.562 -10.237 -6.784 1.00 12.34 H new ATOM 0 HG2 GLN A 99 0.194 -11.354 -5.607 1.00 64.11 H new ATOM 0 HG3 GLN A 99 -1.297 -11.651 -4.734 1.00 64.11 H new ATOM 0 HE21 GLN A 99 1.483 -13.080 -5.520 1.00 62.30 H new ATOM 0 HE22 GLN A 99 0.966 -14.758 -5.712 1.00 62.30 H new ATOM 1545 N ILE A 100 -4.175 -10.806 -5.021 1.00 23.41 N ATOM 1546 CA ILE A 100 -4.792 -10.767 -3.701 1.00 2.43 C ATOM 1547 C ILE A 100 -6.069 -11.602 -3.669 1.00 64.41 C ATOM 1548 O ILE A 100 -6.285 -12.390 -2.749 1.00 64.03 O ATOM 1549 CB ILE A 100 -5.121 -9.321 -3.280 1.00 32.14 C ATOM 1550 CG1 ILE A 100 -3.865 -8.451 -3.348 1.00 33.22 C ATOM 1551 CG2 ILE A 100 -5.718 -9.292 -1.879 1.00 52.24 C ATOM 1552 CD1 ILE A 100 -4.149 -6.968 -3.257 1.00 43.52 C ATOM 0 H ILE A 100 -4.212 -9.923 -5.530 1.00 23.41 H new ATOM 0 HA ILE A 100 -4.072 -11.185 -2.998 1.00 2.43 H new ATOM 0 HB ILE A 100 -5.860 -8.918 -3.973 1.00 32.14 H new ATOM 0 HG12 ILE A 100 -3.193 -8.734 -2.538 1.00 33.22 H new ATOM 0 HG13 ILE A 100 -3.342 -8.655 -4.282 1.00 33.22 H new ATOM 0 HG21 ILE A 100 -5.943 -8.262 -1.601 1.00 52.24 H new ATOM 0 HG22 ILE A 100 -6.635 -9.881 -1.862 1.00 52.24 H new ATOM 0 HG23 ILE A 100 -5.004 -9.711 -1.170 1.00 52.24 H new ATOM 0 HD11 ILE A 100 -3.212 -6.414 -3.312 1.00 43.52 H new ATOM 0 HD12 ILE A 100 -4.796 -6.670 -4.082 1.00 43.52 H new ATOM 0 HD13 ILE A 100 -4.644 -6.750 -2.311 1.00 43.52 H new ATOM 1564 N LYS A 101 -6.910 -11.423 -4.682 1.00 14.30 N ATOM 1565 CA LYS A 101 -8.166 -12.159 -4.772 1.00 12.43 C ATOM 1566 C LYS A 101 -7.916 -13.664 -4.807 1.00 43.45 C ATOM 1567 O LYS A 101 -8.769 -14.454 -4.402 1.00 14.25 O ATOM 1568 CB LYS A 101 -8.942 -11.729 -6.018 1.00 71.45 C ATOM 1569 CG LYS A 101 -9.278 -10.247 -6.044 1.00 65.21 C ATOM 1570 CD LYS A 101 -9.488 -9.748 -7.464 1.00 5.30 C ATOM 1571 CE LYS A 101 -10.699 -10.402 -8.110 1.00 45.31 C ATOM 1572 NZ LYS A 101 -11.003 -9.818 -9.447 1.00 23.51 N ATOM 0 H LYS A 101 -6.745 -10.775 -5.452 1.00 14.30 H new ATOM 0 HA LYS A 101 -8.757 -11.930 -3.886 1.00 12.43 H new ATOM 0 HB2 LYS A 101 -8.357 -11.976 -6.904 1.00 71.45 H new ATOM 0 HB3 LYS A 101 -9.866 -12.304 -6.077 1.00 71.45 H new ATOM 0 HG2 LYS A 101 -10.179 -10.067 -5.457 1.00 65.21 H new ATOM 0 HG3 LYS A 101 -8.473 -9.682 -5.574 1.00 65.21 H new ATOM 0 HD2 LYS A 101 -9.619 -8.666 -7.455 1.00 5.30 H new ATOM 0 HD3 LYS A 101 -8.599 -9.957 -8.060 1.00 5.30 H new ATOM 0 HE2 LYS A 101 -10.520 -11.472 -8.214 1.00 45.31 H new ATOM 0 HE3 LYS A 101 -11.565 -10.285 -7.458 1.00 45.31 H new ATOM 0 HZ1 LYS A 101 -11.994 -9.503 -9.471 1.00 23.51 H new ATOM 0 HZ2 LYS A 101 -10.377 -9.006 -9.621 1.00 23.51 H new ATOM 0 HZ3 LYS A 101 -10.850 -10.537 -10.183 1.00 23.51 H new ATOM 1586 N ARG A 102 -6.742 -14.055 -5.295 1.00 30.45 N ATOM 1587 CA ARG A 102 -6.382 -15.466 -5.382 1.00 72.11 C ATOM 1588 C ARG A 102 -6.209 -16.072 -3.993 1.00 13.33 C ATOM 1589 O ARG A 102 -6.893 -17.030 -3.633 1.00 12.11 O ATOM 1590 CB ARG A 102 -5.094 -15.637 -6.189 1.00 32.21 C ATOM 1591 CG ARG A 102 -4.671 -17.088 -6.358 1.00 22.23 C ATOM 1592 CD ARG A 102 -3.881 -17.292 -7.640 1.00 4.40 C ATOM 1593 NE ARG A 102 -3.363 -18.654 -7.753 1.00 52.25 N ATOM 1594 CZ ARG A 102 -4.118 -19.714 -8.036 1.00 13.05 C ATOM 1595 NH1 ARG A 102 -5.422 -19.574 -8.235 1.00 73.43 N ATOM 1596 NH2 ARG A 102 -3.566 -20.917 -8.121 1.00 22.13 N ATOM 0 H ARG A 102 -6.025 -13.415 -5.636 1.00 30.45 H new ATOM 0 HA ARG A 102 -7.193 -15.990 -5.888 1.00 72.11 H new ATOM 0 HB2 ARG A 102 -5.230 -15.190 -7.174 1.00 32.21 H new ATOM 0 HB3 ARG A 102 -4.291 -15.088 -5.697 1.00 32.21 H new ATOM 0 HG2 ARG A 102 -4.066 -17.394 -5.504 1.00 22.23 H new ATOM 0 HG3 ARG A 102 -5.554 -17.727 -6.368 1.00 22.23 H new ATOM 0 HD2 ARG A 102 -4.518 -17.074 -8.497 1.00 4.40 H new ATOM 0 HD3 ARG A 102 -3.052 -16.585 -7.671 1.00 4.40 H new ATOM 0 HE ARG A 102 -2.364 -18.801 -7.606 1.00 52.25 H new ATOM 0 HH11 ARG A 102 -5.851 -18.651 -8.172 1.00 73.43 H new ATOM 0 HH12 ARG A 102 -5.995 -20.389 -8.451 1.00 73.43 H new ATOM 0 HH21 ARG A 102 -2.564 -21.030 -7.970 1.00 22.13 H new ATOM 0 HH22 ARG A 102 -4.144 -21.729 -8.338 1.00 22.13 H new ATOM 1610 N VAL A 103 -5.289 -15.508 -3.216 1.00 33.21 N ATOM 1611 CA VAL A 103 -5.027 -15.994 -1.867 1.00 65.11 C ATOM 1612 C VAL A 103 -6.267 -15.872 -0.988 1.00 70.22 C ATOM 1613 O VAL A 103 -6.719 -16.850 -0.394 1.00 5.10 O ATOM 1614 CB VAL A 103 -3.868 -15.224 -1.208 1.00 61.54 C ATOM 1615 CG1 VAL A 103 -3.487 -15.862 0.119 1.00 35.53 C ATOM 1616 CG2 VAL A 103 -2.669 -15.163 -2.143 1.00 21.24 C ATOM 0 H VAL A 103 -4.713 -14.715 -3.498 1.00 33.21 H new ATOM 0 HA VAL A 103 -4.751 -17.045 -1.958 1.00 65.11 H new ATOM 0 HB VAL A 103 -4.199 -14.204 -1.011 1.00 61.54 H new ATOM 0 HG11 VAL A 103 -2.666 -15.303 0.569 1.00 35.53 H new ATOM 0 HG12 VAL A 103 -4.346 -15.848 0.790 1.00 35.53 H new ATOM 0 HG13 VAL A 103 -3.175 -16.893 -0.049 1.00 35.53 H new ATOM 0 HG21 VAL A 103 -1.859 -14.615 -1.661 1.00 21.24 H new ATOM 0 HG22 VAL A 103 -2.336 -16.175 -2.374 1.00 21.24 H new ATOM 0 HG23 VAL A 103 -2.952 -14.655 -3.065 1.00 21.24 H new ATOM 1626 N LYS A 104 -6.814 -14.663 -0.913 1.00 22.02 N ATOM 1627 CA LYS A 104 -8.003 -14.411 -0.108 1.00 12.53 C ATOM 1628 C LYS A 104 -9.199 -15.188 -0.648 1.00 62.12 C ATOM 1629 O LYS A 104 -10.131 -15.504 0.091 1.00 14.23 O ATOM 1630 CB LYS A 104 -8.321 -12.915 -0.084 1.00 33.55 C ATOM 1631 CG LYS A 104 -7.163 -12.055 0.397 1.00 73.55 C ATOM 1632 CD LYS A 104 -7.121 -11.977 1.914 1.00 14.52 C ATOM 1633 CE LYS A 104 -8.012 -10.863 2.443 1.00 52.55 C ATOM 1634 NZ LYS A 104 -9.114 -11.391 3.293 1.00 53.15 N ATOM 0 H LYS A 104 -6.453 -13.843 -1.400 1.00 22.02 H new ATOM 0 HA LYS A 104 -7.801 -14.749 0.909 1.00 12.53 H new ATOM 0 HB2 LYS A 104 -8.607 -12.597 -1.086 1.00 33.55 H new ATOM 0 HB3 LYS A 104 -9.182 -12.745 0.563 1.00 33.55 H new ATOM 0 HG2 LYS A 104 -6.224 -12.467 0.027 1.00 73.55 H new ATOM 0 HG3 LYS A 104 -7.257 -11.051 -0.018 1.00 73.55 H new ATOM 0 HD2 LYS A 104 -7.439 -12.930 2.337 1.00 14.52 H new ATOM 0 HD3 LYS A 104 -6.095 -11.810 2.242 1.00 14.52 H new ATOM 0 HE2 LYS A 104 -7.411 -10.161 3.022 1.00 52.55 H new ATOM 0 HE3 LYS A 104 -8.434 -10.307 1.606 1.00 52.55 H new ATOM 0 HZ1 LYS A 104 -9.698 -10.601 3.634 1.00 53.15 H new ATOM 0 HZ2 LYS A 104 -9.703 -12.041 2.734 1.00 53.15 H new ATOM 0 HZ3 LYS A 104 -8.712 -11.900 4.106 1.00 53.15 H new ATOM 1648 N ASP A 105 -9.167 -15.494 -1.943 1.00 25.11 N ATOM 1649 CA ASP A 105 -10.249 -16.235 -2.580 1.00 3.11 C ATOM 1650 C ASP A 105 -11.544 -15.429 -2.562 1.00 34.10 C ATOM 1651 O ASP A 105 -12.603 -15.941 -2.198 1.00 1.14 O ATOM 1652 CB ASP A 105 -10.456 -17.579 -1.879 1.00 21.34 C ATOM 1653 CG ASP A 105 -11.136 -18.600 -2.771 1.00 72.44 C ATOM 1654 OD1 ASP A 105 -10.580 -18.914 -3.844 1.00 75.35 O ATOM 1655 OD2 ASP A 105 -12.224 -19.085 -2.395 1.00 22.31 O ATOM 0 H ASP A 105 -8.404 -15.240 -2.570 1.00 25.11 H new ATOM 0 HA ASP A 105 -9.972 -16.416 -3.618 1.00 3.11 H new ATOM 0 HB2 ASP A 105 -9.491 -17.969 -1.556 1.00 21.34 H new ATOM 0 HB3 ASP A 105 -11.056 -17.429 -0.981 1.00 21.34 H new ATOM 1660 N SER A 106 -11.451 -14.164 -2.958 1.00 12.24 N ATOM 1661 CA SER A 106 -12.613 -13.284 -2.988 1.00 14.32 C ATOM 1662 C SER A 106 -12.305 -12.005 -3.762 1.00 53.11 C ATOM 1663 O SER A 106 -11.154 -11.574 -3.834 1.00 71.55 O ATOM 1664 CB SER A 106 -13.058 -12.943 -1.564 1.00 50.22 C ATOM 1665 OG SER A 106 -14.336 -13.489 -1.285 1.00 73.33 O ATOM 0 H SER A 106 -10.582 -13.725 -3.263 1.00 12.24 H new ATOM 0 HA SER A 106 -13.423 -13.807 -3.496 1.00 14.32 H new ATOM 0 HB2 SER A 106 -12.330 -13.329 -0.850 1.00 50.22 H new ATOM 0 HB3 SER A 106 -13.086 -11.861 -1.438 1.00 50.22 H new ATOM 0 HG SER A 106 -14.323 -14.455 -1.452 1.00 73.33 H new ATOM 1671 N ASP A 107 -13.339 -11.404 -4.339 1.00 70.44 N ATOM 1672 CA ASP A 107 -13.178 -10.176 -5.108 1.00 33.34 C ATOM 1673 C ASP A 107 -13.346 -8.948 -4.219 1.00 4.44 C ATOM 1674 O ASP A 107 -12.667 -7.938 -4.403 1.00 3.42 O ATOM 1675 CB ASP A 107 -14.189 -10.132 -6.255 1.00 63.51 C ATOM 1676 CG ASP A 107 -15.623 -10.142 -5.763 1.00 42.54 C ATOM 1677 OD1 ASP A 107 -15.988 -11.075 -5.017 1.00 55.01 O ATOM 1678 OD2 ASP A 107 -16.381 -9.217 -6.124 1.00 41.31 O ATOM 0 H ASP A 107 -14.298 -11.747 -4.289 1.00 70.44 H new ATOM 0 HA ASP A 107 -12.169 -10.166 -5.521 1.00 33.34 H new ATOM 0 HB2 ASP A 107 -14.019 -9.236 -6.851 1.00 63.51 H new ATOM 0 HB3 ASP A 107 -14.027 -10.987 -6.911 1.00 63.51 H new ATOM 1683 N ASP A 108 -14.255 -9.042 -3.254 1.00 31.31 N ATOM 1684 CA ASP A 108 -14.514 -7.938 -2.337 1.00 64.42 C ATOM 1685 C ASP A 108 -13.637 -8.045 -1.094 1.00 55.02 C ATOM 1686 O ASP A 108 -14.077 -8.531 -0.052 1.00 52.02 O ATOM 1687 CB ASP A 108 -15.989 -7.918 -1.933 1.00 43.24 C ATOM 1688 CG ASP A 108 -16.330 -6.740 -1.042 1.00 31.14 C ATOM 1689 OD1 ASP A 108 -16.089 -5.588 -1.463 1.00 43.12 O ATOM 1690 OD2 ASP A 108 -16.837 -6.968 0.076 1.00 12.14 O ATOM 0 H ASP A 108 -14.825 -9.871 -3.087 1.00 31.31 H new ATOM 0 HA ASP A 108 -14.272 -7.008 -2.852 1.00 64.42 H new ATOM 0 HB2 ASP A 108 -16.608 -7.882 -2.830 1.00 43.24 H new ATOM 0 HB3 ASP A 108 -16.233 -8.845 -1.414 1.00 43.24 H new ATOM 1695 N VAL A 109 -12.395 -7.583 -1.208 1.00 41.42 N ATOM 1696 CA VAL A 109 -11.460 -7.624 -0.091 1.00 54.14 C ATOM 1697 C VAL A 109 -11.104 -6.214 0.378 1.00 24.22 C ATOM 1698 O VAL A 109 -11.135 -5.265 -0.406 1.00 33.32 O ATOM 1699 CB VAL A 109 -10.168 -8.380 -0.461 1.00 43.24 C ATOM 1700 CG1 VAL A 109 -10.492 -9.784 -0.948 1.00 74.10 C ATOM 1701 CG2 VAL A 109 -9.375 -7.617 -1.513 1.00 41.44 C ATOM 0 H VAL A 109 -12.014 -7.176 -2.062 1.00 41.42 H new ATOM 0 HA VAL A 109 -11.957 -8.157 0.719 1.00 54.14 H new ATOM 0 HB VAL A 109 -9.552 -8.459 0.435 1.00 43.24 H new ATOM 0 HG11 VAL A 109 -9.568 -10.302 -1.205 1.00 74.10 H new ATOM 0 HG12 VAL A 109 -11.009 -10.332 -0.160 1.00 74.10 H new ATOM 0 HG13 VAL A 109 -11.132 -9.725 -1.829 1.00 74.10 H new ATOM 0 HG21 VAL A 109 -8.468 -8.170 -1.757 1.00 41.44 H new ATOM 0 HG22 VAL A 109 -9.981 -7.499 -2.411 1.00 41.44 H new ATOM 0 HG23 VAL A 109 -9.107 -6.634 -1.125 1.00 41.44 H new ATOM 1711 N PRO A 110 -10.761 -6.059 1.667 1.00 13.15 N ATOM 1712 CA PRO A 110 -10.399 -4.758 2.236 1.00 12.05 C ATOM 1713 C PRO A 110 -9.055 -4.253 1.724 1.00 11.01 C ATOM 1714 O PRO A 110 -8.000 -4.729 2.144 1.00 52.21 O ATOM 1715 CB PRO A 110 -10.330 -5.032 3.740 1.00 24.10 C ATOM 1716 CG PRO A 110 -10.036 -6.488 3.850 1.00 61.22 C ATOM 1717 CD PRO A 110 -10.700 -7.140 2.669 1.00 74.03 C ATOM 0 HA PRO A 110 -11.115 -3.983 1.963 1.00 12.05 H new ATOM 0 HB2 PRO A 110 -9.552 -4.435 4.215 1.00 24.10 H new ATOM 0 HB3 PRO A 110 -11.270 -4.780 4.231 1.00 24.10 H new ATOM 0 HG2 PRO A 110 -8.961 -6.670 3.842 1.00 61.22 H new ATOM 0 HG3 PRO A 110 -10.421 -6.893 4.786 1.00 61.22 H new ATOM 0 HD2 PRO A 110 -10.125 -7.992 2.306 1.00 74.03 H new ATOM 0 HD3 PRO A 110 -11.694 -7.510 2.921 1.00 74.03 H new ATOM 1725 N MET A 111 -9.100 -3.285 0.814 1.00 63.00 N ATOM 1726 CA MET A 111 -7.886 -2.712 0.245 1.00 61.31 C ATOM 1727 C MET A 111 -8.125 -1.275 -0.209 1.00 60.23 C ATOM 1728 O MET A 111 -9.265 -0.816 -0.275 1.00 33.04 O ATOM 1729 CB MET A 111 -7.401 -3.558 -0.934 1.00 14.43 C ATOM 1730 CG MET A 111 -8.410 -3.660 -2.065 1.00 12.13 C ATOM 1731 SD MET A 111 -7.646 -4.087 -3.640 1.00 43.33 S ATOM 1732 CE MET A 111 -7.406 -5.848 -3.426 1.00 63.33 C ATOM 0 H MET A 111 -9.965 -2.881 0.455 1.00 63.00 H new ATOM 0 HA MET A 111 -7.118 -2.707 1.019 1.00 61.31 H new ATOM 0 HB2 MET A 111 -6.476 -3.130 -1.321 1.00 14.43 H new ATOM 0 HB3 MET A 111 -7.164 -4.561 -0.578 1.00 14.43 H new ATOM 0 HG2 MET A 111 -9.158 -4.412 -1.813 1.00 12.13 H new ATOM 0 HG3 MET A 111 -8.934 -2.710 -2.166 1.00 12.13 H new ATOM 0 HE1 MET A 111 -6.673 -6.206 -4.149 1.00 63.33 H new ATOM 0 HE2 MET A 111 -7.046 -6.046 -2.416 1.00 63.33 H new ATOM 0 HE3 MET A 111 -8.352 -6.366 -3.582 1.00 63.33 H new ATOM 1742 N VAL A 112 -7.042 -0.569 -0.518 1.00 11.22 N ATOM 1743 CA VAL A 112 -7.133 0.816 -0.963 1.00 33.14 C ATOM 1744 C VAL A 112 -6.096 1.119 -2.038 1.00 15.21 C ATOM 1745 O VAL A 112 -5.015 0.530 -2.057 1.00 15.44 O ATOM 1746 CB VAL A 112 -6.936 1.792 0.212 1.00 65.15 C ATOM 1747 CG1 VAL A 112 -7.161 3.228 -0.239 1.00 11.30 C ATOM 1748 CG2 VAL A 112 -7.863 1.434 1.362 1.00 32.22 C ATOM 0 H VAL A 112 -6.091 -0.934 -0.468 1.00 11.22 H new ATOM 0 HA VAL A 112 -8.131 0.951 -1.379 1.00 33.14 H new ATOM 0 HB VAL A 112 -5.908 1.706 0.563 1.00 65.15 H new ATOM 0 HG11 VAL A 112 -7.017 3.901 0.606 1.00 11.30 H new ATOM 0 HG12 VAL A 112 -6.450 3.477 -1.027 1.00 11.30 H new ATOM 0 HG13 VAL A 112 -8.177 3.335 -0.619 1.00 11.30 H new ATOM 0 HG21 VAL A 112 -7.710 2.134 2.184 1.00 32.22 H new ATOM 0 HG22 VAL A 112 -8.898 1.489 1.026 1.00 32.22 H new ATOM 0 HG23 VAL A 112 -7.646 0.422 1.703 1.00 32.22 H new ATOM 1758 N LEU A 113 -6.431 2.044 -2.932 1.00 13.13 N ATOM 1759 CA LEU A 113 -5.527 2.428 -4.009 1.00 0.23 C ATOM 1760 C LEU A 113 -4.948 3.817 -3.762 1.00 63.02 C ATOM 1761 O LEU A 113 -5.644 4.824 -3.896 1.00 23.10 O ATOM 1762 CB LEU A 113 -6.260 2.398 -5.353 1.00 63.22 C ATOM 1763 CG LEU A 113 -5.393 2.690 -6.583 1.00 74.54 C ATOM 1764 CD1 LEU A 113 -4.014 2.060 -6.440 1.00 34.30 C ATOM 1765 CD2 LEU A 113 -6.079 2.186 -7.843 1.00 73.34 C ATOM 0 H LEU A 113 -7.322 2.541 -2.931 1.00 13.13 H new ATOM 0 HA LEU A 113 -4.706 1.711 -4.035 1.00 0.23 H new ATOM 0 HB2 LEU A 113 -6.716 1.416 -5.476 1.00 63.22 H new ATOM 0 HB3 LEU A 113 -7.072 3.125 -5.321 1.00 63.22 H new ATOM 0 HG LEU A 113 -5.265 3.770 -6.661 1.00 74.54 H new ATOM 0 HD11 LEU A 113 -3.419 2.282 -7.326 1.00 34.30 H new ATOM 0 HD12 LEU A 113 -3.518 2.466 -5.558 1.00 34.30 H new ATOM 0 HD13 LEU A 113 -4.117 0.980 -6.333 1.00 34.30 H new ATOM 0 HD21 LEU A 113 -5.452 2.400 -8.709 1.00 73.34 H new ATOM 0 HD22 LEU A 113 -6.237 1.110 -7.766 1.00 73.34 H new ATOM 0 HD23 LEU A 113 -7.041 2.686 -7.959 1.00 73.34 H new ATOM 1777 N VAL A 114 -3.671 3.864 -3.398 1.00 15.04 N ATOM 1778 CA VAL A 114 -2.999 5.129 -3.130 1.00 33.44 C ATOM 1779 C VAL A 114 -2.132 5.555 -4.309 1.00 31.41 C ATOM 1780 O VAL A 114 -1.454 4.732 -4.924 1.00 50.11 O ATOM 1781 CB VAL A 114 -2.122 5.041 -1.868 1.00 61.11 C ATOM 1782 CG1 VAL A 114 -1.604 6.416 -1.480 1.00 31.31 C ATOM 1783 CG2 VAL A 114 -2.898 4.412 -0.721 1.00 52.32 C ATOM 0 H VAL A 114 -3.081 3.040 -3.282 1.00 15.04 H new ATOM 0 HA VAL A 114 -3.780 5.873 -2.971 1.00 33.44 H new ATOM 0 HB VAL A 114 -1.265 4.405 -2.088 1.00 61.11 H new ATOM 0 HG11 VAL A 114 -0.986 6.333 -0.586 1.00 31.31 H new ATOM 0 HG12 VAL A 114 -1.008 6.824 -2.296 1.00 31.31 H new ATOM 0 HG13 VAL A 114 -2.446 7.079 -1.279 1.00 31.31 H new ATOM 0 HG21 VAL A 114 -2.262 4.358 0.162 1.00 52.32 H new ATOM 0 HG22 VAL A 114 -3.776 5.019 -0.500 1.00 52.32 H new ATOM 0 HG23 VAL A 114 -3.213 3.407 -1.003 1.00 52.32 H new ATOM 1793 N GLY A 115 -2.157 6.847 -4.618 1.00 53.20 N ATOM 1794 CA GLY A 115 -1.367 7.362 -5.722 1.00 50.30 C ATOM 1795 C GLY A 115 -0.197 8.204 -5.254 1.00 24.30 C ATOM 1796 O GLY A 115 -0.355 9.389 -4.960 1.00 64.11 O ATOM 0 H GLY A 115 -2.710 7.547 -4.124 1.00 53.20 H new ATOM 0 HA2 GLY A 115 -0.995 6.529 -6.319 1.00 50.30 H new ATOM 0 HA3 GLY A 115 -2.004 7.961 -6.373 1.00 50.30 H new ATOM 1800 N ASN A 116 0.980 7.591 -5.183 1.00 33.34 N ATOM 1801 CA ASN A 116 2.181 8.291 -4.746 1.00 64.04 C ATOM 1802 C ASN A 116 2.721 9.191 -5.853 1.00 41.30 C ATOM 1803 O ASN A 116 2.296 9.099 -7.005 1.00 22.23 O ATOM 1804 CB ASN A 116 3.255 7.289 -4.318 1.00 21.22 C ATOM 1805 CG ASN A 116 4.245 7.886 -3.336 1.00 24.54 C ATOM 1806 OD1 ASN A 116 4.183 9.074 -3.019 1.00 75.55 O ATOM 1807 ND2 ASN A 116 5.165 7.062 -2.848 1.00 21.22 N ATOM 0 H ASN A 116 1.127 6.611 -5.423 1.00 33.34 H new ATOM 0 HA ASN A 116 1.916 8.915 -3.893 1.00 64.04 H new ATOM 0 HB2 ASN A 116 2.777 6.420 -3.865 1.00 21.22 H new ATOM 0 HB3 ASN A 116 3.790 6.935 -5.199 1.00 21.22 H new ATOM 0 HD21 ASN A 116 5.857 7.407 -2.183 1.00 21.22 H new ATOM 0 HD22 ASN A 116 5.179 6.084 -3.138 1.00 21.22 H new ATOM 1814 N LYS A 117 3.662 10.059 -5.496 1.00 10.10 N ATOM 1815 CA LYS A 117 4.264 10.976 -6.459 1.00 33.32 C ATOM 1816 C LYS A 117 3.217 11.925 -7.035 1.00 4.14 C ATOM 1817 O LYS A 117 2.857 11.831 -8.209 1.00 14.01 O ATOM 1818 CB LYS A 117 4.939 10.194 -7.588 1.00 33.31 C ATOM 1819 CG LYS A 117 5.751 9.003 -7.103 1.00 25.34 C ATOM 1820 CD LYS A 117 6.670 8.471 -8.193 1.00 32.41 C ATOM 1821 CE LYS A 117 8.134 8.690 -7.846 1.00 40.34 C ATOM 1822 NZ LYS A 117 9.009 8.596 -9.046 1.00 65.34 N ATOM 0 H LYS A 117 4.025 10.147 -4.547 1.00 10.10 H new ATOM 0 HA LYS A 117 5.016 11.568 -5.938 1.00 33.32 H new ATOM 0 HB2 LYS A 117 4.176 9.844 -8.283 1.00 33.31 H new ATOM 0 HB3 LYS A 117 5.592 10.866 -8.144 1.00 33.31 H new ATOM 0 HG2 LYS A 117 6.344 9.295 -6.236 1.00 25.34 H new ATOM 0 HG3 LYS A 117 5.077 8.211 -6.776 1.00 25.34 H new ATOM 0 HD2 LYS A 117 6.485 7.407 -8.338 1.00 32.41 H new ATOM 0 HD3 LYS A 117 6.441 8.966 -9.137 1.00 32.41 H new ATOM 0 HE2 LYS A 117 8.255 9.670 -7.384 1.00 40.34 H new ATOM 0 HE3 LYS A 117 8.447 7.950 -7.110 1.00 40.34 H new ATOM 0 HZ1 LYS A 117 9.999 8.751 -8.767 1.00 65.34 H new ATOM 0 HZ2 LYS A 117 8.913 7.652 -9.472 1.00 65.34 H new ATOM 0 HZ3 LYS A 117 8.727 9.319 -9.739 1.00 65.34 H new ATOM 1836 N CYS A 118 2.733 12.839 -6.201 1.00 71.34 N ATOM 1837 CA CYS A 118 1.729 13.807 -6.626 1.00 72.10 C ATOM 1838 C CYS A 118 2.329 15.207 -6.741 1.00 53.53 C ATOM 1839 O CYS A 118 1.797 16.063 -7.448 1.00 75.52 O ATOM 1840 CB CYS A 118 0.557 13.822 -5.642 1.00 45.21 C ATOM 1841 SG CYS A 118 -0.902 14.704 -6.245 1.00 32.02 S ATOM 0 H CYS A 118 3.020 12.930 -5.226 1.00 71.34 H new ATOM 0 HA CYS A 118 1.368 13.507 -7.610 1.00 72.10 H new ATOM 0 HB2 CYS A 118 0.277 12.794 -5.411 1.00 45.21 H new ATOM 0 HB3 CYS A 118 0.886 14.280 -4.709 1.00 45.21 H new ATOM 0 HG CYS A 118 -1.839 14.660 -5.345 1.00 32.02 H new ATOM 1847 N ASP A 119 3.437 15.433 -6.041 1.00 1.14 N ATOM 1848 CA ASP A 119 4.105 16.730 -6.066 1.00 14.32 C ATOM 1849 C ASP A 119 5.020 16.856 -7.282 1.00 20.01 C ATOM 1850 O ASP A 119 5.306 17.961 -7.741 1.00 50.45 O ATOM 1851 CB ASP A 119 4.913 16.933 -4.783 1.00 74.43 C ATOM 1852 CG ASP A 119 5.597 18.286 -4.735 1.00 20.23 C ATOM 1853 OD1 ASP A 119 4.883 19.311 -4.712 1.00 31.24 O ATOM 1854 OD2 ASP A 119 6.845 18.320 -4.723 1.00 2.23 O ATOM 0 H ASP A 119 3.891 14.736 -5.450 1.00 1.14 H new ATOM 0 HA ASP A 119 3.338 17.502 -6.134 1.00 14.32 H new ATOM 0 HB2 ASP A 119 4.252 16.833 -3.922 1.00 74.43 H new ATOM 0 HB3 ASP A 119 5.664 16.147 -4.702 1.00 74.43 H new ATOM 1859 N LEU A 120 5.477 15.718 -7.801 1.00 3.31 N ATOM 1860 CA LEU A 120 6.361 15.708 -8.963 1.00 22.32 C ATOM 1861 C LEU A 120 5.790 16.560 -10.094 1.00 54.10 C ATOM 1862 O LEU A 120 4.601 16.877 -10.106 1.00 71.41 O ATOM 1863 CB LEU A 120 6.581 14.274 -9.449 1.00 25.41 C ATOM 1864 CG LEU A 120 7.772 13.552 -8.818 1.00 71.40 C ATOM 1865 CD1 LEU A 120 7.906 12.147 -9.384 1.00 61.44 C ATOM 1866 CD2 LEU A 120 9.051 14.344 -9.042 1.00 74.30 C ATOM 0 H LEU A 120 5.250 14.793 -7.436 1.00 3.31 H new ATOM 0 HA LEU A 120 7.318 16.134 -8.662 1.00 22.32 H new ATOM 0 HB2 LEU A 120 5.678 13.697 -9.249 1.00 25.41 H new ATOM 0 HB3 LEU A 120 6.717 14.290 -10.530 1.00 25.41 H new ATOM 0 HG LEU A 120 7.599 13.473 -7.745 1.00 71.40 H new ATOM 0 HD11 LEU A 120 8.759 11.649 -8.923 1.00 61.44 H new ATOM 0 HD12 LEU A 120 6.998 11.582 -9.173 1.00 61.44 H new ATOM 0 HD13 LEU A 120 8.057 12.202 -10.462 1.00 61.44 H new ATOM 0 HD21 LEU A 120 9.890 13.817 -8.587 1.00 74.30 H new ATOM 0 HD22 LEU A 120 9.229 14.453 -10.112 1.00 74.30 H new ATOM 0 HD23 LEU A 120 8.953 15.330 -8.588 1.00 74.30 H new ATOM 1878 N ALA A 121 6.647 16.931 -11.041 1.00 63.52 N ATOM 1879 CA ALA A 121 6.227 17.750 -12.172 1.00 23.45 C ATOM 1880 C ALA A 121 6.365 16.991 -13.487 1.00 15.53 C ATOM 1881 O ALA A 121 6.600 17.589 -14.537 1.00 64.32 O ATOM 1882 CB ALA A 121 7.037 19.037 -12.217 1.00 1.34 C ATOM 0 H ALA A 121 7.635 16.678 -11.047 1.00 63.52 H new ATOM 0 HA ALA A 121 5.174 17.997 -12.037 1.00 23.45 H new ATOM 0 HB1 ALA A 121 6.715 19.640 -13.066 1.00 1.34 H new ATOM 0 HB2 ALA A 121 6.883 19.597 -11.294 1.00 1.34 H new ATOM 0 HB3 ALA A 121 8.095 18.797 -12.323 1.00 1.34 H new ATOM 1888 N ALA A 122 6.220 15.671 -13.425 1.00 31.11 N ATOM 1889 CA ALA A 122 6.330 14.834 -14.612 1.00 23.13 C ATOM 1890 C ALA A 122 5.356 13.661 -14.552 1.00 73.25 C ATOM 1891 O ALA A 122 5.762 12.500 -14.621 1.00 1.32 O ATOM 1892 CB ALA A 122 7.757 14.333 -14.767 1.00 72.31 C ATOM 0 H ALA A 122 6.026 15.159 -12.564 1.00 31.11 H new ATOM 0 HA ALA A 122 6.070 15.439 -15.481 1.00 23.13 H new ATOM 0 HB1 ALA A 122 7.829 13.708 -15.657 1.00 72.31 H new ATOM 0 HB2 ALA A 122 8.432 15.183 -14.865 1.00 72.31 H new ATOM 0 HB3 ALA A 122 8.035 13.748 -13.890 1.00 72.31 H new ATOM 1898 N ARG A 123 4.070 13.969 -14.420 1.00 54.44 N ATOM 1899 CA ARG A 123 3.042 12.938 -14.349 1.00 14.24 C ATOM 1900 C ARG A 123 2.633 12.475 -15.744 1.00 52.30 C ATOM 1901 O ARG A 123 2.478 13.285 -16.658 1.00 34.34 O ATOM 1902 CB ARG A 123 1.818 13.456 -13.587 1.00 2.23 C ATOM 1903 CG ARG A 123 0.984 14.456 -14.373 1.00 63.23 C ATOM 1904 CD ARG A 123 -0.274 14.850 -13.616 1.00 20.20 C ATOM 1905 NE ARG A 123 0.031 15.420 -12.306 1.00 41.33 N ATOM 1906 CZ ARG A 123 0.559 16.629 -12.129 1.00 51.45 C ATOM 1907 NH1 ARG A 123 0.843 17.397 -13.174 1.00 53.13 N ATOM 1908 NH2 ARG A 123 0.804 17.072 -10.903 1.00 54.02 N ATOM 0 H ARG A 123 3.715 14.924 -14.360 1.00 54.44 H new ATOM 0 HA ARG A 123 3.458 12.085 -13.813 1.00 14.24 H new ATOM 0 HB2 ARG A 123 1.189 12.610 -13.311 1.00 2.23 H new ATOM 0 HB3 ARG A 123 2.150 13.923 -12.660 1.00 2.23 H new ATOM 0 HG2 ARG A 123 1.579 15.345 -14.579 1.00 63.23 H new ATOM 0 HG3 ARG A 123 0.710 14.025 -15.336 1.00 63.23 H new ATOM 0 HD2 ARG A 123 -0.839 15.574 -14.204 1.00 20.20 H new ATOM 0 HD3 ARG A 123 -0.911 13.974 -13.491 1.00 20.20 H new ATOM 0 HE ARG A 123 -0.172 14.859 -11.479 1.00 41.33 H new ATOM 0 HH11 ARG A 123 0.657 17.062 -14.119 1.00 53.13 H new ATOM 0 HH12 ARG A 123 1.247 18.323 -13.032 1.00 53.13 H new ATOM 0 HH21 ARG A 123 0.588 16.486 -10.096 1.00 54.02 H new ATOM 0 HH22 ARG A 123 1.209 17.998 -10.767 1.00 54.02 H new ATOM 1922 N THR A 124 2.457 11.167 -15.900 1.00 35.23 N ATOM 1923 CA THR A 124 2.062 10.597 -17.182 1.00 53.34 C ATOM 1924 C THR A 124 0.603 10.156 -17.151 1.00 3.44 C ATOM 1925 O THR A 124 -0.174 10.478 -18.051 1.00 55.44 O ATOM 1926 CB THR A 124 2.960 9.410 -17.535 1.00 44.41 C ATOM 1927 OG1 THR A 124 2.639 8.284 -16.738 1.00 10.32 O ATOM 1928 CG2 THR A 124 4.433 9.699 -17.350 1.00 41.44 C ATOM 0 H THR A 124 2.582 10.482 -15.154 1.00 35.23 H new ATOM 0 HA THR A 124 2.175 11.366 -17.946 1.00 53.34 H new ATOM 0 HB THR A 124 2.775 9.212 -18.591 1.00 44.41 H new ATOM 0 HG1 THR A 124 3.223 7.535 -16.980 1.00 10.32 H new ATOM 0 HG21 THR A 124 5.013 8.816 -17.618 1.00 41.44 H new ATOM 0 HG22 THR A 124 4.724 10.532 -17.990 1.00 41.44 H new ATOM 0 HG23 THR A 124 4.625 9.957 -16.309 1.00 41.44 H new ATOM 1936 N VAL A 125 0.237 9.417 -16.109 1.00 21.35 N ATOM 1937 CA VAL A 125 -1.124 8.930 -15.954 1.00 13.24 C ATOM 1938 C VAL A 125 -1.906 9.798 -14.972 1.00 4.32 C ATOM 1939 O VAL A 125 -1.713 9.708 -13.760 1.00 42.20 O ATOM 1940 CB VAL A 125 -1.132 7.471 -15.461 1.00 62.12 C ATOM 1941 CG1 VAL A 125 -2.555 6.962 -15.317 1.00 63.41 C ATOM 1942 CG2 VAL A 125 -0.334 6.585 -16.405 1.00 5.21 C ATOM 0 H VAL A 125 0.869 9.143 -15.357 1.00 21.35 H new ATOM 0 HA VAL A 125 -1.602 8.980 -16.932 1.00 13.24 H new ATOM 0 HB VAL A 125 -0.659 7.437 -14.479 1.00 62.12 H new ATOM 0 HG11 VAL A 125 -2.539 5.930 -14.968 1.00 63.41 H new ATOM 0 HG12 VAL A 125 -3.091 7.580 -14.597 1.00 63.41 H new ATOM 0 HG13 VAL A 125 -3.058 7.010 -16.283 1.00 63.41 H new ATOM 0 HG21 VAL A 125 -0.351 5.558 -16.041 1.00 5.21 H new ATOM 0 HG22 VAL A 125 -0.775 6.624 -17.401 1.00 5.21 H new ATOM 0 HG23 VAL A 125 0.697 6.937 -16.451 1.00 5.21 H new ATOM 1952 N GLU A 126 -2.789 10.638 -15.504 1.00 21.34 N ATOM 1953 CA GLU A 126 -3.599 11.521 -14.673 1.00 40.24 C ATOM 1954 C GLU A 126 -4.436 10.720 -13.681 1.00 74.40 C ATOM 1955 O GLU A 126 -4.738 9.549 -13.911 1.00 2.22 O ATOM 1956 CB GLU A 126 -4.513 12.383 -15.548 1.00 41.34 C ATOM 1957 CG GLU A 126 -5.313 11.584 -16.564 1.00 55.43 C ATOM 1958 CD GLU A 126 -6.415 12.400 -17.209 1.00 71.31 C ATOM 1959 OE1 GLU A 126 -6.331 13.646 -17.172 1.00 3.01 O ATOM 1960 OE2 GLU A 126 -7.363 11.794 -17.752 1.00 3.52 O ATOM 0 H GLU A 126 -2.961 10.725 -16.506 1.00 21.34 H new ATOM 0 HA GLU A 126 -2.925 12.169 -14.113 1.00 40.24 H new ATOM 0 HB2 GLU A 126 -5.202 12.933 -14.907 1.00 41.34 H new ATOM 0 HB3 GLU A 126 -3.908 13.121 -16.074 1.00 41.34 H new ATOM 0 HG2 GLU A 126 -4.642 11.211 -17.338 1.00 55.43 H new ATOM 0 HG3 GLU A 126 -5.750 10.714 -16.074 1.00 55.43 H new ATOM 1967 N SER A 127 -4.807 11.359 -12.575 1.00 11.10 N ATOM 1968 CA SER A 127 -5.610 10.706 -11.547 1.00 32.11 C ATOM 1969 C SER A 127 -6.917 10.176 -12.129 1.00 63.15 C ATOM 1970 O SER A 127 -7.463 9.182 -11.652 1.00 12.42 O ATOM 1971 CB SER A 127 -5.904 11.680 -10.405 1.00 14.33 C ATOM 1972 OG SER A 127 -4.712 12.063 -9.741 1.00 31.20 O ATOM 0 H SER A 127 -4.564 12.328 -12.368 1.00 11.10 H new ATOM 0 HA SER A 127 -5.040 9.862 -11.158 1.00 32.11 H new ATOM 0 HB2 SER A 127 -6.406 12.565 -10.798 1.00 14.33 H new ATOM 0 HB3 SER A 127 -6.587 11.216 -9.694 1.00 14.33 H new ATOM 0 HG SER A 127 -4.927 12.687 -9.017 1.00 31.20 H new ATOM 1978 N ARG A 128 -7.413 10.848 -13.164 1.00 51.01 N ATOM 1979 CA ARG A 128 -8.655 10.445 -13.814 1.00 44.05 C ATOM 1980 C ARG A 128 -8.551 9.019 -14.347 1.00 60.43 C ATOM 1981 O ARG A 128 -9.499 8.240 -14.254 1.00 54.41 O ATOM 1982 CB ARG A 128 -8.991 11.411 -14.954 1.00 25.24 C ATOM 1983 CG ARG A 128 -10.180 10.978 -15.798 1.00 42.43 C ATOM 1984 CD ARG A 128 -11.461 10.941 -14.982 1.00 11.43 C ATOM 1985 NE ARG A 128 -12.647 10.850 -15.830 1.00 1.32 N ATOM 1986 CZ ARG A 128 -13.849 10.490 -15.387 1.00 53.31 C ATOM 1987 NH1 ARG A 128 -14.030 10.186 -14.108 1.00 23.21 N ATOM 1988 NH2 ARG A 128 -14.875 10.434 -16.226 1.00 34.04 N ATOM 0 H ARG A 128 -6.973 11.674 -13.570 1.00 51.01 H new ATOM 0 HA ARG A 128 -9.455 10.476 -13.074 1.00 44.05 H new ATOM 0 HB2 ARG A 128 -9.195 12.396 -14.534 1.00 25.24 H new ATOM 0 HB3 ARG A 128 -8.118 11.514 -15.599 1.00 25.24 H new ATOM 0 HG2 ARG A 128 -10.301 11.664 -16.636 1.00 42.43 H new ATOM 0 HG3 ARG A 128 -9.988 9.991 -16.219 1.00 42.43 H new ATOM 0 HD2 ARG A 128 -11.434 10.088 -14.303 1.00 11.43 H new ATOM 0 HD3 ARG A 128 -11.524 11.837 -14.365 1.00 11.43 H new ATOM 0 HE ARG A 128 -12.548 11.076 -16.820 1.00 1.32 H new ATOM 0 HH11 ARG A 128 -13.245 10.228 -13.458 1.00 23.21 H new ATOM 0 HH12 ARG A 128 -14.954 9.911 -13.775 1.00 23.21 H new ATOM 0 HH21 ARG A 128 -14.742 10.667 -17.210 1.00 34.04 H new ATOM 0 HH22 ARG A 128 -15.797 10.158 -15.887 1.00 34.04 H new ATOM 2002 N GLN A 129 -7.392 8.684 -14.905 1.00 74.24 N ATOM 2003 CA GLN A 129 -7.164 7.352 -15.452 1.00 74.41 C ATOM 2004 C GLN A 129 -7.143 6.305 -14.344 1.00 4.44 C ATOM 2005 O GLN A 129 -7.587 5.173 -14.537 1.00 12.12 O ATOM 2006 CB GLN A 129 -5.848 7.316 -16.231 1.00 13.32 C ATOM 2007 CG GLN A 129 -5.699 8.454 -17.228 1.00 32.34 C ATOM 2008 CD GLN A 129 -5.367 7.967 -18.625 1.00 11.41 C ATOM 2009 OE1 GLN A 129 -6.243 7.512 -19.361 1.00 33.23 O ATOM 2010 NE2 GLN A 129 -4.096 8.061 -18.998 1.00 53.11 N ATOM 0 H GLN A 129 -6.597 9.317 -14.990 1.00 74.24 H new ATOM 0 HA GLN A 129 -7.985 7.119 -16.130 1.00 74.41 H new ATOM 0 HB2 GLN A 129 -5.017 7.351 -15.526 1.00 13.32 H new ATOM 0 HB3 GLN A 129 -5.776 6.367 -16.762 1.00 13.32 H new ATOM 0 HG2 GLN A 129 -6.625 9.029 -17.258 1.00 32.34 H new ATOM 0 HG3 GLN A 129 -4.915 9.130 -16.887 1.00 32.34 H new ATOM 0 HE21 GLN A 129 -3.403 8.445 -18.355 1.00 53.11 H new ATOM 0 HE22 GLN A 129 -3.813 7.750 -19.927 1.00 53.11 H new ATOM 2019 N ALA A 130 -6.624 6.690 -13.183 1.00 3.50 N ATOM 2020 CA ALA A 130 -6.544 5.785 -12.043 1.00 35.13 C ATOM 2021 C ALA A 130 -7.886 5.687 -11.325 1.00 1.24 C ATOM 2022 O ALA A 130 -8.258 4.624 -10.827 1.00 3.40 O ATOM 2023 CB ALA A 130 -5.460 6.244 -11.080 1.00 4.20 C ATOM 0 H ALA A 130 -6.252 7.623 -13.007 1.00 3.50 H new ATOM 0 HA ALA A 130 -6.287 4.793 -12.415 1.00 35.13 H new ATOM 0 HB1 ALA A 130 -5.411 5.559 -10.234 1.00 4.20 H new ATOM 0 HB2 ALA A 130 -4.498 6.255 -11.593 1.00 4.20 H new ATOM 0 HB3 ALA A 130 -5.692 7.247 -10.722 1.00 4.20 H new ATOM 2029 N GLN A 131 -8.607 6.802 -11.275 1.00 60.32 N ATOM 2030 CA GLN A 131 -9.909 6.842 -10.618 1.00 64.24 C ATOM 2031 C GLN A 131 -10.867 5.832 -11.243 1.00 35.23 C ATOM 2032 O GLN A 131 -11.612 5.150 -10.540 1.00 64.11 O ATOM 2033 CB GLN A 131 -10.502 8.250 -10.705 1.00 3.35 C ATOM 2034 CG GLN A 131 -10.508 8.989 -9.377 1.00 60.13 C ATOM 2035 CD GLN A 131 -11.896 9.110 -8.782 1.00 74.32 C ATOM 2036 OE1 GLN A 131 -12.527 10.164 -8.854 1.00 24.15 O ATOM 2037 NE2 GLN A 131 -12.380 8.025 -8.189 1.00 43.01 N ATOM 0 H GLN A 131 -8.312 7.690 -11.681 1.00 60.32 H new ATOM 0 HA GLN A 131 -9.768 6.578 -9.570 1.00 64.24 H new ATOM 0 HB2 GLN A 131 -9.934 8.830 -11.432 1.00 3.35 H new ATOM 0 HB3 GLN A 131 -11.524 8.183 -11.079 1.00 3.35 H new ATOM 0 HG2 GLN A 131 -9.859 8.468 -8.673 1.00 60.13 H new ATOM 0 HG3 GLN A 131 -10.090 9.985 -9.518 1.00 60.13 H new ATOM 0 HE21 GLN A 131 -11.822 7.172 -8.152 1.00 43.01 H new ATOM 0 HE22 GLN A 131 -13.310 8.045 -7.770 1.00 43.01 H new ATOM 2046 N ASP A 132 -10.842 5.745 -12.568 1.00 65.02 N ATOM 2047 CA ASP A 132 -11.709 4.821 -13.290 1.00 42.10 C ATOM 2048 C ASP A 132 -11.432 3.378 -12.880 1.00 25.35 C ATOM 2049 O ASP A 132 -12.358 2.590 -12.686 1.00 3.11 O ATOM 2050 CB ASP A 132 -11.515 4.981 -14.799 1.00 14.34 C ATOM 2051 CG ASP A 132 -12.569 4.241 -15.598 1.00 15.12 C ATOM 2052 OD1 ASP A 132 -13.673 4.796 -15.783 1.00 73.44 O ATOM 2053 OD2 ASP A 132 -12.291 3.106 -16.041 1.00 43.14 O ATOM 0 H ASP A 132 -10.231 6.303 -13.164 1.00 65.02 H new ATOM 0 HA ASP A 132 -12.742 5.059 -13.035 1.00 42.10 H new ATOM 0 HB2 ASP A 132 -11.545 6.040 -15.056 1.00 14.34 H new ATOM 0 HB3 ASP A 132 -10.527 4.613 -15.077 1.00 14.34 H new ATOM 2058 N LEU A 133 -10.153 3.036 -12.755 1.00 61.01 N ATOM 2059 CA LEU A 133 -9.757 1.691 -12.375 1.00 52.32 C ATOM 2060 C LEU A 133 -10.173 1.378 -10.940 1.00 70.31 C ATOM 2061 O LEU A 133 -10.815 0.361 -10.677 1.00 54.21 O ATOM 2062 CB LEU A 133 -8.242 1.547 -12.528 1.00 10.02 C ATOM 2063 CG LEU A 133 -7.638 0.269 -11.949 1.00 72.45 C ATOM 2064 CD1 LEU A 133 -7.394 0.420 -10.456 1.00 42.34 C ATOM 2065 CD2 LEU A 133 -8.538 -0.925 -12.227 1.00 42.33 C ATOM 0 H LEU A 133 -9.374 3.676 -12.912 1.00 61.01 H new ATOM 0 HA LEU A 133 -10.262 0.981 -13.030 1.00 52.32 H new ATOM 0 HB2 LEU A 133 -7.996 1.596 -13.589 1.00 10.02 H new ATOM 0 HB3 LEU A 133 -7.764 2.402 -12.050 1.00 10.02 H new ATOM 0 HG LEU A 133 -6.679 0.094 -12.436 1.00 72.45 H new ATOM 0 HD11 LEU A 133 -6.964 -0.501 -10.063 1.00 42.34 H new ATOM 0 HD12 LEU A 133 -6.705 1.246 -10.282 1.00 42.34 H new ATOM 0 HD13 LEU A 133 -8.339 0.623 -9.952 1.00 42.34 H new ATOM 0 HD21 LEU A 133 -8.089 -1.825 -11.806 1.00 42.33 H new ATOM 0 HD22 LEU A 133 -9.514 -0.759 -11.771 1.00 42.33 H new ATOM 0 HD23 LEU A 133 -8.657 -1.048 -13.303 1.00 42.33 H new ATOM 2077 N ALA A 134 -9.803 2.258 -10.017 1.00 13.42 N ATOM 2078 CA ALA A 134 -10.138 2.075 -8.609 1.00 2.23 C ATOM 2079 C ALA A 134 -11.649 2.051 -8.408 1.00 11.33 C ATOM 2080 O ALA A 134 -12.170 1.249 -7.634 1.00 3.24 O ATOM 2081 CB ALA A 134 -9.506 3.173 -7.765 1.00 63.42 C ATOM 0 H ALA A 134 -9.271 3.105 -10.218 1.00 13.42 H new ATOM 0 HA ALA A 134 -9.737 1.114 -8.286 1.00 2.23 H new ATOM 0 HB1 ALA A 134 -9.766 3.022 -6.717 1.00 63.42 H new ATOM 0 HB2 ALA A 134 -8.422 3.141 -7.878 1.00 63.42 H new ATOM 0 HB3 ALA A 134 -9.877 4.144 -8.094 1.00 63.42 H new ATOM 2087 N ARG A 135 -12.346 2.935 -9.114 1.00 61.11 N ATOM 2088 CA ARG A 135 -13.799 3.015 -9.016 1.00 51.13 C ATOM 2089 C ARG A 135 -14.450 1.710 -9.469 1.00 55.01 C ATOM 2090 O ARG A 135 -15.573 1.399 -9.074 1.00 51.43 O ATOM 2091 CB ARG A 135 -14.325 4.179 -9.859 1.00 33.22 C ATOM 2092 CG ARG A 135 -15.816 4.423 -9.694 1.00 52.22 C ATOM 2093 CD ARG A 135 -16.184 5.862 -10.015 1.00 70.31 C ATOM 2094 NE ARG A 135 -17.226 6.372 -9.127 1.00 24.43 N ATOM 2095 CZ ARG A 135 -18.511 6.040 -9.225 1.00 44.42 C ATOM 2096 NH1 ARG A 135 -18.916 5.199 -10.169 1.00 30.44 N ATOM 2097 NH2 ARG A 135 -19.395 6.549 -8.377 1.00 11.15 N ATOM 0 H ARG A 135 -11.929 3.605 -9.760 1.00 61.11 H new ATOM 0 HA ARG A 135 -14.058 3.185 -7.971 1.00 51.13 H new ATOM 0 HB2 ARG A 135 -13.785 5.086 -9.589 1.00 33.22 H new ATOM 0 HB3 ARG A 135 -14.111 3.982 -10.910 1.00 33.22 H new ATOM 0 HG2 ARG A 135 -16.370 3.750 -10.348 1.00 52.22 H new ATOM 0 HG3 ARG A 135 -16.113 4.190 -8.671 1.00 52.22 H new ATOM 0 HD2 ARG A 135 -15.297 6.490 -9.931 1.00 70.31 H new ATOM 0 HD3 ARG A 135 -16.525 5.927 -11.048 1.00 70.31 H new ATOM 0 HE ARG A 135 -16.953 7.020 -8.389 1.00 24.43 H new ATOM 0 HH11 ARG A 135 -18.241 4.804 -10.824 1.00 30.44 H new ATOM 0 HH12 ARG A 135 -19.902 4.948 -10.240 1.00 30.44 H new ATOM 0 HH21 ARG A 135 -19.090 7.195 -7.649 1.00 11.15 H new ATOM 0 HH22 ARG A 135 -20.380 6.294 -8.453 1.00 11.15 H new ATOM 2111 N SER A 136 -13.740 0.950 -10.298 1.00 54.20 N ATOM 2112 CA SER A 136 -14.255 -0.319 -10.800 1.00 3.11 C ATOM 2113 C SER A 136 -14.162 -1.402 -9.731 1.00 11.41 C ATOM 2114 O SER A 136 -15.033 -2.267 -9.630 1.00 21.53 O ATOM 2115 CB SER A 136 -13.482 -0.749 -12.049 1.00 42.43 C ATOM 2116 OG SER A 136 -12.263 -1.383 -11.704 1.00 41.23 O ATOM 0 H SER A 136 -12.808 1.191 -10.636 1.00 54.20 H new ATOM 0 HA SER A 136 -15.304 -0.181 -11.062 1.00 3.11 H new ATOM 0 HB2 SER A 136 -14.093 -1.429 -12.642 1.00 42.43 H new ATOM 0 HB3 SER A 136 -13.278 0.122 -12.672 1.00 42.43 H new ATOM 0 HG SER A 136 -11.590 -0.704 -11.491 1.00 41.23 H new ATOM 2122 N TYR A 137 -13.101 -1.348 -8.933 1.00 74.55 N ATOM 2123 CA TYR A 137 -12.893 -2.323 -7.868 1.00 20.41 C ATOM 2124 C TYR A 137 -13.796 -2.032 -6.672 1.00 33.11 C ATOM 2125 O TYR A 137 -14.068 -2.916 -5.859 1.00 11.54 O ATOM 2126 CB TYR A 137 -11.427 -2.323 -7.429 1.00 30.10 C ATOM 2127 CG TYR A 137 -10.464 -2.746 -8.517 1.00 24.15 C ATOM 2128 CD1 TYR A 137 -10.797 -3.750 -9.418 1.00 74.04 C ATOM 2129 CD2 TYR A 137 -9.221 -2.139 -8.641 1.00 21.34 C ATOM 2130 CE1 TYR A 137 -9.919 -4.137 -10.412 1.00 11.42 C ATOM 2131 CE2 TYR A 137 -8.337 -2.521 -9.633 1.00 65.44 C ATOM 2132 CZ TYR A 137 -8.691 -3.520 -10.515 1.00 50.11 C ATOM 2133 OH TYR A 137 -7.813 -3.902 -11.503 1.00 3.24 O ATOM 0 H TYR A 137 -12.371 -0.639 -9.003 1.00 74.55 H new ATOM 0 HA TYR A 137 -13.150 -3.308 -8.258 1.00 20.41 H new ATOM 0 HB2 TYR A 137 -11.159 -1.323 -7.088 1.00 30.10 H new ATOM 0 HB3 TYR A 137 -11.313 -2.991 -6.576 1.00 30.10 H new ATOM 0 HD1 TYR A 137 -11.758 -4.236 -9.340 1.00 74.04 H new ATOM 0 HD2 TYR A 137 -8.941 -1.356 -7.952 1.00 21.34 H new ATOM 0 HE1 TYR A 137 -10.194 -4.919 -11.105 1.00 11.42 H new ATOM 0 HE2 TYR A 137 -7.374 -2.039 -9.717 1.00 65.44 H new ATOM 0 HH TYR A 137 -8.081 -4.775 -11.859 1.00 3.24 H new ATOM 2143 N GLY A 138 -14.256 -0.789 -6.568 1.00 42.21 N ATOM 2144 CA GLY A 138 -15.121 -0.409 -5.466 1.00 44.15 C ATOM 2145 C GLY A 138 -14.344 0.052 -4.247 1.00 61.35 C ATOM 2146 O GLY A 138 -14.898 0.152 -3.152 1.00 50.02 O ATOM 0 H GLY A 138 -14.045 -0.039 -7.226 1.00 42.21 H new ATOM 0 HA2 GLY A 138 -15.788 0.390 -5.791 1.00 44.15 H new ATOM 0 HA3 GLY A 138 -15.749 -1.257 -5.193 1.00 44.15 H new ATOM 2150 N ILE A 139 -13.057 0.335 -4.435 1.00 65.32 N ATOM 2151 CA ILE A 139 -12.209 0.788 -3.340 1.00 13.40 C ATOM 2152 C ILE A 139 -11.861 2.267 -3.483 1.00 2.00 C ATOM 2153 O ILE A 139 -11.799 2.794 -4.594 1.00 3.42 O ATOM 2154 CB ILE A 139 -10.912 -0.026 -3.261 1.00 41.22 C ATOM 2155 CG1 ILE A 139 -10.235 -0.072 -4.623 1.00 31.34 C ATOM 2156 CG2 ILE A 139 -11.198 -1.434 -2.754 1.00 34.24 C ATOM 2157 CD1 ILE A 139 -8.907 -0.774 -4.586 1.00 24.30 C ATOM 0 H ILE A 139 -12.581 0.258 -5.334 1.00 65.32 H new ATOM 0 HA ILE A 139 -12.778 0.641 -2.422 1.00 13.40 H new ATOM 0 HB ILE A 139 -10.237 0.460 -2.557 1.00 41.22 H new ATOM 0 HG12 ILE A 139 -10.889 -0.578 -5.333 1.00 31.34 H new ATOM 0 HG13 ILE A 139 -10.094 0.945 -4.989 1.00 31.34 H new ATOM 0 HG21 ILE A 139 -10.267 -1.999 -2.704 1.00 34.24 H new ATOM 0 HG22 ILE A 139 -11.643 -1.380 -1.761 1.00 34.24 H new ATOM 0 HG23 ILE A 139 -11.888 -1.932 -3.434 1.00 34.24 H new ATOM 0 HD11 ILE A 139 -8.469 -0.777 -5.584 1.00 24.30 H new ATOM 0 HD12 ILE A 139 -8.240 -0.254 -3.899 1.00 24.30 H new ATOM 0 HD13 ILE A 139 -9.047 -1.801 -4.248 1.00 24.30 H new ATOM 2169 N PRO A 140 -11.631 2.960 -2.354 1.00 22.21 N ATOM 2170 CA PRO A 140 -11.289 4.386 -2.358 1.00 74.14 C ATOM 2171 C PRO A 140 -9.945 4.660 -3.023 1.00 33.12 C ATOM 2172 O PRO A 140 -9.052 3.812 -3.015 1.00 51.54 O ATOM 2173 CB PRO A 140 -11.232 4.753 -0.872 1.00 54.30 C ATOM 2174 CG PRO A 140 -10.999 3.462 -0.165 1.00 51.21 C ATOM 2175 CD PRO A 140 -11.686 2.410 -0.988 1.00 2.22 C ATOM 0 HA PRO A 140 -12.014 4.970 -2.925 1.00 74.14 H new ATOM 0 HB2 PRO A 140 -10.430 5.463 -0.671 1.00 54.30 H new ATOM 0 HB3 PRO A 140 -12.161 5.220 -0.545 1.00 54.30 H new ATOM 0 HG2 PRO A 140 -9.933 3.253 -0.075 1.00 51.21 H new ATOM 0 HG3 PRO A 140 -11.404 3.492 0.847 1.00 51.21 H new ATOM 0 HD2 PRO A 140 -11.176 1.449 -0.920 1.00 2.22 H new ATOM 0 HD3 PRO A 140 -12.713 2.249 -0.660 1.00 2.22 H new ATOM 2183 N TYR A 141 -9.809 5.852 -3.594 1.00 25.52 N ATOM 2184 CA TYR A 141 -8.574 6.247 -4.262 1.00 44.15 C ATOM 2185 C TYR A 141 -8.024 7.533 -3.652 1.00 41.51 C ATOM 2186 O TYR A 141 -8.562 8.617 -3.875 1.00 42.14 O ATOM 2187 CB TYR A 141 -8.818 6.433 -5.763 1.00 31.55 C ATOM 2188 CG TYR A 141 -7.658 7.067 -6.500 1.00 22.11 C ATOM 2189 CD1 TYR A 141 -6.443 6.405 -6.625 1.00 4.23 C ATOM 2190 CD2 TYR A 141 -7.779 8.329 -7.069 1.00 33.23 C ATOM 2191 CE1 TYR A 141 -5.382 6.982 -7.296 1.00 12.21 C ATOM 2192 CE2 TYR A 141 -6.722 8.913 -7.741 1.00 21.31 C ATOM 2193 CZ TYR A 141 -5.526 8.236 -7.852 1.00 34.53 C ATOM 2194 OH TYR A 141 -4.472 8.814 -8.520 1.00 52.24 O ATOM 0 H TYR A 141 -10.540 6.563 -3.608 1.00 25.52 H new ATOM 0 HA TYR A 141 -7.837 5.456 -4.123 1.00 44.15 H new ATOM 0 HB2 TYR A 141 -9.032 5.462 -6.209 1.00 31.55 H new ATOM 0 HB3 TYR A 141 -9.705 7.050 -5.903 1.00 31.55 H new ATOM 0 HD1 TYR A 141 -6.326 5.423 -6.191 1.00 4.23 H new ATOM 0 HD2 TYR A 141 -8.714 8.862 -6.985 1.00 33.23 H new ATOM 0 HE1 TYR A 141 -4.444 6.454 -7.385 1.00 12.21 H new ATOM 0 HE2 TYR A 141 -6.832 9.895 -8.177 1.00 21.31 H new ATOM 0 HH TYR A 141 -4.739 9.697 -8.852 1.00 52.24 H new ATOM 2204 N ILE A 142 -6.949 7.404 -2.882 1.00 45.03 N ATOM 2205 CA ILE A 142 -6.329 8.555 -2.239 1.00 22.14 C ATOM 2206 C ILE A 142 -4.997 8.898 -2.898 1.00 3.44 C ATOM 2207 O ILE A 142 -4.258 8.012 -3.326 1.00 61.40 O ATOM 2208 CB ILE A 142 -6.104 8.301 -0.736 1.00 63.53 C ATOM 2209 CG1 ILE A 142 -7.411 7.864 -0.072 1.00 25.24 C ATOM 2210 CG2 ILE A 142 -5.554 9.548 -0.062 1.00 22.24 C ATOM 2211 CD1 ILE A 142 -7.624 6.367 -0.088 1.00 12.50 C ATOM 0 H ILE A 142 -6.490 6.514 -2.688 1.00 45.03 H new ATOM 0 HA ILE A 142 -7.013 9.396 -2.356 1.00 22.14 H new ATOM 0 HB ILE A 142 -5.373 7.500 -0.624 1.00 63.53 H new ATOM 0 HG12 ILE A 142 -7.419 8.213 0.960 1.00 25.24 H new ATOM 0 HG13 ILE A 142 -8.246 8.347 -0.579 1.00 25.24 H new ATOM 0 HG21 ILE A 142 -5.401 9.351 0.999 1.00 22.24 H new ATOM 0 HG22 ILE A 142 -4.604 9.821 -0.521 1.00 22.24 H new ATOM 0 HG23 ILE A 142 -6.262 10.368 -0.180 1.00 22.24 H new ATOM 0 HD11 ILE A 142 -8.570 6.129 0.399 1.00 12.50 H new ATOM 0 HD12 ILE A 142 -7.648 6.014 -1.119 1.00 12.50 H new ATOM 0 HD13 ILE A 142 -6.808 5.878 0.444 1.00 12.50 H new ATOM 2223 N GLU A 143 -4.697 10.190 -2.978 1.00 63.01 N ATOM 2224 CA GLU A 143 -3.454 10.649 -3.587 1.00 41.04 C ATOM 2225 C GLU A 143 -2.488 11.172 -2.530 1.00 22.22 C ATOM 2226 O GLU A 143 -2.866 11.965 -1.666 1.00 52.04 O ATOM 2227 CB GLU A 143 -3.740 11.742 -4.618 1.00 21.30 C ATOM 2228 CG GLU A 143 -4.478 11.239 -5.848 1.00 50.43 C ATOM 2229 CD GLU A 143 -5.947 11.614 -5.841 1.00 31.02 C ATOM 2230 OE1 GLU A 143 -6.718 10.979 -5.091 1.00 54.41 O ATOM 2231 OE2 GLU A 143 -6.326 12.544 -6.584 1.00 63.54 O ATOM 0 H GLU A 143 -5.297 10.937 -2.629 1.00 63.01 H new ATOM 0 HA GLU A 143 -2.990 9.799 -4.087 1.00 41.04 H new ATOM 0 HB2 GLU A 143 -4.329 12.529 -4.147 1.00 21.30 H new ATOM 0 HB3 GLU A 143 -2.797 12.192 -4.929 1.00 21.30 H new ATOM 0 HG2 GLU A 143 -4.007 11.647 -6.742 1.00 50.43 H new ATOM 0 HG3 GLU A 143 -4.384 10.155 -5.905 1.00 50.43 H new ATOM 2238 N THR A 144 -1.239 10.725 -2.604 1.00 34.20 N ATOM 2239 CA THR A 144 -0.218 11.150 -1.654 1.00 11.41 C ATOM 2240 C THR A 144 1.129 11.329 -2.345 1.00 23.23 C ATOM 2241 O THR A 144 1.276 11.027 -3.530 1.00 10.21 O ATOM 2242 CB THR A 144 -0.092 10.133 -0.518 1.00 60.30 C ATOM 2243 OG1 THR A 144 0.464 8.919 -0.992 1.00 61.41 O ATOM 2244 CG2 THR A 144 -1.413 9.807 0.142 1.00 52.34 C ATOM 0 H THR A 144 -0.910 10.069 -3.312 1.00 34.20 H new ATOM 0 HA THR A 144 -0.522 12.111 -1.239 1.00 11.41 H new ATOM 0 HB THR A 144 0.558 10.603 0.220 1.00 60.30 H new ATOM 0 HG1 THR A 144 0.538 8.282 -0.251 1.00 61.41 H new ATOM 0 HG21 THR A 144 -1.252 9.080 0.938 1.00 52.34 H new ATOM 0 HG22 THR A 144 -1.844 10.716 0.562 1.00 52.34 H new ATOM 0 HG23 THR A 144 -2.096 9.389 -0.598 1.00 52.34 H new ATOM 2252 N SER A 145 2.111 11.822 -1.597 1.00 64.41 N ATOM 2253 CA SER A 145 3.447 12.042 -2.137 1.00 4.40 C ATOM 2254 C SER A 145 4.502 11.922 -1.042 1.00 24.23 C ATOM 2255 O SER A 145 4.433 12.608 -0.022 1.00 21.14 O ATOM 2256 CB SER A 145 3.533 13.419 -2.797 1.00 13.13 C ATOM 2257 OG SER A 145 4.298 13.368 -3.988 1.00 34.00 O ATOM 0 H SER A 145 2.006 12.077 -0.615 1.00 64.41 H new ATOM 0 HA SER A 145 3.640 11.275 -2.888 1.00 4.40 H new ATOM 0 HB2 SER A 145 2.530 13.781 -3.021 1.00 13.13 H new ATOM 0 HB3 SER A 145 3.981 14.130 -2.104 1.00 13.13 H new ATOM 0 HG SER A 145 4.971 14.080 -3.975 1.00 34.00 H new ATOM 2263 N ALA A 146 5.478 11.047 -1.261 1.00 23.23 N ATOM 2264 CA ALA A 146 6.549 10.836 -0.293 1.00 74.55 C ATOM 2265 C ALA A 146 7.609 11.934 -0.379 1.00 63.15 C ATOM 2266 O ALA A 146 8.567 11.940 0.395 1.00 43.10 O ATOM 2267 CB ALA A 146 7.185 9.470 -0.504 1.00 60.31 C ATOM 0 H ALA A 146 5.550 10.472 -2.101 1.00 23.23 H new ATOM 0 HA ALA A 146 6.111 10.877 0.704 1.00 74.55 H new ATOM 0 HB1 ALA A 146 7.983 9.324 0.224 1.00 60.31 H new ATOM 0 HB2 ALA A 146 6.431 8.694 -0.376 1.00 60.31 H new ATOM 0 HB3 ALA A 146 7.598 9.413 -1.511 1.00 60.31 H new ATOM 2273 N LYS A 147 7.438 12.860 -1.320 1.00 70.14 N ATOM 2274 CA LYS A 147 8.386 13.954 -1.496 1.00 60.41 C ATOM 2275 C LYS A 147 7.929 15.200 -0.742 1.00 52.14 C ATOM 2276 O LYS A 147 8.748 16.010 -0.310 1.00 54.14 O ATOM 2277 CB LYS A 147 8.556 14.271 -2.985 1.00 24.41 C ATOM 2278 CG LYS A 147 9.409 15.501 -3.259 1.00 20.31 C ATOM 2279 CD LYS A 147 10.837 15.312 -2.774 1.00 4.14 C ATOM 2280 CE LYS A 147 11.684 16.546 -3.044 1.00 3.33 C ATOM 2281 NZ LYS A 147 11.780 17.427 -1.848 1.00 1.01 N ATOM 0 H LYS A 147 6.653 12.873 -1.971 1.00 70.14 H new ATOM 0 HA LYS A 147 9.347 13.641 -1.087 1.00 60.41 H new ATOM 0 HB2 LYS A 147 9.006 13.411 -3.481 1.00 24.41 H new ATOM 0 HB3 LYS A 147 7.572 14.417 -3.430 1.00 24.41 H new ATOM 0 HG2 LYS A 147 9.412 15.711 -4.329 1.00 20.31 H new ATOM 0 HG3 LYS A 147 8.968 16.367 -2.765 1.00 20.31 H new ATOM 0 HD2 LYS A 147 10.834 15.098 -1.705 1.00 4.14 H new ATOM 0 HD3 LYS A 147 11.280 14.449 -3.271 1.00 4.14 H new ATOM 0 HE2 LYS A 147 12.684 16.240 -3.350 1.00 3.33 H new ATOM 0 HE3 LYS A 147 11.254 17.107 -3.874 1.00 3.33 H new ATOM 0 HZ1 LYS A 147 12.365 18.256 -2.074 1.00 1.01 H new ATOM 0 HZ2 LYS A 147 10.828 17.740 -1.570 1.00 1.01 H new ATOM 0 HZ3 LYS A 147 12.214 16.901 -1.063 1.00 1.01 H new ATOM 2295 N THR A 148 6.616 15.350 -0.591 1.00 21.22 N ATOM 2296 CA THR A 148 6.056 16.503 0.107 1.00 1.13 C ATOM 2297 C THR A 148 5.187 16.076 1.291 1.00 61.13 C ATOM 2298 O THR A 148 4.613 16.919 1.980 1.00 11.33 O ATOM 2299 CB THR A 148 5.229 17.352 -0.859 1.00 2.40 C ATOM 2300 OG1 THR A 148 4.483 16.529 -1.736 1.00 42.51 O ATOM 2301 CG2 THR A 148 6.068 18.284 -1.706 1.00 25.14 C ATOM 0 H THR A 148 5.922 14.690 -0.941 1.00 21.22 H new ATOM 0 HA THR A 148 6.888 17.092 0.492 1.00 1.13 H new ATOM 0 HB THR A 148 4.574 17.952 -0.228 1.00 2.40 H new ATOM 0 HG1 THR A 148 3.627 16.960 -1.940 1.00 42.51 H new ATOM 0 HG21 THR A 148 5.419 18.857 -2.369 1.00 25.14 H new ATOM 0 HG22 THR A 148 6.619 18.966 -1.059 1.00 25.14 H new ATOM 0 HG23 THR A 148 6.771 17.701 -2.301 1.00 25.14 H new ATOM 2309 N ARG A 149 5.091 14.769 1.526 1.00 5.15 N ATOM 2310 CA ARG A 149 4.288 14.246 2.628 1.00 61.12 C ATOM 2311 C ARG A 149 2.889 14.860 2.630 1.00 54.15 C ATOM 2312 O ARG A 149 2.532 15.617 3.533 1.00 12.44 O ATOM 2313 CB ARG A 149 4.980 14.522 3.964 1.00 35.13 C ATOM 2314 CG ARG A 149 4.630 13.515 5.047 1.00 34.23 C ATOM 2315 CD ARG A 149 5.408 13.781 6.324 1.00 13.51 C ATOM 2316 NE ARG A 149 4.817 13.103 7.476 1.00 64.34 N ATOM 2317 CZ ARG A 149 5.069 13.432 8.741 1.00 32.43 C ATOM 2318 NH1 ARG A 149 5.900 14.429 9.022 1.00 40.50 N ATOM 2319 NH2 ARG A 149 4.489 12.763 9.729 1.00 31.23 N ATOM 0 H ARG A 149 5.559 14.054 0.969 1.00 5.15 H new ATOM 0 HA ARG A 149 4.189 13.169 2.490 1.00 61.12 H new ATOM 0 HB2 ARG A 149 6.059 14.520 3.812 1.00 35.13 H new ATOM 0 HB3 ARG A 149 4.708 15.521 4.306 1.00 35.13 H new ATOM 0 HG2 ARG A 149 3.561 13.559 5.255 1.00 34.23 H new ATOM 0 HG3 ARG A 149 4.845 12.507 4.692 1.00 34.23 H new ATOM 0 HD2 ARG A 149 6.438 13.449 6.197 1.00 13.51 H new ATOM 0 HD3 ARG A 149 5.440 14.854 6.512 1.00 13.51 H new ATOM 0 HE ARG A 149 4.173 12.332 7.300 1.00 64.34 H new ATOM 0 HH11 ARG A 149 6.349 14.947 8.267 1.00 40.50 H new ATOM 0 HH12 ARG A 149 6.089 14.677 9.993 1.00 40.50 H new ATOM 0 HH21 ARG A 149 3.850 11.996 9.519 1.00 31.23 H new ATOM 0 HH22 ARG A 149 4.682 13.015 10.698 1.00 31.23 H new ATOM 2333 N GLN A 150 2.101 14.530 1.611 1.00 11.43 N ATOM 2334 CA GLN A 150 0.743 15.051 1.496 1.00 12.22 C ATOM 2335 C GLN A 150 -0.285 13.927 1.578 1.00 14.40 C ATOM 2336 O GLN A 150 -0.314 13.036 0.731 1.00 4.33 O ATOM 2337 CB GLN A 150 0.579 15.813 0.178 1.00 25.05 C ATOM 2338 CG GLN A 150 -0.812 16.393 -0.021 1.00 63.01 C ATOM 2339 CD GLN A 150 -0.798 17.897 -0.205 1.00 11.24 C ATOM 2340 OE1 GLN A 150 -1.158 18.650 0.700 1.00 33.42 O ATOM 2341 NE2 GLN A 150 -0.381 18.343 -1.384 1.00 4.52 N ATOM 0 H GLN A 150 2.379 13.905 0.854 1.00 11.43 H new ATOM 0 HA GLN A 150 0.572 15.733 2.329 1.00 12.22 H new ATOM 0 HB2 GLN A 150 1.309 16.622 0.142 1.00 25.05 H new ATOM 0 HB3 GLN A 150 0.806 15.142 -0.651 1.00 25.05 H new ATOM 0 HG2 GLN A 150 -1.273 15.929 -0.893 1.00 63.01 H new ATOM 0 HG3 GLN A 150 -1.432 16.142 0.840 1.00 63.01 H new ATOM 0 HE21 GLN A 150 -0.092 17.683 -2.106 1.00 4.52 H new ATOM 0 HE22 GLN A 150 -0.350 19.346 -1.568 1.00 4.52 H new ATOM 2350 N GLY A 151 -1.129 13.979 2.603 1.00 42.12 N ATOM 2351 CA GLY A 151 -2.152 12.963 2.778 1.00 34.44 C ATOM 2352 C GLY A 151 -1.584 11.557 2.846 1.00 11.33 C ATOM 2353 O GLY A 151 -2.300 10.583 2.613 1.00 41.43 O ATOM 0 H GLY A 151 -1.123 14.707 3.317 1.00 42.12 H new ATOM 0 HA2 GLY A 151 -2.709 13.169 3.692 1.00 34.44 H new ATOM 0 HA3 GLY A 151 -2.861 13.023 1.953 1.00 34.44 H new ATOM 2357 N VAL A 152 -0.298 11.448 3.168 1.00 35.22 N ATOM 2358 CA VAL A 152 0.360 10.160 3.268 1.00 70.41 C ATOM 2359 C VAL A 152 -0.380 9.233 4.226 1.00 12.13 C ATOM 2360 O VAL A 152 -0.767 8.124 3.858 1.00 41.42 O ATOM 2361 CB VAL A 152 1.809 10.332 3.748 1.00 60.51 C ATOM 2362 CG1 VAL A 152 2.553 9.022 3.644 1.00 31.12 C ATOM 2363 CG2 VAL A 152 2.515 11.418 2.951 1.00 73.11 C ATOM 0 H VAL A 152 0.308 12.245 3.364 1.00 35.22 H new ATOM 0 HA VAL A 152 0.355 9.713 2.274 1.00 70.41 H new ATOM 0 HB VAL A 152 1.793 10.639 4.794 1.00 60.51 H new ATOM 0 HG11 VAL A 152 3.579 9.158 3.987 1.00 31.12 H new ATOM 0 HG12 VAL A 152 2.059 8.273 4.263 1.00 31.12 H new ATOM 0 HG13 VAL A 152 2.559 8.688 2.606 1.00 31.12 H new ATOM 0 HG21 VAL A 152 3.540 11.523 3.308 1.00 73.11 H new ATOM 0 HG22 VAL A 152 2.524 11.147 1.895 1.00 73.11 H new ATOM 0 HG23 VAL A 152 1.988 12.364 3.078 1.00 73.11 H new ATOM 2373 N GLU A 153 -0.576 9.696 5.455 1.00 74.21 N ATOM 2374 CA GLU A 153 -1.274 8.910 6.466 1.00 10.33 C ATOM 2375 C GLU A 153 -2.740 8.718 6.087 1.00 42.15 C ATOM 2376 O GLU A 153 -3.366 7.732 6.473 1.00 35.31 O ATOM 2377 CB GLU A 153 -1.172 9.590 7.832 1.00 25.42 C ATOM 2378 CG GLU A 153 0.254 9.916 8.244 1.00 43.50 C ATOM 2379 CD GLU A 153 0.603 11.377 8.034 1.00 44.10 C ATOM 2380 OE1 GLU A 153 0.813 11.775 6.869 1.00 12.54 O ATOM 2381 OE2 GLU A 153 0.667 12.122 9.034 1.00 42.04 O ATOM 0 H GLU A 153 -0.261 10.612 5.776 1.00 74.21 H new ATOM 0 HA GLU A 153 -0.800 7.930 6.521 1.00 10.33 H new ATOM 0 HB2 GLU A 153 -1.756 10.510 7.815 1.00 25.42 H new ATOM 0 HB3 GLU A 153 -1.620 8.942 8.585 1.00 25.42 H new ATOM 0 HG2 GLU A 153 0.392 9.661 9.295 1.00 43.50 H new ATOM 0 HG3 GLU A 153 0.944 9.296 7.672 1.00 43.50 H new ATOM 2388 N ASP A 154 -3.280 9.668 5.327 1.00 13.54 N ATOM 2389 CA ASP A 154 -4.671 9.602 4.894 1.00 45.43 C ATOM 2390 C ASP A 154 -4.936 8.322 4.106 1.00 50.33 C ATOM 2391 O ASP A 154 -5.813 7.534 4.459 1.00 51.04 O ATOM 2392 CB ASP A 154 -5.019 10.825 4.040 1.00 44.51 C ATOM 2393 CG ASP A 154 -6.007 11.747 4.727 1.00 33.33 C ATOM 2394 OD1 ASP A 154 -5.630 12.372 5.741 1.00 73.03 O ATOM 2395 OD2 ASP A 154 -7.157 11.845 4.250 1.00 73.31 O ATOM 0 H ASP A 154 -2.775 10.491 4.999 1.00 13.54 H new ATOM 0 HA ASP A 154 -5.303 9.596 5.782 1.00 45.43 H new ATOM 0 HB2 ASP A 154 -4.107 11.378 3.813 1.00 44.51 H new ATOM 0 HB3 ASP A 154 -5.436 10.494 3.089 1.00 44.51 H new ATOM 2400 N ALA A 155 -4.169 8.122 3.039 1.00 71.42 N ATOM 2401 CA ALA A 155 -4.317 6.937 2.201 1.00 10.54 C ATOM 2402 C ALA A 155 -4.174 5.660 3.023 1.00 63.24 C ATOM 2403 O ALA A 155 -4.847 4.663 2.762 1.00 15.33 O ATOM 2404 CB ALA A 155 -3.295 6.961 1.074 1.00 60.44 C ATOM 0 H ALA A 155 -3.438 8.765 2.734 1.00 71.42 H new ATOM 0 HA ALA A 155 -5.318 6.948 1.771 1.00 10.54 H new ATOM 0 HB1 ALA A 155 -3.415 6.072 0.455 1.00 60.44 H new ATOM 0 HB2 ALA A 155 -3.447 7.851 0.464 1.00 60.44 H new ATOM 0 HB3 ALA A 155 -2.290 6.977 1.495 1.00 60.44 H new ATOM 2410 N PHE A 156 -3.295 5.699 4.020 1.00 33.41 N ATOM 2411 CA PHE A 156 -3.067 4.545 4.884 1.00 14.33 C ATOM 2412 C PHE A 156 -4.265 4.304 5.794 1.00 10.51 C ATOM 2413 O PHE A 156 -4.784 3.191 5.875 1.00 72.11 O ATOM 2414 CB PHE A 156 -1.808 4.756 5.729 1.00 72.31 C ATOM 2415 CG PHE A 156 -0.539 4.362 5.029 1.00 53.21 C ATOM 2416 CD1 PHE A 156 -0.364 4.627 3.680 1.00 60.23 C ATOM 2417 CD2 PHE A 156 0.480 3.728 5.721 1.00 12.32 C ATOM 2418 CE1 PHE A 156 0.804 4.267 3.035 1.00 11.24 C ATOM 2419 CE2 PHE A 156 1.650 3.365 5.082 1.00 3.12 C ATOM 2420 CZ PHE A 156 1.812 3.635 3.736 1.00 33.11 C ATOM 0 H PHE A 156 -2.729 6.516 4.250 1.00 33.41 H new ATOM 0 HA PHE A 156 -2.930 3.669 4.250 1.00 14.33 H new ATOM 0 HB2 PHE A 156 -1.744 5.806 6.014 1.00 72.31 H new ATOM 0 HB3 PHE A 156 -1.898 4.180 6.650 1.00 72.31 H new ATOM 0 HD1 PHE A 156 -1.149 5.120 3.127 1.00 60.23 H new ATOM 0 HD2 PHE A 156 0.358 3.515 6.773 1.00 12.32 H new ATOM 0 HE1 PHE A 156 0.928 4.480 1.983 1.00 11.24 H new ATOM 0 HE2 PHE A 156 2.437 2.871 5.633 1.00 3.12 H new ATOM 0 HZ PHE A 156 2.725 3.352 3.234 1.00 33.11 H new ATOM 2430 N TYR A 157 -4.699 5.358 6.477 1.00 35.15 N ATOM 2431 CA TYR A 157 -5.838 5.270 7.386 1.00 32.34 C ATOM 2432 C TYR A 157 -7.062 4.691 6.681 1.00 64.32 C ATOM 2433 O TYR A 157 -7.921 4.078 7.315 1.00 72.44 O ATOM 2434 CB TYR A 157 -6.170 6.651 7.954 1.00 15.33 C ATOM 2435 CG TYR A 157 -5.150 7.160 8.948 1.00 20.21 C ATOM 2436 CD1 TYR A 157 -4.633 6.325 9.931 1.00 33.32 C ATOM 2437 CD2 TYR A 157 -4.704 8.474 8.903 1.00 72.15 C ATOM 2438 CE1 TYR A 157 -3.701 6.786 10.841 1.00 31.12 C ATOM 2439 CE2 TYR A 157 -3.772 8.943 9.810 1.00 53.54 C ATOM 2440 CZ TYR A 157 -3.274 8.095 10.776 1.00 23.12 C ATOM 2441 OH TYR A 157 -2.346 8.558 11.681 1.00 72.20 O ATOM 0 H TYR A 157 -4.279 6.286 6.419 1.00 35.15 H new ATOM 0 HA TYR A 157 -5.565 4.602 8.203 1.00 32.34 H new ATOM 0 HB2 TYR A 157 -6.250 7.363 7.132 1.00 15.33 H new ATOM 0 HB3 TYR A 157 -7.146 6.611 8.437 1.00 15.33 H new ATOM 0 HD1 TYR A 157 -4.965 5.299 9.985 1.00 33.32 H new ATOM 0 HD2 TYR A 157 -5.092 9.141 8.147 1.00 72.15 H new ATOM 0 HE1 TYR A 157 -3.309 6.124 11.599 1.00 31.12 H new ATOM 0 HE2 TYR A 157 -3.436 9.968 9.762 1.00 53.54 H new ATOM 0 HH TYR A 157 -2.152 9.501 11.497 1.00 72.20 H new ATOM 2451 N THR A 158 -7.136 4.888 5.368 1.00 10.52 N ATOM 2452 CA THR A 158 -8.253 4.386 4.581 1.00 52.15 C ATOM 2453 C THR A 158 -8.404 2.876 4.741 1.00 50.30 C ATOM 2454 O THR A 158 -9.514 2.367 4.893 1.00 55.34 O ATOM 2455 CB THR A 158 -8.054 4.737 3.108 1.00 3.45 C ATOM 2456 OG1 THR A 158 -7.668 6.093 2.963 1.00 14.30 O ATOM 2457 CG2 THR A 158 -9.294 4.522 2.274 1.00 1.21 C ATOM 0 H THR A 158 -6.433 5.393 4.828 1.00 10.52 H new ATOM 0 HA THR A 158 -9.165 4.860 4.945 1.00 52.15 H new ATOM 0 HB THR A 158 -7.273 4.065 2.752 1.00 3.45 H new ATOM 0 HG1 THR A 158 -8.401 6.600 2.557 1.00 14.30 H new ATOM 0 HG21 THR A 158 -9.087 4.790 1.238 1.00 1.21 H new ATOM 0 HG22 THR A 158 -9.590 3.474 2.326 1.00 1.21 H new ATOM 0 HG23 THR A 158 -10.102 5.147 2.655 1.00 1.21 H new ATOM 2465 N LEU A 159 -7.280 2.164 4.708 1.00 60.12 N ATOM 2466 CA LEU A 159 -7.291 0.712 4.852 1.00 1.12 C ATOM 2467 C LEU A 159 -7.988 0.301 6.146 1.00 65.24 C ATOM 2468 O LEU A 159 -8.625 -0.750 6.214 1.00 35.42 O ATOM 2469 CB LEU A 159 -5.860 0.164 4.826 1.00 33.40 C ATOM 2470 CG LEU A 159 -5.593 -0.901 3.760 1.00 72.14 C ATOM 2471 CD1 LEU A 159 -4.179 -1.447 3.895 1.00 11.52 C ATOM 2472 CD2 LEU A 159 -6.612 -2.026 3.860 1.00 21.54 C ATOM 0 H LEU A 159 -6.352 2.569 4.583 1.00 60.12 H new ATOM 0 HA LEU A 159 -7.846 0.290 4.014 1.00 1.12 H new ATOM 0 HB2 LEU A 159 -5.172 0.995 4.668 1.00 33.40 H new ATOM 0 HB3 LEU A 159 -5.631 -0.258 5.805 1.00 33.40 H new ATOM 0 HG LEU A 159 -5.691 -0.437 2.779 1.00 72.14 H new ATOM 0 HD11 LEU A 159 -4.006 -2.203 3.129 1.00 11.52 H new ATOM 0 HD12 LEU A 159 -3.462 -0.635 3.772 1.00 11.52 H new ATOM 0 HD13 LEU A 159 -4.054 -1.894 4.881 1.00 11.52 H new ATOM 0 HD21 LEU A 159 -6.405 -2.773 3.094 1.00 21.54 H new ATOM 0 HD22 LEU A 159 -6.548 -2.489 4.845 1.00 21.54 H new ATOM 0 HD23 LEU A 159 -7.614 -1.623 3.713 1.00 21.54 H new ATOM 2484 N VAL A 160 -7.865 1.141 7.169 1.00 72.32 N ATOM 2485 CA VAL A 160 -8.485 0.871 8.459 1.00 40.42 C ATOM 2486 C VAL A 160 -9.999 0.752 8.323 1.00 25.12 C ATOM 2487 O VAL A 160 -10.595 -0.241 8.741 1.00 0.22 O ATOM 2488 CB VAL A 160 -8.160 1.977 9.481 1.00 3.33 C ATOM 2489 CG1 VAL A 160 -8.674 1.599 10.861 1.00 31.14 C ATOM 2490 CG2 VAL A 160 -6.662 2.251 9.516 1.00 22.21 C ATOM 0 H VAL A 160 -7.341 2.015 7.128 1.00 72.32 H new ATOM 0 HA VAL A 160 -8.077 -0.075 8.816 1.00 40.42 H new ATOM 0 HB VAL A 160 -8.665 2.892 9.170 1.00 3.33 H new ATOM 0 HG11 VAL A 160 -8.435 2.393 11.568 1.00 31.14 H new ATOM 0 HG12 VAL A 160 -9.755 1.462 10.822 1.00 31.14 H new ATOM 0 HG13 VAL A 160 -8.202 0.671 11.184 1.00 31.14 H new ATOM 0 HG21 VAL A 160 -6.452 3.035 10.244 1.00 22.21 H new ATOM 0 HG22 VAL A 160 -6.132 1.342 9.800 1.00 22.21 H new ATOM 0 HG23 VAL A 160 -6.328 2.573 8.530 1.00 22.21 H new ATOM 2500 N ARG A 161 -10.616 1.771 7.732 1.00 41.43 N ATOM 2501 CA ARG A 161 -12.061 1.781 7.538 1.00 2.45 C ATOM 2502 C ARG A 161 -12.492 0.640 6.622 1.00 2.25 C ATOM 2503 O ARG A 161 -13.592 0.104 6.758 1.00 20.15 O ATOM 2504 CB ARG A 161 -12.508 3.120 6.949 1.00 13.52 C ATOM 2505 CG ARG A 161 -12.045 4.325 7.752 1.00 5.43 C ATOM 2506 CD ARG A 161 -12.070 5.595 6.917 1.00 64.35 C ATOM 2507 NE ARG A 161 -11.724 6.776 7.704 1.00 24.43 N ATOM 2508 CZ ARG A 161 -12.546 7.349 8.581 1.00 2.15 C ATOM 2509 NH1 ARG A 161 -13.759 6.853 8.787 1.00 73.44 N ATOM 2510 NH2 ARG A 161 -12.152 8.422 9.254 1.00 12.31 N ATOM 0 H ARG A 161 -10.137 2.600 7.379 1.00 41.43 H new ATOM 0 HA ARG A 161 -12.535 1.644 8.510 1.00 2.45 H new ATOM 0 HB2 ARG A 161 -12.127 3.205 5.931 1.00 13.52 H new ATOM 0 HB3 ARG A 161 -13.596 3.134 6.884 1.00 13.52 H new ATOM 0 HG2 ARG A 161 -12.686 4.450 8.625 1.00 5.43 H new ATOM 0 HG3 ARG A 161 -11.034 4.151 8.121 1.00 5.43 H new ATOM 0 HD2 ARG A 161 -11.371 5.496 6.086 1.00 64.35 H new ATOM 0 HD3 ARG A 161 -13.062 5.725 6.485 1.00 64.35 H new ATOM 0 HE ARG A 161 -10.799 7.186 7.574 1.00 24.43 H new ATOM 0 HH11 ARG A 161 -14.067 6.028 8.272 1.00 73.44 H new ATOM 0 HH12 ARG A 161 -14.384 7.297 9.460 1.00 73.44 H new ATOM 0 HH21 ARG A 161 -11.220 8.807 9.099 1.00 12.31 H new ATOM 0 HH22 ARG A 161 -12.781 8.862 9.926 1.00 12.31 H new ATOM 2524 N GLU A 162 -11.619 0.275 5.689 1.00 34.14 N ATOM 2525 CA GLU A 162 -11.909 -0.802 4.750 1.00 62.12 C ATOM 2526 C GLU A 162 -11.880 -2.158 5.449 1.00 4.24 C ATOM 2527 O GLU A 162 -12.782 -2.976 5.275 1.00 1.32 O ATOM 2528 CB GLU A 162 -10.902 -0.787 3.598 1.00 54.41 C ATOM 2529 CG GLU A 162 -11.332 0.078 2.425 1.00 13.34 C ATOM 2530 CD GLU A 162 -12.514 -0.503 1.673 1.00 53.12 C ATOM 2531 OE1 GLU A 162 -12.777 -1.715 1.826 1.00 22.42 O ATOM 2532 OE2 GLU A 162 -13.176 0.253 0.932 1.00 45.31 O ATOM 0 H GLU A 162 -10.705 0.709 5.563 1.00 34.14 H new ATOM 0 HA GLU A 162 -12.910 -0.642 4.351 1.00 62.12 H new ATOM 0 HB2 GLU A 162 -9.942 -0.429 3.970 1.00 54.41 H new ATOM 0 HB3 GLU A 162 -10.747 -1.808 3.248 1.00 54.41 H new ATOM 0 HG2 GLU A 162 -11.591 1.073 2.788 1.00 13.34 H new ATOM 0 HG3 GLU A 162 -10.493 0.197 1.739 1.00 13.34 H new ATOM 2539 N ILE A 163 -10.837 -2.389 6.241 1.00 14.24 N ATOM 2540 CA ILE A 163 -10.689 -3.640 6.964 1.00 73.25 C ATOM 2541 C ILE A 163 -11.772 -3.792 8.028 1.00 5.10 C ATOM 2542 O ILE A 163 -12.244 -4.897 8.295 1.00 33.12 O ATOM 2543 CB ILE A 163 -9.307 -3.728 7.623 1.00 12.04 C ATOM 2544 CG1 ILE A 163 -8.221 -3.668 6.555 1.00 41.42 C ATOM 2545 CG2 ILE A 163 -9.184 -5.005 8.435 1.00 73.04 C ATOM 2546 CD1 ILE A 163 -6.894 -3.194 7.084 1.00 64.35 C ATOM 0 H ILE A 163 -10.082 -1.721 6.396 1.00 14.24 H new ATOM 0 HA ILE A 163 -10.792 -4.449 6.241 1.00 73.25 H new ATOM 0 HB ILE A 163 -9.185 -2.882 8.300 1.00 12.04 H new ATOM 0 HG12 ILE A 163 -8.097 -4.658 6.116 1.00 41.42 H new ATOM 0 HG13 ILE A 163 -8.544 -3.003 5.754 1.00 41.42 H new ATOM 0 HG21 ILE A 163 -8.197 -5.050 8.895 1.00 73.04 H new ATOM 0 HG22 ILE A 163 -9.948 -5.017 9.213 1.00 73.04 H new ATOM 0 HG23 ILE A 163 -9.319 -5.866 7.781 1.00 73.04 H new ATOM 0 HD11 ILE A 163 -6.165 -3.174 6.274 1.00 64.35 H new ATOM 0 HD12 ILE A 163 -7.004 -2.191 7.497 1.00 64.35 H new ATOM 0 HD13 ILE A 163 -6.550 -3.873 7.865 1.00 64.35 H new ATOM 2558 N ARG A 164 -12.160 -2.673 8.635 1.00 22.14 N ATOM 2559 CA ARG A 164 -13.186 -2.679 9.673 1.00 55.35 C ATOM 2560 C ARG A 164 -14.437 -3.415 9.203 1.00 52.35 C ATOM 2561 O ARG A 164 -15.160 -4.007 10.005 1.00 60.33 O ATOM 2562 CB ARG A 164 -13.545 -1.247 10.073 1.00 54.41 C ATOM 2563 CG ARG A 164 -12.624 -0.663 11.133 1.00 44.22 C ATOM 2564 CD ARG A 164 -13.405 0.076 12.208 1.00 22.05 C ATOM 2565 NE ARG A 164 -14.088 1.253 11.677 1.00 41.11 N ATOM 2566 CZ ARG A 164 -13.471 2.395 11.376 1.00 31.53 C ATOM 2567 NH1 ARG A 164 -12.162 2.516 11.553 1.00 75.52 N ATOM 2568 NH2 ARG A 164 -14.167 3.417 10.897 1.00 64.14 N ATOM 0 H ARG A 164 -11.779 -1.750 8.425 1.00 22.14 H new ATOM 0 HA ARG A 164 -12.784 -3.203 10.540 1.00 55.35 H new ATOM 0 HB2 ARG A 164 -13.514 -0.613 9.187 1.00 54.41 H new ATOM 0 HB3 ARG A 164 -14.570 -1.228 10.443 1.00 54.41 H new ATOM 0 HG2 ARG A 164 -12.042 -1.463 11.591 1.00 44.22 H new ATOM 0 HG3 ARG A 164 -11.915 0.019 10.664 1.00 44.22 H new ATOM 0 HD2 ARG A 164 -14.137 -0.598 12.652 1.00 22.05 H new ATOM 0 HD3 ARG A 164 -12.726 0.380 13.005 1.00 22.05 H new ATOM 0 HE ARG A 164 -15.096 1.197 11.528 1.00 41.11 H new ATOM 0 HH11 ARG A 164 -11.623 1.733 11.921 1.00 75.52 H new ATOM 0 HH12 ARG A 164 -11.695 3.393 11.321 1.00 75.52 H new ATOM 0 HH21 ARG A 164 -15.174 3.329 10.759 1.00 64.14 H new ATOM 0 HH22 ARG A 164 -13.696 4.292 10.666 1.00 64.14 H new ATOM 2582 N GLN A 165 -14.685 -3.376 7.898 1.00 14.14 N ATOM 2583 CA GLN A 165 -15.846 -4.041 7.321 1.00 43.04 C ATOM 2584 C GLN A 165 -15.428 -5.277 6.528 1.00 72.32 C ATOM 2585 O GLN A 165 -16.136 -6.284 6.512 1.00 24.23 O ATOM 2586 CB GLN A 165 -16.624 -3.076 6.430 1.00 12.12 C ATOM 2587 CG GLN A 165 -15.942 -2.817 5.108 1.00 21.21 C ATOM 2588 CD GLN A 165 -16.689 -1.821 4.244 1.00 60.32 C ATOM 2589 OE1 GLN A 165 -17.300 -2.189 3.240 1.00 30.11 O ATOM 2590 NE2 GLN A 165 -16.645 -0.551 4.630 1.00 21.23 N ATOM 0 H GLN A 165 -14.097 -2.891 7.220 1.00 14.14 H new ATOM 0 HA GLN A 165 -16.493 -4.363 8.137 1.00 43.04 H new ATOM 0 HB2 GLN A 165 -17.619 -3.481 6.246 1.00 12.12 H new ATOM 0 HB3 GLN A 165 -16.757 -2.131 6.956 1.00 12.12 H new ATOM 0 HG2 GLN A 165 -14.934 -2.446 5.292 1.00 21.21 H new ATOM 0 HG3 GLN A 165 -15.842 -3.757 4.566 1.00 21.21 H new ATOM 0 HE21 GLN A 165 -16.127 -0.291 5.469 1.00 21.23 H new ATOM 0 HE22 GLN A 165 -17.130 0.164 4.088 1.00 21.23 H new ATOM 2599 N HIS A 166 -14.273 -5.192 5.873 1.00 11.45 N ATOM 2600 CA HIS A 166 -13.759 -6.304 5.079 1.00 33.32 C ATOM 2601 C HIS A 166 -14.819 -6.813 4.102 1.00 42.02 C ATOM 2602 O HIS A 166 -14.819 -6.357 2.939 1.00 1.45 O ATOM 2603 CB HIS A 166 -13.289 -7.436 6.003 1.00 12.44 C ATOM 2604 CG HIS A 166 -13.150 -8.766 5.323 1.00 31.22 C ATOM 2605 ND1 HIS A 166 -14.177 -9.682 5.246 1.00 33.51 N ATOM 2606 CD2 HIS A 166 -12.096 -9.332 4.688 1.00 44.32 C ATOM 2607 CE1 HIS A 166 -13.762 -10.753 4.594 1.00 23.30 C ATOM 2608 NE2 HIS A 166 -12.503 -10.566 4.244 1.00 33.31 N ATOM 2609 OXT HIS A 166 -15.637 -7.665 4.509 1.00 24.23 O ATOM 0 H HIS A 166 -13.676 -4.365 5.876 1.00 11.45 H new ATOM 0 HA HIS A 166 -12.909 -5.949 4.496 1.00 33.32 H new ATOM 0 HB2 HIS A 166 -12.328 -7.160 6.437 1.00 12.44 H new ATOM 0 HB3 HIS A 166 -13.995 -7.534 6.828 1.00 12.44 H new ATOM 0 HD1 HIS A 166 -15.112 -9.553 5.632 1.00 33.51 H new ATOM 0 HD2 HIS A 166 -11.118 -8.894 4.556 1.00 44.32 H new ATOM 0 HE1 HIS A 166 -14.352 -11.632 4.383 1.00 23.30 H new