USER MOD reduce.3.24.130724 H: found=0, std=0, add=1016, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1014 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 61 SER OG : rot 168:sc= 1.21 USER MOD Set 1.2: A 62 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 29 GLN : amide:sc= -1.57 K(o=-1.6,f=-3.8!) USER MOD Set 2.2: A 32 GLN :FLIP amide:sc= 0 F(o=-2.1,f=-1.6) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 172:sc= 0.706 (180deg=0.646) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 THR OG1 : rot 47:sc= 0.247 USER MOD Single : A 15 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0337) USER MOD Single : A 31 SER OG : rot -170:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= -0.0294 X(o=-0.029,f=-0.31) USER MOD Single : A 45 ASN : amide:sc= 0.297 K(o=0.3,f=-3.1!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot -53:sc= 1.27 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 56 CYS SG : rot 180:sc= -0.173 USER MOD Single : A 58 HIS : +bothHN:sc= 1.94 K(o=1.9,f=-9.2!) USER MOD Single : A 63 GLN : amide:sc= -0.0999 X(o=-0.1,f=-0.023) USER MOD Single : A 65 HIS : no HD1:sc= -0.187 X(o=-0.19,f=-0.19) USER MOD Single : A 67 ASN : amide:sc= -0.506 K(o=-0.51,f=-1.7) USER MOD Single : A 68 ASN : amide:sc= -0.205 X(o=-0.2,f=-0.54) USER MOD Single : A 72 GLN : amide:sc= 0.857 K(o=0.86,f=-0.62) USER MOD Single : A 73 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 74 LYS NZ :NH3+ 175:sc= 1.24 (180deg=1.15) USER MOD Single : A 80 SER OG : rot 98:sc= 1.24 USER MOD Single : A 81 MET CE :methyl 168:sc=-0.00913 (180deg=-0.217) USER MOD Single : A 83 LYS NZ :NH3+ 170:sc= 1.18 (180deg=1.1) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 ASN : amide:sc= -0.104 X(o=-0.1,f=-0.051) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0.14 USER MOD Single : A 107 GLN : amide:sc= -0.034 X(o=-0.034,f=-0.0019) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ -131:sc= 0.294 (180deg=-1.12!) USER MOD Single : A 116 GLN : amide:sc= -1.15 K(o=-1.2,f=-5.4!) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 125 ASN : amide:sc= -0.0863! X(o=-0.086!,f=-0.037) USER MOD Single : A 126 ASN : amide:sc= 0.135 X(o=0.13,f=-0.084) USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -27.853 2.589 -2.686 1.00 0.00 N ATOM 2 CA MET A 1 -27.825 2.206 -1.265 1.00 0.00 C ATOM 3 C MET A 1 -27.435 3.430 -0.444 1.00 0.00 C ATOM 4 O MET A 1 -28.302 4.275 -0.222 1.00 0.00 O ATOM 5 CB MET A 1 -26.948 0.978 -1.002 1.00 0.00 C ATOM 6 CG MET A 1 -27.679 -0.338 -1.279 1.00 0.00 C ATOM 7 SD MET A 1 -28.244 -0.594 -2.978 1.00 0.00 S ATOM 8 CE MET A 1 -28.518 -2.380 -2.899 1.00 0.00 C ATOM 0 H1 MET A 1 -27.984 1.740 -3.272 1.00 0.00 H new ATOM 0 H2 MET A 1 -28.640 3.249 -2.852 1.00 0.00 H new ATOM 0 H3 MET A 1 -26.956 3.050 -2.939 1.00 0.00 H new ATOM 0 HA MET A 1 -28.819 1.885 -0.952 1.00 0.00 H new ATOM 0 HB2 MET A 1 -26.056 1.032 -1.627 1.00 0.00 H new ATOM 0 HB3 MET A 1 -26.612 0.991 0.035 1.00 0.00 H new ATOM 0 HG2 MET A 1 -27.017 -1.161 -1.010 1.00 0.00 H new ATOM 0 HG3 MET A 1 -28.544 -0.396 -0.618 1.00 0.00 H new ATOM 0 HE1 MET A 1 -28.875 -2.736 -3.865 1.00 0.00 H new ATOM 0 HE2 MET A 1 -27.582 -2.881 -2.650 1.00 0.00 H new ATOM 0 HE3 MET A 1 -29.262 -2.600 -2.134 1.00 0.00 H new ATOM 18 N LYS A 2 -26.179 3.587 -0.007 1.00 0.00 N ATOM 19 CA LYS A 2 -25.691 4.838 0.567 1.00 0.00 C ATOM 20 C LYS A 2 -24.220 5.012 0.234 1.00 0.00 C ATOM 21 O LYS A 2 -23.517 4.034 -0.038 1.00 0.00 O ATOM 22 CB LYS A 2 -25.944 4.880 2.093 1.00 0.00 C ATOM 23 CG LYS A 2 -25.041 3.978 2.964 1.00 0.00 C ATOM 24 CD LYS A 2 -23.764 4.680 3.468 1.00 0.00 C ATOM 25 CE LYS A 2 -23.025 3.805 4.486 1.00 0.00 C ATOM 26 NZ LYS A 2 -21.870 4.496 5.100 1.00 0.00 N ATOM 0 H LYS A 2 -25.477 2.848 -0.043 1.00 0.00 H new ATOM 0 HA LYS A 2 -26.241 5.672 0.131 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -25.826 5.910 2.431 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -26.982 4.602 2.275 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -25.614 3.626 3.822 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -24.757 3.098 2.387 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -23.108 4.898 2.626 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -24.025 5.635 3.925 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -23.719 3.500 5.269 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -22.680 2.895 3.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -21.406 3.860 5.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -21.192 4.764 4.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -22.199 5.350 5.594 1.00 0.00 H new ATOM 40 N ALA A 3 -23.750 6.245 0.336 1.00 0.00 N ATOM 41 CA ALA A 3 -22.370 6.686 0.210 1.00 0.00 C ATOM 42 C ALA A 3 -22.250 7.911 1.127 1.00 0.00 C ATOM 43 O ALA A 3 -23.197 8.216 1.857 1.00 0.00 O ATOM 44 CB ALA A 3 -22.065 7.016 -1.258 1.00 0.00 C ATOM 0 H ALA A 3 -24.376 7.028 0.525 1.00 0.00 H new ATOM 0 HA ALA A 3 -21.648 5.924 0.502 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -21.030 7.346 -1.349 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -22.218 6.127 -1.870 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -22.730 7.809 -1.598 1.00 0.00 H new ATOM 50 N LEU A 4 -21.107 8.590 1.161 1.00 0.00 N ATOM 51 CA LEU A 4 -20.964 9.848 1.900 1.00 0.00 C ATOM 52 C LEU A 4 -19.847 10.618 1.217 1.00 0.00 C ATOM 53 O LEU A 4 -20.075 11.708 0.700 1.00 0.00 O ATOM 54 CB LEU A 4 -20.744 9.624 3.412 1.00 0.00 C ATOM 55 CG LEU A 4 -21.358 10.707 4.323 1.00 0.00 C ATOM 56 CD1 LEU A 4 -20.723 12.083 4.143 1.00 0.00 C ATOM 57 CD2 LEU A 4 -22.882 10.805 4.174 1.00 0.00 C ATOM 0 H LEU A 4 -20.258 8.290 0.682 1.00 0.00 H new ATOM 0 HA LEU A 4 -21.883 10.433 1.870 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -21.165 8.657 3.687 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -19.673 9.572 3.605 1.00 0.00 H new ATOM 0 HG LEU A 4 -21.133 10.375 5.337 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -21.203 12.796 4.814 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -19.659 12.026 4.374 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -20.853 12.412 3.112 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -23.263 11.582 4.837 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -23.131 11.054 3.142 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -23.335 9.849 4.437 1.00 0.00 H new ATOM 69 N GLU A 5 -18.677 9.982 1.139 1.00 0.00 N ATOM 70 CA GLU A 5 -17.498 10.440 0.413 1.00 0.00 C ATOM 71 C GLU A 5 -17.101 11.876 0.758 1.00 0.00 C ATOM 72 O GLU A 5 -17.032 12.760 -0.103 1.00 0.00 O ATOM 73 CB GLU A 5 -17.751 10.236 -1.089 1.00 0.00 C ATOM 74 CG GLU A 5 -18.320 8.867 -1.511 1.00 0.00 C ATOM 75 CD GLU A 5 -17.792 7.703 -0.675 1.00 0.00 C ATOM 76 OE1 GLU A 5 -16.560 7.465 -0.684 1.00 0.00 O ATOM 77 OE2 GLU A 5 -18.594 7.094 0.076 1.00 0.00 O ATOM 0 H GLU A 5 -18.521 9.088 1.605 1.00 0.00 H new ATOM 0 HA GLU A 5 -16.637 9.846 0.719 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -18.439 11.010 -1.427 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -16.811 10.392 -1.618 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -19.407 8.895 -1.434 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -18.079 8.690 -2.559 1.00 0.00 H new ATOM 84 N HIS A 6 -16.836 12.114 2.040 1.00 0.00 N ATOM 85 CA HIS A 6 -16.566 13.458 2.554 1.00 0.00 C ATOM 86 C HIS A 6 -15.378 13.583 3.510 1.00 0.00 C ATOM 87 O HIS A 6 -15.181 14.656 4.078 1.00 0.00 O ATOM 88 CB HIS A 6 -17.871 14.071 3.088 1.00 0.00 C ATOM 89 CG HIS A 6 -18.179 15.359 2.383 1.00 0.00 C ATOM 90 ND1 HIS A 6 -17.896 16.625 2.848 1.00 0.00 N ATOM 91 CD2 HIS A 6 -18.633 15.456 1.097 1.00 0.00 C ATOM 92 CE1 HIS A 6 -18.169 17.483 1.847 1.00 0.00 C ATOM 93 NE2 HIS A 6 -18.618 16.797 0.774 1.00 0.00 N ATOM 0 H HIS A 6 -16.802 11.384 2.752 1.00 0.00 H new ATOM 0 HA HIS A 6 -16.217 14.053 1.710 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -18.693 13.369 2.948 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -17.783 14.249 4.160 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -18.943 14.642 0.459 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -18.048 18.555 1.895 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -18.898 17.200 -0.120 1.00 0.00 H new ATOM 102 N GLU A 7 -14.575 12.531 3.680 1.00 0.00 N ATOM 103 CA GLU A 7 -13.336 12.578 4.460 1.00 0.00 C ATOM 104 C GLU A 7 -12.218 11.889 3.675 1.00 0.00 C ATOM 105 O GLU A 7 -11.135 12.454 3.507 1.00 0.00 O ATOM 106 CB GLU A 7 -13.522 11.944 5.847 1.00 0.00 C ATOM 107 CG GLU A 7 -14.076 12.935 6.887 1.00 0.00 C ATOM 108 CD GLU A 7 -15.222 12.349 7.707 1.00 0.00 C ATOM 109 OE1 GLU A 7 -16.232 11.902 7.114 1.00 0.00 O ATOM 110 OE2 GLU A 7 -15.146 12.342 8.959 1.00 0.00 O ATOM 0 H GLU A 7 -14.768 11.614 3.277 1.00 0.00 H new ATOM 0 HA GLU A 7 -13.061 13.620 4.626 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -14.199 11.094 5.765 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -12.565 11.556 6.195 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -13.272 13.238 7.558 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -14.422 13.834 6.378 1.00 0.00 H new ATOM 117 N LYS A 8 -12.466 10.675 3.178 1.00 0.00 N ATOM 118 CA LYS A 8 -11.538 9.958 2.309 1.00 0.00 C ATOM 119 C LYS A 8 -11.595 10.602 0.931 1.00 0.00 C ATOM 120 O LYS A 8 -12.576 10.385 0.228 1.00 0.00 O ATOM 121 CB LYS A 8 -11.939 8.475 2.244 1.00 0.00 C ATOM 122 CG LYS A 8 -11.585 7.713 3.530 1.00 0.00 C ATOM 123 CD LYS A 8 -10.150 7.168 3.472 1.00 0.00 C ATOM 124 CE LYS A 8 -9.681 6.728 4.861 1.00 0.00 C ATOM 125 NZ LYS A 8 -8.985 7.814 5.570 1.00 0.00 N ATOM 0 H LYS A 8 -13.325 10.160 3.371 1.00 0.00 H new ATOM 0 HA LYS A 8 -10.519 10.013 2.693 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -13.011 8.399 2.064 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -11.440 8.004 1.397 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -11.692 8.375 4.390 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -12.285 6.890 3.673 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -10.104 6.325 2.783 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -9.480 7.935 3.083 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -10.539 6.401 5.448 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -9.015 5.870 4.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -8.682 7.479 6.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -8.152 8.109 5.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -9.629 8.623 5.683 1.00 0.00 H new ATOM 139 N THR A 9 -10.597 11.395 0.544 1.00 0.00 N ATOM 140 CA THR A 9 -10.496 12.000 -0.783 1.00 0.00 C ATOM 141 C THR A 9 -9.665 11.081 -1.695 1.00 0.00 C ATOM 142 O THR A 9 -8.433 11.170 -1.652 1.00 0.00 O ATOM 143 CB THR A 9 -9.865 13.400 -0.654 1.00 0.00 C ATOM 144 OG1 THR A 9 -8.711 13.360 0.172 1.00 0.00 O ATOM 145 CG2 THR A 9 -10.858 14.389 -0.044 1.00 0.00 C ATOM 0 H THR A 9 -9.820 11.640 1.157 1.00 0.00 H new ATOM 0 HA THR A 9 -11.483 12.115 -1.230 1.00 0.00 H new ATOM 0 HB THR A 9 -9.589 13.724 -1.658 1.00 0.00 H new ATOM 0 HG1 THR A 9 -8.142 12.609 -0.097 1.00 0.00 H new ATOM 0 HG21 THR A 9 -10.391 15.370 0.037 1.00 0.00 H new ATOM 0 HG22 THR A 9 -11.740 14.459 -0.681 1.00 0.00 H new ATOM 0 HG23 THR A 9 -11.153 14.044 0.947 1.00 0.00 H new ATOM 153 N PRO A 10 -10.268 10.199 -2.517 1.00 0.00 N ATOM 154 CA PRO A 10 -9.518 9.242 -3.322 1.00 0.00 C ATOM 155 C PRO A 10 -8.791 9.911 -4.490 1.00 0.00 C ATOM 156 O PRO A 10 -7.952 9.282 -5.120 1.00 0.00 O ATOM 157 CB PRO A 10 -10.564 8.252 -3.833 1.00 0.00 C ATOM 158 CG PRO A 10 -11.785 9.145 -4.025 1.00 0.00 C ATOM 159 CD PRO A 10 -11.688 10.055 -2.802 1.00 0.00 C ATOM 0 HA PRO A 10 -8.737 8.761 -2.733 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -10.255 7.778 -4.765 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -10.753 7.453 -3.116 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -11.741 9.706 -4.959 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -12.713 8.574 -4.040 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -12.146 11.024 -3.000 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -12.214 9.622 -1.951 1.00 0.00 H new ATOM 167 N GLU A 11 -9.123 11.163 -4.794 1.00 0.00 N ATOM 168 CA GLU A 11 -8.572 11.955 -5.881 1.00 0.00 C ATOM 169 C GLU A 11 -7.115 12.275 -5.557 1.00 0.00 C ATOM 170 O GLU A 11 -6.195 11.830 -6.238 1.00 0.00 O ATOM 171 CB GLU A 11 -9.417 13.237 -5.993 1.00 0.00 C ATOM 172 CG GLU A 11 -10.884 12.969 -6.353 1.00 0.00 C ATOM 173 CD GLU A 11 -11.075 12.830 -7.855 1.00 0.00 C ATOM 174 OE1 GLU A 11 -10.687 11.788 -8.425 1.00 0.00 O ATOM 175 OE2 GLU A 11 -11.690 13.736 -8.463 1.00 0.00 O ATOM 0 H GLU A 11 -9.822 11.677 -4.257 1.00 0.00 H new ATOM 0 HA GLU A 11 -8.600 11.422 -6.831 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -9.375 13.775 -5.046 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -8.978 13.888 -6.749 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -11.221 12.059 -5.857 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -11.505 13.783 -5.980 1.00 0.00 H new ATOM 182 N LEU A 12 -6.904 12.994 -4.452 1.00 0.00 N ATOM 183 CA LEU A 12 -5.579 13.324 -3.953 1.00 0.00 C ATOM 184 C LEU A 12 -4.867 12.036 -3.598 1.00 0.00 C ATOM 185 O LEU A 12 -3.698 11.874 -3.932 1.00 0.00 O ATOM 186 CB LEU A 12 -5.661 14.198 -2.698 1.00 0.00 C ATOM 187 CG LEU A 12 -4.253 14.545 -2.167 1.00 0.00 C ATOM 188 CD1 LEU A 12 -3.733 15.829 -2.803 1.00 0.00 C ATOM 189 CD2 LEU A 12 -4.292 14.640 -0.652 1.00 0.00 C ATOM 0 H LEU A 12 -7.660 13.365 -3.877 1.00 0.00 H new ATOM 0 HA LEU A 12 -5.042 13.875 -4.725 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -6.203 15.116 -2.925 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -6.226 13.677 -1.925 1.00 0.00 H new ATOM 0 HG LEU A 12 -3.558 13.752 -2.443 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -2.740 16.052 -2.413 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -3.678 15.703 -3.884 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -4.409 16.651 -2.567 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -3.298 14.885 -0.277 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -4.994 15.419 -0.354 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -4.612 13.685 -0.236 1.00 0.00 H new ATOM 201 N ALA A 13 -5.554 11.123 -2.908 1.00 0.00 N ATOM 202 CA ALA A 13 -4.915 9.910 -2.454 1.00 0.00 C ATOM 203 C ALA A 13 -4.399 9.109 -3.637 1.00 0.00 C ATOM 204 O ALA A 13 -3.363 8.468 -3.488 1.00 0.00 O ATOM 205 CB ALA A 13 -5.891 9.059 -1.653 1.00 0.00 C ATOM 0 H ALA A 13 -6.540 11.208 -2.659 1.00 0.00 H new ATOM 0 HA ALA A 13 -4.077 10.188 -1.815 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -5.392 8.149 -1.319 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -6.238 9.622 -0.786 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -6.743 8.796 -2.279 1.00 0.00 H new ATOM 211 N ALA A 14 -5.076 9.158 -4.787 1.00 0.00 N ATOM 212 CA ALA A 14 -4.600 8.493 -5.991 1.00 0.00 C ATOM 213 C ALA A 14 -3.489 9.285 -6.674 1.00 0.00 C ATOM 214 O ALA A 14 -2.650 8.670 -7.336 1.00 0.00 O ATOM 215 CB ALA A 14 -5.753 8.252 -6.957 1.00 0.00 C ATOM 0 H ALA A 14 -5.959 9.655 -4.904 1.00 0.00 H new ATOM 0 HA ALA A 14 -4.182 7.532 -5.692 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -5.380 7.754 -7.852 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -6.504 7.623 -6.478 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -6.202 9.206 -7.233 1.00 0.00 H new ATOM 221 N LYS A 15 -3.430 10.613 -6.506 1.00 0.00 N ATOM 222 CA LYS A 15 -2.303 11.370 -7.044 1.00 0.00 C ATOM 223 C LYS A 15 -1.059 11.058 -6.231 1.00 0.00 C ATOM 224 O LYS A 15 0.003 10.838 -6.807 1.00 0.00 O ATOM 225 CB LYS A 15 -2.589 12.878 -7.061 1.00 0.00 C ATOM 226 CG LYS A 15 -3.223 13.290 -8.393 1.00 0.00 C ATOM 227 CD LYS A 15 -3.554 14.786 -8.401 1.00 0.00 C ATOM 228 CE LYS A 15 -3.617 15.334 -9.832 1.00 0.00 C ATOM 229 NZ LYS A 15 -2.274 15.501 -10.432 1.00 0.00 N ATOM 0 H LYS A 15 -4.131 11.169 -6.015 1.00 0.00 H new ATOM 0 HA LYS A 15 -2.142 11.070 -8.079 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -3.256 13.137 -6.239 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -1.663 13.431 -6.906 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -2.541 13.060 -9.212 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -4.131 12.712 -8.563 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -4.509 14.952 -7.903 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -2.800 15.331 -7.833 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -4.207 14.658 -10.451 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -4.132 16.295 -9.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -2.360 15.998 -11.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -1.673 16.056 -9.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -1.844 14.567 -10.587 1.00 0.00 H new ATOM 243 N LEU A 16 -1.201 11.014 -4.906 1.00 0.00 N ATOM 244 CA LEU A 16 -0.106 10.762 -3.985 1.00 0.00 C ATOM 245 C LEU A 16 0.322 9.307 -4.226 1.00 0.00 C ATOM 246 O LEU A 16 1.515 9.012 -4.291 1.00 0.00 O ATOM 247 CB LEU A 16 -0.621 10.993 -2.549 1.00 0.00 C ATOM 248 CG LEU A 16 0.390 10.834 -1.395 1.00 0.00 C ATOM 249 CD1 LEU A 16 1.175 9.526 -1.272 1.00 0.00 C ATOM 250 CD2 LEU A 16 1.369 12.013 -1.449 1.00 0.00 C ATOM 0 H LEU A 16 -2.097 11.156 -4.441 1.00 0.00 H new ATOM 0 HA LEU A 16 0.749 11.422 -4.133 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -1.034 12.000 -2.498 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.445 10.302 -2.372 1.00 0.00 H new ATOM 0 HG LEU A 16 -0.238 10.812 -0.504 1.00 0.00 H new ATOM 0 HD11 LEU A 16 1.840 9.580 -0.410 1.00 0.00 H new ATOM 0 HD12 LEU A 16 0.481 8.696 -1.143 1.00 0.00 H new ATOM 0 HD13 LEU A 16 1.765 9.369 -2.175 1.00 0.00 H new ATOM 0 HD21 LEU A 16 2.094 11.921 -0.641 1.00 0.00 H new ATOM 0 HD22 LEU A 16 1.890 12.010 -2.406 1.00 0.00 H new ATOM 0 HD23 LEU A 16 0.819 12.948 -1.339 1.00 0.00 H new ATOM 262 N ALA A 17 -0.651 8.400 -4.426 1.00 0.00 N ATOM 263 CA ALA A 17 -0.412 6.995 -4.724 1.00 0.00 C ATOM 264 C ALA A 17 0.617 6.841 -5.824 1.00 0.00 C ATOM 265 O ALA A 17 1.477 5.995 -5.686 1.00 0.00 O ATOM 266 CB ALA A 17 -1.673 6.259 -5.186 1.00 0.00 C ATOM 0 H ALA A 17 -1.642 8.638 -4.382 1.00 0.00 H new ATOM 0 HA ALA A 17 -0.062 6.560 -3.788 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -1.431 5.217 -5.393 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -2.430 6.307 -4.403 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -2.057 6.729 -6.091 1.00 0.00 H new ATOM 272 N ALA A 18 0.552 7.642 -6.888 1.00 0.00 N ATOM 273 CA ALA A 18 1.420 7.490 -8.045 1.00 0.00 C ATOM 274 C ALA A 18 2.900 7.653 -7.690 1.00 0.00 C ATOM 275 O ALA A 18 3.759 7.140 -8.411 1.00 0.00 O ATOM 276 CB ALA A 18 1.035 8.528 -9.090 1.00 0.00 C ATOM 0 H ALA A 18 -0.108 8.416 -6.967 1.00 0.00 H new ATOM 0 HA ALA A 18 1.287 6.479 -8.431 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.680 8.423 -9.962 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -0.003 8.378 -9.386 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.152 9.527 -8.671 1.00 0.00 H new ATOM 282 N GLU A 19 3.196 8.368 -6.607 1.00 0.00 N ATOM 283 CA GLU A 19 4.535 8.616 -6.101 1.00 0.00 C ATOM 284 C GLU A 19 4.897 7.497 -5.118 1.00 0.00 C ATOM 285 O GLU A 19 5.984 6.922 -5.197 1.00 0.00 O ATOM 286 CB GLU A 19 4.588 10.022 -5.473 1.00 0.00 C ATOM 287 CG GLU A 19 4.116 11.098 -6.471 1.00 0.00 C ATOM 288 CD GLU A 19 4.340 12.527 -5.981 1.00 0.00 C ATOM 289 OE1 GLU A 19 3.952 12.900 -4.853 1.00 0.00 O ATOM 290 OE2 GLU A 19 4.898 13.348 -6.745 1.00 0.00 O ATOM 0 H GLU A 19 2.474 8.808 -6.036 1.00 0.00 H new ATOM 0 HA GLU A 19 5.277 8.603 -6.899 1.00 0.00 H new ATOM 0 HB2 GLU A 19 3.961 10.049 -4.582 1.00 0.00 H new ATOM 0 HB3 GLU A 19 5.606 10.242 -5.152 1.00 0.00 H new ATOM 0 HG2 GLU A 19 4.641 10.960 -7.416 1.00 0.00 H new ATOM 0 HG3 GLU A 19 3.054 10.954 -6.672 1.00 0.00 H new ATOM 297 N ALA A 20 3.974 7.117 -4.228 1.00 0.00 N ATOM 298 CA ALA A 20 4.145 5.983 -3.327 1.00 0.00 C ATOM 299 C ALA A 20 4.306 4.656 -4.077 1.00 0.00 C ATOM 300 O ALA A 20 4.957 3.739 -3.583 1.00 0.00 O ATOM 301 CB ALA A 20 2.946 5.930 -2.375 1.00 0.00 C ATOM 0 H ALA A 20 3.080 7.596 -4.115 1.00 0.00 H new ATOM 0 HA ALA A 20 5.067 6.125 -2.764 1.00 0.00 H new ATOM 0 HB1 ALA A 20 3.059 5.086 -1.694 1.00 0.00 H new ATOM 0 HB2 ALA A 20 2.896 6.855 -1.801 1.00 0.00 H new ATOM 0 HB3 ALA A 20 2.029 5.811 -2.951 1.00 0.00 H new ATOM 307 N ILE A 21 3.710 4.547 -5.258 1.00 0.00 N ATOM 308 CA ILE A 21 3.793 3.447 -6.201 1.00 0.00 C ATOM 309 C ILE A 21 5.207 3.372 -6.763 1.00 0.00 C ATOM 310 O ILE A 21 5.718 2.271 -6.933 1.00 0.00 O ATOM 311 CB ILE A 21 2.691 3.643 -7.268 1.00 0.00 C ATOM 312 CG1 ILE A 21 1.363 3.105 -6.685 1.00 0.00 C ATOM 313 CG2 ILE A 21 3.046 2.944 -8.576 1.00 0.00 C ATOM 314 CD1 ILE A 21 0.116 3.471 -7.495 1.00 0.00 C ATOM 0 H ILE A 21 3.106 5.291 -5.607 1.00 0.00 H new ATOM 0 HA ILE A 21 3.610 2.482 -5.728 1.00 0.00 H new ATOM 0 HB ILE A 21 2.592 4.702 -7.505 1.00 0.00 H new ATOM 0 HG12 ILE A 21 1.427 2.019 -6.612 1.00 0.00 H new ATOM 0 HG13 ILE A 21 1.246 3.486 -5.671 1.00 0.00 H new ATOM 0 HG21 ILE A 21 2.249 3.104 -9.302 1.00 0.00 H new ATOM 0 HG22 ILE A 21 3.978 3.353 -8.966 1.00 0.00 H new ATOM 0 HG23 ILE A 21 3.165 1.875 -8.397 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -0.767 3.052 -7.012 1.00 0.00 H new ATOM 0 HD12 ILE A 21 0.021 4.556 -7.547 1.00 0.00 H new ATOM 0 HD13 ILE A 21 0.205 3.066 -8.503 1.00 0.00 H new ATOM 326 N GLU A 22 5.875 4.493 -7.039 1.00 0.00 N ATOM 327 CA GLU A 22 7.229 4.433 -7.584 1.00 0.00 C ATOM 328 C GLU A 22 8.145 3.853 -6.485 1.00 0.00 C ATOM 329 O GLU A 22 9.031 3.033 -6.743 1.00 0.00 O ATOM 330 CB GLU A 22 7.655 5.847 -8.005 1.00 0.00 C ATOM 331 CG GLU A 22 9.053 5.875 -8.638 1.00 0.00 C ATOM 332 CD GLU A 22 9.054 5.248 -10.040 1.00 0.00 C ATOM 333 OE1 GLU A 22 8.032 5.335 -10.763 1.00 0.00 O ATOM 334 OE2 GLU A 22 10.065 4.623 -10.433 1.00 0.00 O ATOM 0 H GLU A 22 5.509 5.434 -6.897 1.00 0.00 H new ATOM 0 HA GLU A 22 7.290 3.795 -8.466 1.00 0.00 H new ATOM 0 HB2 GLU A 22 6.930 6.245 -8.715 1.00 0.00 H new ATOM 0 HB3 GLU A 22 7.641 6.502 -7.134 1.00 0.00 H new ATOM 0 HG2 GLU A 22 9.404 6.905 -8.700 1.00 0.00 H new ATOM 0 HG3 GLU A 22 9.753 5.337 -7.998 1.00 0.00 H new ATOM 341 N ARG A 23 7.866 4.226 -5.230 1.00 0.00 N ATOM 342 CA ARG A 23 8.543 3.768 -4.028 1.00 0.00 C ATOM 343 C ARG A 23 8.129 2.350 -3.616 1.00 0.00 C ATOM 344 O ARG A 23 8.738 1.813 -2.692 1.00 0.00 O ATOM 345 CB ARG A 23 8.234 4.779 -2.905 1.00 0.00 C ATOM 346 CG ARG A 23 9.338 4.945 -1.849 1.00 0.00 C ATOM 347 CD ARG A 23 10.461 5.903 -2.274 1.00 0.00 C ATOM 348 NE ARG A 23 11.316 5.358 -3.337 1.00 0.00 N ATOM 349 CZ ARG A 23 12.243 4.400 -3.218 1.00 0.00 C ATOM 350 NH1 ARG A 23 12.626 3.965 -2.025 1.00 0.00 N ATOM 351 NH2 ARG A 23 12.761 3.869 -4.319 1.00 0.00 N ATOM 0 H ARG A 23 7.121 4.891 -5.023 1.00 0.00 H new ATOM 0 HA ARG A 23 9.614 3.715 -4.222 1.00 0.00 H new ATOM 0 HB2 ARG A 23 8.038 5.751 -3.358 1.00 0.00 H new ATOM 0 HB3 ARG A 23 7.317 4.470 -2.403 1.00 0.00 H new ATOM 0 HG2 ARG A 23 8.892 5.310 -0.924 1.00 0.00 H new ATOM 0 HG3 ARG A 23 9.769 3.968 -1.631 1.00 0.00 H new ATOM 0 HD2 ARG A 23 10.021 6.840 -2.615 1.00 0.00 H new ATOM 0 HD3 ARG A 23 11.077 6.138 -1.406 1.00 0.00 H new ATOM 0 HE ARG A 23 11.189 5.753 -4.269 1.00 0.00 H new ATOM 0 HH11 ARG A 23 12.213 4.361 -1.181 1.00 0.00 H new ATOM 0 HH12 ARG A 23 13.334 3.234 -1.952 1.00 0.00 H new ATOM 0 HH21 ARG A 23 12.451 4.192 -5.236 1.00 0.00 H new ATOM 0 HH22 ARG A 23 13.469 3.138 -4.248 1.00 0.00 H new ATOM 365 N ASP A 24 7.139 1.729 -4.264 1.00 0.00 N ATOM 366 CA ASP A 24 6.690 0.376 -3.931 1.00 0.00 C ATOM 367 C ASP A 24 6.285 -0.408 -5.183 1.00 0.00 C ATOM 368 O ASP A 24 5.168 -0.232 -5.688 1.00 0.00 O ATOM 369 CB ASP A 24 5.520 0.390 -2.949 1.00 0.00 C ATOM 370 CG ASP A 24 5.129 -1.019 -2.494 1.00 0.00 C ATOM 371 OD1 ASP A 24 5.780 -2.015 -2.889 1.00 0.00 O ATOM 372 OD2 ASP A 24 4.135 -1.131 -1.746 1.00 0.00 O ATOM 0 H ASP A 24 6.625 2.153 -5.037 1.00 0.00 H new ATOM 0 HA ASP A 24 7.539 -0.119 -3.459 1.00 0.00 H new ATOM 0 HB2 ASP A 24 5.786 0.990 -2.079 1.00 0.00 H new ATOM 0 HB3 ASP A 24 4.661 0.870 -3.417 1.00 0.00 H new ATOM 377 N PRO A 25 7.135 -1.324 -5.681 1.00 0.00 N ATOM 378 CA PRO A 25 6.824 -2.103 -6.868 1.00 0.00 C ATOM 379 C PRO A 25 5.581 -2.984 -6.692 1.00 0.00 C ATOM 380 O PRO A 25 4.988 -3.372 -7.701 1.00 0.00 O ATOM 381 CB PRO A 25 8.088 -2.913 -7.171 1.00 0.00 C ATOM 382 CG PRO A 25 8.792 -3.022 -5.823 1.00 0.00 C ATOM 383 CD PRO A 25 8.432 -1.704 -5.146 1.00 0.00 C ATOM 0 HA PRO A 25 6.563 -1.456 -7.705 1.00 0.00 H new ATOM 0 HB2 PRO A 25 7.844 -3.896 -7.574 1.00 0.00 H new ATOM 0 HB3 PRO A 25 8.715 -2.412 -7.909 1.00 0.00 H new ATOM 0 HG2 PRO A 25 8.439 -3.880 -5.251 1.00 0.00 H new ATOM 0 HG3 PRO A 25 9.870 -3.137 -5.938 1.00 0.00 H new ATOM 0 HD2 PRO A 25 8.389 -1.820 -4.063 1.00 0.00 H new ATOM 0 HD3 PRO A 25 9.180 -0.940 -5.356 1.00 0.00 H new ATOM 391 N TRP A 26 5.164 -3.314 -5.463 1.00 0.00 N ATOM 392 CA TRP A 26 3.918 -4.033 -5.240 1.00 0.00 C ATOM 393 C TRP A 26 2.748 -3.070 -5.345 1.00 0.00 C ATOM 394 O TRP A 26 1.776 -3.418 -6.010 1.00 0.00 O ATOM 395 CB TRP A 26 3.910 -4.708 -3.869 1.00 0.00 C ATOM 396 CG TRP A 26 2.565 -5.216 -3.433 1.00 0.00 C ATOM 397 CD1 TRP A 26 1.934 -4.839 -2.300 1.00 0.00 C ATOM 398 CD2 TRP A 26 1.656 -6.153 -4.093 1.00 0.00 C ATOM 399 NE1 TRP A 26 0.698 -5.441 -2.224 1.00 0.00 N ATOM 400 CE2 TRP A 26 0.482 -6.284 -3.292 1.00 0.00 C ATOM 401 CE3 TRP A 26 1.723 -6.945 -5.259 1.00 0.00 C ATOM 402 CZ2 TRP A 26 -0.563 -7.161 -3.628 1.00 0.00 C ATOM 403 CZ3 TRP A 26 0.718 -7.882 -5.566 1.00 0.00 C ATOM 404 CH2 TRP A 26 -0.429 -7.982 -4.760 1.00 0.00 C ATOM 0 H TRP A 26 5.678 -3.091 -4.611 1.00 0.00 H new ATOM 0 HA TRP A 26 3.827 -4.807 -6.002 1.00 0.00 H new ATOM 0 HB2 TRP A 26 4.612 -5.542 -3.884 1.00 0.00 H new ATOM 0 HB3 TRP A 26 4.275 -3.998 -3.126 1.00 0.00 H new ATOM 0 HD1 TRP A 26 2.340 -4.164 -1.561 1.00 0.00 H new ATOM 0 HE1 TRP A 26 0.027 -5.283 -1.472 1.00 0.00 H new ATOM 0 HE3 TRP A 26 2.562 -6.830 -5.929 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -1.457 -7.203 -3.024 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 0.829 -8.527 -6.425 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -1.206 -8.689 -5.011 1.00 0.00 H new ATOM 415 N ALA A 27 2.801 -1.870 -4.754 1.00 0.00 N ATOM 416 CA ALA A 27 1.685 -0.941 -4.890 1.00 0.00 C ATOM 417 C ALA A 27 1.408 -0.642 -6.366 1.00 0.00 C ATOM 418 O ALA A 27 0.241 -0.527 -6.749 1.00 0.00 O ATOM 419 CB ALA A 27 1.951 0.346 -4.122 1.00 0.00 C ATOM 0 H ALA A 27 3.583 -1.531 -4.194 1.00 0.00 H new ATOM 0 HA ALA A 27 0.800 -1.412 -4.463 1.00 0.00 H new ATOM 0 HB1 ALA A 27 1.104 1.022 -4.240 1.00 0.00 H new ATOM 0 HB2 ALA A 27 2.089 0.117 -3.065 1.00 0.00 H new ATOM 0 HB3 ALA A 27 2.851 0.822 -4.510 1.00 0.00 H new ATOM 425 N ALA A 28 2.452 -0.568 -7.201 1.00 0.00 N ATOM 426 CA ALA A 28 2.298 -0.408 -8.642 1.00 0.00 C ATOM 427 C ALA A 28 1.443 -1.535 -9.210 1.00 0.00 C ATOM 428 O ALA A 28 0.492 -1.306 -9.960 1.00 0.00 O ATOM 429 CB ALA A 28 3.678 -0.440 -9.323 1.00 0.00 C ATOM 0 H ALA A 28 3.423 -0.618 -6.892 1.00 0.00 H new ATOM 0 HA ALA A 28 1.812 0.549 -8.833 1.00 0.00 H new ATOM 0 HB1 ALA A 28 3.555 -0.320 -10.399 1.00 0.00 H new ATOM 0 HB2 ALA A 28 4.294 0.371 -8.935 1.00 0.00 H new ATOM 0 HB3 ALA A 28 4.163 -1.394 -9.117 1.00 0.00 H new ATOM 435 N GLN A 29 1.794 -2.755 -8.815 1.00 0.00 N ATOM 436 CA GLN A 29 1.151 -3.979 -9.236 1.00 0.00 C ATOM 437 C GLN A 29 -0.296 -4.027 -8.744 1.00 0.00 C ATOM 438 O GLN A 29 -1.150 -4.415 -9.532 1.00 0.00 O ATOM 439 CB GLN A 29 2.019 -5.169 -8.785 1.00 0.00 C ATOM 440 CG GLN A 29 3.323 -5.271 -9.595 1.00 0.00 C ATOM 441 CD GLN A 29 3.147 -5.796 -11.017 1.00 0.00 C ATOM 442 OE1 GLN A 29 2.534 -5.156 -11.866 1.00 0.00 O ATOM 443 NE2 GLN A 29 3.724 -6.950 -11.320 1.00 0.00 N ATOM 0 H GLN A 29 2.565 -2.916 -8.167 1.00 0.00 H new ATOM 0 HA GLN A 29 1.077 -4.031 -10.322 1.00 0.00 H new ATOM 0 HB2 GLN A 29 2.257 -5.063 -7.727 1.00 0.00 H new ATOM 0 HB3 GLN A 29 1.452 -6.093 -8.894 1.00 0.00 H new ATOM 0 HG2 GLN A 29 3.785 -4.285 -9.640 1.00 0.00 H new ATOM 0 HG3 GLN A 29 4.015 -5.924 -9.064 1.00 0.00 H new ATOM 0 HE21 GLN A 29 4.230 -7.471 -10.604 1.00 0.00 H new ATOM 0 HE22 GLN A 29 3.662 -7.317 -12.270 1.00 0.00 H new ATOM 452 N VAL A 30 -0.627 -3.567 -7.530 1.00 0.00 N ATOM 453 CA VAL A 30 -2.019 -3.485 -7.067 1.00 0.00 C ATOM 454 C VAL A 30 -2.834 -2.593 -8.013 1.00 0.00 C ATOM 455 O VAL A 30 -3.964 -2.938 -8.358 1.00 0.00 O ATOM 456 CB VAL A 30 -2.110 -2.990 -5.604 1.00 0.00 C ATOM 457 CG1 VAL A 30 -3.564 -2.924 -5.107 1.00 0.00 C ATOM 458 CG2 VAL A 30 -1.347 -3.916 -4.652 1.00 0.00 C ATOM 0 H VAL A 30 0.057 -3.243 -6.846 1.00 0.00 H new ATOM 0 HA VAL A 30 -2.443 -4.489 -7.084 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.671 -1.993 -5.603 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -3.580 -2.572 -4.076 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.132 -2.237 -5.734 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -4.011 -3.917 -5.158 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.431 -3.539 -3.633 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -1.769 -4.919 -4.704 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -0.296 -3.949 -4.941 1.00 0.00 H new ATOM 468 N SER A 31 -2.260 -1.478 -8.470 1.00 0.00 N ATOM 469 CA SER A 31 -2.916 -0.575 -9.407 1.00 0.00 C ATOM 470 C SER A 31 -3.154 -1.229 -10.774 1.00 0.00 C ATOM 471 O SER A 31 -4.049 -0.789 -11.496 1.00 0.00 O ATOM 472 CB SER A 31 -2.099 0.722 -9.497 1.00 0.00 C ATOM 473 OG SER A 31 -2.552 1.644 -8.514 1.00 0.00 O ATOM 0 H SER A 31 -1.324 -1.179 -8.197 1.00 0.00 H new ATOM 0 HA SER A 31 -3.912 -0.332 -9.037 1.00 0.00 H new ATOM 0 HB2 SER A 31 -1.041 0.507 -9.348 1.00 0.00 H new ATOM 0 HB3 SER A 31 -2.199 1.158 -10.491 1.00 0.00 H new ATOM 0 HG SER A 31 -2.143 2.520 -8.674 1.00 0.00 H new ATOM 479 N GLN A 32 -2.412 -2.285 -11.115 1.00 0.00 N ATOM 480 CA GLN A 32 -2.621 -3.074 -12.319 1.00 0.00 C ATOM 481 C GLN A 32 -3.568 -4.256 -12.044 1.00 0.00 C ATOM 482 O GLN A 32 -4.294 -4.670 -12.944 1.00 0.00 O ATOM 483 CB GLN A 32 -1.249 -3.510 -12.858 1.00 0.00 C ATOM 484 CG GLN A 32 -1.374 -4.334 -14.143 1.00 0.00 C ATOM 485 CD GLN A 32 -0.070 -4.391 -14.934 1.00 0.00 C ATOM 486 OE1 GLN A 32 1.007 -4.911 -14.375 1.00 0.00 O flip ATOM 487 NE2 GLN A 32 -0.020 -3.965 -16.086 1.00 0.00 N flip ATOM 0 H GLN A 32 -1.634 -2.618 -10.546 1.00 0.00 H new ATOM 0 HA GLN A 32 -3.114 -2.478 -13.087 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -0.638 -2.628 -13.051 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -0.731 -4.097 -12.100 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -1.686 -5.348 -13.891 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -2.156 -3.906 -14.770 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -0.852 -3.563 -16.518 1.00 0.00 H new ATOM 0 HE22 GLN A 32 0.854 -4.013 -16.610 1.00 0.00 H new ATOM 496 N LEU A 33 -3.617 -4.784 -10.812 1.00 0.00 N ATOM 497 CA LEU A 33 -4.570 -5.827 -10.427 1.00 0.00 C ATOM 498 C LEU A 33 -5.999 -5.313 -10.521 1.00 0.00 C ATOM 499 O LEU A 33 -6.914 -6.081 -10.818 1.00 0.00 O ATOM 500 CB LEU A 33 -4.348 -6.321 -8.984 1.00 0.00 C ATOM 501 CG LEU A 33 -3.041 -7.063 -8.682 1.00 0.00 C ATOM 502 CD1 LEU A 33 -3.160 -7.786 -7.338 1.00 0.00 C ATOM 503 CD2 LEU A 33 -2.722 -8.060 -9.786 1.00 0.00 C ATOM 0 H LEU A 33 -2.995 -4.497 -10.056 1.00 0.00 H new ATOM 0 HA LEU A 33 -4.407 -6.653 -11.119 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -4.406 -5.458 -8.321 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -5.176 -6.980 -8.723 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.229 -6.338 -8.632 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -2.230 -8.313 -7.125 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -3.354 -7.059 -6.550 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -3.981 -8.502 -7.381 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -1.791 -8.576 -9.552 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -3.530 -8.787 -9.864 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.616 -7.532 -10.734 1.00 0.00 H new ATOM 515 N SER A 34 -6.175 -4.024 -10.250 1.00 0.00 N ATOM 516 CA SER A 34 -7.429 -3.300 -10.349 1.00 0.00 C ATOM 517 C SER A 34 -8.528 -3.933 -9.493 1.00 0.00 C ATOM 518 O SER A 34 -9.386 -4.697 -9.953 1.00 0.00 O ATOM 519 CB SER A 34 -7.765 -3.078 -11.826 1.00 0.00 C ATOM 520 OG SER A 34 -6.855 -2.106 -12.311 1.00 0.00 O ATOM 0 H SER A 34 -5.406 -3.430 -9.940 1.00 0.00 H new ATOM 0 HA SER A 34 -7.334 -2.306 -9.912 1.00 0.00 H new ATOM 0 HB2 SER A 34 -7.673 -4.008 -12.387 1.00 0.00 H new ATOM 0 HB3 SER A 34 -8.794 -2.736 -11.941 1.00 0.00 H new ATOM 0 HG SER A 34 -7.034 -1.934 -13.259 1.00 0.00 H new ATOM 526 N LEU A 35 -8.463 -3.615 -8.201 1.00 0.00 N ATOM 527 CA LEU A 35 -9.300 -4.171 -7.146 1.00 0.00 C ATOM 528 C LEU A 35 -10.384 -3.156 -6.739 1.00 0.00 C ATOM 529 O LEU A 35 -10.244 -1.966 -7.035 1.00 0.00 O ATOM 530 CB LEU A 35 -8.374 -4.601 -5.991 1.00 0.00 C ATOM 531 CG LEU A 35 -7.844 -6.054 -6.066 1.00 0.00 C ATOM 532 CD1 LEU A 35 -7.623 -6.628 -7.467 1.00 0.00 C ATOM 533 CD2 LEU A 35 -6.516 -6.150 -5.308 1.00 0.00 C ATOM 0 H LEU A 35 -7.794 -2.931 -7.848 1.00 0.00 H new ATOM 0 HA LEU A 35 -9.846 -5.053 -7.481 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -7.521 -3.923 -5.961 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -8.913 -4.477 -5.052 1.00 0.00 H new ATOM 0 HG LEU A 35 -8.641 -6.650 -5.622 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -7.251 -7.650 -7.387 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -8.566 -6.626 -8.014 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -6.894 -6.017 -8.000 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -6.141 -7.172 -5.359 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -5.790 -5.474 -5.759 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -6.671 -5.872 -4.265 1.00 0.00 H new ATOM 545 N PRO A 36 -11.471 -3.608 -6.078 1.00 0.00 N ATOM 546 CA PRO A 36 -12.618 -2.774 -5.755 1.00 0.00 C ATOM 547 C PRO A 36 -12.312 -1.971 -4.485 1.00 0.00 C ATOM 548 O PRO A 36 -11.549 -1.009 -4.539 1.00 0.00 O ATOM 549 CB PRO A 36 -13.778 -3.774 -5.645 1.00 0.00 C ATOM 550 CG PRO A 36 -13.124 -5.024 -5.054 1.00 0.00 C ATOM 551 CD PRO A 36 -11.697 -4.968 -5.603 1.00 0.00 C ATOM 0 HA PRO A 36 -12.871 -2.012 -6.492 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -14.573 -3.396 -5.002 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -14.225 -3.978 -6.618 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -13.137 -5.007 -3.964 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -13.639 -5.933 -5.365 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -10.976 -5.230 -4.828 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -11.568 -5.685 -6.414 1.00 0.00 H new ATOM 559 N LYS A 37 -12.822 -2.385 -3.318 1.00 0.00 N ATOM 560 CA LYS A 37 -12.499 -1.762 -2.041 1.00 0.00 C ATOM 561 C LYS A 37 -12.050 -2.789 -1.025 1.00 0.00 C ATOM 562 O LYS A 37 -11.011 -2.584 -0.413 1.00 0.00 O ATOM 563 CB LYS A 37 -13.693 -0.935 -1.556 1.00 0.00 C ATOM 564 CG LYS A 37 -13.248 0.120 -0.533 1.00 0.00 C ATOM 565 CD LYS A 37 -14.297 1.212 -0.297 1.00 0.00 C ATOM 566 CE LYS A 37 -15.487 0.666 0.500 1.00 0.00 C ATOM 567 NZ LYS A 37 -16.781 1.078 -0.073 1.00 0.00 N ATOM 0 H LYS A 37 -13.473 -3.166 -3.240 1.00 0.00 H new ATOM 0 HA LYS A 37 -11.656 -1.084 -2.175 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -14.171 -0.446 -2.405 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -14.437 -1.592 -1.107 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -13.026 -0.372 0.414 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -12.323 0.582 -0.877 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -13.845 2.045 0.242 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -14.644 1.602 -1.254 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -15.434 -0.422 0.527 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -15.421 1.014 1.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -17.555 0.685 0.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -16.845 2.116 -0.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -16.857 0.724 -1.048 1.00 0.00 H new ATOM 581 N LEU A 38 -12.762 -3.908 -0.884 1.00 0.00 N ATOM 582 CA LEU A 38 -12.408 -4.915 0.123 1.00 0.00 C ATOM 583 C LEU A 38 -11.071 -5.538 -0.241 1.00 0.00 C ATOM 584 O LEU A 38 -10.120 -5.523 0.538 1.00 0.00 O ATOM 585 CB LEU A 38 -13.486 -6.008 0.260 1.00 0.00 C ATOM 586 CG LEU A 38 -13.090 -7.125 1.256 1.00 0.00 C ATOM 587 CD1 LEU A 38 -12.712 -6.606 2.646 1.00 0.00 C ATOM 588 CD2 LEU A 38 -14.246 -8.110 1.418 1.00 0.00 C ATOM 0 H LEU A 38 -13.580 -4.141 -1.447 1.00 0.00 H new ATOM 0 HA LEU A 38 -12.338 -4.415 1.089 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -14.420 -5.551 0.587 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -13.674 -6.451 -0.718 1.00 0.00 H new ATOM 0 HG LEU A 38 -12.208 -7.603 0.829 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -12.447 -7.446 3.288 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -11.861 -5.930 2.563 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -13.559 -6.072 3.078 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -13.961 -8.893 2.120 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -15.122 -7.584 1.798 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -14.481 -8.557 0.452 1.00 0.00 H new ATOM 600 N VAL A 39 -11.007 -6.094 -1.449 1.00 0.00 N ATOM 601 CA VAL A 39 -9.813 -6.796 -1.906 1.00 0.00 C ATOM 602 C VAL A 39 -8.678 -5.779 -2.091 1.00 0.00 C ATOM 603 O VAL A 39 -7.514 -6.122 -1.894 1.00 0.00 O ATOM 604 CB VAL A 39 -10.112 -7.622 -3.178 1.00 0.00 C ATOM 605 CG1 VAL A 39 -8.994 -8.634 -3.461 1.00 0.00 C ATOM 606 CG2 VAL A 39 -11.455 -8.368 -3.089 1.00 0.00 C ATOM 0 H VAL A 39 -11.768 -6.071 -2.128 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.489 -7.520 -1.158 1.00 0.00 H new ATOM 0 HB VAL A 39 -10.170 -6.905 -3.997 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -9.234 -9.199 -4.362 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -8.052 -8.105 -3.605 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -8.900 -9.318 -2.618 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -11.619 -8.933 -4.007 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -11.436 -9.052 -2.240 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -12.263 -7.648 -2.957 1.00 0.00 H new ATOM 616 N GLU A 40 -9.009 -4.519 -2.400 1.00 0.00 N ATOM 617 CA GLU A 40 -8.032 -3.445 -2.485 1.00 0.00 C ATOM 618 C GLU A 40 -7.451 -3.210 -1.087 1.00 0.00 C ATOM 619 O GLU A 40 -6.237 -3.213 -0.940 1.00 0.00 O ATOM 620 CB GLU A 40 -8.671 -2.186 -3.100 1.00 0.00 C ATOM 621 CG GLU A 40 -7.659 -1.038 -3.238 1.00 0.00 C ATOM 622 CD GLU A 40 -7.667 -0.382 -4.621 1.00 0.00 C ATOM 623 OE1 GLU A 40 -6.976 -0.887 -5.534 1.00 0.00 O ATOM 624 OE2 GLU A 40 -8.271 0.706 -4.781 1.00 0.00 O ATOM 0 H GLU A 40 -9.965 -4.223 -2.597 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.211 -3.715 -3.149 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -9.080 -2.429 -4.081 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -9.505 -1.862 -2.478 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.875 -0.281 -2.484 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.659 -1.419 -3.031 1.00 0.00 H new ATOM 631 N GLN A 41 -8.280 -3.092 -0.043 1.00 0.00 N ATOM 632 CA GLN A 41 -7.825 -2.907 1.331 1.00 0.00 C ATOM 633 C GLN A 41 -6.904 -4.046 1.758 1.00 0.00 C ATOM 634 O GLN A 41 -5.956 -3.784 2.488 1.00 0.00 O ATOM 635 CB GLN A 41 -9.027 -2.795 2.297 1.00 0.00 C ATOM 636 CG GLN A 41 -8.662 -2.126 3.633 1.00 0.00 C ATOM 637 CD GLN A 41 -9.880 -1.733 4.472 1.00 0.00 C ATOM 638 OE1 GLN A 41 -10.005 -2.072 5.647 1.00 0.00 O ATOM 639 NE2 GLN A 41 -10.789 -0.945 3.933 1.00 0.00 N ATOM 0 H GLN A 41 -9.295 -3.123 -0.134 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.260 -1.976 1.374 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -9.821 -2.224 1.816 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.424 -3.791 2.492 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -8.036 -2.806 4.212 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.066 -1.236 3.433 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -10.700 -0.655 2.959 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -11.582 -0.625 4.490 1.00 0.00 H new ATOM 648 N VAL A 42 -7.145 -5.282 1.315 1.00 0.00 N ATOM 649 CA VAL A 42 -6.251 -6.406 1.580 1.00 0.00 C ATOM 650 C VAL A 42 -4.916 -6.173 0.886 1.00 0.00 C ATOM 651 O VAL A 42 -3.887 -6.133 1.557 1.00 0.00 O ATOM 652 CB VAL A 42 -6.919 -7.730 1.162 1.00 0.00 C ATOM 653 CG1 VAL A 42 -5.985 -8.951 1.197 1.00 0.00 C ATOM 654 CG2 VAL A 42 -8.069 -7.985 2.131 1.00 0.00 C ATOM 0 H VAL A 42 -7.966 -5.529 0.763 1.00 0.00 H new ATOM 0 HA VAL A 42 -6.052 -6.481 2.649 1.00 0.00 H new ATOM 0 HB VAL A 42 -7.239 -7.616 0.126 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -6.536 -9.840 0.889 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -5.148 -8.789 0.517 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -5.608 -9.091 2.210 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -8.568 -8.917 1.866 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -7.680 -8.058 3.147 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -8.782 -7.163 2.074 1.00 0.00 H new ATOM 664 N ALA A 43 -4.923 -6.015 -0.439 1.00 0.00 N ATOM 665 CA ALA A 43 -3.704 -5.853 -1.215 1.00 0.00 C ATOM 666 C ALA A 43 -2.884 -4.653 -0.730 1.00 0.00 C ATOM 667 O ALA A 43 -1.658 -4.694 -0.771 1.00 0.00 O ATOM 668 CB ALA A 43 -4.078 -5.711 -2.692 1.00 0.00 C ATOM 0 H ALA A 43 -5.776 -5.997 -0.999 1.00 0.00 H new ATOM 0 HA ALA A 43 -3.074 -6.733 -1.083 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -3.173 -5.589 -3.286 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -4.610 -6.604 -3.020 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.719 -4.839 -2.823 1.00 0.00 H new ATOM 674 N LEU A 44 -3.554 -3.602 -0.257 1.00 0.00 N ATOM 675 CA LEU A 44 -2.945 -2.382 0.238 1.00 0.00 C ATOM 676 C LEU A 44 -2.488 -2.505 1.685 1.00 0.00 C ATOM 677 O LEU A 44 -1.555 -1.797 2.058 1.00 0.00 O ATOM 678 CB LEU A 44 -3.925 -1.202 0.103 1.00 0.00 C ATOM 679 CG LEU A 44 -4.185 -0.745 -1.348 1.00 0.00 C ATOM 680 CD1 LEU A 44 -5.144 0.452 -1.329 1.00 0.00 C ATOM 681 CD2 LEU A 44 -2.926 -0.350 -2.123 1.00 0.00 C ATOM 0 H LEU A 44 -4.573 -3.583 -0.209 1.00 0.00 H new ATOM 0 HA LEU A 44 -2.060 -2.200 -0.372 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -4.875 -1.482 0.557 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -3.536 -0.357 0.672 1.00 0.00 H new ATOM 0 HG LEU A 44 -4.609 -1.606 -1.865 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -5.334 0.782 -2.350 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -6.084 0.158 -0.862 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -4.697 1.268 -0.761 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -3.201 -0.042 -3.132 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -2.430 0.477 -1.614 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -2.249 -1.202 -2.176 1.00 0.00 H new ATOM 693 N ASN A 45 -3.094 -3.366 2.510 1.00 0.00 N ATOM 694 CA ASN A 45 -2.670 -3.512 3.904 1.00 0.00 C ATOM 695 C ASN A 45 -1.686 -4.661 4.077 1.00 0.00 C ATOM 696 O ASN A 45 -1.447 -5.103 5.204 1.00 0.00 O ATOM 697 CB ASN A 45 -3.865 -3.593 4.862 1.00 0.00 C ATOM 698 CG ASN A 45 -4.410 -2.198 5.127 1.00 0.00 C ATOM 699 OD1 ASN A 45 -3.836 -1.452 5.911 1.00 0.00 O ATOM 700 ND2 ASN A 45 -5.486 -1.806 4.479 1.00 0.00 N ATOM 0 H ASN A 45 -3.872 -3.967 2.239 1.00 0.00 H new ATOM 0 HA ASN A 45 -2.129 -2.606 4.178 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -4.645 -4.222 4.433 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -3.560 -4.058 5.799 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -5.856 -0.867 4.626 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -5.950 -2.441 3.830 1.00 0.00 H new ATOM 707 N ALA A 46 -1.100 -5.151 2.984 1.00 0.00 N ATOM 708 CA ALA A 46 -0.056 -6.148 3.004 1.00 0.00 C ATOM 709 C ALA A 46 1.084 -5.712 2.117 1.00 0.00 C ATOM 710 O ALA A 46 0.858 -5.062 1.101 1.00 0.00 O ATOM 711 CB ALA A 46 -0.597 -7.484 2.495 1.00 0.00 C ATOM 0 H ALA A 46 -1.352 -4.851 2.042 1.00 0.00 H new ATOM 0 HA ALA A 46 0.296 -6.264 4.029 1.00 0.00 H new ATOM 0 HB1 ALA A 46 0.198 -8.229 2.514 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.417 -7.812 3.134 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -0.958 -7.365 1.474 1.00 0.00 H new ATOM 717 N TRP A 47 2.285 -6.165 2.454 1.00 0.00 N ATOM 718 CA TRP A 47 3.464 -5.955 1.641 1.00 0.00 C ATOM 719 C TRP A 47 3.731 -7.311 1.018 1.00 0.00 C ATOM 720 O TRP A 47 3.538 -8.364 1.640 1.00 0.00 O ATOM 721 CB TRP A 47 4.650 -5.424 2.448 1.00 0.00 C ATOM 722 CG TRP A 47 5.187 -6.287 3.548 1.00 0.00 C ATOM 723 CD1 TRP A 47 4.804 -6.229 4.843 1.00 0.00 C ATOM 724 CD2 TRP A 47 6.218 -7.323 3.477 1.00 0.00 C ATOM 725 NE1 TRP A 47 5.576 -7.096 5.585 1.00 0.00 N ATOM 726 CE2 TRP A 47 6.470 -7.797 4.798 1.00 0.00 C ATOM 727 CE3 TRP A 47 6.954 -7.927 2.433 1.00 0.00 C ATOM 728 CZ2 TRP A 47 7.416 -8.802 5.065 1.00 0.00 C ATOM 729 CZ3 TRP A 47 7.874 -8.961 2.692 1.00 0.00 C ATOM 730 CH2 TRP A 47 8.114 -9.395 4.005 1.00 0.00 C ATOM 0 H TRP A 47 2.464 -6.693 3.308 1.00 0.00 H new ATOM 0 HA TRP A 47 3.312 -5.184 0.886 1.00 0.00 H new ATOM 0 HB2 TRP A 47 5.465 -5.222 1.753 1.00 0.00 H new ATOM 0 HB3 TRP A 47 4.358 -4.469 2.884 1.00 0.00 H new ATOM 0 HD1 TRP A 47 4.017 -5.602 5.234 1.00 0.00 H new ATOM 0 HE1 TRP A 47 5.497 -7.207 6.596 1.00 0.00 H new ATOM 0 HE3 TRP A 47 6.808 -7.589 1.418 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 7.604 -9.115 6.081 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 8.401 -9.425 1.871 1.00 0.00 H new ATOM 0 HH2 TRP A 47 8.831 -10.180 4.197 1.00 0.00 H new ATOM 741 N LYS A 48 4.089 -7.286 -0.257 1.00 0.00 N ATOM 742 CA LYS A 48 4.239 -8.499 -1.030 1.00 0.00 C ATOM 743 C LYS A 48 5.664 -8.996 -1.014 1.00 0.00 C ATOM 744 O LYS A 48 6.603 -8.220 -1.192 1.00 0.00 O ATOM 745 CB LYS A 48 3.722 -8.212 -2.440 1.00 0.00 C ATOM 746 CG LYS A 48 3.710 -9.425 -3.364 1.00 0.00 C ATOM 747 CD LYS A 48 4.905 -9.487 -4.326 1.00 0.00 C ATOM 748 CE LYS A 48 4.801 -8.425 -5.422 1.00 0.00 C ATOM 749 NZ LYS A 48 5.802 -8.620 -6.484 1.00 0.00 N ATOM 0 H LYS A 48 4.281 -6.430 -0.777 1.00 0.00 H new ATOM 0 HA LYS A 48 3.656 -9.309 -0.592 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.710 -7.814 -2.369 1.00 0.00 H new ATOM 0 HB3 LYS A 48 4.339 -7.434 -2.889 1.00 0.00 H new ATOM 0 HG2 LYS A 48 3.697 -10.331 -2.758 1.00 0.00 H new ATOM 0 HG3 LYS A 48 2.788 -9.417 -3.946 1.00 0.00 H new ATOM 0 HD2 LYS A 48 5.830 -9.345 -3.768 1.00 0.00 H new ATOM 0 HD3 LYS A 48 4.956 -10.476 -4.781 1.00 0.00 H new ATOM 0 HE2 LYS A 48 3.802 -8.452 -5.858 1.00 0.00 H new ATOM 0 HE3 LYS A 48 4.930 -7.437 -4.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 5.693 -7.877 -7.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 6.757 -8.568 -6.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 5.664 -9.552 -6.924 1.00 0.00 H new ATOM 763 N GLU A 49 5.778 -10.303 -0.830 1.00 0.00 N ATOM 764 CA GLU A 49 6.985 -11.079 -0.902 1.00 0.00 C ATOM 765 C GLU A 49 6.742 -11.998 -2.085 1.00 0.00 C ATOM 766 O GLU A 49 5.913 -12.904 -1.999 1.00 0.00 O ATOM 767 CB GLU A 49 7.191 -11.925 0.361 1.00 0.00 C ATOM 768 CG GLU A 49 8.381 -12.897 0.220 1.00 0.00 C ATOM 769 CD GLU A 49 8.154 -14.211 0.963 1.00 0.00 C ATOM 770 OE1 GLU A 49 7.649 -14.163 2.107 1.00 0.00 O ATOM 771 OE2 GLU A 49 8.515 -15.284 0.420 1.00 0.00 O ATOM 0 H GLU A 49 4.966 -10.880 -0.612 1.00 0.00 H new ATOM 0 HA GLU A 49 7.869 -10.449 -0.998 1.00 0.00 H new ATOM 0 HB2 GLU A 49 7.359 -11.267 1.214 1.00 0.00 H new ATOM 0 HB3 GLU A 49 6.283 -12.491 0.570 1.00 0.00 H new ATOM 0 HG2 GLU A 49 8.552 -13.105 -0.836 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.283 -12.419 0.601 1.00 0.00 H new ATOM 778 N GLU A 50 7.347 -11.698 -3.223 1.00 0.00 N ATOM 779 CA GLU A 50 7.282 -12.610 -4.349 1.00 0.00 C ATOM 780 C GLU A 50 8.371 -13.624 -4.020 1.00 0.00 C ATOM 781 O GLU A 50 9.538 -13.260 -3.827 1.00 0.00 O ATOM 782 CB GLU A 50 7.487 -11.863 -5.656 1.00 0.00 C ATOM 783 CG GLU A 50 7.702 -12.757 -6.879 1.00 0.00 C ATOM 784 CD GLU A 50 7.487 -11.956 -8.164 1.00 0.00 C ATOM 785 OE1 GLU A 50 8.246 -10.991 -8.429 1.00 0.00 O ATOM 786 OE2 GLU A 50 6.498 -12.231 -8.887 1.00 0.00 O ATOM 0 H GLU A 50 7.880 -10.844 -3.389 1.00 0.00 H new ATOM 0 HA GLU A 50 6.319 -13.100 -4.491 1.00 0.00 H new ATOM 0 HB2 GLU A 50 6.619 -11.228 -5.835 1.00 0.00 H new ATOM 0 HB3 GLU A 50 8.348 -11.203 -5.550 1.00 0.00 H new ATOM 0 HG2 GLU A 50 8.711 -13.170 -6.864 1.00 0.00 H new ATOM 0 HG3 GLU A 50 7.012 -13.600 -6.848 1.00 0.00 H new ATOM 793 N SER A 51 7.958 -14.860 -3.806 1.00 0.00 N ATOM 794 CA SER A 51 8.814 -15.957 -3.440 1.00 0.00 C ATOM 795 C SER A 51 9.331 -16.591 -4.738 1.00 0.00 C ATOM 796 O SER A 51 8.946 -16.184 -5.841 1.00 0.00 O ATOM 797 CB SER A 51 8.017 -16.959 -2.593 1.00 0.00 C ATOM 798 OG SER A 51 7.174 -16.373 -1.605 1.00 0.00 O ATOM 0 H SER A 51 6.978 -15.130 -3.887 1.00 0.00 H new ATOM 0 HA SER A 51 9.662 -15.626 -2.841 1.00 0.00 H new ATOM 0 HB2 SER A 51 7.404 -17.568 -3.258 1.00 0.00 H new ATOM 0 HB3 SER A 51 8.717 -17.633 -2.099 1.00 0.00 H new ATOM 0 HG SER A 51 7.698 -15.755 -1.053 1.00 0.00 H new ATOM 804 N ASP A 52 10.178 -17.607 -4.603 1.00 0.00 N ATOM 805 CA ASP A 52 10.777 -18.358 -5.703 1.00 0.00 C ATOM 806 C ASP A 52 9.773 -18.722 -6.795 1.00 0.00 C ATOM 807 O ASP A 52 10.054 -18.541 -7.985 1.00 0.00 O ATOM 808 CB ASP A 52 11.427 -19.625 -5.148 1.00 0.00 C ATOM 809 CG ASP A 52 12.231 -20.342 -6.225 1.00 0.00 C ATOM 810 OD1 ASP A 52 13.113 -19.698 -6.841 1.00 0.00 O ATOM 811 OD2 ASP A 52 11.995 -21.546 -6.444 1.00 0.00 O ATOM 0 H ASP A 52 10.478 -17.944 -3.688 1.00 0.00 H new ATOM 0 HA ASP A 52 11.523 -17.715 -6.170 1.00 0.00 H new ATOM 0 HB2 ASP A 52 12.079 -19.368 -4.313 1.00 0.00 H new ATOM 0 HB3 ASP A 52 10.658 -20.292 -4.758 1.00 0.00 H new ATOM 816 N ASN A 53 8.587 -19.186 -6.397 1.00 0.00 N ATOM 817 CA ASN A 53 7.491 -19.487 -7.316 1.00 0.00 C ATOM 818 C ASN A 53 6.113 -19.190 -6.707 1.00 0.00 C ATOM 819 O ASN A 53 5.102 -19.705 -7.190 1.00 0.00 O ATOM 820 CB ASN A 53 7.603 -20.953 -7.781 1.00 0.00 C ATOM 821 CG ASN A 53 7.104 -21.176 -9.207 1.00 0.00 C ATOM 822 OD1 ASN A 53 6.362 -20.381 -9.778 1.00 0.00 O ATOM 823 ND2 ASN A 53 7.549 -22.250 -9.835 1.00 0.00 N ATOM 0 H ASN A 53 8.360 -19.365 -5.419 1.00 0.00 H new ATOM 0 HA ASN A 53 7.580 -18.829 -8.180 1.00 0.00 H new ATOM 0 HB2 ASN A 53 8.644 -21.269 -7.715 1.00 0.00 H new ATOM 0 HB3 ASN A 53 7.033 -21.587 -7.101 1.00 0.00 H new ATOM 0 HD21 ASN A 53 7.277 -22.425 -10.802 1.00 0.00 H new ATOM 0 HD22 ASN A 53 8.165 -22.904 -9.352 1.00 0.00 H new ATOM 830 N ALA A 54 6.027 -18.395 -5.636 1.00 0.00 N ATOM 831 CA ALA A 54 4.787 -18.132 -4.910 1.00 0.00 C ATOM 832 C ALA A 54 4.732 -16.637 -4.617 1.00 0.00 C ATOM 833 O ALA A 54 5.676 -15.920 -4.944 1.00 0.00 O ATOM 834 CB ALA A 54 4.751 -18.978 -3.632 1.00 0.00 C ATOM 0 H ALA A 54 6.834 -17.909 -5.245 1.00 0.00 H new ATOM 0 HA ALA A 54 3.911 -18.408 -5.497 1.00 0.00 H new ATOM 0 HB1 ALA A 54 3.825 -18.781 -3.091 1.00 0.00 H new ATOM 0 HB2 ALA A 54 4.800 -20.035 -3.894 1.00 0.00 H new ATOM 0 HB3 ALA A 54 5.602 -18.720 -3.001 1.00 0.00 H new ATOM 840 N VAL A 55 3.641 -16.141 -4.035 1.00 0.00 N ATOM 841 CA VAL A 55 3.574 -14.743 -3.614 1.00 0.00 C ATOM 842 C VAL A 55 2.887 -14.687 -2.247 1.00 0.00 C ATOM 843 O VAL A 55 1.697 -14.968 -2.137 1.00 0.00 O ATOM 844 CB VAL A 55 2.917 -13.862 -4.705 1.00 0.00 C ATOM 845 CG1 VAL A 55 2.878 -12.405 -4.250 1.00 0.00 C ATOM 846 CG2 VAL A 55 3.703 -13.829 -6.031 1.00 0.00 C ATOM 0 H VAL A 55 2.797 -16.682 -3.845 1.00 0.00 H new ATOM 0 HA VAL A 55 4.571 -14.320 -3.494 1.00 0.00 H new ATOM 0 HB VAL A 55 1.932 -14.303 -4.859 1.00 0.00 H new ATOM 0 HG11 VAL A 55 2.414 -11.794 -5.025 1.00 0.00 H new ATOM 0 HG12 VAL A 55 2.298 -12.326 -3.330 1.00 0.00 H new ATOM 0 HG13 VAL A 55 3.894 -12.053 -4.070 1.00 0.00 H new ATOM 0 HG21 VAL A 55 3.183 -13.193 -6.747 1.00 0.00 H new ATOM 0 HG22 VAL A 55 4.702 -13.432 -5.852 1.00 0.00 H new ATOM 0 HG23 VAL A 55 3.781 -14.839 -6.433 1.00 0.00 H new ATOM 856 N CYS A 56 3.620 -14.355 -1.188 1.00 0.00 N ATOM 857 CA CYS A 56 3.077 -14.221 0.157 1.00 0.00 C ATOM 858 C CYS A 56 2.807 -12.749 0.451 1.00 0.00 C ATOM 859 O CYS A 56 3.718 -11.923 0.408 1.00 0.00 O ATOM 860 CB CYS A 56 4.046 -14.831 1.173 1.00 0.00 C ATOM 861 SG CYS A 56 4.072 -16.628 0.939 1.00 0.00 S ATOM 0 H CYS A 56 4.621 -14.169 -1.243 1.00 0.00 H new ATOM 0 HA CYS A 56 2.133 -14.761 0.233 1.00 0.00 H new ATOM 0 HB2 CYS A 56 5.045 -14.417 1.038 1.00 0.00 H new ATOM 0 HB3 CYS A 56 3.734 -14.586 2.188 1.00 0.00 H new ATOM 0 HG CYS A 56 4.892 -17.165 1.793 1.00 0.00 H new ATOM 867 N LEU A 57 1.555 -12.404 0.752 1.00 0.00 N ATOM 868 CA LEU A 57 1.172 -11.062 1.181 1.00 0.00 C ATOM 869 C LEU A 57 1.213 -11.002 2.699 1.00 0.00 C ATOM 870 O LEU A 57 0.357 -11.569 3.375 1.00 0.00 O ATOM 871 CB LEU A 57 -0.206 -10.661 0.625 1.00 0.00 C ATOM 872 CG LEU A 57 -0.082 -10.013 -0.761 1.00 0.00 C ATOM 873 CD1 LEU A 57 -1.445 -9.776 -1.408 1.00 0.00 C ATOM 874 CD2 LEU A 57 0.588 -8.641 -0.721 1.00 0.00 C ATOM 0 H LEU A 57 0.772 -13.056 0.704 1.00 0.00 H new ATOM 0 HA LEU A 57 1.881 -10.338 0.779 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.845 -11.542 0.561 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.689 -9.966 1.312 1.00 0.00 H new ATOM 0 HG LEU A 57 0.519 -10.723 -1.329 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -1.308 -9.316 -2.387 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -1.963 -10.728 -1.524 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -2.038 -9.115 -0.776 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.646 -8.235 -1.731 1.00 0.00 H new ATOM 0 HD22 LEU A 57 0.003 -7.969 -0.093 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.593 -8.739 -0.311 1.00 0.00 H new ATOM 886 N HIS A 58 2.234 -10.343 3.234 1.00 0.00 N ATOM 887 CA HIS A 58 2.434 -10.114 4.654 1.00 0.00 C ATOM 888 C HIS A 58 1.532 -8.951 5.071 1.00 0.00 C ATOM 889 O HIS A 58 1.894 -7.789 4.890 1.00 0.00 O ATOM 890 CB HIS A 58 3.916 -9.814 4.884 1.00 0.00 C ATOM 891 CG HIS A 58 4.874 -10.975 4.706 1.00 0.00 C ATOM 892 ND1 HIS A 58 5.794 -11.401 5.650 1.00 0.00 N ATOM 893 CD2 HIS A 58 5.115 -11.663 3.545 1.00 0.00 C ATOM 894 CE1 HIS A 58 6.589 -12.308 5.057 1.00 0.00 C ATOM 895 NE2 HIS A 58 6.173 -12.518 3.795 1.00 0.00 N ATOM 0 H HIS A 58 2.975 -9.937 2.663 1.00 0.00 H new ATOM 0 HA HIS A 58 2.171 -10.983 5.258 1.00 0.00 H new ATOM 0 HB2 HIS A 58 4.213 -9.018 4.201 1.00 0.00 H new ATOM 0 HB3 HIS A 58 4.033 -9.426 5.896 1.00 0.00 H new ATOM 0 HD1 HIS A 58 5.857 -11.084 6.618 1.00 0.00 H new ATOM 0 HD2 HIS A 58 4.580 -11.557 2.613 1.00 0.00 H new ATOM 0 HE1 HIS A 58 7.433 -12.794 5.523 1.00 0.00 H new ATOM 0 HE2 HIS A 58 6.569 -13.190 3.138 1.00 0.00 H new ATOM 904 N LEU A 59 0.326 -9.264 5.539 1.00 0.00 N ATOM 905 CA LEU A 59 -0.747 -8.339 5.882 1.00 0.00 C ATOM 906 C LEU A 59 -0.631 -7.891 7.334 1.00 0.00 C ATOM 907 O LEU A 59 -0.337 -8.708 8.203 1.00 0.00 O ATOM 908 CB LEU A 59 -2.079 -9.063 5.631 1.00 0.00 C ATOM 909 CG LEU A 59 -3.311 -8.133 5.636 1.00 0.00 C ATOM 910 CD1 LEU A 59 -4.027 -8.130 4.284 1.00 0.00 C ATOM 911 CD2 LEU A 59 -4.320 -8.597 6.681 1.00 0.00 C ATOM 0 H LEU A 59 0.057 -10.235 5.698 1.00 0.00 H new ATOM 0 HA LEU A 59 -0.687 -7.440 5.268 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -2.027 -9.575 4.670 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -2.213 -9.830 6.394 1.00 0.00 H new ATOM 0 HG LEU A 59 -2.944 -7.131 5.859 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -4.888 -7.463 4.330 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -3.342 -7.785 3.510 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.362 -9.140 4.048 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -5.184 -7.932 6.673 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -4.642 -9.612 6.450 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -3.857 -8.579 7.667 1.00 0.00 H new ATOM 923 N ARG A 60 -0.880 -6.608 7.614 1.00 0.00 N ATOM 924 CA ARG A 60 -0.709 -6.075 8.963 1.00 0.00 C ATOM 925 C ARG A 60 -1.589 -6.793 9.969 1.00 0.00 C ATOM 926 O ARG A 60 -2.767 -7.063 9.720 1.00 0.00 O ATOM 927 CB ARG A 60 -0.992 -4.566 9.028 1.00 0.00 C ATOM 928 CG ARG A 60 0.221 -3.729 8.606 1.00 0.00 C ATOM 929 CD ARG A 60 1.194 -3.608 9.783 1.00 0.00 C ATOM 930 NE ARG A 60 2.487 -3.054 9.363 1.00 0.00 N ATOM 931 CZ ARG A 60 3.132 -2.016 9.899 1.00 0.00 C ATOM 932 NH1 ARG A 60 2.531 -1.207 10.770 1.00 0.00 N ATOM 933 NH2 ARG A 60 4.393 -1.788 9.547 1.00 0.00 N ATOM 0 H ARG A 60 -1.199 -5.925 6.927 1.00 0.00 H new ATOM 0 HA ARG A 60 0.336 -6.246 9.222 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -1.837 -4.329 8.382 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -1.282 -4.296 10.044 1.00 0.00 H new ATOM 0 HG2 ARG A 60 0.719 -4.194 7.755 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -0.102 -2.739 8.284 1.00 0.00 H new ATOM 0 HD2 ARG A 60 0.758 -2.971 10.552 1.00 0.00 H new ATOM 0 HD3 ARG A 60 1.347 -4.590 10.231 1.00 0.00 H new ATOM 0 HE ARG A 60 2.943 -3.513 8.574 1.00 0.00 H new ATOM 0 HH11 ARG A 60 1.561 -1.376 11.038 1.00 0.00 H new ATOM 0 HH12 ARG A 60 3.040 -0.419 11.169 1.00 0.00 H new ATOM 0 HH21 ARG A 60 4.854 -2.402 8.876 1.00 0.00 H new ATOM 0 HH22 ARG A 60 4.900 -0.999 9.948 1.00 0.00 H new ATOM 947 N SER A 61 -1.035 -6.948 11.162 1.00 0.00 N ATOM 948 CA SER A 61 -1.669 -7.480 12.352 1.00 0.00 C ATOM 949 C SER A 61 -2.991 -6.774 12.639 1.00 0.00 C ATOM 950 O SER A 61 -3.994 -7.420 12.956 1.00 0.00 O ATOM 951 CB SER A 61 -0.656 -7.314 13.493 1.00 0.00 C ATOM 952 OG SER A 61 -0.168 -5.977 13.479 1.00 0.00 O ATOM 0 H SER A 61 -0.064 -6.686 11.332 1.00 0.00 H new ATOM 0 HA SER A 61 -1.928 -8.531 12.228 1.00 0.00 H new ATOM 0 HB2 SER A 61 -1.127 -7.534 14.451 1.00 0.00 H new ATOM 0 HB3 SER A 61 0.167 -8.018 13.373 1.00 0.00 H new ATOM 0 HG SER A 61 0.333 -5.803 14.303 1.00 0.00 H new ATOM 958 N SER A 62 -3.014 -5.451 12.467 1.00 0.00 N ATOM 959 CA SER A 62 -4.155 -4.610 12.797 1.00 0.00 C ATOM 960 C SER A 62 -5.269 -4.756 11.768 1.00 0.00 C ATOM 961 O SER A 62 -6.389 -4.320 12.019 1.00 0.00 O ATOM 962 CB SER A 62 -3.702 -3.146 12.841 1.00 0.00 C ATOM 963 OG SER A 62 -2.638 -2.978 13.756 1.00 0.00 O ATOM 0 H SER A 62 -2.224 -4.929 12.087 1.00 0.00 H new ATOM 0 HA SER A 62 -4.542 -4.922 13.767 1.00 0.00 H new ATOM 0 HB2 SER A 62 -3.387 -2.828 11.847 1.00 0.00 H new ATOM 0 HB3 SER A 62 -4.539 -2.510 13.129 1.00 0.00 H new ATOM 0 HG SER A 62 -2.362 -2.038 13.768 1.00 0.00 H new ATOM 969 N GLN A 63 -4.997 -5.411 10.638 1.00 0.00 N ATOM 970 CA GLN A 63 -5.894 -5.522 9.506 1.00 0.00 C ATOM 971 C GLN A 63 -6.216 -6.979 9.177 1.00 0.00 C ATOM 972 O GLN A 63 -6.882 -7.215 8.171 1.00 0.00 O ATOM 973 CB GLN A 63 -5.252 -4.808 8.297 1.00 0.00 C ATOM 974 CG GLN A 63 -4.613 -3.445 8.618 1.00 0.00 C ATOM 975 CD GLN A 63 -5.543 -2.414 9.246 1.00 0.00 C ATOM 976 OE1 GLN A 63 -6.747 -2.367 8.999 1.00 0.00 O ATOM 977 NE2 GLN A 63 -4.998 -1.569 10.100 1.00 0.00 N ATOM 0 H GLN A 63 -4.111 -5.894 10.489 1.00 0.00 H new ATOM 0 HA GLN A 63 -6.842 -5.045 9.755 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -4.489 -5.460 7.871 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -6.014 -4.665 7.531 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -3.772 -3.608 9.292 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -4.207 -3.028 7.696 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -3.998 -1.617 10.297 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -5.576 -0.868 10.563 1.00 0.00 H new ATOM 986 N ARG A 64 -5.826 -7.964 10.003 1.00 0.00 N ATOM 987 CA ARG A 64 -6.010 -9.373 9.625 1.00 0.00 C ATOM 988 C ARG A 64 -7.463 -9.735 9.340 1.00 0.00 C ATOM 989 O ARG A 64 -7.694 -10.510 8.422 1.00 0.00 O ATOM 990 CB ARG A 64 -5.402 -10.332 10.659 1.00 0.00 C ATOM 991 CG ARG A 64 -5.206 -11.727 10.040 1.00 0.00 C ATOM 992 CD ARG A 64 -4.711 -12.757 11.053 1.00 0.00 C ATOM 993 NE ARG A 64 -4.643 -14.086 10.440 1.00 0.00 N ATOM 994 CZ ARG A 64 -4.890 -15.236 11.068 1.00 0.00 C ATOM 995 NH1 ARG A 64 -4.815 -15.310 12.389 1.00 0.00 N ATOM 996 NH2 ARG A 64 -5.211 -16.308 10.361 1.00 0.00 N ATOM 0 H ARG A 64 -5.392 -7.816 10.914 1.00 0.00 H new ATOM 0 HA ARG A 64 -5.466 -9.494 8.689 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -4.445 -9.943 11.008 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -6.054 -10.401 11.529 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -6.150 -12.067 9.614 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -4.492 -11.659 9.219 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -3.727 -12.469 11.422 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -5.380 -12.780 11.913 1.00 0.00 H new ATOM 0 HE ARG A 64 -4.386 -14.135 9.454 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -4.567 -14.484 12.933 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -5.005 -16.193 12.862 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -5.268 -16.250 9.344 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -5.402 -17.192 10.833 1.00 0.00 H new ATOM 1010 N HIS A 65 -8.446 -9.121 10.003 1.00 0.00 N ATOM 1011 CA HIS A 65 -9.846 -9.398 9.682 1.00 0.00 C ATOM 1012 C HIS A 65 -10.241 -8.993 8.246 1.00 0.00 C ATOM 1013 O HIS A 65 -11.337 -9.340 7.804 1.00 0.00 O ATOM 1014 CB HIS A 65 -10.749 -8.812 10.770 1.00 0.00 C ATOM 1015 CG HIS A 65 -12.201 -9.165 10.596 1.00 0.00 C ATOM 1016 ND1 HIS A 65 -13.217 -8.257 10.399 1.00 0.00 N ATOM 1017 CD2 HIS A 65 -12.733 -10.424 10.565 1.00 0.00 C ATOM 1018 CE1 HIS A 65 -14.356 -8.959 10.257 1.00 0.00 C ATOM 1019 NE2 HIS A 65 -14.090 -10.274 10.364 1.00 0.00 N ATOM 0 H HIS A 65 -8.303 -8.442 10.751 1.00 0.00 H new ATOM 0 HA HIS A 65 -9.990 -10.478 9.682 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -10.410 -9.168 11.743 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -10.644 -7.727 10.773 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -12.196 -11.354 10.676 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -15.333 -8.533 10.084 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -14.773 -11.029 10.306 1.00 0.00 H new ATOM 1028 N LEU A 66 -9.428 -8.226 7.508 1.00 0.00 N ATOM 1029 CA LEU A 66 -9.694 -7.941 6.097 1.00 0.00 C ATOM 1030 C LEU A 66 -9.197 -9.127 5.267 1.00 0.00 C ATOM 1031 O LEU A 66 -9.835 -9.462 4.266 1.00 0.00 O ATOM 1032 CB LEU A 66 -9.022 -6.646 5.591 1.00 0.00 C ATOM 1033 CG LEU A 66 -9.660 -5.304 6.002 1.00 0.00 C ATOM 1034 CD1 LEU A 66 -11.179 -5.292 5.814 1.00 0.00 C ATOM 1035 CD2 LEU A 66 -9.324 -4.914 7.445 1.00 0.00 C ATOM 0 H LEU A 66 -8.579 -7.792 7.869 1.00 0.00 H new ATOM 0 HA LEU A 66 -10.768 -7.792 5.990 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -7.988 -6.647 5.937 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -8.994 -6.685 4.502 1.00 0.00 H new ATOM 0 HG LEU A 66 -9.223 -4.565 5.330 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -11.576 -4.324 6.119 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -11.417 -5.468 4.765 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -11.627 -6.076 6.424 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -9.797 -3.962 7.684 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -9.692 -5.683 8.125 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -8.244 -4.820 7.554 1.00 0.00 H new ATOM 1047 N ASN A 67 -8.072 -9.755 5.657 1.00 0.00 N ATOM 1048 CA ASN A 67 -7.580 -10.976 5.021 1.00 0.00 C ATOM 1049 C ASN A 67 -8.624 -12.045 5.263 1.00 0.00 C ATOM 1050 O ASN A 67 -8.756 -12.586 6.363 1.00 0.00 O ATOM 1051 CB ASN A 67 -6.226 -11.486 5.540 1.00 0.00 C ATOM 1052 CG ASN A 67 -5.960 -12.910 5.034 1.00 0.00 C ATOM 1053 OD1 ASN A 67 -6.410 -13.301 3.959 1.00 0.00 O ATOM 1054 ND2 ASN A 67 -5.243 -13.728 5.779 1.00 0.00 N ATOM 0 H ASN A 67 -7.484 -9.425 6.422 1.00 0.00 H new ATOM 0 HA ASN A 67 -7.416 -10.747 3.968 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -5.429 -10.821 5.209 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -6.219 -11.474 6.630 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -5.064 -14.681 5.463 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -4.868 -13.408 6.672 1.00 0.00 H new ATOM 1061 N ASN A 68 -9.401 -12.306 4.233 1.00 0.00 N ATOM 1062 CA ASN A 68 -10.398 -13.351 4.216 1.00 0.00 C ATOM 1063 C ASN A 68 -10.243 -14.159 2.940 1.00 0.00 C ATOM 1064 O ASN A 68 -9.751 -13.633 1.934 1.00 0.00 O ATOM 1065 CB ASN A 68 -11.774 -12.721 4.399 1.00 0.00 C ATOM 1066 CG ASN A 68 -12.368 -12.143 3.129 1.00 0.00 C ATOM 1067 OD1 ASN A 68 -13.230 -12.757 2.512 1.00 0.00 O ATOM 1068 ND2 ASN A 68 -11.942 -10.965 2.713 1.00 0.00 N ATOM 0 H ASN A 68 -9.354 -11.781 3.360 1.00 0.00 H new ATOM 0 HA ASN A 68 -10.270 -14.054 5.039 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -12.456 -13.473 4.796 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -11.703 -11.930 5.146 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -12.331 -10.552 1.865 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -11.224 -10.468 3.239 1.00 0.00 H new ATOM 1075 N ARG A 69 -10.679 -15.421 2.953 1.00 0.00 N ATOM 1076 CA ARG A 69 -10.463 -16.298 1.806 1.00 0.00 C ATOM 1077 C ARG A 69 -11.254 -15.806 0.594 1.00 0.00 C ATOM 1078 O ARG A 69 -10.798 -15.975 -0.534 1.00 0.00 O ATOM 1079 CB ARG A 69 -10.777 -17.764 2.157 1.00 0.00 C ATOM 1080 CG ARG A 69 -9.816 -18.685 1.386 1.00 0.00 C ATOM 1081 CD ARG A 69 -10.172 -20.174 1.477 1.00 0.00 C ATOM 1082 NE ARG A 69 -9.807 -20.788 2.764 1.00 0.00 N ATOM 1083 CZ ARG A 69 -8.771 -21.606 2.993 1.00 0.00 C ATOM 1084 NH1 ARG A 69 -7.796 -21.724 2.100 1.00 0.00 N ATOM 1085 NH2 ARG A 69 -8.707 -22.323 4.108 1.00 0.00 N ATOM 0 H ARG A 69 -11.176 -15.851 3.733 1.00 0.00 H new ATOM 0 HA ARG A 69 -9.407 -16.262 1.538 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -10.671 -17.924 3.230 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -11.810 -17.999 1.900 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -9.807 -18.388 0.337 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -8.805 -18.540 1.767 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -11.244 -20.293 1.318 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -9.668 -20.710 0.672 1.00 0.00 H new ATOM 0 HE ARG A 69 -10.403 -20.569 3.562 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -7.832 -21.190 1.232 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -7.011 -22.349 2.282 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -9.452 -22.255 4.802 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -7.913 -22.942 4.271 1.00 0.00 H new ATOM 1099 N GLY A 70 -12.391 -15.145 0.826 1.00 0.00 N ATOM 1100 CA GLY A 70 -13.190 -14.505 -0.208 1.00 0.00 C ATOM 1101 C GLY A 70 -12.340 -13.531 -1.015 1.00 0.00 C ATOM 1102 O GLY A 70 -12.258 -13.666 -2.240 1.00 0.00 O ATOM 0 H GLY A 70 -12.786 -15.041 1.761 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -13.613 -15.261 -0.869 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -14.027 -13.975 0.247 1.00 0.00 H new ATOM 1106 N ALA A 71 -11.680 -12.586 -0.334 1.00 0.00 N ATOM 1107 CA ALA A 71 -10.808 -11.622 -0.989 1.00 0.00 C ATOM 1108 C ALA A 71 -9.599 -12.323 -1.599 1.00 0.00 C ATOM 1109 O ALA A 71 -9.226 -11.999 -2.725 1.00 0.00 O ATOM 1110 CB ALA A 71 -10.351 -10.539 -0.006 1.00 0.00 C ATOM 0 H ALA A 71 -11.739 -12.474 0.678 1.00 0.00 H new ATOM 0 HA ALA A 71 -11.376 -11.143 -1.787 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -9.701 -9.832 -0.521 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -11.221 -10.013 0.386 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -9.805 -11.001 0.817 1.00 0.00 H new ATOM 1116 N GLN A 72 -8.992 -13.272 -0.878 1.00 0.00 N ATOM 1117 CA GLN A 72 -7.811 -13.987 -1.342 1.00 0.00 C ATOM 1118 C GLN A 72 -8.076 -14.663 -2.689 1.00 0.00 C ATOM 1119 O GLN A 72 -7.170 -14.699 -3.514 1.00 0.00 O ATOM 1120 CB GLN A 72 -7.358 -15.013 -0.291 1.00 0.00 C ATOM 1121 CG GLN A 72 -5.986 -15.631 -0.621 1.00 0.00 C ATOM 1122 CD GLN A 72 -5.594 -16.770 0.320 1.00 0.00 C ATOM 1123 OE1 GLN A 72 -6.297 -17.089 1.280 1.00 0.00 O ATOM 1124 NE2 GLN A 72 -4.485 -17.443 0.068 1.00 0.00 N ATOM 0 H GLN A 72 -9.312 -13.562 0.046 1.00 0.00 H new ATOM 0 HA GLN A 72 -7.007 -13.265 -1.484 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -7.310 -14.531 0.685 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -8.102 -15.806 -0.218 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -6.000 -16.004 -1.645 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -5.224 -14.853 -0.575 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -3.900 -17.183 -0.726 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -4.214 -18.223 0.667 1.00 0.00 H new ATOM 1133 N GLN A 73 -9.283 -15.180 -2.938 1.00 0.00 N ATOM 1134 CA GLN A 73 -9.623 -15.822 -4.202 1.00 0.00 C ATOM 1135 C GLN A 73 -9.461 -14.824 -5.351 1.00 0.00 C ATOM 1136 O GLN A 73 -8.739 -15.088 -6.314 1.00 0.00 O ATOM 1137 CB GLN A 73 -11.059 -16.386 -4.139 1.00 0.00 C ATOM 1138 CG GLN A 73 -11.183 -17.775 -4.780 1.00 0.00 C ATOM 1139 CD GLN A 73 -10.728 -18.911 -3.860 1.00 0.00 C ATOM 1140 OE1 GLN A 73 -10.094 -18.711 -2.823 1.00 0.00 O ATOM 1141 NE2 GLN A 73 -11.084 -20.138 -4.184 1.00 0.00 N ATOM 0 H GLN A 73 -10.049 -15.163 -2.265 1.00 0.00 H new ATOM 0 HA GLN A 73 -8.945 -16.656 -4.382 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -11.377 -16.442 -3.098 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -11.737 -15.697 -4.643 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -12.221 -17.943 -5.067 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -10.591 -17.799 -5.695 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -11.609 -20.307 -5.042 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -10.834 -20.919 -3.577 1.00 0.00 H new ATOM 1150 N LYS A 74 -10.087 -13.651 -5.220 1.00 0.00 N ATOM 1151 CA LYS A 74 -10.047 -12.627 -6.258 1.00 0.00 C ATOM 1152 C LYS A 74 -8.626 -12.112 -6.420 1.00 0.00 C ATOM 1153 O LYS A 74 -8.163 -11.963 -7.549 1.00 0.00 O ATOM 1154 CB LYS A 74 -11.026 -11.492 -5.907 1.00 0.00 C ATOM 1155 CG LYS A 74 -11.237 -10.450 -7.025 1.00 0.00 C ATOM 1156 CD LYS A 74 -12.391 -10.793 -7.981 1.00 0.00 C ATOM 1157 CE LYS A 74 -12.111 -11.930 -8.965 1.00 0.00 C ATOM 1158 NZ LYS A 74 -11.244 -11.525 -10.087 1.00 0.00 N ATOM 0 H LYS A 74 -10.630 -13.389 -4.397 1.00 0.00 H new ATOM 0 HA LYS A 74 -10.358 -13.055 -7.211 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -11.991 -11.930 -5.651 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -10.662 -10.980 -5.016 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -11.430 -9.478 -6.571 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -10.316 -10.356 -7.600 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -13.266 -11.056 -7.387 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -12.648 -9.899 -8.549 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -11.642 -12.757 -8.431 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -13.057 -12.301 -9.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -11.022 -12.356 -10.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -11.735 -10.815 -10.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -10.362 -11.118 -9.715 1.00 0.00 H new ATOM 1172 N LEU A 75 -7.935 -11.858 -5.305 1.00 0.00 N ATOM 1173 CA LEU A 75 -6.548 -11.415 -5.310 1.00 0.00 C ATOM 1174 C LEU A 75 -5.685 -12.446 -6.043 1.00 0.00 C ATOM 1175 O LEU A 75 -4.777 -12.061 -6.773 1.00 0.00 O ATOM 1176 CB LEU A 75 -6.032 -11.194 -3.869 1.00 0.00 C ATOM 1177 CG LEU A 75 -5.249 -9.889 -3.634 1.00 0.00 C ATOM 1178 CD1 LEU A 75 -4.937 -9.769 -2.138 1.00 0.00 C ATOM 1179 CD2 LEU A 75 -3.963 -9.722 -4.447 1.00 0.00 C ATOM 0 H LEU A 75 -8.330 -11.956 -4.370 1.00 0.00 H new ATOM 0 HA LEU A 75 -6.485 -10.460 -5.832 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -6.885 -11.212 -3.190 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -5.392 -12.034 -3.599 1.00 0.00 H new ATOM 0 HG LEU A 75 -5.898 -9.088 -3.988 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -4.382 -8.849 -1.955 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -5.869 -9.750 -1.572 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -4.338 -10.623 -1.822 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -3.497 -8.768 -4.199 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.275 -10.534 -4.211 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -4.199 -9.745 -5.511 1.00 0.00 H new ATOM 1191 N ALA A 76 -5.949 -13.745 -5.861 1.00 0.00 N ATOM 1192 CA ALA A 76 -5.112 -14.803 -6.406 1.00 0.00 C ATOM 1193 C ALA A 76 -5.284 -14.905 -7.900 1.00 0.00 C ATOM 1194 O ALA A 76 -4.288 -15.006 -8.607 1.00 0.00 O ATOM 1195 CB ALA A 76 -5.421 -16.140 -5.744 1.00 0.00 C ATOM 0 H ALA A 76 -6.751 -14.085 -5.330 1.00 0.00 H new ATOM 0 HA ALA A 76 -4.073 -14.549 -6.194 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -4.782 -16.913 -6.170 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -5.237 -16.066 -4.672 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -6.466 -16.398 -5.916 1.00 0.00 H new ATOM 1201 N GLU A 77 -6.522 -14.857 -8.386 1.00 0.00 N ATOM 1202 CA GLU A 77 -6.794 -14.826 -9.811 1.00 0.00 C ATOM 1203 C GLU A 77 -6.135 -13.589 -10.429 1.00 0.00 C ATOM 1204 O GLU A 77 -5.530 -13.675 -11.493 1.00 0.00 O ATOM 1205 CB GLU A 77 -8.312 -14.796 -10.007 1.00 0.00 C ATOM 1206 CG GLU A 77 -8.694 -15.057 -11.466 1.00 0.00 C ATOM 1207 CD GLU A 77 -10.160 -14.709 -11.672 1.00 0.00 C ATOM 1208 OE1 GLU A 77 -10.462 -13.503 -11.842 1.00 0.00 O ATOM 1209 OE2 GLU A 77 -11.022 -15.607 -11.591 1.00 0.00 O ATOM 0 H GLU A 77 -7.358 -14.839 -7.802 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.385 -15.708 -10.304 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -8.777 -15.546 -9.368 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -8.701 -13.827 -9.696 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -8.070 -14.459 -12.130 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -8.518 -16.103 -11.719 1.00 0.00 H new ATOM 1216 N ALA A 78 -6.207 -12.444 -9.745 1.00 0.00 N ATOM 1217 CA ALA A 78 -5.625 -11.196 -10.205 1.00 0.00 C ATOM 1218 C ALA A 78 -4.106 -11.348 -10.336 1.00 0.00 C ATOM 1219 O ALA A 78 -3.545 -11.035 -11.385 1.00 0.00 O ATOM 1220 CB ALA A 78 -6.023 -10.058 -9.257 1.00 0.00 C ATOM 0 H ALA A 78 -6.679 -12.365 -8.844 1.00 0.00 H new ATOM 0 HA ALA A 78 -6.010 -10.944 -11.193 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -5.584 -9.123 -9.606 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -7.109 -9.964 -9.237 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -5.659 -10.277 -8.253 1.00 0.00 H new ATOM 1226 N LEU A 79 -3.435 -11.848 -9.294 1.00 0.00 N ATOM 1227 CA LEU A 79 -1.993 -12.068 -9.298 1.00 0.00 C ATOM 1228 C LEU A 79 -1.593 -13.121 -10.322 1.00 0.00 C ATOM 1229 O LEU A 79 -0.554 -12.983 -10.962 1.00 0.00 O ATOM 1230 CB LEU A 79 -1.494 -12.479 -7.900 1.00 0.00 C ATOM 1231 CG LEU A 79 -0.578 -11.398 -7.314 1.00 0.00 C ATOM 1232 CD1 LEU A 79 -0.380 -11.638 -5.822 1.00 0.00 C ATOM 1233 CD2 LEU A 79 0.788 -11.358 -8.016 1.00 0.00 C ATOM 0 H LEU A 79 -3.885 -12.113 -8.418 1.00 0.00 H new ATOM 0 HA LEU A 79 -1.524 -11.124 -9.576 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -2.344 -12.641 -7.238 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.955 -13.424 -7.964 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.063 -10.435 -7.475 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.272 -10.866 -5.413 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.345 -11.603 -5.317 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.075 -12.616 -5.668 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.404 -10.578 -7.569 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.284 -12.322 -7.902 1.00 0.00 H new ATOM 0 HD23 LEU A 79 0.646 -11.146 -9.076 1.00 0.00 H new ATOM 1245 N SER A 80 -2.414 -14.153 -10.488 1.00 0.00 N ATOM 1246 CA SER A 80 -2.173 -15.195 -11.473 1.00 0.00 C ATOM 1247 C SER A 80 -2.228 -14.592 -12.875 1.00 0.00 C ATOM 1248 O SER A 80 -1.347 -14.849 -13.688 1.00 0.00 O ATOM 1249 CB SER A 80 -3.196 -16.316 -11.301 1.00 0.00 C ATOM 1250 OG SER A 80 -3.082 -16.895 -10.010 1.00 0.00 O ATOM 0 H SER A 80 -3.265 -14.288 -9.942 1.00 0.00 H new ATOM 0 HA SER A 80 -1.182 -15.624 -11.327 1.00 0.00 H new ATOM 0 HB2 SER A 80 -4.203 -15.923 -11.443 1.00 0.00 H new ATOM 0 HB3 SER A 80 -3.041 -17.079 -12.064 1.00 0.00 H new ATOM 0 HG SER A 80 -3.754 -16.502 -9.415 1.00 0.00 H new ATOM 1256 N MET A 81 -3.206 -13.725 -13.142 1.00 0.00 N ATOM 1257 CA MET A 81 -3.351 -13.074 -14.436 1.00 0.00 C ATOM 1258 C MET A 81 -2.208 -12.083 -14.669 1.00 0.00 C ATOM 1259 O MET A 81 -1.704 -11.953 -15.784 1.00 0.00 O ATOM 1260 CB MET A 81 -4.714 -12.370 -14.489 1.00 0.00 C ATOM 1261 CG MET A 81 -5.115 -12.050 -15.929 1.00 0.00 C ATOM 1262 SD MET A 81 -5.346 -13.496 -16.995 1.00 0.00 S ATOM 1263 CE MET A 81 -6.798 -14.250 -16.214 1.00 0.00 C ATOM 0 H MET A 81 -3.919 -13.457 -12.463 1.00 0.00 H new ATOM 0 HA MET A 81 -3.304 -13.819 -15.230 1.00 0.00 H new ATOM 0 HB2 MET A 81 -5.472 -13.005 -14.030 1.00 0.00 H new ATOM 0 HB3 MET A 81 -4.674 -11.449 -13.907 1.00 0.00 H new ATOM 0 HG2 MET A 81 -6.042 -11.476 -15.914 1.00 0.00 H new ATOM 0 HG3 MET A 81 -4.351 -11.410 -16.370 1.00 0.00 H new ATOM 0 HE1 MET A 81 -7.200 -15.026 -16.866 1.00 0.00 H new ATOM 0 HE2 MET A 81 -6.510 -14.691 -15.260 1.00 0.00 H new ATOM 0 HE3 MET A 81 -7.558 -13.487 -16.047 1.00 0.00 H new ATOM 1273 N LEU A 82 -1.774 -11.405 -13.604 1.00 0.00 N ATOM 1274 CA LEU A 82 -0.685 -10.435 -13.620 1.00 0.00 C ATOM 1275 C LEU A 82 0.653 -11.105 -13.948 1.00 0.00 C ATOM 1276 O LEU A 82 1.471 -10.539 -14.677 1.00 0.00 O ATOM 1277 CB LEU A 82 -0.647 -9.746 -12.246 1.00 0.00 C ATOM 1278 CG LEU A 82 0.575 -8.846 -12.016 1.00 0.00 C ATOM 1279 CD1 LEU A 82 0.559 -7.679 -13.000 1.00 0.00 C ATOM 1280 CD2 LEU A 82 0.600 -8.321 -10.575 1.00 0.00 C ATOM 0 H LEU A 82 -2.187 -11.522 -12.679 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.856 -9.695 -14.401 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.550 -9.147 -12.130 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -0.670 -10.511 -11.470 1.00 0.00 H new ATOM 0 HG LEU A 82 1.475 -9.439 -12.181 1.00 0.00 H new ATOM 0 HD11 LEU A 82 1.430 -7.047 -12.829 1.00 0.00 H new ATOM 0 HD12 LEU A 82 0.584 -8.063 -14.020 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -0.349 -7.093 -12.855 1.00 0.00 H new ATOM 0 HD21 LEU A 82 1.474 -7.686 -10.434 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -0.304 -7.743 -10.383 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.647 -9.161 -9.882 1.00 0.00 H new ATOM 1292 N LYS A 83 0.901 -12.282 -13.374 1.00 0.00 N ATOM 1293 CA LYS A 83 2.066 -13.114 -13.662 1.00 0.00 C ATOM 1294 C LYS A 83 1.898 -13.819 -15.014 1.00 0.00 C ATOM 1295 O LYS A 83 2.883 -14.111 -15.690 1.00 0.00 O ATOM 1296 CB LYS A 83 2.174 -14.141 -12.522 1.00 0.00 C ATOM 1297 CG LYS A 83 3.497 -14.916 -12.437 1.00 0.00 C ATOM 1298 CD LYS A 83 4.642 -14.088 -11.832 1.00 0.00 C ATOM 1299 CE LYS A 83 5.731 -15.025 -11.295 1.00 0.00 C ATOM 1300 NZ LYS A 83 6.895 -14.310 -10.732 1.00 0.00 N ATOM 0 H LYS A 83 0.280 -12.693 -12.677 1.00 0.00 H new ATOM 0 HA LYS A 83 2.972 -12.511 -13.724 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.019 -13.622 -11.576 1.00 0.00 H new ATOM 0 HB3 LYS A 83 1.361 -14.859 -12.629 1.00 0.00 H new ATOM 0 HG2 LYS A 83 3.348 -15.813 -11.836 1.00 0.00 H new ATOM 0 HG3 LYS A 83 3.783 -15.246 -13.436 1.00 0.00 H new ATOM 0 HD2 LYS A 83 5.061 -13.423 -12.587 1.00 0.00 H new ATOM 0 HD3 LYS A 83 4.262 -13.458 -11.028 1.00 0.00 H new ATOM 0 HE2 LYS A 83 5.301 -15.666 -10.526 1.00 0.00 H new ATOM 0 HE3 LYS A 83 6.069 -15.677 -12.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 7.512 -14.986 -10.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 7.427 -13.854 -11.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 6.567 -13.586 -10.061 1.00 0.00 H new ATOM 1314 N GLY A 84 0.655 -14.084 -15.413 1.00 0.00 N ATOM 1315 CA GLY A 84 0.278 -14.855 -16.584 1.00 0.00 C ATOM 1316 C GLY A 84 0.403 -16.360 -16.325 1.00 0.00 C ATOM 1317 O GLY A 84 0.206 -17.152 -17.249 1.00 0.00 O ATOM 0 H GLY A 84 -0.156 -13.745 -14.896 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -0.748 -14.616 -16.864 1.00 0.00 H new ATOM 0 HA3 GLY A 84 0.912 -14.575 -17.426 1.00 0.00 H new ATOM 1321 N SER A 85 0.700 -16.767 -15.089 1.00 0.00 N ATOM 1322 CA SER A 85 0.983 -18.135 -14.685 1.00 0.00 C ATOM 1323 C SER A 85 0.359 -18.431 -13.323 1.00 0.00 C ATOM 1324 O SER A 85 -0.196 -17.549 -12.666 1.00 0.00 O ATOM 1325 CB SER A 85 2.504 -18.312 -14.617 1.00 0.00 C ATOM 1326 OG SER A 85 3.117 -18.062 -15.868 1.00 0.00 O ATOM 0 H SER A 85 0.751 -16.114 -14.307 1.00 0.00 H new ATOM 0 HA SER A 85 0.555 -18.829 -15.409 1.00 0.00 H new ATOM 0 HB2 SER A 85 2.916 -17.635 -13.868 1.00 0.00 H new ATOM 0 HB3 SER A 85 2.738 -19.326 -14.293 1.00 0.00 H new ATOM 0 HG SER A 85 4.086 -18.182 -15.787 1.00 0.00 H new ATOM 1332 N THR A 86 0.462 -19.681 -12.878 1.00 0.00 N ATOM 1333 CA THR A 86 0.038 -20.100 -11.556 1.00 0.00 C ATOM 1334 C THR A 86 0.869 -19.347 -10.510 1.00 0.00 C ATOM 1335 O THR A 86 2.103 -19.386 -10.558 1.00 0.00 O ATOM 1336 CB THR A 86 0.218 -21.622 -11.453 1.00 0.00 C ATOM 1337 OG1 THR A 86 -0.438 -22.236 -12.547 1.00 0.00 O ATOM 1338 CG2 THR A 86 -0.354 -22.191 -10.156 1.00 0.00 C ATOM 0 H THR A 86 0.850 -20.439 -13.440 1.00 0.00 H new ATOM 0 HA THR A 86 -1.012 -19.867 -11.377 1.00 0.00 H new ATOM 0 HB THR A 86 1.288 -21.829 -11.463 1.00 0.00 H new ATOM 0 HG1 THR A 86 -0.327 -23.208 -12.491 1.00 0.00 H new ATOM 0 HG21 THR A 86 -0.201 -23.270 -10.133 1.00 0.00 H new ATOM 0 HG22 THR A 86 0.151 -21.735 -9.305 1.00 0.00 H new ATOM 0 HG23 THR A 86 -1.421 -21.975 -10.103 1.00 0.00 H new ATOM 1346 N VAL A 87 0.210 -18.695 -9.553 1.00 0.00 N ATOM 1347 CA VAL A 87 0.838 -18.033 -8.418 1.00 0.00 C ATOM 1348 C VAL A 87 0.189 -18.607 -7.171 1.00 0.00 C ATOM 1349 O VAL A 87 -1.041 -18.626 -7.071 1.00 0.00 O ATOM 1350 CB VAL A 87 0.633 -16.509 -8.501 1.00 0.00 C ATOM 1351 CG1 VAL A 87 1.143 -15.803 -7.238 1.00 0.00 C ATOM 1352 CG2 VAL A 87 1.360 -15.910 -9.708 1.00 0.00 C ATOM 0 H VAL A 87 -0.807 -18.612 -9.549 1.00 0.00 H new ATOM 0 HA VAL A 87 1.915 -18.203 -8.405 1.00 0.00 H new ATOM 0 HB VAL A 87 -0.441 -16.351 -8.602 1.00 0.00 H new ATOM 0 HG11 VAL A 87 0.982 -14.729 -7.332 1.00 0.00 H new ATOM 0 HG12 VAL A 87 0.602 -16.177 -6.369 1.00 0.00 H new ATOM 0 HG13 VAL A 87 2.208 -16.001 -7.115 1.00 0.00 H new ATOM 0 HG21 VAL A 87 1.194 -14.833 -9.735 1.00 0.00 H new ATOM 0 HG22 VAL A 87 2.428 -16.110 -9.625 1.00 0.00 H new ATOM 0 HG23 VAL A 87 0.976 -16.360 -10.624 1.00 0.00 H new ATOM 1362 N GLU A 88 0.986 -19.082 -6.218 1.00 0.00 N ATOM 1363 CA GLU A 88 0.446 -19.522 -4.944 1.00 0.00 C ATOM 1364 C GLU A 88 0.382 -18.254 -4.104 1.00 0.00 C ATOM 1365 O GLU A 88 1.310 -17.926 -3.361 1.00 0.00 O ATOM 1366 CB GLU A 88 1.328 -20.618 -4.330 1.00 0.00 C ATOM 1367 CG GLU A 88 1.201 -21.921 -5.129 1.00 0.00 C ATOM 1368 CD GLU A 88 1.966 -23.071 -4.480 1.00 0.00 C ATOM 1369 OE1 GLU A 88 3.133 -22.910 -4.073 1.00 0.00 O ATOM 1370 OE2 GLU A 88 1.418 -24.195 -4.377 1.00 0.00 O ATOM 0 H GLU A 88 1.998 -19.170 -6.306 1.00 0.00 H new ATOM 0 HA GLU A 88 -0.539 -19.982 -5.025 1.00 0.00 H new ATOM 0 HB2 GLU A 88 2.368 -20.292 -4.318 1.00 0.00 H new ATOM 0 HB3 GLU A 88 1.036 -20.790 -3.294 1.00 0.00 H new ATOM 0 HG2 GLU A 88 0.148 -22.191 -5.217 1.00 0.00 H new ATOM 0 HG3 GLU A 88 1.575 -21.763 -6.141 1.00 0.00 H new ATOM 1377 N LEU A 89 -0.716 -17.511 -4.256 1.00 0.00 N ATOM 1378 CA LEU A 89 -0.929 -16.297 -3.492 1.00 0.00 C ATOM 1379 C LEU A 89 -1.360 -16.724 -2.103 1.00 0.00 C ATOM 1380 O LEU A 89 -2.459 -17.264 -1.942 1.00 0.00 O ATOM 1381 CB LEU A 89 -1.938 -15.360 -4.152 1.00 0.00 C ATOM 1382 CG LEU A 89 -2.401 -14.248 -3.190 1.00 0.00 C ATOM 1383 CD1 LEU A 89 -1.351 -13.311 -2.609 1.00 0.00 C ATOM 1384 CD2 LEU A 89 -3.335 -13.333 -3.938 1.00 0.00 C ATOM 0 H LEU A 89 -1.469 -17.736 -4.906 1.00 0.00 H new ATOM 0 HA LEU A 89 -0.009 -15.715 -3.443 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -1.491 -14.911 -5.039 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -2.802 -15.934 -4.487 1.00 0.00 H new ATOM 0 HG LEU A 89 -2.818 -14.813 -2.357 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.833 -12.586 -1.953 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.623 -13.889 -2.039 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -0.844 -12.786 -3.419 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -3.675 -12.538 -3.274 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -2.812 -12.897 -4.789 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -4.195 -13.902 -4.293 1.00 0.00 H new ATOM 1396 N THR A 90 -0.510 -16.478 -1.119 1.00 0.00 N ATOM 1397 CA THR A 90 -0.760 -16.773 0.277 1.00 0.00 C ATOM 1398 C THR A 90 -0.904 -15.423 0.977 1.00 0.00 C ATOM 1399 O THR A 90 -0.386 -14.419 0.489 1.00 0.00 O ATOM 1400 CB THR A 90 0.426 -17.591 0.811 1.00 0.00 C ATOM 1401 OG1 THR A 90 0.817 -18.586 -0.129 1.00 0.00 O ATOM 1402 CG2 THR A 90 0.098 -18.275 2.138 1.00 0.00 C ATOM 0 H THR A 90 0.403 -16.053 -1.279 1.00 0.00 H new ATOM 0 HA THR A 90 -1.662 -17.362 0.445 1.00 0.00 H new ATOM 0 HB THR A 90 1.242 -16.887 0.971 1.00 0.00 H new ATOM 0 HG1 THR A 90 1.574 -19.095 0.229 1.00 0.00 H new ATOM 0 HG21 THR A 90 0.964 -18.842 2.479 1.00 0.00 H new ATOM 0 HG22 THR A 90 -0.158 -17.521 2.882 1.00 0.00 H new ATOM 0 HG23 THR A 90 -0.746 -18.950 2.000 1.00 0.00 H new ATOM 1410 N ILE A 91 -1.574 -15.376 2.123 1.00 0.00 N ATOM 1411 CA ILE A 91 -1.672 -14.180 2.945 1.00 0.00 C ATOM 1412 C ILE A 91 -1.201 -14.637 4.324 1.00 0.00 C ATOM 1413 O ILE A 91 -1.614 -15.706 4.782 1.00 0.00 O ATOM 1414 CB ILE A 91 -3.105 -13.590 2.975 1.00 0.00 C ATOM 1415 CG1 ILE A 91 -3.922 -13.655 1.662 1.00 0.00 C ATOM 1416 CG2 ILE A 91 -3.055 -12.139 3.489 1.00 0.00 C ATOM 1417 CD1 ILE A 91 -3.484 -12.720 0.534 1.00 0.00 C ATOM 0 H ILE A 91 -2.070 -16.179 2.510 1.00 0.00 H new ATOM 0 HA ILE A 91 -1.067 -13.363 2.551 1.00 0.00 H new ATOM 0 HB ILE A 91 -3.649 -14.249 3.652 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -3.886 -14.679 1.289 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -4.964 -13.438 1.898 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -4.063 -11.725 3.510 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -2.636 -12.124 4.495 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -2.430 -11.540 2.827 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -4.135 -12.861 -0.329 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -3.550 -11.686 0.872 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -2.455 -12.945 0.254 1.00 0.00 H new ATOM 1429 N VAL A 92 -0.324 -13.874 4.963 1.00 0.00 N ATOM 1430 CA VAL A 92 0.214 -14.167 6.288 1.00 0.00 C ATOM 1431 C VAL A 92 0.033 -12.910 7.140 1.00 0.00 C ATOM 1432 O VAL A 92 -0.016 -11.813 6.585 1.00 0.00 O ATOM 1433 CB VAL A 92 1.680 -14.653 6.179 1.00 0.00 C ATOM 1434 CG1 VAL A 92 1.815 -15.868 5.248 1.00 0.00 C ATOM 1435 CG2 VAL A 92 2.676 -13.589 5.699 1.00 0.00 C ATOM 0 H VAL A 92 0.044 -13.010 4.564 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.317 -14.985 6.774 1.00 0.00 H new ATOM 0 HB VAL A 92 1.934 -14.915 7.206 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.860 -16.176 5.201 1.00 0.00 H new ATOM 0 HG12 VAL A 92 1.212 -16.690 5.633 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.470 -15.601 4.249 1.00 0.00 H new ATOM 0 HG21 VAL A 92 3.676 -14.021 5.654 1.00 0.00 H new ATOM 0 HG22 VAL A 92 2.386 -13.240 4.708 1.00 0.00 H new ATOM 0 HG23 VAL A 92 2.674 -12.749 6.394 1.00 0.00 H new ATOM 1445 N GLU A 93 -0.115 -13.034 8.459 1.00 0.00 N ATOM 1446 CA GLU A 93 -0.164 -11.869 9.334 1.00 0.00 C ATOM 1447 C GLU A 93 1.278 -11.482 9.655 1.00 0.00 C ATOM 1448 O GLU A 93 2.062 -12.343 10.066 1.00 0.00 O ATOM 1449 CB GLU A 93 -0.943 -12.169 10.624 1.00 0.00 C ATOM 1450 CG GLU A 93 -1.291 -10.843 11.320 1.00 0.00 C ATOM 1451 CD GLU A 93 -1.657 -10.969 12.803 1.00 0.00 C ATOM 1452 OE1 GLU A 93 -2.810 -11.313 13.141 1.00 0.00 O ATOM 1453 OE2 GLU A 93 -0.820 -10.609 13.657 1.00 0.00 O ATOM 0 H GLU A 93 -0.203 -13.928 8.941 1.00 0.00 H new ATOM 0 HA GLU A 93 -0.684 -11.050 8.837 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -1.853 -12.723 10.394 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -0.347 -12.796 11.286 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -0.441 -10.167 11.227 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -2.126 -10.381 10.793 1.00 0.00 H new ATOM 1460 N ASP A 94 1.648 -10.216 9.496 1.00 0.00 N ATOM 1461 CA ASP A 94 2.968 -9.713 9.843 1.00 0.00 C ATOM 1462 C ASP A 94 2.851 -8.331 10.460 1.00 0.00 C ATOM 1463 O ASP A 94 2.330 -7.404 9.836 1.00 0.00 O ATOM 1464 CB ASP A 94 3.879 -9.721 8.619 1.00 0.00 C ATOM 1465 CG ASP A 94 5.346 -9.837 9.012 1.00 0.00 C ATOM 1466 OD1 ASP A 94 5.703 -9.535 10.173 1.00 0.00 O ATOM 1467 OD2 ASP A 94 6.120 -10.283 8.138 1.00 0.00 O ATOM 0 H ASP A 94 1.028 -9.501 9.116 1.00 0.00 H new ATOM 0 HA ASP A 94 3.422 -10.368 10.586 1.00 0.00 H new ATOM 0 HB2 ASP A 94 3.609 -10.554 7.969 1.00 0.00 H new ATOM 0 HB3 ASP A 94 3.727 -8.807 8.045 1.00 0.00 H new ATOM 1472 N ASP A 95 3.276 -8.211 11.713 1.00 0.00 N ATOM 1473 CA ASP A 95 3.152 -7.010 12.524 1.00 0.00 C ATOM 1474 C ASP A 95 4.133 -5.941 12.052 1.00 0.00 C ATOM 1475 O ASP A 95 3.719 -4.920 11.503 1.00 0.00 O ATOM 1476 CB ASP A 95 3.376 -7.391 13.988 1.00 0.00 C ATOM 1477 CG ASP A 95 3.056 -6.254 14.950 1.00 0.00 C ATOM 1478 OD1 ASP A 95 1.867 -5.879 15.021 1.00 0.00 O ATOM 1479 OD2 ASP A 95 3.950 -5.828 15.714 1.00 0.00 O ATOM 0 H ASP A 95 3.733 -8.977 12.208 1.00 0.00 H new ATOM 0 HA ASP A 95 2.154 -6.583 12.421 1.00 0.00 H new ATOM 0 HB2 ASP A 95 2.756 -8.253 14.233 1.00 0.00 H new ATOM 0 HB3 ASP A 95 4.414 -7.695 14.125 1.00 0.00 H new ATOM 1484 N ASN A 96 5.439 -6.186 12.187 1.00 0.00 N ATOM 1485 CA ASN A 96 6.488 -5.234 11.804 1.00 0.00 C ATOM 1486 C ASN A 96 7.792 -5.987 11.510 1.00 0.00 C ATOM 1487 O ASN A 96 8.614 -6.155 12.422 1.00 0.00 O ATOM 1488 CB ASN A 96 6.699 -4.158 12.885 1.00 0.00 C ATOM 1489 CG ASN A 96 7.651 -3.069 12.390 1.00 0.00 C ATOM 1490 OD1 ASN A 96 7.217 -1.977 12.042 1.00 0.00 O ATOM 1491 ND2 ASN A 96 8.946 -3.330 12.312 1.00 0.00 N ATOM 0 H ASN A 96 5.803 -7.059 12.569 1.00 0.00 H new ATOM 0 HA ASN A 96 6.169 -4.717 10.899 1.00 0.00 H new ATOM 0 HB2 ASN A 96 5.741 -3.714 13.154 1.00 0.00 H new ATOM 0 HB3 ASN A 96 7.103 -4.617 13.787 1.00 0.00 H new ATOM 0 HD21 ASN A 96 9.589 -2.620 11.961 1.00 0.00 H new ATOM 0 HD22 ASN A 96 9.301 -4.241 12.603 1.00 0.00 H new ATOM 1498 N PRO A 97 7.985 -6.480 10.281 1.00 0.00 N ATOM 1499 CA PRO A 97 9.216 -7.122 9.856 1.00 0.00 C ATOM 1500 C PRO A 97 10.276 -6.050 9.565 1.00 0.00 C ATOM 1501 O PRO A 97 11.063 -5.716 10.452 1.00 0.00 O ATOM 1502 CB PRO A 97 8.814 -7.982 8.654 1.00 0.00 C ATOM 1503 CG PRO A 97 7.625 -7.230 8.058 1.00 0.00 C ATOM 1504 CD PRO A 97 6.994 -6.487 9.222 1.00 0.00 C ATOM 0 HA PRO A 97 9.679 -7.761 10.608 1.00 0.00 H new ATOM 0 HB2 PRO A 97 9.630 -8.076 7.937 1.00 0.00 H new ATOM 0 HB3 PRO A 97 8.539 -8.992 8.957 1.00 0.00 H new ATOM 0 HG2 PRO A 97 7.947 -6.539 7.279 1.00 0.00 H new ATOM 0 HG3 PRO A 97 6.915 -7.918 7.600 1.00 0.00 H new ATOM 0 HD2 PRO A 97 6.724 -5.471 8.935 1.00 0.00 H new ATOM 0 HD3 PRO A 97 6.078 -6.980 9.549 1.00 0.00 H new ATOM 1512 N ALA A 98 10.309 -5.511 8.342 1.00 0.00 N ATOM 1513 CA ALA A 98 11.152 -4.405 7.895 1.00 0.00 C ATOM 1514 C ALA A 98 10.569 -3.782 6.614 1.00 0.00 C ATOM 1515 O ALA A 98 11.313 -3.364 5.720 1.00 0.00 O ATOM 1516 CB ALA A 98 12.579 -4.915 7.666 1.00 0.00 C ATOM 0 H ALA A 98 9.709 -5.859 7.594 1.00 0.00 H new ATOM 0 HA ALA A 98 11.180 -3.629 8.660 1.00 0.00 H new ATOM 0 HB1 ALA A 98 13.210 -4.092 7.332 1.00 0.00 H new ATOM 0 HB2 ALA A 98 12.974 -5.321 8.597 1.00 0.00 H new ATOM 0 HB3 ALA A 98 12.569 -5.696 6.905 1.00 0.00 H new ATOM 1522 N VAL A 99 9.241 -3.763 6.466 1.00 0.00 N ATOM 1523 CA VAL A 99 8.593 -3.320 5.233 1.00 0.00 C ATOM 1524 C VAL A 99 7.368 -2.459 5.556 1.00 0.00 C ATOM 1525 O VAL A 99 6.744 -2.585 6.617 1.00 0.00 O ATOM 1526 CB VAL A 99 8.246 -4.547 4.350 1.00 0.00 C ATOM 1527 CG1 VAL A 99 8.017 -4.143 2.885 1.00 0.00 C ATOM 1528 CG2 VAL A 99 9.328 -5.648 4.339 1.00 0.00 C ATOM 0 H VAL A 99 8.590 -4.053 7.195 1.00 0.00 H new ATOM 0 HA VAL A 99 9.277 -2.693 4.661 1.00 0.00 H new ATOM 0 HB VAL A 99 7.340 -4.945 4.807 1.00 0.00 H new ATOM 0 HG11 VAL A 99 7.776 -5.028 2.297 1.00 0.00 H new ATOM 0 HG12 VAL A 99 7.191 -3.434 2.828 1.00 0.00 H new ATOM 0 HG13 VAL A 99 8.921 -3.680 2.490 1.00 0.00 H new ATOM 0 HG21 VAL A 99 9.006 -6.469 3.698 1.00 0.00 H new ATOM 0 HG22 VAL A 99 10.263 -5.236 3.959 1.00 0.00 H new ATOM 0 HG23 VAL A 99 9.481 -6.018 5.353 1.00 0.00 H new ATOM 1538 N ARG A 100 7.064 -1.512 4.672 1.00 0.00 N ATOM 1539 CA ARG A 100 5.878 -0.671 4.707 1.00 0.00 C ATOM 1540 C ARG A 100 4.927 -1.285 3.684 1.00 0.00 C ATOM 1541 O ARG A 100 5.351 -1.606 2.577 1.00 0.00 O ATOM 1542 CB ARG A 100 6.221 0.790 4.340 1.00 0.00 C ATOM 1543 CG ARG A 100 7.024 1.537 5.428 1.00 0.00 C ATOM 1544 CD ARG A 100 8.545 1.435 5.215 1.00 0.00 C ATOM 1545 NE ARG A 100 9.311 1.445 6.474 1.00 0.00 N ATOM 1546 CZ ARG A 100 10.122 2.399 6.948 1.00 0.00 C ATOM 1547 NH1 ARG A 100 10.221 3.589 6.360 1.00 0.00 N ATOM 1548 NH2 ARG A 100 10.855 2.140 8.025 1.00 0.00 N ATOM 0 H ARG A 100 7.668 -1.303 3.877 1.00 0.00 H new ATOM 0 HA ARG A 100 5.436 -0.634 5.702 1.00 0.00 H new ATOM 0 HB2 ARG A 100 6.792 0.796 3.412 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.296 1.333 4.148 1.00 0.00 H new ATOM 0 HG2 ARG A 100 6.731 2.587 5.434 1.00 0.00 H new ATOM 0 HG3 ARG A 100 6.770 1.129 6.406 1.00 0.00 H new ATOM 0 HD2 ARG A 100 8.768 0.518 4.669 1.00 0.00 H new ATOM 0 HD3 ARG A 100 8.874 2.266 4.591 1.00 0.00 H new ATOM 0 HE ARG A 100 9.210 0.617 7.061 1.00 0.00 H new ATOM 0 HH11 ARG A 100 9.670 3.793 5.526 1.00 0.00 H new ATOM 0 HH12 ARG A 100 10.847 4.297 6.744 1.00 0.00 H new ATOM 0 HH21 ARG A 100 10.794 1.227 8.476 1.00 0.00 H new ATOM 0 HH22 ARG A 100 11.479 2.854 8.401 1.00 0.00 H new ATOM 1562 N THR A 101 3.674 -1.516 4.060 1.00 0.00 N ATOM 1563 CA THR A 101 2.646 -1.969 3.130 1.00 0.00 C ATOM 1564 C THR A 101 2.333 -0.799 2.185 1.00 0.00 C ATOM 1565 O THR A 101 2.711 0.331 2.501 1.00 0.00 O ATOM 1566 CB THR A 101 1.402 -2.347 3.956 1.00 0.00 C ATOM 1567 OG1 THR A 101 0.992 -1.213 4.695 1.00 0.00 O ATOM 1568 CG2 THR A 101 1.689 -3.475 4.954 1.00 0.00 C ATOM 0 H THR A 101 3.343 -1.395 5.017 1.00 0.00 H new ATOM 0 HA THR A 101 2.966 -2.832 2.547 1.00 0.00 H new ATOM 0 HB THR A 101 0.634 -2.687 3.261 1.00 0.00 H new ATOM 0 HG1 THR A 101 0.199 -1.437 5.225 1.00 0.00 H new ATOM 0 HG21 THR A 101 0.782 -3.706 5.513 1.00 0.00 H new ATOM 0 HG22 THR A 101 2.019 -4.363 4.415 1.00 0.00 H new ATOM 0 HG23 THR A 101 2.470 -3.159 5.645 1.00 0.00 H new ATOM 1576 N PRO A 102 1.606 -0.981 1.072 1.00 0.00 N ATOM 1577 CA PRO A 102 1.182 0.133 0.242 1.00 0.00 C ATOM 1578 C PRO A 102 0.432 1.198 1.050 1.00 0.00 C ATOM 1579 O PRO A 102 0.578 2.383 0.758 1.00 0.00 O ATOM 1580 CB PRO A 102 0.272 -0.474 -0.818 1.00 0.00 C ATOM 1581 CG PRO A 102 0.812 -1.890 -0.977 1.00 0.00 C ATOM 1582 CD PRO A 102 1.253 -2.238 0.445 1.00 0.00 C ATOM 0 HA PRO A 102 2.042 0.642 -0.194 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -0.771 -0.475 -0.500 1.00 0.00 H new ATOM 0 HB3 PRO A 102 0.319 0.082 -1.754 1.00 0.00 H new ATOM 0 HG2 PRO A 102 0.049 -2.576 -1.345 1.00 0.00 H new ATOM 0 HG3 PRO A 102 1.643 -1.931 -1.681 1.00 0.00 H new ATOM 0 HD2 PRO A 102 0.452 -2.735 0.991 1.00 0.00 H new ATOM 0 HD3 PRO A 102 2.103 -2.921 0.434 1.00 0.00 H new ATOM 1590 N LEU A 103 -0.368 0.820 2.055 1.00 0.00 N ATOM 1591 CA LEU A 103 -1.107 1.786 2.862 1.00 0.00 C ATOM 1592 C LEU A 103 -0.182 2.560 3.805 1.00 0.00 C ATOM 1593 O LEU A 103 -0.426 3.743 4.069 1.00 0.00 O ATOM 1594 CB LEU A 103 -2.222 1.105 3.671 1.00 0.00 C ATOM 1595 CG LEU A 103 -3.346 2.120 3.942 1.00 0.00 C ATOM 1596 CD1 LEU A 103 -4.343 2.126 2.775 1.00 0.00 C ATOM 1597 CD2 LEU A 103 -4.072 1.831 5.253 1.00 0.00 C ATOM 0 H LEU A 103 -0.517 -0.152 2.325 1.00 0.00 H new ATOM 0 HA LEU A 103 -1.561 2.493 2.167 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -2.614 0.249 3.122 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -1.824 0.725 4.612 1.00 0.00 H new ATOM 0 HG LEU A 103 -2.886 3.104 4.032 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -5.135 2.848 2.977 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -3.826 2.402 1.856 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -4.778 1.133 2.663 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -4.857 2.571 5.405 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -4.515 0.836 5.212 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -3.363 1.879 6.080 1.00 0.00 H new ATOM 1609 N GLU A 104 0.859 1.915 4.340 1.00 0.00 N ATOM 1610 CA GLU A 104 1.860 2.606 5.143 1.00 0.00 C ATOM 1611 C GLU A 104 2.719 3.475 4.226 1.00 0.00 C ATOM 1612 O GLU A 104 2.969 4.621 4.571 1.00 0.00 O ATOM 1613 CB GLU A 104 2.706 1.630 5.976 1.00 0.00 C ATOM 1614 CG GLU A 104 1.923 0.959 7.118 1.00 0.00 C ATOM 1615 CD GLU A 104 1.294 1.964 8.085 1.00 0.00 C ATOM 1616 OE1 GLU A 104 1.951 2.365 9.073 1.00 0.00 O ATOM 1617 OE2 GLU A 104 0.122 2.356 7.878 1.00 0.00 O ATOM 0 H GLU A 104 1.026 0.915 4.229 1.00 0.00 H new ATOM 0 HA GLU A 104 1.355 3.247 5.866 1.00 0.00 H new ATOM 0 HB2 GLU A 104 3.108 0.858 5.319 1.00 0.00 H new ATOM 0 HB3 GLU A 104 3.557 2.166 6.396 1.00 0.00 H new ATOM 0 HG2 GLU A 104 1.139 0.332 6.694 1.00 0.00 H new ATOM 0 HG3 GLU A 104 2.592 0.301 7.672 1.00 0.00 H new ATOM 1624 N TRP A 105 3.105 3.007 3.037 1.00 0.00 N ATOM 1625 CA TRP A 105 3.815 3.807 2.047 1.00 0.00 C ATOM 1626 C TRP A 105 2.972 5.012 1.624 1.00 0.00 C ATOM 1627 O TRP A 105 3.512 6.104 1.488 1.00 0.00 O ATOM 1628 CB TRP A 105 4.187 2.966 0.821 1.00 0.00 C ATOM 1629 CG TRP A 105 5.481 2.214 0.872 1.00 0.00 C ATOM 1630 CD1 TRP A 105 5.642 0.883 0.686 1.00 0.00 C ATOM 1631 CD2 TRP A 105 6.827 2.752 1.042 1.00 0.00 C ATOM 1632 NE1 TRP A 105 6.988 0.571 0.666 1.00 0.00 N ATOM 1633 CE2 TRP A 105 7.767 1.687 0.897 1.00 0.00 C ATOM 1634 CE3 TRP A 105 7.348 4.041 1.292 1.00 0.00 C ATOM 1635 CZ2 TRP A 105 9.152 1.894 0.995 1.00 0.00 C ATOM 1636 CZ3 TRP A 105 8.730 4.249 1.442 1.00 0.00 C ATOM 1637 CH2 TRP A 105 9.631 3.183 1.281 1.00 0.00 C ATOM 0 H TRP A 105 2.929 2.049 2.735 1.00 0.00 H new ATOM 0 HA TRP A 105 4.736 4.166 2.507 1.00 0.00 H new ATOM 0 HB2 TRP A 105 3.386 2.247 0.649 1.00 0.00 H new ATOM 0 HB3 TRP A 105 4.214 3.627 -0.046 1.00 0.00 H new ATOM 0 HD1 TRP A 105 4.838 0.171 0.570 1.00 0.00 H new ATOM 0 HE1 TRP A 105 7.359 -0.365 0.501 1.00 0.00 H new ATOM 0 HE3 TRP A 105 6.673 4.881 1.369 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 9.840 1.074 0.852 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 9.102 5.234 1.682 1.00 0.00 H new ATOM 0 HH2 TRP A 105 10.693 3.355 1.377 1.00 0.00 H new ATOM 1648 N ARG A 106 1.652 4.861 1.458 1.00 0.00 N ATOM 1649 CA ARG A 106 0.764 5.982 1.146 1.00 0.00 C ATOM 1650 C ARG A 106 0.922 7.052 2.223 1.00 0.00 C ATOM 1651 O ARG A 106 1.065 8.225 1.894 1.00 0.00 O ATOM 1652 CB ARG A 106 -0.700 5.506 1.020 1.00 0.00 C ATOM 1653 CG ARG A 106 -1.643 6.552 0.400 1.00 0.00 C ATOM 1654 CD ARG A 106 -1.475 6.726 -1.119 1.00 0.00 C ATOM 1655 NE ARG A 106 -2.633 6.236 -1.883 1.00 0.00 N ATOM 1656 CZ ARG A 106 -2.841 4.999 -2.343 1.00 0.00 C ATOM 1657 NH1 ARG A 106 -1.952 4.024 -2.209 1.00 0.00 N ATOM 1658 NH2 ARG A 106 -3.955 4.730 -2.999 1.00 0.00 N ATOM 0 H ARG A 106 1.174 3.963 1.536 1.00 0.00 H new ATOM 0 HA ARG A 106 1.038 6.411 0.182 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -0.727 4.601 0.413 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -1.071 5.237 2.009 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -2.674 6.267 0.611 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -1.473 7.513 0.886 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -1.318 7.781 -1.344 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -0.581 6.194 -1.444 1.00 0.00 H new ATOM 0 HE ARG A 106 -3.362 6.920 -2.085 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -1.065 4.204 -1.738 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -2.155 3.095 -2.577 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -4.647 5.464 -3.151 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -4.123 3.789 -3.354 1.00 0.00 H new ATOM 1672 N GLN A 107 0.931 6.650 3.496 1.00 0.00 N ATOM 1673 CA GLN A 107 1.164 7.553 4.613 1.00 0.00 C ATOM 1674 C GLN A 107 2.578 8.132 4.559 1.00 0.00 C ATOM 1675 O GLN A 107 2.759 9.326 4.760 1.00 0.00 O ATOM 1676 CB GLN A 107 0.974 6.792 5.937 1.00 0.00 C ATOM 1677 CG GLN A 107 0.675 7.719 7.124 1.00 0.00 C ATOM 1678 CD GLN A 107 -0.771 8.197 7.133 1.00 0.00 C ATOM 1679 OE1 GLN A 107 -1.049 9.394 7.094 1.00 0.00 O ATOM 1680 NE2 GLN A 107 -1.718 7.277 7.193 1.00 0.00 N ATOM 0 H GLN A 107 0.775 5.682 3.777 1.00 0.00 H new ATOM 0 HA GLN A 107 0.449 8.374 4.549 1.00 0.00 H new ATOM 0 HB2 GLN A 107 0.158 6.078 5.826 1.00 0.00 H new ATOM 0 HB3 GLN A 107 1.874 6.216 6.151 1.00 0.00 H new ATOM 0 HG2 GLN A 107 0.888 7.194 8.055 1.00 0.00 H new ATOM 0 HG3 GLN A 107 1.340 8.581 7.085 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -1.468 6.289 7.225 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -2.699 7.555 7.208 1.00 0.00 H new ATOM 1689 N ALA A 108 3.578 7.299 4.287 1.00 0.00 N ATOM 1690 CA ALA A 108 4.975 7.666 4.333 1.00 0.00 C ATOM 1691 C ALA A 108 5.323 8.690 3.263 1.00 0.00 C ATOM 1692 O ALA A 108 6.072 9.621 3.543 1.00 0.00 O ATOM 1693 CB ALA A 108 5.838 6.406 4.225 1.00 0.00 C ATOM 0 H ALA A 108 3.427 6.326 4.022 1.00 0.00 H new ATOM 0 HA ALA A 108 5.182 8.146 5.290 1.00 0.00 H new ATOM 0 HB1 ALA A 108 6.892 6.683 4.260 1.00 0.00 H new ATOM 0 HB2 ALA A 108 5.611 5.737 5.055 1.00 0.00 H new ATOM 0 HB3 ALA A 108 5.627 5.900 3.283 1.00 0.00 H new ATOM 1699 N ILE A 109 4.783 8.563 2.048 1.00 0.00 N ATOM 1700 CA ILE A 109 5.016 9.569 1.017 1.00 0.00 C ATOM 1701 C ILE A 109 4.193 10.821 1.339 1.00 0.00 C ATOM 1702 O ILE A 109 4.685 11.924 1.130 1.00 0.00 O ATOM 1703 CB ILE A 109 4.804 9.023 -0.418 1.00 0.00 C ATOM 1704 CG1 ILE A 109 5.984 8.166 -0.926 1.00 0.00 C ATOM 1705 CG2 ILE A 109 4.719 10.149 -1.448 1.00 0.00 C ATOM 1706 CD1 ILE A 109 5.945 6.749 -0.395 1.00 0.00 C ATOM 0 H ILE A 109 4.190 7.784 1.760 1.00 0.00 H new ATOM 0 HA ILE A 109 6.068 9.853 1.029 1.00 0.00 H new ATOM 0 HB ILE A 109 3.885 8.443 -0.334 1.00 0.00 H new ATOM 0 HG12 ILE A 109 5.968 8.142 -2.016 1.00 0.00 H new ATOM 0 HG13 ILE A 109 6.923 8.635 -0.631 1.00 0.00 H new ATOM 0 HG21 ILE A 109 4.570 9.724 -2.441 1.00 0.00 H new ATOM 0 HG22 ILE A 109 3.882 10.803 -1.204 1.00 0.00 H new ATOM 0 HG23 ILE A 109 5.644 10.725 -1.435 1.00 0.00 H new ATOM 0 HD11 ILE A 109 6.797 6.191 -0.784 1.00 0.00 H new ATOM 0 HD12 ILE A 109 5.989 6.767 0.694 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.020 6.267 -0.712 1.00 0.00 H new ATOM 1718 N TYR A 110 2.978 10.694 1.882 1.00 0.00 N ATOM 1719 CA TYR A 110 2.188 11.848 2.316 1.00 0.00 C ATOM 1720 C TYR A 110 2.970 12.694 3.315 1.00 0.00 C ATOM 1721 O TYR A 110 2.933 13.926 3.270 1.00 0.00 O ATOM 1722 CB TYR A 110 0.891 11.334 2.942 1.00 0.00 C ATOM 1723 CG TYR A 110 -0.198 12.356 3.152 1.00 0.00 C ATOM 1724 CD1 TYR A 110 -0.301 13.115 4.337 1.00 0.00 C ATOM 1725 CD2 TYR A 110 -1.163 12.484 2.145 1.00 0.00 C ATOM 1726 CE1 TYR A 110 -1.408 13.972 4.511 1.00 0.00 C ATOM 1727 CE2 TYR A 110 -2.281 13.302 2.329 1.00 0.00 C ATOM 1728 CZ TYR A 110 -2.428 14.028 3.526 1.00 0.00 C ATOM 1729 OH TYR A 110 -3.576 14.726 3.726 1.00 0.00 O ATOM 0 H TYR A 110 2.518 9.796 2.032 1.00 0.00 H new ATOM 0 HA TYR A 110 1.960 12.483 1.460 1.00 0.00 H new ATOM 0 HB2 TYR A 110 0.497 10.539 2.309 1.00 0.00 H new ATOM 0 HB3 TYR A 110 1.130 10.885 3.906 1.00 0.00 H new ATOM 0 HD1 TYR A 110 0.458 13.041 5.101 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -1.042 11.945 1.217 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -1.479 14.587 5.396 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -3.030 13.377 1.555 1.00 0.00 H new ATOM 0 HH TYR A 110 -4.150 14.645 2.936 1.00 0.00 H new ATOM 1739 N GLU A 111 3.669 12.011 4.212 1.00 0.00 N ATOM 1740 CA GLU A 111 4.518 12.579 5.224 1.00 0.00 C ATOM 1741 C GLU A 111 5.768 13.181 4.573 1.00 0.00 C ATOM 1742 O GLU A 111 6.094 14.332 4.859 1.00 0.00 O ATOM 1743 CB GLU A 111 4.849 11.453 6.211 1.00 0.00 C ATOM 1744 CG GLU A 111 5.252 11.993 7.572 1.00 0.00 C ATOM 1745 CD GLU A 111 6.136 10.990 8.306 1.00 0.00 C ATOM 1746 OE1 GLU A 111 5.655 9.901 8.700 1.00 0.00 O ATOM 1747 OE2 GLU A 111 7.359 11.236 8.434 1.00 0.00 O ATOM 0 H GLU A 111 3.651 10.992 4.246 1.00 0.00 H new ATOM 0 HA GLU A 111 4.030 13.393 5.760 1.00 0.00 H new ATOM 0 HB2 GLU A 111 3.983 10.801 6.321 1.00 0.00 H new ATOM 0 HB3 GLU A 111 5.658 10.843 5.808 1.00 0.00 H new ATOM 0 HG2 GLU A 111 5.785 12.936 7.452 1.00 0.00 H new ATOM 0 HG3 GLU A 111 4.361 12.203 8.164 1.00 0.00 H new ATOM 1754 N GLU A 112 6.456 12.454 3.683 1.00 0.00 N ATOM 1755 CA GLU A 112 7.689 12.900 3.044 1.00 0.00 C ATOM 1756 C GLU A 112 7.446 14.134 2.168 1.00 0.00 C ATOM 1757 O GLU A 112 8.244 15.074 2.199 1.00 0.00 O ATOM 1758 CB GLU A 112 8.387 11.719 2.327 1.00 0.00 C ATOM 1759 CG GLU A 112 8.146 11.477 0.819 1.00 0.00 C ATOM 1760 CD GLU A 112 9.269 11.912 -0.133 1.00 0.00 C ATOM 1761 OE1 GLU A 112 10.185 12.671 0.260 1.00 0.00 O ATOM 1762 OE2 GLU A 112 9.298 11.384 -1.272 1.00 0.00 O ATOM 0 H GLU A 112 6.161 11.524 3.385 1.00 0.00 H new ATOM 0 HA GLU A 112 8.394 13.236 3.805 1.00 0.00 H new ATOM 0 HB2 GLU A 112 9.461 11.844 2.467 1.00 0.00 H new ATOM 0 HB3 GLU A 112 8.101 10.807 2.851 1.00 0.00 H new ATOM 0 HG2 GLU A 112 7.965 10.413 0.669 1.00 0.00 H new ATOM 0 HG3 GLU A 112 7.234 11.999 0.531 1.00 0.00 H new ATOM 1769 N LYS A 113 6.308 14.204 1.467 1.00 0.00 N ATOM 1770 CA LYS A 113 5.970 15.341 0.611 1.00 0.00 C ATOM 1771 C LYS A 113 5.698 16.594 1.430 1.00 0.00 C ATOM 1772 O LYS A 113 5.729 17.697 0.880 1.00 0.00 O ATOM 1773 CB LYS A 113 4.787 15.023 -0.330 1.00 0.00 C ATOM 1774 CG LYS A 113 5.188 15.193 -1.805 1.00 0.00 C ATOM 1775 CD LYS A 113 6.063 14.025 -2.290 1.00 0.00 C ATOM 1776 CE LYS A 113 6.889 14.376 -3.530 1.00 0.00 C ATOM 1777 NZ LYS A 113 6.080 14.803 -4.684 1.00 0.00 N ATOM 0 H LYS A 113 5.597 13.472 1.479 1.00 0.00 H new ATOM 0 HA LYS A 113 6.840 15.536 -0.016 1.00 0.00 H new ATOM 0 HB2 LYS A 113 4.447 14.002 -0.158 1.00 0.00 H new ATOM 0 HB3 LYS A 113 3.949 15.681 -0.100 1.00 0.00 H new ATOM 0 HG2 LYS A 113 4.291 15.258 -2.422 1.00 0.00 H new ATOM 0 HG3 LYS A 113 5.729 16.131 -1.930 1.00 0.00 H new ATOM 0 HD2 LYS A 113 6.734 13.722 -1.486 1.00 0.00 H new ATOM 0 HD3 LYS A 113 5.426 13.169 -2.514 1.00 0.00 H new ATOM 0 HE2 LYS A 113 7.589 15.172 -3.275 1.00 0.00 H new ATOM 0 HE3 LYS A 113 7.483 13.508 -3.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 6.381 14.280 -5.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 5.076 14.608 -4.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 6.211 15.823 -4.842 1.00 0.00 H new ATOM 1791 N LEU A 114 5.381 16.445 2.713 1.00 0.00 N ATOM 1792 CA LEU A 114 5.224 17.534 3.664 1.00 0.00 C ATOM 1793 C LEU A 114 6.599 17.839 4.254 1.00 0.00 C ATOM 1794 O LEU A 114 6.982 18.998 4.369 1.00 0.00 O ATOM 1795 CB LEU A 114 4.234 17.113 4.769 1.00 0.00 C ATOM 1796 CG LEU A 114 2.803 17.643 4.597 1.00 0.00 C ATOM 1797 CD1 LEU A 114 1.903 16.978 5.650 1.00 0.00 C ATOM 1798 CD2 LEU A 114 2.723 19.164 4.759 1.00 0.00 C ATOM 0 H LEU A 114 5.221 15.528 3.131 1.00 0.00 H new ATOM 0 HA LEU A 114 4.827 18.425 3.177 1.00 0.00 H new ATOM 0 HB2 LEU A 114 4.199 16.024 4.809 1.00 0.00 H new ATOM 0 HB3 LEU A 114 4.619 17.455 5.730 1.00 0.00 H new ATOM 0 HG LEU A 114 2.474 17.402 3.586 1.00 0.00 H new ATOM 0 HD11 LEU A 114 0.882 17.345 5.540 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.917 15.897 5.510 1.00 0.00 H new ATOM 0 HD13 LEU A 114 2.270 17.220 6.647 1.00 0.00 H new ATOM 0 HD21 LEU A 114 1.691 19.490 4.628 1.00 0.00 H new ATOM 0 HD22 LEU A 114 3.068 19.443 5.755 1.00 0.00 H new ATOM 0 HD23 LEU A 114 3.353 19.643 4.009 1.00 0.00 H new ATOM 1810 N ALA A 115 7.368 16.802 4.599 1.00 0.00 N ATOM 1811 CA ALA A 115 8.645 16.939 5.281 1.00 0.00 C ATOM 1812 C ALA A 115 9.647 17.701 4.420 1.00 0.00 C ATOM 1813 O ALA A 115 10.388 18.538 4.945 1.00 0.00 O ATOM 1814 CB ALA A 115 9.196 15.556 5.648 1.00 0.00 C ATOM 0 H ALA A 115 7.112 15.834 4.407 1.00 0.00 H new ATOM 0 HA ALA A 115 8.486 17.511 6.195 1.00 0.00 H new ATOM 0 HB1 ALA A 115 10.153 15.669 6.158 1.00 0.00 H new ATOM 0 HB2 ALA A 115 8.492 15.047 6.306 1.00 0.00 H new ATOM 0 HB3 ALA A 115 9.336 14.968 4.741 1.00 0.00 H new ATOM 1820 N GLN A 116 9.625 17.444 3.108 1.00 0.00 N ATOM 1821 CA GLN A 116 10.528 18.093 2.161 1.00 0.00 C ATOM 1822 C GLN A 116 10.315 19.604 2.135 1.00 0.00 C ATOM 1823 O GLN A 116 11.243 20.344 1.837 1.00 0.00 O ATOM 1824 CB GLN A 116 10.408 17.498 0.747 1.00 0.00 C ATOM 1825 CG GLN A 116 9.062 17.734 0.058 1.00 0.00 C ATOM 1826 CD GLN A 116 9.015 17.090 -1.325 1.00 0.00 C ATOM 1827 OE1 GLN A 116 8.711 15.912 -1.469 1.00 0.00 O ATOM 1828 NE2 GLN A 116 9.318 17.833 -2.375 1.00 0.00 N ATOM 0 H GLN A 116 8.981 16.781 2.677 1.00 0.00 H new ATOM 0 HA GLN A 116 11.542 17.900 2.510 1.00 0.00 H new ATOM 0 HB2 GLN A 116 11.197 17.919 0.124 1.00 0.00 H new ATOM 0 HB3 GLN A 116 10.586 16.424 0.805 1.00 0.00 H new ATOM 0 HG2 GLN A 116 8.261 17.328 0.676 1.00 0.00 H new ATOM 0 HG3 GLN A 116 8.883 18.805 -0.033 1.00 0.00 H new ATOM 0 HE21 GLN A 116 9.570 18.813 -2.250 1.00 0.00 H new ATOM 0 HE22 GLN A 116 9.299 17.426 -3.310 1.00 0.00 H new ATOM 1837 N ALA A 117 9.112 20.074 2.478 1.00 0.00 N ATOM 1838 CA ALA A 117 8.819 21.496 2.503 1.00 0.00 C ATOM 1839 C ALA A 117 9.650 22.190 3.579 1.00 0.00 C ATOM 1840 O ALA A 117 10.163 23.287 3.353 1.00 0.00 O ATOM 1841 CB ALA A 117 7.323 21.716 2.732 1.00 0.00 C ATOM 0 H ALA A 117 8.326 19.480 2.742 1.00 0.00 H new ATOM 0 HA ALA A 117 9.086 21.933 1.541 1.00 0.00 H new ATOM 0 HB1 ALA A 117 7.111 22.785 2.750 1.00 0.00 H new ATOM 0 HB2 ALA A 117 6.759 21.247 1.926 1.00 0.00 H new ATOM 0 HB3 ALA A 117 7.032 21.273 3.684 1.00 0.00 H new ATOM 1847 N ARG A 118 9.793 21.573 4.758 1.00 0.00 N ATOM 1848 CA ARG A 118 10.626 22.140 5.812 1.00 0.00 C ATOM 1849 C ARG A 118 12.094 21.994 5.437 1.00 0.00 C ATOM 1850 O ARG A 118 12.855 22.930 5.648 1.00 0.00 O ATOM 1851 CB ARG A 118 10.277 21.503 7.163 1.00 0.00 C ATOM 1852 CG ARG A 118 10.610 22.385 8.379 1.00 0.00 C ATOM 1853 CD ARG A 118 12.064 22.299 8.881 1.00 0.00 C ATOM 1854 NE ARG A 118 12.398 20.976 9.435 1.00 0.00 N ATOM 1855 CZ ARG A 118 11.894 20.419 10.544 1.00 0.00 C ATOM 1856 NH1 ARG A 118 11.067 21.096 11.335 1.00 0.00 N ATOM 1857 NH2 ARG A 118 12.215 19.178 10.871 1.00 0.00 N ATOM 0 H ARG A 118 9.345 20.689 5.000 1.00 0.00 H new ATOM 0 HA ARG A 118 10.430 23.207 5.917 1.00 0.00 H new ATOM 0 HB2 ARG A 118 9.212 21.269 7.178 1.00 0.00 H new ATOM 0 HB3 ARG A 118 10.812 20.558 7.256 1.00 0.00 H new ATOM 0 HG2 ARG A 118 10.393 23.422 8.124 1.00 0.00 H new ATOM 0 HG3 ARG A 118 9.944 22.112 9.198 1.00 0.00 H new ATOM 0 HD2 ARG A 118 12.742 22.525 8.058 1.00 0.00 H new ATOM 0 HD3 ARG A 118 12.226 23.059 9.645 1.00 0.00 H new ATOM 0 HE ARG A 118 13.085 20.426 8.920 1.00 0.00 H new ATOM 0 HH11 ARG A 118 10.808 22.054 11.101 1.00 0.00 H new ATOM 0 HH12 ARG A 118 10.692 20.657 12.176 1.00 0.00 H new ATOM 0 HH21 ARG A 118 12.848 18.642 10.278 1.00 0.00 H new ATOM 0 HH22 ARG A 118 11.829 18.757 11.716 1.00 0.00 H new ATOM 1871 N GLU A 119 12.488 20.876 4.829 1.00 0.00 N ATOM 1872 CA GLU A 119 13.852 20.675 4.343 1.00 0.00 C ATOM 1873 C GLU A 119 14.228 21.752 3.312 1.00 0.00 C ATOM 1874 O GLU A 119 15.359 22.238 3.304 1.00 0.00 O ATOM 1875 CB GLU A 119 13.954 19.245 3.782 1.00 0.00 C ATOM 1876 CG GLU A 119 15.391 18.726 3.640 1.00 0.00 C ATOM 1877 CD GLU A 119 15.430 17.305 3.058 1.00 0.00 C ATOM 1878 OE1 GLU A 119 14.612 16.444 3.463 1.00 0.00 O ATOM 1879 OE2 GLU A 119 16.275 17.036 2.170 1.00 0.00 O ATOM 0 H GLU A 119 11.869 20.083 4.659 1.00 0.00 H new ATOM 0 HA GLU A 119 14.571 20.780 5.155 1.00 0.00 H new ATOM 0 HB2 GLU A 119 13.399 18.571 4.434 1.00 0.00 H new ATOM 0 HB3 GLU A 119 13.470 19.214 2.806 1.00 0.00 H new ATOM 0 HG2 GLU A 119 15.958 19.398 2.996 1.00 0.00 H new ATOM 0 HG3 GLU A 119 15.878 18.733 4.615 1.00 0.00 H new ATOM 1886 N SER A 120 13.263 22.199 2.502 1.00 0.00 N ATOM 1887 CA SER A 120 13.447 23.245 1.509 1.00 0.00 C ATOM 1888 C SER A 120 13.827 24.596 2.138 1.00 0.00 C ATOM 1889 O SER A 120 14.436 25.426 1.466 1.00 0.00 O ATOM 1890 CB SER A 120 12.184 23.358 0.647 1.00 0.00 C ATOM 1891 OG SER A 120 12.484 23.973 -0.589 1.00 0.00 O ATOM 0 H SER A 120 12.312 21.830 2.525 1.00 0.00 H new ATOM 0 HA SER A 120 14.289 22.966 0.875 1.00 0.00 H new ATOM 0 HB2 SER A 120 11.764 22.367 0.475 1.00 0.00 H new ATOM 0 HB3 SER A 120 11.427 23.938 1.175 1.00 0.00 H new ATOM 0 HG SER A 120 11.669 24.037 -1.129 1.00 0.00 H new ATOM 1897 N ILE A 121 13.530 24.821 3.425 1.00 0.00 N ATOM 1898 CA ILE A 121 13.953 26.025 4.139 1.00 0.00 C ATOM 1899 C ILE A 121 15.484 26.055 4.169 1.00 0.00 C ATOM 1900 O ILE A 121 16.068 27.117 3.955 1.00 0.00 O ATOM 1901 CB ILE A 121 13.331 26.063 5.558 1.00 0.00 C ATOM 1902 CG1 ILE A 121 11.787 26.035 5.461 1.00 0.00 C ATOM 1903 CG2 ILE A 121 13.779 27.276 6.395 1.00 0.00 C ATOM 1904 CD1 ILE A 121 11.089 25.962 6.820 1.00 0.00 C ATOM 0 H ILE A 121 12.990 24.172 3.997 1.00 0.00 H new ATOM 0 HA ILE A 121 13.598 26.919 3.626 1.00 0.00 H new ATOM 0 HB ILE A 121 13.695 25.176 6.076 1.00 0.00 H new ATOM 0 HG12 ILE A 121 11.448 26.928 4.935 1.00 0.00 H new ATOM 0 HG13 ILE A 121 11.485 25.177 4.860 1.00 0.00 H new ATOM 0 HG21 ILE A 121 13.304 27.237 7.375 1.00 0.00 H new ATOM 0 HG22 ILE A 121 14.862 27.255 6.515 1.00 0.00 H new ATOM 0 HG23 ILE A 121 13.488 28.196 5.888 1.00 0.00 H new ATOM 0 HD11 ILE A 121 10.009 25.946 6.674 1.00 0.00 H new ATOM 0 HD12 ILE A 121 11.399 25.055 7.340 1.00 0.00 H new ATOM 0 HD13 ILE A 121 11.361 26.833 7.416 1.00 0.00 H new ATOM 1916 N ILE A 122 16.131 24.907 4.417 1.00 0.00 N ATOM 1917 CA ILE A 122 17.585 24.805 4.385 1.00 0.00 C ATOM 1918 C ILE A 122 18.046 24.877 2.926 1.00 0.00 C ATOM 1919 O ILE A 122 19.021 25.564 2.635 1.00 0.00 O ATOM 1920 CB ILE A 122 18.084 23.518 5.092 1.00 0.00 C ATOM 1921 CG1 ILE A 122 17.527 23.369 6.529 1.00 0.00 C ATOM 1922 CG2 ILE A 122 19.622 23.518 5.175 1.00 0.00 C ATOM 1923 CD1 ILE A 122 16.252 22.523 6.591 1.00 0.00 C ATOM 0 H ILE A 122 15.658 24.032 4.643 1.00 0.00 H new ATOM 0 HA ILE A 122 18.022 25.636 4.938 1.00 0.00 H new ATOM 0 HB ILE A 122 17.723 22.682 4.493 1.00 0.00 H new ATOM 0 HG12 ILE A 122 18.289 22.915 7.163 1.00 0.00 H new ATOM 0 HG13 ILE A 122 17.320 24.358 6.937 1.00 0.00 H new ATOM 0 HG21 ILE A 122 19.959 22.609 5.673 1.00 0.00 H new ATOM 0 HG22 ILE A 122 20.041 23.557 4.169 1.00 0.00 H new ATOM 0 HG23 ILE A 122 19.956 24.388 5.741 1.00 0.00 H new ATOM 0 HD11 ILE A 122 15.910 22.455 7.624 1.00 0.00 H new ATOM 0 HD12 ILE A 122 15.477 22.988 5.982 1.00 0.00 H new ATOM 0 HD13 ILE A 122 16.460 21.523 6.211 1.00 0.00 H new ATOM 1935 N ALA A 123 17.342 24.200 2.010 1.00 0.00 N ATOM 1936 CA ALA A 123 17.731 24.135 0.605 1.00 0.00 C ATOM 1937 C ALA A 123 17.755 25.507 -0.081 1.00 0.00 C ATOM 1938 O ALA A 123 18.380 25.662 -1.128 1.00 0.00 O ATOM 1939 CB ALA A 123 16.775 23.213 -0.160 1.00 0.00 C ATOM 0 H ALA A 123 16.489 23.684 2.227 1.00 0.00 H new ATOM 0 HA ALA A 123 18.748 23.743 0.586 1.00 0.00 H new ATOM 0 HB1 ALA A 123 17.072 23.170 -1.208 1.00 0.00 H new ATOM 0 HB2 ALA A 123 16.813 22.212 0.270 1.00 0.00 H new ATOM 0 HB3 ALA A 123 15.759 23.601 -0.087 1.00 0.00 H new ATOM 1945 N ASP A 124 17.047 26.496 0.465 1.00 0.00 N ATOM 1946 CA ASP A 124 17.049 27.867 -0.040 1.00 0.00 C ATOM 1947 C ASP A 124 18.324 28.614 0.340 1.00 0.00 C ATOM 1948 O ASP A 124 18.635 29.630 -0.276 1.00 0.00 O ATOM 1949 CB ASP A 124 15.813 28.619 0.467 1.00 0.00 C ATOM 1950 CG ASP A 124 14.551 28.292 -0.329 1.00 0.00 C ATOM 1951 OD1 ASP A 124 14.623 27.813 -1.483 1.00 0.00 O ATOM 1952 OD2 ASP A 124 13.435 28.561 0.177 1.00 0.00 O ATOM 0 H ASP A 124 16.449 26.365 1.281 1.00 0.00 H new ATOM 0 HA ASP A 124 17.016 27.818 -1.128 1.00 0.00 H new ATOM 0 HB2 ASP A 124 15.649 28.373 1.516 1.00 0.00 H new ATOM 0 HB3 ASP A 124 16.000 29.692 0.417 1.00 0.00 H new ATOM 1957 N ASN A 125 19.067 28.137 1.343 1.00 0.00 N ATOM 1958 CA ASN A 125 20.368 28.704 1.689 1.00 0.00 C ATOM 1959 C ASN A 125 21.399 28.220 0.669 1.00 0.00 C ATOM 1960 O ASN A 125 22.243 29.006 0.242 1.00 0.00 O ATOM 1961 CB ASN A 125 20.782 28.296 3.115 1.00 0.00 C ATOM 1962 CG ASN A 125 21.934 29.117 3.701 1.00 0.00 C ATOM 1963 OD1 ASN A 125 21.994 29.313 4.908 1.00 0.00 O ATOM 1964 ND2 ASN A 125 22.879 29.614 2.918 1.00 0.00 N ATOM 0 H ASN A 125 18.784 27.354 1.932 1.00 0.00 H new ATOM 0 HA ASN A 125 20.309 29.792 1.664 1.00 0.00 H new ATOM 0 HB2 ASN A 125 19.917 28.388 3.771 1.00 0.00 H new ATOM 0 HB3 ASN A 125 21.068 27.244 3.110 1.00 0.00 H new ATOM 0 HD21 ASN A 125 23.645 30.153 3.322 1.00 0.00 H new ATOM 0 HD22 ASN A 125 22.841 29.458 1.911 1.00 0.00 H new ATOM 1971 N ASN A 126 21.364 26.929 0.321 1.00 0.00 N ATOM 1972 CA ASN A 126 22.146 26.241 -0.696 1.00 0.00 C ATOM 1973 C ASN A 126 21.716 24.775 -0.643 1.00 0.00 C ATOM 1974 O ASN A 126 21.367 24.246 0.414 1.00 0.00 O ATOM 1975 CB ASN A 126 23.662 26.362 -0.441 1.00 0.00 C ATOM 1976 CG ASN A 126 24.509 25.327 -1.184 1.00 0.00 C ATOM 1977 OD1 ASN A 126 25.199 24.538 -0.554 1.00 0.00 O ATOM 1978 ND2 ASN A 126 24.505 25.282 -2.509 1.00 0.00 N ATOM 0 H ASN A 126 20.727 26.286 0.791 1.00 0.00 H new ATOM 0 HA ASN A 126 21.967 26.685 -1.675 1.00 0.00 H new ATOM 0 HB2 ASN A 126 23.989 27.360 -0.733 1.00 0.00 H new ATOM 0 HB3 ASN A 126 23.848 26.266 0.629 1.00 0.00 H new ATOM 0 HD21 ASN A 126 25.075 24.592 -2.998 1.00 0.00 H new ATOM 0 HD22 ASN A 126 23.931 25.938 -3.040 1.00 0.00 H new ATOM 1985 N ILE A 127 21.723 24.135 -1.802 1.00 0.00 N ATOM 1986 CA ILE A 127 21.484 22.708 -2.019 1.00 0.00 C ATOM 1987 C ILE A 127 22.163 22.309 -3.338 1.00 0.00 C ATOM 1988 O ILE A 127 22.600 21.174 -3.528 1.00 0.00 O ATOM 1989 CB ILE A 127 19.961 22.421 -1.989 1.00 0.00 C ATOM 1990 CG1 ILE A 127 19.610 21.079 -1.313 1.00 0.00 C ATOM 1991 CG2 ILE A 127 19.237 22.604 -3.337 1.00 0.00 C ATOM 1992 CD1 ILE A 127 20.211 19.822 -1.949 1.00 0.00 C ATOM 0 H ILE A 127 21.907 24.627 -2.676 1.00 0.00 H new ATOM 0 HA ILE A 127 21.917 22.099 -1.226 1.00 0.00 H new ATOM 0 HB ILE A 127 19.563 23.211 -1.352 1.00 0.00 H new ATOM 0 HG12 ILE A 127 19.934 21.125 -0.273 1.00 0.00 H new ATOM 0 HG13 ILE A 127 18.525 20.973 -1.305 1.00 0.00 H new ATOM 0 HG21 ILE A 127 18.177 22.380 -3.214 1.00 0.00 H new ATOM 0 HG22 ILE A 127 19.354 23.633 -3.676 1.00 0.00 H new ATOM 0 HG23 ILE A 127 19.667 21.928 -4.076 1.00 0.00 H new ATOM 0 HD11 ILE A 127 19.894 18.943 -1.388 1.00 0.00 H new ATOM 0 HD12 ILE A 127 19.868 19.737 -2.980 1.00 0.00 H new ATOM 0 HD13 ILE A 127 21.299 19.890 -1.932 1.00 0.00 H new ATOM 2004 N GLN A 128 22.247 23.263 -4.262 1.00 0.00 N ATOM 2005 CA GLN A 128 22.910 23.265 -5.540 1.00 0.00 C ATOM 2006 C GLN A 128 23.395 24.705 -5.726 1.00 0.00 C ATOM 2007 O GLN A 128 24.123 24.928 -6.709 1.00 0.00 O ATOM 2008 CB GLN A 128 21.894 22.828 -6.609 1.00 0.00 C ATOM 2009 CG GLN A 128 22.538 22.339 -7.911 1.00 0.00 C ATOM 2010 CD GLN A 128 21.517 21.538 -8.716 1.00 0.00 C ATOM 2011 OE1 GLN A 128 21.583 20.313 -8.779 1.00 0.00 O ATOM 2012 NE2 GLN A 128 20.518 22.197 -9.281 1.00 0.00 N ATOM 2013 OXT GLN A 128 23.042 25.550 -4.861 1.00 0.00 O ATOM 0 H GLN A 128 21.790 24.160 -4.100 1.00 0.00 H new ATOM 0 HA GLN A 128 23.753 22.578 -5.615 1.00 0.00 H new ATOM 0 HB2 GLN A 128 21.271 22.032 -6.201 1.00 0.00 H new ATOM 0 HB3 GLN A 128 21.234 23.666 -6.833 1.00 0.00 H new ATOM 0 HG2 GLN A 128 22.892 23.188 -8.495 1.00 0.00 H new ATOM 0 HG3 GLN A 128 23.408 21.721 -7.689 1.00 0.00 H new ATOM 0 HE21 GLN A 128 20.478 23.214 -9.219 1.00 0.00 H new ATOM 0 HE22 GLN A 128 19.788 21.688 -9.778 1.00 0.00 H new TER 2022 GLN A 128