USER MOD reduce.3.24.130724 H: found=0, std=0, add=1275, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1275 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 95 LYS NZ :NH3+ 138:sc= 1.01 (180deg=0) USER MOD Set 1.2: A 147 TYR OH : rot 130:sc= 0.88 USER MOD Set 2.1: A 34 ASN : amide:sc= -1.64 K(o=-2.4,f=-14!) USER MOD Set 2.2: A 37 ASN : amide:sc= -0.751 K(o=-2.4,f=-11!) USER MOD Set 3.1: A 26 ASN : amide:sc= -3.04 K(o=-3.7,f=-10!) USER MOD Set 3.2: A 49 GLN : amide:sc= -0.659 K(o=-3.7,f=-6!) USER MOD Set 4.1: A 18 THR OG1 : rot -79:sc= 0.799 USER MOD Set 4.2: A 24 TYR OH : rot 171:sc= -0.33 USER MOD Set 4.3: A 36 SER OG : rot 120:sc= 1 USER MOD Single : A 1 MET CE :methyl -165:sc= -0.115 (180deg=-0.435) USER MOD Single : A 1 MET N :NH3+ -122:sc= 1.98 (180deg=0.208) USER MOD Single : A 8 LYS NZ :NH3+ 173:sc=-0.00888 (180deg=-0.0795) USER MOD Single : A 10 THR OG1 : rot 37:sc= 0.217 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 39:sc= -0.821 USER MOD Single : A 14 SER OG : rot -2:sc= 1.18 USER MOD Single : A 15 LYS NZ :NH3+ 155:sc= 0.831 (180deg=0.492) USER MOD Single : A 16 GLN : amide:sc= -0.0205 X(o=-0.021,f=-0.35) USER MOD Single : A 20 MET CE :methyl -124:sc= -1.03 (180deg=-3.83) USER MOD Single : A 27 SER OG : rot -23:sc= 0.253 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot -26:sc= 0.122 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= -0.16 X(o=-0.16,f=-0.37) USER MOD Single : A 48 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000778) USER MOD Single : A 52 LYS NZ :NH3+ -168:sc= 0.86 (180deg=0.643) USER MOD Single : A 55 TYR OH : rot 180:sc= -0.214 USER MOD Single : A 58 MET CE :methyl 166:sc= -1.72 (180deg=-1.86) USER MOD Single : A 62 THR OG1 : rot 117:sc= 0.367 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 TYR OH : rot 165:sc= -0.249 USER MOD Single : A 73 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= -1.15 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 86 ASN : amide:sc= -1.95 K(o=-2,f=-5!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 LYS NZ :NH3+ -174:sc=-0.00894 (180deg=-0.0543) USER MOD Single : A 97 SER OG : rot 180:sc= -0.0233 USER MOD Single : A 100 SER OG : rot 180:sc= -0.533 USER MOD Single : A 104 GLN :FLIP amide:sc= -0.024 F(o=-0.75,f=-0.024) USER MOD Single : A 114 GLN : amide:sc= -0.26 X(o=-0.26,f=-0.19) USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 ASN : amide:sc=-0.00735 K(o=-0.0074,f=-0.64) USER MOD Single : A 119 TYR OH : rot -144:sc= 0.302 USER MOD Single : A 120 GLN :FLIP amide:sc= -0.158 F(o=-1.6,f=-0.16) USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 GLN :FLIP amide:sc= -0.173 F(o=-1.1,f=-0.17) USER MOD Single : A 127 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 129 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 HIS : no HD1:sc=-0.00823 K(o=-0.0082,f=-0.59) USER MOD Single : A 140 GLN : amide:sc= -1.17 K(o=-1.2,f=-4.2!) USER MOD Single : A 145 THR OG1 : rot 144:sc= 0.0198 USER MOD Single : A 151 GLN : amide:sc= -0.0147 K(o=-0.015,f=-1.6) USER MOD Single : A 155 HIS : no HD1:sc= -0.347 X(o=-0.35,f=-0.15) USER MOD Single : A 156 HIS : no HD1:sc= -0.248 X(o=-0.25,f=0.032) USER MOD Single : A 157 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 158 HIS : no HD1:sc= -0.0025 X(o=-0.0025,f=-0.23) USER MOD Single : A 159 HIS : no HD1:sc= -0.0361 X(o=-0.036,f=0.0019) USER MOD Single : A 160 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -30.158 -6.222 -7.938 1.00 41.32 N ATOM 2 CA MET A 1 -30.161 -4.874 -7.323 1.00 4.20 C ATOM 3 C MET A 1 -28.994 -4.769 -6.325 1.00 20.42 C ATOM 4 O MET A 1 -29.077 -5.265 -5.199 1.00 32.43 O ATOM 5 CB MET A 1 -31.520 -4.589 -6.609 1.00 74.42 C ATOM 6 CG MET A 1 -32.759 -4.733 -7.505 1.00 41.33 C ATOM 7 SD MET A 1 -34.306 -4.285 -6.677 1.00 64.44 S ATOM 8 CE MET A 1 -34.282 -5.354 -5.233 1.00 22.25 C ATOM 0 H1 MET A 1 -30.080 -6.132 -8.971 1.00 41.32 H new ATOM 0 H2 MET A 1 -29.349 -6.767 -7.576 1.00 41.32 H new ATOM 0 H3 MET A 1 -31.042 -6.715 -7.699 1.00 41.32 H new ATOM 0 HA MET A 1 -30.036 -4.126 -8.106 1.00 4.20 H new ATOM 0 HB2 MET A 1 -31.620 -5.269 -5.763 1.00 74.42 H new ATOM 0 HB3 MET A 1 -31.497 -3.577 -6.204 1.00 74.42 H new ATOM 0 HG2 MET A 1 -32.634 -4.106 -8.388 1.00 41.33 H new ATOM 0 HG3 MET A 1 -32.828 -5.764 -7.853 1.00 41.33 H new ATOM 0 HE1 MET A 1 -35.275 -5.382 -4.784 1.00 22.25 H new ATOM 0 HE2 MET A 1 -33.990 -6.361 -5.531 1.00 22.25 H new ATOM 0 HE3 MET A 1 -33.566 -4.969 -4.507 1.00 22.25 H new ATOM 20 N VAL A 2 -27.887 -4.167 -6.787 1.00 14.22 N ATOM 21 CA VAL A 2 -26.686 -3.877 -5.968 1.00 11.44 C ATOM 22 C VAL A 2 -26.263 -2.419 -6.194 1.00 75.23 C ATOM 23 O VAL A 2 -26.953 -1.670 -6.896 1.00 13.43 O ATOM 24 CB VAL A 2 -25.479 -4.833 -6.325 1.00 70.45 C ATOM 25 CG1 VAL A 2 -25.703 -6.253 -5.775 1.00 14.15 C ATOM 26 CG2 VAL A 2 -25.214 -4.840 -7.849 1.00 2.43 C ATOM 0 H VAL A 2 -27.794 -3.861 -7.755 1.00 14.22 H new ATOM 0 HA VAL A 2 -26.945 -4.046 -4.923 1.00 11.44 H new ATOM 0 HB VAL A 2 -24.585 -4.443 -5.838 1.00 70.45 H new ATOM 0 HG11 VAL A 2 -24.854 -6.884 -6.039 1.00 14.15 H new ATOM 0 HG12 VAL A 2 -25.801 -6.212 -4.690 1.00 14.15 H new ATOM 0 HG13 VAL A 2 -26.613 -6.671 -6.206 1.00 14.15 H new ATOM 0 HG21 VAL A 2 -24.379 -5.505 -8.070 1.00 2.43 H new ATOM 0 HG22 VAL A 2 -26.104 -5.190 -8.372 1.00 2.43 H new ATOM 0 HG23 VAL A 2 -24.971 -3.830 -8.181 1.00 2.43 H new ATOM 36 N GLU A 3 -25.127 -2.030 -5.585 1.00 62.34 N ATOM 37 CA GLU A 3 -24.521 -0.702 -5.787 1.00 64.33 C ATOM 38 C GLU A 3 -24.214 -0.422 -7.282 1.00 61.51 C ATOM 39 O GLU A 3 -24.017 -1.363 -8.065 1.00 5.15 O ATOM 40 CB GLU A 3 -23.226 -0.567 -4.938 1.00 24.33 C ATOM 41 CG GLU A 3 -23.469 -0.549 -3.420 1.00 73.40 C ATOM 42 CD GLU A 3 -24.375 0.610 -2.960 1.00 32.21 C ATOM 43 OE1 GLU A 3 -23.900 1.767 -2.916 1.00 71.34 O ATOM 44 OE2 GLU A 3 -25.565 0.378 -2.651 1.00 3.21 O ATOM 0 H GLU A 3 -24.606 -2.626 -4.942 1.00 62.34 H new ATOM 0 HA GLU A 3 -25.248 0.041 -5.458 1.00 64.33 H new ATOM 0 HB2 GLU A 3 -22.559 -1.395 -5.178 1.00 24.33 H new ATOM 0 HB3 GLU A 3 -22.711 0.350 -5.224 1.00 24.33 H new ATOM 0 HG2 GLU A 3 -23.921 -1.495 -3.120 1.00 73.40 H new ATOM 0 HG3 GLU A 3 -22.510 -0.477 -2.907 1.00 73.40 H new ATOM 51 N PRO A 4 -24.208 0.885 -7.697 1.00 10.41 N ATOM 52 CA PRO A 4 -23.824 1.309 -9.073 1.00 25.14 C ATOM 53 C PRO A 4 -22.456 0.768 -9.550 1.00 43.13 C ATOM 54 O PRO A 4 -21.704 0.160 -8.772 1.00 32.22 O ATOM 55 CB PRO A 4 -23.778 2.849 -8.963 1.00 55.15 C ATOM 56 CG PRO A 4 -24.749 3.185 -7.871 1.00 63.10 C ATOM 57 CD PRO A 4 -24.648 2.052 -6.869 1.00 52.44 C ATOM 0 HA PRO A 4 -24.528 0.920 -9.809 1.00 25.14 H new ATOM 0 HB2 PRO A 4 -22.774 3.198 -8.721 1.00 55.15 H new ATOM 0 HB3 PRO A 4 -24.062 3.321 -9.904 1.00 55.15 H new ATOM 0 HG2 PRO A 4 -24.502 4.140 -7.408 1.00 63.10 H new ATOM 0 HG3 PRO A 4 -25.763 3.273 -8.262 1.00 63.10 H new ATOM 0 HD2 PRO A 4 -23.930 2.277 -6.081 1.00 52.44 H new ATOM 0 HD3 PRO A 4 -25.605 1.860 -6.383 1.00 52.44 H new ATOM 65 N GLY A 5 -22.135 1.010 -10.837 1.00 11.13 N ATOM 66 CA GLY A 5 -20.830 0.645 -11.399 1.00 4.15 C ATOM 67 C GLY A 5 -19.710 1.570 -10.917 1.00 23.23 C ATOM 68 O GLY A 5 -19.155 2.357 -11.688 1.00 32.43 O ATOM 0 H GLY A 5 -22.766 1.457 -11.503 1.00 11.13 H new ATOM 0 HA2 GLY A 5 -20.593 -0.383 -11.124 1.00 4.15 H new ATOM 0 HA3 GLY A 5 -20.883 0.679 -12.487 1.00 4.15 H new ATOM 72 N VAL A 6 -19.383 1.464 -9.618 1.00 14.32 N ATOM 73 CA VAL A 6 -18.328 2.257 -8.960 1.00 61.43 C ATOM 74 C VAL A 6 -17.054 1.405 -8.776 1.00 15.15 C ATOM 75 O VAL A 6 -16.099 1.827 -8.110 1.00 2.12 O ATOM 76 CB VAL A 6 -18.831 2.826 -7.575 1.00 70.44 C ATOM 77 CG1 VAL A 6 -20.023 3.791 -7.775 1.00 52.13 C ATOM 78 CG2 VAL A 6 -19.199 1.687 -6.591 1.00 55.53 C ATOM 0 H VAL A 6 -19.851 0.815 -8.985 1.00 14.32 H new ATOM 0 HA VAL A 6 -18.085 3.106 -9.600 1.00 61.43 H new ATOM 0 HB VAL A 6 -18.009 3.388 -7.133 1.00 70.44 H new ATOM 0 HG11 VAL A 6 -20.351 4.169 -6.807 1.00 52.13 H new ATOM 0 HG12 VAL A 6 -19.714 4.625 -8.405 1.00 52.13 H new ATOM 0 HG13 VAL A 6 -20.845 3.259 -8.254 1.00 52.13 H new ATOM 0 HG21 VAL A 6 -19.541 2.116 -5.649 1.00 55.53 H new ATOM 0 HG22 VAL A 6 -19.993 1.077 -7.021 1.00 55.53 H new ATOM 0 HG23 VAL A 6 -18.322 1.066 -6.410 1.00 55.53 H new ATOM 88 N ALA A 7 -17.057 0.208 -9.399 1.00 31.12 N ATOM 89 CA ALA A 7 -15.914 -0.723 -9.401 1.00 25.31 C ATOM 90 C ALA A 7 -14.821 -0.242 -10.389 1.00 53.03 C ATOM 91 O ALA A 7 -14.927 0.868 -10.929 1.00 43.40 O ATOM 92 CB ALA A 7 -16.405 -2.135 -9.757 1.00 70.21 C ATOM 0 H ALA A 7 -17.862 -0.141 -9.919 1.00 31.12 H new ATOM 0 HA ALA A 7 -15.468 -0.749 -8.407 1.00 25.31 H new ATOM 0 HB1 ALA A 7 -15.561 -2.824 -9.759 1.00 70.21 H new ATOM 0 HB2 ALA A 7 -17.139 -2.462 -9.020 1.00 70.21 H new ATOM 0 HB3 ALA A 7 -16.865 -2.122 -10.745 1.00 70.21 H new ATOM 98 N LYS A 8 -13.786 -1.092 -10.625 1.00 43.13 N ATOM 99 CA LYS A 8 -12.608 -0.752 -11.464 1.00 22.41 C ATOM 100 C LYS A 8 -11.862 0.446 -10.846 1.00 42.43 C ATOM 101 O LYS A 8 -12.112 1.603 -11.220 1.00 13.33 O ATOM 102 CB LYS A 8 -12.965 -0.459 -12.972 1.00 11.32 C ATOM 103 CG LYS A 8 -13.283 -1.686 -13.858 1.00 3.43 C ATOM 104 CD LYS A 8 -14.558 -2.440 -13.448 1.00 14.21 C ATOM 105 CE LYS A 8 -14.908 -3.555 -14.448 1.00 72.41 C ATOM 106 NZ LYS A 8 -13.792 -4.524 -14.627 1.00 22.53 N ATOM 0 H LYS A 8 -13.747 -2.034 -10.237 1.00 43.13 H new ATOM 0 HA LYS A 8 -11.966 -1.633 -11.476 1.00 22.41 H new ATOM 0 HB2 LYS A 8 -13.825 0.210 -12.995 1.00 11.32 H new ATOM 0 HB3 LYS A 8 -12.130 0.079 -13.422 1.00 11.32 H new ATOM 0 HG2 LYS A 8 -13.384 -1.358 -14.892 1.00 3.43 H new ATOM 0 HG3 LYS A 8 -12.439 -2.375 -13.823 1.00 3.43 H new ATOM 0 HD2 LYS A 8 -14.423 -2.871 -12.456 1.00 14.21 H new ATOM 0 HD3 LYS A 8 -15.389 -1.738 -13.380 1.00 14.21 H new ATOM 0 HE2 LYS A 8 -15.795 -4.086 -14.101 1.00 72.41 H new ATOM 0 HE3 LYS A 8 -15.158 -3.111 -15.411 1.00 72.41 H new ATOM 0 HZ1 LYS A 8 -14.114 -5.319 -15.215 1.00 22.53 H new ATOM 0 HZ2 LYS A 8 -12.992 -4.050 -15.093 1.00 22.53 H new ATOM 0 HZ3 LYS A 8 -13.490 -4.881 -13.698 1.00 22.53 H new ATOM 120 N LEU A 9 -10.986 0.170 -9.865 1.00 12.23 N ATOM 121 CA LEU A 9 -10.148 1.218 -9.268 1.00 11.14 C ATOM 122 C LEU A 9 -9.057 1.631 -10.272 1.00 40.01 C ATOM 123 O LEU A 9 -8.577 0.809 -11.065 1.00 22.23 O ATOM 124 CB LEU A 9 -9.522 0.775 -7.910 1.00 15.14 C ATOM 125 CG LEU A 9 -8.732 1.886 -7.127 1.00 31.23 C ATOM 126 CD1 LEU A 9 -9.620 3.115 -6.820 1.00 34.00 C ATOM 127 CD2 LEU A 9 -8.098 1.319 -5.837 1.00 33.21 C ATOM 0 H LEU A 9 -10.842 -0.761 -9.473 1.00 12.23 H new ATOM 0 HA LEU A 9 -10.783 2.076 -9.047 1.00 11.14 H new ATOM 0 HB2 LEU A 9 -10.320 0.402 -7.268 1.00 15.14 H new ATOM 0 HB3 LEU A 9 -8.847 -0.060 -8.098 1.00 15.14 H new ATOM 0 HG LEU A 9 -7.924 2.225 -7.776 1.00 31.23 H new ATOM 0 HD11 LEU A 9 -9.036 3.859 -6.278 1.00 34.00 H new ATOM 0 HD12 LEU A 9 -9.980 3.546 -7.754 1.00 34.00 H new ATOM 0 HD13 LEU A 9 -10.470 2.807 -6.211 1.00 34.00 H new ATOM 0 HD21 LEU A 9 -7.559 2.111 -5.318 1.00 33.21 H new ATOM 0 HD22 LEU A 9 -8.882 0.928 -5.188 1.00 33.21 H new ATOM 0 HD23 LEU A 9 -7.406 0.517 -6.094 1.00 33.21 H new ATOM 139 N THR A 10 -8.716 2.922 -10.222 1.00 70.21 N ATOM 140 CA THR A 10 -7.723 3.568 -11.082 1.00 5.33 C ATOM 141 C THR A 10 -6.367 2.812 -11.079 1.00 33.31 C ATOM 142 O THR A 10 -5.591 2.892 -10.116 1.00 30.45 O ATOM 143 CB THR A 10 -7.553 5.038 -10.589 1.00 72.34 C ATOM 144 OG1 THR A 10 -7.272 5.036 -9.179 1.00 72.34 O ATOM 145 CG2 THR A 10 -8.820 5.878 -10.847 1.00 25.50 C ATOM 0 H THR A 10 -9.140 3.569 -9.557 1.00 70.21 H new ATOM 0 HA THR A 10 -8.070 3.552 -12.115 1.00 5.33 H new ATOM 0 HB THR A 10 -6.730 5.485 -11.146 1.00 72.34 H new ATOM 0 HG1 THR A 10 -6.697 4.273 -8.961 1.00 72.34 H new ATOM 0 HG21 THR A 10 -8.661 6.895 -10.489 1.00 25.50 H new ATOM 0 HG22 THR A 10 -9.032 5.898 -11.916 1.00 25.50 H new ATOM 0 HG23 THR A 10 -9.664 5.435 -10.318 1.00 25.50 H new ATOM 153 N THR A 11 -6.125 2.052 -12.163 1.00 12.12 N ATOM 154 CA THR A 11 -4.951 1.178 -12.298 1.00 44.31 C ATOM 155 C THR A 11 -3.644 1.993 -12.433 1.00 14.14 C ATOM 156 O THR A 11 -2.605 1.589 -11.911 1.00 11.40 O ATOM 157 CB THR A 11 -5.121 0.208 -13.512 1.00 21.25 C ATOM 158 OG1 THR A 11 -5.376 0.959 -14.711 1.00 53.24 O ATOM 159 CG2 THR A 11 -6.269 -0.796 -13.293 1.00 72.13 C ATOM 0 H THR A 11 -6.744 2.029 -12.973 1.00 12.12 H new ATOM 0 HA THR A 11 -4.878 0.586 -11.386 1.00 44.31 H new ATOM 0 HB THR A 11 -4.192 -0.353 -13.609 1.00 21.25 H new ATOM 0 HG1 THR A 11 -5.479 0.344 -15.467 1.00 53.24 H new ATOM 0 HG21 THR A 11 -6.351 -1.450 -14.161 1.00 72.13 H new ATOM 0 HG22 THR A 11 -6.064 -1.395 -12.406 1.00 72.13 H new ATOM 0 HG23 THR A 11 -7.205 -0.254 -13.157 1.00 72.13 H new ATOM 167 N TYR A 12 -3.719 3.156 -13.110 1.00 24.53 N ATOM 168 CA TYR A 12 -2.565 4.075 -13.257 1.00 33.12 C ATOM 169 C TYR A 12 -2.054 4.562 -11.881 1.00 15.41 C ATOM 170 O TYR A 12 -0.854 4.757 -11.689 1.00 75.12 O ATOM 171 CB TYR A 12 -2.931 5.282 -14.169 1.00 50.15 C ATOM 172 CG TYR A 12 -4.107 6.144 -13.674 1.00 41.43 C ATOM 173 CD1 TYR A 12 -3.915 7.152 -12.726 1.00 2.11 C ATOM 174 CD2 TYR A 12 -5.405 5.935 -14.138 1.00 41.52 C ATOM 175 CE1 TYR A 12 -4.961 7.906 -12.265 1.00 74.23 C ATOM 176 CE2 TYR A 12 -6.454 6.698 -13.674 1.00 64.45 C ATOM 177 CZ TYR A 12 -6.225 7.678 -12.736 1.00 42.24 C ATOM 178 OH TYR A 12 -7.272 8.436 -12.266 1.00 63.54 O ATOM 0 H TYR A 12 -4.570 3.485 -13.567 1.00 24.53 H new ATOM 0 HA TYR A 12 -1.758 3.519 -13.733 1.00 33.12 H new ATOM 0 HB2 TYR A 12 -2.052 5.919 -14.272 1.00 50.15 H new ATOM 0 HB3 TYR A 12 -3.170 4.906 -15.164 1.00 50.15 H new ATOM 0 HD1 TYR A 12 -2.921 7.341 -12.349 1.00 2.11 H new ATOM 0 HD2 TYR A 12 -5.591 5.164 -14.871 1.00 41.52 H new ATOM 0 HE1 TYR A 12 -4.788 8.679 -11.531 1.00 74.23 H new ATOM 0 HE2 TYR A 12 -7.454 6.527 -14.046 1.00 64.45 H new ATOM 0 HH TYR A 12 -6.980 9.365 -12.158 1.00 63.54 H new ATOM 188 N ALA A 13 -2.998 4.725 -10.934 1.00 44.34 N ATOM 189 CA ALA A 13 -2.715 5.227 -9.585 1.00 1.52 C ATOM 190 C ALA A 13 -1.860 4.226 -8.805 1.00 74.40 C ATOM 191 O ALA A 13 -0.932 4.617 -8.090 1.00 52.23 O ATOM 192 CB ALA A 13 -4.029 5.511 -8.851 1.00 32.12 C ATOM 0 H ALA A 13 -3.983 4.509 -11.089 1.00 44.34 H new ATOM 0 HA ALA A 13 -2.151 6.156 -9.664 1.00 1.52 H new ATOM 0 HB1 ALA A 13 -3.813 5.884 -7.850 1.00 32.12 H new ATOM 0 HB2 ALA A 13 -4.599 6.259 -9.402 1.00 32.12 H new ATOM 0 HB3 ALA A 13 -4.611 4.592 -8.779 1.00 32.12 H new ATOM 198 N SER A 14 -2.175 2.926 -8.978 1.00 1.15 N ATOM 199 CA SER A 14 -1.439 1.837 -8.331 1.00 23.55 C ATOM 200 C SER A 14 -0.049 1.662 -8.951 1.00 34.52 C ATOM 201 O SER A 14 0.920 1.412 -8.229 1.00 61.13 O ATOM 202 CB SER A 14 -2.253 0.520 -8.377 1.00 65.12 C ATOM 203 OG SER A 14 -2.601 0.135 -9.696 1.00 63.32 O ATOM 0 H SER A 14 -2.944 2.610 -9.569 1.00 1.15 H new ATOM 0 HA SER A 14 -1.295 2.101 -7.283 1.00 23.55 H new ATOM 0 HB2 SER A 14 -1.673 -0.277 -7.912 1.00 65.12 H new ATOM 0 HB3 SER A 14 -3.161 0.639 -7.786 1.00 65.12 H new ATOM 0 HG SER A 14 -2.280 0.810 -10.329 1.00 63.32 H new ATOM 209 N LYS A 15 0.034 1.839 -10.288 1.00 21.01 N ATOM 210 CA LYS A 15 1.301 1.735 -11.047 1.00 71.12 C ATOM 211 C LYS A 15 2.330 2.762 -10.556 1.00 42.43 C ATOM 212 O LYS A 15 3.457 2.406 -10.204 1.00 45.43 O ATOM 213 CB LYS A 15 1.051 1.947 -12.566 1.00 63.04 C ATOM 214 CG LYS A 15 0.160 0.881 -13.224 1.00 14.23 C ATOM 215 CD LYS A 15 0.805 -0.519 -13.247 1.00 71.21 C ATOM 216 CE LYS A 15 -0.157 -1.590 -13.775 1.00 45.34 C ATOM 217 NZ LYS A 15 0.499 -2.923 -13.857 1.00 71.34 N ATOM 0 H LYS A 15 -0.774 2.058 -10.871 1.00 21.01 H new ATOM 0 HA LYS A 15 1.697 0.733 -10.881 1.00 71.12 H new ATOM 0 HB2 LYS A 15 0.593 2.925 -12.712 1.00 63.04 H new ATOM 0 HB3 LYS A 15 2.012 1.965 -13.080 1.00 63.04 H new ATOM 0 HG2 LYS A 15 -0.788 0.828 -12.689 1.00 14.23 H new ATOM 0 HG3 LYS A 15 -0.067 1.186 -14.245 1.00 14.23 H new ATOM 0 HD2 LYS A 15 1.698 -0.496 -13.871 1.00 71.21 H new ATOM 0 HD3 LYS A 15 1.126 -0.786 -12.240 1.00 71.21 H new ATOM 0 HE2 LYS A 15 -1.027 -1.652 -13.122 1.00 45.34 H new ATOM 0 HE3 LYS A 15 -0.519 -1.300 -14.762 1.00 45.34 H new ATOM 0 HZ1 LYS A 15 -0.223 -3.669 -13.798 1.00 71.34 H new ATOM 0 HZ2 LYS A 15 1.008 -3.004 -14.760 1.00 71.34 H new ATOM 0 HZ3 LYS A 15 1.171 -3.028 -13.070 1.00 71.34 H new ATOM 231 N GLN A 16 1.903 4.036 -10.528 1.00 50.34 N ATOM 232 CA GLN A 16 2.765 5.172 -10.174 1.00 14.01 C ATOM 233 C GLN A 16 3.163 5.126 -8.690 1.00 72.34 C ATOM 234 O GLN A 16 4.308 5.431 -8.350 1.00 52.12 O ATOM 235 CB GLN A 16 2.056 6.504 -10.518 1.00 5.14 C ATOM 236 CG GLN A 16 1.774 6.704 -12.032 1.00 5.52 C ATOM 237 CD GLN A 16 3.041 6.765 -12.898 1.00 20.52 C ATOM 238 OE1 GLN A 16 4.096 7.206 -12.451 1.00 72.33 O ATOM 239 NE2 GLN A 16 2.941 6.364 -14.154 1.00 5.42 N ATOM 0 H GLN A 16 0.945 4.306 -10.752 1.00 50.34 H new ATOM 0 HA GLN A 16 3.682 5.105 -10.760 1.00 14.01 H new ATOM 0 HB2 GLN A 16 1.112 6.551 -9.975 1.00 5.14 H new ATOM 0 HB3 GLN A 16 2.670 7.331 -10.162 1.00 5.14 H new ATOM 0 HG2 GLN A 16 1.143 5.888 -12.385 1.00 5.52 H new ATOM 0 HG3 GLN A 16 1.208 7.626 -12.168 1.00 5.52 H new ATOM 0 HE21 GLN A 16 2.055 6.001 -14.504 1.00 5.42 H new ATOM 0 HE22 GLN A 16 3.750 6.418 -14.772 1.00 5.42 H new ATOM 248 N ALA A 17 2.210 4.715 -7.826 1.00 25.12 N ATOM 249 CA ALA A 17 2.436 4.601 -6.373 1.00 12.24 C ATOM 250 C ALA A 17 3.584 3.628 -6.063 1.00 25.41 C ATOM 251 O ALA A 17 4.541 3.985 -5.370 1.00 25.40 O ATOM 252 CB ALA A 17 1.155 4.154 -5.653 1.00 12.13 C ATOM 0 H ALA A 17 1.268 4.455 -8.116 1.00 25.12 H new ATOM 0 HA ALA A 17 2.716 5.589 -6.006 1.00 12.24 H new ATOM 0 HB1 ALA A 17 1.347 4.077 -4.583 1.00 12.13 H new ATOM 0 HB2 ALA A 17 0.365 4.884 -5.828 1.00 12.13 H new ATOM 0 HB3 ALA A 17 0.842 3.183 -6.036 1.00 12.13 H new ATOM 258 N THR A 18 3.478 2.409 -6.617 1.00 53.41 N ATOM 259 CA THR A 18 4.444 1.325 -6.379 1.00 34.41 C ATOM 260 C THR A 18 5.813 1.627 -7.015 1.00 64.13 C ATOM 261 O THR A 18 6.859 1.307 -6.434 1.00 0.11 O ATOM 262 CB THR A 18 3.888 -0.025 -6.915 1.00 41.43 C ATOM 263 OG1 THR A 18 3.484 0.123 -8.283 1.00 3.10 O ATOM 264 CG2 THR A 18 2.695 -0.534 -6.095 1.00 73.54 C ATOM 0 H THR A 18 2.717 2.147 -7.244 1.00 53.41 H new ATOM 0 HA THR A 18 4.590 1.249 -5.302 1.00 34.41 H new ATOM 0 HB THR A 18 4.691 -0.757 -6.829 1.00 41.43 H new ATOM 0 HG1 THR A 18 2.608 0.560 -8.320 1.00 3.10 H new ATOM 0 HG21 THR A 18 2.345 -1.479 -6.510 1.00 73.54 H new ATOM 0 HG22 THR A 18 3.002 -0.684 -5.060 1.00 73.54 H new ATOM 0 HG23 THR A 18 1.889 0.199 -6.131 1.00 73.54 H new ATOM 272 N ASP A 19 5.763 2.252 -8.204 1.00 45.42 N ATOM 273 CA ASP A 19 6.948 2.702 -8.969 1.00 21.20 C ATOM 274 C ASP A 19 7.849 3.604 -8.109 1.00 62.41 C ATOM 275 O ASP A 19 9.056 3.366 -7.983 1.00 22.45 O ATOM 276 CB ASP A 19 6.465 3.462 -10.238 1.00 14.33 C ATOM 277 CG ASP A 19 7.588 4.134 -11.057 1.00 24.14 C ATOM 278 OD1 ASP A 19 8.183 3.468 -11.930 1.00 33.24 O ATOM 279 OD2 ASP A 19 7.863 5.336 -10.846 1.00 64.13 O ATOM 0 H ASP A 19 4.882 2.465 -8.673 1.00 45.42 H new ATOM 0 HA ASP A 19 7.539 1.834 -9.262 1.00 21.20 H new ATOM 0 HB2 ASP A 19 5.933 2.762 -10.883 1.00 14.33 H new ATOM 0 HB3 ASP A 19 5.748 4.226 -9.936 1.00 14.33 H new ATOM 284 N MET A 20 7.222 4.617 -7.495 1.00 50.22 N ATOM 285 CA MET A 20 7.923 5.615 -6.670 1.00 52.14 C ATOM 286 C MET A 20 8.221 5.063 -5.262 1.00 74.52 C ATOM 287 O MET A 20 9.185 5.499 -4.619 1.00 13.53 O ATOM 288 CB MET A 20 7.081 6.913 -6.585 1.00 74.53 C ATOM 289 CG MET A 20 6.800 7.578 -7.945 1.00 50.43 C ATOM 290 SD MET A 20 5.789 9.072 -7.788 1.00 5.11 S ATOM 291 CE MET A 20 4.300 8.411 -7.030 1.00 33.30 C ATOM 0 H MET A 20 6.215 4.769 -7.555 1.00 50.22 H new ATOM 0 HA MET A 20 8.878 5.844 -7.142 1.00 52.14 H new ATOM 0 HB2 MET A 20 6.131 6.684 -6.103 1.00 74.53 H new ATOM 0 HB3 MET A 20 7.600 7.627 -5.945 1.00 74.53 H new ATOM 0 HG2 MET A 20 7.745 7.831 -8.425 1.00 50.43 H new ATOM 0 HG3 MET A 20 6.293 6.866 -8.596 1.00 50.43 H new ATOM 0 HE1 MET A 20 3.436 8.660 -7.646 1.00 33.30 H new ATOM 0 HE2 MET A 20 4.385 7.328 -6.946 1.00 33.30 H new ATOM 0 HE3 MET A 20 4.174 8.843 -6.037 1.00 33.30 H new ATOM 301 N GLY A 21 7.394 4.103 -4.799 1.00 3.13 N ATOM 302 CA GLY A 21 7.605 3.444 -3.504 1.00 31.24 C ATOM 303 C GLY A 21 6.297 3.113 -2.793 1.00 63.12 C ATOM 304 O GLY A 21 5.789 3.924 -2.011 1.00 24.40 O ATOM 0 H GLY A 21 6.575 3.770 -5.307 1.00 3.13 H new ATOM 0 HA2 GLY A 21 8.174 2.527 -3.656 1.00 31.24 H new ATOM 0 HA3 GLY A 21 8.207 4.090 -2.866 1.00 31.24 H new ATOM 308 N ALA A 22 5.737 1.922 -3.096 1.00 72.31 N ATOM 309 CA ALA A 22 4.555 1.374 -2.394 1.00 60.00 C ATOM 310 C ALA A 22 4.506 -0.154 -2.542 1.00 60.33 C ATOM 311 O ALA A 22 4.970 -0.707 -3.545 1.00 74.41 O ATOM 312 CB ALA A 22 3.248 2.023 -2.886 1.00 65.30 C ATOM 0 H ALA A 22 6.091 1.313 -3.834 1.00 72.31 H new ATOM 0 HA ALA A 22 4.652 1.616 -1.336 1.00 60.00 H new ATOM 0 HB1 ALA A 22 2.403 1.594 -2.347 1.00 65.30 H new ATOM 0 HB2 ALA A 22 3.285 3.097 -2.707 1.00 65.30 H new ATOM 0 HB3 ALA A 22 3.129 1.837 -3.953 1.00 65.30 H new ATOM 318 N ILE A 23 3.941 -0.823 -1.521 1.00 15.21 N ATOM 319 CA ILE A 23 3.846 -2.304 -1.453 1.00 73.32 C ATOM 320 C ILE A 23 2.379 -2.748 -1.296 1.00 35.11 C ATOM 321 O ILE A 23 1.492 -1.912 -1.085 1.00 42.42 O ATOM 322 CB ILE A 23 4.753 -2.884 -0.280 1.00 55.14 C ATOM 323 CG1 ILE A 23 4.444 -2.220 1.122 1.00 5.10 C ATOM 324 CG2 ILE A 23 6.256 -2.745 -0.639 1.00 3.34 C ATOM 325 CD1 ILE A 23 3.307 -2.846 1.919 1.00 1.55 C ATOM 0 H ILE A 23 3.533 -0.354 -0.712 1.00 15.21 H new ATOM 0 HA ILE A 23 4.223 -2.712 -2.391 1.00 73.32 H new ATOM 0 HB ILE A 23 4.507 -3.941 -0.181 1.00 55.14 H new ATOM 0 HG12 ILE A 23 5.350 -2.257 1.727 1.00 5.10 H new ATOM 0 HG13 ILE A 23 4.212 -1.167 0.960 1.00 5.10 H new ATOM 0 HG21 ILE A 23 6.863 -3.146 0.173 1.00 3.34 H new ATOM 0 HG22 ILE A 23 6.464 -3.298 -1.555 1.00 3.34 H new ATOM 0 HG23 ILE A 23 6.499 -1.693 -0.788 1.00 3.34 H new ATOM 0 HD11 ILE A 23 3.185 -2.311 2.861 1.00 1.55 H new ATOM 0 HD12 ILE A 23 2.383 -2.784 1.344 1.00 1.55 H new ATOM 0 HD13 ILE A 23 3.538 -3.891 2.123 1.00 1.55 H new ATOM 337 N TYR A 24 2.138 -4.071 -1.396 1.00 4.00 N ATOM 338 CA TYR A 24 0.810 -4.670 -1.148 1.00 44.10 C ATOM 339 C TYR A 24 0.864 -5.648 0.031 1.00 35.05 C ATOM 340 O TYR A 24 1.669 -6.590 0.036 1.00 14.52 O ATOM 341 CB TYR A 24 0.281 -5.414 -2.400 1.00 72.41 C ATOM 342 CG TYR A 24 -0.152 -4.507 -3.551 1.00 42.23 C ATOM 343 CD1 TYR A 24 -1.394 -3.873 -3.524 1.00 53.13 C ATOM 344 CD2 TYR A 24 0.662 -4.300 -4.666 1.00 34.35 C ATOM 345 CE1 TYR A 24 -1.803 -3.069 -4.564 1.00 71.40 C ATOM 346 CE2 TYR A 24 0.253 -3.493 -5.704 1.00 42.11 C ATOM 347 CZ TYR A 24 -0.980 -2.882 -5.650 1.00 12.33 C ATOM 348 OH TYR A 24 -1.387 -2.082 -6.687 1.00 31.33 O ATOM 0 H TYR A 24 2.854 -4.752 -1.650 1.00 4.00 H new ATOM 0 HA TYR A 24 0.130 -3.852 -0.911 1.00 44.10 H new ATOM 0 HB2 TYR A 24 1.059 -6.088 -2.760 1.00 72.41 H new ATOM 0 HB3 TYR A 24 -0.566 -6.033 -2.106 1.00 72.41 H new ATOM 0 HD1 TYR A 24 -2.045 -4.015 -2.674 1.00 53.13 H new ATOM 0 HD2 TYR A 24 1.628 -4.780 -4.715 1.00 34.35 H new ATOM 0 HE1 TYR A 24 -2.768 -2.586 -4.527 1.00 71.40 H new ATOM 0 HE2 TYR A 24 0.897 -3.340 -6.557 1.00 42.11 H new ATOM 0 HH TYR A 24 -0.639 -1.941 -7.305 1.00 31.33 H new ATOM 358 N VAL A 25 -0.007 -5.410 1.018 1.00 4.25 N ATOM 359 CA VAL A 25 -0.304 -6.364 2.093 1.00 13.21 C ATOM 360 C VAL A 25 -1.798 -6.709 2.056 1.00 41.14 C ATOM 361 O VAL A 25 -2.621 -5.864 1.737 1.00 53.51 O ATOM 362 CB VAL A 25 0.091 -5.819 3.518 1.00 24.13 C ATOM 363 CG1 VAL A 25 1.613 -5.609 3.635 1.00 14.32 C ATOM 364 CG2 VAL A 25 -0.690 -4.538 3.888 1.00 44.24 C ATOM 0 H VAL A 25 -0.532 -4.539 1.094 1.00 4.25 H new ATOM 0 HA VAL A 25 0.299 -7.256 1.922 1.00 13.21 H new ATOM 0 HB VAL A 25 -0.194 -6.582 4.243 1.00 24.13 H new ATOM 0 HG11 VAL A 25 1.853 -5.233 4.629 1.00 14.32 H new ATOM 0 HG12 VAL A 25 2.125 -6.558 3.473 1.00 14.32 H new ATOM 0 HG13 VAL A 25 1.939 -4.888 2.886 1.00 14.32 H new ATOM 0 HG21 VAL A 25 -0.385 -4.199 4.878 1.00 44.24 H new ATOM 0 HG22 VAL A 25 -0.478 -3.758 3.156 1.00 44.24 H new ATOM 0 HG23 VAL A 25 -1.759 -4.752 3.891 1.00 44.24 H new ATOM 374 N ASN A 26 -2.128 -7.964 2.351 1.00 52.22 N ATOM 375 CA ASN A 26 -3.527 -8.421 2.502 1.00 55.43 C ATOM 376 C ASN A 26 -4.121 -7.971 3.857 1.00 43.44 C ATOM 377 O ASN A 26 -3.465 -7.241 4.611 1.00 45.32 O ATOM 378 CB ASN A 26 -3.593 -9.957 2.385 1.00 41.43 C ATOM 379 CG ASN A 26 -2.696 -10.671 3.401 1.00 21.43 C ATOM 380 OD1 ASN A 26 -1.569 -10.270 3.660 1.00 13.22 O ATOM 381 ND2 ASN A 26 -3.208 -11.683 4.036 1.00 51.44 N ATOM 0 H ASN A 26 -1.439 -8.702 2.494 1.00 52.22 H new ATOM 0 HA ASN A 26 -4.118 -7.969 1.706 1.00 55.43 H new ATOM 0 HB2 ASN A 26 -4.624 -10.283 2.525 1.00 41.43 H new ATOM 0 HB3 ASN A 26 -3.299 -10.253 1.378 1.00 41.43 H new ATOM 0 HD21 ASN A 26 -2.669 -12.155 4.762 1.00 51.44 H new ATOM 0 HD22 ASN A 26 -4.149 -12.005 3.808 1.00 51.44 H new ATOM 388 N SER A 27 -5.361 -8.433 4.169 1.00 30.35 N ATOM 389 CA SER A 27 -6.059 -8.062 5.422 1.00 51.45 C ATOM 390 C SER A 27 -5.413 -8.717 6.652 1.00 30.34 C ATOM 391 O SER A 27 -5.730 -8.345 7.789 1.00 41.40 O ATOM 392 CB SER A 27 -7.567 -8.380 5.346 1.00 44.20 C ATOM 393 OG SER A 27 -8.276 -7.856 6.462 1.00 3.54 O ATOM 0 H SER A 27 -5.894 -9.062 3.569 1.00 30.35 H new ATOM 0 HA SER A 27 -5.954 -6.983 5.537 1.00 51.45 H new ATOM 0 HB2 SER A 27 -7.980 -7.965 4.426 1.00 44.20 H new ATOM 0 HB3 SER A 27 -7.709 -9.460 5.300 1.00 44.20 H new ATOM 0 HG SER A 27 -7.657 -7.726 7.211 1.00 3.54 H new ATOM 399 N LYS A 28 -4.512 -9.689 6.440 1.00 44.53 N ATOM 400 CA LYS A 28 -3.592 -10.114 7.502 1.00 30.54 C ATOM 401 C LYS A 28 -2.484 -9.052 7.606 1.00 21.42 C ATOM 402 O LYS A 28 -2.411 -8.315 8.582 1.00 51.41 O ATOM 403 CB LYS A 28 -2.994 -11.517 7.226 1.00 24.43 C ATOM 404 CG LYS A 28 -4.039 -12.613 6.928 1.00 3.02 C ATOM 405 CD LYS A 28 -5.014 -12.878 8.088 1.00 44.11 C ATOM 406 CE LYS A 28 -6.061 -13.938 7.714 1.00 5.42 C ATOM 407 NZ LYS A 28 -6.887 -14.345 8.880 1.00 33.25 N ATOM 0 H LYS A 28 -4.403 -10.188 5.557 1.00 44.53 H new ATOM 0 HA LYS A 28 -4.134 -10.198 8.444 1.00 30.54 H new ATOM 0 HB2 LYS A 28 -2.310 -11.446 6.380 1.00 24.43 H new ATOM 0 HB3 LYS A 28 -2.403 -11.822 8.090 1.00 24.43 H new ATOM 0 HG2 LYS A 28 -4.610 -12.326 6.045 1.00 3.02 H new ATOM 0 HG3 LYS A 28 -3.519 -13.540 6.684 1.00 3.02 H new ATOM 0 HD2 LYS A 28 -4.457 -13.209 8.964 1.00 44.11 H new ATOM 0 HD3 LYS A 28 -5.516 -11.950 8.362 1.00 44.11 H new ATOM 0 HE2 LYS A 28 -6.709 -13.546 6.931 1.00 5.42 H new ATOM 0 HE3 LYS A 28 -5.559 -14.814 7.303 1.00 5.42 H new ATOM 0 HZ1 LYS A 28 -7.580 -15.061 8.582 1.00 33.25 H new ATOM 0 HZ2 LYS A 28 -6.273 -14.744 9.618 1.00 33.25 H new ATOM 0 HZ3 LYS A 28 -7.388 -13.515 9.257 1.00 33.25 H new ATOM 421 N GLY A 29 -1.693 -8.923 6.533 1.00 10.54 N ATOM 422 CA GLY A 29 -0.547 -8.014 6.503 1.00 72.10 C ATOM 423 C GLY A 29 0.725 -8.755 6.130 1.00 73.32 C ATOM 424 O GLY A 29 1.664 -8.829 6.916 1.00 21.40 O ATOM 0 H GLY A 29 -1.831 -9.444 5.667 1.00 10.54 H new ATOM 0 HA2 GLY A 29 -0.731 -7.215 5.785 1.00 72.10 H new ATOM 0 HA3 GLY A 29 -0.425 -7.544 7.479 1.00 72.10 H new ATOM 428 N ASP A 30 0.747 -9.297 4.913 1.00 22.33 N ATOM 429 CA ASP A 30 1.838 -10.163 4.412 1.00 5.24 C ATOM 430 C ASP A 30 2.255 -9.678 3.021 1.00 73.54 C ATOM 431 O ASP A 30 1.438 -9.082 2.310 1.00 74.22 O ATOM 432 CB ASP A 30 1.345 -11.637 4.359 1.00 60.31 C ATOM 433 CG ASP A 30 2.388 -12.618 3.794 1.00 51.13 C ATOM 434 OD1 ASP A 30 3.350 -12.947 4.517 1.00 74.15 O ATOM 435 OD2 ASP A 30 2.259 -13.047 2.629 1.00 43.42 O ATOM 0 H ASP A 30 0.003 -9.151 4.231 1.00 22.33 H new ATOM 0 HA ASP A 30 2.699 -10.112 5.078 1.00 5.24 H new ATOM 0 HB2 ASP A 30 1.068 -11.954 5.364 1.00 60.31 H new ATOM 0 HB3 ASP A 30 0.443 -11.688 3.749 1.00 60.31 H new ATOM 440 N ARG A 31 3.524 -9.933 2.640 1.00 21.01 N ATOM 441 CA ARG A 31 4.046 -9.578 1.309 1.00 53.32 C ATOM 442 C ARG A 31 3.448 -10.519 0.221 1.00 43.41 C ATOM 443 O ARG A 31 4.102 -11.426 -0.291 1.00 3.13 O ATOM 444 CB ARG A 31 5.616 -9.574 1.302 1.00 35.52 C ATOM 445 CG ARG A 31 6.338 -10.942 1.559 1.00 72.11 C ATOM 446 CD ARG A 31 6.969 -11.088 2.956 1.00 42.22 C ATOM 447 NE ARG A 31 6.008 -11.437 4.014 1.00 20.53 N ATOM 448 CZ ARG A 31 6.268 -11.356 5.334 1.00 24.11 C ATOM 449 NH1 ARG A 31 7.453 -10.933 5.771 1.00 45.02 N ATOM 450 NH2 ARG A 31 5.345 -11.704 6.208 1.00 12.31 N ATOM 0 H ARG A 31 4.209 -10.388 3.243 1.00 21.01 H new ATOM 0 HA ARG A 31 3.731 -8.563 1.067 1.00 53.32 H new ATOM 0 HB2 ARG A 31 5.948 -9.193 0.336 1.00 35.52 H new ATOM 0 HB3 ARG A 31 5.955 -8.866 2.058 1.00 35.52 H new ATOM 0 HG2 ARG A 31 5.619 -11.749 1.415 1.00 72.11 H new ATOM 0 HG3 ARG A 31 7.118 -11.072 0.808 1.00 72.11 H new ATOM 0 HD2 ARG A 31 7.743 -11.854 2.915 1.00 42.22 H new ATOM 0 HD3 ARG A 31 7.461 -10.152 3.221 1.00 42.22 H new ATOM 0 HE ARG A 31 5.084 -11.762 3.730 1.00 20.53 H new ATOM 0 HH11 ARG A 31 8.177 -10.666 5.104 1.00 45.02 H new ATOM 0 HH12 ARG A 31 7.637 -10.876 6.773 1.00 45.02 H new ATOM 0 HH21 ARG A 31 4.435 -12.034 5.885 1.00 12.31 H new ATOM 0 HH22 ARG A 31 5.540 -11.643 7.207 1.00 12.31 H new ATOM 464 N ILE A 32 2.169 -10.304 -0.104 1.00 52.33 N ATOM 465 CA ILE A 32 1.431 -11.149 -1.067 1.00 74.20 C ATOM 466 C ILE A 32 1.914 -10.897 -2.509 1.00 3.10 C ATOM 467 O ILE A 32 1.967 -11.821 -3.325 1.00 5.21 O ATOM 468 CB ILE A 32 -0.120 -10.913 -0.950 1.00 11.32 C ATOM 469 CG1 ILE A 32 -0.478 -9.399 -1.121 1.00 55.20 C ATOM 470 CG2 ILE A 32 -0.659 -11.466 0.391 1.00 20.44 C ATOM 471 CD1 ILE A 32 -1.964 -9.097 -1.127 1.00 13.22 C ATOM 0 H ILE A 32 1.612 -9.544 0.288 1.00 52.33 H new ATOM 0 HA ILE A 32 1.635 -12.191 -0.820 1.00 74.20 H new ATOM 0 HB ILE A 32 -0.605 -11.458 -1.760 1.00 11.32 H new ATOM 0 HG12 ILE A 32 -0.010 -8.835 -0.314 1.00 55.20 H new ATOM 0 HG13 ILE A 32 -0.044 -9.040 -2.054 1.00 55.20 H new ATOM 0 HG21 ILE A 32 -1.733 -11.292 0.451 1.00 20.44 H new ATOM 0 HG22 ILE A 32 -0.461 -12.536 0.449 1.00 20.44 H new ATOM 0 HG23 ILE A 32 -0.163 -10.960 1.219 1.00 20.44 H new ATOM 0 HD11 ILE A 32 -2.117 -8.025 -1.250 1.00 13.22 H new ATOM 0 HD12 ILE A 32 -2.440 -9.628 -1.951 1.00 13.22 H new ATOM 0 HD13 ILE A 32 -2.405 -9.420 -0.184 1.00 13.22 H new ATOM 483 N VAL A 33 2.263 -9.631 -2.786 1.00 23.54 N ATOM 484 CA VAL A 33 2.875 -9.193 -4.045 1.00 75.11 C ATOM 485 C VAL A 33 3.650 -7.883 -3.773 1.00 53.32 C ATOM 486 O VAL A 33 3.162 -7.006 -3.048 1.00 54.21 O ATOM 487 CB VAL A 33 1.815 -9.031 -5.208 1.00 1.44 C ATOM 488 CG1 VAL A 33 0.651 -8.107 -4.812 1.00 4.13 C ATOM 489 CG2 VAL A 33 2.475 -8.574 -6.535 1.00 34.20 C ATOM 0 H VAL A 33 2.123 -8.868 -2.124 1.00 23.54 H new ATOM 0 HA VAL A 33 3.565 -9.960 -4.397 1.00 75.11 H new ATOM 0 HB VAL A 33 1.392 -10.021 -5.379 1.00 1.44 H new ATOM 0 HG11 VAL A 33 -0.050 -8.028 -5.643 1.00 4.13 H new ATOM 0 HG12 VAL A 33 0.138 -8.520 -3.943 1.00 4.13 H new ATOM 0 HG13 VAL A 33 1.038 -7.118 -4.568 1.00 4.13 H new ATOM 0 HG21 VAL A 33 1.711 -8.475 -7.306 1.00 34.20 H new ATOM 0 HG22 VAL A 33 2.965 -7.612 -6.385 1.00 34.20 H new ATOM 0 HG23 VAL A 33 3.213 -9.313 -6.848 1.00 34.20 H new ATOM 499 N ASN A 34 4.871 -7.796 -4.328 1.00 70.44 N ATOM 500 CA ASN A 34 5.818 -6.685 -4.084 1.00 43.40 C ATOM 501 C ASN A 34 5.257 -5.316 -4.530 1.00 63.32 C ATOM 502 O ASN A 34 5.358 -4.320 -3.803 1.00 41.30 O ATOM 503 CB ASN A 34 7.174 -6.960 -4.800 1.00 14.33 C ATOM 504 CG ASN A 34 7.060 -7.189 -6.315 1.00 13.11 C ATOM 505 OD1 ASN A 34 6.095 -7.762 -6.812 1.00 62.11 O ATOM 506 ND2 ASN A 34 8.033 -6.713 -7.062 1.00 64.31 N ATOM 0 H ASN A 34 5.236 -8.502 -4.967 1.00 70.44 H new ATOM 0 HA ASN A 34 5.974 -6.636 -3.006 1.00 43.40 H new ATOM 0 HB2 ASN A 34 7.842 -6.117 -4.622 1.00 14.33 H new ATOM 0 HB3 ASN A 34 7.638 -7.836 -4.347 1.00 14.33 H new ATOM 0 HD21 ASN A 34 7.995 -6.817 -8.076 1.00 64.31 H new ATOM 0 HD22 ASN A 34 8.825 -6.240 -6.627 1.00 64.31 H new ATOM 513 N GLU A 35 4.652 -5.303 -5.724 1.00 70.10 N ATOM 514 CA GLU A 35 4.217 -4.070 -6.401 1.00 43.42 C ATOM 515 C GLU A 35 3.163 -4.393 -7.478 1.00 44.44 C ATOM 516 O GLU A 35 2.665 -5.520 -7.553 1.00 42.32 O ATOM 517 CB GLU A 35 5.451 -3.356 -7.033 1.00 30.31 C ATOM 518 CG GLU A 35 6.165 -4.154 -8.145 1.00 42.42 C ATOM 519 CD GLU A 35 7.394 -3.436 -8.718 1.00 52.35 C ATOM 520 OE1 GLU A 35 8.407 -3.316 -7.999 1.00 34.53 O ATOM 521 OE2 GLU A 35 7.365 -3.000 -9.889 1.00 61.53 O ATOM 0 H GLU A 35 4.448 -6.151 -6.253 1.00 70.10 H new ATOM 0 HA GLU A 35 3.760 -3.402 -5.671 1.00 43.42 H new ATOM 0 HB2 GLU A 35 5.128 -2.399 -7.443 1.00 30.31 H new ATOM 0 HB3 GLU A 35 6.170 -3.138 -6.243 1.00 30.31 H new ATOM 0 HG2 GLU A 35 6.471 -5.122 -7.748 1.00 42.42 H new ATOM 0 HG3 GLU A 35 5.459 -4.350 -8.952 1.00 42.42 H new ATOM 528 N SER A 36 2.830 -3.388 -8.310 1.00 1.00 N ATOM 529 CA SER A 36 1.893 -3.534 -9.442 1.00 20.13 C ATOM 530 C SER A 36 2.636 -4.095 -10.684 1.00 21.45 C ATOM 531 O SER A 36 2.457 -3.594 -11.803 1.00 63.31 O ATOM 532 CB SER A 36 1.263 -2.147 -9.744 1.00 63.31 C ATOM 533 OG SER A 36 0.678 -1.572 -8.589 1.00 71.22 O ATOM 0 H SER A 36 3.206 -2.445 -8.215 1.00 1.00 H new ATOM 0 HA SER A 36 1.102 -4.239 -9.187 1.00 20.13 H new ATOM 0 HB2 SER A 36 2.029 -1.477 -10.135 1.00 63.31 H new ATOM 0 HB3 SER A 36 0.506 -2.253 -10.521 1.00 63.31 H new ATOM 0 HG SER A 36 1.114 -0.716 -8.393 1.00 71.22 H new ATOM 539 N ASN A 37 3.440 -5.167 -10.467 1.00 14.01 N ATOM 540 CA ASN A 37 4.304 -5.779 -11.505 1.00 41.10 C ATOM 541 C ASN A 37 3.493 -6.237 -12.736 1.00 42.14 C ATOM 542 O ASN A 37 3.929 -6.064 -13.879 1.00 65.32 O ATOM 543 CB ASN A 37 5.140 -6.950 -10.894 1.00 75.10 C ATOM 544 CG ASN A 37 4.342 -8.018 -10.115 1.00 32.33 C ATOM 545 OD1 ASN A 37 3.166 -8.271 -10.363 1.00 72.31 O ATOM 546 ND2 ASN A 37 4.992 -8.663 -9.161 1.00 40.22 N ATOM 0 H ASN A 37 3.506 -5.632 -9.562 1.00 14.01 H new ATOM 0 HA ASN A 37 4.996 -5.015 -11.859 1.00 41.10 H new ATOM 0 HB2 ASN A 37 5.679 -7.445 -11.702 1.00 75.10 H new ATOM 0 HB3 ASN A 37 5.889 -6.525 -10.225 1.00 75.10 H new ATOM 0 HD21 ASN A 37 4.517 -9.384 -8.618 1.00 40.22 H new ATOM 0 HD22 ASN A 37 5.969 -8.440 -8.969 1.00 40.22 H new ATOM 553 N VAL A 38 2.300 -6.777 -12.455 1.00 72.24 N ATOM 554 CA VAL A 38 1.294 -7.178 -13.446 1.00 31.11 C ATOM 555 C VAL A 38 -0.013 -7.496 -12.692 1.00 4.11 C ATOM 556 O VAL A 38 0.032 -8.027 -11.570 1.00 63.12 O ATOM 557 CB VAL A 38 1.753 -8.410 -14.325 1.00 72.51 C ATOM 558 CG1 VAL A 38 2.105 -9.636 -13.462 1.00 34.22 C ATOM 559 CG2 VAL A 38 0.706 -8.757 -15.415 1.00 72.42 C ATOM 0 H VAL A 38 1.998 -6.953 -11.497 1.00 72.24 H new ATOM 0 HA VAL A 38 1.146 -6.357 -14.147 1.00 31.11 H new ATOM 0 HB VAL A 38 2.667 -8.111 -14.838 1.00 72.51 H new ATOM 0 HG11 VAL A 38 2.415 -10.458 -14.107 1.00 34.22 H new ATOM 0 HG12 VAL A 38 2.919 -9.381 -12.783 1.00 34.22 H new ATOM 0 HG13 VAL A 38 1.231 -9.937 -12.885 1.00 34.22 H new ATOM 0 HG21 VAL A 38 1.057 -9.608 -15.998 1.00 72.42 H new ATOM 0 HG22 VAL A 38 -0.243 -9.008 -14.941 1.00 72.42 H new ATOM 0 HG23 VAL A 38 0.567 -7.899 -16.073 1.00 72.42 H new ATOM 569 N TYR A 39 -1.168 -7.175 -13.313 1.00 51.12 N ATOM 570 CA TYR A 39 -2.508 -7.395 -12.716 1.00 23.42 C ATOM 571 C TYR A 39 -2.735 -8.877 -12.364 1.00 3.54 C ATOM 572 O TYR A 39 -3.482 -9.193 -11.437 1.00 43.34 O ATOM 573 CB TYR A 39 -3.617 -6.899 -13.691 1.00 33.24 C ATOM 574 CG TYR A 39 -3.695 -7.651 -15.049 1.00 52.32 C ATOM 575 CD1 TYR A 39 -2.937 -7.244 -16.150 1.00 43.24 C ATOM 576 CD2 TYR A 39 -4.537 -8.760 -15.224 1.00 64.14 C ATOM 577 CE1 TYR A 39 -3.011 -7.908 -17.361 1.00 12.11 C ATOM 578 CE2 TYR A 39 -4.611 -9.423 -16.436 1.00 4.00 C ATOM 579 CZ TYR A 39 -3.849 -8.993 -17.500 1.00 52.33 C ATOM 580 OH TYR A 39 -3.919 -9.655 -18.711 1.00 44.51 O ATOM 0 H TYR A 39 -1.201 -6.756 -14.242 1.00 51.12 H new ATOM 0 HA TYR A 39 -2.559 -6.822 -11.790 1.00 23.42 H new ATOM 0 HB2 TYR A 39 -4.582 -6.985 -13.191 1.00 33.24 H new ATOM 0 HB3 TYR A 39 -3.455 -5.840 -13.890 1.00 33.24 H new ATOM 0 HD1 TYR A 39 -2.279 -6.393 -16.053 1.00 43.24 H new ATOM 0 HD2 TYR A 39 -5.139 -9.103 -14.396 1.00 64.14 H new ATOM 0 HE1 TYR A 39 -2.413 -7.576 -18.197 1.00 12.11 H new ATOM 0 HE2 TYR A 39 -5.265 -10.276 -16.548 1.00 4.00 H new ATOM 0 HH TYR A 39 -4.555 -10.397 -18.642 1.00 44.51 H new ATOM 590 N THR A 40 -2.062 -9.755 -13.128 1.00 33.51 N ATOM 591 CA THR A 40 -2.203 -11.204 -13.038 1.00 21.30 C ATOM 592 C THR A 40 -1.653 -11.735 -11.692 1.00 61.53 C ATOM 593 O THR A 40 -2.404 -12.324 -10.919 1.00 64.00 O ATOM 594 CB THR A 40 -1.483 -11.891 -14.248 1.00 12.22 C ATOM 595 OG1 THR A 40 -1.830 -11.206 -15.469 1.00 30.11 O ATOM 596 CG2 THR A 40 -1.863 -13.376 -14.374 1.00 65.43 C ATOM 0 H THR A 40 -1.392 -9.462 -13.839 1.00 33.51 H new ATOM 0 HA THR A 40 -3.264 -11.451 -13.079 1.00 21.30 H new ATOM 0 HB THR A 40 -0.409 -11.832 -14.071 1.00 12.22 H new ATOM 0 HG1 THR A 40 -2.706 -10.779 -15.367 1.00 30.11 H new ATOM 0 HG21 THR A 40 -1.342 -13.814 -15.225 1.00 65.43 H new ATOM 0 HG22 THR A 40 -1.578 -13.903 -13.464 1.00 65.43 H new ATOM 0 HG23 THR A 40 -2.939 -13.465 -14.523 1.00 65.43 H new ATOM 604 N THR A 41 -0.349 -11.479 -11.419 1.00 12.41 N ATOM 605 CA THR A 41 0.332 -11.885 -10.156 1.00 72.51 C ATOM 606 C THR A 41 -0.382 -11.297 -8.922 1.00 12.12 C ATOM 607 O THR A 41 -0.571 -11.981 -7.906 1.00 5.51 O ATOM 608 CB THR A 41 1.830 -11.423 -10.162 1.00 14.10 C ATOM 609 OG1 THR A 41 2.496 -12.004 -11.288 1.00 35.22 O ATOM 610 CG2 THR A 41 2.595 -11.795 -8.873 1.00 4.11 C ATOM 0 H THR A 41 0.264 -10.985 -12.067 1.00 12.41 H new ATOM 0 HA THR A 41 0.291 -12.973 -10.098 1.00 72.51 H new ATOM 0 HB THR A 41 1.824 -10.335 -10.222 1.00 14.10 H new ATOM 0 HG1 THR A 41 3.433 -11.717 -11.298 1.00 35.22 H new ATOM 0 HG21 THR A 41 3.625 -11.445 -8.947 1.00 4.11 H new ATOM 0 HG22 THR A 41 2.113 -11.326 -8.015 1.00 4.11 H new ATOM 0 HG23 THR A 41 2.588 -12.878 -8.746 1.00 4.11 H new ATOM 618 N PHE A 42 -0.780 -10.023 -9.062 1.00 23.23 N ATOM 619 CA PHE A 42 -1.519 -9.264 -8.043 1.00 73.51 C ATOM 620 C PHE A 42 -2.857 -9.952 -7.684 1.00 21.32 C ATOM 621 O PHE A 42 -3.166 -10.149 -6.501 1.00 22.43 O ATOM 622 CB PHE A 42 -1.755 -7.819 -8.572 1.00 72.23 C ATOM 623 CG PHE A 42 -2.732 -6.982 -7.750 1.00 72.03 C ATOM 624 CD1 PHE A 42 -2.465 -6.688 -6.418 1.00 62.01 C ATOM 625 CD2 PHE A 42 -3.925 -6.507 -8.309 1.00 11.34 C ATOM 626 CE1 PHE A 42 -3.354 -5.953 -5.671 1.00 72.51 C ATOM 627 CE2 PHE A 42 -4.808 -5.767 -7.556 1.00 64.23 C ATOM 628 CZ PHE A 42 -4.523 -5.493 -6.239 1.00 63.23 C ATOM 0 H PHE A 42 -0.593 -9.481 -9.905 1.00 23.23 H new ATOM 0 HA PHE A 42 -0.931 -9.226 -7.126 1.00 73.51 H new ATOM 0 HB2 PHE A 42 -0.797 -7.301 -8.608 1.00 72.23 H new ATOM 0 HB3 PHE A 42 -2.124 -7.879 -9.596 1.00 72.23 H new ATOM 0 HD1 PHE A 42 -1.550 -7.041 -5.966 1.00 62.01 H new ATOM 0 HD2 PHE A 42 -4.155 -6.724 -9.342 1.00 11.34 H new ATOM 0 HE1 PHE A 42 -3.136 -5.735 -4.636 1.00 72.51 H new ATOM 0 HE2 PHE A 42 -5.723 -5.402 -7.999 1.00 64.23 H new ATOM 0 HZ PHE A 42 -5.218 -4.915 -5.647 1.00 63.23 H new ATOM 638 N ARG A 43 -3.633 -10.315 -8.721 1.00 45.03 N ATOM 639 CA ARG A 43 -4.958 -10.940 -8.555 1.00 72.21 C ATOM 640 C ARG A 43 -4.825 -12.354 -7.966 1.00 14.43 C ATOM 641 O ARG A 43 -5.613 -12.739 -7.098 1.00 51.33 O ATOM 642 CB ARG A 43 -5.724 -10.971 -9.907 1.00 74.34 C ATOM 643 CG ARG A 43 -7.094 -11.679 -9.850 1.00 3.32 C ATOM 644 CD ARG A 43 -7.879 -11.574 -11.165 1.00 2.51 C ATOM 645 NE ARG A 43 -8.333 -10.199 -11.452 1.00 20.12 N ATOM 646 CZ ARG A 43 -9.566 -9.866 -11.879 1.00 64.53 C ATOM 647 NH1 ARG A 43 -10.496 -10.804 -12.083 1.00 24.52 N ATOM 648 NH2 ARG A 43 -9.857 -8.594 -12.121 1.00 0.10 N ATOM 0 H ARG A 43 -3.360 -10.184 -9.695 1.00 45.03 H new ATOM 0 HA ARG A 43 -5.534 -10.337 -7.854 1.00 72.21 H new ATOM 0 HB2 ARG A 43 -5.872 -9.947 -10.250 1.00 74.34 H new ATOM 0 HB3 ARG A 43 -5.102 -11.469 -10.651 1.00 74.34 H new ATOM 0 HG2 ARG A 43 -6.943 -12.731 -9.606 1.00 3.32 H new ATOM 0 HG3 ARG A 43 -7.687 -11.247 -9.044 1.00 3.32 H new ATOM 0 HD2 ARG A 43 -7.253 -11.924 -11.986 1.00 2.51 H new ATOM 0 HD3 ARG A 43 -8.744 -12.235 -11.120 1.00 2.51 H new ATOM 0 HE ARG A 43 -7.661 -9.443 -11.317 1.00 20.12 H new ATOM 0 HH11 ARG A 43 -10.276 -11.786 -11.915 1.00 24.52 H new ATOM 0 HH12 ARG A 43 -11.426 -10.538 -12.407 1.00 24.52 H new ATOM 0 HH21 ARG A 43 -9.148 -7.874 -11.983 1.00 0.10 H new ATOM 0 HH22 ARG A 43 -10.789 -8.337 -12.445 1.00 0.10 H new ATOM 662 N ASN A 44 -3.796 -13.096 -8.418 1.00 14.42 N ATOM 663 CA ASN A 44 -3.506 -14.461 -7.927 1.00 42.54 C ATOM 664 C ASN A 44 -3.122 -14.433 -6.445 1.00 73.24 C ATOM 665 O ASN A 44 -3.391 -15.382 -5.726 1.00 43.44 O ATOM 666 CB ASN A 44 -2.361 -15.118 -8.736 1.00 12.44 C ATOM 667 CG ASN A 44 -2.674 -15.319 -10.219 1.00 53.43 C ATOM 668 OD1 ASN A 44 -3.819 -15.544 -10.605 1.00 72.32 O ATOM 669 ND2 ASN A 44 -1.647 -15.234 -11.063 1.00 55.24 N ATOM 0 H ASN A 44 -3.144 -12.770 -9.131 1.00 14.42 H new ATOM 0 HA ASN A 44 -4.413 -15.051 -8.057 1.00 42.54 H new ATOM 0 HB2 ASN A 44 -1.467 -14.501 -8.646 1.00 12.44 H new ATOM 0 HB3 ASN A 44 -2.126 -16.085 -8.292 1.00 12.44 H new ATOM 0 HD21 ASN A 44 -1.798 -15.357 -12.064 1.00 55.24 H new ATOM 0 HD22 ASN A 44 -0.709 -15.046 -10.708 1.00 55.24 H new ATOM 676 N ALA A 45 -2.495 -13.327 -6.016 1.00 11.05 N ATOM 677 CA ALA A 45 -2.098 -13.114 -4.615 1.00 20.04 C ATOM 678 C ALA A 45 -3.334 -12.941 -3.702 1.00 14.42 C ATOM 679 O ALA A 45 -3.324 -13.364 -2.541 1.00 21.40 O ATOM 680 CB ALA A 45 -1.174 -11.898 -4.520 1.00 22.33 C ATOM 0 H ALA A 45 -2.248 -12.553 -6.632 1.00 11.05 H new ATOM 0 HA ALA A 45 -1.559 -13.996 -4.268 1.00 20.04 H new ATOM 0 HB1 ALA A 45 -0.882 -11.743 -3.481 1.00 22.33 H new ATOM 0 HB2 ALA A 45 -0.284 -12.069 -5.126 1.00 22.33 H new ATOM 0 HB3 ALA A 45 -1.697 -11.014 -4.885 1.00 22.33 H new ATOM 686 N ILE A 46 -4.389 -12.314 -4.260 1.00 60.33 N ATOM 687 CA ILE A 46 -5.679 -12.112 -3.573 1.00 62.54 C ATOM 688 C ILE A 46 -6.464 -13.448 -3.508 1.00 20.23 C ATOM 689 O ILE A 46 -7.027 -13.799 -2.467 1.00 43.35 O ATOM 690 CB ILE A 46 -6.540 -11.008 -4.306 1.00 60.12 C ATOM 691 CG1 ILE A 46 -5.751 -9.664 -4.417 1.00 45.11 C ATOM 692 CG2 ILE A 46 -7.893 -10.787 -3.593 1.00 4.04 C ATOM 693 CD1 ILE A 46 -6.480 -8.551 -5.162 1.00 45.12 C ATOM 0 H ILE A 46 -4.369 -11.932 -5.205 1.00 60.33 H new ATOM 0 HA ILE A 46 -5.477 -11.769 -2.558 1.00 62.54 H new ATOM 0 HB ILE A 46 -6.746 -11.368 -5.314 1.00 60.12 H new ATOM 0 HG12 ILE A 46 -5.515 -9.314 -3.412 1.00 45.11 H new ATOM 0 HG13 ILE A 46 -4.803 -9.857 -4.919 1.00 45.11 H new ATOM 0 HG21 ILE A 46 -8.462 -10.022 -4.121 1.00 4.04 H new ATOM 0 HG22 ILE A 46 -8.458 -11.719 -3.587 1.00 4.04 H new ATOM 0 HG23 ILE A 46 -7.715 -10.464 -2.567 1.00 4.04 H new ATOM 0 HD11 ILE A 46 -5.854 -7.659 -5.187 1.00 45.12 H new ATOM 0 HD12 ILE A 46 -6.693 -8.874 -6.181 1.00 45.12 H new ATOM 0 HD13 ILE A 46 -7.415 -8.323 -4.651 1.00 45.12 H new ATOM 705 N LEU A 47 -6.449 -14.194 -4.635 1.00 15.32 N ATOM 706 CA LEU A 47 -7.124 -15.508 -4.768 1.00 24.40 C ATOM 707 C LEU A 47 -6.409 -16.586 -3.926 1.00 12.21 C ATOM 708 O LEU A 47 -7.030 -17.557 -3.477 1.00 4.21 O ATOM 709 CB LEU A 47 -7.169 -15.929 -6.265 1.00 61.15 C ATOM 710 CG LEU A 47 -7.959 -14.979 -7.221 1.00 75.33 C ATOM 711 CD1 LEU A 47 -7.899 -15.467 -8.687 1.00 74.51 C ATOM 712 CD2 LEU A 47 -9.413 -14.798 -6.748 1.00 75.52 C ATOM 0 H LEU A 47 -5.966 -13.901 -5.484 1.00 15.32 H new ATOM 0 HA LEU A 47 -8.143 -15.413 -4.393 1.00 24.40 H new ATOM 0 HB2 LEU A 47 -6.145 -16.010 -6.630 1.00 61.15 H new ATOM 0 HB3 LEU A 47 -7.609 -16.924 -6.329 1.00 61.15 H new ATOM 0 HG LEU A 47 -7.475 -14.003 -7.186 1.00 75.33 H new ATOM 0 HD11 LEU A 47 -8.460 -14.781 -9.322 1.00 74.51 H new ATOM 0 HD12 LEU A 47 -6.861 -15.501 -9.017 1.00 74.51 H new ATOM 0 HD13 LEU A 47 -8.334 -16.464 -8.757 1.00 74.51 H new ATOM 0 HD21 LEU A 47 -9.938 -14.132 -7.433 1.00 75.52 H new ATOM 0 HD22 LEU A 47 -9.913 -15.767 -6.729 1.00 75.52 H new ATOM 0 HD23 LEU A 47 -9.419 -14.367 -5.747 1.00 75.52 H new ATOM 724 N LYS A 48 -5.099 -16.380 -3.732 1.00 34.42 N ATOM 725 CA LYS A 48 -4.233 -17.227 -2.888 1.00 53.43 C ATOM 726 C LYS A 48 -4.636 -17.104 -1.419 1.00 34.41 C ATOM 727 O LYS A 48 -4.644 -18.089 -0.673 1.00 20.35 O ATOM 728 CB LYS A 48 -2.763 -16.754 -3.070 1.00 15.14 C ATOM 729 CG LYS A 48 -1.691 -17.459 -2.207 1.00 51.42 C ATOM 730 CD LYS A 48 -0.282 -16.836 -2.394 1.00 23.11 C ATOM 731 CE LYS A 48 0.210 -16.870 -3.857 1.00 34.43 C ATOM 732 NZ LYS A 48 0.302 -18.260 -4.390 1.00 23.51 N ATOM 0 H LYS A 48 -4.598 -15.604 -4.165 1.00 34.42 H new ATOM 0 HA LYS A 48 -4.337 -18.271 -3.185 1.00 53.43 H new ATOM 0 HB2 LYS A 48 -2.493 -16.881 -4.118 1.00 15.14 H new ATOM 0 HB3 LYS A 48 -2.721 -15.686 -2.858 1.00 15.14 H new ATOM 0 HG2 LYS A 48 -1.976 -17.399 -1.157 1.00 51.42 H new ATOM 0 HG3 LYS A 48 -1.656 -18.517 -2.468 1.00 51.42 H new ATOM 0 HD2 LYS A 48 -0.300 -15.803 -2.048 1.00 23.11 H new ATOM 0 HD3 LYS A 48 0.431 -17.370 -1.766 1.00 23.11 H new ATOM 0 HE2 LYS A 48 -0.469 -16.288 -4.480 1.00 34.43 H new ATOM 0 HE3 LYS A 48 1.188 -16.393 -3.920 1.00 34.43 H new ATOM 0 HZ1 LYS A 48 0.652 -18.234 -5.369 1.00 23.51 H new ATOM 0 HZ2 LYS A 48 0.957 -18.814 -3.802 1.00 23.51 H new ATOM 0 HZ3 LYS A 48 -0.639 -18.702 -4.371 1.00 23.51 H new ATOM 746 N GLN A 49 -5.005 -15.881 -1.035 1.00 72.35 N ATOM 747 CA GLN A 49 -5.245 -15.522 0.362 1.00 12.22 C ATOM 748 C GLN A 49 -6.731 -15.692 0.736 1.00 31.15 C ATOM 749 O GLN A 49 -7.617 -15.480 -0.096 1.00 31.34 O ATOM 750 CB GLN A 49 -4.769 -14.069 0.603 1.00 41.10 C ATOM 751 CG GLN A 49 -4.721 -13.658 2.077 1.00 63.43 C ATOM 752 CD GLN A 49 -3.824 -14.568 2.930 1.00 71.35 C ATOM 753 OE1 GLN A 49 -4.290 -15.539 3.532 1.00 31.03 O ATOM 754 NE2 GLN A 49 -2.531 -14.274 2.973 1.00 24.34 N ATOM 0 H GLN A 49 -5.146 -15.109 -1.687 1.00 72.35 H new ATOM 0 HA GLN A 49 -4.677 -16.195 1.005 1.00 12.22 H new ATOM 0 HB2 GLN A 49 -3.775 -13.948 0.172 1.00 41.10 H new ATOM 0 HB3 GLN A 49 -5.433 -13.388 0.070 1.00 41.10 H new ATOM 0 HG2 GLN A 49 -4.361 -12.632 2.150 1.00 63.43 H new ATOM 0 HG3 GLN A 49 -5.732 -13.670 2.484 1.00 63.43 H new ATOM 0 HE21 GLN A 49 -2.175 -13.465 2.465 1.00 24.34 H new ATOM 0 HE22 GLN A 49 -1.893 -14.857 3.514 1.00 24.34 H new ATOM 763 N ALA A 50 -6.968 -16.060 2.011 1.00 44.40 N ATOM 764 CA ALA A 50 -8.309 -16.357 2.551 1.00 63.21 C ATOM 765 C ALA A 50 -9.238 -15.128 2.522 1.00 73.52 C ATOM 766 O ALA A 50 -10.382 -15.219 2.062 1.00 61.32 O ATOM 767 CB ALA A 50 -8.177 -16.898 3.989 1.00 62.41 C ATOM 0 H ALA A 50 -6.225 -16.160 2.702 1.00 44.40 H new ATOM 0 HA ALA A 50 -8.765 -17.113 1.912 1.00 63.21 H new ATOM 0 HB1 ALA A 50 -9.168 -17.117 4.388 1.00 62.41 H new ATOM 0 HB2 ALA A 50 -7.579 -17.809 3.981 1.00 62.41 H new ATOM 0 HB3 ALA A 50 -7.691 -16.150 4.616 1.00 62.41 H new ATOM 773 N ASP A 51 -8.710 -13.981 2.988 1.00 34.03 N ATOM 774 CA ASP A 51 -9.502 -12.740 3.229 1.00 51.40 C ATOM 775 C ASP A 51 -10.030 -12.074 1.933 1.00 15.11 C ATOM 776 O ASP A 51 -10.991 -11.288 1.992 1.00 33.24 O ATOM 777 CB ASP A 51 -8.684 -11.725 4.093 1.00 44.20 C ATOM 778 CG ASP A 51 -7.255 -11.429 3.573 1.00 13.02 C ATOM 779 OD1 ASP A 51 -7.108 -10.914 2.446 1.00 14.03 O ATOM 780 OD2 ASP A 51 -6.270 -11.681 4.316 1.00 34.33 O ATOM 0 H ASP A 51 -7.720 -13.879 3.212 1.00 34.03 H new ATOM 0 HA ASP A 51 -10.389 -13.047 3.783 1.00 51.40 H new ATOM 0 HB2 ASP A 51 -9.237 -10.787 4.146 1.00 44.20 H new ATOM 0 HB3 ASP A 51 -8.612 -12.111 5.110 1.00 44.20 H new ATOM 785 N LYS A 52 -9.384 -12.388 0.790 1.00 63.13 N ATOM 786 CA LYS A 52 -9.790 -11.925 -0.560 1.00 3.25 C ATOM 787 C LYS A 52 -9.772 -10.384 -0.679 1.00 52.31 C ATOM 788 O LYS A 52 -10.682 -9.778 -1.281 1.00 44.12 O ATOM 789 CB LYS A 52 -11.183 -12.496 -0.982 1.00 64.43 C ATOM 790 CG LYS A 52 -11.263 -14.034 -1.044 1.00 43.41 C ATOM 791 CD LYS A 52 -10.268 -14.660 -2.047 1.00 33.00 C ATOM 792 CE LYS A 52 -10.342 -16.197 -2.051 1.00 12.04 C ATOM 793 NZ LYS A 52 -10.115 -16.772 -0.694 1.00 71.03 N ATOM 0 H LYS A 52 -8.553 -12.979 0.776 1.00 63.13 H new ATOM 0 HA LYS A 52 -9.045 -12.318 -1.252 1.00 3.25 H new ATOM 0 HB2 LYS A 52 -11.935 -12.136 -0.280 1.00 64.43 H new ATOM 0 HB3 LYS A 52 -11.443 -12.094 -1.961 1.00 64.43 H new ATOM 0 HG2 LYS A 52 -11.071 -14.441 -0.051 1.00 43.41 H new ATOM 0 HG3 LYS A 52 -12.276 -14.327 -1.318 1.00 43.41 H new ATOM 0 HD2 LYS A 52 -10.479 -14.285 -3.048 1.00 33.00 H new ATOM 0 HD3 LYS A 52 -9.255 -14.347 -1.796 1.00 33.00 H new ATOM 0 HE2 LYS A 52 -11.318 -16.512 -2.419 1.00 12.04 H new ATOM 0 HE3 LYS A 52 -9.598 -16.594 -2.742 1.00 12.04 H new ATOM 0 HZ1 LYS A 52 -9.971 -17.799 -0.772 1.00 71.03 H new ATOM 0 HZ2 LYS A 52 -9.272 -16.335 -0.268 1.00 71.03 H new ATOM 0 HZ3 LYS A 52 -10.943 -16.583 -0.094 1.00 71.03 H new ATOM 807 N VAL A 53 -8.721 -9.757 -0.126 1.00 45.50 N ATOM 808 CA VAL A 53 -8.495 -8.310 -0.266 1.00 21.23 C ATOM 809 C VAL A 53 -7.008 -7.963 -0.054 1.00 23.25 C ATOM 810 O VAL A 53 -6.377 -8.433 0.890 1.00 33.12 O ATOM 811 CB VAL A 53 -9.420 -7.478 0.707 1.00 14.23 C ATOM 812 CG1 VAL A 53 -9.281 -7.928 2.173 1.00 34.33 C ATOM 813 CG2 VAL A 53 -9.197 -5.958 0.553 1.00 54.12 C ATOM 0 H VAL A 53 -8.009 -10.235 0.427 1.00 45.50 H new ATOM 0 HA VAL A 53 -8.765 -8.032 -1.285 1.00 21.23 H new ATOM 0 HB VAL A 53 -10.448 -7.685 0.411 1.00 14.23 H new ATOM 0 HG11 VAL A 53 -9.937 -7.326 2.802 1.00 34.33 H new ATOM 0 HG12 VAL A 53 -9.559 -8.978 2.259 1.00 34.33 H new ATOM 0 HG13 VAL A 53 -8.248 -7.799 2.497 1.00 34.33 H new ATOM 0 HG21 VAL A 53 -9.852 -5.423 1.240 1.00 54.12 H new ATOM 0 HG22 VAL A 53 -8.159 -5.718 0.781 1.00 54.12 H new ATOM 0 HG23 VAL A 53 -9.422 -5.659 -0.471 1.00 54.12 H new ATOM 823 N ALA A 54 -6.471 -7.132 -0.957 1.00 23.14 N ATOM 824 CA ALA A 54 -5.115 -6.576 -0.854 1.00 44.12 C ATOM 825 C ALA A 54 -5.208 -5.102 -0.450 1.00 13.14 C ATOM 826 O ALA A 54 -6.298 -4.524 -0.450 1.00 23.25 O ATOM 827 CB ALA A 54 -4.379 -6.728 -2.189 1.00 23.21 C ATOM 0 H ALA A 54 -6.972 -6.823 -1.790 1.00 23.14 H new ATOM 0 HA ALA A 54 -4.551 -7.119 -0.095 1.00 44.12 H new ATOM 0 HB1 ALA A 54 -3.375 -6.312 -2.100 1.00 23.21 H new ATOM 0 HB2 ALA A 54 -4.313 -7.784 -2.450 1.00 23.21 H new ATOM 0 HB3 ALA A 54 -4.925 -6.196 -2.968 1.00 23.21 H new ATOM 833 N TYR A 55 -4.074 -4.502 -0.071 1.00 71.53 N ATOM 834 CA TYR A 55 -4.014 -3.093 0.363 1.00 71.42 C ATOM 835 C TYR A 55 -2.725 -2.459 -0.137 1.00 63.30 C ATOM 836 O TYR A 55 -1.627 -2.926 0.192 1.00 41.52 O ATOM 837 CB TYR A 55 -4.087 -2.963 1.907 1.00 52.31 C ATOM 838 CG TYR A 55 -5.406 -3.448 2.519 1.00 45.05 C ATOM 839 CD1 TYR A 55 -6.495 -2.587 2.681 1.00 31.24 C ATOM 840 CD2 TYR A 55 -5.557 -4.769 2.931 1.00 31.02 C ATOM 841 CE1 TYR A 55 -7.673 -3.033 3.239 1.00 13.24 C ATOM 842 CE2 TYR A 55 -6.730 -5.210 3.476 1.00 32.02 C ATOM 843 CZ TYR A 55 -7.781 -4.346 3.631 1.00 63.14 C ATOM 844 OH TYR A 55 -8.937 -4.801 4.200 1.00 5.14 O ATOM 0 H TYR A 55 -3.170 -4.975 -0.055 1.00 71.53 H new ATOM 0 HA TYR A 55 -4.876 -2.577 -0.060 1.00 71.42 H new ATOM 0 HB2 TYR A 55 -3.266 -3.529 2.347 1.00 52.31 H new ATOM 0 HB3 TYR A 55 -3.936 -1.919 2.180 1.00 52.31 H new ATOM 0 HD1 TYR A 55 -6.412 -1.558 2.364 1.00 31.24 H new ATOM 0 HD2 TYR A 55 -4.733 -5.458 2.818 1.00 31.02 H new ATOM 0 HE1 TYR A 55 -8.505 -2.356 3.367 1.00 13.24 H new ATOM 0 HE2 TYR A 55 -6.828 -6.240 3.785 1.00 32.02 H new ATOM 0 HH TYR A 55 -8.843 -5.752 4.416 1.00 5.14 H new ATOM 854 N LEU A 56 -2.875 -1.405 -0.936 1.00 43.20 N ATOM 855 CA LEU A 56 -1.763 -0.611 -1.433 1.00 43.15 C ATOM 856 C LEU A 56 -1.355 0.419 -0.367 1.00 42.21 C ATOM 857 O LEU A 56 -2.064 1.405 -0.140 1.00 70.12 O ATOM 858 CB LEU A 56 -2.168 0.080 -2.756 1.00 44.00 C ATOM 859 CG LEU A 56 -1.060 0.922 -3.451 1.00 41.51 C ATOM 860 CD1 LEU A 56 0.199 0.085 -3.725 1.00 31.54 C ATOM 861 CD2 LEU A 56 -1.602 1.575 -4.736 1.00 42.41 C ATOM 0 H LEU A 56 -3.786 -1.077 -1.258 1.00 43.20 H new ATOM 0 HA LEU A 56 -0.906 -1.253 -1.635 1.00 43.15 H new ATOM 0 HB2 LEU A 56 -2.507 -0.686 -3.454 1.00 44.00 H new ATOM 0 HB3 LEU A 56 -3.020 0.730 -2.558 1.00 44.00 H new ATOM 0 HG LEU A 56 -0.765 1.720 -2.769 1.00 41.51 H new ATOM 0 HD11 LEU A 56 0.951 0.707 -4.211 1.00 31.54 H new ATOM 0 HD12 LEU A 56 0.596 -0.294 -2.783 1.00 31.54 H new ATOM 0 HD13 LEU A 56 -0.055 -0.752 -4.375 1.00 31.54 H new ATOM 0 HD21 LEU A 56 -0.812 2.160 -5.208 1.00 42.41 H new ATOM 0 HD22 LEU A 56 -1.940 0.800 -5.424 1.00 42.41 H new ATOM 0 HD23 LEU A 56 -2.438 2.229 -4.487 1.00 42.41 H new ATOM 873 N VAL A 57 -0.232 0.142 0.308 1.00 23.34 N ATOM 874 CA VAL A 57 0.307 0.999 1.373 1.00 65.42 C ATOM 875 C VAL A 57 1.376 1.938 0.792 1.00 70.52 C ATOM 876 O VAL A 57 2.370 1.467 0.231 1.00 75.43 O ATOM 877 CB VAL A 57 0.944 0.133 2.529 1.00 43.44 C ATOM 878 CG1 VAL A 57 1.485 1.016 3.677 1.00 40.35 C ATOM 879 CG2 VAL A 57 -0.060 -0.918 3.048 1.00 14.40 C ATOM 0 H VAL A 57 0.332 -0.689 0.130 1.00 23.34 H new ATOM 0 HA VAL A 57 -0.514 1.583 1.789 1.00 65.42 H new ATOM 0 HB VAL A 57 1.798 -0.399 2.109 1.00 43.44 H new ATOM 0 HG11 VAL A 57 1.915 0.382 4.452 1.00 40.35 H new ATOM 0 HG12 VAL A 57 2.252 1.686 3.290 1.00 40.35 H new ATOM 0 HG13 VAL A 57 0.670 1.603 4.100 1.00 40.35 H new ATOM 0 HG21 VAL A 57 0.403 -1.502 3.844 1.00 14.40 H new ATOM 0 HG22 VAL A 57 -0.946 -0.415 3.435 1.00 14.40 H new ATOM 0 HG23 VAL A 57 -0.347 -1.581 2.232 1.00 14.40 H new ATOM 889 N MET A 58 1.149 3.257 0.916 1.00 41.21 N ATOM 890 CA MET A 58 2.149 4.293 0.588 1.00 20.23 C ATOM 891 C MET A 58 2.216 5.322 1.731 1.00 12.21 C ATOM 892 O MET A 58 1.476 5.216 2.713 1.00 30.34 O ATOM 893 CB MET A 58 1.818 4.990 -0.768 1.00 22.52 C ATOM 894 CG MET A 58 0.620 5.964 -0.758 1.00 30.15 C ATOM 895 SD MET A 58 -0.970 5.165 -0.487 1.00 33.41 S ATOM 896 CE MET A 58 -1.124 4.196 -1.977 1.00 42.11 C ATOM 0 H MET A 58 0.263 3.638 1.248 1.00 41.21 H new ATOM 0 HA MET A 58 3.123 3.817 0.478 1.00 20.23 H new ATOM 0 HB2 MET A 58 2.702 5.537 -1.097 1.00 22.52 H new ATOM 0 HB3 MET A 58 1.626 4.218 -1.513 1.00 22.52 H new ATOM 0 HG2 MET A 58 0.778 6.710 0.021 1.00 30.15 H new ATOM 0 HG3 MET A 58 0.590 6.497 -1.708 1.00 30.15 H new ATOM 0 HE1 MET A 58 -1.921 3.463 -1.854 1.00 42.11 H new ATOM 0 HE2 MET A 58 -1.361 4.852 -2.815 1.00 42.11 H new ATOM 0 HE3 MET A 58 -0.184 3.680 -2.174 1.00 42.11 H new ATOM 906 N ASP A 59 3.133 6.294 1.611 1.00 13.31 N ATOM 907 CA ASP A 59 3.199 7.462 2.517 1.00 71.32 C ATOM 908 C ASP A 59 2.424 8.645 1.904 1.00 3.14 C ATOM 909 O ASP A 59 1.880 8.540 0.799 1.00 45.21 O ATOM 910 CB ASP A 59 4.676 7.849 2.808 1.00 44.42 C ATOM 911 CG ASP A 59 5.470 8.202 1.539 1.00 14.31 C ATOM 912 OD1 ASP A 59 5.479 9.383 1.131 1.00 32.41 O ATOM 913 OD2 ASP A 59 6.073 7.289 0.935 1.00 5.44 O ATOM 0 H ASP A 59 3.851 6.297 0.886 1.00 13.31 H new ATOM 0 HA ASP A 59 2.734 7.200 3.467 1.00 71.32 H new ATOM 0 HB2 ASP A 59 4.695 8.700 3.489 1.00 44.42 H new ATOM 0 HB3 ASP A 59 5.168 7.021 3.318 1.00 44.42 H new ATOM 918 N GLU A 60 2.416 9.776 2.625 1.00 51.11 N ATOM 919 CA GLU A 60 1.612 10.958 2.275 1.00 24.40 C ATOM 920 C GLU A 60 2.135 11.669 1.012 1.00 54.42 C ATOM 921 O GLU A 60 1.334 12.128 0.196 1.00 70.13 O ATOM 922 CB GLU A 60 1.548 11.924 3.484 1.00 72.40 C ATOM 923 CG GLU A 60 0.662 13.169 3.272 1.00 73.12 C ATOM 924 CD GLU A 60 0.455 13.996 4.551 1.00 62.14 C ATOM 925 OE1 GLU A 60 1.287 14.882 4.842 1.00 64.35 O ATOM 926 OE2 GLU A 60 -0.532 13.756 5.277 1.00 14.22 O ATOM 0 H GLU A 60 2.970 9.898 3.473 1.00 51.11 H new ATOM 0 HA GLU A 60 0.603 10.621 2.038 1.00 24.40 H new ATOM 0 HB2 GLU A 60 1.178 11.375 4.350 1.00 72.40 H new ATOM 0 HB3 GLU A 60 2.560 12.252 3.723 1.00 72.40 H new ATOM 0 HG2 GLU A 60 1.114 13.802 2.508 1.00 73.12 H new ATOM 0 HG3 GLU A 60 -0.309 12.854 2.891 1.00 73.12 H new ATOM 933 N ARG A 61 3.470 11.726 0.850 1.00 43.05 N ATOM 934 CA ARG A 61 4.114 12.369 -0.317 1.00 41.23 C ATOM 935 C ARG A 61 3.799 11.573 -1.601 1.00 34.32 C ATOM 936 O ARG A 61 3.474 12.167 -2.644 1.00 24.22 O ATOM 937 CB ARG A 61 5.655 12.521 -0.096 1.00 10.41 C ATOM 938 CG ARG A 61 6.455 12.992 -1.336 1.00 62.40 C ATOM 939 CD ARG A 61 5.975 14.353 -1.913 1.00 52.51 C ATOM 940 NE ARG A 61 6.425 14.541 -3.305 1.00 41.12 N ATOM 941 CZ ARG A 61 5.867 15.378 -4.198 1.00 34.22 C ATOM 942 NH1 ARG A 61 4.819 16.145 -3.877 1.00 71.51 N ATOM 943 NH2 ARG A 61 6.339 15.424 -5.438 1.00 65.43 N ATOM 0 H ARG A 61 4.132 11.331 1.518 1.00 43.05 H new ATOM 0 HA ARG A 61 3.707 13.373 -0.432 1.00 41.23 H new ATOM 0 HB2 ARG A 61 5.822 13.230 0.715 1.00 10.41 H new ATOM 0 HB3 ARG A 61 6.055 11.562 0.232 1.00 10.41 H new ATOM 0 HG2 ARG A 61 7.508 13.073 -1.068 1.00 62.40 H new ATOM 0 HG3 ARG A 61 6.382 12.232 -2.114 1.00 62.40 H new ATOM 0 HD2 ARG A 61 4.887 14.403 -1.872 1.00 52.51 H new ATOM 0 HD3 ARG A 61 6.355 15.166 -1.294 1.00 52.51 H new ATOM 0 HE ARG A 61 7.226 13.991 -3.616 1.00 41.12 H new ATOM 0 HH11 ARG A 61 4.425 16.103 -2.937 1.00 71.51 H new ATOM 0 HH12 ARG A 61 4.414 16.772 -4.572 1.00 71.51 H new ATOM 0 HH21 ARG A 61 7.120 14.827 -5.709 1.00 65.43 H new ATOM 0 HH22 ARG A 61 5.920 16.057 -6.120 1.00 65.43 H new ATOM 957 N THR A 62 3.867 10.230 -1.505 1.00 34.01 N ATOM 958 CA THR A 62 3.485 9.332 -2.610 1.00 10.04 C ATOM 959 C THR A 62 1.971 9.470 -2.919 1.00 63.41 C ATOM 960 O THR A 62 1.561 9.382 -4.083 1.00 54.41 O ATOM 961 CB THR A 62 3.846 7.845 -2.280 1.00 54.32 C ATOM 962 OG1 THR A 62 5.220 7.764 -1.881 1.00 31.42 O ATOM 963 CG2 THR A 62 3.619 6.889 -3.475 1.00 23.24 C ATOM 0 H THR A 62 4.185 9.742 -0.667 1.00 34.01 H new ATOM 0 HA THR A 62 4.050 9.625 -3.495 1.00 10.04 H new ATOM 0 HB THR A 62 3.182 7.530 -1.475 1.00 54.32 H new ATOM 0 HG1 THR A 62 5.274 7.449 -0.954 1.00 31.42 H new ATOM 0 HG21 THR A 62 3.887 5.873 -3.184 1.00 23.24 H new ATOM 0 HG22 THR A 62 2.570 6.917 -3.769 1.00 23.24 H new ATOM 0 HG23 THR A 62 4.240 7.202 -4.314 1.00 23.24 H new ATOM 971 N TRP A 63 1.157 9.722 -1.863 1.00 63.31 N ATOM 972 CA TRP A 63 -0.296 9.939 -2.002 1.00 64.42 C ATOM 973 C TRP A 63 -0.608 11.243 -2.748 1.00 34.13 C ATOM 974 O TRP A 63 -1.545 11.266 -3.516 1.00 20.03 O ATOM 975 CB TRP A 63 -1.020 9.935 -0.630 1.00 54.34 C ATOM 976 CG TRP A 63 -2.498 10.305 -0.705 1.00 32.42 C ATOM 977 CD1 TRP A 63 -3.076 11.483 -0.303 1.00 34.15 C ATOM 978 CD2 TRP A 63 -3.565 9.510 -1.255 1.00 54.23 C ATOM 979 NE1 TRP A 63 -4.427 11.451 -0.533 1.00 1.20 N ATOM 980 CE2 TRP A 63 -4.750 10.256 -1.122 1.00 75.51 C ATOM 981 CE3 TRP A 63 -3.635 8.240 -1.836 1.00 2.24 C ATOM 982 CZ2 TRP A 63 -5.985 9.776 -1.548 1.00 43.15 C ATOM 983 CZ3 TRP A 63 -4.863 7.768 -2.260 1.00 53.14 C ATOM 984 CH2 TRP A 63 -6.023 8.534 -2.114 1.00 43.54 C ATOM 0 H TRP A 63 1.491 9.779 -0.901 1.00 63.31 H new ATOM 0 HA TRP A 63 -0.672 9.102 -2.591 1.00 64.42 H new ATOM 0 HB2 TRP A 63 -0.927 8.944 -0.185 1.00 54.34 H new ATOM 0 HB3 TRP A 63 -0.515 10.633 0.037 1.00 54.34 H new ATOM 0 HD1 TRP A 63 -2.543 12.316 0.132 1.00 34.15 H new ATOM 0 HE1 TRP A 63 -5.085 12.196 -0.303 1.00 1.20 H new ATOM 0 HE3 TRP A 63 -2.745 7.639 -1.951 1.00 2.24 H new ATOM 0 HZ2 TRP A 63 -6.883 10.366 -1.435 1.00 43.15 H new ATOM 0 HZ3 TRP A 63 -4.927 6.789 -2.712 1.00 53.14 H new ATOM 0 HH2 TRP A 63 -6.967 8.136 -2.455 1.00 43.54 H new ATOM 995 N LYS A 64 0.162 12.324 -2.507 1.00 1.21 N ATOM 996 CA LYS A 64 -0.057 13.628 -3.186 1.00 32.45 C ATOM 997 C LYS A 64 -0.059 13.470 -4.713 1.00 34.54 C ATOM 998 O LYS A 64 -0.778 14.169 -5.423 1.00 51.34 O ATOM 999 CB LYS A 64 1.026 14.655 -2.775 1.00 0.13 C ATOM 1000 CG LYS A 64 1.096 14.935 -1.268 1.00 54.55 C ATOM 1001 CD LYS A 64 -0.265 15.365 -0.681 1.00 0.43 C ATOM 1002 CE LYS A 64 -0.161 15.795 0.780 1.00 14.05 C ATOM 1003 NZ LYS A 64 -1.443 16.364 1.281 1.00 4.01 N ATOM 0 H LYS A 64 0.941 12.325 -1.849 1.00 1.21 H new ATOM 0 HA LYS A 64 -1.034 13.994 -2.871 1.00 32.45 H new ATOM 0 HB2 LYS A 64 1.998 14.293 -3.110 1.00 0.13 H new ATOM 0 HB3 LYS A 64 0.837 15.593 -3.298 1.00 0.13 H new ATOM 0 HG2 LYS A 64 1.444 14.040 -0.752 1.00 54.55 H new ATOM 0 HG3 LYS A 64 1.832 15.717 -1.081 1.00 54.55 H new ATOM 0 HD2 LYS A 64 -0.668 16.188 -1.271 1.00 0.43 H new ATOM 0 HD3 LYS A 64 -0.970 14.538 -0.764 1.00 0.43 H new ATOM 0 HE2 LYS A 64 0.120 14.938 1.392 1.00 14.05 H new ATOM 0 HE3 LYS A 64 0.631 16.536 0.885 1.00 14.05 H new ATOM 0 HZ1 LYS A 64 -1.333 16.644 2.276 1.00 4.01 H new ATOM 0 HZ2 LYS A 64 -1.699 17.197 0.713 1.00 4.01 H new ATOM 0 HZ3 LYS A 64 -2.194 15.649 1.204 1.00 4.01 H new ATOM 1017 N LYS A 65 0.761 12.527 -5.185 1.00 12.53 N ATOM 1018 CA LYS A 65 0.844 12.167 -6.595 1.00 25.54 C ATOM 1019 C LYS A 65 -0.407 11.383 -7.024 1.00 71.50 C ATOM 1020 O LYS A 65 -1.069 11.774 -7.974 1.00 35.14 O ATOM 1021 CB LYS A 65 2.139 11.363 -6.837 1.00 75.24 C ATOM 1022 CG LYS A 65 3.424 12.130 -6.444 1.00 22.41 C ATOM 1023 CD LYS A 65 3.634 13.416 -7.274 1.00 2.23 C ATOM 1024 CE LYS A 65 3.885 13.117 -8.759 1.00 73.21 C ATOM 1025 NZ LYS A 65 3.983 14.360 -9.570 1.00 34.34 N ATOM 0 H LYS A 65 1.391 11.989 -4.589 1.00 12.53 H new ATOM 0 HA LYS A 65 0.880 13.069 -7.206 1.00 25.54 H new ATOM 0 HB2 LYS A 65 2.092 10.434 -6.269 1.00 75.24 H new ATOM 0 HB3 LYS A 65 2.196 11.090 -7.891 1.00 75.24 H new ATOM 0 HG2 LYS A 65 3.377 12.390 -5.386 1.00 22.41 H new ATOM 0 HG3 LYS A 65 4.286 11.475 -6.573 1.00 22.41 H new ATOM 0 HD2 LYS A 65 2.756 14.055 -7.178 1.00 2.23 H new ATOM 0 HD3 LYS A 65 4.480 13.973 -6.870 1.00 2.23 H new ATOM 0 HE2 LYS A 65 4.806 12.543 -8.862 1.00 73.21 H new ATOM 0 HE3 LYS A 65 3.077 12.495 -9.145 1.00 73.21 H new ATOM 0 HZ1 LYS A 65 4.153 14.112 -10.566 1.00 34.34 H new ATOM 0 HZ2 LYS A 65 3.095 14.896 -9.493 1.00 34.34 H new ATOM 0 HZ3 LYS A 65 4.770 14.942 -9.219 1.00 34.34 H new ATOM 1039 N VAL A 66 -0.739 10.317 -6.262 1.00 52.30 N ATOM 1040 CA VAL A 66 -1.909 9.446 -6.530 1.00 10.14 C ATOM 1041 C VAL A 66 -3.218 10.270 -6.585 1.00 70.30 C ATOM 1042 O VAL A 66 -3.910 10.257 -7.596 1.00 74.31 O ATOM 1043 CB VAL A 66 -2.019 8.313 -5.437 1.00 15.24 C ATOM 1044 CG1 VAL A 66 -3.282 7.444 -5.631 1.00 23.53 C ATOM 1045 CG2 VAL A 66 -0.742 7.439 -5.419 1.00 1.14 C ATOM 0 H VAL A 66 -0.203 10.034 -5.442 1.00 52.30 H new ATOM 0 HA VAL A 66 -1.762 8.979 -7.504 1.00 10.14 H new ATOM 0 HB VAL A 66 -2.112 8.804 -4.468 1.00 15.24 H new ATOM 0 HG11 VAL A 66 -3.318 6.677 -4.857 1.00 23.53 H new ATOM 0 HG12 VAL A 66 -4.170 8.072 -5.561 1.00 23.53 H new ATOM 0 HG13 VAL A 66 -3.250 6.969 -6.612 1.00 23.53 H new ATOM 0 HG21 VAL A 66 -0.841 6.665 -4.658 1.00 1.14 H new ATOM 0 HG22 VAL A 66 -0.606 6.973 -6.395 1.00 1.14 H new ATOM 0 HG23 VAL A 66 0.123 8.063 -5.192 1.00 1.14 H new ATOM 1055 N TYR A 67 -3.495 10.990 -5.487 1.00 35.42 N ATOM 1056 CA TYR A 67 -4.635 11.919 -5.320 1.00 43.13 C ATOM 1057 C TYR A 67 -4.796 12.884 -6.521 1.00 42.13 C ATOM 1058 O TYR A 67 -5.911 13.105 -7.008 1.00 34.31 O ATOM 1059 CB TYR A 67 -4.417 12.726 -4.009 1.00 31.22 C ATOM 1060 CG TYR A 67 -5.593 13.615 -3.565 1.00 52.31 C ATOM 1061 CD1 TYR A 67 -6.627 13.092 -2.794 1.00 32.45 C ATOM 1062 CD2 TYR A 67 -5.662 14.972 -3.900 1.00 31.21 C ATOM 1063 CE1 TYR A 67 -7.678 13.878 -2.371 1.00 43.12 C ATOM 1064 CE2 TYR A 67 -6.719 15.760 -3.480 1.00 10.34 C ATOM 1065 CZ TYR A 67 -7.724 15.207 -2.717 1.00 23.41 C ATOM 1066 OH TYR A 67 -8.780 15.993 -2.292 1.00 42.11 O ATOM 0 H TYR A 67 -2.909 10.942 -4.653 1.00 35.42 H new ATOM 0 HA TYR A 67 -5.553 11.334 -5.269 1.00 43.13 H new ATOM 0 HB2 TYR A 67 -4.194 12.024 -3.206 1.00 31.22 H new ATOM 0 HB3 TYR A 67 -3.537 13.357 -4.135 1.00 31.22 H new ATOM 0 HD1 TYR A 67 -6.606 12.047 -2.521 1.00 32.45 H new ATOM 0 HD2 TYR A 67 -4.877 15.412 -4.497 1.00 31.21 H new ATOM 0 HE1 TYR A 67 -8.465 13.449 -1.768 1.00 43.12 H new ATOM 0 HE2 TYR A 67 -6.756 16.805 -3.749 1.00 10.34 H new ATOM 0 HH TYR A 67 -8.551 16.939 -2.409 1.00 42.11 H new ATOM 1076 N ASP A 68 -3.661 13.437 -6.983 1.00 33.14 N ATOM 1077 CA ASP A 68 -3.620 14.385 -8.113 1.00 21.41 C ATOM 1078 C ASP A 68 -3.987 13.685 -9.436 1.00 64.13 C ATOM 1079 O ASP A 68 -4.767 14.218 -10.231 1.00 63.31 O ATOM 1080 CB ASP A 68 -2.217 15.033 -8.211 1.00 75.43 C ATOM 1081 CG ASP A 68 -2.094 16.061 -9.351 1.00 4.45 C ATOM 1082 OD1 ASP A 68 -2.751 17.124 -9.276 1.00 71.32 O ATOM 1083 OD2 ASP A 68 -1.348 15.818 -10.322 1.00 53.33 O ATOM 0 H ASP A 68 -2.744 13.239 -6.583 1.00 33.14 H new ATOM 0 HA ASP A 68 -4.358 15.167 -7.933 1.00 21.41 H new ATOM 0 HB2 ASP A 68 -1.984 15.522 -7.265 1.00 75.43 H new ATOM 0 HB3 ASP A 68 -1.473 14.250 -8.357 1.00 75.43 H new ATOM 1088 N LEU A 69 -3.430 12.471 -9.630 1.00 33.35 N ATOM 1089 CA LEU A 69 -3.678 11.620 -10.814 1.00 0.01 C ATOM 1090 C LEU A 69 -5.157 11.205 -10.899 1.00 20.24 C ATOM 1091 O LEU A 69 -5.714 11.091 -12.006 1.00 34.13 O ATOM 1092 CB LEU A 69 -2.795 10.344 -10.750 1.00 73.22 C ATOM 1093 CG LEU A 69 -1.257 10.557 -10.808 1.00 2.21 C ATOM 1094 CD1 LEU A 69 -0.501 9.245 -10.521 1.00 60.32 C ATOM 1095 CD2 LEU A 69 -0.840 11.156 -12.154 1.00 72.14 C ATOM 0 H LEU A 69 -2.787 12.048 -8.960 1.00 33.35 H new ATOM 0 HA LEU A 69 -3.424 12.202 -11.700 1.00 0.01 H new ATOM 0 HB2 LEU A 69 -3.031 9.813 -9.828 1.00 73.22 H new ATOM 0 HB3 LEU A 69 -3.080 9.691 -11.575 1.00 73.22 H new ATOM 0 HG LEU A 69 -0.987 11.268 -10.027 1.00 2.21 H new ATOM 0 HD11 LEU A 69 0.573 9.426 -10.569 1.00 60.32 H new ATOM 0 HD12 LEU A 69 -0.764 8.883 -9.527 1.00 60.32 H new ATOM 0 HD13 LEU A 69 -0.776 8.497 -11.264 1.00 60.32 H new ATOM 0 HD21 LEU A 69 0.241 11.296 -12.171 1.00 72.14 H new ATOM 0 HD22 LEU A 69 -1.131 10.481 -12.959 1.00 72.14 H new ATOM 0 HD23 LEU A 69 -1.333 12.118 -12.292 1.00 72.14 H new ATOM 1107 N LEU A 70 -5.764 10.959 -9.714 1.00 44.23 N ATOM 1108 CA LEU A 70 -7.180 10.576 -9.583 1.00 45.12 C ATOM 1109 C LEU A 70 -8.064 11.642 -10.244 1.00 1.33 C ATOM 1110 O LEU A 70 -8.805 11.351 -11.184 1.00 72.21 O ATOM 1111 CB LEU A 70 -7.583 10.403 -8.080 1.00 74.21 C ATOM 1112 CG LEU A 70 -6.880 9.263 -7.283 1.00 71.31 C ATOM 1113 CD1 LEU A 70 -7.397 9.183 -5.828 1.00 4.40 C ATOM 1114 CD2 LEU A 70 -7.016 7.915 -8.003 1.00 24.14 C ATOM 0 H LEU A 70 -5.277 11.023 -8.820 1.00 44.23 H new ATOM 0 HA LEU A 70 -7.325 9.618 -10.083 1.00 45.12 H new ATOM 0 HB2 LEU A 70 -7.388 11.345 -7.567 1.00 74.21 H new ATOM 0 HB3 LEU A 70 -8.659 10.233 -8.036 1.00 74.21 H new ATOM 0 HG LEU A 70 -5.818 9.505 -7.235 1.00 71.31 H new ATOM 0 HD11 LEU A 70 -6.884 8.377 -5.303 1.00 4.40 H new ATOM 0 HD12 LEU A 70 -7.203 10.128 -5.320 1.00 4.40 H new ATOM 0 HD13 LEU A 70 -8.469 8.988 -5.833 1.00 4.40 H new ATOM 0 HD21 LEU A 70 -6.515 7.140 -7.422 1.00 24.14 H new ATOM 0 HD22 LEU A 70 -8.071 7.664 -8.109 1.00 24.14 H new ATOM 0 HD23 LEU A 70 -6.558 7.982 -8.990 1.00 24.14 H new ATOM 1126 N ILE A 71 -7.905 12.887 -9.768 1.00 44.20 N ATOM 1127 CA ILE A 71 -8.697 14.048 -10.213 1.00 14.51 C ATOM 1128 C ILE A 71 -8.361 14.418 -11.678 1.00 73.15 C ATOM 1129 O ILE A 71 -9.224 14.883 -12.429 1.00 75.13 O ATOM 1130 CB ILE A 71 -8.444 15.279 -9.259 1.00 61.40 C ATOM 1131 CG1 ILE A 71 -8.652 14.873 -7.766 1.00 14.34 C ATOM 1132 CG2 ILE A 71 -9.352 16.478 -9.625 1.00 55.23 C ATOM 1133 CD1 ILE A 71 -8.260 15.934 -6.750 1.00 22.32 C ATOM 0 H ILE A 71 -7.215 13.120 -9.054 1.00 44.20 H new ATOM 0 HA ILE A 71 -9.753 13.781 -10.167 1.00 14.51 H new ATOM 0 HB ILE A 71 -7.409 15.592 -9.395 1.00 61.40 H new ATOM 0 HG12 ILE A 71 -9.702 14.619 -7.617 1.00 14.34 H new ATOM 0 HG13 ILE A 71 -8.075 13.970 -7.567 1.00 14.34 H new ATOM 0 HG21 ILE A 71 -9.150 17.307 -8.947 1.00 55.23 H new ATOM 0 HG22 ILE A 71 -9.148 16.789 -10.650 1.00 55.23 H new ATOM 0 HG23 ILE A 71 -10.398 16.183 -9.536 1.00 55.23 H new ATOM 0 HD11 ILE A 71 -8.441 15.558 -5.743 1.00 22.32 H new ATOM 0 HD12 ILE A 71 -7.203 16.173 -6.863 1.00 22.32 H new ATOM 0 HD13 ILE A 71 -8.855 16.832 -6.914 1.00 22.32 H new ATOM 1145 N LEU A 72 -7.097 14.169 -12.070 1.00 44.14 N ATOM 1146 CA LEU A 72 -6.583 14.490 -13.415 1.00 3.13 C ATOM 1147 C LEU A 72 -7.307 13.649 -14.492 1.00 1.52 C ATOM 1148 O LEU A 72 -7.752 14.196 -15.510 1.00 25.32 O ATOM 1149 CB LEU A 72 -5.029 14.303 -13.433 1.00 52.13 C ATOM 1150 CG LEU A 72 -4.222 14.776 -14.703 1.00 13.21 C ATOM 1151 CD1 LEU A 72 -4.230 13.727 -15.831 1.00 55.01 C ATOM 1152 CD2 LEU A 72 -4.711 16.158 -15.205 1.00 61.25 C ATOM 0 H LEU A 72 -6.402 13.738 -11.461 1.00 44.14 H new ATOM 0 HA LEU A 72 -6.791 15.532 -13.656 1.00 3.13 H new ATOM 0 HB2 LEU A 72 -4.623 14.829 -12.569 1.00 52.13 H new ATOM 0 HB3 LEU A 72 -4.822 13.243 -13.286 1.00 52.13 H new ATOM 0 HG LEU A 72 -3.184 14.887 -14.390 1.00 13.21 H new ATOM 0 HD11 LEU A 72 -3.661 14.103 -16.681 1.00 55.01 H new ATOM 0 HD12 LEU A 72 -3.778 12.803 -15.471 1.00 55.01 H new ATOM 0 HD13 LEU A 72 -5.257 13.532 -16.140 1.00 55.01 H new ATOM 0 HD21 LEU A 72 -4.133 16.452 -16.081 1.00 61.25 H new ATOM 0 HD22 LEU A 72 -5.766 16.096 -15.471 1.00 61.25 H new ATOM 0 HD23 LEU A 72 -4.578 16.899 -14.417 1.00 61.25 H new ATOM 1164 N HIS A 73 -7.420 12.329 -14.264 1.00 14.34 N ATOM 1165 CA HIS A 73 -8.107 11.423 -15.211 1.00 24.53 C ATOM 1166 C HIS A 73 -9.631 11.406 -14.981 1.00 63.04 C ATOM 1167 O HIS A 73 -10.392 11.815 -15.872 1.00 42.43 O ATOM 1168 CB HIS A 73 -7.533 9.990 -15.124 1.00 32.55 C ATOM 1169 CG HIS A 73 -6.233 9.785 -15.855 1.00 62.14 C ATOM 1170 ND1 HIS A 73 -6.155 9.129 -17.064 1.00 0.13 N ATOM 1171 CD2 HIS A 73 -4.968 10.142 -15.545 1.00 3.53 C ATOM 1172 CE1 HIS A 73 -4.906 9.091 -17.464 1.00 45.43 C ATOM 1173 NE2 HIS A 73 -4.161 9.701 -16.565 1.00 61.34 N ATOM 0 H HIS A 73 -7.047 11.864 -13.436 1.00 14.34 H new ATOM 0 HA HIS A 73 -7.925 11.809 -16.214 1.00 24.53 H new ATOM 0 HB2 HIS A 73 -7.387 9.735 -14.074 1.00 32.55 H new ATOM 0 HB3 HIS A 73 -8.271 9.293 -15.522 1.00 32.55 H new ATOM 0 HD2 HIS A 73 -4.650 10.675 -14.661 1.00 3.53 H new ATOM 0 HE1 HIS A 73 -4.549 8.636 -18.376 1.00 45.43 H new ATOM 0 HE2 HIS A 73 -3.150 9.825 -16.618 1.00 61.34 H new ATOM 1182 N ASP A 74 -10.068 10.951 -13.788 1.00 32.45 N ATOM 1183 CA ASP A 74 -11.505 10.745 -13.494 1.00 40.52 C ATOM 1184 C ASP A 74 -11.753 10.598 -11.973 1.00 43.34 C ATOM 1185 O ASP A 74 -11.719 9.487 -11.436 1.00 14.41 O ATOM 1186 CB ASP A 74 -12.042 9.504 -14.273 1.00 62.43 C ATOM 1187 CG ASP A 74 -13.562 9.294 -14.108 1.00 11.24 C ATOM 1188 OD1 ASP A 74 -14.343 10.016 -14.771 1.00 41.44 O ATOM 1189 OD2 ASP A 74 -13.980 8.416 -13.318 1.00 22.03 O ATOM 0 H ASP A 74 -9.448 10.719 -13.012 1.00 32.45 H new ATOM 0 HA ASP A 74 -12.052 11.627 -13.828 1.00 40.52 H new ATOM 0 HB2 ASP A 74 -11.811 9.620 -15.332 1.00 62.43 H new ATOM 0 HB3 ASP A 74 -11.519 8.612 -13.928 1.00 62.43 H new ATOM 1194 N PHE A 75 -11.936 11.754 -11.313 1.00 63.01 N ATOM 1195 CA PHE A 75 -12.340 11.889 -9.890 1.00 21.44 C ATOM 1196 C PHE A 75 -12.502 13.384 -9.571 1.00 70.44 C ATOM 1197 O PHE A 75 -12.172 14.254 -10.389 1.00 62.52 O ATOM 1198 CB PHE A 75 -11.312 11.238 -8.878 1.00 22.04 C ATOM 1199 CG PHE A 75 -11.678 9.843 -8.345 1.00 71.50 C ATOM 1200 CD1 PHE A 75 -12.896 9.620 -7.715 1.00 63.43 C ATOM 1201 CD2 PHE A 75 -10.787 8.768 -8.445 1.00 3.21 C ATOM 1202 CE1 PHE A 75 -13.218 8.375 -7.207 1.00 72.31 C ATOM 1203 CE2 PHE A 75 -11.111 7.522 -7.941 1.00 24.42 C ATOM 1204 CZ PHE A 75 -12.327 7.327 -7.320 1.00 32.31 C ATOM 0 H PHE A 75 -11.803 12.658 -11.767 1.00 63.01 H new ATOM 0 HA PHE A 75 -13.278 11.349 -9.762 1.00 21.44 H new ATOM 0 HB2 PHE A 75 -10.341 11.174 -9.369 1.00 22.04 H new ATOM 0 HB3 PHE A 75 -11.195 11.910 -8.028 1.00 22.04 H new ATOM 0 HD1 PHE A 75 -13.602 10.432 -7.621 1.00 63.43 H new ATOM 0 HD2 PHE A 75 -9.830 8.914 -8.924 1.00 3.21 H new ATOM 0 HE1 PHE A 75 -14.170 8.222 -6.720 1.00 72.31 H new ATOM 0 HE2 PHE A 75 -10.413 6.703 -8.033 1.00 24.42 H new ATOM 0 HZ PHE A 75 -12.582 6.356 -6.923 1.00 32.31 H new ATOM 1214 N THR A 76 -13.009 13.662 -8.367 1.00 61.11 N ATOM 1215 CA THR A 76 -13.042 15.012 -7.789 1.00 42.45 C ATOM 1216 C THR A 76 -12.817 14.861 -6.257 1.00 23.33 C ATOM 1217 O THR A 76 -13.144 13.795 -5.711 1.00 2.51 O ATOM 1218 CB THR A 76 -14.401 15.752 -8.144 1.00 13.30 C ATOM 1219 OG1 THR A 76 -14.258 17.168 -7.980 1.00 41.45 O ATOM 1220 CG2 THR A 76 -15.598 15.282 -7.293 1.00 2.51 C ATOM 0 H THR A 76 -13.413 12.950 -7.758 1.00 61.11 H new ATOM 0 HA THR A 76 -12.256 15.640 -8.209 1.00 42.45 H new ATOM 0 HB THR A 76 -14.611 15.498 -9.183 1.00 13.30 H new ATOM 0 HG1 THR A 76 -15.103 17.610 -8.204 1.00 41.45 H new ATOM 0 HG21 THR A 76 -16.493 15.830 -7.589 1.00 2.51 H new ATOM 0 HG22 THR A 76 -15.758 14.215 -7.448 1.00 2.51 H new ATOM 0 HG23 THR A 76 -15.391 15.469 -6.239 1.00 2.51 H new ATOM 1228 N PRO A 77 -12.219 15.885 -5.543 1.00 25.20 N ATOM 1229 CA PRO A 77 -11.923 15.811 -4.077 1.00 42.43 C ATOM 1230 C PRO A 77 -13.109 15.321 -3.215 1.00 40.14 C ATOM 1231 O PRO A 77 -12.894 14.581 -2.254 1.00 1.45 O ATOM 1232 CB PRO A 77 -11.489 17.263 -3.706 1.00 64.33 C ATOM 1233 CG PRO A 77 -11.784 18.104 -4.918 1.00 3.13 C ATOM 1234 CD PRO A 77 -11.724 17.169 -6.102 1.00 62.20 C ATOM 0 HA PRO A 77 -11.153 15.067 -3.871 1.00 42.43 H new ATOM 0 HB2 PRO A 77 -12.038 17.625 -2.837 1.00 64.33 H new ATOM 0 HB3 PRO A 77 -10.430 17.301 -3.452 1.00 64.33 H new ATOM 0 HG2 PRO A 77 -12.766 18.570 -4.839 1.00 3.13 H new ATOM 0 HG3 PRO A 77 -11.056 18.909 -5.020 1.00 3.13 H new ATOM 0 HD2 PRO A 77 -12.349 17.519 -6.924 1.00 62.20 H new ATOM 0 HD3 PRO A 77 -10.710 17.075 -6.491 1.00 62.20 H new ATOM 1242 N GLU A 78 -14.348 15.700 -3.613 1.00 30.21 N ATOM 1243 CA GLU A 78 -15.598 15.295 -2.921 1.00 3.15 C ATOM 1244 C GLU A 78 -15.796 13.768 -2.946 1.00 43.13 C ATOM 1245 O GLU A 78 -16.212 13.175 -1.943 1.00 65.55 O ATOM 1246 CB GLU A 78 -16.827 15.999 -3.554 1.00 30.22 C ATOM 1247 CG GLU A 78 -16.831 17.531 -3.407 1.00 3.23 C ATOM 1248 CD GLU A 78 -18.072 18.196 -4.031 1.00 25.24 C ATOM 1249 OE1 GLU A 78 -18.128 18.325 -5.273 1.00 23.32 O ATOM 1250 OE2 GLU A 78 -18.996 18.589 -3.283 1.00 42.11 O ATOM 0 H GLU A 78 -14.510 16.296 -4.425 1.00 30.21 H new ATOM 0 HA GLU A 78 -15.506 15.605 -1.880 1.00 3.15 H new ATOM 0 HB2 GLU A 78 -16.867 15.748 -4.614 1.00 30.22 H new ATOM 0 HB3 GLU A 78 -17.733 15.601 -3.098 1.00 30.22 H new ATOM 0 HG2 GLU A 78 -16.782 17.788 -2.349 1.00 3.23 H new ATOM 0 HG3 GLU A 78 -15.935 17.937 -3.876 1.00 3.23 H new ATOM 1257 N GLU A 79 -15.498 13.145 -4.099 1.00 73.23 N ATOM 1258 CA GLU A 79 -15.599 11.680 -4.266 1.00 1.34 C ATOM 1259 C GLU A 79 -14.564 10.951 -3.393 1.00 64.50 C ATOM 1260 O GLU A 79 -14.907 10.033 -2.646 1.00 11.33 O ATOM 1261 CB GLU A 79 -15.392 11.281 -5.749 1.00 61.42 C ATOM 1262 CG GLU A 79 -16.475 11.790 -6.713 1.00 14.25 C ATOM 1263 CD GLU A 79 -17.872 11.213 -6.420 1.00 12.31 C ATOM 1264 OE1 GLU A 79 -18.061 9.990 -6.594 1.00 33.45 O ATOM 1265 OE2 GLU A 79 -18.784 11.974 -6.032 1.00 60.55 O ATOM 0 H GLU A 79 -15.183 13.635 -4.936 1.00 73.23 H new ATOM 0 HA GLU A 79 -16.599 11.383 -3.950 1.00 1.34 H new ATOM 0 HB2 GLU A 79 -14.425 11.659 -6.080 1.00 61.42 H new ATOM 0 HB3 GLU A 79 -15.349 10.194 -5.815 1.00 61.42 H new ATOM 0 HG2 GLU A 79 -16.520 12.878 -6.656 1.00 14.25 H new ATOM 0 HG3 GLU A 79 -16.191 11.535 -7.734 1.00 14.25 H new ATOM 1272 N ILE A 80 -13.309 11.418 -3.484 1.00 54.12 N ATOM 1273 CA ILE A 80 -12.146 10.785 -2.837 1.00 23.20 C ATOM 1274 C ILE A 80 -12.296 10.794 -1.303 1.00 20.22 C ATOM 1275 O ILE A 80 -12.127 9.759 -0.645 1.00 53.43 O ATOM 1276 CB ILE A 80 -10.816 11.512 -3.269 1.00 71.33 C ATOM 1277 CG1 ILE A 80 -10.687 11.550 -4.828 1.00 3.21 C ATOM 1278 CG2 ILE A 80 -9.576 10.844 -2.627 1.00 34.51 C ATOM 1279 CD1 ILE A 80 -9.492 12.333 -5.351 1.00 21.32 C ATOM 0 H ILE A 80 -13.069 12.255 -4.015 1.00 54.12 H new ATOM 0 HA ILE A 80 -12.097 9.746 -3.164 1.00 23.20 H new ATOM 0 HB ILE A 80 -10.863 12.539 -2.906 1.00 71.33 H new ATOM 0 HG12 ILE A 80 -10.623 10.527 -5.198 1.00 3.21 H new ATOM 0 HG13 ILE A 80 -11.597 11.983 -5.243 1.00 3.21 H new ATOM 0 HG21 ILE A 80 -8.675 11.369 -2.945 1.00 34.51 H new ATOM 0 HG22 ILE A 80 -9.659 10.890 -1.541 1.00 34.51 H new ATOM 0 HG23 ILE A 80 -9.520 9.802 -2.943 1.00 34.51 H new ATOM 0 HD11 ILE A 80 -9.486 12.303 -6.441 1.00 21.32 H new ATOM 0 HD12 ILE A 80 -9.561 13.368 -5.017 1.00 21.32 H new ATOM 0 HD13 ILE A 80 -8.572 11.889 -4.971 1.00 21.32 H new ATOM 1291 N LYS A 81 -12.676 11.966 -0.757 1.00 50.30 N ATOM 1292 CA LYS A 81 -12.850 12.155 0.696 1.00 70.10 C ATOM 1293 C LYS A 81 -14.048 11.344 1.228 1.00 12.31 C ATOM 1294 O LYS A 81 -14.065 10.970 2.399 1.00 71.21 O ATOM 1295 CB LYS A 81 -13.009 13.656 1.037 1.00 21.01 C ATOM 1296 CG LYS A 81 -14.335 14.292 0.571 1.00 63.22 C ATOM 1297 CD LYS A 81 -14.317 15.834 0.617 1.00 15.51 C ATOM 1298 CE LYS A 81 -14.120 16.398 2.031 1.00 51.24 C ATOM 1299 NZ LYS A 81 -14.048 17.888 2.022 1.00 22.11 N ATOM 0 H LYS A 81 -12.870 12.803 -1.307 1.00 50.30 H new ATOM 0 HA LYS A 81 -11.952 11.783 1.190 1.00 70.10 H new ATOM 0 HB2 LYS A 81 -12.924 13.779 2.117 1.00 21.01 H new ATOM 0 HB3 LYS A 81 -12.182 14.205 0.587 1.00 21.01 H new ATOM 0 HG2 LYS A 81 -14.548 13.968 -0.448 1.00 63.22 H new ATOM 0 HG3 LYS A 81 -15.147 13.925 1.199 1.00 63.22 H new ATOM 0 HD2 LYS A 81 -13.518 16.200 -0.027 1.00 15.51 H new ATOM 0 HD3 LYS A 81 -15.254 16.214 0.209 1.00 15.51 H new ATOM 0 HE2 LYS A 81 -14.943 16.077 2.670 1.00 51.24 H new ATOM 0 HE3 LYS A 81 -13.205 15.991 2.461 1.00 51.24 H new ATOM 0 HZ1 LYS A 81 -13.915 18.235 2.993 1.00 22.11 H new ATOM 0 HZ2 LYS A 81 -13.248 18.193 1.432 1.00 22.11 H new ATOM 0 HZ3 LYS A 81 -14.932 18.276 1.634 1.00 22.11 H new ATOM 1313 N SER A 82 -15.025 11.057 0.343 1.00 0.33 N ATOM 1314 CA SER A 82 -16.232 10.287 0.699 1.00 50.15 C ATOM 1315 C SER A 82 -15.863 8.830 1.048 1.00 71.42 C ATOM 1316 O SER A 82 -16.518 8.202 1.887 1.00 42.12 O ATOM 1317 CB SER A 82 -17.256 10.339 -0.458 1.00 1.34 C ATOM 1318 OG SER A 82 -18.488 9.738 -0.098 1.00 3.41 O ATOM 0 H SER A 82 -14.999 11.351 -0.633 1.00 0.33 H new ATOM 0 HA SER A 82 -16.688 10.736 1.581 1.00 50.15 H new ATOM 0 HB2 SER A 82 -17.428 11.376 -0.745 1.00 1.34 H new ATOM 0 HB3 SER A 82 -16.845 9.831 -1.330 1.00 1.34 H new ATOM 0 HG SER A 82 -19.111 9.791 -0.853 1.00 3.41 H new ATOM 1324 N PHE A 83 -14.789 8.318 0.402 1.00 24.41 N ATOM 1325 CA PHE A 83 -14.242 6.974 0.689 1.00 72.12 C ATOM 1326 C PHE A 83 -13.499 6.946 2.034 1.00 11.32 C ATOM 1327 O PHE A 83 -13.412 5.894 2.653 1.00 61.32 O ATOM 1328 CB PHE A 83 -13.301 6.486 -0.441 1.00 41.12 C ATOM 1329 CG PHE A 83 -13.986 6.320 -1.798 1.00 34.02 C ATOM 1330 CD1 PHE A 83 -14.912 5.298 -2.007 1.00 55.22 C ATOM 1331 CD2 PHE A 83 -13.713 7.182 -2.857 1.00 63.13 C ATOM 1332 CE1 PHE A 83 -15.539 5.147 -3.229 1.00 3.43 C ATOM 1333 CE2 PHE A 83 -14.341 7.032 -4.076 1.00 21.34 C ATOM 1334 CZ PHE A 83 -15.252 6.015 -4.266 1.00 44.55 C ATOM 0 H PHE A 83 -14.282 8.821 -0.326 1.00 24.41 H new ATOM 0 HA PHE A 83 -15.093 6.295 0.746 1.00 72.12 H new ATOM 0 HB2 PHE A 83 -12.479 7.194 -0.546 1.00 41.12 H new ATOM 0 HB3 PHE A 83 -12.864 5.531 -0.148 1.00 41.12 H new ATOM 0 HD1 PHE A 83 -15.142 4.615 -1.202 1.00 55.22 H new ATOM 0 HD2 PHE A 83 -12.998 7.980 -2.722 1.00 63.13 H new ATOM 0 HE1 PHE A 83 -16.254 4.350 -3.374 1.00 3.43 H new ATOM 0 HE2 PHE A 83 -14.118 7.713 -4.884 1.00 21.34 H new ATOM 0 HZ PHE A 83 -15.740 5.897 -5.222 1.00 44.55 H new ATOM 1344 N PHE A 84 -12.965 8.103 2.468 1.00 62.54 N ATOM 1345 CA PHE A 84 -12.325 8.239 3.799 1.00 54.01 C ATOM 1346 C PHE A 84 -13.403 8.286 4.901 1.00 73.43 C ATOM 1347 O PHE A 84 -13.245 7.677 5.967 1.00 60.34 O ATOM 1348 CB PHE A 84 -11.440 9.522 3.884 1.00 75.24 C ATOM 1349 CG PHE A 84 -10.136 9.486 3.073 1.00 60.14 C ATOM 1350 CD1 PHE A 84 -8.958 9.004 3.641 1.00 13.20 C ATOM 1351 CD2 PHE A 84 -10.081 9.955 1.761 1.00 63.54 C ATOM 1352 CE1 PHE A 84 -7.774 8.987 2.923 1.00 42.43 C ATOM 1353 CE2 PHE A 84 -8.895 9.944 1.047 1.00 11.50 C ATOM 1354 CZ PHE A 84 -7.742 9.458 1.629 1.00 0.33 C ATOM 0 H PHE A 84 -12.962 8.962 1.918 1.00 62.54 H new ATOM 0 HA PHE A 84 -11.682 7.371 3.946 1.00 54.01 H new ATOM 0 HB2 PHE A 84 -12.032 10.373 3.547 1.00 75.24 H new ATOM 0 HB3 PHE A 84 -11.191 9.701 4.930 1.00 75.24 H new ATOM 0 HD1 PHE A 84 -8.969 8.638 4.657 1.00 13.20 H new ATOM 0 HD2 PHE A 84 -10.978 10.333 1.294 1.00 63.54 H new ATOM 0 HE1 PHE A 84 -6.873 8.603 3.379 1.00 42.43 H new ATOM 0 HE2 PHE A 84 -8.872 10.316 0.033 1.00 11.50 H new ATOM 0 HZ PHE A 84 -6.817 9.447 1.071 1.00 0.33 H new ATOM 1364 N GLU A 85 -14.519 8.978 4.609 1.00 24.50 N ATOM 1365 CA GLU A 85 -15.597 9.237 5.588 1.00 61.20 C ATOM 1366 C GLU A 85 -16.614 8.078 5.676 1.00 32.14 C ATOM 1367 O GLU A 85 -17.763 8.297 6.076 1.00 20.32 O ATOM 1368 CB GLU A 85 -16.319 10.576 5.240 1.00 31.42 C ATOM 1369 CG GLU A 85 -15.405 11.822 5.223 1.00 34.23 C ATOM 1370 CD GLU A 85 -14.599 12.004 6.524 1.00 60.45 C ATOM 1371 OE1 GLU A 85 -15.166 12.492 7.527 1.00 4.05 O ATOM 1372 OE2 GLU A 85 -13.397 11.649 6.547 1.00 22.11 O ATOM 0 H GLU A 85 -14.702 9.375 3.687 1.00 24.50 H new ATOM 0 HA GLU A 85 -15.132 9.317 6.570 1.00 61.20 H new ATOM 0 HB2 GLU A 85 -16.789 10.475 4.262 1.00 31.42 H new ATOM 0 HB3 GLU A 85 -17.118 10.739 5.963 1.00 31.42 H new ATOM 0 HG2 GLU A 85 -14.714 11.746 4.383 1.00 34.23 H new ATOM 0 HG3 GLU A 85 -16.015 12.709 5.054 1.00 34.23 H new ATOM 1379 N ASN A 86 -16.182 6.846 5.342 1.00 55.25 N ATOM 1380 CA ASN A 86 -17.037 5.650 5.454 1.00 72.32 C ATOM 1381 C ASN A 86 -17.179 5.261 6.943 1.00 60.01 C ATOM 1382 O ASN A 86 -16.311 4.587 7.513 1.00 43.22 O ATOM 1383 CB ASN A 86 -16.453 4.468 4.632 1.00 73.52 C ATOM 1384 CG ASN A 86 -17.436 3.299 4.442 1.00 75.25 C ATOM 1385 OD1 ASN A 86 -18.384 3.112 5.211 1.00 44.44 O ATOM 1386 ND2 ASN A 86 -17.195 2.475 3.435 1.00 40.22 N ATOM 0 H ASN A 86 -15.243 6.654 4.992 1.00 55.25 H new ATOM 0 HA ASN A 86 -18.021 5.879 5.046 1.00 72.32 H new ATOM 0 HB2 ASN A 86 -16.146 4.835 3.653 1.00 73.52 H new ATOM 0 HB3 ASN A 86 -15.556 4.099 5.130 1.00 73.52 H new ATOM 0 HD21 ASN A 86 -17.798 1.667 3.282 1.00 40.22 H new ATOM 0 HD22 ASN A 86 -16.406 2.648 2.812 1.00 40.22 H new ATOM 1393 N LYS A 87 -18.265 5.738 7.570 1.00 21.12 N ATOM 1394 CA LYS A 87 -18.540 5.524 8.997 1.00 74.22 C ATOM 1395 C LYS A 87 -19.474 4.313 9.198 1.00 64.13 C ATOM 1396 O LYS A 87 -20.698 4.460 9.296 1.00 43.15 O ATOM 1397 CB LYS A 87 -19.167 6.803 9.622 1.00 3.51 C ATOM 1398 CG LYS A 87 -18.321 8.088 9.459 1.00 4.51 C ATOM 1399 CD LYS A 87 -18.902 9.282 10.255 1.00 20.04 C ATOM 1400 CE LYS A 87 -18.950 9.011 11.770 1.00 55.02 C ATOM 1401 NZ LYS A 87 -19.527 10.153 12.525 1.00 62.02 N ATOM 0 H LYS A 87 -18.982 6.287 7.096 1.00 21.12 H new ATOM 0 HA LYS A 87 -17.597 5.314 9.501 1.00 74.22 H new ATOM 0 HB2 LYS A 87 -20.145 6.969 9.170 1.00 3.51 H new ATOM 0 HB3 LYS A 87 -19.333 6.627 10.685 1.00 3.51 H new ATOM 0 HG2 LYS A 87 -17.302 7.894 9.793 1.00 4.51 H new ATOM 0 HG3 LYS A 87 -18.265 8.352 8.403 1.00 4.51 H new ATOM 0 HD2 LYS A 87 -18.297 10.169 10.067 1.00 20.04 H new ATOM 0 HD3 LYS A 87 -19.908 9.499 9.896 1.00 20.04 H new ATOM 0 HE2 LYS A 87 -19.543 8.116 11.959 1.00 55.02 H new ATOM 0 HE3 LYS A 87 -17.943 8.809 12.134 1.00 55.02 H new ATOM 0 HZ1 LYS A 87 -19.540 9.927 13.540 1.00 62.02 H new ATOM 0 HZ2 LYS A 87 -18.948 11.002 12.367 1.00 62.02 H new ATOM 0 HZ3 LYS A 87 -20.498 10.331 12.198 1.00 62.02 H new ATOM 1415 N GLY A 88 -18.883 3.109 9.222 1.00 23.00 N ATOM 1416 CA GLY A 88 -19.636 1.876 9.487 1.00 54.31 C ATOM 1417 C GLY A 88 -19.058 0.692 8.741 1.00 41.41 C ATOM 1418 O GLY A 88 -18.833 -0.374 9.324 1.00 70.43 O ATOM 0 H GLY A 88 -17.886 2.964 9.061 1.00 23.00 H new ATOM 0 HA2 GLY A 88 -19.630 1.669 10.557 1.00 54.31 H new ATOM 0 HA3 GLY A 88 -20.677 2.016 9.195 1.00 54.31 H new ATOM 1422 N LYS A 89 -18.830 0.884 7.435 1.00 64.13 N ATOM 1423 CA LYS A 89 -18.155 -0.113 6.584 1.00 43.03 C ATOM 1424 C LYS A 89 -16.651 0.225 6.522 1.00 10.23 C ATOM 1425 O LYS A 89 -16.196 1.183 7.163 1.00 1.41 O ATOM 1426 CB LYS A 89 -18.776 -0.111 5.155 1.00 71.33 C ATOM 1427 CG LYS A 89 -20.316 -0.292 5.099 1.00 34.23 C ATOM 1428 CD LYS A 89 -20.810 -1.679 5.573 1.00 44.25 C ATOM 1429 CE LYS A 89 -20.237 -2.847 4.745 1.00 73.34 C ATOM 1430 NZ LYS A 89 -20.451 -2.673 3.277 1.00 62.10 N ATOM 0 H LYS A 89 -19.106 1.730 6.937 1.00 64.13 H new ATOM 0 HA LYS A 89 -18.287 -1.109 7.006 1.00 43.03 H new ATOM 0 HB2 LYS A 89 -18.520 0.829 4.667 1.00 71.33 H new ATOM 0 HB3 LYS A 89 -18.312 -0.908 4.574 1.00 71.33 H new ATOM 0 HG2 LYS A 89 -20.783 0.477 5.714 1.00 34.23 H new ATOM 0 HG3 LYS A 89 -20.652 -0.130 4.075 1.00 34.23 H new ATOM 0 HD2 LYS A 89 -20.537 -1.816 6.619 1.00 44.25 H new ATOM 0 HD3 LYS A 89 -21.898 -1.706 5.522 1.00 44.25 H new ATOM 0 HE2 LYS A 89 -19.169 -2.938 4.944 1.00 73.34 H new ATOM 0 HE3 LYS A 89 -20.702 -3.778 5.068 1.00 73.34 H new ATOM 0 HZ1 LYS A 89 -20.139 -3.530 2.777 1.00 62.10 H new ATOM 0 HZ2 LYS A 89 -21.461 -2.511 3.090 1.00 62.10 H new ATOM 0 HZ3 LYS A 89 -19.902 -1.857 2.940 1.00 62.10 H new ATOM 1444 N ARG A 90 -15.887 -0.576 5.763 1.00 64.45 N ATOM 1445 CA ARG A 90 -14.451 -0.345 5.565 1.00 24.43 C ATOM 1446 C ARG A 90 -14.243 0.802 4.551 1.00 33.33 C ATOM 1447 O ARG A 90 -14.815 0.753 3.453 1.00 24.41 O ATOM 1448 CB ARG A 90 -13.761 -1.642 5.064 1.00 41.25 C ATOM 1449 CG ARG A 90 -12.235 -1.510 4.845 1.00 11.33 C ATOM 1450 CD ARG A 90 -11.603 -2.804 4.314 1.00 35.32 C ATOM 1451 NE ARG A 90 -11.793 -3.941 5.234 1.00 31.01 N ATOM 1452 CZ ARG A 90 -11.808 -5.235 4.881 1.00 3.21 C ATOM 1453 NH1 ARG A 90 -11.640 -5.594 3.605 1.00 4.02 N ATOM 1454 NH2 ARG A 90 -11.991 -6.165 5.809 1.00 22.35 N ATOM 0 H ARG A 90 -16.246 -1.396 5.273 1.00 64.45 H new ATOM 0 HA ARG A 90 -14.001 -0.063 6.517 1.00 24.43 H new ATOM 0 HB2 ARG A 90 -13.945 -2.439 5.785 1.00 41.25 H new ATOM 0 HB3 ARG A 90 -14.225 -1.947 4.126 1.00 41.25 H new ATOM 0 HG2 ARG A 90 -12.041 -0.700 4.142 1.00 11.33 H new ATOM 0 HG3 ARG A 90 -11.758 -1.236 5.786 1.00 11.33 H new ATOM 0 HD2 ARG A 90 -12.039 -3.047 3.345 1.00 35.32 H new ATOM 0 HD3 ARG A 90 -10.537 -2.645 4.153 1.00 35.32 H new ATOM 0 HE ARG A 90 -11.924 -3.725 6.222 1.00 31.01 H new ATOM 0 HH11 ARG A 90 -11.499 -4.881 2.889 1.00 4.02 H new ATOM 0 HH12 ARG A 90 -11.653 -6.581 3.347 1.00 4.02 H new ATOM 0 HH21 ARG A 90 -12.119 -5.894 6.784 1.00 22.35 H new ATOM 0 HH22 ARG A 90 -12.004 -7.151 5.548 1.00 22.35 H new ATOM 1468 N PRO A 91 -13.462 1.871 4.914 1.00 14.23 N ATOM 1469 CA PRO A 91 -13.061 2.916 3.952 1.00 32.02 C ATOM 1470 C PRO A 91 -12.158 2.339 2.841 1.00 50.21 C ATOM 1471 O PRO A 91 -11.212 1.597 3.131 1.00 21.05 O ATOM 1472 CB PRO A 91 -12.310 3.962 4.837 1.00 13.42 C ATOM 1473 CG PRO A 91 -12.710 3.651 6.250 1.00 21.41 C ATOM 1474 CD PRO A 91 -12.937 2.159 6.278 1.00 40.02 C ATOM 0 HA PRO A 91 -13.906 3.355 3.421 1.00 32.02 H new ATOM 0 HB2 PRO A 91 -11.231 3.883 4.708 1.00 13.42 H new ATOM 0 HB3 PRO A 91 -12.590 4.980 4.565 1.00 13.42 H new ATOM 0 HG2 PRO A 91 -11.931 3.944 6.953 1.00 21.41 H new ATOM 0 HG3 PRO A 91 -13.613 4.192 6.532 1.00 21.41 H new ATOM 0 HD2 PRO A 91 -12.014 1.615 6.478 1.00 40.02 H new ATOM 0 HD3 PRO A 91 -13.649 1.874 7.052 1.00 40.02 H new ATOM 1482 N VAL A 92 -12.491 2.645 1.572 1.00 21.15 N ATOM 1483 CA VAL A 92 -11.674 2.230 0.414 1.00 33.12 C ATOM 1484 C VAL A 92 -10.334 2.982 0.433 1.00 45.53 C ATOM 1485 O VAL A 92 -9.277 2.420 0.147 1.00 3.22 O ATOM 1486 CB VAL A 92 -12.431 2.476 -0.946 1.00 2.53 C ATOM 1487 CG1 VAL A 92 -11.556 2.104 -2.167 1.00 25.11 C ATOM 1488 CG2 VAL A 92 -13.776 1.712 -0.970 1.00 1.13 C ATOM 0 H VAL A 92 -13.323 3.180 1.322 1.00 21.15 H new ATOM 0 HA VAL A 92 -11.487 1.159 0.491 1.00 33.12 H new ATOM 0 HB VAL A 92 -12.642 3.543 -1.016 1.00 2.53 H new ATOM 0 HG11 VAL A 92 -12.115 2.288 -3.085 1.00 25.11 H new ATOM 0 HG12 VAL A 92 -10.651 2.712 -2.165 1.00 25.11 H new ATOM 0 HG13 VAL A 92 -11.285 1.050 -2.113 1.00 25.11 H new ATOM 0 HG21 VAL A 92 -14.282 1.896 -1.918 1.00 1.13 H new ATOM 0 HG22 VAL A 92 -13.590 0.644 -0.859 1.00 1.13 H new ATOM 0 HG23 VAL A 92 -14.405 2.057 -0.150 1.00 1.13 H new ATOM 1498 N PHE A 93 -10.402 4.273 0.767 1.00 25.42 N ATOM 1499 CA PHE A 93 -9.217 5.105 0.998 1.00 61.21 C ATOM 1500 C PHE A 93 -9.106 5.371 2.511 1.00 51.11 C ATOM 1501 O PHE A 93 -9.971 6.035 3.082 1.00 4.05 O ATOM 1502 CB PHE A 93 -9.324 6.438 0.201 1.00 4.31 C ATOM 1503 CG PHE A 93 -9.462 6.310 -1.330 1.00 51.14 C ATOM 1504 CD1 PHE A 93 -8.998 5.192 -2.026 1.00 52.05 C ATOM 1505 CD2 PHE A 93 -10.045 7.336 -2.072 1.00 42.01 C ATOM 1506 CE1 PHE A 93 -9.120 5.104 -3.402 1.00 62.51 C ATOM 1507 CE2 PHE A 93 -10.166 7.245 -3.450 1.00 44.22 C ATOM 1508 CZ PHE A 93 -9.703 6.127 -4.115 1.00 34.51 C ATOM 0 H PHE A 93 -11.283 4.773 0.885 1.00 25.42 H new ATOM 0 HA PHE A 93 -8.321 4.591 0.650 1.00 61.21 H new ATOM 0 HB2 PHE A 93 -10.184 6.993 0.577 1.00 4.31 H new ATOM 0 HB3 PHE A 93 -8.439 7.037 0.416 1.00 4.31 H new ATOM 0 HD1 PHE A 93 -8.536 4.382 -1.481 1.00 52.05 H new ATOM 0 HD2 PHE A 93 -10.409 8.217 -1.564 1.00 42.01 H new ATOM 0 HE1 PHE A 93 -8.756 4.228 -3.919 1.00 62.51 H new ATOM 0 HE2 PHE A 93 -10.624 8.051 -4.005 1.00 44.22 H new ATOM 0 HZ PHE A 93 -9.798 6.056 -5.188 1.00 34.51 H new ATOM 1518 N VAL A 94 -8.075 4.800 3.162 1.00 4.04 N ATOM 1519 CA VAL A 94 -7.807 5.003 4.607 1.00 31.10 C ATOM 1520 C VAL A 94 -6.502 5.816 4.780 1.00 52.54 C ATOM 1521 O VAL A 94 -5.640 5.793 3.896 1.00 20.10 O ATOM 1522 CB VAL A 94 -7.668 3.626 5.377 1.00 72.43 C ATOM 1523 CG1 VAL A 94 -7.591 3.836 6.900 1.00 51.10 C ATOM 1524 CG2 VAL A 94 -8.811 2.653 5.038 1.00 64.42 C ATOM 0 H VAL A 94 -7.402 4.184 2.705 1.00 4.04 H new ATOM 0 HA VAL A 94 -8.653 5.545 5.031 1.00 31.10 H new ATOM 0 HB VAL A 94 -6.733 3.179 5.038 1.00 72.43 H new ATOM 0 HG11 VAL A 94 -7.496 2.870 7.396 1.00 51.10 H new ATOM 0 HG12 VAL A 94 -6.725 4.453 7.139 1.00 51.10 H new ATOM 0 HG13 VAL A 94 -8.497 4.334 7.245 1.00 51.10 H new ATOM 0 HG21 VAL A 94 -8.673 1.723 5.590 1.00 64.42 H new ATOM 0 HG22 VAL A 94 -9.765 3.101 5.316 1.00 64.42 H new ATOM 0 HG23 VAL A 94 -8.806 2.444 3.968 1.00 64.42 H new ATOM 1534 N LYS A 95 -6.367 6.527 5.923 1.00 73.02 N ATOM 1535 CA LYS A 95 -5.147 7.281 6.270 1.00 12.20 C ATOM 1536 C LYS A 95 -4.903 7.292 7.786 1.00 75.41 C ATOM 1537 O LYS A 95 -5.734 6.826 8.567 1.00 62.13 O ATOM 1538 CB LYS A 95 -5.235 8.727 5.745 1.00 4.32 C ATOM 1539 CG LYS A 95 -6.364 9.582 6.363 1.00 22.41 C ATOM 1540 CD LYS A 95 -6.367 11.027 5.807 1.00 21.45 C ATOM 1541 CE LYS A 95 -5.102 11.810 6.180 1.00 2.25 C ATOM 1542 NZ LYS A 95 -5.021 13.102 5.448 1.00 2.14 N ATOM 0 H LYS A 95 -7.101 6.592 6.628 1.00 73.02 H new ATOM 0 HA LYS A 95 -4.306 6.777 5.793 1.00 12.20 H new ATOM 0 HB2 LYS A 95 -4.282 9.223 5.930 1.00 4.32 H new ATOM 0 HB3 LYS A 95 -5.374 8.697 4.664 1.00 4.32 H new ATOM 0 HG2 LYS A 95 -7.327 9.113 6.160 1.00 22.41 H new ATOM 0 HG3 LYS A 95 -6.246 9.610 7.446 1.00 22.41 H new ATOM 0 HD2 LYS A 95 -6.461 10.994 4.722 1.00 21.45 H new ATOM 0 HD3 LYS A 95 -7.241 11.556 6.187 1.00 21.45 H new ATOM 0 HE2 LYS A 95 -5.094 11.998 7.254 1.00 2.25 H new ATOM 0 HE3 LYS A 95 -4.222 11.208 5.955 1.00 2.25 H new ATOM 0 HZ1 LYS A 95 -4.698 13.848 6.096 1.00 2.14 H new ATOM 0 HZ2 LYS A 95 -4.349 13.013 4.660 1.00 2.14 H new ATOM 0 HZ3 LYS A 95 -5.960 13.349 5.076 1.00 2.14 H new ATOM 1556 N GLY A 96 -3.739 7.828 8.169 1.00 32.35 N ATOM 1557 CA GLY A 96 -3.316 7.948 9.563 1.00 12.35 C ATOM 1558 C GLY A 96 -1.878 7.489 9.704 1.00 1.31 C ATOM 1559 O GLY A 96 -1.117 7.571 8.746 1.00 41.15 O ATOM 0 H GLY A 96 -3.056 8.195 7.507 1.00 32.35 H new ATOM 0 HA2 GLY A 96 -3.411 8.982 9.894 1.00 12.35 H new ATOM 0 HA3 GLY A 96 -3.963 7.348 10.202 1.00 12.35 H new ATOM 1563 N SER A 97 -1.493 7.027 10.896 1.00 64.21 N ATOM 1564 CA SER A 97 -0.213 6.321 11.097 1.00 2.04 C ATOM 1565 C SER A 97 -0.279 4.924 10.445 1.00 55.23 C ATOM 1566 O SER A 97 -1.364 4.473 10.064 1.00 23.11 O ATOM 1567 CB SER A 97 0.079 6.221 12.613 1.00 32.30 C ATOM 1568 OG SER A 97 1.295 5.538 12.888 1.00 22.20 O ATOM 0 H SER A 97 -2.049 7.127 11.745 1.00 64.21 H new ATOM 0 HA SER A 97 0.598 6.874 10.623 1.00 2.04 H new ATOM 0 HB2 SER A 97 0.125 7.224 13.038 1.00 32.30 H new ATOM 0 HB3 SER A 97 -0.744 5.703 13.105 1.00 32.30 H new ATOM 0 HG SER A 97 1.438 5.501 13.857 1.00 22.20 H new ATOM 1574 N LEU A 98 0.882 4.249 10.322 1.00 51.51 N ATOM 1575 CA LEU A 98 0.965 2.870 9.782 1.00 55.41 C ATOM 1576 C LEU A 98 0.006 1.923 10.544 1.00 72.30 C ATOM 1577 O LEU A 98 -0.709 1.115 9.939 1.00 23.32 O ATOM 1578 CB LEU A 98 2.430 2.352 9.882 1.00 72.55 C ATOM 1579 CG LEU A 98 2.694 0.904 9.344 1.00 55.35 C ATOM 1580 CD1 LEU A 98 2.401 0.786 7.831 1.00 14.23 C ATOM 1581 CD2 LEU A 98 4.127 0.443 9.677 1.00 53.53 C ATOM 0 H LEU A 98 1.785 4.639 10.591 1.00 51.51 H new ATOM 0 HA LEU A 98 0.663 2.887 8.735 1.00 55.41 H new ATOM 0 HB2 LEU A 98 3.074 3.042 9.337 1.00 72.55 H new ATOM 0 HB3 LEU A 98 2.735 2.389 10.928 1.00 72.55 H new ATOM 0 HG LEU A 98 1.999 0.237 9.854 1.00 55.35 H new ATOM 0 HD11 LEU A 98 2.597 -0.234 7.501 1.00 14.23 H new ATOM 0 HD12 LEU A 98 1.356 1.034 7.642 1.00 14.23 H new ATOM 0 HD13 LEU A 98 3.042 1.475 7.281 1.00 14.23 H new ATOM 0 HD21 LEU A 98 4.284 -0.565 9.292 1.00 53.53 H new ATOM 0 HD22 LEU A 98 4.844 1.123 9.217 1.00 53.53 H new ATOM 0 HD23 LEU A 98 4.268 0.445 10.758 1.00 53.53 H new ATOM 1593 N GLU A 99 -0.015 2.084 11.878 1.00 23.13 N ATOM 1594 CA GLU A 99 -0.832 1.266 12.790 1.00 13.25 C ATOM 1595 C GLU A 99 -2.289 1.769 12.849 1.00 73.21 C ATOM 1596 O GLU A 99 -3.221 0.968 12.850 1.00 4.32 O ATOM 1597 CB GLU A 99 -0.180 1.257 14.196 1.00 32.51 C ATOM 1598 CG GLU A 99 1.295 0.804 14.177 1.00 73.12 C ATOM 1599 CD GLU A 99 1.924 0.690 15.568 1.00 32.14 C ATOM 1600 OE1 GLU A 99 2.256 1.734 16.161 1.00 2.44 O ATOM 1601 OE2 GLU A 99 2.122 -0.447 16.064 1.00 52.40 O ATOM 0 H GLU A 99 0.540 2.792 12.358 1.00 23.13 H new ATOM 0 HA GLU A 99 -0.868 0.245 12.410 1.00 13.25 H new ATOM 0 HB2 GLU A 99 -0.241 2.257 14.624 1.00 32.51 H new ATOM 0 HB3 GLU A 99 -0.749 0.595 14.849 1.00 32.51 H new ATOM 0 HG2 GLU A 99 1.362 -0.163 13.678 1.00 73.12 H new ATOM 0 HG3 GLU A 99 1.875 1.511 13.583 1.00 73.12 H new ATOM 1608 N SER A 100 -2.468 3.111 12.866 1.00 34.23 N ATOM 1609 CA SER A 100 -3.800 3.755 12.951 1.00 41.22 C ATOM 1610 C SER A 100 -4.678 3.383 11.741 1.00 44.34 C ATOM 1611 O SER A 100 -5.816 2.919 11.897 1.00 42.42 O ATOM 1612 CB SER A 100 -3.645 5.293 13.032 1.00 63.44 C ATOM 1613 OG SER A 100 -2.830 5.689 14.128 1.00 44.51 O ATOM 0 H SER A 100 -1.696 3.776 12.821 1.00 34.23 H new ATOM 0 HA SER A 100 -4.290 3.392 13.854 1.00 41.22 H new ATOM 0 HB2 SER A 100 -3.209 5.663 12.104 1.00 63.44 H new ATOM 0 HB3 SER A 100 -4.629 5.752 13.127 1.00 63.44 H new ATOM 0 HG SER A 100 -2.755 6.666 14.144 1.00 44.51 H new ATOM 1619 N ALA A 101 -4.114 3.585 10.536 1.00 51.54 N ATOM 1620 CA ALA A 101 -4.775 3.283 9.256 1.00 11.01 C ATOM 1621 C ALA A 101 -5.098 1.787 9.128 1.00 50.21 C ATOM 1622 O ALA A 101 -6.065 1.407 8.465 1.00 41.43 O ATOM 1623 CB ALA A 101 -3.890 3.758 8.095 1.00 12.01 C ATOM 0 H ALA A 101 -3.175 3.967 10.424 1.00 51.54 H new ATOM 0 HA ALA A 101 -5.724 3.818 9.221 1.00 11.01 H new ATOM 0 HB1 ALA A 101 -4.381 3.534 7.148 1.00 12.01 H new ATOM 0 HB2 ALA A 101 -3.731 4.833 8.175 1.00 12.01 H new ATOM 0 HB3 ALA A 101 -2.929 3.245 8.136 1.00 12.01 H new ATOM 1629 N ALA A 102 -4.284 0.954 9.798 1.00 42.54 N ATOM 1630 CA ALA A 102 -4.483 -0.497 9.850 1.00 72.24 C ATOM 1631 C ALA A 102 -5.770 -0.847 10.611 1.00 70.45 C ATOM 1632 O ALA A 102 -6.580 -1.642 10.136 1.00 42.44 O ATOM 1633 CB ALA A 102 -3.282 -1.163 10.512 1.00 15.35 C ATOM 0 H ALA A 102 -3.468 1.273 10.319 1.00 42.54 H new ATOM 0 HA ALA A 102 -4.580 -0.868 8.830 1.00 72.24 H new ATOM 0 HB1 ALA A 102 -3.437 -2.241 10.547 1.00 15.35 H new ATOM 0 HB2 ALA A 102 -2.382 -0.945 9.937 1.00 15.35 H new ATOM 0 HB3 ALA A 102 -3.167 -0.780 11.526 1.00 15.35 H new ATOM 1639 N GLU A 103 -5.941 -0.214 11.789 1.00 71.01 N ATOM 1640 CA GLU A 103 -7.113 -0.425 12.671 1.00 22.31 C ATOM 1641 C GLU A 103 -8.418 0.021 11.976 1.00 3.00 C ATOM 1642 O GLU A 103 -9.446 -0.655 12.056 1.00 43.54 O ATOM 1643 CB GLU A 103 -6.912 0.353 14.004 1.00 74.23 C ATOM 1644 CG GLU A 103 -5.578 0.043 14.713 1.00 5.30 C ATOM 1645 CD GLU A 103 -5.341 0.865 15.987 1.00 64.22 C ATOM 1646 OE1 GLU A 103 -5.193 2.103 15.878 1.00 41.13 O ATOM 1647 OE2 GLU A 103 -5.302 0.283 17.098 1.00 72.31 O ATOM 0 H GLU A 103 -5.270 0.460 12.159 1.00 71.01 H new ATOM 0 HA GLU A 103 -7.199 -1.490 12.887 1.00 22.31 H new ATOM 0 HB2 GLU A 103 -6.964 1.423 13.801 1.00 74.23 H new ATOM 0 HB3 GLU A 103 -7.735 0.117 14.679 1.00 74.23 H new ATOM 0 HG2 GLU A 103 -5.551 -1.017 14.967 1.00 5.30 H new ATOM 0 HG3 GLU A 103 -4.758 0.225 14.018 1.00 5.30 H new ATOM 1654 N GLN A 104 -8.329 1.160 11.271 1.00 71.31 N ATOM 1655 CA GLN A 104 -9.456 1.768 10.534 1.00 51.40 C ATOM 1656 C GLN A 104 -9.858 0.927 9.302 1.00 33.10 C ATOM 1657 O GLN A 104 -11.040 0.875 8.938 1.00 50.24 O ATOM 1658 CB GLN A 104 -9.072 3.209 10.114 1.00 1.32 C ATOM 1659 CG GLN A 104 -8.812 4.173 11.289 1.00 62.12 C ATOM 1660 CD GLN A 104 -8.261 5.528 10.838 1.00 21.22 C ATOM 1661 OE1 GLN A 104 -6.954 5.622 10.722 1.00 45.11 O flip ATOM 1662 NE2 GLN A 104 -9.004 6.469 10.569 1.00 55.33 N flip ATOM 0 H GLN A 104 -7.463 1.694 11.194 1.00 71.31 H new ATOM 0 HA GLN A 104 -10.324 1.798 11.193 1.00 51.40 H new ATOM 0 HB2 GLN A 104 -8.178 3.166 9.492 1.00 1.32 H new ATOM 0 HB3 GLN A 104 -9.871 3.618 9.496 1.00 1.32 H new ATOM 0 HG2 GLN A 104 -9.741 4.329 11.837 1.00 62.12 H new ATOM 0 HG3 GLN A 104 -8.107 3.712 11.981 1.00 62.12 H new ATOM 0 HE21 GLN A 104 -10.014 6.366 10.669 1.00 55.33 H new ATOM 0 HE22 GLN A 104 -8.611 7.353 10.246 1.00 55.33 H new ATOM 1671 N ALA A 105 -8.866 0.277 8.668 1.00 32.31 N ATOM 1672 CA ALA A 105 -9.093 -0.603 7.503 1.00 62.43 C ATOM 1673 C ALA A 105 -9.509 -2.020 7.939 1.00 23.20 C ATOM 1674 O ALA A 105 -10.124 -2.753 7.168 1.00 25.53 O ATOM 1675 CB ALA A 105 -7.830 -0.652 6.630 1.00 30.45 C ATOM 0 H ALA A 105 -7.887 0.345 8.946 1.00 32.31 H new ATOM 0 HA ALA A 105 -9.914 -0.188 6.918 1.00 62.43 H new ATOM 0 HB1 ALA A 105 -8.005 -1.303 5.773 1.00 30.45 H new ATOM 0 HB2 ALA A 105 -7.590 0.352 6.280 1.00 30.45 H new ATOM 0 HB3 ALA A 105 -6.997 -1.040 7.216 1.00 30.45 H new ATOM 1681 N GLY A 106 -9.169 -2.393 9.182 1.00 2.21 N ATOM 1682 CA GLY A 106 -9.441 -3.737 9.690 1.00 55.04 C ATOM 1683 C GLY A 106 -8.447 -4.757 9.152 1.00 24.13 C ATOM 1684 O GLY A 106 -8.825 -5.774 8.560 1.00 13.33 O ATOM 0 H GLY A 106 -8.705 -1.779 9.851 1.00 2.21 H new ATOM 0 HA2 GLY A 106 -9.400 -3.729 10.779 1.00 55.04 H new ATOM 0 HA3 GLY A 106 -10.452 -4.033 9.411 1.00 55.04 H new ATOM 1688 N ILE A 107 -7.158 -4.434 9.320 1.00 70.10 N ATOM 1689 CA ILE A 107 -6.025 -5.313 8.972 1.00 60.15 C ATOM 1690 C ILE A 107 -5.320 -5.716 10.277 1.00 55.30 C ATOM 1691 O ILE A 107 -5.344 -4.941 11.246 1.00 63.35 O ATOM 1692 CB ILE A 107 -4.981 -4.574 8.043 1.00 12.05 C ATOM 1693 CG1 ILE A 107 -5.683 -3.775 6.913 1.00 2.12 C ATOM 1694 CG2 ILE A 107 -3.967 -5.570 7.434 1.00 2.44 C ATOM 1695 CD1 ILE A 107 -4.739 -2.925 6.077 1.00 24.53 C ATOM 0 H ILE A 107 -6.864 -3.538 9.709 1.00 70.10 H new ATOM 0 HA ILE A 107 -6.406 -6.181 8.433 1.00 60.15 H new ATOM 0 HB ILE A 107 -4.441 -3.869 8.675 1.00 12.05 H new ATOM 0 HG12 ILE A 107 -6.203 -4.474 6.257 1.00 2.12 H new ATOM 0 HG13 ILE A 107 -6.441 -3.129 7.356 1.00 2.12 H new ATOM 0 HG21 ILE A 107 -3.263 -5.031 6.800 1.00 2.44 H new ATOM 0 HG22 ILE A 107 -3.424 -6.072 8.235 1.00 2.44 H new ATOM 0 HG23 ILE A 107 -4.499 -6.311 6.837 1.00 2.44 H new ATOM 0 HD11 ILE A 107 -5.307 -2.399 5.310 1.00 24.53 H new ATOM 0 HD12 ILE A 107 -4.237 -2.201 6.718 1.00 24.53 H new ATOM 0 HD13 ILE A 107 -3.996 -3.566 5.603 1.00 24.53 H new ATOM 1707 N VAL A 108 -4.684 -6.905 10.307 1.00 55.20 N ATOM 1708 CA VAL A 108 -3.924 -7.346 11.484 1.00 62.32 C ATOM 1709 C VAL A 108 -2.630 -6.498 11.573 1.00 70.10 C ATOM 1710 O VAL A 108 -1.687 -6.675 10.778 1.00 72.12 O ATOM 1711 CB VAL A 108 -3.592 -8.882 11.445 1.00 23.03 C ATOM 1712 CG1 VAL A 108 -2.947 -9.348 12.768 1.00 25.52 C ATOM 1713 CG2 VAL A 108 -4.842 -9.727 11.102 1.00 35.35 C ATOM 0 H VAL A 108 -4.684 -7.570 9.533 1.00 55.20 H new ATOM 0 HA VAL A 108 -4.536 -7.196 12.373 1.00 62.32 H new ATOM 0 HB VAL A 108 -2.866 -9.038 10.647 1.00 23.03 H new ATOM 0 HG11 VAL A 108 -2.729 -10.414 12.711 1.00 25.52 H new ATOM 0 HG12 VAL A 108 -2.022 -8.797 12.936 1.00 25.52 H new ATOM 0 HG13 VAL A 108 -3.634 -9.162 13.593 1.00 25.52 H new ATOM 0 HG21 VAL A 108 -4.573 -10.783 11.084 1.00 35.35 H new ATOM 0 HG22 VAL A 108 -5.612 -9.561 11.856 1.00 35.35 H new ATOM 0 HG23 VAL A 108 -5.223 -9.433 10.124 1.00 35.35 H new ATOM 1723 N VAL A 109 -2.640 -5.559 12.533 1.00 53.42 N ATOM 1724 CA VAL A 109 -1.605 -4.523 12.691 1.00 44.42 C ATOM 1725 C VAL A 109 -0.206 -5.143 12.854 1.00 11.15 C ATOM 1726 O VAL A 109 0.722 -4.763 12.146 1.00 52.30 O ATOM 1727 CB VAL A 109 -1.938 -3.591 13.921 1.00 32.30 C ATOM 1728 CG1 VAL A 109 -0.868 -2.494 14.121 1.00 72.32 C ATOM 1729 CG2 VAL A 109 -3.349 -2.968 13.780 1.00 63.25 C ATOM 0 H VAL A 109 -3.379 -5.497 13.233 1.00 53.42 H new ATOM 0 HA VAL A 109 -1.600 -3.920 11.783 1.00 44.42 H new ATOM 0 HB VAL A 109 -1.929 -4.219 14.812 1.00 32.30 H new ATOM 0 HG11 VAL A 109 -1.137 -1.876 14.978 1.00 72.32 H new ATOM 0 HG12 VAL A 109 0.101 -2.959 14.299 1.00 72.32 H new ATOM 0 HG13 VAL A 109 -0.813 -1.872 13.228 1.00 72.32 H new ATOM 0 HG21 VAL A 109 -3.553 -2.331 14.640 1.00 63.25 H new ATOM 0 HG22 VAL A 109 -3.394 -2.372 12.868 1.00 63.25 H new ATOM 0 HG23 VAL A 109 -4.094 -3.762 13.732 1.00 63.25 H new ATOM 1739 N ASP A 110 -0.104 -6.136 13.758 1.00 63.10 N ATOM 1740 CA ASP A 110 1.162 -6.831 14.077 1.00 1.01 C ATOM 1741 C ASP A 110 1.798 -7.456 12.825 1.00 21.30 C ATOM 1742 O ASP A 110 3.008 -7.334 12.623 1.00 61.12 O ATOM 1743 CB ASP A 110 0.929 -7.911 15.173 1.00 72.13 C ATOM 1744 CG ASP A 110 2.198 -8.724 15.521 1.00 42.42 C ATOM 1745 OD1 ASP A 110 3.151 -8.141 16.086 1.00 3.30 O ATOM 1746 OD2 ASP A 110 2.255 -9.939 15.213 1.00 3.22 O ATOM 0 H ASP A 110 -0.901 -6.482 14.292 1.00 63.10 H new ATOM 0 HA ASP A 110 1.860 -6.087 14.461 1.00 1.01 H new ATOM 0 HB2 ASP A 110 0.559 -7.426 16.076 1.00 72.13 H new ATOM 0 HB3 ASP A 110 0.150 -8.595 14.837 1.00 72.13 H new ATOM 1751 N GLU A 111 0.956 -8.083 11.974 1.00 51.31 N ATOM 1752 CA GLU A 111 1.405 -8.713 10.721 1.00 53.14 C ATOM 1753 C GLU A 111 2.060 -7.684 9.783 1.00 41.04 C ATOM 1754 O GLU A 111 3.220 -7.864 9.373 1.00 33.12 O ATOM 1755 CB GLU A 111 0.228 -9.413 9.995 1.00 11.51 C ATOM 1756 CG GLU A 111 -0.311 -10.686 10.666 1.00 41.20 C ATOM 1757 CD GLU A 111 0.715 -11.830 10.737 1.00 63.41 C ATOM 1758 OE1 GLU A 111 1.078 -12.376 9.674 1.00 34.21 O ATOM 1759 OE2 GLU A 111 1.156 -12.186 11.846 1.00 42.54 O ATOM 0 H GLU A 111 -0.047 -8.164 12.138 1.00 51.31 H new ATOM 0 HA GLU A 111 2.149 -9.464 10.986 1.00 53.14 H new ATOM 0 HB2 GLU A 111 -0.591 -8.700 9.901 1.00 11.51 H new ATOM 0 HB3 GLU A 111 0.548 -9.666 8.984 1.00 11.51 H new ATOM 0 HG2 GLU A 111 -0.640 -10.442 11.676 1.00 41.20 H new ATOM 0 HG3 GLU A 111 -1.189 -11.030 10.119 1.00 41.20 H new ATOM 1766 N LEU A 112 1.318 -6.598 9.452 1.00 21.13 N ATOM 1767 CA LEU A 112 1.795 -5.615 8.455 1.00 60.23 C ATOM 1768 C LEU A 112 2.984 -4.810 8.980 1.00 35.42 C ATOM 1769 O LEU A 112 3.897 -4.520 8.220 1.00 65.43 O ATOM 1770 CB LEU A 112 0.649 -4.696 7.941 1.00 21.22 C ATOM 1771 CG LEU A 112 -0.021 -3.702 8.961 1.00 24.54 C ATOM 1772 CD1 LEU A 112 0.729 -2.354 9.097 1.00 4.24 C ATOM 1773 CD2 LEU A 112 -1.481 -3.459 8.597 1.00 43.54 C ATOM 0 H LEU A 112 0.405 -6.385 9.853 1.00 21.13 H new ATOM 0 HA LEU A 112 2.147 -6.182 7.594 1.00 60.23 H new ATOM 0 HB2 LEU A 112 1.041 -4.108 7.111 1.00 21.22 H new ATOM 0 HB3 LEU A 112 -0.135 -5.336 7.536 1.00 21.22 H new ATOM 0 HG LEU A 112 0.037 -4.188 9.935 1.00 24.54 H new ATOM 0 HD11 LEU A 112 0.210 -1.720 9.816 1.00 4.24 H new ATOM 0 HD12 LEU A 112 1.747 -2.537 9.442 1.00 4.24 H new ATOM 0 HD13 LEU A 112 0.759 -1.855 8.128 1.00 4.24 H new ATOM 0 HD21 LEU A 112 -1.925 -2.769 9.315 1.00 43.54 H new ATOM 0 HD22 LEU A 112 -1.540 -3.030 7.597 1.00 43.54 H new ATOM 0 HD23 LEU A 112 -2.024 -4.404 8.619 1.00 43.54 H new ATOM 1785 N VAL A 113 2.975 -4.479 10.292 1.00 1.32 N ATOM 1786 CA VAL A 113 4.068 -3.715 10.924 1.00 24.24 C ATOM 1787 C VAL A 113 5.381 -4.486 10.796 1.00 65.10 C ATOM 1788 O VAL A 113 6.400 -3.886 10.483 1.00 40.43 O ATOM 1789 CB VAL A 113 3.766 -3.327 12.431 1.00 51.33 C ATOM 1790 CG1 VAL A 113 5.012 -2.748 13.158 1.00 75.11 C ATOM 1791 CG2 VAL A 113 2.599 -2.312 12.501 1.00 34.52 C ATOM 0 H VAL A 113 2.221 -4.731 10.931 1.00 1.32 H new ATOM 0 HA VAL A 113 4.155 -2.769 10.390 1.00 24.24 H new ATOM 0 HB VAL A 113 3.486 -4.247 12.945 1.00 51.33 H new ATOM 0 HG11 VAL A 113 4.750 -2.499 14.186 1.00 75.11 H new ATOM 0 HG12 VAL A 113 5.811 -3.489 13.156 1.00 75.11 H new ATOM 0 HG13 VAL A 113 5.350 -1.849 12.642 1.00 75.11 H new ATOM 0 HG21 VAL A 113 2.403 -2.055 13.542 1.00 34.52 H new ATOM 0 HG22 VAL A 113 2.867 -1.411 11.949 1.00 34.52 H new ATOM 0 HG23 VAL A 113 1.705 -2.755 12.062 1.00 34.52 H new ATOM 1801 N GLN A 114 5.328 -5.828 10.960 1.00 62.42 N ATOM 1802 CA GLN A 114 6.502 -6.686 10.745 1.00 24.32 C ATOM 1803 C GLN A 114 6.972 -6.607 9.284 1.00 5.23 C ATOM 1804 O GLN A 114 8.077 -6.149 9.030 1.00 1.24 O ATOM 1805 CB GLN A 114 6.235 -8.159 11.156 1.00 23.22 C ATOM 1806 CG GLN A 114 6.011 -8.376 12.666 1.00 60.10 C ATOM 1807 CD GLN A 114 7.154 -7.848 13.535 1.00 4.54 C ATOM 1808 OE1 GLN A 114 8.129 -8.551 13.807 1.00 21.43 O ATOM 1809 NE2 GLN A 114 7.033 -6.610 13.992 1.00 42.12 N ATOM 0 H GLN A 114 4.486 -6.332 11.239 1.00 62.42 H new ATOM 0 HA GLN A 114 7.297 -6.311 11.390 1.00 24.32 H new ATOM 0 HB2 GLN A 114 5.359 -8.519 10.617 1.00 23.22 H new ATOM 0 HB3 GLN A 114 7.079 -8.770 10.836 1.00 23.22 H new ATOM 0 HG2 GLN A 114 5.084 -7.885 12.962 1.00 60.10 H new ATOM 0 HG3 GLN A 114 5.883 -9.441 12.857 1.00 60.10 H new ATOM 0 HE21 GLN A 114 6.213 -6.054 13.748 1.00 42.12 H new ATOM 0 HE22 GLN A 114 7.760 -6.213 14.588 1.00 42.12 H new ATOM 1818 N THR A 115 6.103 -6.977 8.325 1.00 34.34 N ATOM 1819 CA THR A 115 6.512 -7.087 6.904 1.00 74.13 C ATOM 1820 C THR A 115 6.900 -5.715 6.282 1.00 13.24 C ATOM 1821 O THR A 115 7.638 -5.679 5.300 1.00 12.23 O ATOM 1822 CB THR A 115 5.424 -7.806 6.032 1.00 14.01 C ATOM 1823 OG1 THR A 115 5.941 -8.122 4.721 1.00 64.24 O ATOM 1824 CG2 THR A 115 4.149 -6.973 5.877 1.00 75.30 C ATOM 0 H THR A 115 5.124 -7.203 8.500 1.00 34.34 H new ATOM 0 HA THR A 115 7.409 -7.707 6.901 1.00 74.13 H new ATOM 0 HB THR A 115 5.168 -8.723 6.562 1.00 14.01 H new ATOM 0 HG1 THR A 115 5.247 -8.571 4.195 1.00 64.24 H new ATOM 0 HG21 THR A 115 3.430 -7.518 5.265 1.00 75.30 H new ATOM 0 HG22 THR A 115 3.717 -6.782 6.860 1.00 75.30 H new ATOM 0 HG23 THR A 115 4.390 -6.025 5.396 1.00 75.30 H new ATOM 1832 N VAL A 116 6.400 -4.596 6.867 1.00 34.21 N ATOM 1833 CA VAL A 116 6.742 -3.224 6.416 1.00 51.13 C ATOM 1834 C VAL A 116 8.065 -2.744 7.055 1.00 64.20 C ATOM 1835 O VAL A 116 8.901 -2.174 6.359 1.00 53.14 O ATOM 1836 CB VAL A 116 5.575 -2.187 6.699 1.00 42.44 C ATOM 1837 CG1 VAL A 116 6.011 -0.721 6.432 1.00 35.12 C ATOM 1838 CG2 VAL A 116 4.309 -2.535 5.870 1.00 63.03 C ATOM 0 H VAL A 116 5.755 -4.619 7.657 1.00 34.21 H new ATOM 0 HA VAL A 116 6.875 -3.272 5.335 1.00 51.13 H new ATOM 0 HB VAL A 116 5.334 -2.267 7.759 1.00 42.44 H new ATOM 0 HG11 VAL A 116 5.178 -0.050 6.640 1.00 35.12 H new ATOM 0 HG12 VAL A 116 6.851 -0.468 7.079 1.00 35.12 H new ATOM 0 HG13 VAL A 116 6.311 -0.615 5.389 1.00 35.12 H new ATOM 0 HG21 VAL A 116 3.524 -1.809 6.082 1.00 63.03 H new ATOM 0 HG22 VAL A 116 4.551 -2.508 4.808 1.00 63.03 H new ATOM 0 HG23 VAL A 116 3.962 -3.533 6.137 1.00 63.03 H new ATOM 1848 N LYS A 117 8.267 -2.988 8.369 1.00 54.03 N ATOM 1849 CA LYS A 117 9.495 -2.524 9.076 1.00 65.42 C ATOM 1850 C LYS A 117 10.714 -3.368 8.652 1.00 30.04 C ATOM 1851 O LYS A 117 11.842 -2.865 8.589 1.00 42.13 O ATOM 1852 CB LYS A 117 9.320 -2.565 10.625 1.00 5.33 C ATOM 1853 CG LYS A 117 9.382 -3.977 11.263 1.00 62.21 C ATOM 1854 CD LYS A 117 8.981 -3.994 12.757 1.00 42.21 C ATOM 1855 CE LYS A 117 9.896 -3.131 13.639 1.00 24.31 C ATOM 1856 NZ LYS A 117 9.500 -3.202 15.076 1.00 41.05 N ATOM 0 H LYS A 117 7.609 -3.496 8.960 1.00 54.03 H new ATOM 0 HA LYS A 117 9.665 -1.486 8.790 1.00 65.42 H new ATOM 0 HB2 LYS A 117 10.094 -1.946 11.078 1.00 5.33 H new ATOM 0 HB3 LYS A 117 8.361 -2.112 10.878 1.00 5.33 H new ATOM 0 HG2 LYS A 117 8.723 -4.647 10.710 1.00 62.21 H new ATOM 0 HG3 LYS A 117 10.394 -4.369 11.161 1.00 62.21 H new ATOM 0 HD2 LYS A 117 7.954 -3.641 12.855 1.00 42.21 H new ATOM 0 HD3 LYS A 117 9.001 -5.022 13.120 1.00 42.21 H new ATOM 0 HE2 LYS A 117 10.928 -3.464 13.529 1.00 24.31 H new ATOM 0 HE3 LYS A 117 9.857 -2.095 13.301 1.00 24.31 H new ATOM 0 HZ1 LYS A 117 10.139 -2.608 15.642 1.00 41.05 H new ATOM 0 HZ2 LYS A 117 8.523 -2.861 15.184 1.00 41.05 H new ATOM 0 HZ3 LYS A 117 9.561 -4.187 15.405 1.00 41.05 H new ATOM 1870 N ASN A 118 10.453 -4.655 8.354 1.00 4.54 N ATOM 1871 CA ASN A 118 11.474 -5.610 7.892 1.00 3.42 C ATOM 1872 C ASN A 118 11.804 -5.335 6.432 1.00 50.42 C ATOM 1873 O ASN A 118 12.950 -5.511 6.023 1.00 44.44 O ATOM 1874 CB ASN A 118 11.008 -7.076 8.084 1.00 20.22 C ATOM 1875 CG ASN A 118 10.809 -7.453 9.558 1.00 52.51 C ATOM 1876 OD1 ASN A 118 11.489 -6.932 10.446 1.00 4.24 O ATOM 1877 ND2 ASN A 118 9.883 -8.361 9.832 1.00 54.43 N ATOM 0 H ASN A 118 9.521 -5.062 8.428 1.00 4.54 H new ATOM 0 HA ASN A 118 12.372 -5.476 8.495 1.00 3.42 H new ATOM 0 HB2 ASN A 118 10.072 -7.227 7.546 1.00 20.22 H new ATOM 0 HB3 ASN A 118 11.743 -7.747 7.639 1.00 20.22 H new ATOM 0 HD21 ASN A 118 9.718 -8.646 10.797 1.00 54.43 H new ATOM 0 HD22 ASN A 118 9.336 -8.775 9.077 1.00 54.43 H new ATOM 1884 N TYR A 119 10.782 -4.882 5.665 1.00 15.14 N ATOM 1885 CA TYR A 119 10.985 -4.315 4.320 1.00 30.33 C ATOM 1886 C TYR A 119 11.979 -3.157 4.426 1.00 74.34 C ATOM 1887 O TYR A 119 13.083 -3.250 3.900 1.00 23.43 O ATOM 1888 CB TYR A 119 9.636 -3.854 3.685 1.00 40.14 C ATOM 1889 CG TYR A 119 9.752 -3.015 2.390 1.00 21.23 C ATOM 1890 CD1 TYR A 119 10.133 -3.596 1.175 1.00 23.43 C ATOM 1891 CD2 TYR A 119 9.468 -1.640 2.387 1.00 63.01 C ATOM 1892 CE1 TYR A 119 10.232 -2.840 0.018 1.00 40.14 C ATOM 1893 CE2 TYR A 119 9.567 -0.886 1.233 1.00 74.33 C ATOM 1894 CZ TYR A 119 9.950 -1.488 0.051 1.00 61.05 C ATOM 1895 OH TYR A 119 10.045 -0.738 -1.106 1.00 44.00 O ATOM 0 H TYR A 119 9.806 -4.901 5.962 1.00 15.14 H new ATOM 0 HA TYR A 119 11.390 -5.082 3.659 1.00 30.33 H new ATOM 0 HB2 TYR A 119 9.037 -4.739 3.470 1.00 40.14 H new ATOM 0 HB3 TYR A 119 9.089 -3.271 4.425 1.00 40.14 H new ATOM 0 HD1 TYR A 119 10.354 -4.653 1.139 1.00 23.43 H new ATOM 0 HD2 TYR A 119 9.166 -1.161 3.307 1.00 63.01 H new ATOM 0 HE1 TYR A 119 10.529 -3.307 -0.909 1.00 40.14 H new ATOM 0 HE2 TYR A 119 9.345 0.171 1.256 1.00 74.33 H new ATOM 0 HH TYR A 119 10.382 0.156 -0.889 1.00 44.00 H new ATOM 1905 N GLN A 120 11.609 -2.139 5.232 1.00 23.31 N ATOM 1906 CA GLN A 120 12.418 -0.926 5.454 1.00 75.30 C ATOM 1907 C GLN A 120 13.809 -1.254 6.051 1.00 72.52 C ATOM 1908 O GLN A 120 14.753 -0.460 5.923 1.00 31.05 O ATOM 1909 CB GLN A 120 11.653 0.075 6.370 1.00 3.23 C ATOM 1910 CG GLN A 120 10.317 0.597 5.777 1.00 30.20 C ATOM 1911 CD GLN A 120 9.707 1.786 6.539 1.00 11.55 C ATOM 1912 OE1 GLN A 120 8.961 2.620 5.827 1.00 14.15 O flip ATOM 1913 NE2 GLN A 120 9.884 1.944 7.746 1.00 15.32 N flip ATOM 0 H GLN A 120 10.731 -2.138 5.751 1.00 23.31 H new ATOM 0 HA GLN A 120 12.585 -0.463 4.481 1.00 75.30 H new ATOM 0 HB2 GLN A 120 11.448 -0.409 7.325 1.00 3.23 H new ATOM 0 HB3 GLN A 120 12.301 0.926 6.578 1.00 3.23 H new ATOM 0 HG2 GLN A 120 10.484 0.892 4.741 1.00 30.20 H new ATOM 0 HG3 GLN A 120 9.595 -0.220 5.764 1.00 30.20 H new ATOM 0 HE21 GLN A 120 10.463 1.286 8.267 1.00 15.32 H new ATOM 0 HE22 GLN A 120 9.452 2.733 8.226 1.00 15.32 H new ATOM 1922 N GLY A 121 13.909 -2.441 6.677 1.00 13.21 N ATOM 1923 CA GLY A 121 15.159 -2.959 7.197 1.00 42.05 C ATOM 1924 C GLY A 121 16.078 -3.441 6.088 1.00 70.14 C ATOM 1925 O GLY A 121 17.149 -2.879 5.886 1.00 2.14 O ATOM 0 H GLY A 121 13.113 -3.060 6.830 1.00 13.21 H new ATOM 0 HA2 GLY A 121 15.662 -2.182 7.773 1.00 42.05 H new ATOM 0 HA3 GLY A 121 14.954 -3.782 7.882 1.00 42.05 H new ATOM 1929 N TYR A 122 15.632 -4.452 5.319 1.00 42.31 N ATOM 1930 CA TYR A 122 16.465 -5.051 4.257 1.00 72.31 C ATOM 1931 C TYR A 122 16.711 -4.083 3.072 1.00 41.02 C ATOM 1932 O TYR A 122 17.642 -4.288 2.287 1.00 12.13 O ATOM 1933 CB TYR A 122 15.932 -6.447 3.817 1.00 4.34 C ATOM 1934 CG TYR A 122 14.514 -6.568 3.197 1.00 4.21 C ATOM 1935 CD1 TYR A 122 14.162 -5.924 2.007 1.00 45.15 C ATOM 1936 CD2 TYR A 122 13.554 -7.409 3.775 1.00 14.14 C ATOM 1937 CE1 TYR A 122 12.913 -6.101 1.433 1.00 52.32 C ATOM 1938 CE2 TYR A 122 12.316 -7.596 3.197 1.00 41.41 C ATOM 1939 CZ TYR A 122 11.999 -6.944 2.030 1.00 21.01 C ATOM 1940 OH TYR A 122 10.763 -7.141 1.453 1.00 44.04 O ATOM 0 H TYR A 122 14.706 -4.870 5.411 1.00 42.31 H new ATOM 0 HA TYR A 122 17.450 -5.228 4.689 1.00 72.31 H new ATOM 0 HB2 TYR A 122 16.639 -6.853 3.094 1.00 4.34 H new ATOM 0 HB3 TYR A 122 15.962 -7.097 4.691 1.00 4.34 H new ATOM 0 HD1 TYR A 122 14.878 -5.275 1.525 1.00 45.15 H new ATOM 0 HD2 TYR A 122 13.789 -7.923 4.695 1.00 14.14 H new ATOM 0 HE1 TYR A 122 12.656 -5.581 0.522 1.00 52.32 H new ATOM 0 HE2 TYR A 122 11.596 -8.254 3.661 1.00 41.41 H new ATOM 0 HH TYR A 122 10.242 -7.764 2.001 1.00 44.04 H new ATOM 1950 N VAL A 123 15.873 -3.029 2.964 1.00 3.31 N ATOM 1951 CA VAL A 123 16.060 -1.937 1.990 1.00 45.23 C ATOM 1952 C VAL A 123 17.385 -1.180 2.258 1.00 42.02 C ATOM 1953 O VAL A 123 18.190 -0.993 1.338 1.00 64.42 O ATOM 1954 CB VAL A 123 14.836 -0.934 2.010 1.00 20.12 C ATOM 1955 CG1 VAL A 123 15.155 0.382 1.272 1.00 32.21 C ATOM 1956 CG2 VAL A 123 13.568 -1.586 1.410 1.00 13.33 C ATOM 0 H VAL A 123 15.047 -2.913 3.552 1.00 3.31 H new ATOM 0 HA VAL A 123 16.113 -2.385 0.998 1.00 45.23 H new ATOM 0 HB VAL A 123 14.645 -0.694 3.056 1.00 20.12 H new ATOM 0 HG11 VAL A 123 14.287 1.040 1.311 1.00 32.21 H new ATOM 0 HG12 VAL A 123 16.003 0.871 1.751 1.00 32.21 H new ATOM 0 HG13 VAL A 123 15.400 0.166 0.232 1.00 32.21 H new ATOM 0 HG21 VAL A 123 12.744 -0.873 1.438 1.00 13.33 H new ATOM 0 HG22 VAL A 123 13.762 -1.877 0.378 1.00 13.33 H new ATOM 0 HG23 VAL A 123 13.303 -2.469 1.992 1.00 13.33 H new ATOM 1966 N GLN A 124 17.610 -0.768 3.525 1.00 61.03 N ATOM 1967 CA GLN A 124 18.824 0.002 3.908 1.00 42.44 C ATOM 1968 C GLN A 124 20.065 -0.912 3.994 1.00 53.21 C ATOM 1969 O GLN A 124 21.198 -0.432 3.914 1.00 44.21 O ATOM 1970 CB GLN A 124 18.598 0.789 5.229 1.00 35.30 C ATOM 1971 CG GLN A 124 18.197 -0.083 6.429 1.00 45.23 C ATOM 1972 CD GLN A 124 17.894 0.697 7.711 1.00 22.21 C ATOM 1973 OE1 GLN A 124 16.994 0.164 8.525 1.00 54.52 O flip ATOM 1974 NE2 GLN A 124 18.459 1.763 7.972 1.00 44.22 N flip ATOM 0 H GLN A 124 16.973 -0.952 4.300 1.00 61.03 H new ATOM 0 HA GLN A 124 19.015 0.733 3.122 1.00 42.44 H new ATOM 0 HB2 GLN A 124 19.512 1.328 5.477 1.00 35.30 H new ATOM 0 HB3 GLN A 124 17.822 1.537 5.064 1.00 35.30 H new ATOM 0 HG2 GLN A 124 17.318 -0.668 6.159 1.00 45.23 H new ATOM 0 HG3 GLN A 124 19.001 -0.791 6.632 1.00 45.23 H new ATOM 0 HE21 GLN A 124 19.147 2.147 7.325 1.00 44.22 H new ATOM 0 HE22 GLN A 124 18.238 2.260 8.835 1.00 44.22 H new ATOM 1983 N ASP A 125 19.835 -2.231 4.154 1.00 25.31 N ATOM 1984 CA ASP A 125 20.892 -3.261 4.000 1.00 5.23 C ATOM 1985 C ASP A 125 21.304 -3.404 2.518 1.00 42.25 C ATOM 1986 O ASP A 125 22.418 -3.851 2.211 1.00 52.00 O ATOM 1987 CB ASP A 125 20.388 -4.630 4.533 1.00 65.41 C ATOM 1988 CG ASP A 125 20.392 -4.735 6.067 1.00 44.55 C ATOM 1989 OD1 ASP A 125 19.454 -4.240 6.713 1.00 24.34 O ATOM 1990 OD2 ASP A 125 21.338 -5.317 6.633 1.00 63.14 O ATOM 0 H ASP A 125 18.920 -2.614 4.392 1.00 25.31 H new ATOM 0 HA ASP A 125 21.761 -2.945 4.578 1.00 5.23 H new ATOM 0 HB2 ASP A 125 19.375 -4.801 4.169 1.00 65.41 H new ATOM 0 HB3 ASP A 125 21.013 -5.423 4.122 1.00 65.41 H new ATOM 1995 N GLY A 126 20.379 -3.019 1.617 1.00 74.23 N ATOM 1996 CA GLY A 126 20.612 -3.049 0.177 1.00 61.34 C ATOM 1997 C GLY A 126 20.437 -4.440 -0.426 1.00 13.44 C ATOM 1998 O GLY A 126 21.229 -4.846 -1.286 1.00 44.55 O ATOM 0 H GLY A 126 19.453 -2.680 1.877 1.00 74.23 H new ATOM 0 HA2 GLY A 126 19.925 -2.358 -0.311 1.00 61.34 H new ATOM 0 HA3 GLY A 126 21.621 -2.694 -0.030 1.00 61.34 H new ATOM 2002 N HIS A 127 19.391 -5.161 0.022 1.00 21.01 N ATOM 2003 CA HIS A 127 19.088 -6.527 -0.453 1.00 11.23 C ATOM 2004 C HIS A 127 17.624 -6.902 -0.124 1.00 11.51 C ATOM 2005 O HIS A 127 17.271 -6.993 1.047 1.00 65.30 O ATOM 2006 CB HIS A 127 20.071 -7.541 0.207 1.00 43.20 C ATOM 2007 CG HIS A 127 19.865 -8.981 -0.196 1.00 23.25 C ATOM 2008 ND1 HIS A 127 20.465 -9.546 -1.298 1.00 60.34 N ATOM 2009 CD2 HIS A 127 19.135 -9.974 0.374 1.00 5.14 C ATOM 2010 CE1 HIS A 127 20.115 -10.813 -1.388 1.00 21.34 C ATOM 2011 NE2 HIS A 127 19.311 -11.097 -0.386 1.00 52.13 N ATOM 0 H HIS A 127 18.734 -4.815 0.721 1.00 21.01 H new ATOM 0 HA HIS A 127 19.213 -6.563 -1.535 1.00 11.23 H new ATOM 0 HB2 HIS A 127 21.091 -7.251 -0.044 1.00 43.20 H new ATOM 0 HB3 HIS A 127 19.975 -7.465 1.290 1.00 43.20 H new ATOM 0 HD2 HIS A 127 18.528 -9.892 1.263 1.00 5.14 H new ATOM 0 HE1 HIS A 127 20.434 -11.503 -2.155 1.00 21.34 H new ATOM 0 HE2 HIS A 127 18.888 -12.007 -0.205 1.00 52.13 H new ATOM 2020 N ASP A 128 16.788 -7.139 -1.163 1.00 42.35 N ATOM 2021 CA ASP A 128 15.394 -7.607 -0.978 1.00 13.21 C ATOM 2022 C ASP A 128 15.395 -9.081 -0.541 1.00 33.41 C ATOM 2023 O ASP A 128 16.294 -9.838 -0.908 1.00 21.15 O ATOM 2024 CB ASP A 128 14.542 -7.419 -2.278 1.00 14.31 C ATOM 2025 CG ASP A 128 14.811 -8.468 -3.378 1.00 53.14 C ATOM 2026 OD1 ASP A 128 15.893 -8.423 -3.995 1.00 61.01 O ATOM 2027 OD2 ASP A 128 13.956 -9.359 -3.598 1.00 74.04 O ATOM 0 H ASP A 128 17.056 -7.013 -2.139 1.00 42.35 H new ATOM 0 HA ASP A 128 14.933 -7.000 -0.199 1.00 13.21 H new ATOM 0 HB2 ASP A 128 13.485 -7.453 -2.013 1.00 14.31 H new ATOM 0 HB3 ASP A 128 14.737 -6.427 -2.685 1.00 14.31 H new ATOM 2032 N HIS A 129 14.393 -9.480 0.257 1.00 11.04 N ATOM 2033 CA HIS A 129 14.263 -10.873 0.744 1.00 62.30 C ATOM 2034 C HIS A 129 13.195 -11.621 -0.057 1.00 32.22 C ATOM 2035 O HIS A 129 13.426 -12.746 -0.512 1.00 20.22 O ATOM 2036 CB HIS A 129 13.937 -10.909 2.264 1.00 70.33 C ATOM 2037 CG HIS A 129 15.107 -10.595 3.168 1.00 32.32 C ATOM 2038 ND1 HIS A 129 15.158 -10.976 4.494 1.00 14.50 N ATOM 2039 CD2 HIS A 129 16.263 -9.923 2.934 1.00 31.13 C ATOM 2040 CE1 HIS A 129 16.288 -10.555 5.025 1.00 4.04 C ATOM 2041 NE2 HIS A 129 16.973 -9.921 4.101 1.00 34.44 N ATOM 0 H HIS A 129 13.654 -8.858 0.584 1.00 11.04 H new ATOM 0 HA HIS A 129 15.220 -11.373 0.598 1.00 62.30 H new ATOM 0 HB2 HIS A 129 13.137 -10.197 2.467 1.00 70.33 H new ATOM 0 HB3 HIS A 129 13.555 -11.898 2.517 1.00 70.33 H new ATOM 0 HD2 HIS A 129 16.565 -9.474 1.999 1.00 31.13 H new ATOM 0 HE1 HIS A 129 16.599 -10.706 6.048 1.00 4.04 H new ATOM 0 HE2 HIS A 129 17.890 -9.495 4.234 1.00 34.44 H new ATOM 2050 N ASP A 130 12.024 -10.993 -0.230 1.00 52.43 N ATOM 2051 CA ASP A 130 10.878 -11.622 -0.917 1.00 41.45 C ATOM 2052 C ASP A 130 10.498 -10.824 -2.162 1.00 71.40 C ATOM 2053 O ASP A 130 9.771 -9.829 -2.056 1.00 15.21 O ATOM 2054 CB ASP A 130 9.658 -11.743 0.026 1.00 11.22 C ATOM 2055 CG ASP A 130 9.913 -12.653 1.233 1.00 30.14 C ATOM 2056 OD1 ASP A 130 9.715 -13.879 1.120 1.00 4.35 O ATOM 2057 OD2 ASP A 130 10.315 -12.141 2.296 1.00 64.04 O ATOM 0 H ASP A 130 11.841 -10.044 0.097 1.00 52.43 H new ATOM 0 HA ASP A 130 11.180 -12.626 -1.216 1.00 41.45 H new ATOM 0 HB2 ASP A 130 9.381 -10.750 0.380 1.00 11.22 H new ATOM 0 HB3 ASP A 130 8.808 -12.128 -0.538 1.00 11.22 H new ATOM 2062 N PHE A 131 11.043 -11.276 -3.323 1.00 1.00 N ATOM 2063 CA PHE A 131 10.681 -10.828 -4.699 1.00 3.10 C ATOM 2064 C PHE A 131 10.456 -9.305 -4.837 1.00 41.03 C ATOM 2065 O PHE A 131 9.671 -8.884 -5.690 1.00 21.21 O ATOM 2066 CB PHE A 131 9.463 -11.653 -5.274 1.00 55.41 C ATOM 2067 CG PHE A 131 8.243 -11.797 -4.357 1.00 33.11 C ATOM 2068 CD1 PHE A 131 7.348 -10.743 -4.176 1.00 40.13 C ATOM 2069 CD2 PHE A 131 8.013 -12.984 -3.653 1.00 41.04 C ATOM 2070 CE1 PHE A 131 6.272 -10.868 -3.324 1.00 60.14 C ATOM 2071 CE2 PHE A 131 6.939 -13.104 -2.798 1.00 22.31 C ATOM 2072 CZ PHE A 131 6.067 -12.047 -2.635 1.00 14.03 C ATOM 0 H PHE A 131 11.773 -11.988 -3.329 1.00 1.00 H new ATOM 0 HA PHE A 131 11.559 -11.040 -5.310 1.00 3.10 H new ATOM 0 HB2 PHE A 131 9.139 -11.182 -6.202 1.00 55.41 H new ATOM 0 HB3 PHE A 131 9.817 -12.651 -5.530 1.00 55.41 H new ATOM 0 HD1 PHE A 131 7.500 -9.817 -4.710 1.00 40.13 H new ATOM 0 HD2 PHE A 131 8.687 -13.818 -3.782 1.00 41.04 H new ATOM 0 HE1 PHE A 131 5.588 -10.042 -3.195 1.00 60.14 H new ATOM 0 HE2 PHE A 131 6.780 -14.024 -2.256 1.00 22.31 H new ATOM 0 HZ PHE A 131 5.223 -12.142 -1.968 1.00 14.03 H new ATOM 2082 N GLY A 132 11.179 -8.498 -4.031 1.00 53.02 N ATOM 2083 CA GLY A 132 11.024 -7.045 -4.024 1.00 24.45 C ATOM 2084 C GLY A 132 11.526 -6.428 -5.322 1.00 72.31 C ATOM 2085 O GLY A 132 10.787 -6.390 -6.311 1.00 34.43 O ATOM 0 H GLY A 132 11.880 -8.842 -3.374 1.00 53.02 H new ATOM 0 HA2 GLY A 132 9.974 -6.790 -3.880 1.00 24.45 H new ATOM 0 HA3 GLY A 132 11.573 -6.623 -3.182 1.00 24.45 H new ATOM 2089 N ARG A 133 12.790 -5.964 -5.316 1.00 75.20 N ATOM 2090 CA ARG A 133 13.475 -5.412 -6.508 1.00 15.32 C ATOM 2091 C ARG A 133 14.911 -5.023 -6.155 1.00 2.12 C ATOM 2092 O ARG A 133 15.375 -5.300 -5.043 1.00 42.03 O ATOM 2093 CB ARG A 133 12.686 -4.222 -7.150 1.00 15.20 C ATOM 2094 CG ARG A 133 12.383 -3.019 -6.226 1.00 54.11 C ATOM 2095 CD ARG A 133 11.319 -2.099 -6.848 1.00 24.03 C ATOM 2096 NE ARG A 133 11.056 -0.877 -6.072 1.00 12.15 N ATOM 2097 CZ ARG A 133 9.964 -0.100 -6.219 1.00 54.24 C ATOM 2098 NH1 ARG A 133 9.007 -0.419 -7.093 1.00 24.01 N ATOM 2099 NH2 ARG A 133 9.855 1.029 -5.534 1.00 51.25 N ATOM 0 H ARG A 133 13.372 -5.960 -4.478 1.00 75.20 H new ATOM 0 HA ARG A 133 13.508 -6.192 -7.268 1.00 15.32 H new ATOM 0 HB2 ARG A 133 13.253 -3.860 -8.008 1.00 15.20 H new ATOM 0 HB3 ARG A 133 11.740 -4.606 -7.532 1.00 15.20 H new ATOM 0 HG2 ARG A 133 12.036 -3.379 -5.257 1.00 54.11 H new ATOM 0 HG3 ARG A 133 13.298 -2.454 -6.047 1.00 54.11 H new ATOM 0 HD2 ARG A 133 11.638 -1.818 -7.852 1.00 24.03 H new ATOM 0 HD3 ARG A 133 10.389 -2.657 -6.954 1.00 24.03 H new ATOM 0 HE ARG A 133 11.747 -0.599 -5.375 1.00 12.15 H new ATOM 0 HH11 ARG A 133 9.096 -1.261 -7.662 1.00 24.01 H new ATOM 0 HH12 ARG A 133 8.187 0.179 -7.192 1.00 24.01 H new ATOM 0 HH21 ARG A 133 10.598 1.311 -4.894 1.00 51.25 H new ATOM 0 HH22 ARG A 133 9.028 1.616 -5.646 1.00 51.25 H new ATOM 2113 N ASP A 134 15.609 -4.400 -7.125 1.00 24.12 N ATOM 2114 CA ASP A 134 17.013 -3.977 -6.974 1.00 31.12 C ATOM 2115 C ASP A 134 17.149 -2.976 -5.790 1.00 43.21 C ATOM 2116 O ASP A 134 16.253 -2.151 -5.598 1.00 75.54 O ATOM 2117 CB ASP A 134 17.514 -3.335 -8.302 1.00 31.32 C ATOM 2118 CG ASP A 134 19.033 -3.117 -8.342 1.00 13.41 C ATOM 2119 OD1 ASP A 134 19.516 -2.129 -7.760 1.00 3.01 O ATOM 2120 OD2 ASP A 134 19.753 -3.953 -8.922 1.00 0.23 O ATOM 0 H ASP A 134 15.212 -4.176 -8.038 1.00 24.12 H new ATOM 0 HA ASP A 134 17.629 -4.849 -6.754 1.00 31.12 H new ATOM 0 HB2 ASP A 134 17.224 -3.973 -9.137 1.00 31.32 H new ATOM 0 HB3 ASP A 134 17.014 -2.377 -8.445 1.00 31.32 H new ATOM 2125 N PRO A 135 18.246 -3.069 -4.962 1.00 31.02 N ATOM 2126 CA PRO A 135 18.510 -2.159 -3.808 1.00 35.22 C ATOM 2127 C PRO A 135 18.314 -0.655 -4.092 1.00 22.02 C ATOM 2128 O PRO A 135 17.865 0.082 -3.207 1.00 73.45 O ATOM 2129 CB PRO A 135 19.989 -2.471 -3.438 1.00 3.42 C ATOM 2130 CG PRO A 135 20.506 -3.362 -4.536 1.00 71.55 C ATOM 2131 CD PRO A 135 19.303 -4.110 -5.030 1.00 41.14 C ATOM 0 HA PRO A 135 17.792 -2.342 -3.009 1.00 35.22 H new ATOM 0 HB2 PRO A 135 20.576 -1.555 -3.368 1.00 3.42 H new ATOM 0 HB3 PRO A 135 20.054 -2.966 -2.469 1.00 3.42 H new ATOM 0 HG2 PRO A 135 20.963 -2.778 -5.335 1.00 71.55 H new ATOM 0 HG3 PRO A 135 21.269 -4.045 -4.163 1.00 71.55 H new ATOM 0 HD2 PRO A 135 19.443 -4.484 -6.044 1.00 41.14 H new ATOM 0 HD3 PRO A 135 19.070 -4.970 -4.402 1.00 41.14 H new ATOM 2139 N LYS A 136 18.655 -0.209 -5.320 1.00 51.01 N ATOM 2140 CA LYS A 136 18.547 1.221 -5.700 1.00 34.42 C ATOM 2141 C LYS A 136 17.070 1.653 -5.816 1.00 43.51 C ATOM 2142 O LYS A 136 16.731 2.815 -5.566 1.00 21.14 O ATOM 2143 CB LYS A 136 19.310 1.504 -7.031 1.00 22.42 C ATOM 2144 CG LYS A 136 18.664 0.908 -8.300 1.00 75.32 C ATOM 2145 CD LYS A 136 19.517 1.096 -9.577 1.00 25.43 C ATOM 2146 CE LYS A 136 20.846 0.326 -9.528 1.00 61.33 C ATOM 2147 NZ LYS A 136 21.701 0.572 -10.724 1.00 43.22 N ATOM 0 H LYS A 136 19.006 -0.813 -6.063 1.00 51.01 H new ATOM 0 HA LYS A 136 19.011 1.811 -4.910 1.00 34.42 H new ATOM 0 HB2 LYS A 136 19.396 2.583 -7.159 1.00 22.42 H new ATOM 0 HB3 LYS A 136 20.323 1.112 -6.940 1.00 22.42 H new ATOM 0 HG2 LYS A 136 18.490 -0.157 -8.143 1.00 75.32 H new ATOM 0 HG3 LYS A 136 17.689 1.371 -8.453 1.00 75.32 H new ATOM 0 HD2 LYS A 136 18.943 0.765 -10.443 1.00 25.43 H new ATOM 0 HD3 LYS A 136 19.723 2.157 -9.717 1.00 25.43 H new ATOM 0 HE2 LYS A 136 21.394 0.613 -8.630 1.00 61.33 H new ATOM 0 HE3 LYS A 136 20.639 -0.741 -9.448 1.00 61.33 H new ATOM 0 HZ1 LYS A 136 22.583 0.028 -10.638 1.00 43.22 H new ATOM 0 HZ2 LYS A 136 21.193 0.274 -11.581 1.00 43.22 H new ATOM 0 HZ3 LYS A 136 21.924 1.586 -10.789 1.00 43.22 H new ATOM 2161 N TYR A 137 16.204 0.704 -6.205 1.00 52.41 N ATOM 2162 CA TYR A 137 14.756 0.946 -6.352 1.00 50.23 C ATOM 2163 C TYR A 137 14.012 0.634 -5.046 1.00 11.11 C ATOM 2164 O TYR A 137 12.871 1.071 -4.861 1.00 72.31 O ATOM 2165 CB TYR A 137 14.187 0.102 -7.513 1.00 30.22 C ATOM 2166 CG TYR A 137 14.838 0.398 -8.866 1.00 71.14 C ATOM 2167 CD1 TYR A 137 14.684 1.641 -9.474 1.00 13.24 C ATOM 2168 CD2 TYR A 137 15.606 -0.558 -9.530 1.00 64.43 C ATOM 2169 CE1 TYR A 137 15.268 1.912 -10.695 1.00 33.32 C ATOM 2170 CE2 TYR A 137 16.190 -0.293 -10.751 1.00 71.55 C ATOM 2171 CZ TYR A 137 16.019 0.940 -11.331 1.00 64.45 C ATOM 2172 OH TYR A 137 16.593 1.208 -12.558 1.00 43.12 O ATOM 0 H TYR A 137 16.485 -0.251 -6.427 1.00 52.41 H new ATOM 0 HA TYR A 137 14.608 2.001 -6.581 1.00 50.23 H new ATOM 0 HB2 TYR A 137 14.318 -0.955 -7.280 1.00 30.22 H new ATOM 0 HB3 TYR A 137 13.115 0.281 -7.589 1.00 30.22 H new ATOM 0 HD1 TYR A 137 14.099 2.405 -8.983 1.00 13.24 H new ATOM 0 HD2 TYR A 137 15.747 -1.529 -9.078 1.00 64.43 H new ATOM 0 HE1 TYR A 137 15.139 2.881 -11.153 1.00 33.32 H new ATOM 0 HE2 TYR A 137 16.778 -1.050 -11.248 1.00 71.55 H new ATOM 0 HH TYR A 137 17.088 0.420 -12.867 1.00 43.12 H new ATOM 2182 N LEU A 138 14.651 -0.148 -4.164 1.00 51.13 N ATOM 2183 CA LEU A 138 14.165 -0.357 -2.797 1.00 40.14 C ATOM 2184 C LEU A 138 14.260 0.978 -2.028 1.00 15.14 C ATOM 2185 O LEU A 138 15.358 1.494 -1.808 1.00 2.13 O ATOM 2186 CB LEU A 138 14.995 -1.456 -2.070 1.00 31.42 C ATOM 2187 CG LEU A 138 14.852 -2.922 -2.578 1.00 65.24 C ATOM 2188 CD1 LEU A 138 15.783 -3.868 -1.783 1.00 74.25 C ATOM 2189 CD2 LEU A 138 13.385 -3.405 -2.530 1.00 53.12 C ATOM 0 H LEU A 138 15.513 -0.649 -4.378 1.00 51.13 H new ATOM 0 HA LEU A 138 13.129 -0.695 -2.833 1.00 40.14 H new ATOM 0 HB2 LEU A 138 16.047 -1.179 -2.134 1.00 31.42 H new ATOM 0 HB3 LEU A 138 14.724 -1.438 -1.014 1.00 31.42 H new ATOM 0 HG LEU A 138 15.159 -2.942 -3.624 1.00 65.24 H new ATOM 0 HD11 LEU A 138 15.668 -4.887 -2.153 1.00 74.25 H new ATOM 0 HD12 LEU A 138 16.818 -3.551 -1.909 1.00 74.25 H new ATOM 0 HD13 LEU A 138 15.520 -3.834 -0.726 1.00 74.25 H new ATOM 0 HD21 LEU A 138 13.328 -4.431 -2.892 1.00 53.12 H new ATOM 0 HD22 LEU A 138 13.021 -3.362 -1.503 1.00 53.12 H new ATOM 0 HD23 LEU A 138 12.770 -2.763 -3.160 1.00 53.12 H new ATOM 2201 N HIS A 139 13.100 1.551 -1.668 1.00 42.12 N ATOM 2202 CA HIS A 139 13.023 2.799 -0.874 1.00 64.15 C ATOM 2203 C HIS A 139 12.019 2.619 0.268 1.00 45.12 C ATOM 2204 O HIS A 139 11.056 1.854 0.145 1.00 32.02 O ATOM 2205 CB HIS A 139 12.618 4.017 -1.759 1.00 12.13 C ATOM 2206 CG HIS A 139 13.727 4.545 -2.638 1.00 21.45 C ATOM 2207 ND1 HIS A 139 14.378 5.734 -2.400 1.00 11.32 N ATOM 2208 CD2 HIS A 139 14.298 4.035 -3.751 1.00 12.41 C ATOM 2209 CE1 HIS A 139 15.295 5.921 -3.326 1.00 43.44 C ATOM 2210 NE2 HIS A 139 15.270 4.907 -4.156 1.00 71.02 N ATOM 0 H HIS A 139 12.188 1.167 -1.916 1.00 42.12 H new ATOM 0 HA HIS A 139 14.012 3.004 -0.464 1.00 64.15 H new ATOM 0 HB2 HIS A 139 11.777 3.729 -2.390 1.00 12.13 H new ATOM 0 HB3 HIS A 139 12.270 4.822 -1.111 1.00 12.13 H new ATOM 0 HD2 HIS A 139 14.034 3.106 -4.234 1.00 12.41 H new ATOM 0 HE1 HIS A 139 15.959 6.770 -3.391 1.00 43.44 H new ATOM 0 HE2 HIS A 139 15.875 4.788 -4.969 1.00 71.02 H new ATOM 2219 N GLN A 140 12.273 3.325 1.378 1.00 55.20 N ATOM 2220 CA GLN A 140 11.367 3.362 2.536 1.00 31.50 C ATOM 2221 C GLN A 140 10.370 4.514 2.374 1.00 63.12 C ATOM 2222 O GLN A 140 10.629 5.480 1.640 1.00 30.23 O ATOM 2223 CB GLN A 140 12.153 3.518 3.872 1.00 72.54 C ATOM 2224 CG GLN A 140 13.227 2.428 4.136 1.00 52.23 C ATOM 2225 CD GLN A 140 14.641 2.772 3.662 1.00 1.21 C ATOM 2226 OE1 GLN A 140 14.838 3.534 2.719 1.00 14.55 O ATOM 2227 NE2 GLN A 140 15.637 2.162 4.289 1.00 63.45 N ATOM 0 H GLN A 140 13.115 3.888 1.499 1.00 55.20 H new ATOM 0 HA GLN A 140 10.829 2.415 2.577 1.00 31.50 H new ATOM 0 HB2 GLN A 140 12.639 4.494 3.878 1.00 72.54 H new ATOM 0 HB3 GLN A 140 11.441 3.512 4.697 1.00 72.54 H new ATOM 0 HG2 GLN A 140 13.260 2.226 5.207 1.00 52.23 H new ATOM 0 HG3 GLN A 140 12.912 1.506 3.647 1.00 52.23 H new ATOM 0 HE21 GLN A 140 15.441 1.535 5.069 1.00 63.45 H new ATOM 0 HE22 GLN A 140 16.600 2.320 3.991 1.00 63.45 H new ATOM 2236 N PHE A 141 9.245 4.400 3.088 1.00 30.15 N ATOM 2237 CA PHE A 141 8.164 5.381 3.059 1.00 45.30 C ATOM 2238 C PHE A 141 8.568 6.605 3.884 1.00 12.32 C ATOM 2239 O PHE A 141 8.441 6.600 5.115 1.00 43.34 O ATOM 2240 CB PHE A 141 6.859 4.760 3.615 1.00 71.34 C ATOM 2241 CG PHE A 141 6.425 3.494 2.896 1.00 41.10 C ATOM 2242 CD1 PHE A 141 5.769 3.573 1.679 1.00 55.43 C ATOM 2243 CD2 PHE A 141 6.670 2.229 3.439 1.00 24.44 C ATOM 2244 CE1 PHE A 141 5.373 2.436 1.024 1.00 12.12 C ATOM 2245 CE2 PHE A 141 6.271 1.090 2.781 1.00 50.44 C ATOM 2246 CZ PHE A 141 5.620 1.193 1.569 1.00 54.41 C ATOM 0 H PHE A 141 9.061 3.612 3.709 1.00 30.15 H new ATOM 0 HA PHE A 141 7.983 5.687 2.029 1.00 45.30 H new ATOM 0 HB2 PHE A 141 6.997 4.536 4.673 1.00 71.34 H new ATOM 0 HB3 PHE A 141 6.059 5.497 3.546 1.00 71.34 H new ATOM 0 HD1 PHE A 141 5.567 4.540 1.242 1.00 55.43 H new ATOM 0 HD2 PHE A 141 7.179 2.146 4.388 1.00 24.44 H new ATOM 0 HE1 PHE A 141 4.864 2.514 0.075 1.00 12.12 H new ATOM 0 HE2 PHE A 141 6.466 0.119 3.211 1.00 50.44 H new ATOM 0 HZ PHE A 141 5.304 0.302 1.048 1.00 54.41 H new ATOM 2256 N GLU A 142 9.123 7.613 3.209 1.00 74.21 N ATOM 2257 CA GLU A 142 9.503 8.875 3.846 1.00 50.24 C ATOM 2258 C GLU A 142 8.252 9.769 3.954 1.00 31.52 C ATOM 2259 O GLU A 142 7.872 10.457 2.995 1.00 0.25 O ATOM 2260 CB GLU A 142 10.648 9.547 3.039 1.00 31.11 C ATOM 2261 CG GLU A 142 11.937 8.698 2.962 1.00 30.51 C ATOM 2262 CD GLU A 142 13.038 9.330 2.094 1.00 33.03 C ATOM 2263 OE1 GLU A 142 13.683 10.304 2.547 1.00 63.24 O ATOM 2264 OE2 GLU A 142 13.262 8.869 0.952 1.00 62.21 O ATOM 0 H GLU A 142 9.321 7.578 2.209 1.00 74.21 H new ATOM 0 HA GLU A 142 9.883 8.704 4.853 1.00 50.24 H new ATOM 0 HB2 GLU A 142 10.297 9.750 2.027 1.00 31.11 H new ATOM 0 HB3 GLU A 142 10.884 10.509 3.493 1.00 31.11 H new ATOM 0 HG2 GLU A 142 12.323 8.546 3.970 1.00 30.51 H new ATOM 0 HG3 GLU A 142 11.691 7.714 2.563 1.00 30.51 H new ATOM 2271 N GLY A 143 7.601 9.700 5.124 1.00 14.24 N ATOM 2272 CA GLY A 143 6.360 10.423 5.393 1.00 73.33 C ATOM 2273 C GLY A 143 5.796 10.055 6.760 1.00 44.33 C ATOM 2274 O GLY A 143 6.028 8.941 7.253 1.00 34.44 O ATOM 0 H GLY A 143 7.926 9.137 5.910 1.00 14.24 H new ATOM 0 HA2 GLY A 143 6.544 11.496 5.349 1.00 73.33 H new ATOM 0 HA3 GLY A 143 5.627 10.193 4.620 1.00 73.33 H new ATOM 2278 N GLU A 144 5.069 11.001 7.379 1.00 31.01 N ATOM 2279 CA GLU A 144 4.448 10.820 8.705 1.00 13.42 C ATOM 2280 C GLU A 144 3.155 9.999 8.570 1.00 55.13 C ATOM 2281 O GLU A 144 2.950 9.004 9.274 1.00 60.31 O ATOM 2282 CB GLU A 144 4.139 12.209 9.340 1.00 65.31 C ATOM 2283 CG GLU A 144 5.337 13.191 9.351 1.00 2.44 C ATOM 2284 CD GLU A 144 5.003 14.567 9.961 1.00 5.25 C ATOM 2285 OE1 GLU A 144 4.250 15.334 9.323 1.00 43.35 O ATOM 2286 OE2 GLU A 144 5.477 14.877 11.085 1.00 0.02 O ATOM 0 H GLU A 144 4.894 11.919 6.971 1.00 31.01 H new ATOM 0 HA GLU A 144 5.140 10.283 9.353 1.00 13.42 H new ATOM 0 HB2 GLU A 144 3.314 12.668 8.795 1.00 65.31 H new ATOM 0 HB3 GLU A 144 3.799 12.058 10.365 1.00 65.31 H new ATOM 0 HG2 GLU A 144 6.157 12.744 9.912 1.00 2.44 H new ATOM 0 HG3 GLU A 144 5.690 13.332 8.329 1.00 2.44 H new ATOM 2293 N THR A 145 2.288 10.442 7.643 1.00 33.10 N ATOM 2294 CA THR A 145 0.990 9.806 7.385 1.00 2.25 C ATOM 2295 C THR A 145 1.125 8.703 6.315 1.00 53.54 C ATOM 2296 O THR A 145 1.628 8.949 5.220 1.00 63.12 O ATOM 2297 CB THR A 145 -0.069 10.861 6.918 1.00 22.31 C ATOM 2298 OG1 THR A 145 -0.129 11.944 7.855 1.00 51.30 O ATOM 2299 CG2 THR A 145 -1.476 10.256 6.763 1.00 33.51 C ATOM 0 H THR A 145 2.471 11.253 7.052 1.00 33.10 H new ATOM 0 HA THR A 145 0.652 9.358 8.319 1.00 2.25 H new ATOM 0 HB THR A 145 0.252 11.219 5.940 1.00 22.31 H new ATOM 0 HG1 THR A 145 -0.278 12.785 7.374 1.00 51.30 H new ATOM 0 HG21 THR A 145 -2.171 11.030 6.438 1.00 33.51 H new ATOM 0 HG22 THR A 145 -1.449 9.457 6.022 1.00 33.51 H new ATOM 0 HG23 THR A 145 -1.806 9.851 7.720 1.00 33.51 H new ATOM 2307 N PHE A 146 0.704 7.483 6.672 1.00 72.02 N ATOM 2308 CA PHE A 146 0.510 6.377 5.722 1.00 41.44 C ATOM 2309 C PHE A 146 -0.938 6.379 5.194 1.00 54.32 C ATOM 2310 O PHE A 146 -1.875 6.778 5.901 1.00 25.22 O ATOM 2311 CB PHE A 146 0.821 5.010 6.393 1.00 32.34 C ATOM 2312 CG PHE A 146 2.310 4.684 6.514 1.00 42.22 C ATOM 2313 CD1 PHE A 146 3.115 5.309 7.466 1.00 54.43 C ATOM 2314 CD2 PHE A 146 2.898 3.737 5.679 1.00 74.23 C ATOM 2315 CE1 PHE A 146 4.458 4.995 7.572 1.00 43.25 C ATOM 2316 CE2 PHE A 146 4.234 3.423 5.790 1.00 15.43 C ATOM 2317 CZ PHE A 146 5.016 4.048 6.735 1.00 71.14 C ATOM 0 H PHE A 146 0.486 7.232 7.636 1.00 72.02 H new ATOM 0 HA PHE A 146 1.198 6.520 4.889 1.00 41.44 H new ATOM 0 HB2 PHE A 146 0.378 5.000 7.389 1.00 32.34 H new ATOM 0 HB3 PHE A 146 0.335 4.220 5.820 1.00 32.34 H new ATOM 0 HD1 PHE A 146 2.685 6.046 8.128 1.00 54.43 H new ATOM 0 HD2 PHE A 146 2.296 3.241 4.932 1.00 74.23 H new ATOM 0 HE1 PHE A 146 5.071 5.491 8.310 1.00 43.25 H new ATOM 0 HE2 PHE A 146 4.670 2.684 5.134 1.00 15.43 H new ATOM 0 HZ PHE A 146 6.063 3.799 6.822 1.00 71.14 H new ATOM 2327 N TYR A 147 -1.098 5.939 3.939 1.00 34.21 N ATOM 2328 CA TYR A 147 -2.401 5.750 3.289 1.00 61.20 C ATOM 2329 C TYR A 147 -2.527 4.288 2.861 1.00 12.12 C ATOM 2330 O TYR A 147 -1.657 3.757 2.158 1.00 74.14 O ATOM 2331 CB TYR A 147 -2.566 6.701 2.071 1.00 40.40 C ATOM 2332 CG TYR A 147 -2.723 8.179 2.458 1.00 3.54 C ATOM 2333 CD1 TYR A 147 -1.634 8.929 2.898 1.00 21.02 C ATOM 2334 CD2 TYR A 147 -3.964 8.817 2.393 1.00 50.03 C ATOM 2335 CE1 TYR A 147 -1.775 10.248 3.261 1.00 34.51 C ATOM 2336 CE2 TYR A 147 -4.103 10.144 2.754 1.00 21.43 C ATOM 2337 CZ TYR A 147 -3.003 10.854 3.189 1.00 20.10 C ATOM 2338 OH TYR A 147 -3.133 12.177 3.558 1.00 12.10 O ATOM 0 H TYR A 147 -0.311 5.700 3.336 1.00 34.21 H new ATOM 0 HA TYR A 147 -3.195 5.995 3.995 1.00 61.20 H new ATOM 0 HB2 TYR A 147 -1.699 6.596 1.419 1.00 40.40 H new ATOM 0 HB3 TYR A 147 -3.438 6.391 1.495 1.00 40.40 H new ATOM 0 HD1 TYR A 147 -0.660 8.465 2.955 1.00 21.02 H new ATOM 0 HD2 TYR A 147 -4.828 8.265 2.055 1.00 50.03 H new ATOM 0 HE1 TYR A 147 -0.917 10.808 3.603 1.00 34.51 H new ATOM 0 HE2 TYR A 147 -5.069 10.623 2.696 1.00 21.43 H new ATOM 0 HH TYR A 147 -3.606 12.668 2.854 1.00 12.10 H new ATOM 2348 N ILE A 148 -3.600 3.640 3.320 1.00 51.42 N ATOM 2349 CA ILE A 148 -3.882 2.234 3.036 1.00 43.23 C ATOM 2350 C ILE A 148 -5.133 2.152 2.142 1.00 15.32 C ATOM 2351 O ILE A 148 -6.252 2.428 2.586 1.00 5.32 O ATOM 2352 CB ILE A 148 -4.062 1.420 4.374 1.00 74.52 C ATOM 2353 CG1 ILE A 148 -2.714 1.378 5.175 1.00 1.12 C ATOM 2354 CG2 ILE A 148 -4.585 0.002 4.095 1.00 22.53 C ATOM 2355 CD1 ILE A 148 -2.736 0.542 6.449 1.00 14.34 C ATOM 0 H ILE A 148 -4.306 4.084 3.907 1.00 51.42 H new ATOM 0 HA ILE A 148 -3.042 1.785 2.506 1.00 43.23 H new ATOM 0 HB ILE A 148 -4.807 1.929 4.985 1.00 74.52 H new ATOM 0 HG12 ILE A 148 -1.934 0.990 4.520 1.00 1.12 H new ATOM 0 HG13 ILE A 148 -2.434 2.399 5.435 1.00 1.12 H new ATOM 0 HG21 ILE A 148 -4.699 -0.535 5.036 1.00 22.53 H new ATOM 0 HG22 ILE A 148 -5.550 0.063 3.592 1.00 22.53 H new ATOM 0 HG23 ILE A 148 -3.877 -0.528 3.458 1.00 22.53 H new ATOM 0 HD11 ILE A 148 -1.757 0.580 6.926 1.00 14.34 H new ATOM 0 HD12 ILE A 148 -3.488 0.939 7.132 1.00 14.34 H new ATOM 0 HD13 ILE A 148 -2.980 -0.491 6.202 1.00 14.34 H new ATOM 2367 N ILE A 149 -4.914 1.805 0.866 1.00 70.42 N ATOM 2368 CA ILE A 149 -5.966 1.780 -0.155 1.00 4.35 C ATOM 2369 C ILE A 149 -6.443 0.337 -0.369 1.00 70.10 C ATOM 2370 O ILE A 149 -5.666 -0.504 -0.838 1.00 61.44 O ATOM 2371 CB ILE A 149 -5.443 2.386 -1.514 1.00 73.53 C ATOM 2372 CG1 ILE A 149 -4.781 3.786 -1.288 1.00 2.32 C ATOM 2373 CG2 ILE A 149 -6.572 2.469 -2.565 1.00 15.53 C ATOM 2374 CD1 ILE A 149 -5.641 4.803 -0.550 1.00 52.02 C ATOM 0 H ILE A 149 -3.997 1.533 0.513 1.00 70.42 H new ATOM 0 HA ILE A 149 -6.801 2.390 0.190 1.00 4.35 H new ATOM 0 HB ILE A 149 -4.679 1.712 -1.903 1.00 73.53 H new ATOM 0 HG12 ILE A 149 -3.855 3.646 -0.730 1.00 2.32 H new ATOM 0 HG13 ILE A 149 -4.509 4.201 -2.258 1.00 2.32 H new ATOM 0 HG21 ILE A 149 -6.178 2.891 -3.490 1.00 15.53 H new ATOM 0 HG22 ILE A 149 -6.962 1.470 -2.759 1.00 15.53 H new ATOM 0 HG23 ILE A 149 -7.373 3.105 -2.189 1.00 15.53 H new ATOM 0 HD11 ILE A 149 -5.090 5.738 -0.446 1.00 52.02 H new ATOM 0 HD12 ILE A 149 -6.557 4.982 -1.113 1.00 52.02 H new ATOM 0 HD13 ILE A 149 -5.893 4.418 0.438 1.00 52.02 H new ATOM 2386 N GLU A 150 -7.713 0.065 -0.003 1.00 45.12 N ATOM 2387 CA GLU A 150 -8.352 -1.240 -0.209 1.00 44.43 C ATOM 2388 C GLU A 150 -8.388 -1.616 -1.704 1.00 32.34 C ATOM 2389 O GLU A 150 -8.766 -0.805 -2.563 1.00 33.35 O ATOM 2390 CB GLU A 150 -9.793 -1.267 0.386 1.00 12.03 C ATOM 2391 CG GLU A 150 -10.551 -2.596 0.115 1.00 12.13 C ATOM 2392 CD GLU A 150 -11.945 -2.711 0.751 1.00 0.42 C ATOM 2393 OE1 GLU A 150 -12.717 -1.731 0.717 1.00 60.24 O ATOM 2394 OE2 GLU A 150 -12.290 -3.814 1.253 1.00 10.12 O ATOM 0 H GLU A 150 -8.321 0.750 0.445 1.00 45.12 H new ATOM 0 HA GLU A 150 -7.749 -1.979 0.318 1.00 44.43 H new ATOM 0 HB2 GLU A 150 -9.736 -1.103 1.462 1.00 12.03 H new ATOM 0 HB3 GLU A 150 -10.366 -0.439 -0.032 1.00 12.03 H new ATOM 0 HG2 GLU A 150 -10.652 -2.721 -0.963 1.00 12.13 H new ATOM 0 HG3 GLU A 150 -9.938 -3.422 0.476 1.00 12.13 H new ATOM 2401 N GLN A 151 -7.982 -2.861 -1.981 1.00 4.11 N ATOM 2402 CA GLN A 151 -7.960 -3.450 -3.321 1.00 41.14 C ATOM 2403 C GLN A 151 -8.809 -4.726 -3.284 1.00 2.30 C ATOM 2404 O GLN A 151 -8.364 -5.767 -2.787 1.00 74.32 O ATOM 2405 CB GLN A 151 -6.499 -3.789 -3.739 1.00 74.41 C ATOM 2406 CG GLN A 151 -5.480 -2.634 -3.602 1.00 53.44 C ATOM 2407 CD GLN A 151 -5.708 -1.474 -4.579 1.00 63.23 C ATOM 2408 OE1 GLN A 151 -6.181 -1.662 -5.699 1.00 52.34 O ATOM 2409 NE2 GLN A 151 -5.364 -0.263 -4.163 1.00 20.41 N ATOM 0 H GLN A 151 -7.652 -3.501 -1.259 1.00 4.11 H new ATOM 0 HA GLN A 151 -8.362 -2.746 -4.050 1.00 41.14 H new ATOM 0 HB2 GLN A 151 -6.153 -4.628 -3.136 1.00 74.41 H new ATOM 0 HB3 GLN A 151 -6.505 -4.123 -4.777 1.00 74.41 H new ATOM 0 HG2 GLN A 151 -5.519 -2.249 -2.583 1.00 53.44 H new ATOM 0 HG3 GLN A 151 -4.476 -3.030 -3.754 1.00 53.44 H new ATOM 0 HE21 GLN A 151 -4.974 -0.136 -3.229 1.00 20.41 H new ATOM 0 HE22 GLN A 151 -5.489 0.542 -4.777 1.00 20.41 H new ATOM 2418 N ARG A 152 -10.047 -4.636 -3.774 1.00 74.23 N ATOM 2419 CA ARG A 152 -10.968 -5.784 -3.852 1.00 33.35 C ATOM 2420 C ARG A 152 -10.934 -6.412 -5.253 1.00 64.24 C ATOM 2421 O ARG A 152 -10.378 -5.838 -6.199 1.00 15.43 O ATOM 2422 CB ARG A 152 -12.427 -5.353 -3.489 1.00 13.12 C ATOM 2423 CG ARG A 152 -12.719 -5.233 -1.977 1.00 21.41 C ATOM 2424 CD ARG A 152 -12.685 -6.597 -1.260 1.00 5.30 C ATOM 2425 NE ARG A 152 -13.071 -6.488 0.156 1.00 25.03 N ATOM 2426 CZ ARG A 152 -13.072 -7.495 1.043 1.00 35.52 C ATOM 2427 NH1 ARG A 152 -12.689 -8.731 0.694 1.00 13.20 N ATOM 2428 NH2 ARG A 152 -13.458 -7.266 2.285 1.00 63.54 N ATOM 0 H ARG A 152 -10.445 -3.767 -4.130 1.00 74.23 H new ATOM 0 HA ARG A 152 -10.638 -6.529 -3.128 1.00 33.35 H new ATOM 0 HB2 ARG A 152 -12.633 -4.392 -3.960 1.00 13.12 H new ATOM 0 HB3 ARG A 152 -13.120 -6.075 -3.921 1.00 13.12 H new ATOM 0 HG2 ARG A 152 -11.986 -4.568 -1.520 1.00 21.41 H new ATOM 0 HG3 ARG A 152 -13.698 -4.775 -1.834 1.00 21.41 H new ATOM 0 HD2 ARG A 152 -13.358 -7.289 -1.766 1.00 5.30 H new ATOM 0 HD3 ARG A 152 -11.682 -7.018 -1.331 1.00 5.30 H new ATOM 0 HE ARG A 152 -13.362 -5.570 0.491 1.00 25.03 H new ATOM 0 HH11 ARG A 152 -12.389 -8.921 -0.262 1.00 13.20 H new ATOM 0 HH12 ARG A 152 -12.698 -9.482 1.385 1.00 13.20 H new ATOM 0 HH21 ARG A 152 -13.752 -6.330 2.563 1.00 63.54 H new ATOM 0 HH22 ARG A 152 -13.462 -8.025 2.966 1.00 63.54 H new ATOM 2442 N LEU A 153 -11.525 -7.612 -5.353 1.00 74.33 N ATOM 2443 CA LEU A 153 -11.832 -8.255 -6.639 1.00 0.31 C ATOM 2444 C LEU A 153 -13.056 -7.571 -7.285 1.00 43.11 C ATOM 2445 O LEU A 153 -13.771 -6.799 -6.624 1.00 32.24 O ATOM 2446 CB LEU A 153 -12.107 -9.770 -6.418 1.00 30.42 C ATOM 2447 CG LEU A 153 -10.913 -10.604 -5.866 1.00 73.23 C ATOM 2448 CD1 LEU A 153 -11.366 -12.021 -5.452 1.00 62.11 C ATOM 2449 CD2 LEU A 153 -9.752 -10.654 -6.887 1.00 3.42 C ATOM 0 H LEU A 153 -11.804 -8.165 -4.543 1.00 74.33 H new ATOM 0 HA LEU A 153 -10.979 -8.150 -7.310 1.00 0.31 H new ATOM 0 HB2 LEU A 153 -12.945 -9.871 -5.728 1.00 30.42 H new ATOM 0 HB3 LEU A 153 -12.421 -10.205 -7.367 1.00 30.42 H new ATOM 0 HG LEU A 153 -10.542 -10.106 -4.970 1.00 73.23 H new ATOM 0 HD11 LEU A 153 -10.511 -12.579 -5.071 1.00 62.11 H new ATOM 0 HD12 LEU A 153 -12.127 -11.947 -4.675 1.00 62.11 H new ATOM 0 HD13 LEU A 153 -11.780 -12.538 -6.318 1.00 62.11 H new ATOM 0 HD21 LEU A 153 -8.931 -11.242 -6.476 1.00 3.42 H new ATOM 0 HD22 LEU A 153 -10.100 -11.113 -7.812 1.00 3.42 H new ATOM 0 HD23 LEU A 153 -9.405 -9.642 -7.093 1.00 3.42 H new ATOM 2461 N GLU A 154 -13.303 -7.891 -8.565 1.00 14.01 N ATOM 2462 CA GLU A 154 -14.444 -7.355 -9.342 1.00 4.11 C ATOM 2463 C GLU A 154 -15.808 -7.788 -8.742 1.00 44.23 C ATOM 2464 O GLU A 154 -15.849 -8.543 -7.763 1.00 72.40 O ATOM 2465 CB GLU A 154 -14.310 -7.815 -10.816 1.00 54.45 C ATOM 2466 CG GLU A 154 -14.285 -9.346 -11.007 1.00 34.31 C ATOM 2467 CD GLU A 154 -14.106 -9.751 -12.475 1.00 13.42 C ATOM 2468 OE1 GLU A 154 -12.980 -9.618 -12.993 1.00 22.13 O ATOM 2469 OE2 GLU A 154 -15.088 -10.175 -13.124 1.00 60.42 O ATOM 0 H GLU A 154 -12.716 -8.533 -9.098 1.00 14.01 H new ATOM 0 HA GLU A 154 -14.418 -6.266 -9.296 1.00 4.11 H new ATOM 0 HB2 GLU A 154 -15.141 -7.403 -11.389 1.00 54.45 H new ATOM 0 HB3 GLU A 154 -13.395 -7.394 -11.233 1.00 54.45 H new ATOM 0 HG2 GLU A 154 -13.474 -9.770 -10.415 1.00 34.31 H new ATOM 0 HG3 GLU A 154 -15.213 -9.772 -10.626 1.00 34.31 H new ATOM 2476 N HIS A 155 -16.908 -7.288 -9.339 1.00 14.53 N ATOM 2477 CA HIS A 155 -18.287 -7.550 -8.871 1.00 4.54 C ATOM 2478 C HIS A 155 -18.636 -9.068 -8.893 1.00 54.51 C ATOM 2479 O HIS A 155 -19.135 -9.612 -9.886 1.00 53.11 O ATOM 2480 CB HIS A 155 -19.321 -6.702 -9.680 1.00 62.43 C ATOM 2481 CG HIS A 155 -19.425 -6.980 -11.170 1.00 1.30 C ATOM 2482 ND1 HIS A 155 -20.620 -6.968 -11.856 1.00 23.02 N ATOM 2483 CD2 HIS A 155 -18.475 -7.264 -12.099 1.00 4.02 C ATOM 2484 CE1 HIS A 155 -20.393 -7.208 -13.128 1.00 73.12 C ATOM 2485 NE2 HIS A 155 -19.110 -7.401 -13.303 1.00 71.42 N ATOM 0 H HIS A 155 -16.867 -6.688 -10.163 1.00 14.53 H new ATOM 0 HA HIS A 155 -18.344 -7.237 -7.829 1.00 4.54 H new ATOM 0 HB2 HIS A 155 -20.305 -6.855 -9.237 1.00 62.43 H new ATOM 0 HB3 HIS A 155 -19.073 -5.649 -9.548 1.00 62.43 H new ATOM 0 HD2 HIS A 155 -17.415 -7.363 -11.920 1.00 4.02 H new ATOM 0 HE1 HIS A 155 -21.144 -7.241 -13.904 1.00 73.12 H new ATOM 0 HE2 HIS A 155 -18.658 -7.618 -14.191 1.00 71.42 H new ATOM 2494 N HIS A 156 -18.303 -9.750 -7.789 1.00 32.35 N ATOM 2495 CA HIS A 156 -18.610 -11.182 -7.595 1.00 1.31 C ATOM 2496 C HIS A 156 -19.670 -11.348 -6.497 1.00 62.32 C ATOM 2497 O HIS A 156 -20.443 -12.308 -6.506 1.00 2.10 O ATOM 2498 CB HIS A 156 -17.324 -11.991 -7.270 1.00 33.03 C ATOM 2499 CG HIS A 156 -16.667 -11.674 -5.946 1.00 3.24 C ATOM 2500 ND1 HIS A 156 -16.979 -12.333 -4.777 1.00 1.10 N ATOM 2501 CD2 HIS A 156 -15.706 -10.778 -5.614 1.00 72.34 C ATOM 2502 CE1 HIS A 156 -16.248 -11.855 -3.795 1.00 42.01 C ATOM 2503 NE2 HIS A 156 -15.465 -10.909 -4.274 1.00 32.43 N ATOM 0 H HIS A 156 -17.812 -9.328 -7.001 1.00 32.35 H new ATOM 0 HA HIS A 156 -19.015 -11.581 -8.525 1.00 1.31 H new ATOM 0 HB2 HIS A 156 -17.571 -13.053 -7.287 1.00 33.03 H new ATOM 0 HB3 HIS A 156 -16.598 -11.819 -8.065 1.00 33.03 H new ATOM 0 HD2 HIS A 156 -15.219 -10.086 -6.285 1.00 72.34 H new ATOM 0 HE1 HIS A 156 -16.283 -12.183 -2.767 1.00 42.01 H new ATOM 0 HE2 HIS A 156 -14.791 -10.365 -3.735 1.00 32.43 H new ATOM 2512 N HIS A 157 -19.693 -10.393 -5.546 1.00 22.54 N ATOM 2513 CA HIS A 157 -20.703 -10.347 -4.483 1.00 0.12 C ATOM 2514 C HIS A 157 -21.950 -9.625 -5.026 1.00 10.24 C ATOM 2515 O HIS A 157 -22.041 -8.392 -4.985 1.00 55.50 O ATOM 2516 CB HIS A 157 -20.132 -9.637 -3.226 1.00 70.51 C ATOM 2517 CG HIS A 157 -21.056 -9.665 -2.029 1.00 23.55 C ATOM 2518 ND1 HIS A 157 -21.783 -8.570 -1.603 1.00 62.21 N ATOM 2519 CD2 HIS A 157 -21.364 -10.666 -1.167 1.00 53.22 C ATOM 2520 CE1 HIS A 157 -22.489 -8.897 -0.543 1.00 3.30 C ATOM 2521 NE2 HIS A 157 -22.256 -10.161 -0.258 1.00 42.24 N ATOM 0 H HIS A 157 -19.011 -9.636 -5.498 1.00 22.54 H new ATOM 0 HA HIS A 157 -20.981 -11.357 -4.181 1.00 0.12 H new ATOM 0 HB2 HIS A 157 -19.187 -10.108 -2.954 1.00 70.51 H new ATOM 0 HB3 HIS A 157 -19.911 -8.600 -3.477 1.00 70.51 H new ATOM 0 HD2 HIS A 157 -20.978 -11.674 -1.193 1.00 53.22 H new ATOM 0 HE1 HIS A 157 -23.149 -8.239 0.002 1.00 3.30 H new ATOM 0 HE2 HIS A 157 -22.672 -10.680 0.515 1.00 42.24 H new ATOM 2530 N HIS A 158 -22.876 -10.410 -5.596 1.00 51.21 N ATOM 2531 CA HIS A 158 -24.086 -9.887 -6.268 1.00 41.10 C ATOM 2532 C HIS A 158 -25.358 -10.204 -5.452 1.00 62.33 C ATOM 2533 O HIS A 158 -25.329 -11.023 -4.528 1.00 45.11 O ATOM 2534 CB HIS A 158 -24.183 -10.473 -7.702 1.00 65.12 C ATOM 2535 CG HIS A 158 -24.283 -11.981 -7.769 1.00 4.02 C ATOM 2536 ND1 HIS A 158 -25.466 -12.664 -7.578 1.00 41.44 N ATOM 2537 CD2 HIS A 158 -23.347 -12.934 -8.013 1.00 4.53 C ATOM 2538 CE1 HIS A 158 -25.254 -13.957 -7.699 1.00 72.14 C ATOM 2539 NE2 HIS A 158 -23.982 -14.148 -7.963 1.00 15.20 N ATOM 0 H HIS A 158 -22.812 -11.428 -5.607 1.00 51.21 H new ATOM 0 HA HIS A 158 -24.007 -8.802 -6.336 1.00 41.10 H new ATOM 0 HB2 HIS A 158 -25.055 -10.043 -8.196 1.00 65.12 H new ATOM 0 HB3 HIS A 158 -23.307 -10.156 -8.268 1.00 65.12 H new ATOM 0 HD2 HIS A 158 -22.298 -12.767 -8.210 1.00 4.53 H new ATOM 0 HE1 HIS A 158 -26.001 -14.731 -7.598 1.00 72.14 H new ATOM 0 HE2 HIS A 158 -23.537 -15.055 -8.108 1.00 15.20 H new ATOM 2548 N HIS A 159 -26.473 -9.555 -5.831 1.00 11.14 N ATOM 2549 CA HIS A 159 -27.780 -9.697 -5.159 1.00 5.12 C ATOM 2550 C HIS A 159 -28.916 -9.407 -6.157 1.00 64.51 C ATOM 2551 O HIS A 159 -28.859 -8.418 -6.897 1.00 73.35 O ATOM 2552 CB HIS A 159 -27.859 -8.729 -3.941 1.00 22.13 C ATOM 2553 CG HIS A 159 -29.209 -8.663 -3.256 1.00 63.41 C ATOM 2554 ND1 HIS A 159 -29.631 -9.583 -2.321 1.00 10.31 N ATOM 2555 CD2 HIS A 159 -30.223 -7.767 -3.373 1.00 54.14 C ATOM 2556 CE1 HIS A 159 -30.836 -9.256 -1.900 1.00 14.34 C ATOM 2557 NE2 HIS A 159 -31.214 -8.164 -2.521 1.00 22.52 N ATOM 0 H HIS A 159 -26.494 -8.910 -6.621 1.00 11.14 H new ATOM 0 HA HIS A 159 -27.889 -10.719 -4.796 1.00 5.12 H new ATOM 0 HB2 HIS A 159 -27.112 -9.032 -3.208 1.00 22.13 H new ATOM 0 HB3 HIS A 159 -27.590 -7.727 -4.275 1.00 22.13 H new ATOM 0 HD2 HIS A 159 -30.242 -6.902 -4.019 1.00 54.14 H new ATOM 0 HE1 HIS A 159 -31.416 -9.797 -1.166 1.00 14.34 H new ATOM 0 HE2 HIS A 159 -32.106 -7.687 -2.389 1.00 22.52 H new ATOM 2566 N HIS A 160 -29.928 -10.294 -6.170 1.00 52.11 N ATOM 2567 CA HIS A 160 -31.168 -10.107 -6.941 1.00 14.40 C ATOM 2568 C HIS A 160 -32.019 -8.982 -6.310 1.00 60.43 C ATOM 2569 O HIS A 160 -32.565 -9.184 -5.206 1.00 64.11 O ATOM 2570 CB HIS A 160 -31.966 -11.444 -7.016 1.00 65.32 C ATOM 2571 CG HIS A 160 -33.295 -11.339 -7.734 1.00 45.24 C ATOM 2572 ND1 HIS A 160 -33.409 -11.322 -9.107 1.00 30.00 N ATOM 2573 CD2 HIS A 160 -34.564 -11.246 -7.259 1.00 13.42 C ATOM 2574 CE1 HIS A 160 -34.679 -11.221 -9.441 1.00 74.32 C ATOM 2575 NE2 HIS A 160 -35.398 -11.168 -8.341 1.00 74.40 N ATOM 2576 OXT HIS A 160 -32.137 -7.911 -6.920 1.00 37.48 O ATOM 0 H HIS A 160 -29.907 -11.166 -5.642 1.00 52.11 H new ATOM 0 HA HIS A 160 -30.914 -9.811 -7.959 1.00 14.40 H new ATOM 0 HB2 HIS A 160 -31.353 -12.191 -7.519 1.00 65.32 H new ATOM 0 HB3 HIS A 160 -32.142 -11.806 -6.003 1.00 65.32 H new ATOM 0 HD2 HIS A 160 -34.860 -11.236 -6.220 1.00 13.42 H new ATOM 0 HE1 HIS A 160 -35.065 -11.187 -10.449 1.00 74.32 H new ATOM 0 HE2 HIS A 160 -36.414 -11.083 -8.301 1.00 74.40 H new TER 2585 HIS A 160