USER MOD reduce.3.24.130724 H: found=0, std=0, add=1035, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1035 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 89 LYS NZ :NH3+ 161:sc= 1.2 (180deg=-0.0208) USER MOD Set 1.2: A 116 GLN : amide:sc= -3.61 K(o=-2.4,f=-13!) USER MOD Set 2.1: A 64 MET CE :methyl -148:sc= -8.67! (180deg=-10.4!) USER MOD Set 2.2: A 65 ASN : amide:sc= -5.93! C(o=-15!,f=-21!) USER MOD Set 3.1: A 37 HIS : no HD1:sc= -4.94! C(o=-19!,f=-12!) USER MOD Set 3.2: A 38 CYS SG : rot -91:sc= -14.4! USER MOD Set 4.1: A 17 ASN : amide:sc= 1.28 K(o=3.1,f=-5.2!) USER MOD Set 4.2: A 20 LYS NZ :NH3+ -177:sc= 1.86 (180deg=0.927) USER MOD Set 5.1: A 9 HIS : no HE2:sc= -1.01 K(o=0.23,f=-7.9!) USER MOD Set 5.2: A 11 SER OG : rot 6:sc= 1.24 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -122:sc= 0.191 (180deg=-0.0847) USER MOD Single : A 3 SER OG : rot 180:sc= 0.456 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=-0.0052) USER MOD Single : A 6 HIS : no HE2:sc= 0.105 K(o=0.1,f=-0.41) USER MOD Single : A 7 HIS : no HD1:sc= -0.124 K(o=0.27,f=-6.5!) USER MOD Single : A 8 HIS : no HD1:sc= -0.177 X(o=-0.18,f=-0.18) USER MOD Single : A 10 HIS : no HD1:sc= -1.01 K(o=-1,f=-2.3!) USER MOD Single : A 12 GLN : amide:sc= -0.288 K(o=-0.29,f=-3.4!) USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= -0.591 X(o=-0.59,f=-1) USER MOD Single : A 22 ASN : amide:sc= -0.657 K(o=-0.66,f=-1.8) USER MOD Single : A 23 SER OG : rot -8:sc= 1.16 USER MOD Single : A 24 SER OG : rot 180:sc= 0.171 USER MOD Single : A 25 LYS NZ :NH3+ 169:sc= 0.791 (180deg=0.339) USER MOD Single : A 40 SER OG : rot -170:sc= -0.0265 USER MOD Single : A 49 LYS NZ :NH3+ -163:sc= 0.041 (180deg=-0.461!) USER MOD Single : A 54 GLN : amide:sc= -13.9! C(o=-14!,f=-6.2!) USER MOD Single : A 67 SER OG : rot -43:sc= 0.187 USER MOD Single : A 68 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00853) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= -8.07! C(o=-8.1!,f=-6.3!) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 120:sc= -0.0519! USER MOD Single : A 79 THR OG1 : rot 104:sc= -0.718 USER MOD Single : A 80 SER OG : rot 69:sc= 1.24 USER MOD Single : A 81 SER OG : rot 71:sc= -1.11! USER MOD Single : A 84 TYR OH : rot 174:sc= -0.73 USER MOD Single : A 86 TYR OH : rot 153:sc= 0.0712 USER MOD Single : A 93 THR OG1 : rot -146:sc= 1.84 USER MOD Single : A 100 ASN : amide:sc= 1.01 K(o=1,f=-0.47) USER MOD Single : A 102 CYS SG : rot -15:sc= -0.246 USER MOD Single : A 108 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 109 HIS : no HE2:sc= -0.0626 K(o=-0.063,f=-1.8) USER MOD Single : A 112 HIS : no HD1:sc= -1.58 K(o=-1.6,f=-2.4!) USER MOD Single : A 115 LYS NZ :NH3+ -140:sc= -0.0166 (180deg=-4.3!) USER MOD Single : A 121 LYS NZ :NH3+ -157:sc= -0.165 (180deg=-0.202) USER MOD Single : A 125 GLN : amide:sc= -0.415 K(o=-0.42,f=-2.7) USER MOD Single : A 127 GLN : amide:sc= -0.471 K(o=-0.47,f=-5.5!) USER MOD Single : A 131 GLN : amide:sc= 0.344 K(o=0.34,f=-4!) USER MOD Single : A 132 GLN : amide:sc= -0.933 K(o=-0.93,f=-0.18) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 15.805 -7.005 25.851 1.00 0.00 N ATOM 2 CA MET A 1 16.135 -8.047 24.864 1.00 0.00 C ATOM 3 C MET A 1 14.893 -8.866 24.583 1.00 0.00 C ATOM 4 O MET A 1 13.849 -8.664 25.246 1.00 0.00 O ATOM 5 CB MET A 1 17.255 -8.958 25.384 1.00 0.00 C ATOM 6 CG MET A 1 18.593 -8.261 25.592 1.00 0.00 C ATOM 7 SD MET A 1 19.832 -9.371 26.260 1.00 0.00 S ATOM 8 CE MET A 1 21.259 -8.286 26.362 1.00 0.00 C ATOM 0 H1 MET A 1 16.014 -6.068 25.450 1.00 0.00 H new ATOM 0 H2 MET A 1 14.795 -7.061 26.091 1.00 0.00 H new ATOM 0 H3 MET A 1 16.373 -7.148 26.710 1.00 0.00 H new ATOM 0 HA MET A 1 16.485 -7.572 23.948 1.00 0.00 H new ATOM 0 HB2 MET A 1 16.938 -9.398 26.330 1.00 0.00 H new ATOM 0 HB3 MET A 1 17.393 -9.779 24.681 1.00 0.00 H new ATOM 0 HG2 MET A 1 18.943 -7.857 24.642 1.00 0.00 H new ATOM 0 HG3 MET A 1 18.461 -7.416 26.268 1.00 0.00 H new ATOM 0 HE1 MET A 1 22.109 -8.839 26.761 1.00 0.00 H new ATOM 0 HE2 MET A 1 21.504 -7.913 25.368 1.00 0.00 H new ATOM 0 HE3 MET A 1 21.032 -7.446 27.019 1.00 0.00 H new ATOM 20 N GLY A 2 14.982 -9.759 23.628 1.00 0.00 N ATOM 21 CA GLY A 2 13.883 -10.596 23.271 1.00 0.00 C ATOM 22 C GLY A 2 14.370 -11.731 22.426 1.00 0.00 C ATOM 23 O GLY A 2 15.406 -11.606 21.790 1.00 0.00 O ATOM 0 H GLY A 2 15.827 -9.920 23.079 1.00 0.00 H new ATOM 0 HA2 GLY A 2 13.398 -10.980 24.169 1.00 0.00 H new ATOM 0 HA3 GLY A 2 13.135 -10.019 22.727 1.00 0.00 H new ATOM 27 N SER A 3 13.652 -12.812 22.429 1.00 0.00 N ATOM 28 CA SER A 3 14.020 -13.987 21.669 1.00 0.00 C ATOM 29 C SER A 3 12.756 -14.692 21.178 1.00 0.00 C ATOM 30 O SER A 3 12.404 -14.621 20.001 1.00 0.00 O ATOM 31 CB SER A 3 14.878 -14.903 22.555 1.00 0.00 C ATOM 32 OG SER A 3 14.245 -15.107 23.834 1.00 0.00 O ATOM 0 H SER A 3 12.787 -12.913 22.960 1.00 0.00 H new ATOM 0 HA SER A 3 14.607 -13.711 20.793 1.00 0.00 H new ATOM 0 HB2 SER A 3 15.027 -15.862 22.059 1.00 0.00 H new ATOM 0 HB3 SER A 3 15.864 -14.461 22.697 1.00 0.00 H new ATOM 0 HG SER A 3 14.803 -15.694 24.385 1.00 0.00 H new ATOM 38 N SER A 4 12.089 -15.347 22.101 1.00 0.00 N ATOM 39 CA SER A 4 10.803 -15.969 21.867 1.00 0.00 C ATOM 40 C SER A 4 9.728 -15.035 22.428 1.00 0.00 C ATOM 41 O SER A 4 8.598 -14.940 21.932 1.00 0.00 O ATOM 42 CB SER A 4 10.770 -17.341 22.578 1.00 0.00 C ATOM 43 OG SER A 4 9.516 -17.986 22.447 1.00 0.00 O ATOM 0 H SER A 4 12.431 -15.465 23.055 1.00 0.00 H new ATOM 0 HA SER A 4 10.626 -16.133 20.804 1.00 0.00 H new ATOM 0 HB2 SER A 4 11.550 -17.981 22.164 1.00 0.00 H new ATOM 0 HB3 SER A 4 10.997 -17.205 23.635 1.00 0.00 H new ATOM 0 HG SER A 4 9.542 -18.849 22.910 1.00 0.00 H new ATOM 49 N HIS A 5 10.100 -14.324 23.471 1.00 0.00 N ATOM 50 CA HIS A 5 9.227 -13.368 24.089 1.00 0.00 C ATOM 51 C HIS A 5 9.724 -11.996 23.695 1.00 0.00 C ATOM 52 O HIS A 5 10.943 -11.801 23.584 1.00 0.00 O ATOM 53 CB HIS A 5 9.181 -13.552 25.622 1.00 0.00 C ATOM 54 CG HIS A 5 8.680 -14.917 26.055 1.00 0.00 C ATOM 55 ND1 HIS A 5 9.314 -15.695 27.010 1.00 0.00 N ATOM 56 CD2 HIS A 5 7.592 -15.634 25.660 1.00 0.00 C ATOM 57 CE1 HIS A 5 8.642 -16.824 27.172 1.00 0.00 C ATOM 58 NE2 HIS A 5 7.598 -16.810 26.369 1.00 0.00 N ATOM 0 H HIS A 5 11.018 -14.398 23.909 1.00 0.00 H new ATOM 0 HA HIS A 5 8.201 -13.506 23.749 1.00 0.00 H new ATOM 0 HB2 HIS A 5 10.180 -13.395 26.029 1.00 0.00 H new ATOM 0 HB3 HIS A 5 8.538 -12.785 26.053 1.00 0.00 H new ATOM 0 HD2 HIS A 5 6.860 -15.333 24.925 1.00 0.00 H new ATOM 0 HE1 HIS A 5 8.906 -17.623 27.849 1.00 0.00 H new ATOM 0 HE2 HIS A 5 6.905 -17.554 26.287 1.00 0.00 H new ATOM 67 N HIS A 6 8.794 -11.066 23.456 1.00 0.00 N ATOM 68 CA HIS A 6 9.068 -9.709 22.892 1.00 0.00 C ATOM 69 C HIS A 6 9.318 -9.838 21.398 1.00 0.00 C ATOM 70 O HIS A 6 8.576 -9.304 20.590 1.00 0.00 O ATOM 71 CB HIS A 6 10.217 -8.921 23.592 1.00 0.00 C ATOM 72 CG HIS A 6 9.959 -8.573 25.031 1.00 0.00 C ATOM 73 ND1 HIS A 6 10.880 -8.795 26.037 1.00 0.00 N ATOM 74 CD2 HIS A 6 8.888 -7.989 25.630 1.00 0.00 C ATOM 75 CE1 HIS A 6 10.385 -8.370 27.189 1.00 0.00 C ATOM 76 NE2 HIS A 6 9.182 -7.878 26.967 1.00 0.00 N ATOM 0 H HIS A 6 7.805 -11.223 23.648 1.00 0.00 H new ATOM 0 HA HIS A 6 8.180 -9.107 23.085 1.00 0.00 H new ATOM 0 HB2 HIS A 6 11.131 -9.512 23.534 1.00 0.00 H new ATOM 0 HB3 HIS A 6 10.397 -8.000 23.037 1.00 0.00 H new ATOM 0 HD1 HIS A 6 11.799 -9.220 25.911 1.00 0.00 H new ATOM 0 HD2 HIS A 6 7.976 -7.672 25.145 1.00 0.00 H new ATOM 0 HE1 HIS A 6 10.882 -8.418 28.147 1.00 0.00 H new ATOM 85 N HIS A 7 10.318 -10.619 21.039 1.00 0.00 N ATOM 86 CA HIS A 7 10.599 -10.941 19.647 1.00 0.00 C ATOM 87 C HIS A 7 9.684 -12.117 19.266 1.00 0.00 C ATOM 88 O HIS A 7 10.123 -13.209 18.976 1.00 0.00 O ATOM 89 CB HIS A 7 12.105 -11.305 19.469 1.00 0.00 C ATOM 90 CG HIS A 7 12.544 -11.660 18.055 1.00 0.00 C ATOM 91 ND1 HIS A 7 12.590 -12.957 17.588 1.00 0.00 N ATOM 92 CD2 HIS A 7 12.975 -10.887 17.032 1.00 0.00 C ATOM 93 CE1 HIS A 7 13.030 -12.965 16.342 1.00 0.00 C ATOM 94 NE2 HIS A 7 13.271 -11.722 15.983 1.00 0.00 N ATOM 0 H HIS A 7 10.961 -11.050 21.702 1.00 0.00 H new ATOM 0 HA HIS A 7 10.404 -10.089 18.996 1.00 0.00 H new ATOM 0 HB2 HIS A 7 12.705 -10.463 19.814 1.00 0.00 H new ATOM 0 HB3 HIS A 7 12.334 -12.148 20.121 1.00 0.00 H new ATOM 0 HD2 HIS A 7 13.069 -9.811 17.039 1.00 0.00 H new ATOM 0 HE1 HIS A 7 13.168 -13.840 15.725 1.00 0.00 H new ATOM 0 HE2 HIS A 7 13.621 -11.426 15.072 1.00 0.00 H new ATOM 103 N HIS A 8 8.400 -11.876 19.328 1.00 0.00 N ATOM 104 CA HIS A 8 7.420 -12.913 19.067 1.00 0.00 C ATOM 105 C HIS A 8 6.889 -12.766 17.643 1.00 0.00 C ATOM 106 O HIS A 8 5.907 -13.392 17.250 1.00 0.00 O ATOM 107 CB HIS A 8 6.282 -12.847 20.113 1.00 0.00 C ATOM 108 CG HIS A 8 5.319 -14.006 20.060 1.00 0.00 C ATOM 109 ND1 HIS A 8 3.979 -13.866 19.747 1.00 0.00 N ATOM 110 CD2 HIS A 8 5.510 -15.327 20.297 1.00 0.00 C ATOM 111 CE1 HIS A 8 3.391 -15.045 19.793 1.00 0.00 C ATOM 112 NE2 HIS A 8 4.294 -15.951 20.124 1.00 0.00 N ATOM 0 H HIS A 8 8.001 -10.966 19.558 1.00 0.00 H new ATOM 0 HA HIS A 8 7.888 -13.893 19.155 1.00 0.00 H new ATOM 0 HB2 HIS A 8 6.723 -12.802 21.109 1.00 0.00 H new ATOM 0 HB3 HIS A 8 5.725 -11.921 19.968 1.00 0.00 H new ATOM 0 HD2 HIS A 8 6.441 -15.801 20.570 1.00 0.00 H new ATOM 0 HE1 HIS A 8 2.347 -15.238 19.594 1.00 0.00 H new ATOM 0 HE2 HIS A 8 4.119 -16.950 20.234 1.00 0.00 H new ATOM 121 N HIS A 9 7.547 -11.942 16.886 1.00 0.00 N ATOM 122 CA HIS A 9 7.195 -11.735 15.517 1.00 0.00 C ATOM 123 C HIS A 9 8.236 -12.464 14.702 1.00 0.00 C ATOM 124 O HIS A 9 9.431 -12.310 14.965 1.00 0.00 O ATOM 125 CB HIS A 9 7.196 -10.236 15.186 1.00 0.00 C ATOM 126 CG HIS A 9 6.434 -9.898 13.944 1.00 0.00 C ATOM 127 ND1 HIS A 9 6.978 -9.295 12.852 1.00 0.00 N ATOM 128 CD2 HIS A 9 5.126 -10.060 13.668 1.00 0.00 C ATOM 129 CE1 HIS A 9 6.035 -9.099 11.959 1.00 0.00 C ATOM 130 NE2 HIS A 9 4.897 -9.557 12.441 1.00 0.00 N ATOM 0 H HIS A 9 8.346 -11.393 17.203 1.00 0.00 H new ATOM 0 HA HIS A 9 6.194 -12.108 15.300 1.00 0.00 H new ATOM 0 HB2 HIS A 9 6.769 -9.687 16.025 1.00 0.00 H new ATOM 0 HB3 HIS A 9 8.226 -9.898 15.074 1.00 0.00 H new ATOM 0 HD1 HIS A 9 7.959 -9.037 12.744 1.00 0.00 H new ATOM 0 HD2 HIS A 9 4.391 -10.513 14.317 1.00 0.00 H new ATOM 0 HE1 HIS A 9 6.170 -8.639 10.991 1.00 0.00 H new ATOM 139 N HIS A 10 7.802 -13.280 13.776 1.00 0.00 N ATOM 140 CA HIS A 10 8.720 -14.075 12.995 1.00 0.00 C ATOM 141 C HIS A 10 8.352 -13.948 11.528 1.00 0.00 C ATOM 142 O HIS A 10 7.355 -14.534 11.093 1.00 0.00 O ATOM 143 CB HIS A 10 8.661 -15.557 13.433 1.00 0.00 C ATOM 144 CG HIS A 10 9.755 -16.384 12.842 1.00 0.00 C ATOM 145 ND1 HIS A 10 9.734 -16.856 11.553 1.00 0.00 N ATOM 146 CD2 HIS A 10 10.954 -16.723 13.346 1.00 0.00 C ATOM 147 CE1 HIS A 10 10.883 -17.439 11.289 1.00 0.00 C ATOM 148 NE2 HIS A 10 11.651 -17.365 12.358 1.00 0.00 N ATOM 0 H HIS A 10 6.818 -13.413 13.543 1.00 0.00 H new ATOM 0 HA HIS A 10 9.737 -13.715 13.153 1.00 0.00 H new ATOM 0 HB2 HIS A 10 8.719 -15.611 14.520 1.00 0.00 H new ATOM 0 HB3 HIS A 10 7.698 -15.978 13.143 1.00 0.00 H new ATOM 0 HD2 HIS A 10 11.304 -16.525 14.348 1.00 0.00 H new ATOM 0 HE1 HIS A 10 11.153 -17.902 10.351 1.00 0.00 H new ATOM 0 HE2 HIS A 10 12.602 -17.725 12.436 1.00 0.00 H new ATOM 157 N SER A 11 9.164 -13.231 10.785 1.00 0.00 N ATOM 158 CA SER A 11 8.911 -12.917 9.397 1.00 0.00 C ATOM 159 C SER A 11 10.094 -12.202 8.787 1.00 0.00 C ATOM 160 O SER A 11 11.246 -12.550 9.048 1.00 0.00 O ATOM 161 CB SER A 11 7.565 -12.160 9.247 1.00 0.00 C ATOM 162 OG SER A 11 7.502 -10.989 10.039 1.00 0.00 O ATOM 0 H SER A 11 10.038 -12.841 11.137 1.00 0.00 H new ATOM 0 HA SER A 11 8.799 -13.839 8.827 1.00 0.00 H new ATOM 0 HB2 SER A 11 7.418 -11.893 8.200 1.00 0.00 H new ATOM 0 HB3 SER A 11 6.747 -12.825 9.524 1.00 0.00 H new ATOM 0 HG SER A 11 8.370 -10.837 10.468 1.00 0.00 H new ATOM 168 N GLN A 12 9.831 -11.235 7.984 1.00 0.00 N ATOM 169 CA GLN A 12 10.832 -10.655 7.150 1.00 0.00 C ATOM 170 C GLN A 12 10.830 -9.164 7.308 1.00 0.00 C ATOM 171 O GLN A 12 11.017 -8.410 6.378 1.00 0.00 O ATOM 172 CB GLN A 12 10.551 -11.101 5.748 1.00 0.00 C ATOM 173 CG GLN A 12 10.582 -12.622 5.629 1.00 0.00 C ATOM 174 CD GLN A 12 10.045 -13.113 4.328 1.00 0.00 C ATOM 175 OE1 GLN A 12 8.866 -13.402 4.208 1.00 0.00 O ATOM 176 NE2 GLN A 12 10.888 -13.180 3.343 1.00 0.00 N ATOM 0 H GLN A 12 8.906 -10.816 7.883 1.00 0.00 H new ATOM 0 HA GLN A 12 11.835 -10.981 7.427 1.00 0.00 H new ATOM 0 HB2 GLN A 12 9.575 -10.730 5.436 1.00 0.00 H new ATOM 0 HB3 GLN A 12 11.288 -10.667 5.072 1.00 0.00 H new ATOM 0 HG2 GLN A 12 11.608 -12.970 5.747 1.00 0.00 H new ATOM 0 HG3 GLN A 12 10.002 -13.057 6.443 1.00 0.00 H new ATOM 0 HE21 GLN A 12 11.865 -12.928 3.490 1.00 0.00 H new ATOM 0 HE22 GLN A 12 10.573 -13.484 2.422 1.00 0.00 H new ATOM 185 N ASP A 13 10.605 -8.807 8.513 1.00 0.00 N ATOM 186 CA ASP A 13 10.592 -7.519 9.026 1.00 0.00 C ATOM 187 C ASP A 13 11.927 -7.280 9.772 1.00 0.00 C ATOM 188 O ASP A 13 12.765 -8.173 9.754 1.00 0.00 O ATOM 189 CB ASP A 13 9.442 -7.502 9.986 1.00 0.00 C ATOM 190 CG ASP A 13 9.466 -8.565 11.075 1.00 0.00 C ATOM 191 OD1 ASP A 13 9.324 -8.213 12.253 1.00 0.00 O ATOM 192 OD2 ASP A 13 9.621 -9.764 10.771 1.00 0.00 O ATOM 0 H ASP A 13 10.404 -9.499 9.235 1.00 0.00 H new ATOM 0 HA ASP A 13 10.487 -6.747 8.264 1.00 0.00 H new ATOM 0 HB2 ASP A 13 9.407 -6.522 10.463 1.00 0.00 H new ATOM 0 HB3 ASP A 13 8.518 -7.613 9.418 1.00 0.00 H new ATOM 197 N PRO A 14 12.141 -6.116 10.528 1.00 0.00 N ATOM 198 CA PRO A 14 13.449 -5.825 11.172 1.00 0.00 C ATOM 199 C PRO A 14 13.814 -6.850 12.228 1.00 0.00 C ATOM 200 O PRO A 14 14.959 -6.948 12.659 1.00 0.00 O ATOM 201 CB PRO A 14 13.221 -4.471 11.843 1.00 0.00 C ATOM 202 CG PRO A 14 12.073 -3.876 11.123 1.00 0.00 C ATOM 203 CD PRO A 14 11.173 -5.026 10.837 1.00 0.00 C ATOM 0 HA PRO A 14 14.263 -5.840 10.447 1.00 0.00 H new ATOM 0 HB2 PRO A 14 13.003 -4.588 12.905 1.00 0.00 H new ATOM 0 HB3 PRO A 14 14.106 -3.839 11.767 1.00 0.00 H new ATOM 0 HG2 PRO A 14 11.572 -3.122 11.730 1.00 0.00 H new ATOM 0 HG3 PRO A 14 12.393 -3.385 10.204 1.00 0.00 H new ATOM 0 HD2 PRO A 14 10.543 -5.272 11.692 1.00 0.00 H new ATOM 0 HD3 PRO A 14 10.507 -4.823 9.998 1.00 0.00 H new ATOM 211 N MET A 15 12.811 -7.566 12.672 1.00 0.00 N ATOM 212 CA MET A 15 12.969 -8.624 13.605 1.00 0.00 C ATOM 213 C MET A 15 13.807 -9.761 13.035 1.00 0.00 C ATOM 214 O MET A 15 14.440 -10.505 13.804 1.00 0.00 O ATOM 215 CB MET A 15 11.623 -9.154 14.112 1.00 0.00 C ATOM 216 CG MET A 15 10.848 -8.217 14.930 1.00 0.00 C ATOM 217 SD MET A 15 11.606 -7.827 16.520 1.00 0.00 S ATOM 218 CE MET A 15 10.420 -6.647 17.167 1.00 0.00 C ATOM 0 H MET A 15 11.845 -7.416 12.381 1.00 0.00 H new ATOM 0 HA MET A 15 13.503 -8.202 14.457 1.00 0.00 H new ATOM 0 HB2 MET A 15 11.019 -9.445 13.253 1.00 0.00 H new ATOM 0 HB3 MET A 15 11.803 -10.057 14.696 1.00 0.00 H new ATOM 0 HG2 MET A 15 10.708 -7.292 14.370 1.00 0.00 H new ATOM 0 HG3 MET A 15 9.858 -8.637 15.105 1.00 0.00 H new ATOM 0 HE1 MET A 15 10.744 -6.307 18.151 1.00 0.00 H new ATOM 0 HE2 MET A 15 10.351 -5.793 16.493 1.00 0.00 H new ATOM 0 HE3 MET A 15 9.443 -7.122 17.252 1.00 0.00 H new ATOM 228 N GLU A 16 13.788 -9.914 11.703 1.00 0.00 N ATOM 229 CA GLU A 16 14.578 -10.944 11.020 1.00 0.00 C ATOM 230 C GLU A 16 15.020 -10.517 9.617 1.00 0.00 C ATOM 231 O GLU A 16 16.164 -10.117 9.422 1.00 0.00 O ATOM 232 CB GLU A 16 13.836 -12.286 10.906 1.00 0.00 C ATOM 233 CG GLU A 16 13.629 -13.036 12.200 1.00 0.00 C ATOM 234 CD GLU A 16 12.829 -14.279 11.992 1.00 0.00 C ATOM 235 OE1 GLU A 16 11.602 -14.174 11.896 1.00 0.00 O ATOM 236 OE2 GLU A 16 13.408 -15.402 11.949 1.00 0.00 O ATOM 0 H GLU A 16 13.231 -9.333 11.076 1.00 0.00 H new ATOM 0 HA GLU A 16 15.458 -11.074 11.650 1.00 0.00 H new ATOM 0 HB2 GLU A 16 12.861 -12.103 10.454 1.00 0.00 H new ATOM 0 HB3 GLU A 16 14.389 -12.928 10.221 1.00 0.00 H new ATOM 0 HG2 GLU A 16 14.597 -13.293 12.631 1.00 0.00 H new ATOM 0 HG3 GLU A 16 13.121 -12.392 12.918 1.00 0.00 H new ATOM 243 N ASN A 17 14.068 -10.591 8.642 1.00 0.00 N ATOM 244 CA ASN A 17 14.358 -10.419 7.196 1.00 0.00 C ATOM 245 C ASN A 17 15.448 -11.418 6.835 1.00 0.00 C ATOM 246 O ASN A 17 16.469 -11.137 6.216 1.00 0.00 O ATOM 247 CB ASN A 17 14.723 -8.968 6.873 1.00 0.00 C ATOM 248 CG ASN A 17 14.976 -8.604 5.364 1.00 0.00 C ATOM 249 OD1 ASN A 17 15.497 -9.391 4.531 1.00 0.00 O ATOM 250 ND2 ASN A 17 14.577 -7.433 4.998 1.00 0.00 N ATOM 0 H ASN A 17 13.084 -10.771 8.840 1.00 0.00 H new ATOM 0 HA ASN A 17 13.478 -10.623 6.587 1.00 0.00 H new ATOM 0 HB2 ASN A 17 13.922 -8.329 7.244 1.00 0.00 H new ATOM 0 HB3 ASN A 17 15.621 -8.713 7.436 1.00 0.00 H new ATOM 0 HD21 ASN A 17 14.683 -7.139 4.027 1.00 0.00 H new ATOM 0 HD22 ASN A 17 14.156 -6.802 5.679 1.00 0.00 H new ATOM 257 N GLN A 18 15.232 -12.578 7.329 1.00 0.00 N ATOM 258 CA GLN A 18 16.034 -13.692 7.085 1.00 0.00 C ATOM 259 C GLN A 18 15.939 -14.142 5.594 1.00 0.00 C ATOM 260 O GLN A 18 16.913 -13.977 4.869 1.00 0.00 O ATOM 261 CB GLN A 18 15.696 -14.748 8.107 1.00 0.00 C ATOM 262 CG GLN A 18 16.591 -14.755 9.323 1.00 0.00 C ATOM 263 CD GLN A 18 18.045 -14.996 8.966 1.00 0.00 C ATOM 264 OE1 GLN A 18 18.798 -14.072 8.708 1.00 0.00 O ATOM 265 NE2 GLN A 18 18.447 -16.242 8.940 1.00 0.00 N ATOM 0 H GLN A 18 14.445 -12.776 7.947 1.00 0.00 H new ATOM 0 HA GLN A 18 17.091 -13.459 7.211 1.00 0.00 H new ATOM 0 HB2 GLN A 18 14.665 -14.604 8.431 1.00 0.00 H new ATOM 0 HB3 GLN A 18 15.746 -15.727 7.629 1.00 0.00 H new ATOM 0 HG2 GLN A 18 16.500 -13.802 9.844 1.00 0.00 H new ATOM 0 HG3 GLN A 18 16.256 -15.529 10.014 1.00 0.00 H new ATOM 0 HE21 GLN A 18 17.794 -16.993 9.161 1.00 0.00 H new ATOM 0 HE22 GLN A 18 19.414 -16.461 8.699 1.00 0.00 H new ATOM 274 N PRO A 19 14.806 -14.724 5.088 1.00 0.00 N ATOM 275 CA PRO A 19 14.634 -14.903 3.644 1.00 0.00 C ATOM 276 C PRO A 19 14.324 -13.553 2.988 1.00 0.00 C ATOM 277 O PRO A 19 13.655 -12.710 3.588 1.00 0.00 O ATOM 278 CB PRO A 19 13.415 -15.828 3.518 1.00 0.00 C ATOM 279 CG PRO A 19 13.179 -16.371 4.874 1.00 0.00 C ATOM 280 CD PRO A 19 13.686 -15.334 5.823 1.00 0.00 C ATOM 0 HA PRO A 19 15.524 -15.309 3.163 1.00 0.00 H new ATOM 0 HB2 PRO A 19 12.544 -15.280 3.159 1.00 0.00 H new ATOM 0 HB3 PRO A 19 13.604 -16.629 2.803 1.00 0.00 H new ATOM 0 HG2 PRO A 19 12.119 -16.566 5.038 1.00 0.00 H new ATOM 0 HG3 PRO A 19 13.702 -17.317 5.013 1.00 0.00 H new ATOM 0 HD2 PRO A 19 12.917 -14.601 6.066 1.00 0.00 H new ATOM 0 HD3 PRO A 19 14.015 -15.775 6.764 1.00 0.00 H new ATOM 288 N LYS A 20 14.855 -13.334 1.791 1.00 0.00 N ATOM 289 CA LYS A 20 14.695 -12.166 1.063 1.00 0.00 C ATOM 290 C LYS A 20 13.298 -11.913 0.537 1.00 0.00 C ATOM 291 O LYS A 20 12.367 -12.628 0.832 1.00 0.00 O ATOM 292 CB LYS A 20 15.661 -12.216 -0.062 1.00 0.00 C ATOM 293 CG LYS A 20 17.132 -12.318 0.370 1.00 0.00 C ATOM 294 CD LYS A 20 17.509 -11.302 1.442 1.00 0.00 C ATOM 295 CE LYS A 20 17.404 -11.873 2.851 1.00 0.00 C ATOM 296 NZ LYS A 20 17.701 -10.891 3.920 1.00 0.00 N ATOM 0 H LYS A 20 15.431 -14.027 1.313 1.00 0.00 H new ATOM 0 HA LYS A 20 14.878 -11.334 1.743 1.00 0.00 H new ATOM 0 HB2 LYS A 20 15.420 -13.071 -0.694 1.00 0.00 H new ATOM 0 HB3 LYS A 20 15.535 -11.322 -0.673 1.00 0.00 H new ATOM 0 HG2 LYS A 20 17.326 -13.323 0.745 1.00 0.00 H new ATOM 0 HG3 LYS A 20 17.772 -12.174 -0.501 1.00 0.00 H new ATOM 0 HD2 LYS A 20 18.528 -10.957 1.268 1.00 0.00 H new ATOM 0 HD3 LYS A 20 16.859 -10.431 1.357 1.00 0.00 H new ATOM 0 HE2 LYS A 20 16.398 -12.264 3.000 1.00 0.00 H new ATOM 0 HE3 LYS A 20 18.090 -12.715 2.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 17.660 -11.363 4.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 18.652 -10.497 3.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 17.000 -10.123 3.891 1.00 0.00 H new ATOM 310 N LEU A 21 13.196 -10.827 -0.195 1.00 0.00 N ATOM 311 CA LEU A 21 12.023 -10.344 -0.826 1.00 0.00 C ATOM 312 C LEU A 21 11.471 -11.230 -1.884 1.00 0.00 C ATOM 313 O LEU A 21 10.268 -11.300 -2.076 1.00 0.00 O ATOM 314 CB LEU A 21 12.453 -9.049 -1.353 1.00 0.00 C ATOM 315 CG LEU A 21 12.953 -8.093 -0.381 1.00 0.00 C ATOM 316 CD1 LEU A 21 12.550 -6.840 -0.742 1.00 0.00 C ATOM 317 CD2 LEU A 21 12.481 -8.293 0.922 1.00 0.00 C ATOM 0 H LEU A 21 14.001 -10.224 -0.368 1.00 0.00 H new ATOM 0 HA LEU A 21 11.188 -10.286 -0.128 1.00 0.00 H new ATOM 0 HB2 LEU A 21 13.233 -9.223 -2.094 1.00 0.00 H new ATOM 0 HB3 LEU A 21 11.611 -8.596 -1.877 1.00 0.00 H new ATOM 0 HG LEU A 21 14.035 -8.223 -0.377 1.00 0.00 H new ATOM 0 HD11 LEU A 21 12.921 -6.115 -0.017 1.00 0.00 H new ATOM 0 HD12 LEU A 21 12.945 -6.601 -1.729 1.00 0.00 H new ATOM 0 HD13 LEU A 21 11.461 -6.802 -0.768 1.00 0.00 H new ATOM 0 HD21 LEU A 21 12.904 -7.536 1.582 1.00 0.00 H new ATOM 0 HD22 LEU A 21 11.394 -8.216 0.931 1.00 0.00 H new ATOM 0 HD23 LEU A 21 12.778 -9.283 1.268 1.00 0.00 H new ATOM 329 N ASN A 22 12.358 -11.770 -2.650 1.00 0.00 N ATOM 330 CA ASN A 22 12.091 -12.843 -3.598 1.00 0.00 C ATOM 331 C ASN A 22 11.148 -12.420 -4.685 1.00 0.00 C ATOM 332 O ASN A 22 10.484 -13.230 -5.304 1.00 0.00 O ATOM 333 CB ASN A 22 11.604 -14.041 -2.849 1.00 0.00 C ATOM 334 CG ASN A 22 12.547 -14.428 -1.807 1.00 0.00 C ATOM 335 OD1 ASN A 22 13.772 -14.293 -1.934 1.00 0.00 O ATOM 336 ND2 ASN A 22 12.032 -14.845 -0.771 1.00 0.00 N ATOM 0 H ASN A 22 13.335 -11.476 -2.646 1.00 0.00 H new ATOM 0 HA ASN A 22 13.017 -13.104 -4.111 1.00 0.00 H new ATOM 0 HB2 ASN A 22 10.633 -13.825 -2.403 1.00 0.00 H new ATOM 0 HB3 ASN A 22 11.460 -14.872 -3.540 1.00 0.00 H new ATOM 0 HD21 ASN A 22 12.618 -15.095 0.025 1.00 0.00 H new ATOM 0 HD22 ASN A 22 11.018 -14.941 -0.708 1.00 0.00 H new ATOM 343 N SER A 23 11.080 -11.120 -4.839 1.00 0.00 N ATOM 344 CA SER A 23 10.474 -10.412 -5.973 1.00 0.00 C ATOM 345 C SER A 23 8.987 -10.069 -5.868 1.00 0.00 C ATOM 346 O SER A 23 8.437 -9.551 -6.824 1.00 0.00 O ATOM 347 CB SER A 23 10.887 -10.960 -7.400 1.00 0.00 C ATOM 348 OG SER A 23 10.436 -12.277 -7.670 1.00 0.00 O ATOM 0 H SER A 23 11.464 -10.479 -4.145 1.00 0.00 H new ATOM 0 HA SER A 23 10.955 -9.439 -5.876 1.00 0.00 H new ATOM 0 HB2 SER A 23 10.492 -10.289 -8.163 1.00 0.00 H new ATOM 0 HB3 SER A 23 11.973 -10.935 -7.486 1.00 0.00 H new ATOM 0 HG SER A 23 10.053 -12.665 -6.856 1.00 0.00 H new ATOM 354 N SER A 24 8.336 -10.299 -4.723 1.00 0.00 N ATOM 355 CA SER A 24 6.942 -9.845 -4.613 1.00 0.00 C ATOM 356 C SER A 24 6.415 -9.687 -3.172 1.00 0.00 C ATOM 357 O SER A 24 6.583 -8.645 -2.561 1.00 0.00 O ATOM 358 CB SER A 24 6.002 -10.694 -5.488 1.00 0.00 C ATOM 359 OG SER A 24 6.142 -12.079 -5.179 1.00 0.00 O ATOM 0 H SER A 24 8.721 -10.768 -3.903 1.00 0.00 H new ATOM 0 HA SER A 24 6.947 -8.827 -5.004 1.00 0.00 H new ATOM 0 HB2 SER A 24 4.969 -10.383 -5.329 1.00 0.00 H new ATOM 0 HB3 SER A 24 6.227 -10.526 -6.541 1.00 0.00 H new ATOM 0 HG SER A 24 5.536 -12.603 -5.743 1.00 0.00 H new ATOM 365 N LYS A 25 5.857 -10.734 -2.627 1.00 0.00 N ATOM 366 CA LYS A 25 5.192 -10.741 -1.394 1.00 0.00 C ATOM 367 C LYS A 25 6.069 -10.306 -0.300 1.00 0.00 C ATOM 368 O LYS A 25 5.770 -9.381 0.457 1.00 0.00 O ATOM 369 CB LYS A 25 4.827 -12.163 -1.181 1.00 0.00 C ATOM 370 CG LYS A 25 4.560 -12.501 0.235 1.00 0.00 C ATOM 371 CD LYS A 25 3.270 -13.135 0.440 1.00 0.00 C ATOM 372 CE LYS A 25 3.217 -14.452 -0.280 1.00 0.00 C ATOM 373 NZ LYS A 25 4.297 -15.393 0.155 1.00 0.00 N ATOM 0 H LYS A 25 5.867 -11.650 -3.076 1.00 0.00 H new ATOM 0 HA LYS A 25 4.339 -10.062 -1.403 1.00 0.00 H new ATOM 0 HB2 LYS A 25 3.942 -12.395 -1.774 1.00 0.00 H new ATOM 0 HB3 LYS A 25 5.634 -12.796 -1.551 1.00 0.00 H new ATOM 0 HG2 LYS A 25 5.345 -13.165 0.597 1.00 0.00 H new ATOM 0 HG3 LYS A 25 4.610 -11.592 0.834 1.00 0.00 H new ATOM 0 HD2 LYS A 25 3.097 -13.288 1.505 1.00 0.00 H new ATOM 0 HD3 LYS A 25 2.475 -12.483 0.079 1.00 0.00 H new ATOM 0 HE2 LYS A 25 2.246 -14.916 -0.109 1.00 0.00 H new ATOM 0 HE3 LYS A 25 3.302 -14.279 -1.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 4.107 -16.341 -0.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 5.215 -15.055 -0.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 4.320 -15.438 1.194 1.00 0.00 H new ATOM 387 N GLU A 26 7.120 -10.984 -0.230 1.00 0.00 N ATOM 388 CA GLU A 26 8.088 -10.820 0.792 1.00 0.00 C ATOM 389 C GLU A 26 8.770 -9.425 0.724 1.00 0.00 C ATOM 390 O GLU A 26 9.494 -9.036 1.621 1.00 0.00 O ATOM 391 CB GLU A 26 9.128 -11.959 0.769 1.00 0.00 C ATOM 392 CG GLU A 26 8.605 -13.416 0.934 1.00 0.00 C ATOM 393 CD GLU A 26 7.649 -13.897 -0.153 1.00 0.00 C ATOM 394 OE1 GLU A 26 7.725 -13.406 -1.299 1.00 0.00 O ATOM 395 OE2 GLU A 26 6.774 -14.756 0.140 1.00 0.00 O ATOM 0 H GLU A 26 7.360 -11.709 -0.906 1.00 0.00 H new ATOM 0 HA GLU A 26 7.562 -10.873 1.745 1.00 0.00 H new ATOM 0 HB2 GLU A 26 9.669 -11.901 -0.176 1.00 0.00 H new ATOM 0 HB3 GLU A 26 9.851 -11.770 1.562 1.00 0.00 H new ATOM 0 HG2 GLU A 26 9.461 -14.090 0.965 1.00 0.00 H new ATOM 0 HG3 GLU A 26 8.102 -13.496 1.898 1.00 0.00 H new ATOM 402 N VAL A 27 8.522 -8.675 -0.337 1.00 0.00 N ATOM 403 CA VAL A 27 9.044 -7.336 -0.423 1.00 0.00 C ATOM 404 C VAL A 27 8.088 -6.392 0.154 1.00 0.00 C ATOM 405 O VAL A 27 8.481 -5.325 0.505 1.00 0.00 O ATOM 406 CB VAL A 27 9.490 -6.902 -1.814 1.00 0.00 C ATOM 407 CG1 VAL A 27 9.656 -8.051 -2.634 1.00 0.00 C ATOM 408 CG2 VAL A 27 8.603 -5.931 -2.417 1.00 0.00 C ATOM 0 H VAL A 27 7.967 -8.973 -1.139 1.00 0.00 H new ATOM 0 HA VAL A 27 9.965 -7.336 0.160 1.00 0.00 H new ATOM 0 HB VAL A 27 10.447 -6.390 -1.716 1.00 0.00 H new ATOM 0 HG11 VAL A 27 9.975 -7.744 -3.630 1.00 0.00 H new ATOM 0 HG12 VAL A 27 10.411 -8.704 -2.196 1.00 0.00 H new ATOM 0 HG13 VAL A 27 8.710 -8.587 -2.705 1.00 0.00 H new ATOM 0 HG21 VAL A 27 8.975 -5.663 -3.406 1.00 0.00 H new ATOM 0 HG22 VAL A 27 7.604 -6.358 -2.509 1.00 0.00 H new ATOM 0 HG23 VAL A 27 8.560 -5.040 -1.791 1.00 0.00 H new ATOM 418 N ILE A 28 6.800 -6.782 0.290 1.00 0.00 N ATOM 419 CA ILE A 28 5.906 -5.989 1.032 1.00 0.00 C ATOM 420 C ILE A 28 6.411 -5.985 2.372 1.00 0.00 C ATOM 421 O ILE A 28 6.397 -5.016 3.036 1.00 0.00 O ATOM 422 CB ILE A 28 4.531 -6.602 1.077 1.00 0.00 C ATOM 423 CG1 ILE A 28 3.875 -6.511 -0.239 1.00 0.00 C ATOM 424 CG2 ILE A 28 3.630 -6.018 2.209 1.00 0.00 C ATOM 425 CD1 ILE A 28 4.106 -5.184 -0.910 1.00 0.00 C ATOM 0 H ILE A 28 6.401 -7.631 -0.111 1.00 0.00 H new ATOM 0 HA ILE A 28 5.829 -4.998 0.584 1.00 0.00 H new ATOM 0 HB ILE A 28 4.668 -7.655 1.324 1.00 0.00 H new ATOM 0 HG12 ILE A 28 4.247 -7.309 -0.882 1.00 0.00 H new ATOM 0 HG13 ILE A 28 2.804 -6.672 -0.119 1.00 0.00 H new ATOM 0 HG21 ILE A 28 2.654 -6.503 2.184 1.00 0.00 H new ATOM 0 HG22 ILE A 28 4.100 -6.196 3.176 1.00 0.00 H new ATOM 0 HG23 ILE A 28 3.506 -4.946 2.058 1.00 0.00 H new ATOM 0 HD11 ILE A 28 3.601 -5.172 -1.876 1.00 0.00 H new ATOM 0 HD12 ILE A 28 3.710 -4.385 -0.283 1.00 0.00 H new ATOM 0 HD13 ILE A 28 5.175 -5.032 -1.058 1.00 0.00 H new ATOM 437 N ALA A 29 6.837 -7.120 2.744 1.00 0.00 N ATOM 438 CA ALA A 29 7.452 -7.328 3.951 1.00 0.00 C ATOM 439 C ALA A 29 8.666 -6.460 4.177 1.00 0.00 C ATOM 440 O ALA A 29 8.816 -5.908 5.253 1.00 0.00 O ATOM 441 CB ALA A 29 7.697 -8.731 4.131 1.00 0.00 C ATOM 0 H ALA A 29 6.754 -7.962 2.175 1.00 0.00 H new ATOM 0 HA ALA A 29 6.770 -7.003 4.736 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.186 -8.895 5.091 1.00 0.00 H new ATOM 0 HB2 ALA A 29 6.751 -9.271 4.109 1.00 0.00 H new ATOM 0 HB3 ALA A 29 8.341 -9.094 3.330 1.00 0.00 H new ATOM 447 N PHE A 30 9.492 -6.291 3.157 1.00 0.00 N ATOM 448 CA PHE A 30 10.566 -5.381 3.252 1.00 0.00 C ATOM 449 C PHE A 30 10.017 -4.017 3.361 1.00 0.00 C ATOM 450 O PHE A 30 10.406 -3.257 4.185 1.00 0.00 O ATOM 451 CB PHE A 30 11.349 -5.471 2.021 1.00 0.00 C ATOM 452 CG PHE A 30 11.864 -4.213 1.507 1.00 0.00 C ATOM 453 CD1 PHE A 30 12.832 -3.523 2.179 1.00 0.00 C ATOM 454 CD2 PHE A 30 11.367 -3.718 0.338 1.00 0.00 C ATOM 455 CE1 PHE A 30 13.295 -2.372 1.692 1.00 0.00 C ATOM 456 CE2 PHE A 30 11.830 -2.577 -0.127 1.00 0.00 C ATOM 457 CZ PHE A 30 12.795 -1.899 0.542 1.00 0.00 C ATOM 0 H PHE A 30 9.420 -6.782 2.266 1.00 0.00 H new ATOM 0 HA PHE A 30 11.186 -5.608 4.119 1.00 0.00 H new ATOM 0 HB2 PHE A 30 12.190 -6.142 2.196 1.00 0.00 H new ATOM 0 HB3 PHE A 30 10.729 -5.930 1.251 1.00 0.00 H new ATOM 0 HD1 PHE A 30 13.224 -3.911 3.108 1.00 0.00 H new ATOM 0 HD2 PHE A 30 10.601 -4.256 -0.201 1.00 0.00 H new ATOM 0 HE1 PHE A 30 14.064 -1.827 2.218 1.00 0.00 H new ATOM 0 HE2 PHE A 30 11.438 -2.177 -1.050 1.00 0.00 H new ATOM 0 HZ PHE A 30 13.165 -0.966 0.143 1.00 0.00 H new ATOM 467 N LEU A 31 9.102 -3.724 2.476 1.00 0.00 N ATOM 468 CA LEU A 31 8.466 -2.467 2.408 1.00 0.00 C ATOM 469 C LEU A 31 7.925 -2.108 3.720 1.00 0.00 C ATOM 470 O LEU A 31 7.980 -1.034 4.118 1.00 0.00 O ATOM 471 CB LEU A 31 7.360 -2.559 1.394 1.00 0.00 C ATOM 472 CG LEU A 31 7.817 -2.500 0.012 1.00 0.00 C ATOM 473 CD1 LEU A 31 6.682 -2.411 -0.916 1.00 0.00 C ATOM 474 CD2 LEU A 31 8.755 -1.373 -0.153 1.00 0.00 C ATOM 0 H LEU A 31 8.780 -4.384 1.768 1.00 0.00 H new ATOM 0 HA LEU A 31 9.179 -1.697 2.114 1.00 0.00 H new ATOM 0 HB2 LEU A 31 6.817 -3.492 1.547 1.00 0.00 H new ATOM 0 HB3 LEU A 31 6.654 -1.747 1.567 1.00 0.00 H new ATOM 0 HG LEU A 31 8.347 -3.422 -0.229 1.00 0.00 H new ATOM 0 HD11 LEU A 31 7.052 -2.368 -1.940 1.00 0.00 H new ATOM 0 HD12 LEU A 31 6.045 -3.287 -0.797 1.00 0.00 H new ATOM 0 HD13 LEU A 31 6.106 -1.511 -0.701 1.00 0.00 H new ATOM 0 HD21 LEU A 31 9.095 -1.331 -1.188 1.00 0.00 H new ATOM 0 HD22 LEU A 31 8.251 -0.440 0.101 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.612 -1.514 0.505 1.00 0.00 H new ATOM 486 N ALA A 32 7.469 -3.058 4.376 1.00 0.00 N ATOM 487 CA ALA A 32 6.872 -2.904 5.641 1.00 0.00 C ATOM 488 C ALA A 32 7.835 -2.799 6.774 1.00 0.00 C ATOM 489 O ALA A 32 7.519 -2.207 7.794 1.00 0.00 O ATOM 490 CB ALA A 32 6.033 -4.027 5.824 1.00 0.00 C ATOM 0 H ALA A 32 7.492 -4.024 4.049 1.00 0.00 H new ATOM 0 HA ALA A 32 6.331 -1.958 5.652 1.00 0.00 H new ATOM 0 HB1 ALA A 32 5.542 -3.960 6.795 1.00 0.00 H new ATOM 0 HB2 ALA A 32 5.280 -4.050 5.037 1.00 0.00 H new ATOM 0 HB3 ALA A 32 6.630 -4.938 5.782 1.00 0.00 H new ATOM 496 N GLU A 33 8.998 -3.351 6.610 1.00 0.00 N ATOM 497 CA GLU A 33 9.954 -3.309 7.667 1.00 0.00 C ATOM 498 C GLU A 33 10.586 -1.951 7.680 1.00 0.00 C ATOM 499 O GLU A 33 10.981 -1.379 8.697 1.00 0.00 O ATOM 500 CB GLU A 33 10.974 -4.372 7.482 1.00 0.00 C ATOM 501 CG GLU A 33 11.984 -4.088 6.448 1.00 0.00 C ATOM 502 CD GLU A 33 13.228 -4.880 6.573 1.00 0.00 C ATOM 503 OE1 GLU A 33 13.159 -6.076 6.709 1.00 0.00 O ATOM 504 OE2 GLU A 33 14.310 -4.271 6.509 1.00 0.00 O ATOM 0 H GLU A 33 9.304 -3.830 5.763 1.00 0.00 H new ATOM 0 HA GLU A 33 9.465 -3.489 8.624 1.00 0.00 H new ATOM 0 HB2 GLU A 33 11.483 -4.536 8.432 1.00 0.00 H new ATOM 0 HB3 GLU A 33 10.466 -5.302 7.228 1.00 0.00 H new ATOM 0 HG2 GLU A 33 11.545 -4.276 5.468 1.00 0.00 H new ATOM 0 HG3 GLU A 33 12.237 -3.028 6.486 1.00 0.00 H new ATOM 511 N ARG A 34 10.622 -1.488 6.508 1.00 0.00 N ATOM 512 CA ARG A 34 11.180 -0.311 6.074 1.00 0.00 C ATOM 513 C ARG A 34 10.194 0.834 6.258 1.00 0.00 C ATOM 514 O ARG A 34 10.555 1.928 6.687 1.00 0.00 O ATOM 515 CB ARG A 34 11.486 -0.599 4.618 1.00 0.00 C ATOM 516 CG ARG A 34 12.804 -0.231 4.166 1.00 0.00 C ATOM 517 CD ARG A 34 13.843 -1.076 4.841 1.00 0.00 C ATOM 518 NE ARG A 34 15.127 -1.010 4.176 1.00 0.00 N ATOM 519 CZ ARG A 34 16.167 -1.829 4.385 1.00 0.00 C ATOM 520 NH1 ARG A 34 16.070 -2.894 5.195 1.00 0.00 N ATOM 521 NH2 ARG A 34 17.293 -1.602 3.735 1.00 0.00 N ATOM 0 H ARG A 34 10.201 -2.004 5.735 1.00 0.00 H new ATOM 0 HA ARG A 34 12.071 -0.003 6.621 1.00 0.00 H new ATOM 0 HB2 ARG A 34 11.348 -1.666 4.442 1.00 0.00 H new ATOM 0 HB3 ARG A 34 10.753 -0.077 4.003 1.00 0.00 H new ATOM 0 HG2 ARG A 34 12.872 -0.354 3.085 1.00 0.00 H new ATOM 0 HG3 ARG A 34 12.988 0.822 4.379 1.00 0.00 H new ATOM 0 HD2 ARG A 34 13.956 -0.751 5.875 1.00 0.00 H new ATOM 0 HD3 ARG A 34 13.504 -2.112 4.868 1.00 0.00 H new ATOM 0 HE ARG A 34 15.252 -0.271 3.484 1.00 0.00 H new ATOM 0 HH11 ARG A 34 15.190 -3.096 5.669 1.00 0.00 H new ATOM 0 HH12 ARG A 34 16.877 -3.502 5.337 1.00 0.00 H new ATOM 0 HH21 ARG A 34 17.359 -0.816 3.089 1.00 0.00 H new ATOM 0 HH22 ARG A 34 18.097 -2.213 3.879 1.00 0.00 H new ATOM 535 N PHE A 35 8.950 0.579 5.932 1.00 0.00 N ATOM 536 CA PHE A 35 7.896 1.530 6.077 1.00 0.00 C ATOM 537 C PHE A 35 6.773 1.073 7.027 1.00 0.00 C ATOM 538 O PHE A 35 5.655 0.835 6.558 1.00 0.00 O ATOM 539 CB PHE A 35 7.334 1.692 4.712 1.00 0.00 C ATOM 540 CG PHE A 35 8.265 2.271 3.740 1.00 0.00 C ATOM 541 CD1 PHE A 35 8.828 3.516 3.902 1.00 0.00 C ATOM 542 CD2 PHE A 35 8.628 1.528 2.673 1.00 0.00 C ATOM 543 CE1 PHE A 35 9.745 3.978 2.980 1.00 0.00 C ATOM 544 CE2 PHE A 35 9.494 1.965 1.777 1.00 0.00 C ATOM 545 CZ PHE A 35 10.076 3.188 1.898 1.00 0.00 C ATOM 0 H PHE A 35 8.645 -0.317 5.551 1.00 0.00 H new ATOM 0 HA PHE A 35 8.292 2.448 6.511 1.00 0.00 H new ATOM 0 HB2 PHE A 35 7.007 0.718 4.349 1.00 0.00 H new ATOM 0 HB3 PHE A 35 6.448 2.324 4.770 1.00 0.00 H new ATOM 0 HD1 PHE A 35 8.553 4.129 4.747 1.00 0.00 H new ATOM 0 HD2 PHE A 35 8.197 0.546 2.548 1.00 0.00 H new ATOM 0 HE1 PHE A 35 10.200 4.950 3.104 1.00 0.00 H new ATOM 0 HE2 PHE A 35 9.745 1.340 0.933 1.00 0.00 H new ATOM 0 HZ PHE A 35 10.785 3.535 1.160 1.00 0.00 H new ATOM 555 N PRO A 36 7.049 0.933 8.364 1.00 0.00 N ATOM 556 CA PRO A 36 6.035 0.633 9.420 1.00 0.00 C ATOM 557 C PRO A 36 4.728 1.522 9.428 1.00 0.00 C ATOM 558 O PRO A 36 3.937 1.445 10.357 1.00 0.00 O ATOM 559 CB PRO A 36 6.809 0.905 10.722 1.00 0.00 C ATOM 560 CG PRO A 36 8.223 1.161 10.376 1.00 0.00 C ATOM 561 CD PRO A 36 8.398 0.855 8.947 1.00 0.00 C ATOM 0 HA PRO A 36 5.654 -0.376 9.265 1.00 0.00 H new ATOM 0 HB2 PRO A 36 6.385 1.763 11.244 1.00 0.00 H new ATOM 0 HB3 PRO A 36 6.731 0.051 11.395 1.00 0.00 H new ATOM 0 HG2 PRO A 36 8.484 2.200 10.579 1.00 0.00 H new ATOM 0 HG3 PRO A 36 8.883 0.542 10.983 1.00 0.00 H new ATOM 0 HD2 PRO A 36 9.073 1.567 8.472 1.00 0.00 H new ATOM 0 HD3 PRO A 36 8.830 -0.136 8.807 1.00 0.00 H new ATOM 569 N HIS A 37 4.547 2.384 8.448 1.00 0.00 N ATOM 570 CA HIS A 37 3.347 3.175 8.334 1.00 0.00 C ATOM 571 C HIS A 37 2.577 2.810 7.086 1.00 0.00 C ATOM 572 O HIS A 37 1.392 2.538 7.152 1.00 0.00 O ATOM 573 CB HIS A 37 3.595 4.711 8.463 1.00 0.00 C ATOM 574 CG HIS A 37 4.884 5.231 7.913 1.00 0.00 C ATOM 575 ND1 HIS A 37 5.897 5.749 8.699 1.00 0.00 N ATOM 576 CD2 HIS A 37 5.311 5.320 6.657 1.00 0.00 C ATOM 577 CE1 HIS A 37 6.896 6.132 7.927 1.00 0.00 C ATOM 578 NE2 HIS A 37 6.569 5.879 6.680 1.00 0.00 N ATOM 0 H HIS A 37 5.230 2.553 7.710 1.00 0.00 H new ATOM 0 HA HIS A 37 2.724 2.925 9.193 1.00 0.00 H new ATOM 0 HB2 HIS A 37 2.777 5.231 7.964 1.00 0.00 H new ATOM 0 HB3 HIS A 37 3.544 4.977 9.519 1.00 0.00 H new ATOM 0 HD2 HIS A 37 4.768 5.009 5.776 1.00 0.00 H new ATOM 0 HE1 HIS A 37 7.822 6.576 8.262 1.00 0.00 H new ATOM 0 HE2 HIS A 37 7.151 6.066 5.864 1.00 0.00 H new ATOM 587 N CYS A 38 3.246 2.893 5.955 1.00 0.00 N ATOM 588 CA CYS A 38 2.738 2.469 4.710 1.00 0.00 C ATOM 589 C CYS A 38 2.329 1.021 4.713 1.00 0.00 C ATOM 590 O CYS A 38 1.181 0.666 4.437 1.00 0.00 O ATOM 591 CB CYS A 38 3.833 2.680 3.676 1.00 0.00 C ATOM 592 SG CYS A 38 4.579 4.256 3.897 1.00 0.00 S ATOM 0 H CYS A 38 4.190 3.274 5.898 1.00 0.00 H new ATOM 0 HA CYS A 38 1.843 3.048 4.483 1.00 0.00 H new ATOM 0 HB2 CYS A 38 4.586 1.897 3.767 1.00 0.00 H new ATOM 0 HB3 CYS A 38 3.415 2.605 2.672 1.00 0.00 H new ATOM 0 HG CYS A 38 3.962 5.135 3.164 1.00 0.00 H new ATOM 598 N PHE A 39 3.268 0.210 5.028 1.00 0.00 N ATOM 599 CA PHE A 39 3.151 -1.147 4.883 1.00 0.00 C ATOM 600 C PHE A 39 3.012 -1.860 6.227 1.00 0.00 C ATOM 601 O PHE A 39 3.159 -1.263 7.279 1.00 0.00 O ATOM 602 CB PHE A 39 4.395 -1.487 4.171 1.00 0.00 C ATOM 603 CG PHE A 39 4.488 -1.008 2.820 1.00 0.00 C ATOM 604 CD1 PHE A 39 5.475 -0.176 2.520 1.00 0.00 C ATOM 605 CD2 PHE A 39 3.598 -1.373 1.853 1.00 0.00 C ATOM 606 CE1 PHE A 39 5.631 0.312 1.338 1.00 0.00 C ATOM 607 CE2 PHE A 39 3.735 -0.880 0.597 1.00 0.00 C ATOM 608 CZ PHE A 39 4.765 -0.020 0.331 1.00 0.00 C ATOM 0 H PHE A 39 4.166 0.510 5.407 1.00 0.00 H new ATOM 0 HA PHE A 39 2.255 -1.460 4.347 1.00 0.00 H new ATOM 0 HB2 PHE A 39 5.237 -1.089 4.737 1.00 0.00 H new ATOM 0 HB3 PHE A 39 4.502 -2.572 4.161 1.00 0.00 H new ATOM 0 HD1 PHE A 39 6.174 0.103 3.295 1.00 0.00 H new ATOM 0 HD2 PHE A 39 2.790 -2.050 2.086 1.00 0.00 H new ATOM 0 HE1 PHE A 39 6.450 0.987 1.140 1.00 0.00 H new ATOM 0 HE2 PHE A 39 3.041 -1.162 -0.181 1.00 0.00 H new ATOM 0 HZ PHE A 39 4.893 0.391 -0.659 1.00 0.00 H new ATOM 618 N SER A 40 2.699 -3.133 6.162 1.00 0.00 N ATOM 619 CA SER A 40 2.492 -3.953 7.330 1.00 0.00 C ATOM 620 C SER A 40 3.512 -5.019 7.492 1.00 0.00 C ATOM 621 O SER A 40 4.419 -4.853 8.282 1.00 0.00 O ATOM 622 CB SER A 40 1.151 -4.561 7.266 1.00 0.00 C ATOM 623 OG SER A 40 0.138 -3.591 7.352 1.00 0.00 O ATOM 0 H SER A 40 2.579 -3.635 5.282 1.00 0.00 H new ATOM 0 HA SER A 40 2.584 -3.298 8.197 1.00 0.00 H new ATOM 0 HB2 SER A 40 1.046 -5.115 6.333 1.00 0.00 H new ATOM 0 HB3 SER A 40 1.038 -5.279 8.078 1.00 0.00 H new ATOM 0 HG SER A 40 -0.729 -4.033 7.465 1.00 0.00 H new ATOM 629 N ALA A 41 3.221 -6.214 6.868 1.00 0.00 N ATOM 630 CA ALA A 41 4.069 -7.432 6.778 1.00 0.00 C ATOM 631 C ALA A 41 3.641 -8.257 7.917 1.00 0.00 C ATOM 632 O ALA A 41 3.687 -9.471 7.932 1.00 0.00 O ATOM 633 CB ALA A 41 5.451 -7.062 6.875 1.00 0.00 C ATOM 0 H ALA A 41 2.330 -6.346 6.389 1.00 0.00 H new ATOM 0 HA ALA A 41 3.962 -7.970 5.836 1.00 0.00 H new ATOM 0 HB1 ALA A 41 6.072 -7.955 6.809 1.00 0.00 H new ATOM 0 HB2 ALA A 41 5.704 -6.383 6.061 1.00 0.00 H new ATOM 0 HB3 ALA A 41 5.629 -6.566 7.829 1.00 0.00 H new ATOM 639 N GLU A 42 3.193 -7.492 8.865 1.00 0.00 N ATOM 640 CA GLU A 42 2.427 -7.857 9.956 1.00 0.00 C ATOM 641 C GLU A 42 1.145 -8.330 9.477 1.00 0.00 C ATOM 642 O GLU A 42 0.554 -9.319 9.905 1.00 0.00 O ATOM 643 CB GLU A 42 2.102 -6.596 10.589 1.00 0.00 C ATOM 644 CG GLU A 42 3.159 -5.913 11.392 1.00 0.00 C ATOM 645 CD GLU A 42 3.665 -6.764 12.530 1.00 0.00 C ATOM 646 OE1 GLU A 42 3.001 -7.769 12.876 1.00 0.00 O ATOM 647 OE2 GLU A 42 4.748 -6.498 13.044 1.00 0.00 O ATOM 0 H GLU A 42 3.393 -6.492 8.867 1.00 0.00 H new ATOM 0 HA GLU A 42 2.934 -8.594 10.579 1.00 0.00 H new ATOM 0 HB2 GLU A 42 1.779 -5.906 9.809 1.00 0.00 H new ATOM 0 HB3 GLU A 42 1.245 -6.763 11.241 1.00 0.00 H new ATOM 0 HG2 GLU A 42 3.993 -5.652 10.740 1.00 0.00 H new ATOM 0 HG3 GLU A 42 2.761 -4.980 11.790 1.00 0.00 H new ATOM 654 N GLY A 43 0.734 -7.570 8.573 1.00 0.00 N ATOM 655 CA GLY A 43 -0.489 -7.684 8.043 1.00 0.00 C ATOM 656 C GLY A 43 -0.417 -7.933 6.591 1.00 0.00 C ATOM 657 O GLY A 43 0.553 -7.513 5.938 1.00 0.00 O ATOM 0 H GLY A 43 1.291 -6.814 8.175 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -1.025 -8.499 8.529 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -1.057 -6.773 8.231 1.00 0.00 H new ATOM 661 N GLU A 44 -1.414 -8.628 6.126 1.00 0.00 N ATOM 662 CA GLU A 44 -1.696 -8.929 4.757 1.00 0.00 C ATOM 663 C GLU A 44 -1.542 -7.676 3.933 1.00 0.00 C ATOM 664 O GLU A 44 -0.759 -7.628 2.994 1.00 0.00 O ATOM 665 CB GLU A 44 -3.126 -9.338 4.759 1.00 0.00 C ATOM 666 CG GLU A 44 -3.638 -10.115 3.607 1.00 0.00 C ATOM 667 CD GLU A 44 -5.122 -10.317 3.795 1.00 0.00 C ATOM 668 OE1 GLU A 44 -5.891 -9.996 2.867 1.00 0.00 O ATOM 669 OE2 GLU A 44 -5.535 -10.657 4.945 1.00 0.00 O ATOM 0 H GLU A 44 -2.110 -9.033 6.752 1.00 0.00 H new ATOM 0 HA GLU A 44 -1.036 -9.693 4.346 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -3.302 -9.925 5.660 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -3.730 -8.434 4.845 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -3.442 -9.586 2.675 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -3.129 -11.077 3.541 1.00 0.00 H new ATOM 676 N ALA A 45 -2.273 -6.652 4.339 1.00 0.00 N ATOM 677 CA ALA A 45 -2.222 -5.379 3.733 1.00 0.00 C ATOM 678 C ALA A 45 -2.893 -4.378 4.619 1.00 0.00 C ATOM 679 O ALA A 45 -3.432 -4.735 5.691 1.00 0.00 O ATOM 680 CB ALA A 45 -2.837 -5.396 2.361 1.00 0.00 C ATOM 0 H ALA A 45 -2.927 -6.708 5.120 1.00 0.00 H new ATOM 0 HA ALA A 45 -1.178 -5.093 3.605 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -2.780 -4.399 1.924 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -2.296 -6.100 1.729 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -3.881 -5.701 2.434 1.00 0.00 H new ATOM 686 N ARG A 46 -2.875 -3.167 4.168 1.00 0.00 N ATOM 687 CA ARG A 46 -3.322 -2.012 4.866 1.00 0.00 C ATOM 688 C ARG A 46 -3.500 -0.995 3.735 1.00 0.00 C ATOM 689 O ARG A 46 -2.823 -1.168 2.712 1.00 0.00 O ATOM 690 CB ARG A 46 -2.161 -1.675 5.863 1.00 0.00 C ATOM 691 CG ARG A 46 -2.306 -0.493 6.807 1.00 0.00 C ATOM 692 CD ARG A 46 -1.945 0.807 6.141 1.00 0.00 C ATOM 693 NE ARG A 46 -1.896 1.917 7.098 1.00 0.00 N ATOM 694 CZ ARG A 46 -2.024 3.188 6.754 1.00 0.00 C ATOM 695 NH1 ARG A 46 -2.300 3.491 5.508 1.00 0.00 N ATOM 696 NH2 ARG A 46 -1.862 4.158 7.663 1.00 0.00 N ATOM 0 H ARG A 46 -2.522 -2.946 3.237 1.00 0.00 H new ATOM 0 HA ARG A 46 -4.242 -2.077 5.447 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -1.987 -2.561 6.473 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -1.260 -1.513 5.272 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -3.333 -0.442 7.169 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -1.668 -0.644 7.678 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -0.976 0.707 5.651 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -2.674 1.031 5.363 1.00 0.00 H new ATOM 0 HE ARG A 46 -1.755 1.697 8.084 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -2.414 2.750 4.816 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -2.401 4.467 5.231 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -1.638 3.919 8.629 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -1.962 5.135 7.389 1.00 0.00 H new ATOM 710 N PRO A 47 -4.455 -0.013 3.816 1.00 0.00 N ATOM 711 CA PRO A 47 -4.652 0.962 2.728 1.00 0.00 C ATOM 712 C PRO A 47 -3.337 1.656 2.374 1.00 0.00 C ATOM 713 O PRO A 47 -2.594 2.093 3.251 1.00 0.00 O ATOM 714 CB PRO A 47 -5.732 1.942 3.260 1.00 0.00 C ATOM 715 CG PRO A 47 -6.420 1.179 4.351 1.00 0.00 C ATOM 716 CD PRO A 47 -5.410 0.201 4.918 1.00 0.00 C ATOM 0 HA PRO A 47 -4.979 0.497 1.798 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -5.284 2.860 3.639 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -6.430 2.229 2.474 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -6.778 1.856 5.127 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -7.290 0.651 3.962 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -4.915 0.607 5.801 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -5.885 -0.732 5.220 1.00 0.00 H new ATOM 724 N LEU A 48 -3.048 1.670 1.110 1.00 0.00 N ATOM 725 CA LEU A 48 -1.824 2.154 0.546 1.00 0.00 C ATOM 726 C LEU A 48 -2.192 2.760 -0.811 1.00 0.00 C ATOM 727 O LEU A 48 -3.300 2.618 -1.204 1.00 0.00 O ATOM 728 CB LEU A 48 -0.938 0.907 0.364 1.00 0.00 C ATOM 729 CG LEU A 48 0.068 0.943 -0.696 1.00 0.00 C ATOM 730 CD1 LEU A 48 1.323 1.432 -0.230 1.00 0.00 C ATOM 731 CD2 LEU A 48 0.241 -0.333 -1.373 1.00 0.00 C ATOM 0 H LEU A 48 -3.697 1.324 0.403 1.00 0.00 H new ATOM 0 HA LEU A 48 -1.308 2.899 1.151 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -0.426 0.718 1.307 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -1.591 0.054 0.179 1.00 0.00 H new ATOM 0 HG LEU A 48 -0.323 1.645 -1.433 1.00 0.00 H new ATOM 0 HD11 LEU A 48 2.038 1.440 -1.052 1.00 0.00 H new ATOM 0 HD12 LEU A 48 1.199 2.445 0.154 1.00 0.00 H new ATOM 0 HD13 LEU A 48 1.693 0.785 0.566 1.00 0.00 H new ATOM 0 HD21 LEU A 48 1.002 -0.234 -2.147 1.00 0.00 H new ATOM 0 HD22 LEU A 48 0.553 -1.088 -0.652 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -0.702 -0.634 -1.828 1.00 0.00 H new ATOM 743 N LYS A 49 -1.297 3.467 -1.500 1.00 0.00 N ATOM 744 CA LYS A 49 -1.607 3.888 -2.804 1.00 0.00 C ATOM 745 C LYS A 49 -0.898 2.936 -3.718 1.00 0.00 C ATOM 746 O LYS A 49 -0.416 1.944 -3.300 1.00 0.00 O ATOM 747 CB LYS A 49 -1.143 5.309 -3.123 1.00 0.00 C ATOM 748 CG LYS A 49 -2.365 6.163 -3.576 1.00 0.00 C ATOM 749 CD LYS A 49 -3.105 5.519 -4.774 1.00 0.00 C ATOM 750 CE LYS A 49 -4.500 6.108 -5.017 1.00 0.00 C ATOM 751 NZ LYS A 49 -4.472 7.518 -5.414 1.00 0.00 N ATOM 0 H LYS A 49 -0.376 3.741 -1.158 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.690 3.894 -2.923 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -0.678 5.757 -2.245 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -0.388 5.289 -3.909 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -3.057 6.279 -2.742 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -2.028 7.162 -3.852 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -2.503 5.646 -5.674 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -3.197 4.447 -4.601 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -5.001 5.529 -5.793 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -5.094 6.005 -4.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -5.416 7.934 -5.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -3.785 8.031 -4.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -4.195 7.592 -6.414 1.00 0.00 H new ATOM 765 N ILE A 50 -0.852 3.204 -4.918 1.00 0.00 N ATOM 766 CA ILE A 50 -0.004 2.457 -5.791 1.00 0.00 C ATOM 767 C ILE A 50 1.086 3.270 -6.385 1.00 0.00 C ATOM 768 O ILE A 50 2.211 2.817 -6.551 1.00 0.00 O ATOM 769 CB ILE A 50 -0.764 1.586 -6.742 1.00 0.00 C ATOM 770 CG1 ILE A 50 -0.917 0.265 -5.995 1.00 0.00 C ATOM 771 CG2 ILE A 50 0.014 1.447 -8.016 1.00 0.00 C ATOM 772 CD1 ILE A 50 -1.834 -0.697 -6.589 1.00 0.00 C ATOM 0 H ILE A 50 -1.389 3.945 -5.368 1.00 0.00 H new ATOM 0 HA ILE A 50 0.533 1.741 -5.170 1.00 0.00 H new ATOM 0 HB ILE A 50 -1.737 1.982 -7.031 1.00 0.00 H new ATOM 0 HG12 ILE A 50 0.065 -0.200 -5.914 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -1.253 0.480 -4.981 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -0.537 0.813 -8.711 1.00 0.00 H new ATOM 0 HG22 ILE A 50 0.162 2.431 -8.461 1.00 0.00 H new ATOM 0 HG23 ILE A 50 0.983 0.996 -7.803 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -1.864 -1.597 -5.975 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -2.832 -0.262 -6.645 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.493 -0.953 -7.592 1.00 0.00 H new ATOM 784 N GLY A 51 0.794 4.492 -6.574 1.00 0.00 N ATOM 785 CA GLY A 51 1.780 5.409 -7.079 1.00 0.00 C ATOM 786 C GLY A 51 2.872 5.676 -6.062 1.00 0.00 C ATOM 787 O GLY A 51 3.896 6.187 -6.406 1.00 0.00 O ATOM 0 H GLY A 51 -0.122 4.903 -6.391 1.00 0.00 H new ATOM 0 HA2 GLY A 51 2.222 5.003 -7.989 1.00 0.00 H new ATOM 0 HA3 GLY A 51 1.298 6.348 -7.350 1.00 0.00 H new ATOM 791 N ILE A 52 2.647 5.257 -4.790 1.00 0.00 N ATOM 792 CA ILE A 52 3.637 5.207 -3.788 1.00 0.00 C ATOM 793 C ILE A 52 4.821 4.430 -4.267 1.00 0.00 C ATOM 794 O ILE A 52 5.893 4.707 -3.880 1.00 0.00 O ATOM 795 CB ILE A 52 3.129 4.421 -2.601 1.00 0.00 C ATOM 796 CG1 ILE A 52 4.291 4.079 -1.791 1.00 0.00 C ATOM 797 CG2 ILE A 52 2.428 3.138 -3.034 1.00 0.00 C ATOM 798 CD1 ILE A 52 4.008 3.092 -0.839 1.00 0.00 C ATOM 0 H ILE A 52 1.731 4.945 -4.467 1.00 0.00 H new ATOM 0 HA ILE A 52 3.890 6.237 -3.536 1.00 0.00 H new ATOM 0 HB ILE A 52 2.404 5.019 -2.049 1.00 0.00 H new ATOM 0 HG12 ILE A 52 5.094 3.733 -2.441 1.00 0.00 H new ATOM 0 HG13 ILE A 52 4.654 4.974 -1.285 1.00 0.00 H new ATOM 0 HG21 ILE A 52 2.077 2.600 -2.153 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.579 3.385 -3.671 1.00 0.00 H new ATOM 0 HG23 ILE A 52 3.127 2.511 -3.587 1.00 0.00 H new ATOM 0 HD11 ILE A 52 4.907 2.874 -0.263 1.00 0.00 H new ATOM 0 HD12 ILE A 52 3.224 3.446 -0.169 1.00 0.00 H new ATOM 0 HD13 ILE A 52 3.672 2.186 -1.343 1.00 0.00 H new ATOM 810 N PHE A 53 4.593 3.417 -5.059 1.00 0.00 N ATOM 811 CA PHE A 53 5.594 2.539 -5.469 1.00 0.00 C ATOM 812 C PHE A 53 6.807 3.298 -5.921 1.00 0.00 C ATOM 813 O PHE A 53 7.830 3.051 -5.560 1.00 0.00 O ATOM 814 CB PHE A 53 5.057 1.789 -6.575 1.00 0.00 C ATOM 815 CG PHE A 53 6.116 1.183 -7.325 1.00 0.00 C ATOM 816 CD1 PHE A 53 6.694 0.202 -6.779 1.00 0.00 C ATOM 817 CD2 PHE A 53 6.514 1.611 -8.583 1.00 0.00 C ATOM 818 CE1 PHE A 53 7.654 -0.421 -7.342 1.00 0.00 C ATOM 819 CE2 PHE A 53 7.563 0.964 -9.199 1.00 0.00 C ATOM 820 CZ PHE A 53 8.132 -0.077 -8.541 1.00 0.00 C ATOM 0 H PHE A 53 3.671 3.195 -5.434 1.00 0.00 H new ATOM 0 HA PHE A 53 5.894 1.887 -4.648 1.00 0.00 H new ATOM 0 HB2 PHE A 53 4.377 1.021 -6.206 1.00 0.00 H new ATOM 0 HB3 PHE A 53 4.475 2.446 -7.221 1.00 0.00 H new ATOM 0 HD1 PHE A 53 6.364 -0.120 -5.802 1.00 0.00 H new ATOM 0 HD2 PHE A 53 6.012 2.434 -9.070 1.00 0.00 H new ATOM 0 HE1 PHE A 53 8.098 -1.261 -6.829 1.00 0.00 H new ATOM 0 HE2 PHE A 53 7.919 1.274 -10.170 1.00 0.00 H new ATOM 0 HZ PHE A 53 8.957 -0.618 -8.979 1.00 0.00 H new ATOM 830 N GLN A 54 6.568 4.248 -6.632 1.00 0.00 N ATOM 831 CA GLN A 54 7.512 5.201 -7.137 1.00 0.00 C ATOM 832 C GLN A 54 8.389 5.904 -6.025 1.00 0.00 C ATOM 833 O GLN A 54 9.380 6.570 -6.265 1.00 0.00 O ATOM 834 CB GLN A 54 6.577 6.104 -7.813 1.00 0.00 C ATOM 835 CG GLN A 54 6.902 7.544 -7.834 1.00 0.00 C ATOM 836 CD GLN A 54 6.646 8.252 -6.621 1.00 0.00 C ATOM 837 OE1 GLN A 54 6.548 9.467 -6.623 1.00 0.00 O ATOM 838 NE2 GLN A 54 6.248 7.506 -5.607 1.00 0.00 N ATOM 0 H GLN A 54 5.618 4.451 -6.942 1.00 0.00 H new ATOM 0 HA GLN A 54 8.297 4.782 -7.766 1.00 0.00 H new ATOM 0 HB2 GLN A 54 6.475 5.769 -8.845 1.00 0.00 H new ATOM 0 HB3 GLN A 54 5.601 5.988 -7.343 1.00 0.00 H new ATOM 0 HG2 GLN A 54 7.957 7.656 -8.084 1.00 0.00 H new ATOM 0 HG3 GLN A 54 6.333 8.015 -8.636 1.00 0.00 H new ATOM 0 HE21 GLN A 54 6.350 6.492 -5.649 1.00 0.00 H new ATOM 0 HE22 GLN A 54 5.839 7.944 -4.782 1.00 0.00 H new ATOM 847 N ASP A 55 7.920 5.777 -4.914 1.00 0.00 N ATOM 848 CA ASP A 55 8.379 6.521 -3.731 1.00 0.00 C ATOM 849 C ASP A 55 9.123 5.655 -2.954 1.00 0.00 C ATOM 850 O ASP A 55 10.015 6.018 -2.263 1.00 0.00 O ATOM 851 CB ASP A 55 7.220 7.026 -2.902 1.00 0.00 C ATOM 852 CG ASP A 55 7.520 8.069 -1.824 1.00 0.00 C ATOM 853 OD1 ASP A 55 8.146 9.097 -2.126 1.00 0.00 O ATOM 854 OD2 ASP A 55 7.105 7.850 -0.655 1.00 0.00 O ATOM 0 H ASP A 55 7.156 5.132 -4.711 1.00 0.00 H new ATOM 0 HA ASP A 55 8.961 7.382 -4.061 1.00 0.00 H new ATOM 0 HB2 ASP A 55 6.480 7.449 -3.582 1.00 0.00 H new ATOM 0 HB3 ASP A 55 6.754 6.168 -2.418 1.00 0.00 H new ATOM 859 N LEU A 56 8.654 4.491 -2.984 1.00 0.00 N ATOM 860 CA LEU A 56 9.316 3.422 -2.513 1.00 0.00 C ATOM 861 C LEU A 56 10.510 3.414 -3.180 1.00 0.00 C ATOM 862 O LEU A 56 11.472 3.584 -2.618 1.00 0.00 O ATOM 863 CB LEU A 56 8.517 2.388 -3.010 1.00 0.00 C ATOM 864 CG LEU A 56 7.974 1.313 -2.331 1.00 0.00 C ATOM 865 CD1 LEU A 56 7.638 1.656 -1.032 1.00 0.00 C ATOM 866 CD2 LEU A 56 6.743 1.190 -2.876 1.00 0.00 C ATOM 0 H LEU A 56 7.736 4.269 -3.368 1.00 0.00 H new ATOM 0 HA LEU A 56 9.489 3.376 -1.438 1.00 0.00 H new ATOM 0 HB2 LEU A 56 7.665 2.888 -3.471 1.00 0.00 H new ATOM 0 HB3 LEU A 56 9.101 1.945 -3.816 1.00 0.00 H new ATOM 0 HG LEU A 56 8.662 0.468 -2.371 1.00 0.00 H new ATOM 0 HD11 LEU A 56 7.214 0.789 -0.525 1.00 0.00 H new ATOM 0 HD12 LEU A 56 8.530 1.986 -0.501 1.00 0.00 H new ATOM 0 HD13 LEU A 56 6.905 2.463 -1.047 1.00 0.00 H new ATOM 0 HD21 LEU A 56 6.219 0.358 -2.406 1.00 0.00 H new ATOM 0 HD22 LEU A 56 6.181 2.110 -2.716 1.00 0.00 H new ATOM 0 HD23 LEU A 56 6.836 1.003 -3.946 1.00 0.00 H new ATOM 878 N VAL A 57 10.398 3.306 -4.427 1.00 0.00 N ATOM 879 CA VAL A 57 11.502 3.059 -5.301 1.00 0.00 C ATOM 880 C VAL A 57 12.588 4.082 -5.217 1.00 0.00 C ATOM 881 O VAL A 57 13.724 3.804 -5.594 1.00 0.00 O ATOM 882 CB VAL A 57 11.056 2.878 -6.679 1.00 0.00 C ATOM 883 CG1 VAL A 57 10.043 1.877 -6.638 1.00 0.00 C ATOM 884 CG2 VAL A 57 10.523 4.129 -7.215 1.00 0.00 C ATOM 0 H VAL A 57 9.505 3.387 -4.913 1.00 0.00 H new ATOM 0 HA VAL A 57 11.948 2.128 -4.950 1.00 0.00 H new ATOM 0 HB VAL A 57 11.880 2.581 -7.328 1.00 0.00 H new ATOM 0 HG11 VAL A 57 9.668 1.697 -7.646 1.00 0.00 H new ATOM 0 HG12 VAL A 57 10.460 0.954 -6.236 1.00 0.00 H new ATOM 0 HG13 VAL A 57 9.225 2.213 -6.001 1.00 0.00 H new ATOM 0 HG21 VAL A 57 10.196 3.974 -8.243 1.00 0.00 H new ATOM 0 HG22 VAL A 57 9.676 4.453 -6.610 1.00 0.00 H new ATOM 0 HG23 VAL A 57 11.299 4.894 -7.193 1.00 0.00 H new ATOM 894 N ASP A 58 12.200 5.269 -4.768 1.00 0.00 N ATOM 895 CA ASP A 58 13.136 6.324 -4.403 1.00 0.00 C ATOM 896 C ASP A 58 14.197 5.731 -3.469 1.00 0.00 C ATOM 897 O ASP A 58 15.404 5.892 -3.605 1.00 0.00 O ATOM 898 CB ASP A 58 12.388 7.222 -3.531 1.00 0.00 C ATOM 899 CG ASP A 58 13.002 8.556 -3.224 1.00 0.00 C ATOM 900 OD1 ASP A 58 13.304 9.316 -4.152 1.00 0.00 O ATOM 901 OD2 ASP A 58 13.110 8.862 -2.010 1.00 0.00 O ATOM 0 H ASP A 58 11.221 5.528 -4.646 1.00 0.00 H new ATOM 0 HA ASP A 58 13.567 6.784 -5.292 1.00 0.00 H new ATOM 0 HB2 ASP A 58 11.412 7.397 -3.984 1.00 0.00 H new ATOM 0 HB3 ASP A 58 12.213 6.706 -2.587 1.00 0.00 H new ATOM 906 N ARG A 59 13.631 4.986 -2.553 1.00 0.00 N ATOM 907 CA ARG A 59 14.203 4.367 -1.460 1.00 0.00 C ATOM 908 C ARG A 59 14.487 2.888 -1.695 1.00 0.00 C ATOM 909 O ARG A 59 15.621 2.469 -1.861 1.00 0.00 O ATOM 910 CB ARG A 59 13.214 4.468 -0.309 1.00 0.00 C ATOM 911 CG ARG A 59 13.029 5.802 0.424 1.00 0.00 C ATOM 912 CD ARG A 59 11.671 6.370 0.070 1.00 0.00 C ATOM 913 NE ARG A 59 11.204 7.507 0.881 1.00 0.00 N ATOM 914 CZ ARG A 59 10.343 8.395 0.350 1.00 0.00 C ATOM 915 NH1 ARG A 59 10.524 8.794 -0.896 1.00 0.00 N ATOM 916 NH2 ARG A 59 9.439 9.022 1.111 1.00 0.00 N ATOM 0 H ARG A 59 12.629 4.797 -2.594 1.00 0.00 H new ATOM 0 HA ARG A 59 15.153 4.860 -1.255 1.00 0.00 H new ATOM 0 HB2 ARG A 59 12.238 4.170 -0.692 1.00 0.00 H new ATOM 0 HB3 ARG A 59 13.505 3.726 0.435 1.00 0.00 H new ATOM 0 HG2 ARG A 59 13.107 5.655 1.501 1.00 0.00 H new ATOM 0 HG3 ARG A 59 13.816 6.501 0.140 1.00 0.00 H new ATOM 0 HD2 ARG A 59 11.693 6.682 -0.974 1.00 0.00 H new ATOM 0 HD3 ARG A 59 10.935 5.570 0.148 1.00 0.00 H new ATOM 0 HE ARG A 59 11.531 7.621 1.840 1.00 0.00 H new ATOM 0 HH11 ARG A 59 11.306 8.430 -1.440 1.00 0.00 H new ATOM 0 HH12 ARG A 59 9.881 9.466 -1.315 1.00 0.00 H new ATOM 0 HH21 ARG A 59 9.394 8.830 2.112 1.00 0.00 H new ATOM 0 HH22 ARG A 59 8.795 9.692 0.690 1.00 0.00 H new ATOM 930 N VAL A 60 13.404 2.131 -1.813 1.00 0.00 N ATOM 931 CA VAL A 60 13.393 0.696 -1.677 1.00 0.00 C ATOM 932 C VAL A 60 14.186 -0.147 -2.707 1.00 0.00 C ATOM 933 O VAL A 60 14.747 -1.205 -2.429 1.00 0.00 O ATOM 934 CB VAL A 60 11.955 0.315 -1.881 1.00 0.00 C ATOM 935 CG1 VAL A 60 11.067 0.965 -1.030 1.00 0.00 C ATOM 936 CG2 VAL A 60 11.506 0.643 -3.164 1.00 0.00 C ATOM 0 H VAL A 60 12.483 2.520 -2.013 1.00 0.00 H new ATOM 0 HA VAL A 60 13.863 0.484 -0.717 1.00 0.00 H new ATOM 0 HB VAL A 60 11.957 -0.758 -1.690 1.00 0.00 H new ATOM 0 HG11 VAL A 60 10.051 0.634 -1.243 1.00 0.00 H new ATOM 0 HG12 VAL A 60 11.316 0.730 0.005 1.00 0.00 H new ATOM 0 HG13 VAL A 60 11.137 2.042 -1.184 1.00 0.00 H new ATOM 0 HG21 VAL A 60 10.461 0.351 -3.270 1.00 0.00 H new ATOM 0 HG22 VAL A 60 11.599 1.718 -3.318 1.00 0.00 H new ATOM 0 HG23 VAL A 60 12.107 0.116 -3.905 1.00 0.00 H new ATOM 946 N ALA A 61 14.113 0.339 -3.840 1.00 0.00 N ATOM 947 CA ALA A 61 14.206 -0.330 -5.061 1.00 0.00 C ATOM 948 C ALA A 61 15.327 -1.172 -5.435 1.00 0.00 C ATOM 949 O ALA A 61 15.281 -1.764 -6.500 1.00 0.00 O ATOM 950 CB ALA A 61 13.921 0.556 -6.013 1.00 0.00 C ATOM 0 H ALA A 61 13.969 1.340 -3.971 1.00 0.00 H new ATOM 0 HA ALA A 61 13.496 -1.145 -4.920 1.00 0.00 H new ATOM 0 HB1 ALA A 61 13.982 0.074 -6.989 1.00 0.00 H new ATOM 0 HB2 ALA A 61 12.913 0.942 -5.861 1.00 0.00 H new ATOM 0 HB3 ALA A 61 14.635 1.379 -5.970 1.00 0.00 H new ATOM 956 N GLY A 62 16.285 -1.154 -4.736 1.00 0.00 N ATOM 957 CA GLY A 62 17.217 -2.156 -4.836 1.00 0.00 C ATOM 958 C GLY A 62 18.095 -2.208 -3.672 1.00 0.00 C ATOM 959 O GLY A 62 19.270 -2.496 -3.774 1.00 0.00 O ATOM 0 H GLY A 62 16.488 -0.436 -4.041 1.00 0.00 H new ATOM 0 HA2 GLY A 62 16.708 -3.113 -4.949 1.00 0.00 H new ATOM 0 HA3 GLY A 62 17.816 -2.005 -5.734 1.00 0.00 H new ATOM 963 N GLU A 63 17.505 -1.879 -2.591 1.00 0.00 N ATOM 964 CA GLU A 63 18.125 -1.897 -1.283 1.00 0.00 C ATOM 965 C GLU A 63 18.726 -3.238 -0.983 1.00 0.00 C ATOM 966 O GLU A 63 19.900 -3.359 -0.649 1.00 0.00 O ATOM 967 CB GLU A 63 17.102 -1.575 -0.227 1.00 0.00 C ATOM 968 CG GLU A 63 16.774 -0.105 -0.100 1.00 0.00 C ATOM 969 CD GLU A 63 16.063 0.245 1.190 1.00 0.00 C ATOM 970 OE1 GLU A 63 14.829 0.318 1.212 1.00 0.00 O ATOM 971 OE2 GLU A 63 16.754 0.424 2.217 1.00 0.00 O ATOM 0 H GLU A 63 16.532 -1.573 -2.568 1.00 0.00 H new ATOM 0 HA GLU A 63 18.918 -1.149 -1.281 1.00 0.00 H new ATOM 0 HB2 GLU A 63 16.185 -2.121 -0.449 1.00 0.00 H new ATOM 0 HB3 GLU A 63 17.464 -1.938 0.735 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.696 0.472 -0.166 1.00 0.00 H new ATOM 0 HG3 GLU A 63 16.150 0.194 -0.942 1.00 0.00 H new ATOM 978 N MET A 64 17.906 -4.242 -1.061 1.00 0.00 N ATOM 979 CA MET A 64 18.368 -5.540 -0.859 1.00 0.00 C ATOM 980 C MET A 64 18.143 -6.334 -2.051 1.00 0.00 C ATOM 981 O MET A 64 19.040 -6.860 -2.681 1.00 0.00 O ATOM 982 CB MET A 64 17.738 -6.279 0.308 1.00 0.00 C ATOM 983 CG MET A 64 17.522 -5.563 1.612 1.00 0.00 C ATOM 984 SD MET A 64 16.298 -4.272 1.494 1.00 0.00 S ATOM 985 CE MET A 64 14.957 -5.128 0.668 1.00 0.00 C ATOM 0 H MET A 64 16.910 -4.164 -1.266 1.00 0.00 H new ATOM 0 HA MET A 64 19.426 -5.420 -0.626 1.00 0.00 H new ATOM 0 HB2 MET A 64 16.768 -6.648 -0.025 1.00 0.00 H new ATOM 0 HB3 MET A 64 18.358 -7.152 0.514 1.00 0.00 H new ATOM 0 HG2 MET A 64 17.213 -6.283 2.370 1.00 0.00 H new ATOM 0 HG3 MET A 64 18.466 -5.133 1.947 1.00 0.00 H new ATOM 0 HE1 MET A 64 14.409 -4.426 0.040 1.00 0.00 H new ATOM 0 HE2 MET A 64 15.363 -5.928 0.049 1.00 0.00 H new ATOM 0 HE3 MET A 64 14.282 -5.551 1.412 1.00 0.00 H new ATOM 995 N ASN A 65 16.917 -6.457 -2.310 1.00 0.00 N ATOM 996 CA ASN A 65 16.436 -7.310 -3.228 1.00 0.00 C ATOM 997 C ASN A 65 15.360 -6.747 -4.122 1.00 0.00 C ATOM 998 O ASN A 65 14.360 -7.418 -4.312 1.00 0.00 O ATOM 999 CB ASN A 65 15.793 -8.417 -2.491 1.00 0.00 C ATOM 1000 CG ASN A 65 16.396 -8.900 -1.282 1.00 0.00 C ATOM 1001 OD1 ASN A 65 15.955 -8.607 -0.185 1.00 0.00 O ATOM 1002 ND2 ASN A 65 17.371 -9.575 -1.409 1.00 0.00 N ATOM 0 H ASN A 65 16.193 -5.915 -1.839 1.00 0.00 H new ATOM 0 HA ASN A 65 17.281 -7.587 -3.859 1.00 0.00 H new ATOM 0 HB2 ASN A 65 14.778 -8.103 -2.248 1.00 0.00 H new ATOM 0 HB3 ASN A 65 15.710 -9.261 -3.175 1.00 0.00 H new ATOM 0 HD21 ASN A 65 17.860 -9.924 -0.585 1.00 0.00 H new ATOM 0 HD22 ASN A 65 17.715 -9.803 -2.342 1.00 0.00 H new ATOM 1009 N LEU A 66 15.512 -5.596 -4.664 1.00 0.00 N ATOM 1010 CA LEU A 66 14.506 -5.072 -5.541 1.00 0.00 C ATOM 1011 C LEU A 66 15.107 -4.614 -6.825 1.00 0.00 C ATOM 1012 O LEU A 66 16.292 -4.342 -6.932 1.00 0.00 O ATOM 1013 CB LEU A 66 13.825 -3.940 -4.817 1.00 0.00 C ATOM 1014 CG LEU A 66 12.894 -4.190 -3.696 1.00 0.00 C ATOM 1015 CD1 LEU A 66 12.199 -2.933 -3.324 1.00 0.00 C ATOM 1016 CD2 LEU A 66 11.986 -5.254 -4.058 1.00 0.00 C ATOM 0 H LEU A 66 16.320 -4.990 -4.522 1.00 0.00 H new ATOM 0 HA LEU A 66 13.780 -5.843 -5.797 1.00 0.00 H new ATOM 0 HB2 LEU A 66 14.612 -3.288 -4.436 1.00 0.00 H new ATOM 0 HB3 LEU A 66 13.274 -3.371 -5.566 1.00 0.00 H new ATOM 0 HG LEU A 66 13.440 -4.517 -2.811 1.00 0.00 H new ATOM 0 HD11 LEU A 66 11.515 -3.126 -2.498 1.00 0.00 H new ATOM 0 HD12 LEU A 66 12.934 -2.187 -3.020 1.00 0.00 H new ATOM 0 HD13 LEU A 66 11.637 -2.561 -4.181 1.00 0.00 H new ATOM 0 HD21 LEU A 66 11.298 -5.441 -3.234 1.00 0.00 H new ATOM 0 HD22 LEU A 66 11.421 -4.964 -4.944 1.00 0.00 H new ATOM 0 HD23 LEU A 66 12.553 -6.160 -4.270 1.00 0.00 H new ATOM 1028 N SER A 67 14.259 -4.587 -7.778 1.00 0.00 N ATOM 1029 CA SER A 67 14.524 -4.177 -9.095 1.00 0.00 C ATOM 1030 C SER A 67 13.308 -3.318 -9.574 1.00 0.00 C ATOM 1031 O SER A 67 12.995 -3.239 -10.750 1.00 0.00 O ATOM 1032 CB SER A 67 14.644 -5.472 -9.871 1.00 0.00 C ATOM 1033 OG SER A 67 15.019 -5.279 -11.221 1.00 0.00 O ATOM 0 H SER A 67 13.289 -4.873 -7.645 1.00 0.00 H new ATOM 0 HA SER A 67 15.422 -3.572 -9.216 1.00 0.00 H new ATOM 0 HB2 SER A 67 15.379 -6.113 -9.384 1.00 0.00 H new ATOM 0 HB3 SER A 67 13.690 -5.998 -9.837 1.00 0.00 H new ATOM 0 HG SER A 67 14.516 -4.526 -11.596 1.00 0.00 H new ATOM 1039 N LYS A 68 12.705 -2.575 -8.606 1.00 0.00 N ATOM 1040 CA LYS A 68 11.451 -1.763 -8.740 1.00 0.00 C ATOM 1041 C LYS A 68 10.269 -2.567 -9.196 1.00 0.00 C ATOM 1042 O LYS A 68 9.300 -2.607 -8.552 1.00 0.00 O ATOM 1043 CB LYS A 68 11.507 -0.448 -9.605 1.00 0.00 C ATOM 1044 CG LYS A 68 12.820 0.022 -10.166 1.00 0.00 C ATOM 1045 CD LYS A 68 13.730 0.140 -9.044 1.00 0.00 C ATOM 1046 CE LYS A 68 15.114 -0.456 -9.320 1.00 0.00 C ATOM 1047 NZ LYS A 68 15.778 0.167 -10.496 1.00 0.00 N ATOM 0 H LYS A 68 13.094 -2.520 -7.665 1.00 0.00 H new ATOM 0 HA LYS A 68 11.338 -1.435 -7.707 1.00 0.00 H new ATOM 0 HB2 LYS A 68 10.824 -0.581 -10.444 1.00 0.00 H new ATOM 0 HB3 LYS A 68 11.107 0.361 -8.994 1.00 0.00 H new ATOM 0 HG2 LYS A 68 13.202 -0.685 -10.902 1.00 0.00 H new ATOM 0 HG3 LYS A 68 12.704 0.980 -10.674 1.00 0.00 H new ATOM 0 HD2 LYS A 68 13.841 1.193 -8.784 1.00 0.00 H new ATOM 0 HD3 LYS A 68 13.294 -0.358 -8.178 1.00 0.00 H new ATOM 0 HE2 LYS A 68 15.744 -0.326 -8.440 1.00 0.00 H new ATOM 0 HE3 LYS A 68 15.017 -1.529 -9.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 16.731 -0.235 -10.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 15.218 -0.022 -11.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 15.851 1.194 -10.350 1.00 0.00 H new ATOM 1061 N THR A 69 10.369 -3.279 -10.238 1.00 0.00 N ATOM 1062 CA THR A 69 9.236 -3.832 -10.827 1.00 0.00 C ATOM 1063 C THR A 69 8.784 -5.059 -10.117 1.00 0.00 C ATOM 1064 O THR A 69 7.622 -5.436 -10.166 1.00 0.00 O ATOM 1065 CB THR A 69 9.519 -4.140 -12.223 1.00 0.00 C ATOM 1066 OG1 THR A 69 10.523 -5.169 -12.276 1.00 0.00 O ATOM 1067 CG2 THR A 69 10.033 -2.932 -12.918 1.00 0.00 C ATOM 0 H THR A 69 11.248 -3.495 -10.709 1.00 0.00 H new ATOM 0 HA THR A 69 8.430 -3.101 -10.761 1.00 0.00 H new ATOM 0 HB THR A 69 8.603 -4.473 -12.711 1.00 0.00 H new ATOM 0 HG1 THR A 69 10.720 -5.386 -13.211 1.00 0.00 H new ATOM 0 HG21 THR A 69 10.241 -3.173 -13.960 1.00 0.00 H new ATOM 0 HG22 THR A 69 9.286 -2.140 -12.871 1.00 0.00 H new ATOM 0 HG23 THR A 69 10.949 -2.596 -12.433 1.00 0.00 H new ATOM 1075 N GLN A 70 9.682 -5.639 -9.420 1.00 0.00 N ATOM 1076 CA GLN A 70 9.351 -6.759 -8.611 1.00 0.00 C ATOM 1077 C GLN A 70 8.626 -6.227 -7.362 1.00 0.00 C ATOM 1078 O GLN A 70 7.806 -6.867 -6.749 1.00 0.00 O ATOM 1079 CB GLN A 70 10.602 -7.499 -8.267 1.00 0.00 C ATOM 1080 CG GLN A 70 11.546 -6.665 -7.629 1.00 0.00 C ATOM 1081 CD GLN A 70 12.555 -7.405 -6.985 1.00 0.00 C ATOM 1082 OE1 GLN A 70 13.595 -7.697 -7.522 1.00 0.00 O ATOM 1083 NE2 GLN A 70 12.239 -7.751 -5.827 1.00 0.00 N ATOM 0 H GLN A 70 10.662 -5.359 -9.389 1.00 0.00 H new ATOM 0 HA GLN A 70 8.694 -7.458 -9.128 1.00 0.00 H new ATOM 0 HB2 GLN A 70 10.360 -8.339 -7.616 1.00 0.00 H new ATOM 0 HB3 GLN A 70 11.039 -7.915 -9.175 1.00 0.00 H new ATOM 0 HG2 GLN A 70 11.998 -6.000 -8.365 1.00 0.00 H new ATOM 0 HG3 GLN A 70 11.038 -6.034 -6.900 1.00 0.00 H new ATOM 0 HE21 GLN A 70 11.341 -7.466 -5.437 1.00 0.00 H new ATOM 0 HE22 GLN A 70 12.879 -8.318 -5.271 1.00 0.00 H new ATOM 1092 N LEU A 71 8.899 -4.990 -7.093 1.00 0.00 N ATOM 1093 CA LEU A 71 8.360 -4.265 -6.000 1.00 0.00 C ATOM 1094 C LEU A 71 6.999 -3.731 -6.398 1.00 0.00 C ATOM 1095 O LEU A 71 6.092 -3.778 -5.634 1.00 0.00 O ATOM 1096 CB LEU A 71 9.332 -3.122 -5.713 1.00 0.00 C ATOM 1097 CG LEU A 71 9.264 -2.342 -4.466 1.00 0.00 C ATOM 1098 CD1 LEU A 71 9.373 -0.897 -4.699 1.00 0.00 C ATOM 1099 CD2 LEU A 71 8.152 -2.667 -3.652 1.00 0.00 C ATOM 0 H LEU A 71 9.538 -4.435 -7.663 1.00 0.00 H new ATOM 0 HA LEU A 71 8.236 -4.884 -5.112 1.00 0.00 H new ATOM 0 HB2 LEU A 71 10.337 -3.541 -5.769 1.00 0.00 H new ATOM 0 HB3 LEU A 71 9.236 -2.412 -6.535 1.00 0.00 H new ATOM 0 HG LEU A 71 10.144 -2.640 -3.896 1.00 0.00 H new ATOM 0 HD11 LEU A 71 9.317 -0.370 -3.747 1.00 0.00 H new ATOM 0 HD12 LEU A 71 10.326 -0.677 -5.180 1.00 0.00 H new ATOM 0 HD13 LEU A 71 8.557 -0.570 -5.343 1.00 0.00 H new ATOM 0 HD21 LEU A 71 8.168 -2.053 -2.752 1.00 0.00 H new ATOM 0 HD22 LEU A 71 7.230 -2.479 -4.203 1.00 0.00 H new ATOM 0 HD23 LEU A 71 8.200 -3.720 -3.374 1.00 0.00 H new ATOM 1111 N ARG A 72 6.846 -3.286 -7.626 1.00 0.00 N ATOM 1112 CA ARG A 72 5.557 -2.708 -8.051 1.00 0.00 C ATOM 1113 C ARG A 72 4.518 -3.801 -8.114 1.00 0.00 C ATOM 1114 O ARG A 72 3.340 -3.576 -8.218 1.00 0.00 O ATOM 1115 CB ARG A 72 5.723 -2.006 -9.421 1.00 0.00 C ATOM 1116 CG ARG A 72 6.120 -2.916 -10.506 1.00 0.00 C ATOM 1117 CD ARG A 72 4.949 -3.628 -11.129 1.00 0.00 C ATOM 1118 NE ARG A 72 4.106 -2.719 -11.932 1.00 0.00 N ATOM 1119 CZ ARG A 72 3.511 -3.038 -13.099 1.00 0.00 C ATOM 1120 NH1 ARG A 72 3.628 -4.278 -13.602 1.00 0.00 N ATOM 1121 NH2 ARG A 72 2.796 -2.115 -13.758 1.00 0.00 N ATOM 0 H ARG A 72 7.570 -3.305 -8.345 1.00 0.00 H new ATOM 0 HA ARG A 72 5.227 -1.960 -7.330 1.00 0.00 H new ATOM 0 HB2 ARG A 72 4.783 -1.524 -9.689 1.00 0.00 H new ATOM 0 HB3 ARG A 72 6.470 -1.218 -9.328 1.00 0.00 H new ATOM 0 HG2 ARG A 72 6.646 -2.350 -11.275 1.00 0.00 H new ATOM 0 HG3 ARG A 72 6.822 -3.653 -10.117 1.00 0.00 H new ATOM 0 HD2 ARG A 72 5.313 -4.437 -11.762 1.00 0.00 H new ATOM 0 HD3 ARG A 72 4.344 -4.084 -10.345 1.00 0.00 H new ATOM 0 HE ARG A 72 3.963 -1.774 -11.575 1.00 0.00 H new ATOM 0 HH11 ARG A 72 4.169 -4.983 -13.101 1.00 0.00 H new ATOM 0 HH12 ARG A 72 3.176 -4.515 -14.485 1.00 0.00 H new ATOM 0 HH21 ARG A 72 2.703 -1.174 -13.376 1.00 0.00 H new ATOM 0 HH22 ARG A 72 2.345 -2.354 -14.641 1.00 0.00 H new ATOM 1135 N SER A 73 5.030 -4.966 -8.114 1.00 0.00 N ATOM 1136 CA SER A 73 4.338 -6.157 -8.221 1.00 0.00 C ATOM 1137 C SER A 73 3.985 -6.676 -6.870 1.00 0.00 C ATOM 1138 O SER A 73 3.056 -7.447 -6.672 1.00 0.00 O ATOM 1139 CB SER A 73 5.223 -6.997 -8.984 1.00 0.00 C ATOM 1140 OG SER A 73 4.822 -8.334 -9.119 1.00 0.00 O ATOM 0 H SER A 73 6.037 -5.109 -8.031 1.00 0.00 H new ATOM 0 HA SER A 73 3.372 -6.080 -8.720 1.00 0.00 H new ATOM 0 HB2 SER A 73 5.334 -6.567 -9.980 1.00 0.00 H new ATOM 0 HB3 SER A 73 6.207 -6.977 -8.516 1.00 0.00 H new ATOM 0 HG SER A 73 5.484 -8.822 -9.652 1.00 0.00 H new ATOM 1146 N ALA A 74 4.661 -6.143 -5.947 1.00 0.00 N ATOM 1147 CA ALA A 74 4.381 -6.388 -4.542 1.00 0.00 C ATOM 1148 C ALA A 74 3.251 -5.494 -4.181 1.00 0.00 C ATOM 1149 O ALA A 74 2.332 -5.822 -3.430 1.00 0.00 O ATOM 1150 CB ALA A 74 5.608 -6.105 -3.717 1.00 0.00 C ATOM 0 H ALA A 74 5.443 -5.510 -6.112 1.00 0.00 H new ATOM 0 HA ALA A 74 4.113 -7.427 -4.352 1.00 0.00 H new ATOM 0 HB1 ALA A 74 5.390 -6.291 -2.665 1.00 0.00 H new ATOM 0 HB2 ALA A 74 6.421 -6.755 -4.040 1.00 0.00 H new ATOM 0 HB3 ALA A 74 5.902 -5.064 -3.848 1.00 0.00 H new ATOM 1156 N LEU A 75 3.228 -4.496 -4.932 1.00 0.00 N ATOM 1157 CA LEU A 75 2.416 -3.389 -4.836 1.00 0.00 C ATOM 1158 C LEU A 75 1.309 -3.529 -5.901 1.00 0.00 C ATOM 1159 O LEU A 75 0.796 -2.587 -6.481 1.00 0.00 O ATOM 1160 CB LEU A 75 3.411 -2.354 -5.065 1.00 0.00 C ATOM 1161 CG LEU A 75 3.843 -1.523 -3.914 1.00 0.00 C ATOM 1162 CD1 LEU A 75 5.181 -1.139 -4.162 1.00 0.00 C ATOM 1163 CD2 LEU A 75 3.081 -0.252 -3.765 1.00 0.00 C ATOM 0 H LEU A 75 3.859 -4.428 -5.730 1.00 0.00 H new ATOM 0 HA LEU A 75 1.859 -3.206 -3.917 1.00 0.00 H new ATOM 0 HB2 LEU A 75 4.298 -2.832 -5.480 1.00 0.00 H new ATOM 0 HB3 LEU A 75 3.022 -1.683 -5.831 1.00 0.00 H new ATOM 0 HG LEU A 75 3.691 -2.120 -3.015 1.00 0.00 H new ATOM 0 HD11 LEU A 75 5.542 -0.524 -3.338 1.00 0.00 H new ATOM 0 HD12 LEU A 75 5.804 -2.029 -4.250 1.00 0.00 H new ATOM 0 HD13 LEU A 75 5.230 -0.568 -5.089 1.00 0.00 H new ATOM 0 HD21 LEU A 75 3.456 0.298 -2.902 1.00 0.00 H new ATOM 0 HD22 LEU A 75 3.204 0.354 -4.663 1.00 0.00 H new ATOM 0 HD23 LEU A 75 2.024 -0.476 -3.621 1.00 0.00 H new ATOM 1175 N ARG A 76 0.974 -4.790 -6.050 1.00 0.00 N ATOM 1176 CA ARG A 76 -0.043 -5.421 -6.894 1.00 0.00 C ATOM 1177 C ARG A 76 -0.592 -6.544 -6.098 1.00 0.00 C ATOM 1178 O ARG A 76 -1.780 -6.704 -5.942 1.00 0.00 O ATOM 1179 CB ARG A 76 0.599 -6.046 -8.134 1.00 0.00 C ATOM 1180 CG ARG A 76 0.283 -5.383 -9.427 1.00 0.00 C ATOM 1181 CD ARG A 76 0.471 -3.930 -9.260 1.00 0.00 C ATOM 1182 NE ARG A 76 -0.756 -3.244 -8.778 1.00 0.00 N ATOM 1183 CZ ARG A 76 -1.936 -3.140 -9.445 1.00 0.00 C ATOM 1184 NH1 ARG A 76 -2.056 -3.593 -10.701 1.00 0.00 N ATOM 1185 NH2 ARG A 76 -2.988 -2.580 -8.849 1.00 0.00 N ATOM 0 H ARG A 76 1.470 -5.501 -5.513 1.00 0.00 H new ATOM 0 HA ARG A 76 -0.787 -4.685 -7.197 1.00 0.00 H new ATOM 0 HB2 ARG A 76 1.681 -6.044 -8.001 1.00 0.00 H new ATOM 0 HB3 ARG A 76 0.287 -7.089 -8.196 1.00 0.00 H new ATOM 0 HG2 ARG A 76 0.932 -5.762 -10.217 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -0.742 -5.601 -9.725 1.00 0.00 H new ATOM 0 HD2 ARG A 76 1.283 -3.752 -8.555 1.00 0.00 H new ATOM 0 HD3 ARG A 76 0.775 -3.495 -10.212 1.00 0.00 H new ATOM 0 HE ARG A 76 -0.708 -2.809 -7.857 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -1.256 -4.022 -11.167 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -2.947 -3.509 -11.191 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -2.907 -2.230 -7.894 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -3.874 -2.501 -9.348 1.00 0.00 H new ATOM 1199 N LEU A 77 0.336 -7.265 -5.556 1.00 0.00 N ATOM 1200 CA LEU A 77 0.126 -8.463 -4.805 1.00 0.00 C ATOM 1201 C LEU A 77 -0.696 -8.201 -3.611 1.00 0.00 C ATOM 1202 O LEU A 77 -1.842 -8.607 -3.510 1.00 0.00 O ATOM 1203 CB LEU A 77 1.468 -8.934 -4.326 1.00 0.00 C ATOM 1204 CG LEU A 77 1.540 -10.203 -3.617 1.00 0.00 C ATOM 1205 CD1 LEU A 77 2.653 -10.951 -4.190 1.00 0.00 C ATOM 1206 CD2 LEU A 77 1.917 -9.883 -2.254 1.00 0.00 C ATOM 0 H LEU A 77 1.323 -7.018 -5.630 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.378 -9.195 -5.435 1.00 0.00 H new ATOM 0 HB2 LEU A 77 2.126 -8.999 -5.192 1.00 0.00 H new ATOM 0 HB3 LEU A 77 1.877 -8.164 -3.672 1.00 0.00 H new ATOM 0 HG LEU A 77 0.605 -10.760 -3.675 1.00 0.00 H new ATOM 0 HD11 LEU A 77 2.743 -11.913 -3.685 1.00 0.00 H new ATOM 0 HD12 LEU A 77 2.473 -11.114 -5.253 1.00 0.00 H new ATOM 0 HD13 LEU A 77 3.576 -10.386 -4.061 1.00 0.00 H new ATOM 0 HD21 LEU A 77 1.987 -10.801 -1.671 1.00 0.00 H new ATOM 0 HD22 LEU A 77 2.883 -9.378 -2.253 1.00 0.00 H new ATOM 0 HD23 LEU A 77 1.165 -9.229 -1.812 1.00 0.00 H new ATOM 1218 N TYR A 78 -0.113 -7.448 -2.730 1.00 0.00 N ATOM 1219 CA TYR A 78 -0.705 -7.228 -1.471 1.00 0.00 C ATOM 1220 C TYR A 78 -1.771 -6.170 -1.625 1.00 0.00 C ATOM 1221 O TYR A 78 -2.638 -6.002 -0.804 1.00 0.00 O ATOM 1222 CB TYR A 78 0.359 -6.920 -0.395 1.00 0.00 C ATOM 1223 CG TYR A 78 0.464 -5.541 0.051 1.00 0.00 C ATOM 1224 CD1 TYR A 78 0.287 -5.249 1.353 1.00 0.00 C ATOM 1225 CD2 TYR A 78 0.719 -4.543 -0.822 1.00 0.00 C ATOM 1226 CE1 TYR A 78 0.336 -3.990 1.792 1.00 0.00 C ATOM 1227 CE2 TYR A 78 0.780 -3.280 -0.412 1.00 0.00 C ATOM 1228 CZ TYR A 78 0.569 -3.000 0.929 1.00 0.00 C ATOM 1229 OH TYR A 78 0.591 -1.737 1.394 1.00 0.00 O ATOM 0 H TYR A 78 0.780 -6.977 -2.873 1.00 0.00 H new ATOM 0 HA TYR A 78 -1.195 -8.132 -1.108 1.00 0.00 H new ATOM 0 HB2 TYR A 78 0.152 -7.543 0.475 1.00 0.00 H new ATOM 0 HB3 TYR A 78 1.331 -7.226 -0.782 1.00 0.00 H new ATOM 0 HD1 TYR A 78 0.102 -6.048 2.055 1.00 0.00 H new ATOM 0 HD2 TYR A 78 0.875 -4.774 -1.865 1.00 0.00 H new ATOM 0 HE1 TYR A 78 0.188 -3.774 2.840 1.00 0.00 H new ATOM 0 HE2 TYR A 78 0.990 -2.485 -1.112 1.00 0.00 H new ATOM 0 HH TYR A 78 1.468 -1.338 1.215 1.00 0.00 H new ATOM 1239 N THR A 79 -1.700 -5.472 -2.745 1.00 0.00 N ATOM 1240 CA THR A 79 -2.700 -4.437 -3.038 1.00 0.00 C ATOM 1241 C THR A 79 -3.964 -5.056 -3.608 1.00 0.00 C ATOM 1242 O THR A 79 -4.943 -4.390 -3.854 1.00 0.00 O ATOM 1243 CB THR A 79 -2.154 -3.373 -3.974 1.00 0.00 C ATOM 1244 OG1 THR A 79 -1.999 -3.878 -5.295 1.00 0.00 O ATOM 1245 CG2 THR A 79 -0.834 -2.979 -3.451 1.00 0.00 C ATOM 0 H THR A 79 -0.981 -5.592 -3.458 1.00 0.00 H new ATOM 0 HA THR A 79 -2.947 -3.947 -2.096 1.00 0.00 H new ATOM 0 HB THR A 79 -2.844 -2.530 -4.020 1.00 0.00 H new ATOM 0 HG1 THR A 79 -2.724 -3.540 -5.862 1.00 0.00 H new ATOM 0 HG21 THR A 79 -0.402 -2.213 -4.095 1.00 0.00 H new ATOM 0 HG22 THR A 79 -0.946 -2.584 -2.441 1.00 0.00 H new ATOM 0 HG23 THR A 79 -0.177 -3.848 -3.430 1.00 0.00 H new ATOM 1253 N SER A 80 -3.891 -6.325 -3.874 1.00 0.00 N ATOM 1254 CA SER A 80 -5.054 -7.083 -4.234 1.00 0.00 C ATOM 1255 C SER A 80 -5.694 -7.643 -2.967 1.00 0.00 C ATOM 1256 O SER A 80 -6.686 -8.375 -3.027 1.00 0.00 O ATOM 1257 CB SER A 80 -4.710 -8.200 -5.225 1.00 0.00 C ATOM 1258 OG SER A 80 -4.182 -7.658 -6.430 1.00 0.00 O ATOM 0 H SER A 80 -3.026 -6.865 -3.848 1.00 0.00 H new ATOM 0 HA SER A 80 -5.766 -6.428 -4.736 1.00 0.00 H new ATOM 0 HB2 SER A 80 -3.985 -8.879 -4.777 1.00 0.00 H new ATOM 0 HB3 SER A 80 -5.603 -8.786 -5.444 1.00 0.00 H new ATOM 0 HG SER A 80 -3.300 -7.269 -6.255 1.00 0.00 H new ATOM 1264 N SER A 81 -5.118 -7.304 -1.799 1.00 0.00 N ATOM 1265 CA SER A 81 -5.739 -7.688 -0.576 1.00 0.00 C ATOM 1266 C SER A 81 -6.863 -6.771 -0.312 1.00 0.00 C ATOM 1267 O SER A 81 -6.857 -5.647 -0.751 1.00 0.00 O ATOM 1268 CB SER A 81 -4.770 -7.673 0.576 1.00 0.00 C ATOM 1269 OG SER A 81 -5.416 -7.690 1.838 1.00 0.00 O ATOM 0 H SER A 81 -4.248 -6.780 -1.704 1.00 0.00 H new ATOM 0 HA SER A 81 -6.099 -8.712 -0.673 1.00 0.00 H new ATOM 0 HB2 SER A 81 -4.109 -8.536 0.500 1.00 0.00 H new ATOM 0 HB3 SER A 81 -4.143 -6.784 0.506 1.00 0.00 H new ATOM 0 HG SER A 81 -5.814 -8.573 1.990 1.00 0.00 H new ATOM 1275 N TRP A 82 -7.787 -7.233 0.432 1.00 0.00 N ATOM 1276 CA TRP A 82 -8.981 -6.451 0.723 1.00 0.00 C ATOM 1277 C TRP A 82 -8.658 -5.418 1.647 1.00 0.00 C ATOM 1278 O TRP A 82 -8.956 -4.291 1.406 1.00 0.00 O ATOM 1279 CB TRP A 82 -10.130 -7.265 1.288 1.00 0.00 C ATOM 1280 CG TRP A 82 -11.373 -6.861 0.771 1.00 0.00 C ATOM 1281 CD1 TRP A 82 -11.564 -6.328 -0.410 1.00 0.00 C ATOM 1282 CD2 TRP A 82 -12.618 -7.006 1.357 1.00 0.00 C ATOM 1283 NE1 TRP A 82 -12.840 -6.049 -0.594 1.00 0.00 N ATOM 1284 CE2 TRP A 82 -13.525 -6.462 0.470 1.00 0.00 C ATOM 1285 CE3 TRP A 82 -13.065 -7.516 2.549 1.00 0.00 C ATOM 1286 CZ2 TRP A 82 -14.834 -6.399 0.720 1.00 0.00 C ATOM 1287 CZ3 TRP A 82 -14.394 -7.463 2.791 1.00 0.00 C ATOM 1288 CH2 TRP A 82 -15.266 -6.891 1.862 1.00 0.00 C ATOM 0 H TRP A 82 -7.765 -8.155 0.868 1.00 0.00 H new ATOM 0 HA TRP A 82 -9.317 -6.047 -0.232 1.00 0.00 H new ATOM 0 HB2 TRP A 82 -9.971 -8.320 1.063 1.00 0.00 H new ATOM 0 HB3 TRP A 82 -10.142 -7.169 2.374 1.00 0.00 H new ATOM 0 HD1 TRP A 82 -10.784 -6.142 -1.134 1.00 0.00 H new ATOM 0 HE1 TRP A 82 -13.236 -5.592 -1.416 1.00 0.00 H new ATOM 0 HE3 TRP A 82 -12.381 -7.944 3.267 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 -15.517 -5.959 0.009 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 -14.786 -7.867 3.713 1.00 0.00 H new ATOM 0 HH2 TRP A 82 -16.322 -6.851 2.086 1.00 0.00 H new ATOM 1299 N ARG A 83 -8.019 -5.798 2.682 1.00 0.00 N ATOM 1300 CA ARG A 83 -7.664 -4.932 3.763 1.00 0.00 C ATOM 1301 C ARG A 83 -6.707 -3.862 3.358 1.00 0.00 C ATOM 1302 O ARG A 83 -6.390 -2.960 4.120 1.00 0.00 O ATOM 1303 CB ARG A 83 -7.245 -5.743 4.889 1.00 0.00 C ATOM 1304 CG ARG A 83 -6.062 -6.580 4.649 1.00 0.00 C ATOM 1305 CD ARG A 83 -6.033 -7.687 5.636 1.00 0.00 C ATOM 1306 NE ARG A 83 -5.464 -7.351 6.934 1.00 0.00 N ATOM 1307 CZ ARG A 83 -5.066 -8.295 7.808 1.00 0.00 C ATOM 1308 NH1 ARG A 83 -5.103 -9.603 7.448 1.00 0.00 N ATOM 1309 NH2 ARG A 83 -4.593 -7.940 9.015 1.00 0.00 N ATOM 0 H ARG A 83 -7.710 -6.760 2.817 1.00 0.00 H new ATOM 0 HA ARG A 83 -8.535 -4.360 4.083 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -7.040 -5.086 5.734 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -8.074 -6.388 5.181 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -6.087 -6.982 3.636 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -5.156 -5.980 4.732 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -7.052 -8.044 5.786 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -5.464 -8.515 5.212 1.00 0.00 H new ATOM 0 HE ARG A 83 -5.364 -6.369 7.189 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -5.431 -9.867 6.519 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -4.803 -10.322 8.106 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -4.535 -6.954 9.270 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -4.292 -8.656 9.676 1.00 0.00 H new ATOM 1323 N TYR A 84 -6.259 -3.998 2.158 1.00 0.00 N ATOM 1324 CA TYR A 84 -5.636 -2.967 1.467 1.00 0.00 C ATOM 1325 C TYR A 84 -6.722 -1.909 1.135 1.00 0.00 C ATOM 1326 O TYR A 84 -6.790 -0.871 1.745 1.00 0.00 O ATOM 1327 CB TYR A 84 -5.037 -3.536 0.202 1.00 0.00 C ATOM 1328 CG TYR A 84 -4.591 -2.520 -0.799 1.00 0.00 C ATOM 1329 CD1 TYR A 84 -3.357 -1.838 -0.749 1.00 0.00 C ATOM 1330 CD2 TYR A 84 -5.447 -2.234 -1.827 1.00 0.00 C ATOM 1331 CE1 TYR A 84 -3.055 -0.937 -1.709 1.00 0.00 C ATOM 1332 CE2 TYR A 84 -5.132 -1.326 -2.787 1.00 0.00 C ATOM 1333 CZ TYR A 84 -3.926 -0.677 -2.727 1.00 0.00 C ATOM 1334 OH TYR A 84 -3.575 0.229 -3.701 1.00 0.00 O ATOM 0 H TYR A 84 -6.328 -4.867 1.629 1.00 0.00 H new ATOM 0 HA TYR A 84 -4.841 -2.505 2.052 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -4.183 -4.158 0.470 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -5.772 -4.189 -0.268 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -2.659 -2.035 0.051 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -6.398 -2.743 -1.877 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -2.110 -0.415 -1.670 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -5.824 -1.118 -3.589 1.00 0.00 H new ATOM 0 HH TYR A 84 -4.256 0.233 -4.405 1.00 0.00 H new ATOM 1344 N LEU A 85 -7.661 -2.285 0.269 1.00 0.00 N ATOM 1345 CA LEU A 85 -8.679 -1.358 -0.282 1.00 0.00 C ATOM 1346 C LEU A 85 -9.817 -0.970 0.582 1.00 0.00 C ATOM 1347 O LEU A 85 -10.794 -0.425 0.103 1.00 0.00 O ATOM 1348 CB LEU A 85 -9.215 -1.664 -1.649 1.00 0.00 C ATOM 1349 CG LEU A 85 -9.893 -2.971 -2.021 1.00 0.00 C ATOM 1350 CD1 LEU A 85 -8.933 -4.056 -2.022 1.00 0.00 C ATOM 1351 CD2 LEU A 85 -11.012 -3.271 -1.077 1.00 0.00 C ATOM 0 H LEU A 85 -7.748 -3.240 -0.078 1.00 0.00 H new ATOM 0 HA LEU A 85 -8.012 -0.498 -0.348 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -9.929 -0.874 -1.880 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.378 -1.548 -2.337 1.00 0.00 H new ATOM 0 HG LEU A 85 -10.306 -2.869 -3.025 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -9.435 -4.986 -2.291 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -8.147 -3.846 -2.747 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -8.494 -4.154 -1.029 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -11.485 -4.211 -1.360 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -10.621 -3.353 -0.063 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -11.748 -2.468 -1.118 1.00 0.00 H new ATOM 1363 N TYR A 86 -9.669 -1.148 1.790 1.00 0.00 N ATOM 1364 CA TYR A 86 -10.633 -0.795 2.776 1.00 0.00 C ATOM 1365 C TYR A 86 -10.797 0.720 2.775 1.00 0.00 C ATOM 1366 O TYR A 86 -11.782 1.281 3.244 1.00 0.00 O ATOM 1367 CB TYR A 86 -10.064 -1.218 4.042 1.00 0.00 C ATOM 1368 CG TYR A 86 -10.311 -2.621 4.459 1.00 0.00 C ATOM 1369 CD1 TYR A 86 -10.360 -3.009 5.793 1.00 0.00 C ATOM 1370 CD2 TYR A 86 -10.584 -3.536 3.528 1.00 0.00 C ATOM 1371 CE1 TYR A 86 -10.692 -4.295 6.138 1.00 0.00 C ATOM 1372 CE2 TYR A 86 -10.894 -4.798 3.832 1.00 0.00 C ATOM 1373 CZ TYR A 86 -10.963 -5.199 5.143 1.00 0.00 C ATOM 1374 OH TYR A 86 -11.303 -6.493 5.458 1.00 0.00 O ATOM 0 H TYR A 86 -8.828 -1.570 2.184 1.00 0.00 H new ATOM 0 HA TYR A 86 -11.605 -1.254 2.595 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -8.986 -1.063 3.997 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -10.448 -0.561 4.822 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -10.134 -2.290 6.567 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -10.553 -3.245 2.488 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -10.739 -4.590 7.176 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -11.092 -5.508 3.042 1.00 0.00 H new ATOM 0 HH TYR A 86 -11.859 -6.868 4.744 1.00 0.00 H new ATOM 1384 N GLY A 87 -9.788 1.326 2.215 1.00 0.00 N ATOM 1385 CA GLY A 87 -9.694 2.705 2.008 1.00 0.00 C ATOM 1386 C GLY A 87 -8.562 2.991 1.145 1.00 0.00 C ATOM 1387 O GLY A 87 -7.554 3.302 1.616 1.00 0.00 O ATOM 0 H GLY A 87 -8.969 0.819 1.878 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -10.613 3.079 1.556 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -9.576 3.219 2.962 1.00 0.00 H new ATOM 1391 N VAL A 88 -8.710 2.875 -0.176 1.00 0.00 N ATOM 1392 CA VAL A 88 -7.541 3.159 -1.053 1.00 0.00 C ATOM 1393 C VAL A 88 -7.741 4.138 -2.224 1.00 0.00 C ATOM 1394 O VAL A 88 -6.790 4.778 -2.645 1.00 0.00 O ATOM 1395 CB VAL A 88 -6.872 1.877 -1.552 1.00 0.00 C ATOM 1396 CG1 VAL A 88 -5.769 2.159 -2.560 1.00 0.00 C ATOM 1397 CG2 VAL A 88 -6.318 1.189 -0.395 1.00 0.00 C ATOM 0 H VAL A 88 -9.569 2.604 -0.654 1.00 0.00 H new ATOM 0 HA VAL A 88 -6.885 3.698 -0.370 1.00 0.00 H new ATOM 0 HB VAL A 88 -7.616 1.264 -2.062 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -5.324 1.219 -2.885 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -6.188 2.679 -3.421 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -5.003 2.782 -2.097 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -5.832 0.268 -0.717 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -5.587 1.832 0.095 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -7.119 0.951 0.305 1.00 0.00 H new ATOM 1407 N LYS A 89 -8.951 4.362 -2.607 1.00 0.00 N ATOM 1408 CA LYS A 89 -9.219 4.990 -3.945 1.00 0.00 C ATOM 1409 C LYS A 89 -8.442 6.278 -4.225 1.00 0.00 C ATOM 1410 O LYS A 89 -7.669 6.322 -5.182 1.00 0.00 O ATOM 1411 CB LYS A 89 -10.708 5.029 -4.346 1.00 0.00 C ATOM 1412 CG LYS A 89 -11.242 3.681 -4.755 1.00 0.00 C ATOM 1413 CD LYS A 89 -10.665 3.205 -6.089 1.00 0.00 C ATOM 1414 CE LYS A 89 -10.976 1.730 -6.346 1.00 0.00 C ATOM 1415 NZ LYS A 89 -12.419 1.409 -6.161 1.00 0.00 N ATOM 0 H LYS A 89 -9.783 4.142 -2.059 1.00 0.00 H new ATOM 0 HA LYS A 89 -8.780 4.284 -4.649 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -11.294 5.407 -3.509 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -10.839 5.731 -5.170 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -11.009 2.951 -3.980 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -12.328 3.731 -4.829 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -11.074 3.809 -6.899 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -9.585 3.355 -6.093 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -10.677 1.471 -7.362 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -10.381 1.114 -5.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -12.640 0.514 -6.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -12.627 1.317 -5.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -12.999 2.172 -6.565 1.00 0.00 H new ATOM 1429 N PRO A 90 -8.634 7.333 -3.456 1.00 0.00 N ATOM 1430 CA PRO A 90 -7.751 8.438 -3.501 1.00 0.00 C ATOM 1431 C PRO A 90 -6.686 8.387 -2.389 1.00 0.00 C ATOM 1432 O PRO A 90 -5.925 7.433 -2.306 1.00 0.00 O ATOM 1433 CB PRO A 90 -8.677 9.629 -3.435 1.00 0.00 C ATOM 1434 CG PRO A 90 -9.990 9.082 -2.906 1.00 0.00 C ATOM 1435 CD PRO A 90 -9.768 7.622 -2.628 1.00 0.00 C ATOM 0 HA PRO A 90 -7.135 8.466 -4.400 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -8.279 10.402 -2.777 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -8.806 10.082 -4.418 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -10.291 9.607 -2.000 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -10.789 9.220 -3.635 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -9.563 7.433 -1.574 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -10.635 7.018 -2.897 1.00 0.00 H new ATOM 1443 N GLY A 91 -6.676 9.355 -1.482 1.00 0.00 N ATOM 1444 CA GLY A 91 -5.655 9.469 -0.487 1.00 0.00 C ATOM 1445 C GLY A 91 -5.924 8.650 0.722 1.00 0.00 C ATOM 1446 O GLY A 91 -5.534 8.886 1.838 1.00 0.00 O ATOM 0 H GLY A 91 -7.389 10.082 -1.428 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -4.701 9.166 -0.918 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -5.556 10.515 -0.195 1.00 0.00 H new ATOM 1450 N ALA A 92 -6.604 7.716 0.421 1.00 0.00 N ATOM 1451 CA ALA A 92 -7.110 6.685 1.270 1.00 0.00 C ATOM 1452 C ALA A 92 -6.033 5.840 1.734 1.00 0.00 C ATOM 1453 O ALA A 92 -6.071 5.304 2.836 1.00 0.00 O ATOM 1454 CB ALA A 92 -8.058 5.962 0.476 1.00 0.00 C ATOM 0 H ALA A 92 -6.896 7.577 -0.546 1.00 0.00 H new ATOM 0 HA ALA A 92 -7.584 7.083 2.167 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -8.487 5.153 1.068 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -8.852 6.636 0.154 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -7.558 5.546 -0.399 1.00 0.00 H new ATOM 1460 N THR A 93 -5.080 5.770 0.894 1.00 0.00 N ATOM 1461 CA THR A 93 -3.811 5.212 1.148 1.00 0.00 C ATOM 1462 C THR A 93 -3.320 5.628 2.507 1.00 0.00 C ATOM 1463 O THR A 93 -2.784 4.858 3.268 1.00 0.00 O ATOM 1464 CB THR A 93 -2.827 5.805 0.148 1.00 0.00 C ATOM 1465 OG1 THR A 93 -1.508 5.625 0.550 1.00 0.00 O ATOM 1466 CG2 THR A 93 -3.137 7.227 -0.157 1.00 0.00 C ATOM 0 H THR A 93 -5.170 6.126 -0.058 1.00 0.00 H new ATOM 0 HA THR A 93 -3.885 4.127 1.080 1.00 0.00 H new ATOM 0 HB THR A 93 -2.945 5.254 -0.785 1.00 0.00 H new ATOM 0 HG1 THR A 93 -0.972 6.396 0.269 1.00 0.00 H new ATOM 0 HG21 THR A 93 -2.412 7.612 -0.874 1.00 0.00 H new ATOM 0 HG22 THR A 93 -4.139 7.298 -0.581 1.00 0.00 H new ATOM 0 HG23 THR A 93 -3.088 7.815 0.760 1.00 0.00 H new ATOM 1474 N ARG A 94 -3.540 6.899 2.775 1.00 0.00 N ATOM 1475 CA ARG A 94 -3.078 7.592 3.886 1.00 0.00 C ATOM 1476 C ARG A 94 -1.577 7.725 3.892 1.00 0.00 C ATOM 1477 O ARG A 94 -1.047 8.319 4.774 1.00 0.00 O ATOM 1478 CB ARG A 94 -3.517 6.996 5.179 1.00 0.00 C ATOM 1479 CG ARG A 94 -5.034 6.829 5.424 1.00 0.00 C ATOM 1480 CD ARG A 94 -5.901 8.010 4.960 1.00 0.00 C ATOM 1481 NE ARG A 94 -5.409 9.328 5.463 1.00 0.00 N ATOM 1482 CZ ARG A 94 -5.910 9.988 6.542 1.00 0.00 C ATOM 1483 NH1 ARG A 94 -6.742 9.367 7.389 1.00 0.00 N ATOM 1484 NH2 ARG A 94 -5.544 11.253 6.792 1.00 0.00 N ATOM 0 H ARG A 94 -4.092 7.489 2.153 1.00 0.00 H new ATOM 0 HA ARG A 94 -3.528 8.581 3.799 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -3.054 6.013 5.268 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -3.115 7.611 5.984 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -5.372 5.927 4.914 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -5.200 6.673 6.490 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -5.926 8.029 3.870 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -6.925 7.857 5.300 1.00 0.00 H new ATOM 0 HE ARG A 94 -4.638 9.767 4.959 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -7.003 8.394 7.226 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -7.115 9.867 8.196 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -4.887 11.726 6.172 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -5.923 11.743 7.602 1.00 0.00 H new ATOM 1498 N VAL A 95 -0.906 7.132 2.913 1.00 0.00 N ATOM 1499 CA VAL A 95 0.497 7.123 2.844 1.00 0.00 C ATOM 1500 C VAL A 95 1.103 7.260 1.390 1.00 0.00 C ATOM 1501 O VAL A 95 0.507 7.077 0.332 1.00 0.00 O ATOM 1502 CB VAL A 95 1.132 5.871 3.505 1.00 0.00 C ATOM 1503 CG1 VAL A 95 0.246 5.244 4.462 1.00 0.00 C ATOM 1504 CG2 VAL A 95 1.605 4.910 2.489 1.00 0.00 C ATOM 0 H VAL A 95 -1.359 6.641 2.142 1.00 0.00 H new ATOM 0 HA VAL A 95 0.757 8.022 3.404 1.00 0.00 H new ATOM 0 HB VAL A 95 2.001 6.215 4.066 1.00 0.00 H new ATOM 0 HG11 VAL A 95 0.737 4.373 4.896 1.00 0.00 H new ATOM 0 HG12 VAL A 95 0.002 5.954 5.252 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -0.670 4.932 3.960 1.00 0.00 H new ATOM 0 HG21 VAL A 95 2.045 4.044 2.984 1.00 0.00 H new ATOM 0 HG22 VAL A 95 0.765 4.588 1.873 1.00 0.00 H new ATOM 0 HG23 VAL A 95 2.355 5.387 1.858 1.00 0.00 H new ATOM 1514 N ASP A 96 2.209 7.678 1.511 1.00 0.00 N ATOM 1515 CA ASP A 96 3.329 7.712 0.684 1.00 0.00 C ATOM 1516 C ASP A 96 4.263 7.199 1.738 1.00 0.00 C ATOM 1517 O ASP A 96 3.809 6.983 2.889 1.00 0.00 O ATOM 1518 CB ASP A 96 3.688 9.159 0.242 1.00 0.00 C ATOM 1519 CG ASP A 96 3.935 10.138 1.380 1.00 0.00 C ATOM 1520 OD1 ASP A 96 4.346 11.270 1.107 1.00 0.00 O ATOM 1521 OD2 ASP A 96 3.657 9.797 2.561 1.00 0.00 O ATOM 0 H ASP A 96 2.450 8.122 2.397 1.00 0.00 H new ATOM 0 HA ASP A 96 3.282 7.182 -0.267 1.00 0.00 H new ATOM 0 HB2 ASP A 96 4.580 9.121 -0.384 1.00 0.00 H new ATOM 0 HB3 ASP A 96 2.879 9.544 -0.379 1.00 0.00 H new ATOM 1526 N LEU A 97 5.412 6.927 1.487 1.00 0.00 N ATOM 1527 CA LEU A 97 6.192 6.397 2.456 1.00 0.00 C ATOM 1528 C LEU A 97 6.677 7.275 3.617 1.00 0.00 C ATOM 1529 O LEU A 97 7.579 6.898 4.377 1.00 0.00 O ATOM 1530 CB LEU A 97 7.076 5.463 1.866 1.00 0.00 C ATOM 1531 CG LEU A 97 6.420 4.758 0.771 1.00 0.00 C ATOM 1532 CD1 LEU A 97 7.252 4.771 -0.393 1.00 0.00 C ATOM 1533 CD2 LEU A 97 6.275 3.480 1.148 1.00 0.00 C ATOM 0 H LEU A 97 5.865 7.064 0.583 1.00 0.00 H new ATOM 0 HA LEU A 97 5.537 5.850 3.134 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.963 5.977 1.495 1.00 0.00 H new ATOM 0 HB3 LEU A 97 7.412 4.748 2.617 1.00 0.00 H new ATOM 0 HG LEU A 97 5.466 5.234 0.545 1.00 0.00 H new ATOM 0 HD11 LEU A 97 6.752 4.242 -1.204 1.00 0.00 H new ATOM 0 HD12 LEU A 97 7.440 5.802 -0.694 1.00 0.00 H new ATOM 0 HD13 LEU A 97 8.199 4.280 -0.169 1.00 0.00 H new ATOM 0 HD21 LEU A 97 5.786 2.919 0.352 1.00 0.00 H new ATOM 0 HD22 LEU A 97 7.255 3.046 1.349 1.00 0.00 H new ATOM 0 HD23 LEU A 97 5.666 3.434 2.051 1.00 0.00 H new ATOM 1545 N ASP A 98 5.964 8.363 3.825 1.00 0.00 N ATOM 1546 CA ASP A 98 6.061 9.180 4.986 1.00 0.00 C ATOM 1547 C ASP A 98 4.819 8.842 5.800 1.00 0.00 C ATOM 1548 O ASP A 98 4.892 8.406 6.959 1.00 0.00 O ATOM 1549 CB ASP A 98 5.975 10.656 4.666 1.00 0.00 C ATOM 1550 CG ASP A 98 6.489 11.500 5.819 1.00 0.00 C ATOM 1551 OD1 ASP A 98 7.712 11.786 5.838 1.00 0.00 O ATOM 1552 OD2 ASP A 98 5.701 11.847 6.713 1.00 0.00 O ATOM 0 H ASP A 98 5.277 8.704 3.153 1.00 0.00 H new ATOM 0 HA ASP A 98 7.013 8.998 5.485 1.00 0.00 H new ATOM 0 HB2 ASP A 98 6.555 10.870 3.768 1.00 0.00 H new ATOM 0 HB3 ASP A 98 4.941 10.924 4.449 1.00 0.00 H new ATOM 1557 N GLY A 99 3.687 8.875 5.095 1.00 0.00 N ATOM 1558 CA GLY A 99 2.403 8.662 5.676 1.00 0.00 C ATOM 1559 C GLY A 99 1.420 9.832 5.406 1.00 0.00 C ATOM 1560 O GLY A 99 0.586 10.188 6.244 1.00 0.00 O ATOM 0 H GLY A 99 3.659 9.055 4.091 1.00 0.00 H new ATOM 0 HA2 GLY A 99 1.979 7.739 5.281 1.00 0.00 H new ATOM 0 HA3 GLY A 99 2.514 8.527 6.752 1.00 0.00 H new ATOM 1564 N ASN A 100 1.548 10.383 4.212 1.00 0.00 N ATOM 1565 CA ASN A 100 0.706 11.392 3.589 1.00 0.00 C ATOM 1566 C ASN A 100 -0.171 10.613 2.720 1.00 0.00 C ATOM 1567 O ASN A 100 0.287 9.733 2.204 1.00 0.00 O ATOM 1568 CB ASN A 100 1.619 12.137 2.688 1.00 0.00 C ATOM 1569 CG ASN A 100 2.394 13.168 3.264 1.00 0.00 C ATOM 1570 OD1 ASN A 100 1.974 13.899 4.160 1.00 0.00 O ATOM 1571 ND2 ASN A 100 3.536 13.241 2.775 1.00 0.00 N ATOM 0 H ASN A 100 2.314 10.111 3.596 1.00 0.00 H new ATOM 0 HA ASN A 100 0.174 12.042 4.283 1.00 0.00 H new ATOM 0 HB2 ASN A 100 2.299 11.420 2.228 1.00 0.00 H new ATOM 0 HB3 ASN A 100 1.022 12.571 1.886 1.00 0.00 H new ATOM 0 HD21 ASN A 100 4.193 13.942 3.117 1.00 0.00 H new ATOM 0 HD22 ASN A 100 3.815 12.600 2.033 1.00 0.00 H new ATOM 1578 N PRO A 101 -1.403 10.984 2.442 1.00 0.00 N ATOM 1579 CA PRO A 101 -2.409 10.137 1.734 1.00 0.00 C ATOM 1580 C PRO A 101 -2.116 10.070 0.292 1.00 0.00 C ATOM 1581 O PRO A 101 -2.878 10.510 -0.516 1.00 0.00 O ATOM 1582 CB PRO A 101 -3.659 10.967 1.987 1.00 0.00 C ATOM 1583 CG PRO A 101 -3.260 11.846 3.119 1.00 0.00 C ATOM 1584 CD PRO A 101 -1.954 12.248 2.672 1.00 0.00 C ATOM 0 HA PRO A 101 -2.459 9.099 2.063 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -3.943 11.546 1.108 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -4.513 10.341 2.245 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -3.935 12.692 3.248 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -3.230 11.314 4.070 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -1.988 12.863 1.772 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -1.407 12.815 3.425 1.00 0.00 H new ATOM 1592 N CYS A 102 -0.945 9.525 0.006 1.00 0.00 N ATOM 1593 CA CYS A 102 -0.214 9.701 -1.243 1.00 0.00 C ATOM 1594 C CYS A 102 -0.057 11.234 -1.517 1.00 0.00 C ATOM 1595 O CYS A 102 0.381 11.695 -2.560 1.00 0.00 O ATOM 1596 CB CYS A 102 -0.758 8.785 -2.394 1.00 0.00 C ATOM 1597 SG CYS A 102 -0.274 9.198 -4.083 1.00 0.00 S ATOM 0 H CYS A 102 -0.455 8.921 0.666 1.00 0.00 H new ATOM 0 HA CYS A 102 0.807 9.326 -1.172 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -0.437 7.763 -2.192 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -1.847 8.792 -2.344 1.00 0.00 H new ATOM 0 HG CYS A 102 0.212 10.403 -4.113 1.00 0.00 H new ATOM 1603 N GLY A 103 -0.424 11.972 -0.431 1.00 0.00 N ATOM 1604 CA GLY A 103 -0.423 13.424 -0.282 1.00 0.00 C ATOM 1605 C GLY A 103 -1.483 14.038 -1.107 1.00 0.00 C ATOM 1606 O GLY A 103 -1.535 15.232 -1.351 1.00 0.00 O ATOM 0 H GLY A 103 -0.751 11.514 0.420 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -0.573 13.686 0.765 1.00 0.00 H new ATOM 0 HA3 GLY A 103 0.548 13.823 -0.574 1.00 0.00 H new ATOM 1610 N GLU A 104 -2.302 13.181 -1.477 1.00 0.00 N ATOM 1611 CA GLU A 104 -3.361 13.360 -2.364 1.00 0.00 C ATOM 1612 C GLU A 104 -4.661 13.771 -1.673 1.00 0.00 C ATOM 1613 O GLU A 104 -5.382 14.639 -2.174 1.00 0.00 O ATOM 1614 CB GLU A 104 -3.458 12.035 -3.096 1.00 0.00 C ATOM 1615 CG GLU A 104 -4.740 11.316 -3.064 1.00 0.00 C ATOM 1616 CD GLU A 104 -4.635 10.110 -3.912 1.00 0.00 C ATOM 1617 OE1 GLU A 104 -5.364 9.988 -4.902 1.00 0.00 O ATOM 1618 OE2 GLU A 104 -3.826 9.217 -3.583 1.00 0.00 O ATOM 0 H GLU A 104 -2.253 12.222 -1.134 1.00 0.00 H new ATOM 0 HA GLU A 104 -3.187 14.189 -3.050 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -3.202 12.212 -4.140 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -2.694 11.373 -2.688 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -4.990 11.036 -2.040 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -5.542 11.960 -3.423 1.00 0.00 H new ATOM 1625 N LEU A 105 -4.985 13.182 -0.528 1.00 0.00 N ATOM 1626 CA LEU A 105 -6.222 13.496 0.031 1.00 0.00 C ATOM 1627 C LEU A 105 -6.164 13.855 1.527 1.00 0.00 C ATOM 1628 O LEU A 105 -5.172 13.728 2.171 1.00 0.00 O ATOM 1629 CB LEU A 105 -7.205 12.360 -0.321 1.00 0.00 C ATOM 1630 CG LEU A 105 -8.671 12.707 -0.245 1.00 0.00 C ATOM 1631 CD1 LEU A 105 -9.491 11.862 -1.111 1.00 0.00 C ATOM 1632 CD2 LEU A 105 -9.079 12.504 1.077 1.00 0.00 C ATOM 0 H LEU A 105 -4.411 12.515 -0.012 1.00 0.00 H new ATOM 0 HA LEU A 105 -6.590 14.425 -0.405 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -6.985 12.016 -1.332 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -7.015 11.521 0.349 1.00 0.00 H new ATOM 0 HG LEU A 105 -8.800 13.739 -0.572 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -10.537 12.153 -1.019 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -9.171 11.983 -2.146 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -9.377 10.819 -0.815 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -10.138 12.745 1.172 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -8.918 11.461 1.351 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -8.499 13.147 1.739 1.00 0.00 H new ATOM 1644 N ASP A 106 -7.237 14.425 1.949 1.00 0.00 N ATOM 1645 CA ASP A 106 -7.699 14.671 3.302 1.00 0.00 C ATOM 1646 C ASP A 106 -8.066 13.260 3.876 1.00 0.00 C ATOM 1647 O ASP A 106 -7.377 12.263 3.586 1.00 0.00 O ATOM 1648 CB ASP A 106 -8.961 15.592 3.012 1.00 0.00 C ATOM 1649 CG ASP A 106 -10.087 15.623 3.974 1.00 0.00 C ATOM 1650 OD1 ASP A 106 -11.194 15.257 3.531 1.00 0.00 O ATOM 1651 OD2 ASP A 106 -9.883 15.860 5.121 1.00 0.00 O ATOM 0 H ASP A 106 -7.913 14.784 1.274 1.00 0.00 H new ATOM 0 HA ASP A 106 -7.022 15.139 4.016 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -8.599 16.614 2.902 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -9.367 15.292 2.046 1.00 0.00 H new ATOM 1656 N GLU A 107 -9.069 13.170 4.634 1.00 0.00 N ATOM 1657 CA GLU A 107 -9.591 11.907 5.060 1.00 0.00 C ATOM 1658 C GLU A 107 -11.095 11.848 5.173 1.00 0.00 C ATOM 1659 O GLU A 107 -11.656 10.823 5.515 1.00 0.00 O ATOM 1660 CB GLU A 107 -8.885 11.506 6.241 1.00 0.00 C ATOM 1661 CG GLU A 107 -9.187 12.253 7.496 1.00 0.00 C ATOM 1662 CD GLU A 107 -8.098 11.934 8.499 1.00 0.00 C ATOM 1663 OE1 GLU A 107 -7.079 12.655 8.529 1.00 0.00 O ATOM 1664 OE2 GLU A 107 -8.161 10.861 9.132 1.00 0.00 O ATOM 0 H GLU A 107 -9.578 13.976 4.997 1.00 0.00 H new ATOM 0 HA GLU A 107 -9.409 11.172 4.276 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -9.091 10.450 6.417 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -7.817 11.593 6.043 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -9.226 13.325 7.302 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -10.163 11.964 7.887 1.00 0.00 H new ATOM 1671 N GLN A 108 -11.731 12.891 4.753 1.00 0.00 N ATOM 1672 CA GLN A 108 -13.126 12.932 4.629 1.00 0.00 C ATOM 1673 C GLN A 108 -13.382 12.770 3.199 1.00 0.00 C ATOM 1674 O GLN A 108 -14.509 12.870 2.684 1.00 0.00 O ATOM 1675 CB GLN A 108 -13.720 14.188 5.168 1.00 0.00 C ATOM 1676 CG GLN A 108 -15.206 14.043 5.295 1.00 0.00 C ATOM 1677 CD GLN A 108 -15.896 15.178 6.006 1.00 0.00 C ATOM 1678 OE1 GLN A 108 -15.463 16.319 5.960 1.00 0.00 O ATOM 1679 NE2 GLN A 108 -16.990 14.877 6.655 1.00 0.00 N ATOM 0 H GLN A 108 -11.268 13.758 4.482 1.00 0.00 H new ATOM 0 HA GLN A 108 -13.598 12.146 5.219 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -13.285 14.417 6.141 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -13.484 15.023 4.509 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -15.633 13.945 4.297 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -15.422 13.116 5.826 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -17.324 13.913 6.673 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -17.510 15.606 7.143 1.00 0.00 H new ATOM 1688 N HIS A 109 -12.326 12.492 2.476 1.00 0.00 N ATOM 1689 CA HIS A 109 -12.555 12.209 1.145 1.00 0.00 C ATOM 1690 C HIS A 109 -12.121 10.861 0.835 1.00 0.00 C ATOM 1691 O HIS A 109 -12.639 10.209 -0.054 1.00 0.00 O ATOM 1692 CB HIS A 109 -12.030 13.239 0.257 1.00 0.00 C ATOM 1693 CG HIS A 109 -12.435 14.685 0.585 1.00 0.00 C ATOM 1694 ND1 HIS A 109 -13.682 15.041 1.066 1.00 0.00 N ATOM 1695 CD2 HIS A 109 -11.711 15.833 0.575 1.00 0.00 C ATOM 1696 CE1 HIS A 109 -13.700 16.331 1.337 1.00 0.00 C ATOM 1697 NE2 HIS A 109 -12.519 16.840 1.053 1.00 0.00 N ATOM 0 H HIS A 109 -11.358 12.464 2.795 1.00 0.00 H new ATOM 0 HA HIS A 109 -13.629 12.233 0.961 1.00 0.00 H new ATOM 0 HB2 HIS A 109 -10.942 13.177 0.265 1.00 0.00 H new ATOM 0 HB3 HIS A 109 -12.354 13.014 -0.759 1.00 0.00 H new ATOM 0 HD1 HIS A 109 -14.468 14.403 1.192 1.00 0.00 H new ATOM 0 HD2 HIS A 109 -10.686 15.938 0.251 1.00 0.00 H new ATOM 0 HE1 HIS A 109 -14.544 16.880 1.728 1.00 0.00 H new ATOM 1706 N VAL A 110 -11.256 10.398 1.628 1.00 0.00 N ATOM 1707 CA VAL A 110 -10.884 9.049 1.543 1.00 0.00 C ATOM 1708 C VAL A 110 -11.710 8.264 2.444 1.00 0.00 C ATOM 1709 O VAL A 110 -11.573 7.095 2.643 1.00 0.00 O ATOM 1710 CB VAL A 110 -9.478 8.815 1.699 1.00 0.00 C ATOM 1711 CG1 VAL A 110 -8.980 9.310 0.479 1.00 0.00 C ATOM 1712 CG2 VAL A 110 -8.911 9.586 2.817 1.00 0.00 C ATOM 0 H VAL A 110 -10.783 10.936 2.355 1.00 0.00 H new ATOM 0 HA VAL A 110 -11.073 8.715 0.523 1.00 0.00 H new ATOM 0 HB VAL A 110 -9.236 7.774 1.915 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -7.896 9.195 0.455 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -9.422 8.753 -0.347 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -9.235 10.365 0.383 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -7.844 9.378 2.898 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -9.061 10.651 2.638 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -9.408 9.301 3.744 1.00 0.00 H new ATOM 1722 N GLU A 111 -12.597 8.985 2.899 1.00 0.00 N ATOM 1723 CA GLU A 111 -13.685 8.623 3.657 1.00 0.00 C ATOM 1724 C GLU A 111 -14.616 7.848 2.788 1.00 0.00 C ATOM 1725 O GLU A 111 -15.279 6.922 3.205 1.00 0.00 O ATOM 1726 CB GLU A 111 -14.299 9.895 4.172 1.00 0.00 C ATOM 1727 CG GLU A 111 -15.479 9.661 5.042 1.00 0.00 C ATOM 1728 CD GLU A 111 -16.784 9.770 4.274 1.00 0.00 C ATOM 1729 OE1 GLU A 111 -17.144 10.889 3.848 1.00 0.00 O ATOM 1730 OE2 GLU A 111 -17.424 8.729 4.039 1.00 0.00 O ATOM 0 H GLU A 111 -12.584 9.991 2.729 1.00 0.00 H new ATOM 0 HA GLU A 111 -13.426 7.991 4.506 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -13.548 10.454 4.731 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -14.595 10.516 3.327 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -15.406 8.672 5.493 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -15.477 10.384 5.857 1.00 0.00 H new ATOM 1737 N HIS A 112 -14.602 8.200 1.552 1.00 0.00 N ATOM 1738 CA HIS A 112 -15.415 7.548 0.594 1.00 0.00 C ATOM 1739 C HIS A 112 -14.715 6.374 0.026 1.00 0.00 C ATOM 1740 O HIS A 112 -15.282 5.567 -0.679 1.00 0.00 O ATOM 1741 CB HIS A 112 -15.819 8.507 -0.444 1.00 0.00 C ATOM 1742 CG HIS A 112 -16.617 9.666 0.133 1.00 0.00 C ATOM 1743 ND1 HIS A 112 -17.990 9.759 0.089 1.00 0.00 N ATOM 1744 CD2 HIS A 112 -16.205 10.714 0.869 1.00 0.00 C ATOM 1745 CE1 HIS A 112 -18.372 10.817 0.792 1.00 0.00 C ATOM 1746 NE2 HIS A 112 -17.304 11.407 1.280 1.00 0.00 N ATOM 0 H HIS A 112 -14.023 8.952 1.177 1.00 0.00 H new ATOM 0 HA HIS A 112 -16.318 7.174 1.077 1.00 0.00 H new ATOM 0 HB2 HIS A 112 -14.932 8.892 -0.947 1.00 0.00 H new ATOM 0 HB3 HIS A 112 -16.416 7.995 -1.198 1.00 0.00 H new ATOM 0 HD2 HIS A 112 -15.179 10.963 1.095 1.00 0.00 H new ATOM 0 HE1 HIS A 112 -19.392 11.140 0.939 1.00 0.00 H new ATOM 0 HE2 HIS A 112 -17.299 12.241 1.866 1.00 0.00 H new ATOM 1755 N ALA A 113 -13.511 6.293 0.344 1.00 0.00 N ATOM 1756 CA ALA A 113 -12.717 5.234 0.015 1.00 0.00 C ATOM 1757 C ALA A 113 -12.826 4.237 1.087 1.00 0.00 C ATOM 1758 O ALA A 113 -12.807 3.038 0.872 1.00 0.00 O ATOM 1759 CB ALA A 113 -11.395 5.724 -0.077 1.00 0.00 C ATOM 0 H ALA A 113 -13.027 7.016 0.877 1.00 0.00 H new ATOM 0 HA ALA A 113 -13.008 4.772 -0.928 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -10.722 4.908 -0.339 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -11.346 6.496 -0.845 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -11.096 6.147 0.882 1.00 0.00 H new ATOM 1765 N ARG A 114 -12.977 4.786 2.228 1.00 0.00 N ATOM 1766 CA ARG A 114 -13.240 4.109 3.417 1.00 0.00 C ATOM 1767 C ARG A 114 -14.607 3.405 3.263 1.00 0.00 C ATOM 1768 O ARG A 114 -14.893 2.409 3.919 1.00 0.00 O ATOM 1769 CB ARG A 114 -13.268 5.179 4.552 1.00 0.00 C ATOM 1770 CG ARG A 114 -13.563 4.741 5.998 1.00 0.00 C ATOM 1771 CD ARG A 114 -15.050 4.427 6.225 1.00 0.00 C ATOM 1772 NE ARG A 114 -15.949 5.523 5.760 1.00 0.00 N ATOM 1773 CZ ARG A 114 -17.287 5.539 5.895 1.00 0.00 C ATOM 1774 NH1 ARG A 114 -17.911 4.507 6.481 1.00 0.00 N ATOM 1775 NH2 ARG A 114 -18.003 6.563 5.416 1.00 0.00 N ATOM 0 H ARG A 114 -12.914 5.796 2.356 1.00 0.00 H new ATOM 0 HA ARG A 114 -12.489 3.355 3.654 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -12.300 5.680 4.553 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -14.013 5.926 4.278 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -12.968 3.859 6.236 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -13.252 5.529 6.684 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -15.306 3.506 5.701 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -15.221 4.248 7.287 1.00 0.00 H new ATOM 0 HE ARG A 114 -15.514 6.324 5.303 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -17.371 3.712 6.823 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -18.926 4.517 6.585 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -17.534 7.337 4.945 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -19.018 6.569 5.521 1.00 0.00 H new ATOM 1789 N LYS A 115 -15.438 3.911 2.337 1.00 0.00 N ATOM 1790 CA LYS A 115 -16.722 3.465 2.221 1.00 0.00 C ATOM 1791 C LYS A 115 -16.796 2.707 0.942 1.00 0.00 C ATOM 1792 O LYS A 115 -17.750 2.031 0.698 1.00 0.00 O ATOM 1793 CB LYS A 115 -17.659 4.685 2.283 1.00 0.00 C ATOM 1794 CG LYS A 115 -17.922 5.376 0.971 1.00 0.00 C ATOM 1795 CD LYS A 115 -19.111 4.814 0.242 1.00 0.00 C ATOM 1796 CE LYS A 115 -18.979 5.122 -1.211 1.00 0.00 C ATOM 1797 NZ LYS A 115 -20.111 4.580 -2.007 1.00 0.00 N ATOM 0 H LYS A 115 -15.180 4.642 1.674 1.00 0.00 H new ATOM 0 HA LYS A 115 -17.032 2.797 3.025 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -18.613 4.366 2.702 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -17.234 5.411 2.976 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -18.082 6.439 1.152 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -17.039 5.290 0.337 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -19.171 3.736 0.395 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -20.032 5.244 0.636 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -18.926 6.202 -1.348 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -18.043 4.707 -1.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -19.752 4.195 -2.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -20.582 3.824 -1.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -20.792 5.341 -2.204 1.00 0.00 H new ATOM 1811 N GLN A 116 -15.774 2.838 0.080 1.00 0.00 N ATOM 1812 CA GLN A 116 -15.787 2.017 -1.078 1.00 0.00 C ATOM 1813 C GLN A 116 -15.581 0.507 -0.772 1.00 0.00 C ATOM 1814 O GLN A 116 -15.805 -0.357 -1.600 1.00 0.00 O ATOM 1815 CB GLN A 116 -15.011 2.572 -2.259 1.00 0.00 C ATOM 1816 CG GLN A 116 -13.559 2.688 -2.001 1.00 0.00 C ATOM 1817 CD GLN A 116 -12.782 1.406 -2.326 1.00 0.00 C ATOM 1818 OE1 GLN A 116 -12.293 1.244 -3.438 1.00 0.00 O ATOM 1819 NE2 GLN A 116 -12.763 0.472 -1.457 1.00 0.00 N ATOM 0 H GLN A 116 -14.983 3.475 0.177 1.00 0.00 H new ATOM 0 HA GLN A 116 -16.812 2.060 -1.446 1.00 0.00 H new ATOM 0 HB2 GLN A 116 -15.169 1.928 -3.124 1.00 0.00 H new ATOM 0 HB3 GLN A 116 -15.407 3.554 -2.516 1.00 0.00 H new ATOM 0 HG2 GLN A 116 -13.156 3.509 -2.594 1.00 0.00 H new ATOM 0 HG3 GLN A 116 -13.402 2.944 -0.953 1.00 0.00 H new ATOM 0 HE21 GLN A 116 -13.175 0.624 -0.536 1.00 0.00 H new ATOM 0 HE22 GLN A 116 -12.336 -0.426 -1.683 1.00 0.00 H new ATOM 1828 N LEU A 117 -15.105 0.222 0.409 1.00 0.00 N ATOM 1829 CA LEU A 117 -15.058 -1.061 0.914 1.00 0.00 C ATOM 1830 C LEU A 117 -16.398 -1.404 1.526 1.00 0.00 C ATOM 1831 O LEU A 117 -16.705 -2.534 1.678 1.00 0.00 O ATOM 1832 CB LEU A 117 -13.856 -1.302 1.857 1.00 0.00 C ATOM 1833 CG LEU A 117 -14.005 -2.497 2.639 1.00 0.00 C ATOM 1834 CD1 LEU A 117 -13.238 -3.532 1.970 1.00 0.00 C ATOM 1835 CD2 LEU A 117 -13.664 -2.287 4.100 1.00 0.00 C ATOM 0 H LEU A 117 -14.733 0.927 1.045 1.00 0.00 H new ATOM 0 HA LEU A 117 -14.877 -1.754 0.093 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -12.942 -1.369 1.267 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -13.743 -0.447 2.523 1.00 0.00 H new ATOM 0 HG LEU A 117 -15.048 -2.811 2.689 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -13.320 -4.464 2.529 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -13.626 -3.678 0.962 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -12.191 -3.232 1.916 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -13.795 -3.223 4.642 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -12.629 -1.958 4.188 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -14.323 -1.528 4.522 1.00 0.00 H new ATOM 1847 N GLU A 118 -17.251 -0.413 1.731 1.00 0.00 N ATOM 1848 CA GLU A 118 -18.577 -0.636 2.196 1.00 0.00 C ATOM 1849 C GLU A 118 -19.469 -0.780 0.967 1.00 0.00 C ATOM 1850 O GLU A 118 -20.660 -0.842 1.029 1.00 0.00 O ATOM 1851 CB GLU A 118 -19.065 0.446 3.193 1.00 0.00 C ATOM 1852 CG GLU A 118 -20.406 0.126 3.889 1.00 0.00 C ATOM 1853 CD GLU A 118 -20.344 -1.151 4.713 1.00 0.00 C ATOM 1854 OE1 GLU A 118 -20.465 -2.268 4.149 1.00 0.00 O ATOM 1855 OE2 GLU A 118 -20.085 -1.082 5.944 1.00 0.00 O ATOM 0 H GLU A 118 -17.024 0.569 1.573 1.00 0.00 H new ATOM 0 HA GLU A 118 -18.616 -1.552 2.786 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -18.300 0.588 3.956 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -19.164 1.392 2.661 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -20.684 0.959 4.535 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -21.189 0.031 3.136 1.00 0.00 H new ATOM 1862 N GLU A 119 -18.807 -0.827 -0.152 1.00 0.00 N ATOM 1863 CA GLU A 119 -19.412 -1.136 -1.397 1.00 0.00 C ATOM 1864 C GLU A 119 -19.175 -2.599 -1.565 1.00 0.00 C ATOM 1865 O GLU A 119 -20.024 -3.381 -1.966 1.00 0.00 O ATOM 1866 CB GLU A 119 -18.691 -0.435 -2.519 1.00 0.00 C ATOM 1867 CG GLU A 119 -18.606 1.023 -2.346 1.00 0.00 C ATOM 1868 CD GLU A 119 -19.855 1.800 -2.559 1.00 0.00 C ATOM 1869 OE1 GLU A 119 -20.011 2.381 -3.646 1.00 0.00 O ATOM 1870 OE2 GLU A 119 -20.591 2.034 -1.594 1.00 0.00 O ATOM 0 H GLU A 119 -17.805 -0.645 -0.216 1.00 0.00 H new ATOM 0 HA GLU A 119 -20.461 -0.842 -1.417 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -17.683 -0.842 -2.602 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -19.200 -0.652 -3.458 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -18.249 1.224 -1.336 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -17.849 1.402 -3.033 1.00 0.00 H new ATOM 1877 N ALA A 120 -17.945 -2.944 -1.216 1.00 0.00 N ATOM 1878 CA ALA A 120 -17.446 -4.231 -1.278 1.00 0.00 C ATOM 1879 C ALA A 120 -18.054 -5.128 -0.270 1.00 0.00 C ATOM 1880 O ALA A 120 -18.621 -6.091 -0.600 1.00 0.00 O ATOM 1881 CB ALA A 120 -15.972 -4.171 -1.246 1.00 0.00 C ATOM 0 H ALA A 120 -17.264 -2.268 -0.869 1.00 0.00 H new ATOM 0 HA ALA A 120 -17.733 -4.693 -2.223 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -15.566 -5.181 -1.294 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -15.613 -3.594 -2.098 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -15.647 -3.693 -0.322 1.00 0.00 H new ATOM 1887 N LYS A 121 -17.958 -4.754 0.912 1.00 0.00 N ATOM 1888 CA LYS A 121 -18.517 -5.385 2.053 1.00 0.00 C ATOM 1889 C LYS A 121 -19.914 -5.665 1.920 1.00 0.00 C ATOM 1890 O LYS A 121 -20.330 -6.766 2.061 1.00 0.00 O ATOM 1891 CB LYS A 121 -18.260 -4.496 3.167 1.00 0.00 C ATOM 1892 CG LYS A 121 -17.065 -4.796 3.831 1.00 0.00 C ATOM 1893 CD LYS A 121 -16.623 -3.735 4.777 1.00 0.00 C ATOM 1894 CE LYS A 121 -17.701 -2.811 5.282 1.00 0.00 C ATOM 1895 NZ LYS A 121 -18.755 -3.410 6.142 1.00 0.00 N ATOM 0 H LYS A 121 -17.437 -3.913 1.160 1.00 0.00 H new ATOM 0 HA LYS A 121 -18.058 -6.363 2.198 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -18.222 -3.468 2.806 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -19.088 -4.555 3.873 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -17.189 -5.730 4.379 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -16.281 -4.961 3.092 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -16.151 -4.214 5.635 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -15.857 -3.134 4.286 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -17.223 -2.007 5.842 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -18.187 -2.354 4.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -19.610 -2.819 6.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -18.980 -4.366 5.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -18.414 -3.464 7.123 1.00 0.00 H new ATOM 1909 N ALA A 122 -20.583 -4.681 1.673 1.00 0.00 N ATOM 1910 CA ALA A 122 -21.941 -4.670 1.394 1.00 0.00 C ATOM 1911 C ALA A 122 -22.324 -5.495 0.170 1.00 0.00 C ATOM 1912 O ALA A 122 -23.501 -5.731 -0.082 1.00 0.00 O ATOM 1913 CB ALA A 122 -22.309 -3.309 1.181 1.00 0.00 C ATOM 0 H ALA A 122 -20.175 -3.746 1.652 1.00 0.00 H new ATOM 0 HA ALA A 122 -22.467 -5.124 2.234 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -23.374 -3.251 0.957 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -22.095 -2.729 2.079 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -21.740 -2.905 0.344 1.00 0.00 H new ATOM 1919 N ARG A 123 -21.336 -5.912 -0.611 1.00 0.00 N ATOM 1920 CA ARG A 123 -21.599 -6.720 -1.737 1.00 0.00 C ATOM 1921 C ARG A 123 -21.476 -8.128 -1.318 1.00 0.00 C ATOM 1922 O ARG A 123 -22.120 -9.030 -1.833 1.00 0.00 O ATOM 1923 CB ARG A 123 -20.610 -6.420 -2.853 1.00 0.00 C ATOM 1924 CG ARG A 123 -19.640 -7.563 -3.160 1.00 0.00 C ATOM 1925 CD ARG A 123 -18.438 -7.081 -3.892 1.00 0.00 C ATOM 1926 NE ARG A 123 -17.460 -8.151 -4.144 1.00 0.00 N ATOM 1927 CZ ARG A 123 -16.475 -8.136 -5.052 1.00 0.00 C ATOM 1928 NH1 ARG A 123 -16.349 -7.128 -5.923 1.00 0.00 N ATOM 1929 NH2 ARG A 123 -15.633 -9.142 -5.078 1.00 0.00 N ATOM 0 H ARG A 123 -20.351 -5.690 -0.464 1.00 0.00 H new ATOM 0 HA ARG A 123 -22.601 -6.518 -2.117 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -21.165 -6.177 -3.759 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -20.035 -5.534 -2.584 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -19.333 -8.040 -2.229 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -20.148 -8.322 -3.754 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -18.747 -6.645 -4.842 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -17.962 -6.287 -3.317 1.00 0.00 H new ATOM 0 HE ARG A 123 -17.540 -8.990 -3.569 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -17.010 -6.352 -5.904 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -15.592 -7.136 -6.606 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -15.737 -9.911 -4.417 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -14.874 -9.155 -5.760 1.00 0.00 H new ATOM 1943 N VAL A 124 -20.667 -8.263 -0.347 1.00 0.00 N ATOM 1944 CA VAL A 124 -20.206 -9.527 0.089 1.00 0.00 C ATOM 1945 C VAL A 124 -21.167 -10.068 1.029 1.00 0.00 C ATOM 1946 O VAL A 124 -21.768 -11.100 0.840 1.00 0.00 O ATOM 1947 CB VAL A 124 -18.856 -9.391 0.736 1.00 0.00 C ATOM 1948 CG1 VAL A 124 -18.396 -10.677 1.259 1.00 0.00 C ATOM 1949 CG2 VAL A 124 -17.865 -8.823 -0.199 1.00 0.00 C ATOM 0 H VAL A 124 -20.292 -7.479 0.186 1.00 0.00 H new ATOM 0 HA VAL A 124 -20.106 -10.201 -0.762 1.00 0.00 H new ATOM 0 HB VAL A 124 -18.960 -8.699 1.572 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -17.417 -10.552 1.722 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -19.105 -11.042 2.002 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -18.322 -11.396 0.443 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -16.900 -8.738 0.301 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -17.768 -9.475 -1.067 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -18.194 -7.835 -0.522 1.00 0.00 H new ATOM 1959 N GLN A 125 -21.301 -9.244 1.959 1.00 0.00 N ATOM 1960 CA GLN A 125 -22.189 -9.145 3.030 1.00 0.00 C ATOM 1961 C GLN A 125 -22.877 -10.400 3.622 1.00 0.00 C ATOM 1962 O GLN A 125 -22.872 -10.596 4.832 1.00 0.00 O ATOM 1963 CB GLN A 125 -23.048 -8.109 2.536 1.00 0.00 C ATOM 1964 CG GLN A 125 -23.988 -8.421 1.374 1.00 0.00 C ATOM 1965 CD GLN A 125 -25.422 -8.720 1.753 1.00 0.00 C ATOM 1966 OE1 GLN A 125 -25.722 -9.218 2.819 1.00 0.00 O ATOM 1967 NE2 GLN A 125 -26.324 -8.393 0.867 1.00 0.00 N ATOM 0 H GLN A 125 -20.654 -8.456 1.995 1.00 0.00 H new ATOM 0 HA GLN A 125 -21.668 -8.942 3.966 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -23.659 -7.762 3.370 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -22.416 -7.274 2.234 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -23.982 -7.574 0.688 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -23.590 -9.276 0.828 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -26.040 -7.976 -0.020 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -27.312 -8.554 1.062 1.00 0.00 H new ATOM 1976 N ALA A 126 -23.417 -11.203 2.784 1.00 0.00 N ATOM 1977 CA ALA A 126 -24.137 -12.301 3.098 1.00 0.00 C ATOM 1978 C ALA A 126 -23.257 -13.551 3.086 1.00 0.00 C ATOM 1979 O ALA A 126 -22.684 -13.945 4.101 1.00 0.00 O ATOM 1980 CB ALA A 126 -25.245 -12.382 2.114 1.00 0.00 C ATOM 0 H ALA A 126 -23.338 -11.063 1.777 1.00 0.00 H new ATOM 0 HA ALA A 126 -24.542 -12.235 4.108 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -25.858 -13.258 2.327 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -25.859 -11.484 2.183 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -24.833 -12.464 1.108 1.00 0.00 H new ATOM 1986 N GLN A 127 -23.154 -14.169 1.937 1.00 0.00 N ATOM 1987 CA GLN A 127 -22.382 -15.226 1.705 1.00 0.00 C ATOM 1988 C GLN A 127 -21.100 -14.768 1.109 1.00 0.00 C ATOM 1989 O GLN A 127 -21.104 -13.943 0.215 1.00 0.00 O ATOM 1990 CB GLN A 127 -23.135 -16.053 0.723 1.00 0.00 C ATOM 1991 CG GLN A 127 -23.648 -17.336 1.265 1.00 0.00 C ATOM 1992 CD GLN A 127 -22.555 -18.346 1.643 1.00 0.00 C ATOM 1993 OE1 GLN A 127 -21.435 -17.990 2.009 1.00 0.00 O ATOM 1994 NE2 GLN A 127 -22.877 -19.610 1.559 1.00 0.00 N ATOM 0 H GLN A 127 -23.676 -13.873 1.112 1.00 0.00 H new ATOM 0 HA GLN A 127 -22.153 -15.786 2.612 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -23.975 -15.471 0.345 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -22.487 -16.265 -0.127 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -24.254 -17.128 2.147 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -24.307 -17.791 0.526 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -23.812 -19.879 1.253 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -22.193 -20.328 1.800 1.00 0.00 H new ATOM 2003 N ARG A 128 -20.005 -15.285 1.619 1.00 0.00 N ATOM 2004 CA ARG A 128 -18.731 -14.988 1.098 1.00 0.00 C ATOM 2005 C ARG A 128 -18.555 -15.240 -0.369 1.00 0.00 C ATOM 2006 O ARG A 128 -17.647 -14.690 -0.963 1.00 0.00 O ATOM 2007 CB ARG A 128 -17.593 -15.630 1.803 1.00 0.00 C ATOM 2008 CG ARG A 128 -17.048 -14.882 2.961 1.00 0.00 C ATOM 2009 CD ARG A 128 -16.557 -13.521 2.512 1.00 0.00 C ATOM 2010 NE ARG A 128 -15.858 -13.486 1.186 1.00 0.00 N ATOM 2011 CZ ARG A 128 -14.729 -12.814 0.908 1.00 0.00 C ATOM 2012 NH1 ARG A 128 -13.914 -12.422 1.899 1.00 0.00 N ATOM 2013 NH2 ARG A 128 -14.402 -12.556 -0.362 1.00 0.00 N ATOM 0 H ARG A 128 -19.995 -15.926 2.413 1.00 0.00 H new ATOM 0 HA ARG A 128 -18.703 -13.913 1.275 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -17.912 -16.614 2.147 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -16.788 -15.789 1.085 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -17.817 -14.767 3.725 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -16.230 -15.442 3.414 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -17.410 -12.843 2.470 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -15.878 -13.132 3.270 1.00 0.00 H new ATOM 0 HE ARG A 128 -16.278 -14.021 0.426 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -14.151 -12.634 2.868 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -13.057 -11.912 1.683 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -15.010 -12.869 -1.119 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -13.545 -12.046 -0.574 1.00 0.00 H new ATOM 2027 N ALA A 129 -19.311 -16.158 -0.891 1.00 0.00 N ATOM 2028 CA ALA A 129 -19.312 -16.450 -2.265 1.00 0.00 C ATOM 2029 C ALA A 129 -19.710 -15.246 -3.096 1.00 0.00 C ATOM 2030 O ALA A 129 -20.854 -14.807 -3.072 1.00 0.00 O ATOM 2031 CB ALA A 129 -20.176 -17.603 -2.552 1.00 0.00 C ATOM 0 H ALA A 129 -19.956 -16.731 -0.346 1.00 0.00 H new ATOM 0 HA ALA A 129 -18.292 -16.711 -2.547 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -20.162 -17.811 -3.622 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -19.812 -18.475 -2.008 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -21.196 -17.380 -2.240 1.00 0.00 H new ATOM 2037 N GLU A 130 -18.751 -14.757 -3.826 1.00 0.00 N ATOM 2038 CA GLU A 130 -18.850 -13.577 -4.638 1.00 0.00 C ATOM 2039 C GLU A 130 -17.687 -13.531 -5.597 1.00 0.00 C ATOM 2040 O GLU A 130 -17.857 -13.355 -6.793 1.00 0.00 O ATOM 2041 CB GLU A 130 -19.037 -12.280 -3.799 1.00 0.00 C ATOM 2042 CG GLU A 130 -18.156 -12.180 -2.553 1.00 0.00 C ATOM 2043 CD GLU A 130 -16.751 -11.747 -2.774 1.00 0.00 C ATOM 2044 OE1 GLU A 130 -16.521 -10.578 -3.100 1.00 0.00 O ATOM 2045 OE2 GLU A 130 -15.843 -12.593 -2.594 1.00 0.00 O ATOM 0 H GLU A 130 -17.830 -15.193 -3.874 1.00 0.00 H new ATOM 0 HA GLU A 130 -19.762 -13.630 -5.232 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -18.835 -11.420 -4.438 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -20.081 -12.211 -3.493 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -18.624 -11.483 -1.858 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -18.141 -13.155 -2.065 1.00 0.00 H new ATOM 2052 N GLN A 131 -16.509 -13.684 -5.062 1.00 0.00 N ATOM 2053 CA GLN A 131 -15.325 -13.864 -5.904 1.00 0.00 C ATOM 2054 C GLN A 131 -14.564 -15.082 -5.414 1.00 0.00 C ATOM 2055 O GLN A 131 -13.367 -15.241 -5.639 1.00 0.00 O ATOM 2056 CB GLN A 131 -14.426 -12.600 -5.980 1.00 0.00 C ATOM 2057 CG GLN A 131 -13.668 -12.227 -4.716 1.00 0.00 C ATOM 2058 CD GLN A 131 -12.801 -10.994 -4.908 1.00 0.00 C ATOM 2059 OE1 GLN A 131 -13.125 -10.093 -5.693 1.00 0.00 O ATOM 2060 NE2 GLN A 131 -11.687 -10.947 -4.224 1.00 0.00 N ATOM 0 H GLN A 131 -16.327 -13.690 -4.058 1.00 0.00 H new ATOM 0 HA GLN A 131 -15.653 -14.026 -6.931 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -13.702 -12.745 -6.781 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -15.051 -11.754 -6.265 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -14.378 -12.047 -3.909 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -13.042 -13.065 -4.409 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -11.448 -11.705 -3.585 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -11.057 -10.152 -4.330 1.00 0.00 H new ATOM 2069 N GLN A 132 -15.314 -15.959 -4.777 1.00 0.00 N ATOM 2070 CA GLN A 132 -14.797 -17.188 -4.236 1.00 0.00 C ATOM 2071 C GLN A 132 -14.693 -18.226 -5.304 1.00 0.00 C ATOM 2072 O GLN A 132 -13.637 -18.804 -5.555 1.00 0.00 O ATOM 2073 CB GLN A 132 -15.715 -17.710 -3.145 1.00 0.00 C ATOM 2074 CG GLN A 132 -15.710 -16.875 -1.907 1.00 0.00 C ATOM 2075 CD GLN A 132 -14.363 -16.819 -1.193 1.00 0.00 C ATOM 2076 OE1 GLN A 132 -14.038 -15.834 -0.546 1.00 0.00 O ATOM 2077 NE2 GLN A 132 -13.581 -17.872 -1.293 1.00 0.00 N ATOM 0 H GLN A 132 -16.314 -15.831 -4.621 1.00 0.00 H new ATOM 0 HA GLN A 132 -13.809 -16.984 -3.824 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -16.732 -17.763 -3.533 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -15.418 -18.727 -2.888 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -16.013 -15.861 -2.166 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -16.458 -17.265 -1.217 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -13.880 -18.679 -1.840 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -12.676 -17.881 -0.823 1.00 0.00 H new ATOM 2086 N ALA A 133 -15.809 -18.443 -5.877 1.00 0.00 N ATOM 2087 CA ALA A 133 -16.080 -19.359 -6.910 1.00 0.00 C ATOM 2088 C ALA A 133 -17.453 -18.976 -7.328 1.00 0.00 C ATOM 2089 O ALA A 133 -17.728 -18.906 -8.518 1.00 0.00 O ATOM 2090 CB ALA A 133 -16.065 -20.791 -6.393 1.00 0.00 C ATOM 2091 OXT ALA A 133 -18.215 -18.576 -6.393 1.00 0.00 O ATOM 0 H ALA A 133 -16.646 -17.927 -5.604 1.00 0.00 H new ATOM 0 HA ALA A 133 -15.346 -19.327 -7.715 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -16.278 -21.476 -7.214 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -15.083 -21.017 -5.976 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -16.823 -20.906 -5.618 1.00 0.00 H new TER 2097 ALA A 133