USER MOD reduce.3.24.130724 H: found=0, std=0, add=1230, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1230 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 85 ASN : amide:sc= -0.906 K(o=-0.36,f=-5.2!) USER MOD Set 1.2: A 107 LYS NZ :NH3+ -123:sc= 0.551 (180deg=-0.18) USER MOD Set 2.1: A 50 GLN : amide:sc= -4.53! C(o=-6.3!,f=-13!) USER MOD Set 2.2: A 129 ASN : amide:sc= -1.79 K(o=-6.3,f=-7.9!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 ASN : amide:sc= -0.426 K(o=-0.43,f=-3.6!) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= -0.25 K(o=-0.25,f=-2!) USER MOD Single : A 32 ASN : amide:sc= -0.198 K(o=-0.2,f=-1.7!) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 GLN : amide:sc= -3.55 K(o=-3.6,f=-9!) USER MOD Single : A 48 TYR OH : rot 168:sc= -0.405! USER MOD Single : A 53 LYS NZ :NH3+ -158:sc= -0.258 (180deg=-1.02) USER MOD Single : A 54 MET CE :methyl 171:sc= 0 (180deg=-0.175) USER MOD Single : A 57 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 MET CE :methyl -152:sc= -9.3! (180deg=-12.1!) USER MOD Single : A 64 CYS SG : rot -170:sc= -0.299 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 CYS SG : rot -140:sc= -2.04 USER MOD Single : A 73 HIS : no HD1:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 ASN : amide:sc= -0.396 X(o=-0.4,f=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 TYR OH : rot 7:sc= -4.91! USER MOD Single : A 109 ASN : amide:sc= -4.44 K(o=-4.4,f=-10!) USER MOD Single : A 115 SER OG : rot 123:sc= -2.29 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 TYR OH : rot -165:sc= -1.79! USER MOD Single : A 125 HIS : no HD1:sc= -6.29 K(o=-6.3,f=-7.3!) USER MOD Single : A 127 LYS NZ :NH3+ -112:sc= -0.0106 (180deg=-0.248) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 THR OG1 : rot 180:sc= 0.0457 USER MOD Single : A 143 GLN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : B 1 MET CE :methyl -165:sc= -0.0303 (180deg=-0.059) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 SER OG : rot 180:sc= 0 USER MOD Single : B 5 HIS : no HD1:sc= -0.203 X(o=-0.2,f=-0.022) USER MOD Single : B 6 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : B 7 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD Single : B 8 HIS : no HD1:sc= -0.886 K(o=-0.89,f=-2.1) USER MOD Single : B 9 HIS : no HD1:sc= -0.26 X(o=-0.26,f=-0.6) USER MOD Single : B 10 HIS : no HE2:sc= -0.979 K(o=-0.98,f=-2.8!) USER MOD Single : B 11 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET B 1 -43.568 -15.763 14.769 1.00 0.00 N ATOM 2 CA MET B 1 -44.041 -16.893 15.610 1.00 0.00 C ATOM 3 C MET B 1 -43.203 -17.026 16.878 1.00 0.00 C ATOM 4 O MET B 1 -43.735 -17.013 17.989 1.00 0.00 O ATOM 5 CB MET B 1 -43.962 -18.180 14.786 1.00 0.00 C ATOM 6 CG MET B 1 -44.649 -19.366 15.442 1.00 0.00 C ATOM 7 SD MET B 1 -46.443 -19.184 15.500 1.00 0.00 S ATOM 8 CE MET B 1 -46.690 -18.818 17.235 1.00 0.00 C ATOM 0 H1 MET B 1 -44.156 -15.697 13.914 1.00 0.00 H new ATOM 0 H2 MET B 1 -43.639 -14.876 15.308 1.00 0.00 H new ATOM 0 H3 MET B 1 -42.577 -15.924 14.496 1.00 0.00 H new ATOM 0 HA MET B 1 -45.070 -16.705 15.916 1.00 0.00 H new ATOM 0 HB2 MET B 1 -44.413 -18.004 13.809 1.00 0.00 H new ATOM 0 HB3 MET B 1 -42.915 -18.427 14.614 1.00 0.00 H new ATOM 0 HG2 MET B 1 -44.397 -20.275 14.895 1.00 0.00 H new ATOM 0 HG3 MET B 1 -44.267 -19.487 16.456 1.00 0.00 H new ATOM 0 HE1 MET B 1 -47.744 -18.941 17.486 1.00 0.00 H new ATOM 0 HE2 MET B 1 -46.091 -19.499 17.839 1.00 0.00 H new ATOM 0 HE3 MET B 1 -46.386 -17.791 17.437 1.00 0.00 H new ATOM 20 N ARG B 2 -41.892 -17.154 16.705 1.00 0.00 N ATOM 21 CA ARG B 2 -40.981 -17.288 17.838 1.00 0.00 C ATOM 22 C ARG B 2 -40.986 -16.024 18.692 1.00 0.00 C ATOM 23 O ARG B 2 -41.085 -16.092 19.917 1.00 0.00 O ATOM 24 CB ARG B 2 -39.562 -17.581 17.347 1.00 0.00 C ATOM 25 CG ARG B 2 -39.421 -18.932 16.663 1.00 0.00 C ATOM 26 CD ARG B 2 -38.474 -18.860 15.475 1.00 0.00 C ATOM 27 NE ARG B 2 -37.643 -20.055 15.364 1.00 0.00 N ATOM 28 CZ ARG B 2 -38.115 -21.260 15.053 1.00 0.00 C ATOM 29 NH1 ARG B 2 -39.410 -21.433 14.822 1.00 0.00 N ATOM 30 NH2 ARG B 2 -37.289 -22.295 14.972 1.00 0.00 N ATOM 0 H ARG B 2 -41.436 -17.168 15.793 1.00 0.00 H new ATOM 0 HA ARG B 2 -41.324 -18.121 18.452 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -39.258 -16.798 16.652 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -38.877 -17.539 18.194 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -39.053 -19.667 17.379 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -40.400 -19.276 16.329 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -39.051 -18.733 14.559 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -37.835 -17.982 15.573 1.00 0.00 H new ATOM 0 HE ARG B 2 -36.642 -19.961 15.535 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -40.049 -20.640 14.882 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -39.766 -22.359 14.584 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -36.292 -22.167 15.148 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -37.650 -23.219 14.734 1.00 0.00 H new ATOM 44 N GLY B 3 -40.875 -14.873 18.038 1.00 0.00 N ATOM 45 CA GLY B 3 -40.867 -13.611 18.753 1.00 0.00 C ATOM 46 C GLY B 3 -40.226 -12.493 17.955 1.00 0.00 C ATOM 47 O GLY B 3 -39.511 -12.746 16.985 1.00 0.00 O ATOM 0 H GLY B 3 -40.790 -14.792 17.025 1.00 0.00 H new ATOM 0 HA2 GLY B 3 -41.891 -13.333 19.003 1.00 0.00 H new ATOM 0 HA3 GLY B 3 -40.331 -13.734 19.694 1.00 0.00 H new ATOM 51 N SER B 4 -40.483 -11.256 18.363 1.00 0.00 N ATOM 52 CA SER B 4 -39.927 -10.093 17.679 1.00 0.00 C ATOM 53 C SER B 4 -40.347 -10.068 16.213 1.00 0.00 C ATOM 54 O SER B 4 -39.683 -10.652 15.357 1.00 0.00 O ATOM 55 CB SER B 4 -38.401 -10.095 17.784 1.00 0.00 C ATOM 56 OG SER B 4 -37.967 -9.396 18.939 1.00 0.00 O ATOM 0 H SER B 4 -41.073 -11.032 19.164 1.00 0.00 H new ATOM 0 HA SER B 4 -40.317 -9.198 18.164 1.00 0.00 H new ATOM 0 HB2 SER B 4 -38.037 -11.122 17.819 1.00 0.00 H new ATOM 0 HB3 SER B 4 -37.972 -9.635 16.894 1.00 0.00 H new ATOM 0 HG SER B 4 -36.988 -9.414 18.983 1.00 0.00 H new ATOM 62 N HIS B 5 -41.456 -9.391 15.932 1.00 0.00 N ATOM 63 CA HIS B 5 -41.965 -9.292 14.569 1.00 0.00 C ATOM 64 C HIS B 5 -41.569 -7.963 13.935 1.00 0.00 C ATOM 65 O HIS B 5 -41.660 -6.910 14.567 1.00 0.00 O ATOM 66 CB HIS B 5 -43.487 -9.440 14.559 1.00 0.00 C ATOM 67 CG HIS B 5 -44.007 -10.195 13.376 1.00 0.00 C ATOM 68 ND1 HIS B 5 -45.133 -9.814 12.676 1.00 0.00 N ATOM 69 CD2 HIS B 5 -43.549 -11.314 12.766 1.00 0.00 C ATOM 70 CE1 HIS B 5 -45.346 -10.666 11.689 1.00 0.00 C ATOM 71 NE2 HIS B 5 -44.399 -11.585 11.722 1.00 0.00 N ATOM 0 H HIS B 5 -42.019 -8.903 16.629 1.00 0.00 H new ATOM 0 HA HIS B 5 -41.524 -10.099 13.984 1.00 0.00 H new ATOM 0 HB2 HIS B 5 -43.800 -9.949 15.471 1.00 0.00 H new ATOM 0 HB3 HIS B 5 -43.940 -8.449 14.575 1.00 0.00 H new ATOM 0 HD2 HIS B 5 -42.678 -11.887 13.048 1.00 0.00 H new ATOM 0 HE1 HIS B 5 -46.157 -10.619 10.977 1.00 0.00 H new ATOM 0 HE2 HIS B 5 -44.313 -12.370 11.076 1.00 0.00 H new ATOM 80 N HIS B 6 -41.129 -8.019 12.682 1.00 0.00 N ATOM 81 CA HIS B 6 -40.719 -6.819 11.963 1.00 0.00 C ATOM 82 C HIS B 6 -41.330 -6.788 10.566 1.00 0.00 C ATOM 83 O HIS B 6 -42.090 -7.681 10.190 1.00 0.00 O ATOM 84 CB HIS B 6 -39.193 -6.750 11.872 1.00 0.00 C ATOM 85 CG HIS B 6 -38.607 -5.553 12.552 1.00 0.00 C ATOM 86 ND1 HIS B 6 -38.530 -4.310 11.956 1.00 0.00 N ATOM 87 CD2 HIS B 6 -38.067 -5.409 13.786 1.00 0.00 C ATOM 88 CE1 HIS B 6 -37.968 -3.456 12.794 1.00 0.00 C ATOM 89 NE2 HIS B 6 -37.679 -4.098 13.911 1.00 0.00 N ATOM 0 H HIS B 6 -41.047 -8.882 12.144 1.00 0.00 H new ATOM 0 HA HIS B 6 -41.080 -5.951 12.515 1.00 0.00 H new ATOM 0 HB2 HIS B 6 -38.770 -7.652 12.314 1.00 0.00 H new ATOM 0 HB3 HIS B 6 -38.900 -6.741 10.822 1.00 0.00 H new ATOM 0 HD2 HIS B 6 -37.961 -6.182 14.533 1.00 0.00 H new ATOM 0 HE1 HIS B 6 -37.778 -2.411 12.598 1.00 0.00 H new ATOM 0 HE2 HIS B 6 -37.239 -3.686 14.734 1.00 0.00 H new ATOM 98 N HIS B 7 -40.994 -5.754 9.801 1.00 0.00 N ATOM 99 CA HIS B 7 -41.511 -5.607 8.445 1.00 0.00 C ATOM 100 C HIS B 7 -40.381 -5.326 7.459 1.00 0.00 C ATOM 101 O HIS B 7 -39.265 -4.992 7.857 1.00 0.00 O ATOM 102 CB HIS B 7 -42.542 -4.477 8.390 1.00 0.00 C ATOM 103 CG HIS B 7 -43.839 -4.817 9.057 1.00 0.00 C ATOM 104 ND1 HIS B 7 -44.694 -5.792 8.587 1.00 0.00 N ATOM 105 CD2 HIS B 7 -44.426 -4.306 10.164 1.00 0.00 C ATOM 106 CE1 HIS B 7 -45.751 -5.865 9.375 1.00 0.00 C ATOM 107 NE2 HIS B 7 -45.614 -4.974 10.340 1.00 0.00 N ATOM 0 H HIS B 7 -40.367 -5.006 10.097 1.00 0.00 H new ATOM 0 HA HIS B 7 -41.992 -6.544 8.163 1.00 0.00 H new ATOM 0 HB2 HIS B 7 -42.122 -3.589 8.863 1.00 0.00 H new ATOM 0 HB3 HIS B 7 -42.735 -4.222 7.348 1.00 0.00 H new ATOM 0 HD2 HIS B 7 -44.034 -3.520 10.792 1.00 0.00 H new ATOM 0 HE1 HIS B 7 -46.586 -6.539 9.251 1.00 0.00 H new ATOM 0 HE2 HIS B 7 -46.281 -4.809 11.093 1.00 0.00 H new ATOM 116 N HIS B 8 -40.679 -5.466 6.172 1.00 0.00 N ATOM 117 CA HIS B 8 -39.689 -5.229 5.128 1.00 0.00 C ATOM 118 C HIS B 8 -40.343 -4.630 3.887 1.00 0.00 C ATOM 119 O HIS B 8 -39.909 -4.879 2.762 1.00 0.00 O ATOM 120 CB HIS B 8 -38.976 -6.533 4.764 1.00 0.00 C ATOM 121 CG HIS B 8 -38.570 -7.346 5.954 1.00 0.00 C ATOM 122 ND1 HIS B 8 -39.454 -8.124 6.672 1.00 0.00 N ATOM 123 CD2 HIS B 8 -37.364 -7.501 6.553 1.00 0.00 C ATOM 124 CE1 HIS B 8 -38.811 -8.721 7.660 1.00 0.00 C ATOM 125 NE2 HIS B 8 -37.542 -8.360 7.608 1.00 0.00 N ATOM 0 H HIS B 8 -41.598 -5.742 5.827 1.00 0.00 H new ATOM 0 HA HIS B 8 -38.956 -4.519 5.511 1.00 0.00 H new ATOM 0 HB2 HIS B 8 -39.632 -7.132 4.132 1.00 0.00 H new ATOM 0 HB3 HIS B 8 -38.090 -6.300 4.174 1.00 0.00 H new ATOM 0 HD2 HIS B 8 -36.436 -7.035 6.255 1.00 0.00 H new ATOM 0 HE1 HIS B 8 -39.249 -9.390 8.386 1.00 0.00 H new ATOM 0 HE2 HIS B 8 -36.812 -8.670 8.249 1.00 0.00 H new ATOM 134 N HIS B 9 -41.390 -3.840 4.100 1.00 0.00 N ATOM 135 CA HIS B 9 -42.106 -3.206 3.000 1.00 0.00 C ATOM 136 C HIS B 9 -43.200 -2.282 3.526 1.00 0.00 C ATOM 137 O HIS B 9 -43.255 -1.986 4.720 1.00 0.00 O ATOM 138 CB HIS B 9 -42.713 -4.272 2.081 1.00 0.00 C ATOM 139 CG HIS B 9 -42.013 -4.391 0.763 1.00 0.00 C ATOM 140 ND1 HIS B 9 -41.387 -5.547 0.346 1.00 0.00 N ATOM 141 CD2 HIS B 9 -41.842 -3.492 -0.235 1.00 0.00 C ATOM 142 CE1 HIS B 9 -40.861 -5.353 -0.849 1.00 0.00 C ATOM 143 NE2 HIS B 9 -41.123 -4.115 -1.224 1.00 0.00 N ATOM 0 H HIS B 9 -41.761 -3.624 5.025 1.00 0.00 H new ATOM 0 HA HIS B 9 -41.396 -2.607 2.429 1.00 0.00 H new ATOM 0 HB2 HIS B 9 -42.684 -5.237 2.588 1.00 0.00 H new ATOM 0 HB3 HIS B 9 -43.763 -4.035 1.906 1.00 0.00 H new ATOM 0 HD2 HIS B 9 -42.204 -2.475 -0.250 1.00 0.00 H new ATOM 0 HE1 HIS B 9 -40.310 -6.083 -1.423 1.00 0.00 H new ATOM 0 HE2 HIS B 9 -40.837 -3.690 -2.106 1.00 0.00 H new ATOM 152 N HIS B 10 -44.071 -1.827 2.628 1.00 0.00 N ATOM 153 CA HIS B 10 -45.165 -0.936 3.002 1.00 0.00 C ATOM 154 C HIS B 10 -45.935 -1.484 4.201 1.00 0.00 C ATOM 155 O HIS B 10 -46.505 -2.573 4.139 1.00 0.00 O ATOM 156 CB HIS B 10 -46.115 -0.738 1.819 1.00 0.00 C ATOM 157 CG HIS B 10 -46.582 -2.021 1.205 1.00 0.00 C ATOM 158 ND1 HIS B 10 -47.554 -2.818 1.773 1.00 0.00 N ATOM 159 CD2 HIS B 10 -46.205 -2.646 0.064 1.00 0.00 C ATOM 160 CE1 HIS B 10 -47.753 -3.878 1.009 1.00 0.00 C ATOM 161 NE2 HIS B 10 -46.949 -3.797 -0.034 1.00 0.00 N ATOM 0 H HIS B 10 -44.040 -2.061 1.636 1.00 0.00 H new ATOM 0 HA HIS B 10 -44.735 0.026 3.281 1.00 0.00 H new ATOM 0 HB2 HIS B 10 -46.982 -0.167 2.151 1.00 0.00 H new ATOM 0 HB3 HIS B 10 -45.614 -0.141 1.057 1.00 0.00 H new ATOM 0 HD1 HIS B 10 -48.043 -2.620 2.646 1.00 0.00 H new ATOM 0 HD2 HIS B 10 -45.459 -2.304 -0.638 1.00 0.00 H new ATOM 0 HE1 HIS B 10 -48.455 -4.675 1.205 1.00 0.00 H new ATOM 170 N THR B 11 -45.943 -0.723 5.291 1.00 0.00 N ATOM 171 CA THR B 11 -46.638 -1.132 6.506 1.00 0.00 C ATOM 172 C THR B 11 -48.121 -1.373 6.234 1.00 0.00 C ATOM 173 O THR B 11 -48.735 -0.679 5.425 1.00 0.00 O ATOM 174 CB THR B 11 -46.474 -0.070 7.594 1.00 0.00 C ATOM 175 OG1 THR B 11 -47.154 1.121 7.241 1.00 0.00 O ATOM 176 CG2 THR B 11 -45.028 0.289 7.864 1.00 0.00 C ATOM 0 H THR B 11 -45.475 0.181 5.357 1.00 0.00 H new ATOM 0 HA THR B 11 -46.195 -2.067 6.849 1.00 0.00 H new ATOM 0 HB THR B 11 -46.898 -0.512 8.496 1.00 0.00 H new ATOM 0 HG1 THR B 11 -47.038 1.787 7.951 1.00 0.00 H new ATOM 0 HG21 THR B 11 -44.981 1.047 8.646 1.00 0.00 H new ATOM 0 HG22 THR B 11 -44.487 -0.600 8.188 1.00 0.00 H new ATOM 0 HG23 THR B 11 -44.574 0.679 6.953 1.00 0.00 H new ATOM 184 N ASP B 12 -48.687 -2.362 6.917 1.00 0.00 N ATOM 185 CA ASP B 12 -50.098 -2.697 6.753 1.00 0.00 C ATOM 186 C ASP B 12 -50.832 -2.623 8.089 1.00 0.00 C ATOM 187 O ASP B 12 -51.075 -3.645 8.731 1.00 0.00 O ATOM 188 CB ASP B 12 -50.245 -4.097 6.154 1.00 0.00 C ATOM 189 CG ASP B 12 -49.403 -5.127 6.882 1.00 0.00 C ATOM 190 OD1 ASP B 12 -48.161 -4.987 6.880 1.00 0.00 O ATOM 191 OD2 ASP B 12 -49.984 -6.073 7.454 1.00 0.00 O ATOM 0 H ASP B 12 -48.191 -2.946 7.590 1.00 0.00 H new ATOM 0 HA ASP B 12 -50.543 -1.970 6.073 1.00 0.00 H new ATOM 0 HB2 ASP B 12 -51.292 -4.397 6.190 1.00 0.00 H new ATOM 0 HB3 ASP B 12 -49.956 -4.072 5.103 1.00 0.00 H new ATOM 196 N PRO B 13 -51.193 -1.405 8.530 1.00 0.00 N ATOM 197 CA PRO B 13 -51.901 -1.202 9.798 1.00 0.00 C ATOM 198 C PRO B 13 -53.344 -1.693 9.744 1.00 0.00 C ATOM 199 O PRO B 13 -53.879 -2.182 10.738 1.00 0.00 O ATOM 200 CB PRO B 13 -51.859 0.316 9.988 1.00 0.00 C ATOM 201 CG PRO B 13 -51.747 0.866 8.608 1.00 0.00 C ATOM 202 CD PRO B 13 -50.939 -0.133 7.826 1.00 0.00 C ATOM 0 HA PRO B 13 -51.443 -1.761 10.614 1.00 0.00 H new ATOM 0 HB2 PRO B 13 -52.758 0.678 10.487 1.00 0.00 H new ATOM 0 HB3 PRO B 13 -51.011 0.615 10.604 1.00 0.00 H new ATOM 0 HG2 PRO B 13 -52.732 1.005 8.163 1.00 0.00 H new ATOM 0 HG3 PRO B 13 -51.260 1.841 8.615 1.00 0.00 H new ATOM 0 HD2 PRO B 13 -51.257 -0.180 6.784 1.00 0.00 H new ATOM 0 HD3 PRO B 13 -49.879 0.121 7.825 1.00 0.00 H new ATOM 210 N MET B 14 -53.967 -1.558 8.578 1.00 0.00 N ATOM 211 CA MET B 14 -55.349 -1.986 8.398 1.00 0.00 C ATOM 212 C MET B 14 -55.539 -2.665 7.041 1.00 0.00 C ATOM 213 O MET B 14 -55.667 -1.993 6.018 1.00 0.00 O ATOM 214 CB MET B 14 -56.295 -0.790 8.517 1.00 0.00 C ATOM 215 CG MET B 14 -57.731 -1.178 8.827 1.00 0.00 C ATOM 216 SD MET B 14 -58.622 -1.761 7.372 1.00 0.00 S ATOM 217 CE MET B 14 -60.052 -2.522 8.135 1.00 0.00 C ATOM 0 H MET B 14 -53.537 -1.156 7.745 1.00 0.00 H new ATOM 0 HA MET B 14 -55.583 -2.707 9.181 1.00 0.00 H new ATOM 0 HB2 MET B 14 -55.930 -0.125 9.300 1.00 0.00 H new ATOM 0 HB3 MET B 14 -56.273 -0.226 7.584 1.00 0.00 H new ATOM 0 HG2 MET B 14 -57.736 -1.958 9.588 1.00 0.00 H new ATOM 0 HG3 MET B 14 -58.253 -0.318 9.248 1.00 0.00 H new ATOM 0 HE1 MET B 14 -60.702 -2.931 7.362 1.00 0.00 H new ATOM 0 HE2 MET B 14 -59.727 -3.324 8.798 1.00 0.00 H new ATOM 0 HE3 MET B 14 -60.598 -1.775 8.710 1.00 0.00 H new TER 227 MET B 14 ATOM 228 N PRO A 15 -55.560 -4.010 7.014 1.00 0.00 N ATOM 229 CA PRO A 15 -55.738 -4.770 5.772 1.00 0.00 C ATOM 230 C PRO A 15 -56.938 -4.287 4.964 1.00 0.00 C ATOM 231 O PRO A 15 -58.085 -4.457 5.377 1.00 0.00 O ATOM 232 CB PRO A 15 -55.963 -6.202 6.260 1.00 0.00 C ATOM 233 CG PRO A 15 -55.278 -6.264 7.580 1.00 0.00 C ATOM 234 CD PRO A 15 -55.416 -4.894 8.186 1.00 0.00 C ATOM 0 HA PRO A 15 -54.884 -4.663 5.103 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -57.026 -6.426 6.355 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -55.545 -6.928 5.563 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -55.732 -7.021 8.220 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -54.229 -6.534 7.462 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -56.283 -4.832 8.844 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -54.543 -4.630 8.783 1.00 0.00 H new ATOM 242 N LYS A 16 -56.666 -3.684 3.812 1.00 0.00 N ATOM 243 CA LYS A 16 -57.724 -3.176 2.946 1.00 0.00 C ATOM 244 C LYS A 16 -57.550 -3.682 1.518 1.00 0.00 C ATOM 245 O LYS A 16 -58.440 -4.329 0.965 1.00 0.00 O ATOM 246 CB LYS A 16 -57.732 -1.645 2.965 1.00 0.00 C ATOM 247 CG LYS A 16 -59.096 -1.048 3.272 1.00 0.00 C ATOM 248 CD LYS A 16 -59.010 0.454 3.491 1.00 0.00 C ATOM 249 CE LYS A 16 -58.666 1.187 2.205 1.00 0.00 C ATOM 250 NZ LYS A 16 -59.436 2.453 2.064 1.00 0.00 N ATOM 0 H LYS A 16 -55.722 -3.535 3.456 1.00 0.00 H new ATOM 0 HA LYS A 16 -58.679 -3.542 3.324 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -57.016 -1.295 3.709 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -57.392 -1.276 1.997 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -59.780 -1.258 2.450 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -59.511 -1.523 4.161 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -59.961 0.821 3.877 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -58.255 0.670 4.247 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -57.599 1.408 2.187 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -58.872 0.540 1.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -59.172 2.922 1.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -60.454 2.241 2.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -59.220 3.081 2.864 1.00 0.00 H new ATOM 264 N ASN A 17 -56.400 -3.380 0.926 1.00 0.00 N ATOM 265 CA ASN A 17 -56.109 -3.801 -0.440 1.00 0.00 C ATOM 266 C ASN A 17 -57.119 -3.211 -1.417 1.00 0.00 C ATOM 267 O ASN A 17 -58.208 -3.754 -1.604 1.00 0.00 O ATOM 268 CB ASN A 17 -56.118 -5.328 -0.538 1.00 0.00 C ATOM 269 CG ASN A 17 -55.359 -5.833 -1.750 1.00 0.00 C ATOM 270 OD1 ASN A 17 -55.911 -5.930 -2.847 1.00 0.00 O ATOM 271 ND2 ASN A 17 -54.085 -6.158 -1.559 1.00 0.00 N ATOM 0 H ASN A 17 -55.654 -2.845 1.370 1.00 0.00 H new ATOM 0 HA ASN A 17 -55.118 -3.433 -0.704 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -55.677 -5.750 0.365 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -57.148 -5.680 -0.585 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -53.524 -6.503 -2.338 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -53.667 -6.062 -0.633 1.00 0.00 H new ATOM 278 N LYS A 18 -56.750 -2.096 -2.039 1.00 0.00 N ATOM 279 CA LYS A 18 -57.624 -1.431 -3.000 1.00 0.00 C ATOM 280 C LYS A 18 -56.870 -1.105 -4.284 1.00 0.00 C ATOM 281 O LYS A 18 -57.363 -1.351 -5.385 1.00 0.00 O ATOM 282 CB LYS A 18 -58.204 -0.152 -2.391 1.00 0.00 C ATOM 283 CG LYS A 18 -59.712 -0.035 -2.546 1.00 0.00 C ATOM 284 CD LYS A 18 -60.115 1.330 -3.083 1.00 0.00 C ATOM 285 CE LYS A 18 -59.846 1.443 -4.575 1.00 0.00 C ATOM 286 NZ LYS A 18 -60.480 2.656 -5.163 1.00 0.00 N ATOM 0 H LYS A 18 -55.852 -1.634 -1.895 1.00 0.00 H new ATOM 0 HA LYS A 18 -58.441 -2.110 -3.245 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -57.952 -0.117 -1.331 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -57.731 0.711 -2.860 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -60.070 -0.812 -3.221 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -60.192 -0.204 -1.582 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -61.174 1.500 -2.889 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -59.565 2.108 -2.553 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -58.770 1.475 -4.749 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -60.224 0.554 -5.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -60.273 2.697 -6.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -61.509 2.614 -5.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -60.101 3.506 -4.699 1.00 0.00 H new ATOM 300 N GLY A 19 -55.671 -0.550 -4.136 1.00 0.00 N ATOM 301 CA GLY A 19 -54.867 -0.200 -5.292 1.00 0.00 C ATOM 302 C GLY A 19 -53.888 -1.294 -5.669 1.00 0.00 C ATOM 303 O GLY A 19 -54.235 -2.476 -5.662 1.00 0.00 O ATOM 0 H GLY A 19 -55.242 -0.336 -3.236 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -55.523 0.004 -6.138 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -54.318 0.719 -5.085 1.00 0.00 H new ATOM 307 N LYS A 20 -52.663 -0.903 -5.999 1.00 0.00 N ATOM 308 CA LYS A 20 -51.631 -1.860 -6.379 1.00 0.00 C ATOM 309 C LYS A 20 -50.350 -1.624 -5.583 1.00 0.00 C ATOM 310 O LYS A 20 -50.079 -0.507 -5.144 1.00 0.00 O ATOM 311 CB LYS A 20 -51.342 -1.760 -7.878 1.00 0.00 C ATOM 312 CG LYS A 20 -52.463 -2.307 -8.751 1.00 0.00 C ATOM 313 CD LYS A 20 -52.913 -1.290 -9.787 1.00 0.00 C ATOM 314 CE LYS A 20 -53.909 -0.300 -9.204 1.00 0.00 C ATOM 315 NZ LYS A 20 -55.277 -0.493 -9.763 1.00 0.00 N ATOM 0 H LYS A 20 -52.360 0.071 -6.011 1.00 0.00 H new ATOM 0 HA LYS A 20 -51.997 -2.862 -6.153 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -51.167 -0.716 -8.137 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -50.423 -2.302 -8.100 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -52.124 -3.213 -9.253 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -53.309 -2.587 -8.124 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -52.046 -0.752 -10.170 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -53.366 -1.807 -10.633 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -53.941 -0.412 -8.120 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -53.573 0.716 -9.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -55.926 0.201 -9.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -55.252 -0.361 -10.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -55.609 -1.454 -9.545 1.00 0.00 H new ATOM 329 N GLY A 21 -49.570 -2.683 -5.399 1.00 0.00 N ATOM 330 CA GLY A 21 -48.330 -2.569 -4.653 1.00 0.00 C ATOM 331 C GLY A 21 -47.134 -2.307 -5.547 1.00 0.00 C ATOM 332 O GLY A 21 -46.083 -2.928 -5.386 1.00 0.00 O ATOM 0 H GLY A 21 -49.774 -3.618 -5.753 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -48.420 -1.761 -3.927 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -48.164 -3.487 -4.089 1.00 0.00 H new ATOM 336 N GLY A 22 -47.292 -1.385 -6.490 1.00 0.00 N ATOM 337 CA GLY A 22 -46.207 -1.060 -7.397 1.00 0.00 C ATOM 338 C GLY A 22 -45.535 0.255 -7.052 1.00 0.00 C ATOM 339 O GLY A 22 -44.380 0.274 -6.626 1.00 0.00 O ATOM 0 H GLY A 22 -48.151 -0.857 -6.643 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -45.467 -1.860 -7.374 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -46.592 -1.011 -8.416 1.00 0.00 H new ATOM 343 N LYS A 23 -46.260 1.354 -7.236 1.00 0.00 N ATOM 344 CA LYS A 23 -45.729 2.681 -6.941 1.00 0.00 C ATOM 345 C LYS A 23 -44.566 3.020 -7.871 1.00 0.00 C ATOM 346 O LYS A 23 -44.729 3.764 -8.838 1.00 0.00 O ATOM 347 CB LYS A 23 -45.278 2.762 -5.479 1.00 0.00 C ATOM 348 CG LYS A 23 -46.091 3.740 -4.647 1.00 0.00 C ATOM 349 CD LYS A 23 -45.411 4.043 -3.321 1.00 0.00 C ATOM 350 CE LYS A 23 -45.982 3.199 -2.192 1.00 0.00 C ATOM 351 NZ LYS A 23 -44.931 2.381 -1.525 1.00 0.00 N ATOM 0 H LYS A 23 -47.217 1.352 -7.588 1.00 0.00 H new ATOM 0 HA LYS A 23 -46.523 3.409 -7.105 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -45.347 1.771 -5.030 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -44.228 3.054 -5.446 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -46.231 4.666 -5.205 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -47.082 3.326 -4.463 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -44.341 3.857 -3.410 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -45.532 5.100 -3.083 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -46.457 3.849 -1.457 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -46.758 2.542 -2.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -45.360 1.820 -0.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -44.495 1.743 -2.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -44.203 3.008 -1.127 1.00 0.00 H new ATOM 365 N ASN A 24 -43.394 2.469 -7.573 1.00 0.00 N ATOM 366 CA ASN A 24 -42.207 2.713 -8.385 1.00 0.00 C ATOM 367 C ASN A 24 -41.884 1.500 -9.250 1.00 0.00 C ATOM 368 O ASN A 24 -41.567 0.427 -8.738 1.00 0.00 O ATOM 369 CB ASN A 24 -41.012 3.053 -7.492 1.00 0.00 C ATOM 370 CG ASN A 24 -40.164 4.172 -8.064 1.00 0.00 C ATOM 371 OD1 ASN A 24 -40.493 4.748 -9.102 1.00 0.00 O ATOM 372 ND2 ASN A 24 -39.066 4.487 -7.388 1.00 0.00 N ATOM 0 H ASN A 24 -43.241 1.851 -6.776 1.00 0.00 H new ATOM 0 HA ASN A 24 -42.412 3.560 -9.040 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -41.371 3.341 -6.504 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -40.395 2.164 -7.361 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -38.457 5.233 -7.724 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -38.832 3.983 -6.532 1.00 0.00 H new ATOM 379 N ARG A 25 -41.967 1.678 -10.565 1.00 0.00 N ATOM 380 CA ARG A 25 -41.685 0.597 -11.501 1.00 0.00 C ATOM 381 C ARG A 25 -41.335 1.147 -12.880 1.00 0.00 C ATOM 382 O ARG A 25 -42.140 1.838 -13.506 1.00 0.00 O ATOM 383 CB ARG A 25 -42.889 -0.343 -11.602 1.00 0.00 C ATOM 384 CG ARG A 25 -42.521 -1.815 -11.519 1.00 0.00 C ATOM 385 CD ARG A 25 -42.483 -2.299 -10.078 1.00 0.00 C ATOM 386 NE ARG A 25 -42.543 -3.756 -9.989 1.00 0.00 N ATOM 387 CZ ARG A 25 -43.634 -4.471 -10.255 1.00 0.00 C ATOM 388 NH1 ARG A 25 -44.757 -3.867 -10.626 1.00 0.00 N ATOM 389 NH2 ARG A 25 -43.604 -5.791 -10.149 1.00 0.00 N ATOM 0 H ARG A 25 -42.227 2.560 -11.005 1.00 0.00 H new ATOM 0 HA ARG A 25 -40.827 0.039 -11.126 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -43.591 -0.107 -10.803 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -43.405 -0.159 -12.544 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -43.244 -2.404 -12.083 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -41.548 -1.975 -11.983 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -41.570 -1.944 -9.600 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -43.319 -1.867 -9.528 1.00 0.00 H new ATOM 0 HE ARG A 25 -41.699 -4.255 -9.706 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -44.786 -2.851 -10.708 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -45.590 -4.419 -10.829 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -42.745 -6.260 -9.863 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -44.440 -6.338 -10.353 1.00 0.00 H new ATOM 403 N ARG A 26 -40.130 0.836 -13.349 1.00 0.00 N ATOM 404 CA ARG A 26 -39.676 1.299 -14.655 1.00 0.00 C ATOM 405 C ARG A 26 -39.673 2.822 -14.724 1.00 0.00 C ATOM 406 O ARG A 26 -39.918 3.406 -15.779 1.00 0.00 O ATOM 407 CB ARG A 26 -40.570 0.729 -15.759 1.00 0.00 C ATOM 408 CG ARG A 26 -40.016 0.942 -17.160 1.00 0.00 C ATOM 409 CD ARG A 26 -39.484 -0.353 -17.758 1.00 0.00 C ATOM 410 NE ARG A 26 -40.213 -0.737 -18.965 1.00 0.00 N ATOM 411 CZ ARG A 26 -39.995 -0.204 -20.165 1.00 0.00 C ATOM 412 NH1 ARG A 26 -39.072 0.738 -20.323 1.00 0.00 N ATOM 413 NH2 ARG A 26 -40.701 -0.611 -21.209 1.00 0.00 N ATOM 0 H ARG A 26 -39.451 0.266 -12.844 1.00 0.00 H new ATOM 0 HA ARG A 26 -38.655 0.946 -14.803 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -40.707 -0.339 -15.590 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -41.555 1.191 -15.692 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -40.798 1.345 -17.803 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -39.217 1.683 -17.127 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -38.426 -0.236 -17.995 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -39.559 -1.151 -17.020 1.00 0.00 H new ATOM 0 HE ARG A 26 -40.932 -1.456 -18.883 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -38.526 1.056 -19.522 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -38.909 1.143 -21.245 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -41.412 -1.333 -21.094 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -40.534 -0.202 -22.128 1.00 0.00 H new ATOM 427 N ARG A 27 -39.394 3.461 -13.592 1.00 0.00 N ATOM 428 CA ARG A 27 -39.360 4.917 -13.527 1.00 0.00 C ATOM 429 C ARG A 27 -38.260 5.478 -14.423 1.00 0.00 C ATOM 430 O ARG A 27 -38.496 6.388 -15.217 1.00 0.00 O ATOM 431 CB ARG A 27 -39.143 5.379 -12.084 1.00 0.00 C ATOM 432 CG ARG A 27 -39.401 6.862 -11.876 1.00 0.00 C ATOM 433 CD ARG A 27 -38.379 7.480 -10.935 1.00 0.00 C ATOM 434 NE ARG A 27 -37.298 8.143 -11.662 1.00 0.00 N ATOM 435 CZ ARG A 27 -36.138 8.491 -11.109 1.00 0.00 C ATOM 436 NH1 ARG A 27 -35.906 8.242 -9.826 1.00 0.00 N ATOM 437 NH2 ARG A 27 -35.208 9.089 -11.840 1.00 0.00 N ATOM 0 H ARG A 27 -39.189 2.994 -12.709 1.00 0.00 H new ATOM 0 HA ARG A 27 -40.319 5.293 -13.882 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -39.799 4.809 -11.426 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -38.119 5.152 -11.788 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -39.370 7.376 -12.837 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -40.403 7.005 -11.471 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -38.874 8.201 -10.284 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -37.962 6.705 -10.292 1.00 0.00 H new ATOM 0 HE ARG A 27 -37.441 8.351 -12.650 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -36.618 7.782 -9.259 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -35.016 8.511 -9.407 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -35.381 9.283 -12.826 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -34.319 9.356 -11.416 1.00 0.00 H new ATOM 451 N GLY A 28 -37.056 4.929 -14.287 1.00 0.00 N ATOM 452 CA GLY A 28 -35.938 5.388 -15.091 1.00 0.00 C ATOM 453 C GLY A 28 -34.598 5.064 -14.459 1.00 0.00 C ATOM 454 O GLY A 28 -34.516 4.813 -13.257 1.00 0.00 O ATOM 0 H GLY A 28 -36.835 4.176 -13.635 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -35.991 4.929 -16.078 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -36.017 6.465 -15.236 1.00 0.00 H new ATOM 458 N LYS A 29 -33.546 5.069 -15.271 1.00 0.00 N ATOM 459 CA LYS A 29 -32.204 4.773 -14.783 1.00 0.00 C ATOM 460 C LYS A 29 -31.151 5.506 -15.606 1.00 0.00 C ATOM 461 O LYS A 29 -30.860 5.129 -16.741 1.00 0.00 O ATOM 462 CB LYS A 29 -31.943 3.266 -14.830 1.00 0.00 C ATOM 463 CG LYS A 29 -30.630 2.857 -14.181 1.00 0.00 C ATOM 464 CD LYS A 29 -30.860 2.078 -12.895 1.00 0.00 C ATOM 465 CE LYS A 29 -30.691 0.582 -13.111 1.00 0.00 C ATOM 466 NZ LYS A 29 -30.135 -0.094 -11.907 1.00 0.00 N ATOM 0 H LYS A 29 -33.597 5.275 -16.269 1.00 0.00 H new ATOM 0 HA LYS A 29 -32.137 5.116 -13.751 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -32.762 2.748 -14.332 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -31.943 2.938 -15.869 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -30.053 2.248 -14.877 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -30.037 3.746 -13.967 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -30.159 2.418 -12.132 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -31.863 2.281 -12.520 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -31.655 0.140 -13.362 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -30.031 0.410 -13.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -30.035 -1.112 -12.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -29.203 0.309 -11.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -30.778 0.048 -11.102 1.00 0.00 H new ATOM 480 N ASN A 30 -30.580 6.558 -15.024 1.00 0.00 N ATOM 481 CA ASN A 30 -29.557 7.345 -15.704 1.00 0.00 C ATOM 482 C ASN A 30 -30.085 7.905 -17.020 1.00 0.00 C ATOM 483 O ASN A 30 -29.765 7.399 -18.096 1.00 0.00 O ATOM 484 CB ASN A 30 -28.313 6.489 -15.959 1.00 0.00 C ATOM 485 CG ASN A 30 -27.222 6.737 -14.936 1.00 0.00 C ATOM 486 OD1 ASN A 30 -27.158 7.803 -14.325 1.00 0.00 O ATOM 487 ND2 ASN A 30 -26.353 5.750 -14.746 1.00 0.00 N ATOM 0 H ASN A 30 -30.808 6.884 -14.085 1.00 0.00 H new ATOM 0 HA ASN A 30 -29.288 8.182 -15.059 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -28.591 5.435 -15.942 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -27.927 6.701 -16.956 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -25.596 5.860 -14.072 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -26.443 4.882 -15.274 1.00 0.00 H new ATOM 494 N GLU A 31 -30.897 8.953 -16.927 1.00 0.00 N ATOM 495 CA GLU A 31 -31.470 9.582 -18.111 1.00 0.00 C ATOM 496 C GLU A 31 -30.562 10.691 -18.632 1.00 0.00 C ATOM 497 O GLU A 31 -30.189 11.601 -17.890 1.00 0.00 O ATOM 498 CB GLU A 31 -32.856 10.148 -17.793 1.00 0.00 C ATOM 499 CG GLU A 31 -33.799 9.132 -17.170 1.00 0.00 C ATOM 500 CD GLU A 31 -35.218 9.651 -17.049 1.00 0.00 C ATOM 501 OE1 GLU A 31 -35.723 10.233 -18.032 1.00 0.00 O ATOM 502 OE2 GLU A 31 -35.824 9.475 -15.971 1.00 0.00 O ATOM 0 H GLU A 31 -31.173 9.384 -16.045 1.00 0.00 H new ATOM 0 HA GLU A 31 -31.565 8.821 -18.886 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -32.747 10.994 -17.114 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -33.302 10.531 -18.711 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -33.798 8.224 -17.773 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -33.431 8.858 -16.181 1.00 0.00 H new ATOM 509 N ASN A 32 -30.208 10.608 -19.910 1.00 0.00 N ATOM 510 CA ASN A 32 -29.341 11.603 -20.532 1.00 0.00 C ATOM 511 C ASN A 32 -27.947 11.573 -19.909 1.00 0.00 C ATOM 512 O ASN A 32 -27.260 12.592 -19.850 1.00 0.00 O ATOM 513 CB ASN A 32 -29.948 13.001 -20.393 1.00 0.00 C ATOM 514 CG ASN A 32 -30.668 13.446 -21.651 1.00 0.00 C ATOM 515 OD1 ASN A 32 -30.962 12.638 -22.531 1.00 0.00 O ATOM 516 ND2 ASN A 32 -30.956 14.739 -21.741 1.00 0.00 N ATOM 0 H ASN A 32 -30.508 9.861 -20.536 1.00 0.00 H new ATOM 0 HA ASN A 32 -29.252 11.361 -21.591 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -30.646 13.010 -19.556 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -29.159 13.715 -20.157 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -31.440 15.098 -22.564 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -30.693 15.374 -20.987 1.00 0.00 H new ATOM 523 N GLU A 33 -27.536 10.396 -19.447 1.00 0.00 N ATOM 524 CA GLU A 33 -26.226 10.231 -18.829 1.00 0.00 C ATOM 525 C GLU A 33 -25.803 8.765 -18.837 1.00 0.00 C ATOM 526 O GLU A 33 -26.599 7.878 -18.530 1.00 0.00 O ATOM 527 CB GLU A 33 -26.242 10.761 -17.395 1.00 0.00 C ATOM 528 CG GLU A 33 -24.878 11.209 -16.895 1.00 0.00 C ATOM 529 CD GLU A 33 -24.253 10.215 -15.936 1.00 0.00 C ATOM 530 OE1 GLU A 33 -24.645 9.030 -15.969 1.00 0.00 O ATOM 531 OE2 GLU A 33 -23.370 10.622 -15.152 1.00 0.00 O ATOM 0 H GLU A 33 -28.092 9.542 -19.489 1.00 0.00 H new ATOM 0 HA GLU A 33 -25.504 10.804 -19.411 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -26.935 11.600 -17.335 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -26.624 9.984 -16.734 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -24.213 11.354 -17.746 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -24.976 12.174 -16.399 1.00 0.00 H new ATOM 538 N SER A 34 -24.547 8.520 -19.191 1.00 0.00 N ATOM 539 CA SER A 34 -24.019 7.161 -19.239 1.00 0.00 C ATOM 540 C SER A 34 -23.069 6.903 -18.075 1.00 0.00 C ATOM 541 O SER A 34 -23.335 6.057 -17.221 1.00 0.00 O ATOM 542 CB SER A 34 -23.294 6.921 -20.564 1.00 0.00 C ATOM 543 OG SER A 34 -24.215 6.814 -21.637 1.00 0.00 O ATOM 0 H SER A 34 -23.876 9.243 -19.449 1.00 0.00 H new ATOM 0 HA SER A 34 -24.858 6.470 -19.159 1.00 0.00 H new ATOM 0 HB2 SER A 34 -22.600 7.740 -20.756 1.00 0.00 H new ATOM 0 HB3 SER A 34 -22.701 6.009 -20.498 1.00 0.00 H new ATOM 0 HG SER A 34 -23.727 6.663 -22.473 1.00 0.00 H new ATOM 549 N GLU A 35 -21.961 7.635 -18.047 1.00 0.00 N ATOM 550 CA GLU A 35 -20.972 7.484 -16.987 1.00 0.00 C ATOM 551 C GLU A 35 -20.111 8.736 -16.862 1.00 0.00 C ATOM 552 O GLU A 35 -19.788 9.383 -17.860 1.00 0.00 O ATOM 553 CB GLU A 35 -20.088 6.263 -17.260 1.00 0.00 C ATOM 554 CG GLU A 35 -20.159 5.205 -16.172 1.00 0.00 C ATOM 555 CD GLU A 35 -18.974 4.261 -16.198 1.00 0.00 C ATOM 556 OE1 GLU A 35 -17.914 4.653 -16.729 1.00 0.00 O ATOM 557 OE2 GLU A 35 -19.106 3.127 -15.688 1.00 0.00 O ATOM 0 H GLU A 35 -21.725 8.339 -18.746 1.00 0.00 H new ATOM 0 HA GLU A 35 -21.502 7.338 -16.046 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -20.383 5.816 -18.209 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -19.054 6.591 -17.370 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -20.209 5.693 -15.199 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -21.078 4.631 -16.288 1.00 0.00 H new ATOM 564 N LYS A 36 -19.739 9.070 -15.631 1.00 0.00 N ATOM 565 CA LYS A 36 -18.913 10.244 -15.374 1.00 0.00 C ATOM 566 C LYS A 36 -17.688 9.869 -14.545 1.00 0.00 C ATOM 567 O LYS A 36 -17.663 8.827 -13.892 1.00 0.00 O ATOM 568 CB LYS A 36 -19.725 11.318 -14.646 1.00 0.00 C ATOM 569 CG LYS A 36 -19.351 12.737 -15.044 1.00 0.00 C ATOM 570 CD LYS A 36 -19.265 13.653 -13.833 1.00 0.00 C ATOM 571 CE LYS A 36 -20.594 14.339 -13.558 1.00 0.00 C ATOM 572 NZ LYS A 36 -20.421 15.585 -12.761 1.00 0.00 N ATOM 0 H LYS A 36 -19.996 8.544 -14.796 1.00 0.00 H new ATOM 0 HA LYS A 36 -18.578 10.641 -16.332 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -20.784 11.160 -14.848 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -19.585 11.202 -13.571 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -18.393 12.729 -15.564 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -20.090 13.126 -15.744 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -18.965 13.075 -12.959 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -18.493 14.405 -13.998 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -21.082 14.577 -14.503 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -21.252 13.654 -13.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -21.350 16.023 -12.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -19.979 15.355 -11.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -19.814 16.249 -13.282 1.00 0.00 H new ATOM 586 N ARG A 37 -16.671 10.725 -14.578 1.00 0.00 N ATOM 587 CA ARG A 37 -15.443 10.482 -13.830 1.00 0.00 C ATOM 588 C ARG A 37 -14.744 9.222 -14.329 1.00 0.00 C ATOM 589 O ARG A 37 -15.311 8.129 -14.294 1.00 0.00 O ATOM 590 CB ARG A 37 -15.747 10.355 -12.335 1.00 0.00 C ATOM 591 CG ARG A 37 -14.655 10.921 -11.443 1.00 0.00 C ATOM 592 CD ARG A 37 -14.743 12.436 -11.348 1.00 0.00 C ATOM 593 NE ARG A 37 -13.988 13.097 -12.408 1.00 0.00 N ATOM 594 CZ ARG A 37 -12.660 13.191 -12.426 1.00 0.00 C ATOM 595 NH1 ARG A 37 -11.938 12.666 -11.444 1.00 0.00 N ATOM 596 NH2 ARG A 37 -12.052 13.811 -13.428 1.00 0.00 N ATOM 0 H ARG A 37 -16.673 11.592 -15.115 1.00 0.00 H new ATOM 0 HA ARG A 37 -14.777 11.331 -13.986 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -16.684 10.868 -12.118 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -15.895 9.303 -12.091 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -14.737 10.487 -10.446 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -13.679 10.636 -11.836 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -15.788 12.742 -11.402 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -14.366 12.761 -10.378 1.00 0.00 H new ATOM 0 HE ARG A 37 -14.509 13.512 -13.181 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -12.400 12.188 -10.671 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -10.921 12.741 -11.463 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -12.602 14.216 -14.186 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -11.035 13.883 -13.441 1.00 0.00 H new ATOM 610 N GLU A 38 -13.509 9.381 -14.794 1.00 0.00 N ATOM 611 CA GLU A 38 -12.732 8.256 -15.300 1.00 0.00 C ATOM 612 C GLU A 38 -12.381 7.285 -14.176 1.00 0.00 C ATOM 613 O GLU A 38 -11.260 7.287 -13.667 1.00 0.00 O ATOM 614 CB GLU A 38 -11.454 8.755 -15.980 1.00 0.00 C ATOM 615 CG GLU A 38 -11.543 8.782 -17.496 1.00 0.00 C ATOM 616 CD GLU A 38 -12.741 9.564 -17.996 1.00 0.00 C ATOM 617 OE1 GLU A 38 -13.881 9.196 -17.641 1.00 0.00 O ATOM 618 OE2 GLU A 38 -12.541 10.545 -18.744 1.00 0.00 O ATOM 0 H GLU A 38 -13.025 10.278 -14.831 1.00 0.00 H new ATOM 0 HA GLU A 38 -13.341 7.727 -16.033 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -11.229 9.759 -15.620 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -10.622 8.116 -15.684 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -10.632 9.222 -17.902 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -11.599 7.760 -17.871 1.00 0.00 H new ATOM 625 N LEU A 39 -13.347 6.455 -13.796 1.00 0.00 N ATOM 626 CA LEU A 39 -13.142 5.477 -12.734 1.00 0.00 C ATOM 627 C LEU A 39 -12.503 4.206 -13.286 1.00 0.00 C ATOM 628 O LEU A 39 -13.052 3.559 -14.178 1.00 0.00 O ATOM 629 CB LEU A 39 -14.472 5.146 -12.056 1.00 0.00 C ATOM 630 CG LEU A 39 -14.352 4.377 -10.740 1.00 0.00 C ATOM 631 CD1 LEU A 39 -13.915 5.302 -9.614 1.00 0.00 C ATOM 632 CD2 LEU A 39 -15.672 3.705 -10.398 1.00 0.00 C ATOM 0 H LEU A 39 -14.280 6.440 -14.208 1.00 0.00 H new ATOM 0 HA LEU A 39 -12.467 5.909 -11.996 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -15.008 6.076 -11.868 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -15.079 4.561 -12.747 1.00 0.00 H new ATOM 0 HG LEU A 39 -13.591 3.606 -10.860 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -13.836 4.734 -8.687 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -12.946 5.738 -9.857 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -14.650 6.098 -9.491 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -15.571 3.161 -9.459 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -16.450 4.462 -10.298 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -15.943 3.009 -11.192 1.00 0.00 H new ATOM 644 N VAL A 40 -11.332 3.863 -12.758 1.00 0.00 N ATOM 645 CA VAL A 40 -10.604 2.680 -13.203 1.00 0.00 C ATOM 646 C VAL A 40 -10.238 1.771 -12.035 1.00 0.00 C ATOM 647 O VAL A 40 -9.873 2.243 -10.960 1.00 0.00 O ATOM 648 CB VAL A 40 -9.317 3.067 -13.953 1.00 0.00 C ATOM 649 CG1 VAL A 40 -8.703 1.851 -14.629 1.00 0.00 C ATOM 650 CG2 VAL A 40 -9.606 4.161 -14.966 1.00 0.00 C ATOM 0 H VAL A 40 -10.866 4.390 -12.019 1.00 0.00 H new ATOM 0 HA VAL A 40 -11.270 2.142 -13.877 1.00 0.00 H new ATOM 0 HB VAL A 40 -8.596 3.450 -13.231 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -7.794 2.146 -15.154 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.460 1.100 -13.877 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.414 1.433 -15.342 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.687 4.425 -15.489 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -10.343 3.805 -15.685 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -9.996 5.039 -14.452 1.00 0.00 H new ATOM 660 N PHE A 41 -10.336 0.464 -12.257 1.00 0.00 N ATOM 661 CA PHE A 41 -10.007 -0.519 -11.229 1.00 0.00 C ATOM 662 C PHE A 41 -8.715 -1.250 -11.579 1.00 0.00 C ATOM 663 O PHE A 41 -8.199 -1.115 -12.689 1.00 0.00 O ATOM 664 CB PHE A 41 -11.138 -1.536 -11.070 1.00 0.00 C ATOM 665 CG PHE A 41 -12.505 -0.922 -10.986 1.00 0.00 C ATOM 666 CD1 PHE A 41 -12.681 0.358 -10.486 1.00 0.00 C ATOM 667 CD2 PHE A 41 -13.619 -1.628 -11.410 1.00 0.00 C ATOM 668 CE1 PHE A 41 -13.939 0.918 -10.413 1.00 0.00 C ATOM 669 CE2 PHE A 41 -14.881 -1.071 -11.332 1.00 0.00 C ATOM 670 CZ PHE A 41 -15.038 0.206 -10.832 1.00 0.00 C ATOM 0 H PHE A 41 -10.641 0.060 -13.142 1.00 0.00 H new ATOM 0 HA PHE A 41 -9.873 0.015 -10.288 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -11.113 -2.227 -11.913 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -10.960 -2.125 -10.170 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -11.824 0.923 -10.150 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -13.500 -2.626 -11.806 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -14.061 1.919 -10.026 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -15.742 -1.633 -11.661 1.00 0.00 H new ATOM 0 HZ PHE A 41 -16.023 0.645 -10.770 1.00 0.00 H new ATOM 680 N LYS A 42 -8.202 -2.030 -10.631 1.00 0.00 N ATOM 681 CA LYS A 42 -6.971 -2.793 -10.840 1.00 0.00 C ATOM 682 C LYS A 42 -6.990 -3.498 -12.196 1.00 0.00 C ATOM 683 O LYS A 42 -8.029 -3.994 -12.632 1.00 0.00 O ATOM 684 CB LYS A 42 -6.793 -3.821 -9.720 1.00 0.00 C ATOM 685 CG LYS A 42 -5.552 -4.687 -9.870 1.00 0.00 C ATOM 686 CD LYS A 42 -5.730 -6.037 -9.192 1.00 0.00 C ATOM 687 CE LYS A 42 -6.721 -6.913 -9.942 1.00 0.00 C ATOM 688 NZ LYS A 42 -6.052 -8.068 -10.602 1.00 0.00 N ATOM 0 H LYS A 42 -8.619 -2.151 -9.708 1.00 0.00 H new ATOM 0 HA LYS A 42 -6.132 -2.097 -10.826 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -6.746 -3.298 -8.765 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -7.672 -4.465 -9.688 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -5.336 -4.836 -10.928 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -4.693 -4.172 -9.439 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -4.767 -6.545 -9.132 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -6.076 -5.888 -8.169 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -7.478 -7.280 -9.249 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -7.238 -6.315 -10.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -6.761 -8.641 -11.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -5.347 -7.719 -11.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -5.580 -8.653 -9.883 1.00 0.00 H new ATOM 702 N GLU A 43 -5.839 -3.533 -12.861 1.00 0.00 N ATOM 703 CA GLU A 43 -5.733 -4.172 -14.169 1.00 0.00 C ATOM 704 C GLU A 43 -4.886 -5.437 -14.101 1.00 0.00 C ATOM 705 O GLU A 43 -4.193 -5.683 -13.114 1.00 0.00 O ATOM 706 CB GLU A 43 -5.136 -3.200 -15.187 1.00 0.00 C ATOM 707 CG GLU A 43 -5.792 -1.829 -15.174 1.00 0.00 C ATOM 708 CD GLU A 43 -5.108 -0.846 -16.104 1.00 0.00 C ATOM 709 OE1 GLU A 43 -4.408 -1.297 -17.034 1.00 0.00 O ATOM 710 OE2 GLU A 43 -5.273 0.376 -15.901 1.00 0.00 O ATOM 0 H GLU A 43 -4.969 -3.128 -12.517 1.00 0.00 H new ATOM 0 HA GLU A 43 -6.738 -4.452 -14.485 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -4.071 -3.086 -14.987 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -5.229 -3.629 -16.185 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -6.838 -1.928 -15.462 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -5.777 -1.433 -14.159 1.00 0.00 H new ATOM 717 N ASP A 44 -4.951 -6.237 -15.161 1.00 0.00 N ATOM 718 CA ASP A 44 -4.192 -7.481 -15.230 1.00 0.00 C ATOM 719 C ASP A 44 -2.699 -7.215 -15.084 1.00 0.00 C ATOM 720 O ASP A 44 -2.140 -6.358 -15.770 1.00 0.00 O ATOM 721 CB ASP A 44 -4.468 -8.199 -16.553 1.00 0.00 C ATOM 722 CG ASP A 44 -4.009 -7.394 -17.754 1.00 0.00 C ATOM 723 OD1 ASP A 44 -4.158 -6.155 -17.729 1.00 0.00 O ATOM 724 OD2 ASP A 44 -3.499 -8.004 -18.716 1.00 0.00 O ATOM 0 H ASP A 44 -5.522 -6.046 -15.984 1.00 0.00 H new ATOM 0 HA ASP A 44 -4.511 -8.119 -14.406 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -3.963 -9.165 -16.552 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -5.536 -8.398 -16.639 1.00 0.00 H new ATOM 729 N GLY A 45 -2.058 -7.953 -14.185 1.00 0.00 N ATOM 730 CA GLY A 45 -0.636 -7.781 -13.963 1.00 0.00 C ATOM 731 C GLY A 45 -0.334 -6.757 -12.884 1.00 0.00 C ATOM 732 O GLY A 45 0.785 -6.696 -12.376 1.00 0.00 O ATOM 0 H GLY A 45 -2.499 -8.668 -13.606 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -0.197 -8.739 -13.683 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -0.161 -7.473 -14.894 1.00 0.00 H new ATOM 736 N GLN A 46 -1.334 -5.953 -12.530 1.00 0.00 N ATOM 737 CA GLN A 46 -1.166 -4.933 -11.503 1.00 0.00 C ATOM 738 C GLN A 46 -2.106 -5.196 -10.332 1.00 0.00 C ATOM 739 O GLN A 46 -3.148 -5.828 -10.495 1.00 0.00 O ATOM 740 CB GLN A 46 -1.432 -3.538 -12.080 1.00 0.00 C ATOM 741 CG GLN A 46 -0.932 -3.352 -13.506 1.00 0.00 C ATOM 742 CD GLN A 46 -1.666 -2.246 -14.239 1.00 0.00 C ATOM 743 OE1 GLN A 46 -2.658 -1.709 -13.744 1.00 0.00 O ATOM 744 NE2 GLN A 46 -1.182 -1.899 -15.425 1.00 0.00 N ATOM 0 H GLN A 46 -2.267 -5.990 -12.940 1.00 0.00 H new ATOM 0 HA GLN A 46 -0.137 -4.976 -11.147 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -2.504 -3.344 -12.054 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -0.957 -2.795 -11.440 1.00 0.00 H new ATOM 0 HG2 GLN A 46 0.134 -3.126 -13.487 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -1.050 -4.287 -14.054 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -0.358 -2.370 -15.797 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -1.634 -1.161 -15.964 1.00 0.00 H new ATOM 753 N GLU A 47 -1.733 -4.711 -9.153 1.00 0.00 N ATOM 754 CA GLU A 47 -2.551 -4.902 -7.960 1.00 0.00 C ATOM 755 C GLU A 47 -2.774 -3.581 -7.231 1.00 0.00 C ATOM 756 O GLU A 47 -1.950 -2.670 -7.310 1.00 0.00 O ATOM 757 CB GLU A 47 -1.887 -5.911 -7.019 1.00 0.00 C ATOM 758 CG GLU A 47 -2.734 -6.266 -5.807 1.00 0.00 C ATOM 759 CD GLU A 47 -3.919 -7.144 -6.160 1.00 0.00 C ATOM 760 OE1 GLU A 47 -3.722 -8.365 -6.334 1.00 0.00 O ATOM 761 OE2 GLU A 47 -5.043 -6.609 -6.263 1.00 0.00 O ATOM 0 H GLU A 47 -0.873 -4.185 -8.997 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.521 -5.288 -8.274 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -1.665 -6.822 -7.575 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -0.934 -5.505 -6.679 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.113 -6.778 -5.072 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.092 -5.350 -5.338 1.00 0.00 H new ATOM 768 N TYR A 48 -3.890 -3.488 -6.514 1.00 0.00 N ATOM 769 CA TYR A 48 -4.215 -2.283 -5.763 1.00 0.00 C ATOM 770 C TYR A 48 -3.526 -2.315 -4.402 1.00 0.00 C ATOM 771 O TYR A 48 -3.154 -3.381 -3.914 1.00 0.00 O ATOM 772 CB TYR A 48 -5.733 -2.131 -5.619 1.00 0.00 C ATOM 773 CG TYR A 48 -6.321 -2.825 -4.412 1.00 0.00 C ATOM 774 CD1 TYR A 48 -6.402 -4.210 -4.350 1.00 0.00 C ATOM 775 CD2 TYR A 48 -6.800 -2.089 -3.339 1.00 0.00 C ATOM 776 CE1 TYR A 48 -6.945 -4.842 -3.248 1.00 0.00 C ATOM 777 CE2 TYR A 48 -7.345 -2.712 -2.236 1.00 0.00 C ATOM 778 CZ TYR A 48 -7.416 -4.088 -2.194 1.00 0.00 C ATOM 779 OH TYR A 48 -7.966 -4.713 -1.099 1.00 0.00 O ATOM 0 H TYR A 48 -4.583 -4.233 -6.438 1.00 0.00 H new ATOM 0 HA TYR A 48 -3.848 -1.414 -6.309 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -5.976 -1.070 -5.566 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -6.211 -2.523 -6.517 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -6.035 -4.802 -5.176 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -6.745 -1.011 -3.367 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -7.000 -5.920 -3.212 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -7.715 -2.124 -1.409 1.00 0.00 H new ATOM 0 HH TYR A 48 -8.077 -4.064 -0.373 1.00 0.00 H new ATOM 789 N ALA A 49 -3.329 -1.145 -3.802 1.00 0.00 N ATOM 790 CA ALA A 49 -2.651 -1.069 -2.517 1.00 0.00 C ATOM 791 C ALA A 49 -3.149 0.101 -1.673 1.00 0.00 C ATOM 792 O ALA A 49 -3.940 0.926 -2.129 1.00 0.00 O ATOM 793 CB ALA A 49 -1.153 -0.960 -2.748 1.00 0.00 C ATOM 0 H ALA A 49 -3.627 -0.246 -4.182 1.00 0.00 H new ATOM 0 HA ALA A 49 -2.875 -1.978 -1.959 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -0.640 -0.903 -1.788 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -0.804 -1.837 -3.294 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -0.939 -0.062 -3.328 1.00 0.00 H new ATOM 799 N GLN A 50 -2.668 0.159 -0.434 1.00 0.00 N ATOM 800 CA GLN A 50 -3.040 1.213 0.500 1.00 0.00 C ATOM 801 C GLN A 50 -1.788 1.847 1.103 1.00 0.00 C ATOM 802 O GLN A 50 -1.082 1.219 1.893 1.00 0.00 O ATOM 803 CB GLN A 50 -3.931 0.636 1.605 1.00 0.00 C ATOM 804 CG GLN A 50 -4.214 1.608 2.738 1.00 0.00 C ATOM 805 CD GLN A 50 -4.750 2.939 2.248 1.00 0.00 C ATOM 806 OE1 GLN A 50 -5.312 3.032 1.157 1.00 0.00 O ATOM 807 NE2 GLN A 50 -4.577 3.980 3.055 1.00 0.00 N ATOM 0 H GLN A 50 -2.012 -0.522 -0.052 1.00 0.00 H new ATOM 0 HA GLN A 50 -3.595 1.984 -0.034 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -4.877 0.319 1.167 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -3.455 -0.255 2.014 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -4.934 1.161 3.423 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -3.298 1.776 3.304 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -4.105 3.858 3.951 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -4.916 4.901 2.778 1.00 0.00 H new ATOM 816 N VAL A 51 -1.509 3.089 0.716 1.00 0.00 N ATOM 817 CA VAL A 51 -0.329 3.797 1.210 1.00 0.00 C ATOM 818 C VAL A 51 -0.305 3.868 2.734 1.00 0.00 C ATOM 819 O VAL A 51 -1.334 4.085 3.375 1.00 0.00 O ATOM 820 CB VAL A 51 -0.253 5.224 0.645 1.00 0.00 C ATOM 821 CG1 VAL A 51 1.089 5.858 0.977 1.00 0.00 C ATOM 822 CG2 VAL A 51 -0.490 5.218 -0.857 1.00 0.00 C ATOM 0 H VAL A 51 -2.081 3.625 0.064 1.00 0.00 H new ATOM 0 HA VAL A 51 0.534 3.226 0.869 1.00 0.00 H new ATOM 0 HB VAL A 51 -1.037 5.821 1.110 1.00 0.00 H new ATOM 0 HG11 VAL A 51 1.125 6.868 0.569 1.00 0.00 H new ATOM 0 HG12 VAL A 51 1.214 5.899 2.059 1.00 0.00 H new ATOM 0 HG13 VAL A 51 1.891 5.262 0.541 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -0.432 6.237 -1.239 1.00 0.00 H new ATOM 0 HG22 VAL A 51 0.269 4.605 -1.343 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -1.477 4.807 -1.068 1.00 0.00 H new ATOM 832 N ILE A 52 0.883 3.686 3.305 1.00 0.00 N ATOM 833 CA ILE A 52 1.061 3.729 4.752 1.00 0.00 C ATOM 834 C ILE A 52 1.972 4.888 5.156 1.00 0.00 C ATOM 835 O ILE A 52 1.716 5.579 6.140 1.00 0.00 O ATOM 836 CB ILE A 52 1.630 2.387 5.280 1.00 0.00 C ATOM 837 CG1 ILE A 52 0.887 1.956 6.546 1.00 0.00 C ATOM 838 CG2 ILE A 52 3.131 2.475 5.540 1.00 0.00 C ATOM 839 CD1 ILE A 52 0.023 0.731 6.341 1.00 0.00 C ATOM 0 H ILE A 52 1.741 3.506 2.783 1.00 0.00 H new ATOM 0 HA ILE A 52 0.082 3.888 5.203 1.00 0.00 H new ATOM 0 HB ILE A 52 1.476 1.633 4.508 1.00 0.00 H new ATOM 0 HG12 ILE A 52 1.612 1.754 7.334 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.262 2.780 6.891 1.00 0.00 H new ATOM 0 HG21 ILE A 52 3.493 1.515 5.909 1.00 0.00 H new ATOM 0 HG22 ILE A 52 3.647 2.725 4.613 1.00 0.00 H new ATOM 0 HG23 ILE A 52 3.327 3.247 6.284 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -0.476 0.477 7.276 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -0.724 0.937 5.575 1.00 0.00 H new ATOM 0 HD13 ILE A 52 0.646 -0.105 6.024 1.00 0.00 H new ATOM 851 N LYS A 53 3.043 5.078 4.390 1.00 0.00 N ATOM 852 CA LYS A 53 4.003 6.137 4.658 1.00 0.00 C ATOM 853 C LYS A 53 4.602 6.654 3.350 1.00 0.00 C ATOM 854 O LYS A 53 4.594 5.956 2.338 1.00 0.00 O ATOM 855 CB LYS A 53 5.105 5.605 5.569 1.00 0.00 C ATOM 856 CG LYS A 53 6.263 6.571 5.766 1.00 0.00 C ATOM 857 CD LYS A 53 7.132 6.165 6.946 1.00 0.00 C ATOM 858 CE LYS A 53 6.510 6.585 8.267 1.00 0.00 C ATOM 859 NZ LYS A 53 6.168 8.034 8.287 1.00 0.00 N ATOM 0 H LYS A 53 3.266 4.507 3.575 1.00 0.00 H new ATOM 0 HA LYS A 53 3.495 6.964 5.154 1.00 0.00 H new ATOM 0 HB2 LYS A 53 4.675 5.366 6.542 1.00 0.00 H new ATOM 0 HB3 LYS A 53 5.489 4.674 5.153 1.00 0.00 H new ATOM 0 HG2 LYS A 53 6.869 6.604 4.861 1.00 0.00 H new ATOM 0 HG3 LYS A 53 5.876 7.577 5.927 1.00 0.00 H new ATOM 0 HD2 LYS A 53 7.276 5.085 6.938 1.00 0.00 H new ATOM 0 HD3 LYS A 53 8.118 6.619 6.846 1.00 0.00 H new ATOM 0 HE2 LYS A 53 5.610 5.998 8.447 1.00 0.00 H new ATOM 0 HE3 LYS A 53 7.202 6.365 9.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 6.105 8.362 9.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 6.906 8.572 7.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 5.254 8.181 7.814 1.00 0.00 H new ATOM 873 N MET A 54 5.117 7.879 3.378 1.00 0.00 N ATOM 874 CA MET A 54 5.718 8.480 2.192 1.00 0.00 C ATOM 875 C MET A 54 7.234 8.558 2.334 1.00 0.00 C ATOM 876 O MET A 54 7.752 8.805 3.423 1.00 0.00 O ATOM 877 CB MET A 54 5.143 9.878 1.956 1.00 0.00 C ATOM 878 CG MET A 54 5.660 10.541 0.690 1.00 0.00 C ATOM 879 SD MET A 54 4.343 11.253 -0.314 1.00 0.00 S ATOM 880 CE MET A 54 5.085 11.189 -1.943 1.00 0.00 C ATOM 0 H MET A 54 5.130 8.474 4.206 1.00 0.00 H new ATOM 0 HA MET A 54 5.482 7.849 1.335 1.00 0.00 H new ATOM 0 HB2 MET A 54 4.056 9.811 1.904 1.00 0.00 H new ATOM 0 HB3 MET A 54 5.383 10.510 2.811 1.00 0.00 H new ATOM 0 HG2 MET A 54 6.369 11.324 0.959 1.00 0.00 H new ATOM 0 HG3 MET A 54 6.206 9.807 0.098 1.00 0.00 H new ATOM 0 HE1 MET A 54 4.337 11.445 -2.694 1.00 0.00 H new ATOM 0 HE2 MET A 54 5.910 11.900 -1.995 1.00 0.00 H new ATOM 0 HE3 MET A 54 5.460 10.183 -2.133 1.00 0.00 H new ATOM 890 N LEU A 55 7.946 8.347 1.229 1.00 0.00 N ATOM 891 CA LEU A 55 9.405 8.394 1.246 1.00 0.00 C ATOM 892 C LEU A 55 9.926 9.596 0.461 1.00 0.00 C ATOM 893 O LEU A 55 11.026 10.085 0.720 1.00 0.00 O ATOM 894 CB LEU A 55 10.001 7.101 0.675 1.00 0.00 C ATOM 895 CG LEU A 55 9.082 5.873 0.711 1.00 0.00 C ATOM 896 CD1 LEU A 55 9.842 4.631 0.271 1.00 0.00 C ATOM 897 CD2 LEU A 55 8.496 5.674 2.103 1.00 0.00 C ATOM 0 H LEU A 55 7.539 8.143 0.316 1.00 0.00 H new ATOM 0 HA LEU A 55 9.717 8.496 2.285 1.00 0.00 H new ATOM 0 HB2 LEU A 55 10.293 7.283 -0.359 1.00 0.00 H new ATOM 0 HB3 LEU A 55 10.911 6.867 1.227 1.00 0.00 H new ATOM 0 HG LEU A 55 8.258 6.042 0.018 1.00 0.00 H new ATOM 0 HD11 LEU A 55 9.177 3.768 0.302 1.00 0.00 H new ATOM 0 HD12 LEU A 55 10.209 4.770 -0.746 1.00 0.00 H new ATOM 0 HD13 LEU A 55 10.685 4.464 0.941 1.00 0.00 H new ATOM 0 HD21 LEU A 55 7.848 4.797 2.103 1.00 0.00 H new ATOM 0 HD22 LEU A 55 9.304 5.528 2.820 1.00 0.00 H new ATOM 0 HD23 LEU A 55 7.916 6.554 2.383 1.00 0.00 H new ATOM 909 N GLY A 56 9.135 10.067 -0.498 1.00 0.00 N ATOM 910 CA GLY A 56 9.542 11.206 -1.299 1.00 0.00 C ATOM 911 C GLY A 56 8.954 11.176 -2.696 1.00 0.00 C ATOM 912 O GLY A 56 8.142 10.308 -3.016 1.00 0.00 O ATOM 0 H GLY A 56 8.221 9.681 -0.734 1.00 0.00 H new ATOM 0 HA2 GLY A 56 9.235 12.125 -0.799 1.00 0.00 H new ATOM 0 HA3 GLY A 56 10.630 11.228 -1.367 1.00 0.00 H new ATOM 916 N ASN A 57 9.366 12.126 -3.530 1.00 0.00 N ATOM 917 CA ASN A 57 8.875 12.204 -4.901 1.00 0.00 C ATOM 918 C ASN A 57 9.519 11.131 -5.769 1.00 0.00 C ATOM 919 O ASN A 57 10.674 11.258 -6.178 1.00 0.00 O ATOM 920 CB ASN A 57 9.156 13.588 -5.488 1.00 0.00 C ATOM 921 CG ASN A 57 8.213 14.647 -4.950 1.00 0.00 C ATOM 922 OD1 ASN A 57 7.135 14.872 -5.500 1.00 0.00 O ATOM 923 ND2 ASN A 57 8.616 15.302 -3.869 1.00 0.00 N ATOM 0 H ASN A 57 10.038 12.852 -3.280 1.00 0.00 H new ATOM 0 HA ASN A 57 7.798 12.036 -4.885 1.00 0.00 H new ATOM 0 HB2 ASN A 57 10.184 13.873 -5.264 1.00 0.00 H new ATOM 0 HB3 ASN A 57 9.067 13.544 -6.573 1.00 0.00 H new ATOM 0 HD21 ASN A 57 8.024 16.025 -3.461 1.00 0.00 H new ATOM 0 HD22 ASN A 57 9.518 15.082 -3.446 1.00 0.00 H new ATOM 930 N GLY A 58 8.766 10.072 -6.045 1.00 0.00 N ATOM 931 CA GLY A 58 9.278 8.989 -6.861 1.00 0.00 C ATOM 932 C GLY A 58 8.952 7.626 -6.283 1.00 0.00 C ATOM 933 O GLY A 58 8.861 6.640 -7.013 1.00 0.00 O ATOM 0 H GLY A 58 7.809 9.945 -5.717 1.00 0.00 H new ATOM 0 HA2 GLY A 58 8.859 9.065 -7.865 1.00 0.00 H new ATOM 0 HA3 GLY A 58 10.359 9.090 -6.958 1.00 0.00 H new ATOM 937 N ARG A 59 8.774 7.573 -4.967 1.00 0.00 N ATOM 938 CA ARG A 59 8.456 6.325 -4.290 1.00 0.00 C ATOM 939 C ARG A 59 7.645 6.583 -3.025 1.00 0.00 C ATOM 940 O ARG A 59 7.705 7.669 -2.448 1.00 0.00 O ATOM 941 CB ARG A 59 9.741 5.563 -3.960 1.00 0.00 C ATOM 942 CG ARG A 59 10.492 6.102 -2.751 1.00 0.00 C ATOM 943 CD ARG A 59 11.685 5.224 -2.407 1.00 0.00 C ATOM 944 NE ARG A 59 12.947 5.816 -2.845 1.00 0.00 N ATOM 945 CZ ARG A 59 13.606 6.750 -2.162 1.00 0.00 C ATOM 946 NH1 ARG A 59 13.121 7.212 -1.016 1.00 0.00 N ATOM 947 NH2 ARG A 59 14.753 7.223 -2.627 1.00 0.00 N ATOM 0 H ARG A 59 8.845 8.382 -4.349 1.00 0.00 H new ATOM 0 HA ARG A 59 7.849 5.715 -4.959 1.00 0.00 H new ATOM 0 HB2 ARG A 59 9.494 4.516 -3.783 1.00 0.00 H new ATOM 0 HB3 ARG A 59 10.401 5.593 -4.827 1.00 0.00 H new ATOM 0 HG2 ARG A 59 10.831 7.118 -2.954 1.00 0.00 H new ATOM 0 HG3 ARG A 59 9.818 6.156 -1.896 1.00 0.00 H new ATOM 0 HD2 ARG A 59 11.716 5.061 -1.330 1.00 0.00 H new ATOM 0 HD3 ARG A 59 11.562 4.247 -2.874 1.00 0.00 H new ATOM 0 HE ARG A 59 13.347 5.495 -3.727 1.00 0.00 H new ATOM 0 HH11 ARG A 59 12.238 6.852 -0.653 1.00 0.00 H new ATOM 0 HH12 ARG A 59 13.631 7.927 -0.498 1.00 0.00 H new ATOM 0 HH21 ARG A 59 15.130 6.872 -3.507 1.00 0.00 H new ATOM 0 HH22 ARG A 59 15.259 7.938 -2.105 1.00 0.00 H new ATOM 961 N LEU A 60 6.880 5.582 -2.604 1.00 0.00 N ATOM 962 CA LEU A 60 6.051 5.707 -1.414 1.00 0.00 C ATOM 963 C LEU A 60 5.919 4.371 -0.696 1.00 0.00 C ATOM 964 O LEU A 60 5.958 3.311 -1.321 1.00 0.00 O ATOM 965 CB LEU A 60 4.664 6.222 -1.797 1.00 0.00 C ATOM 966 CG LEU A 60 3.860 5.283 -2.702 1.00 0.00 C ATOM 967 CD1 LEU A 60 2.533 4.917 -2.054 1.00 0.00 C ATOM 968 CD2 LEU A 60 3.632 5.918 -4.065 1.00 0.00 C ATOM 0 H LEU A 60 6.818 4.677 -3.069 1.00 0.00 H new ATOM 0 HA LEU A 60 6.531 6.416 -0.739 1.00 0.00 H new ATOM 0 HB2 LEU A 60 4.094 6.402 -0.886 1.00 0.00 H new ATOM 0 HB3 LEU A 60 4.774 7.183 -2.300 1.00 0.00 H new ATOM 0 HG LEU A 60 4.436 4.368 -2.841 1.00 0.00 H new ATOM 0 HD11 LEU A 60 1.978 4.250 -2.713 1.00 0.00 H new ATOM 0 HD12 LEU A 60 2.718 4.417 -1.103 1.00 0.00 H new ATOM 0 HD13 LEU A 60 1.951 5.822 -1.880 1.00 0.00 H new ATOM 0 HD21 LEU A 60 3.059 5.236 -4.693 1.00 0.00 H new ATOM 0 HD22 LEU A 60 3.080 6.850 -3.944 1.00 0.00 H new ATOM 0 HD23 LEU A 60 4.593 6.124 -4.536 1.00 0.00 H new ATOM 980 N GLU A 61 5.738 4.429 0.619 1.00 0.00 N ATOM 981 CA GLU A 61 5.572 3.222 1.415 1.00 0.00 C ATOM 982 C GLU A 61 4.090 2.889 1.531 1.00 0.00 C ATOM 983 O GLU A 61 3.298 3.703 2.006 1.00 0.00 O ATOM 984 CB GLU A 61 6.182 3.408 2.806 1.00 0.00 C ATOM 985 CG GLU A 61 6.017 2.200 3.712 1.00 0.00 C ATOM 986 CD GLU A 61 7.151 1.202 3.567 1.00 0.00 C ATOM 987 OE1 GLU A 61 8.299 1.556 3.907 1.00 0.00 O ATOM 988 OE2 GLU A 61 6.889 0.068 3.114 1.00 0.00 O ATOM 0 H GLU A 61 5.703 5.297 1.153 1.00 0.00 H new ATOM 0 HA GLU A 61 6.089 2.399 0.922 1.00 0.00 H new ATOM 0 HB2 GLU A 61 7.244 3.630 2.701 1.00 0.00 H new ATOM 0 HB3 GLU A 61 5.722 4.274 3.282 1.00 0.00 H new ATOM 0 HG2 GLU A 61 5.961 2.533 4.748 1.00 0.00 H new ATOM 0 HG3 GLU A 61 5.072 1.706 3.485 1.00 0.00 H new ATOM 995 N ALA A 62 3.715 1.701 1.078 1.00 0.00 N ATOM 996 CA ALA A 62 2.319 1.284 1.117 1.00 0.00 C ATOM 997 C ALA A 62 2.156 -0.121 1.674 1.00 0.00 C ATOM 998 O ALA A 62 3.120 -0.878 1.787 1.00 0.00 O ATOM 999 CB ALA A 62 1.709 1.369 -0.274 1.00 0.00 C ATOM 0 H ALA A 62 4.353 1.012 0.681 1.00 0.00 H new ATOM 0 HA ALA A 62 1.794 1.964 1.788 1.00 0.00 H new ATOM 0 HB1 ALA A 62 0.666 1.055 -0.234 1.00 0.00 H new ATOM 0 HB2 ALA A 62 1.765 2.396 -0.634 1.00 0.00 H new ATOM 0 HB3 ALA A 62 2.258 0.716 -0.953 1.00 0.00 H new ATOM 1005 N MET A 63 0.919 -0.457 2.015 1.00 0.00 N ATOM 1006 CA MET A 63 0.598 -1.767 2.558 1.00 0.00 C ATOM 1007 C MET A 63 -0.533 -2.409 1.764 1.00 0.00 C ATOM 1008 O MET A 63 -1.690 -2.000 1.874 1.00 0.00 O ATOM 1009 CB MET A 63 0.193 -1.645 4.028 1.00 0.00 C ATOM 1010 CG MET A 63 -0.036 -2.986 4.709 1.00 0.00 C ATOM 1011 SD MET A 63 0.957 -3.192 6.201 1.00 0.00 S ATOM 1012 CE MET A 63 2.565 -2.674 5.608 1.00 0.00 C ATOM 0 H MET A 63 0.117 0.166 1.923 1.00 0.00 H new ATOM 0 HA MET A 63 1.484 -2.397 2.483 1.00 0.00 H new ATOM 0 HB2 MET A 63 0.969 -1.101 4.566 1.00 0.00 H new ATOM 0 HB3 MET A 63 -0.718 -1.051 4.097 1.00 0.00 H new ATOM 0 HG2 MET A 63 -1.091 -3.083 4.964 1.00 0.00 H new ATOM 0 HG3 MET A 63 0.198 -3.788 4.009 1.00 0.00 H new ATOM 0 HE1 MET A 63 3.344 -3.179 6.180 1.00 0.00 H new ATOM 0 HE2 MET A 63 2.664 -2.932 4.554 1.00 0.00 H new ATOM 0 HE3 MET A 63 2.667 -1.596 5.729 1.00 0.00 H new ATOM 1022 N CYS A 64 -0.197 -3.414 0.965 1.00 0.00 N ATOM 1023 CA CYS A 64 -1.197 -4.106 0.161 1.00 0.00 C ATOM 1024 C CYS A 64 -2.290 -4.675 1.061 1.00 0.00 C ATOM 1025 O CYS A 64 -2.003 -5.286 2.090 1.00 0.00 O ATOM 1026 CB CYS A 64 -0.545 -5.222 -0.655 1.00 0.00 C ATOM 1027 SG CYS A 64 -1.691 -6.122 -1.726 1.00 0.00 S ATOM 0 H CYS A 64 0.754 -3.767 0.856 1.00 0.00 H new ATOM 0 HA CYS A 64 -1.647 -3.392 -0.529 1.00 0.00 H new ATOM 0 HB2 CYS A 64 0.247 -4.793 -1.268 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -0.073 -5.928 0.028 1.00 0.00 H new ATOM 0 HG CYS A 64 -1.097 -7.171 -2.213 1.00 0.00 H new ATOM 1033 N PHE A 65 -3.544 -4.457 0.675 1.00 0.00 N ATOM 1034 CA PHE A 65 -4.682 -4.933 1.457 1.00 0.00 C ATOM 1035 C PHE A 65 -4.541 -6.411 1.819 1.00 0.00 C ATOM 1036 O PHE A 65 -5.108 -6.872 2.809 1.00 0.00 O ATOM 1037 CB PHE A 65 -5.982 -4.708 0.687 1.00 0.00 C ATOM 1038 CG PHE A 65 -6.711 -3.462 1.096 1.00 0.00 C ATOM 1039 CD1 PHE A 65 -6.311 -2.224 0.619 1.00 0.00 C ATOM 1040 CD2 PHE A 65 -7.794 -3.527 1.957 1.00 0.00 C ATOM 1041 CE1 PHE A 65 -6.979 -1.074 0.993 1.00 0.00 C ATOM 1042 CE2 PHE A 65 -8.465 -2.379 2.335 1.00 0.00 C ATOM 1043 CZ PHE A 65 -8.057 -1.151 1.852 1.00 0.00 C ATOM 0 H PHE A 65 -3.798 -3.954 -0.175 1.00 0.00 H new ATOM 0 HA PHE A 65 -4.706 -4.362 2.385 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -5.760 -4.656 -0.379 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -6.636 -5.567 0.835 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -5.468 -2.157 -0.053 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -8.118 -4.485 2.337 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -6.658 -0.115 0.614 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -9.308 -2.442 3.008 1.00 0.00 H new ATOM 0 HZ PHE A 65 -8.580 -0.253 2.146 1.00 0.00 H new ATOM 1053 N ASP A 66 -3.785 -7.150 1.014 1.00 0.00 N ATOM 1054 CA ASP A 66 -3.577 -8.573 1.258 1.00 0.00 C ATOM 1055 C ASP A 66 -2.621 -8.800 2.429 1.00 0.00 C ATOM 1056 O ASP A 66 -2.444 -9.931 2.884 1.00 0.00 O ATOM 1057 CB ASP A 66 -3.032 -9.252 -0.001 1.00 0.00 C ATOM 1058 CG ASP A 66 -4.100 -10.023 -0.751 1.00 0.00 C ATOM 1059 OD1 ASP A 66 -5.086 -9.396 -1.192 1.00 0.00 O ATOM 1060 OD2 ASP A 66 -3.950 -11.255 -0.897 1.00 0.00 O ATOM 0 H ASP A 66 -3.307 -6.788 0.189 1.00 0.00 H new ATOM 0 HA ASP A 66 -4.540 -9.013 1.515 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -2.602 -8.498 -0.660 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -2.225 -9.930 0.276 1.00 0.00 H new ATOM 1065 N GLY A 67 -2.006 -7.725 2.915 1.00 0.00 N ATOM 1066 CA GLY A 67 -1.081 -7.838 4.026 1.00 0.00 C ATOM 1067 C GLY A 67 0.360 -7.937 3.571 1.00 0.00 C ATOM 1068 O GLY A 67 1.130 -8.743 4.095 1.00 0.00 O ATOM 0 H GLY A 67 -2.133 -6.778 2.558 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.194 -6.972 4.679 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.334 -8.718 4.617 1.00 0.00 H new ATOM 1072 N VAL A 68 0.729 -7.115 2.593 1.00 0.00 N ATOM 1073 CA VAL A 68 2.089 -7.116 2.069 1.00 0.00 C ATOM 1074 C VAL A 68 2.691 -5.715 2.088 1.00 0.00 C ATOM 1075 O VAL A 68 2.233 -4.822 1.373 1.00 0.00 O ATOM 1076 CB VAL A 68 2.135 -7.662 0.629 1.00 0.00 C ATOM 1077 CG1 VAL A 68 3.573 -7.827 0.164 1.00 0.00 C ATOM 1078 CG2 VAL A 68 1.382 -8.981 0.535 1.00 0.00 C ATOM 0 H VAL A 68 0.106 -6.441 2.149 1.00 0.00 H new ATOM 0 HA VAL A 68 2.675 -7.767 2.717 1.00 0.00 H new ATOM 0 HB VAL A 68 1.647 -6.942 -0.028 1.00 0.00 H new ATOM 0 HG11 VAL A 68 3.584 -8.214 -0.855 1.00 0.00 H new ATOM 0 HG12 VAL A 68 4.077 -6.861 0.191 1.00 0.00 H new ATOM 0 HG13 VAL A 68 4.090 -8.525 0.822 1.00 0.00 H new ATOM 0 HG21 VAL A 68 1.425 -9.352 -0.489 1.00 0.00 H new ATOM 0 HG22 VAL A 68 1.839 -9.710 1.204 1.00 0.00 H new ATOM 0 HG23 VAL A 68 0.342 -8.827 0.822 1.00 0.00 H new ATOM 1088 N LYS A 69 3.720 -5.529 2.910 1.00 0.00 N ATOM 1089 CA LYS A 69 4.388 -4.237 3.019 1.00 0.00 C ATOM 1090 C LYS A 69 5.440 -4.079 1.927 1.00 0.00 C ATOM 1091 O LYS A 69 6.442 -4.794 1.911 1.00 0.00 O ATOM 1092 CB LYS A 69 5.039 -4.090 4.396 1.00 0.00 C ATOM 1093 CG LYS A 69 5.467 -2.667 4.718 1.00 0.00 C ATOM 1094 CD LYS A 69 5.774 -2.497 6.197 1.00 0.00 C ATOM 1095 CE LYS A 69 5.377 -1.116 6.694 1.00 0.00 C ATOM 1096 NZ LYS A 69 5.988 -0.803 8.015 1.00 0.00 N ATOM 0 H LYS A 69 4.109 -6.257 3.510 1.00 0.00 H new ATOM 0 HA LYS A 69 3.639 -3.455 2.895 1.00 0.00 H new ATOM 0 HB2 LYS A 69 4.338 -4.431 5.158 1.00 0.00 H new ATOM 0 HB3 LYS A 69 5.910 -4.743 4.448 1.00 0.00 H new ATOM 0 HG2 LYS A 69 6.349 -2.410 4.131 1.00 0.00 H new ATOM 0 HG3 LYS A 69 4.677 -1.974 4.428 1.00 0.00 H new ATOM 0 HD2 LYS A 69 5.243 -3.257 6.770 1.00 0.00 H new ATOM 0 HD3 LYS A 69 6.839 -2.654 6.369 1.00 0.00 H new ATOM 0 HE2 LYS A 69 5.684 -0.366 5.965 1.00 0.00 H new ATOM 0 HE3 LYS A 69 4.291 -1.057 6.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 5.692 0.147 8.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 5.675 -1.503 8.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 7.024 -0.834 7.934 1.00 0.00 H new ATOM 1110 N ARG A 70 5.204 -3.143 1.014 1.00 0.00 N ATOM 1111 CA ARG A 70 6.134 -2.899 -0.082 1.00 0.00 C ATOM 1112 C ARG A 70 6.183 -1.420 -0.444 1.00 0.00 C ATOM 1113 O ARG A 70 5.322 -0.640 -0.037 1.00 0.00 O ATOM 1114 CB ARG A 70 5.733 -3.721 -1.309 1.00 0.00 C ATOM 1115 CG ARG A 70 4.390 -3.319 -1.898 1.00 0.00 C ATOM 1116 CD ARG A 70 3.983 -4.238 -3.041 1.00 0.00 C ATOM 1117 NE ARG A 70 3.005 -5.237 -2.619 1.00 0.00 N ATOM 1118 CZ ARG A 70 2.237 -5.924 -3.462 1.00 0.00 C ATOM 1119 NH1 ARG A 70 2.335 -5.725 -4.771 1.00 0.00 N ATOM 1120 NH2 ARG A 70 1.370 -6.811 -2.996 1.00 0.00 N ATOM 0 H ARG A 70 4.379 -2.543 1.011 1.00 0.00 H new ATOM 0 HA ARG A 70 7.127 -3.204 0.247 1.00 0.00 H new ATOM 0 HB2 ARG A 70 6.502 -3.615 -2.074 1.00 0.00 H new ATOM 0 HB3 ARG A 70 5.699 -4.775 -1.035 1.00 0.00 H new ATOM 0 HG2 ARG A 70 3.628 -3.346 -1.119 1.00 0.00 H new ATOM 0 HG3 ARG A 70 4.442 -2.291 -2.257 1.00 0.00 H new ATOM 0 HD2 ARG A 70 3.566 -3.643 -3.853 1.00 0.00 H new ATOM 0 HD3 ARG A 70 4.867 -4.740 -3.435 1.00 0.00 H new ATOM 0 HE ARG A 70 2.904 -5.419 -1.620 1.00 0.00 H new ATOM 0 HH11 ARG A 70 3.001 -5.043 -5.135 1.00 0.00 H new ATOM 0 HH12 ARG A 70 1.744 -6.254 -5.413 1.00 0.00 H new ATOM 0 HH21 ARG A 70 1.291 -6.968 -1.991 1.00 0.00 H new ATOM 0 HH22 ARG A 70 0.782 -7.337 -3.642 1.00 0.00 H new ATOM 1134 N LEU A 71 7.199 -1.040 -1.211 1.00 0.00 N ATOM 1135 CA LEU A 71 7.365 0.345 -1.629 1.00 0.00 C ATOM 1136 C LEU A 71 6.871 0.547 -3.055 1.00 0.00 C ATOM 1137 O LEU A 71 7.500 0.093 -4.012 1.00 0.00 O ATOM 1138 CB LEU A 71 8.833 0.760 -1.522 1.00 0.00 C ATOM 1139 CG LEU A 71 9.388 0.800 -0.099 1.00 0.00 C ATOM 1140 CD1 LEU A 71 8.446 1.565 0.818 1.00 0.00 C ATOM 1141 CD2 LEU A 71 9.608 -0.611 0.422 1.00 0.00 C ATOM 0 H LEU A 71 7.920 -1.673 -1.556 1.00 0.00 H new ATOM 0 HA LEU A 71 6.768 0.971 -0.966 1.00 0.00 H new ATOM 0 HB2 LEU A 71 9.435 0.069 -2.112 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.950 1.747 -1.970 1.00 0.00 H new ATOM 0 HG LEU A 71 10.347 1.317 -0.115 1.00 0.00 H new ATOM 0 HD11 LEU A 71 8.857 1.584 1.828 1.00 0.00 H new ATOM 0 HD12 LEU A 71 8.333 2.586 0.453 1.00 0.00 H new ATOM 0 HD13 LEU A 71 7.473 1.074 0.831 1.00 0.00 H new ATOM 0 HD21 LEU A 71 10.004 -0.567 1.437 1.00 0.00 H new ATOM 0 HD22 LEU A 71 8.660 -1.150 0.425 1.00 0.00 H new ATOM 0 HD23 LEU A 71 10.318 -1.130 -0.222 1.00 0.00 H new ATOM 1153 N CYS A 72 5.744 1.233 -3.191 1.00 0.00 N ATOM 1154 CA CYS A 72 5.168 1.497 -4.501 1.00 0.00 C ATOM 1155 C CYS A 72 5.808 2.731 -5.128 1.00 0.00 C ATOM 1156 O CYS A 72 5.715 3.834 -4.588 1.00 0.00 O ATOM 1157 CB CYS A 72 3.657 1.696 -4.386 1.00 0.00 C ATOM 1158 SG CYS A 72 2.808 0.385 -3.474 1.00 0.00 S ATOM 0 H CYS A 72 5.211 1.616 -2.410 1.00 0.00 H new ATOM 0 HA CYS A 72 5.364 0.637 -5.141 1.00 0.00 H new ATOM 0 HB2 CYS A 72 3.463 2.650 -3.895 1.00 0.00 H new ATOM 0 HB3 CYS A 72 3.232 1.761 -5.388 1.00 0.00 H new ATOM 0 HG CYS A 72 1.680 0.110 -4.059 1.00 0.00 H new ATOM 1164 N HIS A 73 6.458 2.540 -6.271 1.00 0.00 N ATOM 1165 CA HIS A 73 7.111 3.639 -6.970 1.00 0.00 C ATOM 1166 C HIS A 73 6.105 4.411 -7.815 1.00 0.00 C ATOM 1167 O HIS A 73 5.292 3.817 -8.523 1.00 0.00 O ATOM 1168 CB HIS A 73 8.242 3.111 -7.854 1.00 0.00 C ATOM 1169 CG HIS A 73 9.472 2.732 -7.089 1.00 0.00 C ATOM 1170 ND1 HIS A 73 9.475 1.785 -6.087 1.00 0.00 N ATOM 1171 CD2 HIS A 73 10.748 3.178 -7.184 1.00 0.00 C ATOM 1172 CE1 HIS A 73 10.698 1.665 -5.599 1.00 0.00 C ATOM 1173 NE2 HIS A 73 11.488 2.499 -6.249 1.00 0.00 N ATOM 0 H HIS A 73 6.546 1.635 -6.732 1.00 0.00 H new ATOM 0 HA HIS A 73 7.532 4.315 -6.226 1.00 0.00 H new ATOM 0 HB2 HIS A 73 7.885 2.242 -8.406 1.00 0.00 H new ATOM 0 HB3 HIS A 73 8.502 3.871 -8.590 1.00 0.00 H new ATOM 0 HD2 HIS A 73 11.115 3.929 -7.869 1.00 0.00 H new ATOM 0 HE1 HIS A 73 10.999 0.998 -4.804 1.00 0.00 H new ATOM 0 HE2 HIS A 73 12.487 2.619 -6.083 1.00 0.00 H new ATOM 1182 N ILE A 74 6.161 5.737 -7.740 1.00 0.00 N ATOM 1183 CA ILE A 74 5.249 6.579 -8.502 1.00 0.00 C ATOM 1184 C ILE A 74 5.544 6.493 -9.994 1.00 0.00 C ATOM 1185 O ILE A 74 6.703 6.434 -10.406 1.00 0.00 O ATOM 1186 CB ILE A 74 5.305 8.053 -8.044 1.00 0.00 C ATOM 1187 CG1 ILE A 74 4.007 8.766 -8.420 1.00 0.00 C ATOM 1188 CG2 ILE A 74 6.504 8.772 -8.649 1.00 0.00 C ATOM 1189 CD1 ILE A 74 3.931 10.185 -7.908 1.00 0.00 C ATOM 0 H ILE A 74 6.826 6.249 -7.161 1.00 0.00 H new ATOM 0 HA ILE A 74 4.243 6.203 -8.314 1.00 0.00 H new ATOM 0 HB ILE A 74 5.419 8.071 -6.960 1.00 0.00 H new ATOM 0 HG12 ILE A 74 3.907 8.774 -9.505 1.00 0.00 H new ATOM 0 HG13 ILE A 74 3.163 8.200 -8.026 1.00 0.00 H new ATOM 0 HG21 ILE A 74 6.517 9.807 -8.309 1.00 0.00 H new ATOM 0 HG22 ILE A 74 7.422 8.275 -8.335 1.00 0.00 H new ATOM 0 HG23 ILE A 74 6.432 8.748 -9.736 1.00 0.00 H new ATOM 0 HD11 ILE A 74 2.984 10.631 -8.211 1.00 0.00 H new ATOM 0 HD12 ILE A 74 4.000 10.183 -6.820 1.00 0.00 H new ATOM 0 HD13 ILE A 74 4.755 10.766 -8.323 1.00 0.00 H new ATOM 1201 N ARG A 75 4.490 6.480 -10.800 1.00 0.00 N ATOM 1202 CA ARG A 75 4.643 6.392 -12.249 1.00 0.00 C ATOM 1203 C ARG A 75 5.362 7.619 -12.801 1.00 0.00 C ATOM 1204 O ARG A 75 5.342 8.690 -12.193 1.00 0.00 O ATOM 1205 CB ARG A 75 3.278 6.240 -12.924 1.00 0.00 C ATOM 1206 CG ARG A 75 3.043 4.860 -13.519 1.00 0.00 C ATOM 1207 CD ARG A 75 3.762 4.696 -14.847 1.00 0.00 C ATOM 1208 NE ARG A 75 3.745 3.310 -15.309 1.00 0.00 N ATOM 1209 CZ ARG A 75 4.079 2.935 -16.542 1.00 0.00 C ATOM 1210 NH1 ARG A 75 4.458 3.838 -17.438 1.00 0.00 N ATOM 1211 NH2 ARG A 75 4.035 1.653 -16.879 1.00 0.00 N ATOM 0 H ARG A 75 3.523 6.529 -10.478 1.00 0.00 H new ATOM 0 HA ARG A 75 5.247 5.512 -12.467 1.00 0.00 H new ATOM 0 HB2 ARG A 75 2.496 6.450 -12.194 1.00 0.00 H new ATOM 0 HB3 ARG A 75 3.187 6.987 -13.713 1.00 0.00 H new ATOM 0 HG2 ARG A 75 3.389 4.098 -12.821 1.00 0.00 H new ATOM 0 HG3 ARG A 75 1.974 4.701 -13.661 1.00 0.00 H new ATOM 0 HD2 ARG A 75 3.292 5.334 -15.595 1.00 0.00 H new ATOM 0 HD3 ARG A 75 4.794 5.032 -14.745 1.00 0.00 H new ATOM 0 HE ARG A 75 3.460 2.587 -14.648 1.00 0.00 H new ATOM 0 HH11 ARG A 75 4.494 4.825 -17.183 1.00 0.00 H new ATOM 0 HH12 ARG A 75 4.713 3.545 -18.381 1.00 0.00 H new ATOM 0 HH21 ARG A 75 3.745 0.955 -16.194 1.00 0.00 H new ATOM 0 HH22 ARG A 75 4.291 1.365 -17.823 1.00 0.00 H new ATOM 1225 N GLY A 76 5.996 7.455 -13.958 1.00 0.00 N ATOM 1226 CA GLY A 76 6.713 8.554 -14.576 1.00 0.00 C ATOM 1227 C GLY A 76 5.799 9.474 -15.361 1.00 0.00 C ATOM 1228 O GLY A 76 5.875 10.696 -15.230 1.00 0.00 O ATOM 0 H GLY A 76 6.026 6.579 -14.479 1.00 0.00 H new ATOM 0 HA2 GLY A 76 7.226 9.128 -13.805 1.00 0.00 H new ATOM 0 HA3 GLY A 76 7.480 8.156 -15.240 1.00 0.00 H new ATOM 1232 N LYS A 77 4.928 8.887 -16.177 1.00 0.00 N ATOM 1233 CA LYS A 77 3.993 9.664 -16.984 1.00 0.00 C ATOM 1234 C LYS A 77 2.833 10.164 -16.129 1.00 0.00 C ATOM 1235 O LYS A 77 2.386 11.301 -16.272 1.00 0.00 O ATOM 1236 CB LYS A 77 3.462 8.819 -18.144 1.00 0.00 C ATOM 1237 CG LYS A 77 2.760 9.635 -19.220 1.00 0.00 C ATOM 1238 CD LYS A 77 1.938 8.750 -20.145 1.00 0.00 C ATOM 1239 CE LYS A 77 2.400 8.868 -21.589 1.00 0.00 C ATOM 1240 NZ LYS A 77 1.938 10.137 -22.219 1.00 0.00 N ATOM 0 H LYS A 77 4.850 7.877 -16.297 1.00 0.00 H new ATOM 0 HA LYS A 77 4.524 10.525 -17.389 1.00 0.00 H new ATOM 0 HB2 LYS A 77 4.291 8.275 -18.596 1.00 0.00 H new ATOM 0 HB3 LYS A 77 2.768 8.075 -17.753 1.00 0.00 H new ATOM 0 HG2 LYS A 77 2.111 10.375 -18.751 1.00 0.00 H new ATOM 0 HG3 LYS A 77 3.500 10.184 -19.803 1.00 0.00 H new ATOM 0 HD2 LYS A 77 2.016 7.712 -19.821 1.00 0.00 H new ATOM 0 HD3 LYS A 77 0.886 9.027 -20.075 1.00 0.00 H new ATOM 0 HE2 LYS A 77 3.488 8.819 -21.627 1.00 0.00 H new ATOM 0 HE3 LYS A 77 2.023 8.020 -22.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 2.274 10.179 -23.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 0.899 10.173 -22.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 2.319 10.947 -21.689 1.00 0.00 H new ATOM 1254 N LEU A 78 2.355 9.303 -15.237 1.00 0.00 N ATOM 1255 CA LEU A 78 1.250 9.651 -14.350 1.00 0.00 C ATOM 1256 C LEU A 78 1.643 10.789 -13.404 1.00 0.00 C ATOM 1257 O LEU A 78 0.783 11.426 -12.800 1.00 0.00 O ATOM 1258 CB LEU A 78 0.819 8.421 -13.543 1.00 0.00 C ATOM 1259 CG LEU A 78 -0.661 8.042 -13.661 1.00 0.00 C ATOM 1260 CD1 LEU A 78 -1.553 9.251 -13.413 1.00 0.00 C ATOM 1261 CD2 LEU A 78 -0.948 7.432 -15.026 1.00 0.00 C ATOM 0 H LEU A 78 2.716 8.358 -15.109 1.00 0.00 H new ATOM 0 HA LEU A 78 0.414 9.990 -14.962 1.00 0.00 H new ATOM 0 HB2 LEU A 78 1.421 7.570 -13.861 1.00 0.00 H new ATOM 0 HB3 LEU A 78 1.048 8.598 -12.492 1.00 0.00 H new ATOM 0 HG LEU A 78 -0.884 7.297 -12.897 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -2.599 8.956 -13.502 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.370 9.639 -12.411 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.330 10.025 -14.148 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -2.004 7.169 -15.092 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.704 8.154 -15.806 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.342 6.536 -15.159 1.00 0.00 H new ATOM 1273 N ARG A 79 2.947 11.038 -13.279 1.00 0.00 N ATOM 1274 CA ARG A 79 3.451 12.096 -12.403 1.00 0.00 C ATOM 1275 C ARG A 79 2.709 13.413 -12.631 1.00 0.00 C ATOM 1276 O ARG A 79 2.633 14.255 -11.735 1.00 0.00 O ATOM 1277 CB ARG A 79 4.954 12.297 -12.627 1.00 0.00 C ATOM 1278 CG ARG A 79 5.292 13.062 -13.897 1.00 0.00 C ATOM 1279 CD ARG A 79 6.792 13.096 -14.142 1.00 0.00 C ATOM 1280 NE ARG A 79 7.461 14.090 -13.306 1.00 0.00 N ATOM 1281 CZ ARG A 79 8.782 14.175 -13.167 1.00 0.00 C ATOM 1282 NH1 ARG A 79 9.580 13.330 -13.808 1.00 0.00 N ATOM 1283 NH2 ARG A 79 9.307 15.108 -12.384 1.00 0.00 N ATOM 0 H ARG A 79 3.674 10.521 -13.774 1.00 0.00 H new ATOM 0 HA ARG A 79 3.277 11.785 -11.373 1.00 0.00 H new ATOM 0 HB2 ARG A 79 5.370 12.830 -11.772 1.00 0.00 H new ATOM 0 HB3 ARG A 79 5.440 11.322 -12.662 1.00 0.00 H new ATOM 0 HG2 ARG A 79 4.793 12.597 -14.747 1.00 0.00 H new ATOM 0 HG3 ARG A 79 4.911 14.080 -13.822 1.00 0.00 H new ATOM 0 HD2 ARG A 79 7.214 12.111 -13.942 1.00 0.00 H new ATOM 0 HD3 ARG A 79 6.983 13.318 -15.192 1.00 0.00 H new ATOM 0 HE ARG A 79 6.881 14.759 -12.799 1.00 0.00 H new ATOM 0 HH11 ARG A 79 9.182 12.610 -14.411 1.00 0.00 H new ATOM 0 HH12 ARG A 79 10.592 13.400 -13.697 1.00 0.00 H new ATOM 0 HH21 ARG A 79 8.698 15.760 -11.889 1.00 0.00 H new ATOM 0 HH22 ARG A 79 10.319 15.174 -12.277 1.00 0.00 H new ATOM 1297 N LYS A 80 2.173 13.590 -13.835 1.00 0.00 N ATOM 1298 CA LYS A 80 1.451 14.809 -14.179 1.00 0.00 C ATOM 1299 C LYS A 80 0.056 14.829 -13.558 1.00 0.00 C ATOM 1300 O LYS A 80 -0.446 15.887 -13.178 1.00 0.00 O ATOM 1301 CB LYS A 80 1.347 14.949 -15.700 1.00 0.00 C ATOM 1302 CG LYS A 80 2.051 16.180 -16.245 1.00 0.00 C ATOM 1303 CD LYS A 80 3.504 15.888 -16.578 1.00 0.00 C ATOM 1304 CE LYS A 80 4.254 17.154 -16.963 1.00 0.00 C ATOM 1305 NZ LYS A 80 5.669 16.871 -17.329 1.00 0.00 N ATOM 0 H LYS A 80 2.225 12.904 -14.588 1.00 0.00 H new ATOM 0 HA LYS A 80 2.011 15.652 -13.775 1.00 0.00 H new ATOM 0 HB2 LYS A 80 1.771 14.061 -16.168 1.00 0.00 H new ATOM 0 HB3 LYS A 80 0.295 14.987 -15.982 1.00 0.00 H new ATOM 0 HG2 LYS A 80 1.535 16.530 -17.139 1.00 0.00 H new ATOM 0 HG3 LYS A 80 1.999 16.985 -15.512 1.00 0.00 H new ATOM 0 HD2 LYS A 80 3.989 15.424 -15.719 1.00 0.00 H new ATOM 0 HD3 LYS A 80 3.553 15.171 -17.398 1.00 0.00 H new ATOM 0 HE2 LYS A 80 3.751 17.633 -17.803 1.00 0.00 H new ATOM 0 HE3 LYS A 80 4.228 17.859 -16.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 6.146 17.759 -17.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 6.157 16.437 -16.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 5.694 16.219 -18.139 1.00 0.00 H new ATOM 1319 N LYS A 81 -0.575 13.661 -13.467 1.00 0.00 N ATOM 1320 CA LYS A 81 -1.917 13.568 -12.900 1.00 0.00 C ATOM 1321 C LYS A 81 -2.012 12.455 -11.860 1.00 0.00 C ATOM 1322 O LYS A 81 -3.048 11.801 -11.733 1.00 0.00 O ATOM 1323 CB LYS A 81 -2.943 13.334 -14.013 1.00 0.00 C ATOM 1324 CG LYS A 81 -4.024 14.401 -14.078 1.00 0.00 C ATOM 1325 CD LYS A 81 -3.529 15.655 -14.780 1.00 0.00 C ATOM 1326 CE LYS A 81 -4.619 16.281 -15.637 1.00 0.00 C ATOM 1327 NZ LYS A 81 -4.090 16.764 -16.943 1.00 0.00 N ATOM 0 H LYS A 81 -0.182 12.772 -13.776 1.00 0.00 H new ATOM 0 HA LYS A 81 -2.133 14.512 -12.400 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -2.425 13.295 -14.971 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -3.412 12.362 -13.864 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -4.894 14.008 -14.604 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -4.349 14.652 -13.069 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -3.188 16.378 -14.039 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -2.670 15.409 -15.404 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -5.408 15.549 -15.813 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -5.071 17.114 -15.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -4.864 17.184 -17.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -3.355 17.481 -16.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -3.681 15.965 -17.469 1.00 0.00 H new ATOM 1341 N VAL A 82 -0.935 12.246 -11.110 1.00 0.00 N ATOM 1342 CA VAL A 82 -0.916 11.215 -10.081 1.00 0.00 C ATOM 1343 C VAL A 82 -0.563 11.804 -8.717 1.00 0.00 C ATOM 1344 O VAL A 82 0.564 12.242 -8.488 1.00 0.00 O ATOM 1345 CB VAL A 82 0.067 10.080 -10.427 1.00 0.00 C ATOM 1346 CG1 VAL A 82 1.500 10.559 -10.315 1.00 0.00 C ATOM 1347 CG2 VAL A 82 -0.173 8.870 -9.535 1.00 0.00 C ATOM 0 H VAL A 82 -0.067 12.775 -11.196 1.00 0.00 H new ATOM 0 HA VAL A 82 -1.921 10.796 -10.037 1.00 0.00 H new ATOM 0 HB VAL A 82 -0.108 9.779 -11.460 1.00 0.00 H new ATOM 0 HG11 VAL A 82 2.177 9.742 -10.564 1.00 0.00 H new ATOM 0 HG12 VAL A 82 1.662 11.387 -11.005 1.00 0.00 H new ATOM 0 HG13 VAL A 82 1.693 10.893 -9.296 1.00 0.00 H new ATOM 0 HG21 VAL A 82 0.531 8.080 -9.796 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -0.031 9.153 -8.492 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -1.192 8.509 -9.678 1.00 0.00 H new ATOM 1357 N TRP A 83 -1.538 11.815 -7.818 1.00 0.00 N ATOM 1358 CA TRP A 83 -1.332 12.352 -6.480 1.00 0.00 C ATOM 1359 C TRP A 83 -1.361 11.239 -5.438 1.00 0.00 C ATOM 1360 O TRP A 83 -2.411 10.661 -5.161 1.00 0.00 O ATOM 1361 CB TRP A 83 -2.399 13.399 -6.160 1.00 0.00 C ATOM 1362 CG TRP A 83 -1.832 14.681 -5.632 1.00 0.00 C ATOM 1363 CD1 TRP A 83 -1.002 14.831 -4.558 1.00 0.00 C ATOM 1364 CD2 TRP A 83 -2.055 15.997 -6.153 1.00 0.00 C ATOM 1365 NE1 TRP A 83 -0.696 16.155 -4.379 1.00 0.00 N ATOM 1366 CE2 TRP A 83 -1.329 16.892 -5.345 1.00 0.00 C ATOM 1367 CE3 TRP A 83 -2.796 16.503 -7.224 1.00 0.00 C ATOM 1368 CZ2 TRP A 83 -1.324 18.265 -5.575 1.00 0.00 C ATOM 1369 CZ3 TRP A 83 -2.791 17.867 -7.451 1.00 0.00 C ATOM 1370 CH2 TRP A 83 -2.059 18.735 -6.631 1.00 0.00 C ATOM 0 H TRP A 83 -2.478 11.459 -7.991 1.00 0.00 H new ATOM 0 HA TRP A 83 -0.350 12.825 -6.450 1.00 0.00 H new ATOM 0 HB2 TRP A 83 -2.974 13.609 -7.062 1.00 0.00 H new ATOM 0 HB3 TRP A 83 -3.093 12.988 -5.427 1.00 0.00 H new ATOM 0 HD1 TRP A 83 -0.639 14.023 -3.939 1.00 0.00 H new ATOM 0 HE1 TRP A 83 -0.095 16.531 -3.646 1.00 0.00 H new ATOM 0 HE3 TRP A 83 -3.362 15.841 -7.863 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 -0.761 18.936 -4.943 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 -3.361 18.270 -8.275 1.00 0.00 H new ATOM 0 HH2 TRP A 83 -2.074 19.795 -6.835 1.00 0.00 H new ATOM 1381 N ILE A 84 -0.203 10.953 -4.856 1.00 0.00 N ATOM 1382 CA ILE A 84 -0.100 9.916 -3.838 1.00 0.00 C ATOM 1383 C ILE A 84 -0.283 10.501 -2.447 1.00 0.00 C ATOM 1384 O ILE A 84 0.097 11.643 -2.184 1.00 0.00 O ATOM 1385 CB ILE A 84 1.244 9.156 -3.892 1.00 0.00 C ATOM 1386 CG1 ILE A 84 2.317 9.974 -4.616 1.00 0.00 C ATOM 1387 CG2 ILE A 84 1.055 7.804 -4.565 1.00 0.00 C ATOM 1388 CD1 ILE A 84 3.663 9.293 -4.650 1.00 0.00 C ATOM 0 H ILE A 84 0.676 11.424 -5.071 1.00 0.00 H new ATOM 0 HA ILE A 84 -0.898 9.205 -4.051 1.00 0.00 H new ATOM 0 HB ILE A 84 1.585 8.996 -2.869 1.00 0.00 H new ATOM 0 HG12 ILE A 84 1.989 10.167 -5.637 1.00 0.00 H new ATOM 0 HG13 ILE A 84 2.419 10.942 -4.125 1.00 0.00 H new ATOM 0 HG21 ILE A 84 2.009 7.277 -4.597 1.00 0.00 H new ATOM 0 HG22 ILE A 84 0.334 7.214 -4.000 1.00 0.00 H new ATOM 0 HG23 ILE A 84 0.687 7.951 -5.580 1.00 0.00 H new ATOM 0 HD11 ILE A 84 4.377 9.925 -5.177 1.00 0.00 H new ATOM 0 HD12 ILE A 84 4.011 9.124 -3.631 1.00 0.00 H new ATOM 0 HD13 ILE A 84 3.574 8.337 -5.167 1.00 0.00 H new ATOM 1400 N ASN A 85 -0.867 9.711 -1.560 1.00 0.00 N ATOM 1401 CA ASN A 85 -1.104 10.145 -0.190 1.00 0.00 C ATOM 1402 C ASN A 85 -0.826 9.011 0.788 1.00 0.00 C ATOM 1403 O ASN A 85 -0.851 7.843 0.411 1.00 0.00 O ATOM 1404 CB ASN A 85 -2.544 10.637 -0.028 1.00 0.00 C ATOM 1405 CG ASN A 85 -2.973 11.562 -1.151 1.00 0.00 C ATOM 1406 OD1 ASN A 85 -3.771 11.186 -2.011 1.00 0.00 O ATOM 1407 ND2 ASN A 85 -2.444 12.780 -1.150 1.00 0.00 N ATOM 0 H ASN A 85 -1.187 8.764 -1.764 1.00 0.00 H new ATOM 0 HA ASN A 85 -0.424 10.968 0.030 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -3.215 9.779 0.008 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -2.641 11.158 0.924 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -2.695 13.446 -1.881 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -1.787 13.050 -0.418 1.00 0.00 H new ATOM 1414 N THR A 86 -0.558 9.362 2.042 1.00 0.00 N ATOM 1415 CA THR A 86 -0.270 8.362 3.067 1.00 0.00 C ATOM 1416 C THR A 86 -1.533 7.643 3.526 1.00 0.00 C ATOM 1417 O THR A 86 -1.473 6.684 4.297 1.00 0.00 O ATOM 1418 CB THR A 86 0.436 9.002 4.261 1.00 0.00 C ATOM 1419 OG1 THR A 86 1.614 9.672 3.848 1.00 0.00 O ATOM 1420 CG2 THR A 86 0.826 8.004 5.329 1.00 0.00 C ATOM 0 H THR A 86 -0.534 10.327 2.373 1.00 0.00 H new ATOM 0 HA THR A 86 0.392 7.620 2.620 1.00 0.00 H new ATOM 0 HB THR A 86 -0.287 9.700 4.684 1.00 0.00 H new ATOM 0 HG1 THR A 86 2.050 10.076 4.627 1.00 0.00 H new ATOM 0 HG21 THR A 86 1.323 8.523 6.148 1.00 0.00 H new ATOM 0 HG22 THR A 86 -0.067 7.505 5.704 1.00 0.00 H new ATOM 0 HG23 THR A 86 1.504 7.263 4.905 1.00 0.00 H new ATOM 1428 N SER A 87 -2.668 8.108 3.047 1.00 0.00 N ATOM 1429 CA SER A 87 -3.951 7.514 3.401 1.00 0.00 C ATOM 1430 C SER A 87 -4.900 7.526 2.209 1.00 0.00 C ATOM 1431 O SER A 87 -5.818 8.344 2.144 1.00 0.00 O ATOM 1432 CB SER A 87 -4.577 8.264 4.578 1.00 0.00 C ATOM 1433 OG SER A 87 -3.776 8.145 5.741 1.00 0.00 O ATOM 0 H SER A 87 -2.733 8.900 2.407 1.00 0.00 H new ATOM 0 HA SER A 87 -3.777 6.478 3.693 1.00 0.00 H new ATOM 0 HB2 SER A 87 -4.697 9.316 4.321 1.00 0.00 H new ATOM 0 HB3 SER A 87 -5.573 7.869 4.777 1.00 0.00 H new ATOM 0 HG SER A 87 -4.196 8.634 6.479 1.00 0.00 H new ATOM 1439 N ASP A 88 -4.674 6.618 1.267 1.00 0.00 N ATOM 1440 CA ASP A 88 -5.512 6.534 0.079 1.00 0.00 C ATOM 1441 C ASP A 88 -5.274 5.231 -0.679 1.00 0.00 C ATOM 1442 O ASP A 88 -4.247 4.569 -0.504 1.00 0.00 O ATOM 1443 CB ASP A 88 -5.245 7.728 -0.839 1.00 0.00 C ATOM 1444 CG ASP A 88 -6.335 8.780 -0.751 1.00 0.00 C ATOM 1445 OD1 ASP A 88 -7.420 8.561 -1.328 1.00 0.00 O ATOM 1446 OD2 ASP A 88 -6.102 9.822 -0.102 1.00 0.00 O ATOM 0 H ASP A 88 -3.920 5.932 1.303 1.00 0.00 H new ATOM 0 HA ASP A 88 -6.553 6.552 0.402 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -4.288 8.178 -0.576 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -5.162 7.380 -1.869 1.00 0.00 H new ATOM 1451 N ILE A 89 -6.234 4.880 -1.529 1.00 0.00 N ATOM 1452 CA ILE A 89 -6.153 3.669 -2.336 1.00 0.00 C ATOM 1453 C ILE A 89 -5.406 3.948 -3.636 1.00 0.00 C ATOM 1454 O ILE A 89 -5.494 5.048 -4.184 1.00 0.00 O ATOM 1455 CB ILE A 89 -7.568 3.134 -2.662 1.00 0.00 C ATOM 1456 CG1 ILE A 89 -8.335 2.852 -1.367 1.00 0.00 C ATOM 1457 CG2 ILE A 89 -7.502 1.881 -3.530 1.00 0.00 C ATOM 1458 CD1 ILE A 89 -7.641 1.865 -0.455 1.00 0.00 C ATOM 0 H ILE A 89 -7.084 5.423 -1.677 1.00 0.00 H new ATOM 0 HA ILE A 89 -5.612 2.916 -1.762 1.00 0.00 H new ATOM 0 HB ILE A 89 -8.098 3.900 -3.228 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -8.482 3.789 -0.830 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -9.325 2.469 -1.617 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -8.512 1.531 -3.741 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -6.996 2.114 -4.467 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -6.951 1.102 -3.003 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -8.242 1.714 0.442 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -7.518 0.914 -0.974 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -6.662 2.254 -0.175 1.00 0.00 H new ATOM 1470 N ILE A 90 -4.670 2.959 -4.128 1.00 0.00 N ATOM 1471 CA ILE A 90 -3.918 3.122 -5.369 1.00 0.00 C ATOM 1472 C ILE A 90 -3.768 1.800 -6.103 1.00 0.00 C ATOM 1473 O ILE A 90 -4.089 0.739 -5.571 1.00 0.00 O ATOM 1474 CB ILE A 90 -2.501 3.689 -5.113 1.00 0.00 C ATOM 1475 CG1 ILE A 90 -2.497 4.622 -3.894 1.00 0.00 C ATOM 1476 CG2 ILE A 90 -1.982 4.397 -6.358 1.00 0.00 C ATOM 1477 CD1 ILE A 90 -1.231 5.447 -3.750 1.00 0.00 C ATOM 0 H ILE A 90 -4.577 2.042 -3.692 1.00 0.00 H new ATOM 0 HA ILE A 90 -4.488 3.825 -5.977 1.00 0.00 H new ATOM 0 HB ILE A 90 -1.829 2.860 -4.892 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -3.351 5.296 -3.963 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -2.633 4.025 -2.992 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -0.984 4.791 -6.163 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -1.938 3.690 -7.187 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.652 5.217 -6.616 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -1.307 6.079 -2.865 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -0.373 4.782 -3.648 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -1.102 6.073 -4.633 1.00 0.00 H new ATOM 1489 N LEU A 91 -3.250 1.872 -7.324 1.00 0.00 N ATOM 1490 CA LEU A 91 -3.023 0.682 -8.123 1.00 0.00 C ATOM 1491 C LEU A 91 -1.600 0.691 -8.674 1.00 0.00 C ATOM 1492 O LEU A 91 -1.205 1.627 -9.369 1.00 0.00 O ATOM 1493 CB LEU A 91 -4.042 0.587 -9.266 1.00 0.00 C ATOM 1494 CG LEU A 91 -3.481 0.192 -10.637 1.00 0.00 C ATOM 1495 CD1 LEU A 91 -2.862 -1.197 -10.585 1.00 0.00 C ATOM 1496 CD2 LEU A 91 -4.574 0.249 -11.690 1.00 0.00 C ATOM 0 H LEU A 91 -2.980 2.744 -7.779 1.00 0.00 H new ATOM 0 HA LEU A 91 -3.151 -0.193 -7.486 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -4.806 -0.138 -8.986 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -4.539 1.552 -9.364 1.00 0.00 H new ATOM 0 HG LEU A 91 -2.700 0.903 -10.908 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -2.470 -1.458 -11.568 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -2.051 -1.207 -9.857 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -3.621 -1.923 -10.293 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -4.161 -0.034 -12.658 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -5.374 -0.440 -11.421 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -4.972 1.262 -11.747 1.00 0.00 H new ATOM 1508 N VAL A 92 -0.840 -0.352 -8.359 1.00 0.00 N ATOM 1509 CA VAL A 92 0.538 -0.462 -8.822 1.00 0.00 C ATOM 1510 C VAL A 92 0.732 -1.709 -9.680 1.00 0.00 C ATOM 1511 O VAL A 92 0.088 -2.735 -9.456 1.00 0.00 O ATOM 1512 CB VAL A 92 1.520 -0.497 -7.640 1.00 0.00 C ATOM 1513 CG1 VAL A 92 1.451 0.798 -6.844 1.00 0.00 C ATOM 1514 CG2 VAL A 92 1.218 -1.684 -6.754 1.00 0.00 C ATOM 0 H VAL A 92 -1.155 -1.134 -7.785 1.00 0.00 H new ATOM 0 HA VAL A 92 0.745 0.421 -9.427 1.00 0.00 H new ATOM 0 HB VAL A 92 2.533 -0.599 -8.030 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.154 0.752 -6.012 1.00 0.00 H new ATOM 0 HG12 VAL A 92 1.709 1.637 -7.491 1.00 0.00 H new ATOM 0 HG13 VAL A 92 0.441 0.934 -6.458 1.00 0.00 H new ATOM 0 HG21 VAL A 92 1.918 -1.702 -5.919 1.00 0.00 H new ATOM 0 HG22 VAL A 92 0.200 -1.604 -6.373 1.00 0.00 H new ATOM 0 HG23 VAL A 92 1.318 -2.603 -7.331 1.00 0.00 H new ATOM 1524 N GLY A 93 1.619 -1.615 -10.666 1.00 0.00 N ATOM 1525 CA GLY A 93 1.876 -2.743 -11.545 1.00 0.00 C ATOM 1526 C GLY A 93 3.075 -3.563 -11.115 1.00 0.00 C ATOM 1527 O GLY A 93 4.081 -3.016 -10.662 1.00 0.00 O ATOM 0 H GLY A 93 2.165 -0.778 -10.872 1.00 0.00 H new ATOM 0 HA2 GLY A 93 0.995 -3.384 -11.573 1.00 0.00 H new ATOM 0 HA3 GLY A 93 2.037 -2.378 -12.559 1.00 0.00 H new ATOM 1531 N LEU A 94 2.969 -4.882 -11.258 1.00 0.00 N ATOM 1532 CA LEU A 94 4.051 -5.785 -10.885 1.00 0.00 C ATOM 1533 C LEU A 94 4.581 -6.523 -12.112 1.00 0.00 C ATOM 1534 O LEU A 94 3.813 -6.902 -12.997 1.00 0.00 O ATOM 1535 CB LEU A 94 3.573 -6.794 -9.832 1.00 0.00 C ATOM 1536 CG LEU A 94 2.118 -6.641 -9.374 1.00 0.00 C ATOM 1537 CD1 LEU A 94 1.645 -7.899 -8.662 1.00 0.00 C ATOM 1538 CD2 LEU A 94 1.968 -5.426 -8.469 1.00 0.00 C ATOM 0 H LEU A 94 2.142 -5.349 -11.631 1.00 0.00 H new ATOM 0 HA LEU A 94 4.858 -5.189 -10.458 1.00 0.00 H new ATOM 0 HB2 LEU A 94 3.704 -7.799 -10.233 1.00 0.00 H new ATOM 0 HB3 LEU A 94 4.220 -6.713 -8.958 1.00 0.00 H new ATOM 0 HG LEU A 94 1.495 -6.492 -10.256 1.00 0.00 H new ATOM 0 HD11 LEU A 94 0.610 -7.770 -8.345 1.00 0.00 H new ATOM 0 HD12 LEU A 94 1.713 -8.749 -9.341 1.00 0.00 H new ATOM 0 HD13 LEU A 94 2.272 -8.081 -7.789 1.00 0.00 H new ATOM 0 HD21 LEU A 94 0.929 -5.333 -8.154 1.00 0.00 H new ATOM 0 HD22 LEU A 94 2.604 -5.545 -7.592 1.00 0.00 H new ATOM 0 HD23 LEU A 94 2.264 -4.529 -9.013 1.00 0.00 H new ATOM 1550 N ARG A 95 5.895 -6.725 -12.162 1.00 0.00 N ATOM 1551 CA ARG A 95 6.518 -7.417 -13.286 1.00 0.00 C ATOM 1552 C ARG A 95 7.765 -8.180 -12.842 1.00 0.00 C ATOM 1553 O ARG A 95 7.715 -9.388 -12.611 1.00 0.00 O ATOM 1554 CB ARG A 95 6.880 -6.420 -14.390 1.00 0.00 C ATOM 1555 CG ARG A 95 5.701 -6.021 -15.264 1.00 0.00 C ATOM 1556 CD ARG A 95 5.302 -7.143 -16.210 1.00 0.00 C ATOM 1557 NE ARG A 95 6.413 -7.564 -17.061 1.00 0.00 N ATOM 1558 CZ ARG A 95 6.377 -8.635 -17.850 1.00 0.00 C ATOM 1559 NH1 ARG A 95 5.290 -9.395 -17.901 1.00 0.00 N ATOM 1560 NH2 ARG A 95 7.431 -8.948 -18.591 1.00 0.00 N ATOM 0 H ARG A 95 6.547 -6.420 -11.439 1.00 0.00 H new ATOM 0 HA ARG A 95 5.798 -8.137 -13.676 1.00 0.00 H new ATOM 0 HB2 ARG A 95 7.303 -5.525 -13.934 1.00 0.00 H new ATOM 0 HB3 ARG A 95 7.657 -6.854 -15.019 1.00 0.00 H new ATOM 0 HG2 ARG A 95 4.852 -5.757 -14.633 1.00 0.00 H new ATOM 0 HG3 ARG A 95 5.959 -5.132 -15.840 1.00 0.00 H new ATOM 0 HD2 ARG A 95 4.946 -7.995 -15.631 1.00 0.00 H new ATOM 0 HD3 ARG A 95 4.472 -6.812 -16.835 1.00 0.00 H new ATOM 0 HE ARG A 95 7.266 -7.004 -17.050 1.00 0.00 H new ATOM 0 HH11 ARG A 95 4.476 -9.159 -17.333 1.00 0.00 H new ATOM 0 HH12 ARG A 95 5.269 -10.215 -18.508 1.00 0.00 H new ATOM 0 HH21 ARG A 95 8.269 -8.368 -18.556 1.00 0.00 H new ATOM 0 HH22 ARG A 95 7.404 -9.769 -19.196 1.00 0.00 H new ATOM 1574 N ASP A 96 8.882 -7.468 -12.726 1.00 0.00 N ATOM 1575 CA ASP A 96 10.141 -8.078 -12.313 1.00 0.00 C ATOM 1576 C ASP A 96 10.301 -8.048 -10.794 1.00 0.00 C ATOM 1577 O ASP A 96 11.185 -8.705 -10.244 1.00 0.00 O ATOM 1578 CB ASP A 96 11.320 -7.363 -12.978 1.00 0.00 C ATOM 1579 CG ASP A 96 11.925 -8.174 -14.105 1.00 0.00 C ATOM 1580 OD1 ASP A 96 11.886 -9.421 -14.026 1.00 0.00 O ATOM 1581 OD2 ASP A 96 12.438 -7.565 -15.067 1.00 0.00 O ATOM 0 H ASP A 96 8.941 -6.467 -12.912 1.00 0.00 H new ATOM 0 HA ASP A 96 10.127 -9.120 -12.632 1.00 0.00 H new ATOM 0 HB2 ASP A 96 10.986 -6.400 -13.365 1.00 0.00 H new ATOM 0 HB3 ASP A 96 12.086 -7.158 -12.230 1.00 0.00 H new ATOM 1586 N TYR A 97 9.446 -7.282 -10.121 1.00 0.00 N ATOM 1587 CA TYR A 97 9.505 -7.172 -8.667 1.00 0.00 C ATOM 1588 C TYR A 97 9.023 -8.454 -7.991 1.00 0.00 C ATOM 1589 O TYR A 97 9.180 -8.622 -6.781 1.00 0.00 O ATOM 1590 CB TYR A 97 8.664 -5.987 -8.194 1.00 0.00 C ATOM 1591 CG TYR A 97 9.225 -4.642 -8.601 1.00 0.00 C ATOM 1592 CD1 TYR A 97 10.533 -4.293 -8.291 1.00 0.00 C ATOM 1593 CD2 TYR A 97 8.445 -3.723 -9.291 1.00 0.00 C ATOM 1594 CE1 TYR A 97 11.050 -3.066 -8.659 1.00 0.00 C ATOM 1595 CE2 TYR A 97 8.955 -2.494 -9.664 1.00 0.00 C ATOM 1596 CZ TYR A 97 10.256 -2.169 -9.345 1.00 0.00 C ATOM 1597 OH TYR A 97 10.767 -0.947 -9.713 1.00 0.00 O ATOM 0 H TYR A 97 8.707 -6.731 -10.558 1.00 0.00 H new ATOM 0 HA TYR A 97 10.546 -7.012 -8.386 1.00 0.00 H new ATOM 0 HB2 TYR A 97 7.655 -6.086 -8.594 1.00 0.00 H new ATOM 0 HB3 TYR A 97 8.581 -6.022 -7.108 1.00 0.00 H new ATOM 0 HD1 TYR A 97 11.156 -4.992 -7.753 1.00 0.00 H new ATOM 0 HD2 TYR A 97 7.424 -3.973 -9.540 1.00 0.00 H new ATOM 0 HE1 TYR A 97 12.070 -2.810 -8.411 1.00 0.00 H new ATOM 0 HE2 TYR A 97 8.337 -1.791 -10.203 1.00 0.00 H new ATOM 0 HH TYR A 97 10.080 -0.435 -10.189 1.00 0.00 H new ATOM 1607 N GLN A 98 8.442 -9.361 -8.775 1.00 0.00 N ATOM 1608 CA GLN A 98 7.947 -10.628 -8.243 1.00 0.00 C ATOM 1609 C GLN A 98 6.780 -10.406 -7.284 1.00 0.00 C ATOM 1610 O GLN A 98 6.530 -11.228 -6.402 1.00 0.00 O ATOM 1611 CB GLN A 98 9.072 -11.381 -7.526 1.00 0.00 C ATOM 1612 CG GLN A 98 10.412 -11.299 -8.240 1.00 0.00 C ATOM 1613 CD GLN A 98 11.322 -12.465 -7.907 1.00 0.00 C ATOM 1614 OE1 GLN A 98 12.249 -12.335 -7.107 1.00 0.00 O ATOM 1615 NE2 GLN A 98 11.063 -13.613 -8.522 1.00 0.00 N ATOM 0 H GLN A 98 8.303 -9.242 -9.778 1.00 0.00 H new ATOM 0 HA GLN A 98 7.593 -11.226 -9.083 1.00 0.00 H new ATOM 0 HB2 GLN A 98 9.182 -10.980 -6.518 1.00 0.00 H new ATOM 0 HB3 GLN A 98 8.788 -12.428 -7.423 1.00 0.00 H new ATOM 0 HG2 GLN A 98 10.245 -11.269 -9.317 1.00 0.00 H new ATOM 0 HG3 GLN A 98 10.908 -10.367 -7.969 1.00 0.00 H new ATOM 0 HE21 GLN A 98 10.284 -13.676 -9.178 1.00 0.00 H new ATOM 0 HE22 GLN A 98 11.643 -14.432 -8.339 1.00 0.00 H new ATOM 1624 N ASP A 99 6.070 -9.290 -7.462 1.00 0.00 N ATOM 1625 CA ASP A 99 4.922 -8.947 -6.616 1.00 0.00 C ATOM 1626 C ASP A 99 5.359 -8.266 -5.318 1.00 0.00 C ATOM 1627 O ASP A 99 4.572 -7.561 -4.687 1.00 0.00 O ATOM 1628 CB ASP A 99 4.085 -10.192 -6.295 1.00 0.00 C ATOM 1629 CG ASP A 99 2.614 -9.869 -6.119 1.00 0.00 C ATOM 1630 OD1 ASP A 99 2.290 -9.020 -5.263 1.00 0.00 O ATOM 1631 OD2 ASP A 99 1.785 -10.467 -6.839 1.00 0.00 O ATOM 0 H ASP A 99 6.271 -8.603 -8.189 1.00 0.00 H new ATOM 0 HA ASP A 99 4.309 -8.244 -7.180 1.00 0.00 H new ATOM 0 HB2 ASP A 99 4.201 -10.921 -7.097 1.00 0.00 H new ATOM 0 HB3 ASP A 99 4.464 -10.657 -5.385 1.00 0.00 H new ATOM 1636 N ASN A 100 6.613 -8.475 -4.921 1.00 0.00 N ATOM 1637 CA ASN A 100 7.135 -7.872 -3.701 1.00 0.00 C ATOM 1638 C ASN A 100 7.074 -6.350 -3.783 1.00 0.00 C ATOM 1639 O ASN A 100 6.937 -5.669 -2.768 1.00 0.00 O ATOM 1640 CB ASN A 100 8.577 -8.330 -3.458 1.00 0.00 C ATOM 1641 CG ASN A 100 9.205 -7.673 -2.244 1.00 0.00 C ATOM 1642 OD1 ASN A 100 10.368 -7.271 -2.272 1.00 0.00 O ATOM 1643 ND2 ASN A 100 8.437 -7.561 -1.165 1.00 0.00 N ATOM 0 H ASN A 100 7.283 -9.056 -5.426 1.00 0.00 H new ATOM 0 HA ASN A 100 6.515 -8.197 -2.865 1.00 0.00 H new ATOM 0 HB2 ASN A 100 8.593 -9.412 -3.329 1.00 0.00 H new ATOM 0 HB3 ASN A 100 9.178 -8.105 -4.339 1.00 0.00 H new ATOM 0 HD21 ASN A 100 8.807 -7.129 -0.318 1.00 0.00 H new ATOM 0 HD22 ASN A 100 7.478 -7.907 -1.184 1.00 0.00 H new ATOM 1650 N LYS A 101 7.176 -5.825 -5.000 1.00 0.00 N ATOM 1651 CA LYS A 101 7.132 -4.384 -5.220 1.00 0.00 C ATOM 1652 C LYS A 101 6.414 -4.060 -6.526 1.00 0.00 C ATOM 1653 O LYS A 101 6.213 -4.937 -7.367 1.00 0.00 O ATOM 1654 CB LYS A 101 8.547 -3.806 -5.246 1.00 0.00 C ATOM 1655 CG LYS A 101 9.424 -4.290 -4.102 1.00 0.00 C ATOM 1656 CD LYS A 101 10.865 -3.841 -4.277 1.00 0.00 C ATOM 1657 CE LYS A 101 11.169 -2.603 -3.449 1.00 0.00 C ATOM 1658 NZ LYS A 101 12.275 -1.799 -4.037 1.00 0.00 N ATOM 0 H LYS A 101 7.290 -6.377 -5.850 1.00 0.00 H new ATOM 0 HA LYS A 101 6.579 -3.931 -4.397 1.00 0.00 H new ATOM 0 HB2 LYS A 101 9.020 -4.069 -6.192 1.00 0.00 H new ATOM 0 HB3 LYS A 101 8.487 -2.718 -5.211 1.00 0.00 H new ATOM 0 HG2 LYS A 101 9.035 -3.909 -3.158 1.00 0.00 H new ATOM 0 HG3 LYS A 101 9.385 -5.378 -4.047 1.00 0.00 H new ATOM 0 HD2 LYS A 101 11.536 -4.649 -3.985 1.00 0.00 H new ATOM 0 HD3 LYS A 101 11.056 -3.632 -5.329 1.00 0.00 H new ATOM 0 HE2 LYS A 101 10.273 -1.987 -3.374 1.00 0.00 H new ATOM 0 HE3 LYS A 101 11.436 -2.901 -2.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 12.451 -0.964 -3.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 13.138 -2.378 -4.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 12.010 -1.492 -4.995 1.00 0.00 H new ATOM 1672 N ALA A 102 6.032 -2.798 -6.694 1.00 0.00 N ATOM 1673 CA ALA A 102 5.340 -2.370 -7.903 1.00 0.00 C ATOM 1674 C ALA A 102 5.374 -0.853 -8.047 1.00 0.00 C ATOM 1675 O ALA A 102 5.798 -0.144 -7.135 1.00 0.00 O ATOM 1676 CB ALA A 102 3.903 -2.872 -7.897 1.00 0.00 C ATOM 0 H ALA A 102 6.189 -2.057 -6.011 1.00 0.00 H new ATOM 0 HA ALA A 102 5.858 -2.801 -8.760 1.00 0.00 H new ATOM 0 HB1 ALA A 102 3.399 -2.544 -8.806 1.00 0.00 H new ATOM 0 HB2 ALA A 102 3.898 -3.961 -7.852 1.00 0.00 H new ATOM 0 HB3 ALA A 102 3.381 -2.471 -7.028 1.00 0.00 H new ATOM 1682 N ASP A 103 4.925 -0.363 -9.196 1.00 0.00 N ATOM 1683 CA ASP A 103 4.903 1.070 -9.459 1.00 0.00 C ATOM 1684 C ASP A 103 3.475 1.554 -9.687 1.00 0.00 C ATOM 1685 O ASP A 103 2.760 1.025 -10.537 1.00 0.00 O ATOM 1686 CB ASP A 103 5.767 1.400 -10.676 1.00 0.00 C ATOM 1687 CG ASP A 103 5.391 0.577 -11.892 1.00 0.00 C ATOM 1688 OD1 ASP A 103 5.463 -0.668 -11.813 1.00 0.00 O ATOM 1689 OD2 ASP A 103 5.024 1.176 -12.925 1.00 0.00 O ATOM 0 H ASP A 103 4.571 -0.938 -9.961 1.00 0.00 H new ATOM 0 HA ASP A 103 5.309 1.583 -8.587 1.00 0.00 H new ATOM 0 HB2 ASP A 103 5.667 2.459 -10.913 1.00 0.00 H new ATOM 0 HB3 ASP A 103 6.815 1.225 -10.432 1.00 0.00 H new ATOM 1694 N VAL A 104 3.065 2.561 -8.921 1.00 0.00 N ATOM 1695 CA VAL A 104 1.720 3.113 -9.041 1.00 0.00 C ATOM 1696 C VAL A 104 1.387 3.431 -10.498 1.00 0.00 C ATOM 1697 O VAL A 104 1.954 4.350 -11.087 1.00 0.00 O ATOM 1698 CB VAL A 104 1.581 4.400 -8.202 1.00 0.00 C ATOM 1699 CG1 VAL A 104 0.208 5.030 -8.390 1.00 0.00 C ATOM 1700 CG2 VAL A 104 1.844 4.107 -6.733 1.00 0.00 C ATOM 0 H VAL A 104 3.644 3.010 -8.212 1.00 0.00 H new ATOM 0 HA VAL A 104 1.024 2.360 -8.670 1.00 0.00 H new ATOM 0 HB VAL A 104 2.326 5.115 -8.550 1.00 0.00 H new ATOM 0 HG11 VAL A 104 0.138 5.935 -7.787 1.00 0.00 H new ATOM 0 HG12 VAL A 104 0.064 5.281 -9.441 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -0.562 4.325 -8.077 1.00 0.00 H new ATOM 0 HG21 VAL A 104 1.742 5.025 -6.155 1.00 0.00 H new ATOM 0 HG22 VAL A 104 1.125 3.371 -6.374 1.00 0.00 H new ATOM 0 HG23 VAL A 104 2.854 3.715 -6.615 1.00 0.00 H new ATOM 1710 N ILE A 105 0.452 2.676 -11.066 1.00 0.00 N ATOM 1711 CA ILE A 105 0.031 2.889 -12.445 1.00 0.00 C ATOM 1712 C ILE A 105 -0.939 4.058 -12.511 1.00 0.00 C ATOM 1713 O ILE A 105 -0.800 4.956 -13.342 1.00 0.00 O ATOM 1714 CB ILE A 105 -0.643 1.633 -13.030 1.00 0.00 C ATOM 1715 CG1 ILE A 105 0.255 0.409 -12.842 1.00 0.00 C ATOM 1716 CG2 ILE A 105 -0.968 1.841 -14.502 1.00 0.00 C ATOM 1717 CD1 ILE A 105 1.591 0.527 -13.543 1.00 0.00 C ATOM 0 H ILE A 105 -0.028 1.911 -10.592 1.00 0.00 H new ATOM 0 HA ILE A 105 0.920 3.107 -13.036 1.00 0.00 H new ATOM 0 HB ILE A 105 -1.576 1.458 -12.495 1.00 0.00 H new ATOM 0 HG12 ILE A 105 0.425 0.253 -11.777 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -0.265 -0.474 -13.214 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -1.444 0.945 -14.900 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -1.645 2.689 -14.609 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -0.049 2.039 -15.053 1.00 0.00 H new ATOM 0 HD11 ILE A 105 2.175 -0.376 -13.367 1.00 0.00 H new ATOM 0 HD12 ILE A 105 1.430 0.652 -14.614 1.00 0.00 H new ATOM 0 HD13 ILE A 105 2.131 1.390 -13.154 1.00 0.00 H new ATOM 1729 N LEU A 106 -1.908 4.042 -11.606 1.00 0.00 N ATOM 1730 CA LEU A 106 -2.902 5.101 -11.520 1.00 0.00 C ATOM 1731 C LEU A 106 -3.220 5.376 -10.055 1.00 0.00 C ATOM 1732 O LEU A 106 -2.839 4.598 -9.180 1.00 0.00 O ATOM 1733 CB LEU A 106 -4.171 4.722 -12.294 1.00 0.00 C ATOM 1734 CG LEU A 106 -5.101 3.729 -11.594 1.00 0.00 C ATOM 1735 CD1 LEU A 106 -5.958 4.439 -10.556 1.00 0.00 C ATOM 1736 CD2 LEU A 106 -5.978 3.016 -12.614 1.00 0.00 C ATOM 0 H LEU A 106 -2.026 3.300 -10.916 1.00 0.00 H new ATOM 0 HA LEU A 106 -2.500 6.007 -11.973 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.733 5.632 -12.504 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.876 4.301 -13.255 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.490 2.985 -11.082 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -6.613 3.716 -10.069 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -5.314 4.906 -9.810 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -6.562 5.204 -11.044 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -6.634 2.313 -12.101 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -6.580 3.749 -13.151 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -5.348 2.475 -13.321 1.00 0.00 H new ATOM 1748 N LYS A 107 -3.899 6.481 -9.783 1.00 0.00 N ATOM 1749 CA LYS A 107 -4.233 6.838 -8.409 1.00 0.00 C ATOM 1750 C LYS A 107 -5.727 6.714 -8.127 1.00 0.00 C ATOM 1751 O LYS A 107 -6.547 7.393 -8.746 1.00 0.00 O ATOM 1752 CB LYS A 107 -3.768 8.264 -8.109 1.00 0.00 C ATOM 1753 CG LYS A 107 -4.088 8.726 -6.695 1.00 0.00 C ATOM 1754 CD LYS A 107 -4.794 10.073 -6.693 1.00 0.00 C ATOM 1755 CE LYS A 107 -5.711 10.220 -5.489 1.00 0.00 C ATOM 1756 NZ LYS A 107 -5.021 10.870 -4.341 1.00 0.00 N ATOM 0 H LYS A 107 -4.228 7.142 -10.487 1.00 0.00 H new ATOM 0 HA LYS A 107 -3.715 6.134 -7.758 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -2.691 8.327 -8.268 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -4.235 8.946 -8.819 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -4.717 7.984 -6.203 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -3.166 8.797 -6.117 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -4.054 10.873 -6.688 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -5.374 10.182 -7.609 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -6.585 10.809 -5.768 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -6.073 9.237 -5.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -5.066 10.246 -3.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -4.026 11.046 -4.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -5.488 11.773 -4.122 1.00 0.00 H new ATOM 1770 N TYR A 108 -6.065 5.868 -7.159 1.00 0.00 N ATOM 1771 CA TYR A 108 -7.449 5.679 -6.752 1.00 0.00 C ATOM 1772 C TYR A 108 -7.808 6.773 -5.742 1.00 0.00 C ATOM 1773 O TYR A 108 -7.340 6.758 -4.604 1.00 0.00 O ATOM 1774 CB TYR A 108 -7.621 4.283 -6.154 1.00 0.00 C ATOM 1775 CG TYR A 108 -7.358 3.171 -7.153 1.00 0.00 C ATOM 1776 CD1 TYR A 108 -7.776 3.295 -8.475 1.00 0.00 C ATOM 1777 CD2 TYR A 108 -6.716 1.993 -6.777 1.00 0.00 C ATOM 1778 CE1 TYR A 108 -7.568 2.279 -9.386 1.00 0.00 C ATOM 1779 CE2 TYR A 108 -6.502 0.979 -7.687 1.00 0.00 C ATOM 1780 CZ TYR A 108 -6.933 1.124 -8.989 1.00 0.00 C ATOM 1781 OH TYR A 108 -6.727 0.108 -9.897 1.00 0.00 O ATOM 0 H TYR A 108 -5.394 5.301 -6.641 1.00 0.00 H new ATOM 0 HA TYR A 108 -8.120 5.756 -7.608 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -6.943 4.171 -5.308 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -8.635 4.183 -5.766 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -8.271 4.201 -8.793 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -6.381 1.872 -5.757 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -7.902 2.390 -10.407 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -5.998 0.074 -7.381 1.00 0.00 H new ATOM 0 HH TYR A 108 -6.989 0.411 -10.792 1.00 0.00 H new ATOM 1791 N ASN A 109 -8.595 7.750 -6.190 1.00 0.00 N ATOM 1792 CA ASN A 109 -8.971 8.896 -5.355 1.00 0.00 C ATOM 1793 C ASN A 109 -9.961 8.540 -4.249 1.00 0.00 C ATOM 1794 O ASN A 109 -10.419 7.402 -4.141 1.00 0.00 O ATOM 1795 CB ASN A 109 -9.560 10.004 -6.227 1.00 0.00 C ATOM 1796 CG ASN A 109 -8.637 10.398 -7.364 1.00 0.00 C ATOM 1797 OD1 ASN A 109 -7.593 9.782 -7.573 1.00 0.00 O ATOM 1798 ND2 ASN A 109 -9.021 11.431 -8.106 1.00 0.00 N ATOM 0 H ASN A 109 -8.988 7.773 -7.131 1.00 0.00 H new ATOM 0 HA ASN A 109 -8.057 9.236 -4.867 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -10.514 9.672 -6.636 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -9.765 10.878 -5.609 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -8.442 11.742 -8.885 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -9.895 11.913 -7.896 1.00 0.00 H new ATOM 1805 N ALA A 110 -10.282 9.546 -3.431 1.00 0.00 N ATOM 1806 CA ALA A 110 -11.215 9.385 -2.321 1.00 0.00 C ATOM 1807 C ALA A 110 -12.656 9.362 -2.816 1.00 0.00 C ATOM 1808 O ALA A 110 -13.470 8.573 -2.341 1.00 0.00 O ATOM 1809 CB ALA A 110 -11.022 10.500 -1.304 1.00 0.00 C ATOM 0 H ALA A 110 -9.903 10.489 -3.521 1.00 0.00 H new ATOM 0 HA ALA A 110 -11.008 8.429 -1.839 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -11.725 10.368 -0.481 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -10.003 10.469 -0.919 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -11.200 11.463 -1.782 1.00 0.00 H new ATOM 1815 N ASP A 111 -12.969 10.215 -3.789 1.00 0.00 N ATOM 1816 CA ASP A 111 -14.314 10.251 -4.346 1.00 0.00 C ATOM 1817 C ASP A 111 -14.606 8.910 -4.990 1.00 0.00 C ATOM 1818 O ASP A 111 -15.690 8.346 -4.840 1.00 0.00 O ATOM 1819 CB ASP A 111 -14.447 11.376 -5.375 1.00 0.00 C ATOM 1820 CG ASP A 111 -14.161 12.740 -4.780 1.00 0.00 C ATOM 1821 OD1 ASP A 111 -14.661 13.021 -3.670 1.00 0.00 O ATOM 1822 OD2 ASP A 111 -13.436 13.528 -5.423 1.00 0.00 O ATOM 0 H ASP A 111 -12.317 10.882 -4.202 1.00 0.00 H new ATOM 0 HA ASP A 111 -15.032 10.445 -3.549 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -13.760 11.192 -6.201 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -15.455 11.368 -5.790 1.00 0.00 H new ATOM 1827 N GLU A 112 -13.598 8.388 -5.674 1.00 0.00 N ATOM 1828 CA GLU A 112 -13.697 7.087 -6.311 1.00 0.00 C ATOM 1829 C GLU A 112 -13.833 6.015 -5.246 1.00 0.00 C ATOM 1830 O GLU A 112 -14.398 4.953 -5.487 1.00 0.00 O ATOM 1831 CB GLU A 112 -12.455 6.801 -7.155 1.00 0.00 C ATOM 1832 CG GLU A 112 -12.255 7.781 -8.290 1.00 0.00 C ATOM 1833 CD GLU A 112 -10.796 8.088 -8.555 1.00 0.00 C ATOM 1834 OE1 GLU A 112 -9.950 7.197 -8.325 1.00 0.00 O ATOM 1835 OE2 GLU A 112 -10.497 9.218 -8.994 1.00 0.00 O ATOM 0 H GLU A 112 -12.698 8.851 -5.801 1.00 0.00 H new ATOM 0 HA GLU A 112 -14.572 7.084 -6.962 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -11.576 6.820 -6.511 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -12.528 5.794 -7.565 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -12.706 7.376 -9.196 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -12.780 8.708 -8.059 1.00 0.00 H new ATOM 1842 N ALA A 113 -13.279 6.307 -4.069 1.00 0.00 N ATOM 1843 CA ALA A 113 -13.289 5.376 -2.943 1.00 0.00 C ATOM 1844 C ALA A 113 -14.645 4.697 -2.767 1.00 0.00 C ATOM 1845 O ALA A 113 -14.716 3.472 -2.678 1.00 0.00 O ATOM 1846 CB ALA A 113 -12.889 6.089 -1.661 1.00 0.00 C ATOM 0 H ALA A 113 -12.813 7.192 -3.871 1.00 0.00 H new ATOM 0 HA ALA A 113 -12.560 4.596 -3.164 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -12.902 5.381 -0.832 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -11.886 6.501 -1.771 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -13.593 6.897 -1.459 1.00 0.00 H new ATOM 1852 N ARG A 114 -15.726 5.473 -2.736 1.00 0.00 N ATOM 1853 CA ARG A 114 -17.056 4.879 -2.596 1.00 0.00 C ATOM 1854 C ARG A 114 -17.288 3.869 -3.713 1.00 0.00 C ATOM 1855 O ARG A 114 -18.035 2.903 -3.556 1.00 0.00 O ATOM 1856 CB ARG A 114 -18.140 5.961 -2.616 1.00 0.00 C ATOM 1857 CG ARG A 114 -18.380 6.605 -1.259 1.00 0.00 C ATOM 1858 CD ARG A 114 -18.625 8.100 -1.387 1.00 0.00 C ATOM 1859 NE ARG A 114 -20.032 8.405 -1.640 1.00 0.00 N ATOM 1860 CZ ARG A 114 -20.504 9.638 -1.806 1.00 0.00 C ATOM 1861 NH1 ARG A 114 -19.686 10.682 -1.749 1.00 0.00 N ATOM 1862 NH2 ARG A 114 -21.797 9.829 -2.030 1.00 0.00 N ATOM 0 H ARG A 114 -15.712 6.491 -2.804 1.00 0.00 H new ATOM 0 HA ARG A 114 -17.112 4.366 -1.636 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -17.858 6.734 -3.331 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -19.073 5.523 -2.972 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -19.238 6.135 -0.779 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -17.518 6.430 -0.615 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -18.305 8.599 -0.473 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -18.016 8.499 -2.198 1.00 0.00 H new ATOM 0 HE ARG A 114 -20.690 7.628 -1.692 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -18.690 10.541 -1.577 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -20.053 11.625 -1.877 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -22.430 9.031 -2.075 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -22.158 10.774 -2.157 1.00 0.00 H new ATOM 1876 N SER A 115 -16.607 4.093 -4.826 1.00 0.00 N ATOM 1877 CA SER A 115 -16.678 3.213 -5.979 1.00 0.00 C ATOM 1878 C SER A 115 -15.783 1.999 -5.768 1.00 0.00 C ATOM 1879 O SER A 115 -15.975 0.966 -6.400 1.00 0.00 O ATOM 1880 CB SER A 115 -16.267 3.962 -7.247 1.00 0.00 C ATOM 1881 OG SER A 115 -17.277 3.875 -8.237 1.00 0.00 O ATOM 0 H SER A 115 -15.988 4.893 -4.954 1.00 0.00 H new ATOM 0 HA SER A 115 -17.707 2.873 -6.096 1.00 0.00 H new ATOM 0 HB2 SER A 115 -16.074 5.008 -7.010 1.00 0.00 H new ATOM 0 HB3 SER A 115 -15.337 3.546 -7.634 1.00 0.00 H new ATOM 0 HG SER A 115 -17.555 4.777 -8.500 1.00 0.00 H new ATOM 1887 N LEU A 116 -14.789 2.128 -4.887 1.00 0.00 N ATOM 1888 CA LEU A 116 -13.871 1.028 -4.617 1.00 0.00 C ATOM 1889 C LEU A 116 -14.628 -0.253 -4.329 1.00 0.00 C ATOM 1890 O LEU A 116 -14.201 -1.331 -4.739 1.00 0.00 O ATOM 1891 CB LEU A 116 -12.915 1.381 -3.487 1.00 0.00 C ATOM 1892 CG LEU A 116 -11.890 2.469 -3.833 1.00 0.00 C ATOM 1893 CD1 LEU A 116 -10.490 1.904 -3.855 1.00 0.00 C ATOM 1894 CD2 LEU A 116 -12.192 3.124 -5.175 1.00 0.00 C ATOM 0 H LEU A 116 -14.603 2.977 -4.354 1.00 0.00 H new ATOM 0 HA LEU A 116 -13.272 0.859 -5.512 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -13.497 1.709 -2.626 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -12.381 0.480 -3.186 1.00 0.00 H new ATOM 0 HG LEU A 116 -11.961 3.228 -3.054 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -9.782 2.695 -4.103 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -10.248 1.494 -2.875 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -10.428 1.114 -4.604 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -11.444 3.889 -5.383 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -12.169 2.370 -5.961 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -13.180 3.583 -5.142 1.00 0.00 H new ATOM 1906 N LYS A 117 -15.789 -0.146 -3.694 1.00 0.00 N ATOM 1907 CA LYS A 117 -16.597 -1.339 -3.475 1.00 0.00 C ATOM 1908 C LYS A 117 -16.813 -1.987 -4.844 1.00 0.00 C ATOM 1909 O LYS A 117 -16.835 -3.209 -4.991 1.00 0.00 O ATOM 1910 CB LYS A 117 -17.938 -0.983 -2.829 1.00 0.00 C ATOM 1911 CG LYS A 117 -17.957 -1.170 -1.321 1.00 0.00 C ATOM 1912 CD LYS A 117 -17.685 0.137 -0.595 1.00 0.00 C ATOM 1913 CE LYS A 117 -18.062 0.045 0.875 1.00 0.00 C ATOM 1914 NZ LYS A 117 -18.339 1.384 1.464 1.00 0.00 N ATOM 0 H LYS A 117 -16.182 0.723 -3.332 1.00 0.00 H new ATOM 0 HA LYS A 117 -16.091 -2.024 -2.795 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -18.179 0.054 -3.061 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -18.720 -1.599 -3.273 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -18.926 -1.563 -1.014 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -17.208 -1.909 -1.035 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -16.629 0.392 -0.686 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -18.249 0.941 -1.067 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -18.942 -0.589 0.985 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -17.254 -0.434 1.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -18.592 1.276 2.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -17.491 1.981 1.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -19.127 1.831 0.954 1.00 0.00 H new ATOM 1928 N ALA A 118 -16.922 -1.110 -5.846 1.00 0.00 N ATOM 1929 CA ALA A 118 -17.082 -1.480 -7.246 1.00 0.00 C ATOM 1930 C ALA A 118 -15.733 -1.865 -7.873 1.00 0.00 C ATOM 1931 O ALA A 118 -15.687 -2.537 -8.902 1.00 0.00 O ATOM 1932 CB ALA A 118 -17.718 -0.329 -8.014 1.00 0.00 C ATOM 0 H ALA A 118 -16.900 -0.101 -5.698 1.00 0.00 H new ATOM 0 HA ALA A 118 -17.736 -2.350 -7.302 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -17.835 -0.611 -9.060 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -18.695 -0.103 -7.587 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -17.079 0.552 -7.945 1.00 0.00 H new ATOM 1938 N TYR A 119 -14.635 -1.418 -7.246 1.00 0.00 N ATOM 1939 CA TYR A 119 -13.279 -1.699 -7.742 1.00 0.00 C ATOM 1940 C TYR A 119 -12.961 -3.190 -7.646 1.00 0.00 C ATOM 1941 O TYR A 119 -11.894 -3.628 -8.075 1.00 0.00 O ATOM 1942 CB TYR A 119 -12.219 -0.951 -6.904 1.00 0.00 C ATOM 1943 CG TYR A 119 -11.932 0.480 -7.317 1.00 0.00 C ATOM 1944 CD1 TYR A 119 -12.913 1.264 -7.895 1.00 0.00 C ATOM 1945 CD2 TYR A 119 -10.679 1.052 -7.096 1.00 0.00 C ATOM 1946 CE1 TYR A 119 -12.661 2.574 -8.259 1.00 0.00 C ATOM 1947 CE2 TYR A 119 -10.415 2.367 -7.451 1.00 0.00 C ATOM 1948 CZ TYR A 119 -11.410 3.120 -8.037 1.00 0.00 C ATOM 1949 OH TYR A 119 -11.155 4.422 -8.396 1.00 0.00 O ATOM 0 H TYR A 119 -14.659 -0.859 -6.393 1.00 0.00 H new ATOM 0 HA TYR A 119 -13.249 -1.368 -8.780 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -12.543 -0.950 -5.863 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -11.287 -1.514 -6.947 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -13.894 0.846 -8.065 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -9.899 0.460 -6.640 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -13.439 3.169 -8.715 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -9.441 2.796 -7.270 1.00 0.00 H new ATOM 0 HH TYR A 119 -10.187 4.578 -8.397 1.00 0.00 H new ATOM 1959 N GLY A 120 -13.875 -3.964 -7.070 1.00 0.00 N ATOM 1960 CA GLY A 120 -13.639 -5.386 -6.919 1.00 0.00 C ATOM 1961 C GLY A 120 -12.397 -5.665 -6.092 1.00 0.00 C ATOM 1962 O GLY A 120 -11.814 -6.747 -6.175 1.00 0.00 O ATOM 0 H GLY A 120 -14.769 -3.634 -6.707 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -14.504 -5.850 -6.445 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -13.531 -5.843 -7.903 1.00 0.00 H new ATOM 1966 N GLU A 121 -11.989 -4.676 -5.298 1.00 0.00 N ATOM 1967 CA GLU A 121 -10.805 -4.802 -4.455 1.00 0.00 C ATOM 1968 C GLU A 121 -11.184 -4.845 -2.978 1.00 0.00 C ATOM 1969 O GLU A 121 -10.900 -5.822 -2.282 1.00 0.00 O ATOM 1970 CB GLU A 121 -9.852 -3.631 -4.708 1.00 0.00 C ATOM 1971 CG GLU A 121 -9.408 -3.501 -6.157 1.00 0.00 C ATOM 1972 CD GLU A 121 -8.914 -4.812 -6.738 1.00 0.00 C ATOM 1973 OE1 GLU A 121 -8.286 -5.593 -5.992 1.00 0.00 O ATOM 1974 OE2 GLU A 121 -9.157 -5.057 -7.939 1.00 0.00 O ATOM 0 H GLU A 121 -12.464 -3.777 -5.222 1.00 0.00 H new ATOM 0 HA GLU A 121 -10.308 -5.738 -4.711 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -10.340 -2.705 -4.403 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -8.971 -3.749 -4.077 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -10.241 -3.134 -6.756 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -8.615 -2.757 -6.224 1.00 0.00 H new ATOM 1981 N LEU A 122 -11.824 -3.781 -2.502 1.00 0.00 N ATOM 1982 CA LEU A 122 -12.236 -3.702 -1.102 1.00 0.00 C ATOM 1983 C LEU A 122 -13.684 -4.160 -0.935 1.00 0.00 C ATOM 1984 O LEU A 122 -14.523 -3.924 -1.804 1.00 0.00 O ATOM 1985 CB LEU A 122 -12.072 -2.275 -0.552 1.00 0.00 C ATOM 1986 CG LEU A 122 -11.518 -1.238 -1.531 1.00 0.00 C ATOM 1987 CD1 LEU A 122 -11.558 0.149 -0.908 1.00 0.00 C ATOM 1988 CD2 LEU A 122 -10.100 -1.596 -1.946 1.00 0.00 C ATOM 0 H LEU A 122 -12.068 -2.964 -3.062 1.00 0.00 H new ATOM 0 HA LEU A 122 -11.587 -4.368 -0.532 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -13.044 -1.929 -0.199 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -11.413 -2.315 0.315 1.00 0.00 H new ATOM 0 HG LEU A 122 -12.144 -1.236 -2.424 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -11.161 0.877 -1.615 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -12.588 0.407 -0.661 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -10.954 0.158 -0.001 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -9.724 -0.846 -2.642 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -9.459 -1.626 -1.065 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -10.098 -2.573 -2.429 1.00 0.00 H new ATOM 2000 N PRO A 123 -13.996 -4.824 0.193 1.00 0.00 N ATOM 2001 CA PRO A 123 -15.348 -5.314 0.473 1.00 0.00 C ATOM 2002 C PRO A 123 -16.293 -4.196 0.902 1.00 0.00 C ATOM 2003 O PRO A 123 -15.899 -3.034 0.985 1.00 0.00 O ATOM 2004 CB PRO A 123 -15.129 -6.298 1.620 1.00 0.00 C ATOM 2005 CG PRO A 123 -13.932 -5.774 2.336 1.00 0.00 C ATOM 2006 CD PRO A 123 -13.055 -5.148 1.284 1.00 0.00 C ATOM 0 HA PRO A 123 -15.815 -5.756 -0.407 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -15.997 -6.341 2.277 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -14.959 -7.309 1.249 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -14.219 -5.041 3.090 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -13.406 -6.576 2.855 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -12.554 -4.256 1.659 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -12.277 -5.834 0.951 1.00 0.00 H new ATOM 2014 N GLU A 124 -17.543 -4.559 1.171 1.00 0.00 N ATOM 2015 CA GLU A 124 -18.546 -3.587 1.590 1.00 0.00 C ATOM 2016 C GLU A 124 -18.240 -3.049 2.985 1.00 0.00 C ATOM 2017 O GLU A 124 -18.582 -1.913 3.311 1.00 0.00 O ATOM 2018 CB GLU A 124 -19.939 -4.221 1.573 1.00 0.00 C ATOM 2019 CG GLU A 124 -20.068 -5.433 2.481 1.00 0.00 C ATOM 2020 CD GLU A 124 -21.012 -6.480 1.923 1.00 0.00 C ATOM 2021 OE1 GLU A 124 -22.032 -6.096 1.314 1.00 0.00 O ATOM 2022 OE2 GLU A 124 -20.730 -7.685 2.096 1.00 0.00 O ATOM 0 H GLU A 124 -17.885 -5.518 1.106 1.00 0.00 H new ATOM 0 HA GLU A 124 -18.521 -2.755 0.887 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -20.673 -3.473 1.873 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -20.183 -4.515 0.552 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -19.084 -5.878 2.629 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -20.424 -5.113 3.460 1.00 0.00 H new ATOM 2029 N HIS A 125 -17.593 -3.872 3.805 1.00 0.00 N ATOM 2030 CA HIS A 125 -17.242 -3.474 5.166 1.00 0.00 C ATOM 2031 C HIS A 125 -15.969 -2.629 5.191 1.00 0.00 C ATOM 2032 O HIS A 125 -15.527 -2.194 6.255 1.00 0.00 O ATOM 2033 CB HIS A 125 -17.063 -4.710 6.050 1.00 0.00 C ATOM 2034 CG HIS A 125 -16.058 -5.685 5.521 1.00 0.00 C ATOM 2035 ND1 HIS A 125 -16.400 -6.762 4.730 1.00 0.00 N ATOM 2036 CD2 HIS A 125 -14.714 -5.745 5.674 1.00 0.00 C ATOM 2037 CE1 HIS A 125 -15.311 -7.443 4.422 1.00 0.00 C ATOM 2038 NE2 HIS A 125 -14.274 -6.846 4.981 1.00 0.00 N ATOM 0 H HIS A 125 -17.301 -4.816 3.552 1.00 0.00 H new ATOM 0 HA HIS A 125 -18.059 -2.867 5.555 1.00 0.00 H new ATOM 0 HB2 HIS A 125 -16.758 -4.392 7.047 1.00 0.00 H new ATOM 0 HB3 HIS A 125 -18.024 -5.213 6.156 1.00 0.00 H new ATOM 0 HD2 HIS A 125 -14.102 -5.055 6.236 1.00 0.00 H new ATOM 0 HE1 HIS A 125 -15.275 -8.336 3.816 1.00 0.00 H new ATOM 0 HE2 HIS A 125 -13.304 -7.153 4.910 1.00 0.00 H new ATOM 2047 N ALA A 126 -15.381 -2.395 4.020 1.00 0.00 N ATOM 2048 CA ALA A 126 -14.163 -1.600 3.924 1.00 0.00 C ATOM 2049 C ALA A 126 -14.426 -0.150 4.312 1.00 0.00 C ATOM 2050 O ALA A 126 -15.500 0.390 4.045 1.00 0.00 O ATOM 2051 CB ALA A 126 -13.593 -1.676 2.516 1.00 0.00 C ATOM 0 H ALA A 126 -15.729 -2.745 3.127 1.00 0.00 H new ATOM 0 HA ALA A 126 -13.433 -2.010 4.622 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -12.684 -1.078 2.459 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -13.361 -2.713 2.273 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -14.325 -1.292 1.806 1.00 0.00 H new ATOM 2057 N LYS A 127 -13.439 0.476 4.946 1.00 0.00 N ATOM 2058 CA LYS A 127 -13.566 1.865 5.372 1.00 0.00 C ATOM 2059 C LYS A 127 -12.428 2.714 4.814 1.00 0.00 C ATOM 2060 O LYS A 127 -11.255 2.449 5.078 1.00 0.00 O ATOM 2061 CB LYS A 127 -13.581 1.953 6.899 1.00 0.00 C ATOM 2062 CG LYS A 127 -14.921 1.588 7.517 1.00 0.00 C ATOM 2063 CD LYS A 127 -14.753 1.001 8.908 1.00 0.00 C ATOM 2064 CE LYS A 127 -14.089 1.988 9.855 1.00 0.00 C ATOM 2065 NZ LYS A 127 -12.641 1.692 10.041 1.00 0.00 N ATOM 0 H LYS A 127 -12.544 0.044 5.176 1.00 0.00 H new ATOM 0 HA LYS A 127 -14.508 2.252 4.983 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -12.813 1.291 7.300 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -13.316 2.967 7.199 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -15.552 2.475 7.569 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -15.434 0.869 6.878 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -15.728 0.716 9.303 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -14.154 0.092 8.850 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -14.206 2.999 9.465 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -14.592 1.959 10.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -12.475 1.369 11.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -12.351 0.947 9.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -12.085 2.552 9.862 1.00 0.00 H new ATOM 2079 N ILE A 128 -12.783 3.737 4.044 1.00 0.00 N ATOM 2080 CA ILE A 128 -11.794 4.626 3.452 1.00 0.00 C ATOM 2081 C ILE A 128 -11.510 5.812 4.369 1.00 0.00 C ATOM 2082 O ILE A 128 -12.389 6.266 5.103 1.00 0.00 O ATOM 2083 CB ILE A 128 -12.267 5.147 2.081 1.00 0.00 C ATOM 2084 CG1 ILE A 128 -12.627 3.975 1.162 1.00 0.00 C ATOM 2085 CG2 ILE A 128 -11.197 6.022 1.440 1.00 0.00 C ATOM 2086 CD1 ILE A 128 -14.005 4.090 0.549 1.00 0.00 C ATOM 0 H ILE A 128 -13.750 3.970 3.816 1.00 0.00 H new ATOM 0 HA ILE A 128 -10.879 4.049 3.317 1.00 0.00 H new ATOM 0 HB ILE A 128 -13.159 5.756 2.232 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -11.887 3.909 0.364 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -12.567 3.047 1.730 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -11.551 6.380 0.473 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -10.987 6.874 2.087 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -10.286 5.440 1.300 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -14.192 3.227 -0.089 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -14.754 4.125 1.341 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -14.063 5.001 -0.047 1.00 0.00 H new ATOM 2098 N ASN A 129 -10.278 6.306 4.326 1.00 0.00 N ATOM 2099 CA ASN A 129 -9.880 7.437 5.155 1.00 0.00 C ATOM 2100 C ASN A 129 -10.650 8.697 4.774 1.00 0.00 C ATOM 2101 O ASN A 129 -10.189 9.497 3.960 1.00 0.00 O ATOM 2102 CB ASN A 129 -8.376 7.686 5.025 1.00 0.00 C ATOM 2103 CG ASN A 129 -7.563 6.419 5.205 1.00 0.00 C ATOM 2104 OD1 ASN A 129 -6.795 6.030 4.325 1.00 0.00 O ATOM 2105 ND2 ASN A 129 -7.731 5.765 6.349 1.00 0.00 N ATOM 0 H ASN A 129 -9.538 5.941 3.726 1.00 0.00 H new ATOM 0 HA ASN A 129 -10.115 7.193 6.191 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -8.165 8.114 4.045 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -8.067 8.422 5.768 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -7.213 4.904 6.525 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -8.378 6.124 7.051 1.00 0.00 H new ATOM 2112 N GLU A 130 -11.827 8.867 5.368 1.00 0.00 N ATOM 2113 CA GLU A 130 -12.664 10.032 5.093 1.00 0.00 C ATOM 2114 C GLU A 130 -12.963 10.152 3.603 1.00 0.00 C ATOM 2115 O GLU A 130 -12.530 9.323 2.803 1.00 0.00 O ATOM 2116 CB GLU A 130 -11.980 11.306 5.592 1.00 0.00 C ATOM 2117 CG GLU A 130 -12.250 11.608 7.057 1.00 0.00 C ATOM 2118 CD GLU A 130 -12.051 13.073 7.397 1.00 0.00 C ATOM 2119 OE1 GLU A 130 -10.902 13.552 7.307 1.00 0.00 O ATOM 2120 OE2 GLU A 130 -13.045 13.739 7.752 1.00 0.00 O ATOM 0 H GLU A 130 -12.224 8.213 6.043 1.00 0.00 H new ATOM 0 HA GLU A 130 -13.607 9.902 5.623 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -10.904 11.214 5.441 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -12.316 12.149 4.988 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -13.272 11.318 7.302 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -11.589 11.002 7.677 1.00 0.00 H new ATOM 2127 N THR A 131 -13.706 11.192 3.236 1.00 0.00 N ATOM 2128 CA THR A 131 -14.063 11.426 1.842 1.00 0.00 C ATOM 2129 C THR A 131 -13.023 12.299 1.147 1.00 0.00 C ATOM 2130 O THR A 131 -12.904 12.281 -0.078 1.00 0.00 O ATOM 2131 CB THR A 131 -15.440 12.085 1.751 1.00 0.00 C ATOM 2132 OG1 THR A 131 -16.324 11.537 2.712 1.00 0.00 O ATOM 2133 CG2 THR A 131 -16.087 11.931 0.392 1.00 0.00 C ATOM 0 H THR A 131 -14.073 11.887 3.887 1.00 0.00 H new ATOM 0 HA THR A 131 -14.093 10.461 1.337 1.00 0.00 H new ATOM 0 HB THR A 131 -15.265 13.145 1.935 1.00 0.00 H new ATOM 0 HG1 THR A 131 -17.198 11.973 2.638 1.00 0.00 H new ATOM 0 HG21 THR A 131 -17.061 12.421 0.395 1.00 0.00 H new ATOM 0 HG22 THR A 131 -15.453 12.389 -0.367 1.00 0.00 H new ATOM 0 HG23 THR A 131 -16.214 10.872 0.167 1.00 0.00 H new ATOM 2141 N ASP A 132 -12.267 13.060 1.937 1.00 0.00 N ATOM 2142 CA ASP A 132 -11.237 13.936 1.409 1.00 0.00 C ATOM 2143 C ASP A 132 -10.713 14.871 2.495 1.00 0.00 C ATOM 2144 O ASP A 132 -11.394 15.813 2.898 1.00 0.00 O ATOM 2145 CB ASP A 132 -11.771 14.750 0.228 1.00 0.00 C ATOM 2146 CG ASP A 132 -11.164 14.320 -1.094 1.00 0.00 C ATOM 2147 OD1 ASP A 132 -9.978 14.626 -1.329 1.00 0.00 O ATOM 2148 OD2 ASP A 132 -11.878 13.677 -1.893 1.00 0.00 O ATOM 0 H ASP A 132 -12.354 13.083 2.953 1.00 0.00 H new ATOM 0 HA ASP A 132 -10.414 13.313 1.059 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -12.855 14.644 0.178 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -11.561 15.807 0.394 1.00 0.00 H new ATOM 2153 N THR A 133 -9.500 14.601 2.966 1.00 0.00 N ATOM 2154 CA THR A 133 -8.885 15.416 4.007 1.00 0.00 C ATOM 2155 C THR A 133 -8.380 16.738 3.438 1.00 0.00 C ATOM 2156 O THR A 133 -7.318 16.794 2.819 1.00 0.00 O ATOM 2157 CB THR A 133 -7.732 14.656 4.664 1.00 0.00 C ATOM 2158 OG1 THR A 133 -7.895 13.259 4.501 1.00 0.00 O ATOM 2159 CG2 THR A 133 -7.600 14.933 6.146 1.00 0.00 C ATOM 0 H THR A 133 -8.923 13.824 2.643 1.00 0.00 H new ATOM 0 HA THR A 133 -9.644 15.632 4.759 1.00 0.00 H new ATOM 0 HB THR A 133 -6.831 15.009 4.163 1.00 0.00 H new ATOM 0 HG1 THR A 133 -7.147 12.791 4.926 1.00 0.00 H new ATOM 0 HG21 THR A 133 -6.763 14.363 6.550 1.00 0.00 H new ATOM 0 HG22 THR A 133 -7.423 15.997 6.303 1.00 0.00 H new ATOM 0 HG23 THR A 133 -8.518 14.639 6.654 1.00 0.00 H new ATOM 2167 N PHE A 134 -9.148 17.802 3.656 1.00 0.00 N ATOM 2168 CA PHE A 134 -8.778 19.124 3.166 1.00 0.00 C ATOM 2169 C PHE A 134 -8.111 19.943 4.268 1.00 0.00 C ATOM 2170 O PHE A 134 -8.768 20.722 4.959 1.00 0.00 O ATOM 2171 CB PHE A 134 -10.012 19.862 2.641 1.00 0.00 C ATOM 2172 CG PHE A 134 -10.192 19.747 1.154 1.00 0.00 C ATOM 2173 CD1 PHE A 134 -10.093 18.517 0.524 1.00 0.00 C ATOM 2174 CD2 PHE A 134 -10.461 20.869 0.387 1.00 0.00 C ATOM 2175 CE1 PHE A 134 -10.258 18.408 -0.843 1.00 0.00 C ATOM 2176 CE2 PHE A 134 -10.626 20.766 -0.982 1.00 0.00 C ATOM 2177 CZ PHE A 134 -10.525 19.533 -1.598 1.00 0.00 C ATOM 0 H PHE A 134 -10.029 17.773 4.168 1.00 0.00 H new ATOM 0 HA PHE A 134 -8.067 18.996 2.350 1.00 0.00 H new ATOM 0 HB2 PHE A 134 -10.899 19.469 3.138 1.00 0.00 H new ATOM 0 HB3 PHE A 134 -9.937 20.916 2.909 1.00 0.00 H new ATOM 0 HD1 PHE A 134 -9.884 17.633 1.109 1.00 0.00 H new ATOM 0 HD2 PHE A 134 -10.543 21.835 0.864 1.00 0.00 H new ATOM 0 HE1 PHE A 134 -10.178 17.443 -1.321 1.00 0.00 H new ATOM 0 HE2 PHE A 134 -10.834 21.648 -1.569 1.00 0.00 H new ATOM 0 HZ PHE A 134 -10.655 19.450 -2.667 1.00 0.00 H new ATOM 2187 N GLY A 135 -6.804 19.762 4.425 1.00 0.00 N ATOM 2188 CA GLY A 135 -6.072 20.490 5.444 1.00 0.00 C ATOM 2189 C GLY A 135 -5.067 21.463 4.854 1.00 0.00 C ATOM 2190 O GLY A 135 -4.906 21.527 3.635 1.00 0.00 O ATOM 0 H GLY A 135 -6.239 19.124 3.865 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -6.776 21.036 6.072 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -5.552 19.782 6.089 1.00 0.00 H new ATOM 2194 N PRO A 136 -4.369 22.239 5.701 1.00 0.00 N ATOM 2195 CA PRO A 136 -3.374 23.214 5.245 1.00 0.00 C ATOM 2196 C PRO A 136 -2.384 22.614 4.251 1.00 0.00 C ATOM 2197 O PRO A 136 -1.381 22.018 4.642 1.00 0.00 O ATOM 2198 CB PRO A 136 -2.658 23.618 6.533 1.00 0.00 C ATOM 2199 CG PRO A 136 -3.669 23.405 7.607 1.00 0.00 C ATOM 2200 CD PRO A 136 -4.498 22.228 7.172 1.00 0.00 C ATOM 0 HA PRO A 136 -3.835 24.049 4.717 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -1.769 23.010 6.700 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -2.332 24.657 6.496 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -3.185 23.209 8.564 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -4.290 24.291 7.739 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -4.128 21.296 7.600 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -5.537 22.332 7.484 1.00 0.00 H new ATOM 2208 N GLY A 137 -2.673 22.777 2.965 1.00 0.00 N ATOM 2209 CA GLY A 137 -1.799 22.248 1.934 1.00 0.00 C ATOM 2210 C GLY A 137 -1.858 23.056 0.653 1.00 0.00 C ATOM 2211 O GLY A 137 -2.794 22.914 -0.135 1.00 0.00 O ATOM 0 H GLY A 137 -3.498 23.266 2.617 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -0.774 22.233 2.304 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -2.076 21.215 1.722 1.00 0.00 H new ATOM 2215 N ASP A 138 -0.856 23.906 0.446 1.00 0.00 N ATOM 2216 CA ASP A 138 -0.791 24.745 -0.748 1.00 0.00 C ATOM 2217 C ASP A 138 -1.958 25.726 -0.794 1.00 0.00 C ATOM 2218 O ASP A 138 -1.803 26.905 -0.479 1.00 0.00 O ATOM 2219 CB ASP A 138 -0.781 23.881 -2.011 1.00 0.00 C ATOM 2220 CG ASP A 138 0.526 23.132 -2.189 1.00 0.00 C ATOM 2221 OD1 ASP A 138 0.789 22.202 -1.398 1.00 0.00 O ATOM 2222 OD2 ASP A 138 1.286 23.476 -3.118 1.00 0.00 O ATOM 0 H ASP A 138 -0.076 24.032 1.091 1.00 0.00 H new ATOM 0 HA ASP A 138 0.136 25.317 -0.704 1.00 0.00 H new ATOM 0 HB2 ASP A 138 -1.603 23.166 -1.966 1.00 0.00 H new ATOM 0 HB3 ASP A 138 -0.956 24.513 -2.882 1.00 0.00 H new ATOM 2227 N ASP A 139 -3.129 25.233 -1.191 1.00 0.00 N ATOM 2228 CA ASP A 139 -4.319 26.070 -1.278 1.00 0.00 C ATOM 2229 C ASP A 139 -5.585 25.220 -1.280 1.00 0.00 C ATOM 2230 O ASP A 139 -5.607 24.121 -1.835 1.00 0.00 O ATOM 2231 CB ASP A 139 -4.268 26.933 -2.541 1.00 0.00 C ATOM 2232 CG ASP A 139 -5.105 28.190 -2.415 1.00 0.00 C ATOM 2233 OD1 ASP A 139 -5.996 28.227 -1.540 1.00 0.00 O ATOM 2234 OD2 ASP A 139 -4.870 29.140 -3.192 1.00 0.00 O ATOM 0 H ASP A 139 -3.277 24.259 -1.457 1.00 0.00 H new ATOM 0 HA ASP A 139 -4.341 26.719 -0.402 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -3.234 27.208 -2.749 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -4.620 26.349 -3.391 1.00 0.00 H new ATOM 2239 N ASP A 140 -6.640 25.735 -0.655 1.00 0.00 N ATOM 2240 CA ASP A 140 -7.911 25.023 -0.584 1.00 0.00 C ATOM 2241 C ASP A 140 -8.665 25.119 -1.906 1.00 0.00 C ATOM 2242 O ASP A 140 -9.575 25.936 -2.056 1.00 0.00 O ATOM 2243 CB ASP A 140 -8.771 25.588 0.549 1.00 0.00 C ATOM 2244 CG ASP A 140 -8.950 27.091 0.449 1.00 0.00 C ATOM 2245 OD1 ASP A 140 -8.520 27.675 -0.568 1.00 0.00 O ATOM 2246 OD2 ASP A 140 -9.521 27.684 1.389 1.00 0.00 O ATOM 0 H ASP A 140 -6.639 26.643 -0.190 1.00 0.00 H new ATOM 0 HA ASP A 140 -7.700 23.973 -0.384 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -9.749 25.107 0.533 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -8.311 25.343 1.506 1.00 0.00 H new ATOM 2251 N GLU A 141 -8.281 24.281 -2.863 1.00 0.00 N ATOM 2252 CA GLU A 141 -8.920 24.269 -4.173 1.00 0.00 C ATOM 2253 C GLU A 141 -8.781 25.624 -4.860 1.00 0.00 C ATOM 2254 O GLU A 141 -8.482 26.630 -4.217 1.00 0.00 O ATOM 2255 CB GLU A 141 -10.399 23.899 -4.040 1.00 0.00 C ATOM 2256 CG GLU A 141 -10.888 22.948 -5.122 1.00 0.00 C ATOM 2257 CD GLU A 141 -12.332 22.530 -4.921 1.00 0.00 C ATOM 2258 OE1 GLU A 141 -13.096 23.307 -4.310 1.00 0.00 O ATOM 2259 OE2 GLU A 141 -12.699 21.427 -5.377 1.00 0.00 O ATOM 0 H GLU A 141 -7.529 23.600 -2.755 1.00 0.00 H new ATOM 0 HA GLU A 141 -8.420 23.519 -4.786 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -10.564 23.442 -3.064 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -10.997 24.810 -4.071 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -10.784 23.427 -6.096 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -10.255 22.061 -5.134 1.00 0.00 H new ATOM 2266 N ILE A 142 -9.003 25.640 -6.170 1.00 0.00 N ATOM 2267 CA ILE A 142 -8.903 26.871 -6.948 1.00 0.00 C ATOM 2268 C ILE A 142 -10.285 27.426 -7.279 1.00 0.00 C ATOM 2269 O ILE A 142 -10.470 28.638 -7.381 1.00 0.00 O ATOM 2270 CB ILE A 142 -8.121 26.645 -8.258 1.00 0.00 C ATOM 2271 CG1 ILE A 142 -7.918 27.971 -8.995 1.00 0.00 C ATOM 2272 CG2 ILE A 142 -8.845 25.644 -9.148 1.00 0.00 C ATOM 2273 CD1 ILE A 142 -7.138 27.833 -10.284 1.00 0.00 C ATOM 0 H ILE A 142 -9.253 24.815 -6.716 1.00 0.00 H new ATOM 0 HA ILE A 142 -8.365 27.592 -6.333 1.00 0.00 H new ATOM 0 HB ILE A 142 -7.142 26.236 -8.008 1.00 0.00 H new ATOM 0 HG12 ILE A 142 -8.892 28.408 -9.214 1.00 0.00 H new ATOM 0 HG13 ILE A 142 -7.397 28.667 -8.337 1.00 0.00 H new ATOM 0 HG21 ILE A 142 -8.278 25.498 -10.067 1.00 0.00 H new ATOM 0 HG22 ILE A 142 -8.939 24.693 -8.624 1.00 0.00 H new ATOM 0 HG23 ILE A 142 -9.837 26.024 -9.390 1.00 0.00 H new ATOM 0 HD11 ILE A 142 -7.033 28.812 -10.752 1.00 0.00 H new ATOM 0 HD12 ILE A 142 -6.150 27.425 -10.070 1.00 0.00 H new ATOM 0 HD13 ILE A 142 -7.668 27.163 -10.960 1.00 0.00 H new ATOM 2285 N GLN A 143 -11.252 26.529 -7.447 1.00 0.00 N ATOM 2286 CA GLN A 143 -12.618 26.926 -7.769 1.00 0.00 C ATOM 2287 C GLN A 143 -12.673 27.643 -9.116 1.00 0.00 C ATOM 2288 O GLN A 143 -12.966 27.029 -10.142 1.00 0.00 O ATOM 2289 CB GLN A 143 -13.185 27.824 -6.666 1.00 0.00 C ATOM 2290 CG GLN A 143 -13.866 27.058 -5.544 1.00 0.00 C ATOM 2291 CD GLN A 143 -14.192 27.937 -4.352 1.00 0.00 C ATOM 2292 OE1 GLN A 143 -14.484 29.124 -4.503 1.00 0.00 O ATOM 2293 NE2 GLN A 143 -14.141 27.358 -3.158 1.00 0.00 N ATOM 0 H GLN A 143 -11.114 25.522 -7.365 1.00 0.00 H new ATOM 0 HA GLN A 143 -13.228 26.025 -7.837 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -12.377 28.423 -6.246 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -13.901 28.518 -7.107 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -14.785 26.608 -5.921 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -13.220 26.241 -5.222 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -13.894 26.371 -3.080 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -14.348 27.900 -2.319 1.00 0.00 H new ATOM 2302 N PHE A 144 -12.388 28.944 -9.107 1.00 0.00 N ATOM 2303 CA PHE A 144 -12.405 29.745 -10.328 1.00 0.00 C ATOM 2304 C PHE A 144 -12.088 31.205 -10.020 1.00 0.00 C ATOM 2305 O PHE A 144 -12.967 31.970 -9.624 1.00 0.00 O ATOM 2306 CB PHE A 144 -13.769 29.643 -11.016 1.00 0.00 C ATOM 2307 CG PHE A 144 -13.875 30.464 -12.270 1.00 0.00 C ATOM 2308 CD1 PHE A 144 -12.904 30.377 -13.254 1.00 0.00 C ATOM 2309 CD2 PHE A 144 -14.946 31.322 -12.463 1.00 0.00 C ATOM 2310 CE1 PHE A 144 -12.999 31.131 -14.409 1.00 0.00 C ATOM 2311 CE2 PHE A 144 -15.045 32.079 -13.616 1.00 0.00 C ATOM 2312 CZ PHE A 144 -14.071 31.983 -14.590 1.00 0.00 C ATOM 0 H PHE A 144 -12.142 29.466 -8.266 1.00 0.00 H new ATOM 0 HA PHE A 144 -11.640 29.355 -10.999 1.00 0.00 H new ATOM 0 HB2 PHE A 144 -13.967 28.599 -11.258 1.00 0.00 H new ATOM 0 HB3 PHE A 144 -14.543 29.961 -10.318 1.00 0.00 H new ATOM 0 HD1 PHE A 144 -12.063 29.713 -13.117 1.00 0.00 H new ATOM 0 HD2 PHE A 144 -15.711 31.400 -11.705 1.00 0.00 H new ATOM 0 HE1 PHE A 144 -12.236 31.054 -15.169 1.00 0.00 H new ATOM 0 HE2 PHE A 144 -15.884 32.745 -13.755 1.00 0.00 H new ATOM 0 HZ PHE A 144 -14.147 32.573 -15.491 1.00 0.00 H new ATOM 2322 N ASP A 145 -10.827 31.586 -10.201 1.00 0.00 N ATOM 2323 CA ASP A 145 -10.401 32.956 -9.941 1.00 0.00 C ATOM 2324 C ASP A 145 -8.995 33.205 -10.480 1.00 0.00 C ATOM 2325 O ASP A 145 -8.020 32.635 -9.990 1.00 0.00 O ATOM 2326 CB ASP A 145 -10.440 33.246 -8.439 1.00 0.00 C ATOM 2327 CG ASP A 145 -9.714 32.192 -7.627 1.00 0.00 C ATOM 2328 OD1 ASP A 145 -8.486 32.326 -7.444 1.00 0.00 O ATOM 2329 OD2 ASP A 145 -10.373 31.232 -7.176 1.00 0.00 O ATOM 0 H ASP A 145 -10.084 30.967 -10.526 1.00 0.00 H new ATOM 0 HA ASP A 145 -11.090 33.626 -10.455 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -9.991 34.221 -8.248 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -11.478 33.303 -8.110 1.00 0.00 H new ATOM 2334 N ASP A 146 -8.899 34.063 -11.492 1.00 0.00 N ATOM 2335 CA ASP A 146 -7.613 34.390 -12.098 1.00 0.00 C ATOM 2336 C ASP A 146 -6.946 33.142 -12.665 1.00 0.00 C ATOM 2337 O ASP A 146 -7.278 32.020 -12.283 1.00 0.00 O ATOM 2338 CB ASP A 146 -6.695 35.051 -11.070 1.00 0.00 C ATOM 2339 CG ASP A 146 -7.323 36.279 -10.439 1.00 0.00 C ATOM 2340 OD1 ASP A 146 -8.125 36.118 -9.495 1.00 0.00 O ATOM 2341 OD2 ASP A 146 -7.014 37.402 -10.890 1.00 0.00 O ATOM 0 H ASP A 146 -9.696 34.544 -11.909 1.00 0.00 H new ATOM 0 HA ASP A 146 -7.792 35.088 -12.916 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -6.449 34.330 -10.290 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -5.758 35.332 -11.551 1.00 0.00 H new ATOM 2346 N ILE A 147 -6.004 33.344 -13.580 1.00 0.00 N ATOM 2347 CA ILE A 147 -5.291 32.235 -14.200 1.00 0.00 C ATOM 2348 C ILE A 147 -3.932 32.683 -14.733 1.00 0.00 C ATOM 2349 O ILE A 147 -3.531 32.311 -15.836 1.00 0.00 O ATOM 2350 CB ILE A 147 -6.113 31.612 -15.348 1.00 0.00 C ATOM 2351 CG1 ILE A 147 -5.421 30.356 -15.881 1.00 0.00 C ATOM 2352 CG2 ILE A 147 -6.324 32.625 -16.465 1.00 0.00 C ATOM 2353 CD1 ILE A 147 -6.382 29.246 -16.245 1.00 0.00 C ATOM 0 H ILE A 147 -5.717 34.266 -13.908 1.00 0.00 H new ATOM 0 HA ILE A 147 -5.138 31.481 -13.427 1.00 0.00 H new ATOM 0 HB ILE A 147 -7.090 31.326 -14.958 1.00 0.00 H new ATOM 0 HG12 ILE A 147 -4.833 30.620 -16.760 1.00 0.00 H new ATOM 0 HG13 ILE A 147 -4.722 29.989 -15.129 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -6.905 32.168 -17.266 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -6.861 33.490 -16.075 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -5.357 32.943 -16.855 1.00 0.00 H new ATOM 0 HD11 ILE A 147 -5.822 28.387 -16.615 1.00 0.00 H new ATOM 0 HD12 ILE A 147 -6.952 28.955 -15.363 1.00 0.00 H new ATOM 0 HD13 ILE A 147 -7.065 29.595 -17.019 1.00 0.00 H new ATOM 2365 N GLY A 148 -3.228 33.486 -13.941 1.00 0.00 N ATOM 2366 CA GLY A 148 -1.922 33.973 -14.348 1.00 0.00 C ATOM 2367 C GLY A 148 -1.963 34.712 -15.672 1.00 0.00 C ATOM 2368 O GLY A 148 -2.723 35.667 -15.834 1.00 0.00 O ATOM 0 H GLY A 148 -3.539 33.808 -13.024 1.00 0.00 H new ATOM 0 HA2 GLY A 148 -1.529 34.636 -13.578 1.00 0.00 H new ATOM 0 HA3 GLY A 148 -1.233 33.132 -14.426 1.00 0.00 H new ATOM 2372 N ASP A 149 -1.143 34.270 -16.620 1.00 0.00 N ATOM 2373 CA ASP A 149 -1.089 34.895 -17.936 1.00 0.00 C ATOM 2374 C ASP A 149 -0.396 33.984 -18.943 1.00 0.00 C ATOM 2375 O ASP A 149 0.560 33.285 -18.607 1.00 0.00 O ATOM 2376 CB ASP A 149 -0.359 36.237 -17.858 1.00 0.00 C ATOM 2377 CG ASP A 149 0.973 36.131 -17.142 1.00 0.00 C ATOM 2378 OD1 ASP A 149 1.487 35.000 -17.007 1.00 0.00 O ATOM 2379 OD2 ASP A 149 1.502 37.178 -16.716 1.00 0.00 O ATOM 0 H ASP A 149 -0.507 33.481 -16.501 1.00 0.00 H new ATOM 0 HA ASP A 149 -2.112 35.065 -18.271 1.00 0.00 H new ATOM 0 HB2 ASP A 149 -0.197 36.618 -18.866 1.00 0.00 H new ATOM 0 HB3 ASP A 149 -0.989 36.961 -17.341 1.00 0.00 H new ATOM 2384 N ASP A 150 -0.886 33.995 -20.178 1.00 0.00 N ATOM 2385 CA ASP A 150 -0.314 33.168 -21.235 1.00 0.00 C ATOM 2386 C ASP A 150 -0.963 33.479 -22.580 1.00 0.00 C ATOM 2387 O ASP A 150 -0.276 33.647 -23.587 1.00 0.00 O ATOM 2388 CB ASP A 150 -0.487 31.686 -20.902 1.00 0.00 C ATOM 2389 CG ASP A 150 -1.910 31.345 -20.504 1.00 0.00 C ATOM 2390 OD1 ASP A 150 -2.420 31.957 -19.542 1.00 0.00 O ATOM 2391 OD2 ASP A 150 -2.514 30.467 -21.155 1.00 0.00 O ATOM 0 H ASP A 150 -1.678 34.567 -20.472 1.00 0.00 H new ATOM 0 HA ASP A 150 0.750 33.395 -21.304 1.00 0.00 H new ATOM 0 HB2 ASP A 150 -0.201 31.086 -21.766 1.00 0.00 H new ATOM 0 HB3 ASP A 150 0.189 31.418 -20.090 1.00 0.00 H new ATOM 2396 N ASP A 151 -2.290 33.552 -22.587 1.00 0.00 N ATOM 2397 CA ASP A 151 -3.032 33.842 -23.808 1.00 0.00 C ATOM 2398 C ASP A 151 -4.043 34.960 -23.579 1.00 0.00 C ATOM 2399 O ASP A 151 -4.209 35.442 -22.458 1.00 0.00 O ATOM 2400 CB ASP A 151 -3.748 32.584 -24.304 1.00 0.00 C ATOM 2401 CG ASP A 151 -3.708 32.454 -25.814 1.00 0.00 C ATOM 2402 OD1 ASP A 151 -3.973 33.461 -26.504 1.00 0.00 O ATOM 2403 OD2 ASP A 151 -3.414 31.345 -26.307 1.00 0.00 O ATOM 0 H ASP A 151 -2.873 33.414 -21.761 1.00 0.00 H new ATOM 0 HA ASP A 151 -2.321 34.171 -24.566 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -3.286 31.705 -23.854 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -4.786 32.605 -23.971 1.00 0.00 H new ATOM 2408 N GLU A 152 -4.719 35.369 -24.648 1.00 0.00 N ATOM 2409 CA GLU A 152 -5.717 36.430 -24.565 1.00 0.00 C ATOM 2410 C GLU A 152 -5.098 37.721 -24.032 1.00 0.00 C ATOM 2411 O GLU A 152 -5.599 38.314 -23.077 1.00 0.00 O ATOM 2412 CB GLU A 152 -6.878 35.996 -23.669 1.00 0.00 C ATOM 2413 CG GLU A 152 -7.466 34.647 -24.048 1.00 0.00 C ATOM 2414 CD GLU A 152 -8.490 34.155 -23.044 1.00 0.00 C ATOM 2415 OE1 GLU A 152 -8.390 34.534 -21.858 1.00 0.00 O ATOM 2416 OE2 GLU A 152 -9.393 33.390 -23.444 1.00 0.00 O ATOM 0 H GLU A 152 -4.594 34.981 -25.583 1.00 0.00 H new ATOM 0 HA GLU A 152 -6.095 36.620 -25.570 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -6.533 35.956 -22.636 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -7.663 36.751 -23.714 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -7.932 34.721 -25.030 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -6.663 33.915 -24.131 1.00 0.00 H new ATOM 2423 N ASP A 153 -4.007 38.150 -24.659 1.00 0.00 N ATOM 2424 CA ASP A 153 -3.322 39.371 -24.249 1.00 0.00 C ATOM 2425 C ASP A 153 -4.226 40.586 -24.426 1.00 0.00 C ATOM 2426 O ASP A 153 -4.212 41.236 -25.472 1.00 0.00 O ATOM 2427 CB ASP A 153 -2.036 39.554 -25.057 1.00 0.00 C ATOM 2428 CG ASP A 153 -0.821 38.998 -24.342 1.00 0.00 C ATOM 2429 OD1 ASP A 153 -0.532 37.794 -24.510 1.00 0.00 O ATOM 2430 OD2 ASP A 153 -0.157 39.766 -23.615 1.00 0.00 O ATOM 0 H ASP A 153 -3.579 37.671 -25.451 1.00 0.00 H new ATOM 0 HA ASP A 153 -3.069 39.280 -23.193 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -2.143 39.060 -26.023 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -1.883 40.615 -25.256 1.00 0.00 H new ATOM 2435 N ILE A 154 -5.012 40.890 -23.398 1.00 0.00 N ATOM 2436 CA ILE A 154 -5.921 42.028 -23.441 1.00 0.00 C ATOM 2437 C ILE A 154 -5.242 43.291 -22.917 1.00 0.00 C ATOM 2438 O ILE A 154 -5.553 43.774 -21.828 1.00 0.00 O ATOM 2439 CB ILE A 154 -7.202 41.755 -22.623 1.00 0.00 C ATOM 2440 CG1 ILE A 154 -8.180 42.925 -22.752 1.00 0.00 C ATOM 2441 CG2 ILE A 154 -6.862 41.498 -21.162 1.00 0.00 C ATOM 2442 CD1 ILE A 154 -8.795 43.051 -24.130 1.00 0.00 C ATOM 0 H ILE A 154 -5.037 40.363 -22.525 1.00 0.00 H new ATOM 0 HA ILE A 154 -6.197 42.179 -24.485 1.00 0.00 H new ATOM 0 HB ILE A 154 -7.681 40.861 -23.023 1.00 0.00 H new ATOM 0 HG12 ILE A 154 -8.976 42.805 -22.017 1.00 0.00 H new ATOM 0 HG13 ILE A 154 -7.659 43.851 -22.509 1.00 0.00 H new ATOM 0 HG21 ILE A 154 -7.778 41.308 -20.603 1.00 0.00 H new ATOM 0 HG22 ILE A 154 -6.206 40.631 -21.088 1.00 0.00 H new ATOM 0 HG23 ILE A 154 -6.358 42.371 -20.747 1.00 0.00 H new ATOM 0 HD11 ILE A 154 -9.477 43.901 -24.148 1.00 0.00 H new ATOM 0 HD12 ILE A 154 -8.007 43.203 -24.868 1.00 0.00 H new ATOM 0 HD13 ILE A 154 -9.344 42.140 -24.368 1.00 0.00 H new ATOM 2454 N ASP A 155 -4.311 43.823 -23.703 1.00 0.00 N ATOM 2455 CA ASP A 155 -3.587 45.030 -23.321 1.00 0.00 C ATOM 2456 C ASP A 155 -4.391 46.278 -23.675 1.00 0.00 C ATOM 2457 O ASP A 155 -3.944 47.118 -24.457 1.00 0.00 O ATOM 2458 CB ASP A 155 -2.222 45.072 -24.012 1.00 0.00 C ATOM 2459 CG ASP A 155 -1.378 43.849 -23.703 1.00 0.00 C ATOM 2460 OD1 ASP A 155 -1.778 43.056 -22.826 1.00 0.00 O ATOM 2461 OD2 ASP A 155 -0.316 43.686 -24.339 1.00 0.00 O ATOM 0 H ASP A 155 -4.041 43.437 -24.608 1.00 0.00 H new ATOM 0 HA ASP A 155 -3.437 45.010 -22.242 1.00 0.00 H new ATOM 0 HB2 ASP A 155 -2.366 45.148 -25.090 1.00 0.00 H new ATOM 0 HB3 ASP A 155 -1.687 45.968 -23.698 1.00 0.00 H new ATOM 2466 N ASP A 156 -5.579 46.393 -23.092 1.00 0.00 N ATOM 2467 CA ASP A 156 -6.447 47.537 -23.344 1.00 0.00 C ATOM 2468 C ASP A 156 -7.117 48.002 -22.057 1.00 0.00 C ATOM 2469 O ASP A 156 -7.955 47.299 -21.491 1.00 0.00 O ATOM 2470 CB ASP A 156 -7.509 47.179 -24.385 1.00 0.00 C ATOM 2471 CG ASP A 156 -6.903 46.719 -25.696 1.00 0.00 C ATOM 2472 OD1 ASP A 156 -5.946 47.369 -26.167 1.00 0.00 O ATOM 2473 OD2 ASP A 156 -7.387 45.711 -26.252 1.00 0.00 O ATOM 0 H ASP A 156 -5.963 45.708 -22.441 1.00 0.00 H new ATOM 0 HA ASP A 156 -5.832 48.351 -23.728 1.00 0.00 H new ATOM 0 HB2 ASP A 156 -8.151 46.392 -23.989 1.00 0.00 H new ATOM 0 HB3 ASP A 156 -8.143 48.047 -24.566 1.00 0.00 H new ATOM 2478 N ILE A 157 -6.743 49.191 -21.595 1.00 0.00 N ATOM 2479 CA ILE A 157 -7.308 49.748 -20.373 1.00 0.00 C ATOM 2480 C ILE A 157 -7.524 51.253 -20.503 1.00 0.00 C ATOM 2481 O ILE A 157 -7.339 51.968 -19.495 1.00 0.00 O ATOM 2482 CB ILE A 157 -6.406 49.464 -19.153 1.00 0.00 C ATOM 2483 CG1 ILE A 157 -4.932 49.691 -19.505 1.00 0.00 C ATOM 2484 CG2 ILE A 157 -6.622 48.041 -18.658 1.00 0.00 C ATOM 2485 CD1 ILE A 157 -4.623 51.104 -19.949 1.00 0.00 C ATOM 2486 OXT ILE A 157 -7.878 51.705 -21.613 1.00 0.00 O ATOM 0 H ILE A 157 -6.051 49.787 -22.049 1.00 0.00 H new ATOM 0 HA ILE A 157 -8.271 49.261 -20.218 1.00 0.00 H new ATOM 0 HB ILE A 157 -6.676 50.156 -18.355 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -4.319 49.450 -18.636 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -4.646 49.000 -20.298 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -5.980 47.854 -17.797 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -7.665 47.911 -18.368 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -6.376 47.338 -19.454 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -3.561 51.189 -20.181 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -5.209 51.343 -20.837 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -4.876 51.800 -19.149 1.00 0.00 H new TER 2498 ILE A 157