USER MOD reduce.3.24.130724 H: found=0, std=0, add=1090, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1088 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 21 THR OG1 : rot 80:sc= 0.0804 USER MOD Set 1.2: B 133 LYS NZ :NH3+ -174:sc= 0.957 (180deg=0.892) USER MOD Set 2.1: B 97 ASN : amide:sc= 0.478 K(o=0.9,f=-0.62) USER MOD Set 2.2: B 104 TYR OH : rot 6:sc= 0.425 USER MOD Set 3.1: A 17 SER OG : rot 97:sc= 1.18 USER MOD Set 3.2: B 84 THR OG1 : rot 35:sc= 1.44 USER MOD Set 4.1: A 54 THR OG1 : rot 180:sc= 0.373 USER MOD Set 4.2: A 57 THR OG1 : rot 95:sc= 0.355 USER MOD Set 5.1: A 56 LYS NZ :NH3+ -173:sc= 1.05 (180deg=0) USER MOD Set 5.2: A 59 GLN : amide:sc= 0.889 K(o=1.9,f=-4.8!) USER MOD Set 6.1: A 7 THR OG1 : rot 93:sc= 1.26 USER MOD Set 6.2: A 45 THR OG1 : rot 180:sc= 0 USER MOD Set 6.3: A 73 ASN : amide:sc= 1.01 K(o=2.3,f=-0.18) USER MOD Set 7.1: A 4 ASN : amide:sc= -0.492 X(o=-0.49,f=0) USER MOD Set 7.2: A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 156:sc= -0.215 (180deg=-0.514) USER MOD Single : A 1 MET N :NH3+ -102:sc= 0.1 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 13 MET CE :methyl -159:sc= -0.251 (180deg=-2.03) USER MOD Single : A 14 THR OG1 : rot -30:sc= 0.683 USER MOD Single : A 16 ASN : amide:sc= -0.0199 X(o=-0.02,f=0) USER MOD Single : A 24 GLN : amide:sc= 0.59 K(o=0.59,f=-0.078) USER MOD Single : A 25 GLN : amide:sc= 1.06 K(o=1.1,f=-0.26) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 33 HIS : no HD1:sc= -0.203 X(o=-0.2,f=0) USER MOD Single : A 34 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 174:sc= 0.828 USER MOD Single : A 42 LYS NZ :NH3+ 149:sc= 0.00172 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= -0.284 K(o=-0.28,f=-1.7) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 GLN : amide:sc= -1.46 K(o=-1.5,f=-8.7!) USER MOD Single : A 65 MET CE :methyl -166:sc= -0.0377 (180deg=-0.398) USER MOD Single : A 72 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 77 HIS : no HE2:sc= -0.647 X(o=-0.65,f=-1.1) USER MOD Single : B 80 SER OG : rot 180:sc= 0 USER MOD Single : B 83 MET CE :methyl 171:sc= 0 (180deg=-0.143) USER MOD Single : B 88 CYS SG : rot -95:sc= 1.59 USER MOD Single : B 93 SER OG : rot 180:sc= 0 USER MOD Single : B 98 LYS NZ :NH3+ -123:sc= 0.327 (180deg=-0.0466) USER MOD Single : B 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 110 ASN : amide:sc= -0.0223 K(o=-0.022,f=-1.5) USER MOD Single : B 111 LYS NZ :NH3+ 180:sc= 0.893 (180deg=0.893) USER MOD Single : B 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 114 CYS SG : rot 30:sc= -0.134 USER MOD Single : B 117 SER OG : rot 150:sc= 0.473 USER MOD Single : B 119 HIS : no HD1:sc= -0.502 X(o=-0.5,f=-0.058) USER MOD Single : B 120 SER OG : rot 180:sc= 0 USER MOD Single : B 121 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 123 THR OG1 : rot 180:sc= 0 USER MOD Single : B 127 THR OG1 : rot 120:sc= 0 USER MOD Single : B 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 131 THR OG1 : rot -80:sc= 1.27 USER MOD Single : B 134 THR OG1 : rot 180:sc= 0 USER MOD Single : B 136 SER OG : rot 180:sc= 0 USER MOD Single : B 137 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -4.977 -3.809 29.709 1.00 0.00 N ATOM 2 CA MET A 1 -6.102 -4.171 28.819 1.00 0.00 C ATOM 3 C MET A 1 -5.933 -5.610 28.320 1.00 0.00 C ATOM 4 O MET A 1 -4.818 -6.143 28.319 1.00 0.00 O ATOM 5 CB MET A 1 -6.225 -3.178 27.647 1.00 0.00 C ATOM 6 CG MET A 1 -7.625 -3.178 27.017 1.00 0.00 C ATOM 7 SD MET A 1 -8.914 -2.639 28.174 1.00 0.00 S ATOM 8 CE MET A 1 -10.367 -3.552 27.587 1.00 0.00 C ATOM 0 H1 MET A 1 -5.288 -3.859 30.700 1.00 0.00 H new ATOM 0 H2 MET A 1 -4.189 -4.471 29.560 1.00 0.00 H new ATOM 0 H3 MET A 1 -4.661 -2.842 29.494 1.00 0.00 H new ATOM 0 HA MET A 1 -7.030 -4.112 29.388 1.00 0.00 H new ATOM 0 HB2 MET A 1 -5.990 -2.174 28.000 1.00 0.00 H new ATOM 0 HB3 MET A 1 -5.488 -3.429 26.884 1.00 0.00 H new ATOM 0 HG2 MET A 1 -7.627 -2.522 26.146 1.00 0.00 H new ATOM 0 HG3 MET A 1 -7.859 -4.181 26.661 1.00 0.00 H new ATOM 0 HE1 MET A 1 -11.081 -3.663 28.403 1.00 0.00 H new ATOM 0 HE2 MET A 1 -10.834 -3.005 26.768 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.060 -4.537 27.236 1.00 0.00 H new ATOM 20 N GLY A 2 -7.015 -6.251 27.869 1.00 0.00 N ATOM 21 CA GLY A 2 -7.000 -7.570 27.215 1.00 0.00 C ATOM 22 C GLY A 2 -6.442 -7.567 25.785 1.00 0.00 C ATOM 23 O GLY A 2 -5.874 -6.575 25.327 1.00 0.00 O ATOM 0 H GLY A 2 -7.953 -5.859 27.949 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -6.407 -8.255 27.821 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -8.017 -7.962 27.194 1.00 0.00 H new ATOM 27 N VAL A 3 -6.595 -8.696 25.091 1.00 0.00 N ATOM 28 CA VAL A 3 -6.058 -8.979 23.745 1.00 0.00 C ATOM 29 C VAL A 3 -6.964 -9.935 22.961 1.00 0.00 C ATOM 30 O VAL A 3 -7.576 -10.836 23.535 1.00 0.00 O ATOM 31 CB VAL A 3 -4.639 -9.607 23.784 1.00 0.00 C ATOM 32 CG1 VAL A 3 -3.548 -8.567 24.067 1.00 0.00 C ATOM 33 CG2 VAL A 3 -4.506 -10.780 24.772 1.00 0.00 C ATOM 0 H VAL A 3 -7.124 -9.483 25.466 1.00 0.00 H new ATOM 0 HA VAL A 3 -6.011 -8.008 23.252 1.00 0.00 H new ATOM 0 HB VAL A 3 -4.493 -10.008 22.781 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -2.574 -9.057 24.084 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -3.558 -7.807 23.286 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -3.735 -8.097 25.033 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -3.487 -11.166 24.743 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -4.734 -10.434 25.780 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -5.202 -11.571 24.493 1.00 0.00 H new ATOM 43 N ASN A 4 -7.013 -9.768 21.636 1.00 0.00 N ATOM 44 CA ASN A 4 -7.616 -10.710 20.681 1.00 0.00 C ATOM 45 C ASN A 4 -6.578 -11.112 19.608 1.00 0.00 C ATOM 46 O ASN A 4 -5.994 -10.252 18.950 1.00 0.00 O ATOM 47 CB ASN A 4 -8.850 -10.053 20.024 1.00 0.00 C ATOM 48 CG ASN A 4 -10.174 -10.260 20.764 1.00 0.00 C ATOM 49 OD1 ASN A 4 -11.222 -10.446 20.151 1.00 0.00 O ATOM 50 ND2 ASN A 4 -10.199 -10.237 22.084 1.00 0.00 N ATOM 0 H ASN A 4 -6.620 -8.944 21.180 1.00 0.00 H new ATOM 0 HA ASN A 4 -7.932 -11.611 21.207 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -8.666 -8.982 19.935 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -8.954 -10.444 19.012 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -11.080 -10.373 22.580 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -9.337 -10.084 22.608 1.00 0.00 H new ATOM 57 N SER A 5 -6.341 -12.413 19.407 1.00 0.00 N ATOM 58 CA SER A 5 -5.520 -12.935 18.297 1.00 0.00 C ATOM 59 C SER A 5 -6.380 -13.212 17.050 1.00 0.00 C ATOM 60 O SER A 5 -7.486 -13.754 17.165 1.00 0.00 O ATOM 61 CB SER A 5 -4.791 -14.221 18.721 1.00 0.00 C ATOM 62 OG SER A 5 -3.869 -14.634 17.723 1.00 0.00 O ATOM 0 H SER A 5 -6.715 -13.144 20.013 1.00 0.00 H new ATOM 0 HA SER A 5 -4.783 -12.173 18.046 1.00 0.00 H new ATOM 0 HB2 SER A 5 -4.265 -14.052 19.660 1.00 0.00 H new ATOM 0 HB3 SER A 5 -5.518 -15.013 18.901 1.00 0.00 H new ATOM 0 HG SER A 5 -3.416 -15.452 18.015 1.00 0.00 H new ATOM 68 N VAL A 6 -5.888 -12.874 15.854 1.00 0.00 N ATOM 69 CA VAL A 6 -6.579 -13.136 14.580 1.00 0.00 C ATOM 70 C VAL A 6 -5.582 -13.260 13.420 1.00 0.00 C ATOM 71 O VAL A 6 -4.458 -12.764 13.492 1.00 0.00 O ATOM 72 CB VAL A 6 -7.692 -12.088 14.320 1.00 0.00 C ATOM 73 CG1 VAL A 6 -7.137 -10.703 13.965 1.00 0.00 C ATOM 74 CG2 VAL A 6 -8.678 -12.539 13.231 1.00 0.00 C ATOM 0 H VAL A 6 -4.989 -12.406 15.738 1.00 0.00 H new ATOM 0 HA VAL A 6 -7.080 -14.101 14.653 1.00 0.00 H new ATOM 0 HB VAL A 6 -8.228 -12.007 15.266 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -7.963 -10.013 13.794 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -6.522 -10.336 14.786 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -6.531 -10.774 13.062 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -9.437 -11.770 13.087 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -8.140 -12.698 12.296 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -9.157 -13.469 13.536 1.00 0.00 H new ATOM 84 N THR A 7 -6.004 -13.936 12.349 1.00 0.00 N ATOM 85 CA THR A 7 -5.241 -14.186 11.123 1.00 0.00 C ATOM 86 C THR A 7 -6.123 -13.862 9.927 1.00 0.00 C ATOM 87 O THR A 7 -7.331 -14.106 9.929 1.00 0.00 O ATOM 88 CB THR A 7 -4.739 -15.635 11.064 1.00 0.00 C ATOM 89 OG1 THR A 7 -3.942 -15.885 12.197 1.00 0.00 O ATOM 90 CG2 THR A 7 -3.876 -15.923 9.835 1.00 0.00 C ATOM 0 H THR A 7 -6.937 -14.346 12.311 1.00 0.00 H new ATOM 0 HA THR A 7 -4.359 -13.546 11.110 1.00 0.00 H new ATOM 0 HB THR A 7 -5.623 -16.271 11.020 1.00 0.00 H new ATOM 0 HG1 THR A 7 -4.497 -16.264 12.910 1.00 0.00 H new ATOM 0 HG21 THR A 7 -3.553 -16.964 9.853 1.00 0.00 H new ATOM 0 HG22 THR A 7 -4.457 -15.739 8.931 1.00 0.00 H new ATOM 0 HG23 THR A 7 -3.002 -15.272 9.844 1.00 0.00 H new ATOM 98 N ILE A 8 -5.515 -13.278 8.903 1.00 0.00 N ATOM 99 CA ILE A 8 -6.158 -12.864 7.657 1.00 0.00 C ATOM 100 C ILE A 8 -5.404 -13.514 6.492 1.00 0.00 C ATOM 101 O ILE A 8 -4.223 -13.256 6.273 1.00 0.00 O ATOM 102 CB ILE A 8 -6.213 -11.312 7.588 1.00 0.00 C ATOM 103 CG1 ILE A 8 -6.967 -10.745 8.822 1.00 0.00 C ATOM 104 CG2 ILE A 8 -6.862 -10.824 6.280 1.00 0.00 C ATOM 105 CD1 ILE A 8 -7.256 -9.237 8.808 1.00 0.00 C ATOM 0 H ILE A 8 -4.517 -13.070 8.916 1.00 0.00 H new ATOM 0 HA ILE A 8 -7.193 -13.200 7.602 1.00 0.00 H new ATOM 0 HB ILE A 8 -5.188 -10.940 7.601 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -7.915 -11.274 8.917 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -6.384 -10.973 9.714 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -6.883 -9.734 6.268 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -6.283 -11.185 5.430 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -7.880 -11.207 6.214 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -7.785 -8.959 9.720 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -6.317 -8.687 8.752 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -7.872 -8.993 7.942 1.00 0.00 H new ATOM 117 N SER A 9 -6.084 -14.358 5.724 1.00 0.00 N ATOM 118 CA SER A 9 -5.628 -14.826 4.416 1.00 0.00 C ATOM 119 C SER A 9 -5.522 -13.611 3.482 1.00 0.00 C ATOM 120 O SER A 9 -6.540 -13.153 2.962 1.00 0.00 O ATOM 121 CB SER A 9 -6.629 -15.851 3.845 1.00 0.00 C ATOM 122 OG SER A 9 -6.899 -16.908 4.753 1.00 0.00 O ATOM 0 H SER A 9 -6.987 -14.745 5.997 1.00 0.00 H new ATOM 0 HA SER A 9 -4.657 -15.312 4.507 1.00 0.00 H new ATOM 0 HB2 SER A 9 -7.561 -15.344 3.595 1.00 0.00 H new ATOM 0 HB3 SER A 9 -6.232 -16.265 2.918 1.00 0.00 H new ATOM 0 HG SER A 9 -7.539 -17.531 4.349 1.00 0.00 H new ATOM 128 N VAL A 10 -4.320 -13.052 3.303 1.00 0.00 N ATOM 129 CA VAL A 10 -4.038 -11.930 2.391 1.00 0.00 C ATOM 130 C VAL A 10 -3.665 -12.498 1.013 1.00 0.00 C ATOM 131 O VAL A 10 -2.530 -12.451 0.545 1.00 0.00 O ATOM 132 CB VAL A 10 -3.058 -10.893 2.989 1.00 0.00 C ATOM 133 CG1 VAL A 10 -1.667 -11.448 3.303 1.00 0.00 C ATOM 134 CG2 VAL A 10 -2.954 -9.635 2.110 1.00 0.00 C ATOM 0 H VAL A 10 -3.491 -13.375 3.801 1.00 0.00 H new ATOM 0 HA VAL A 10 -4.934 -11.327 2.249 1.00 0.00 H new ATOM 0 HB VAL A 10 -3.496 -10.619 3.949 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -1.044 -10.656 3.718 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.753 -12.258 4.027 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -1.211 -11.826 2.388 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -2.256 -8.931 2.564 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -2.596 -9.912 1.118 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -3.936 -9.169 2.024 1.00 0.00 H new ATOM 144 N GLU A 11 -4.670 -13.119 0.402 1.00 0.00 N ATOM 145 CA GLU A 11 -4.585 -13.952 -0.811 1.00 0.00 C ATOM 146 C GLU A 11 -3.907 -13.293 -2.028 1.00 0.00 C ATOM 147 O GLU A 11 -3.446 -14.003 -2.928 1.00 0.00 O ATOM 148 CB GLU A 11 -5.998 -14.390 -1.223 1.00 0.00 C ATOM 149 CG GLU A 11 -6.641 -15.360 -0.230 1.00 0.00 C ATOM 150 CD GLU A 11 -7.952 -15.897 -0.784 1.00 0.00 C ATOM 151 OE1 GLU A 11 -7.951 -16.941 -1.479 1.00 0.00 O ATOM 152 OE2 GLU A 11 -9.020 -15.312 -0.492 1.00 0.00 O ATOM 0 H GLU A 11 -5.625 -13.055 0.755 1.00 0.00 H new ATOM 0 HA GLU A 11 -3.947 -14.791 -0.532 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -6.631 -13.508 -1.321 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -5.954 -14.861 -2.205 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -5.960 -16.186 -0.026 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -6.820 -14.853 0.718 1.00 0.00 H new ATOM 159 N GLY A 12 -3.844 -11.958 -2.064 1.00 0.00 N ATOM 160 CA GLY A 12 -3.237 -11.170 -3.143 1.00 0.00 C ATOM 161 C GLY A 12 -1.800 -10.693 -2.888 1.00 0.00 C ATOM 162 O GLY A 12 -1.248 -9.960 -3.708 1.00 0.00 O ATOM 0 H GLY A 12 -4.227 -11.377 -1.318 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -3.246 -11.768 -4.055 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -3.863 -10.297 -3.328 1.00 0.00 H new ATOM 166 N MET A 13 -1.184 -11.074 -1.765 1.00 0.00 N ATOM 167 CA MET A 13 0.184 -10.691 -1.374 1.00 0.00 C ATOM 168 C MET A 13 1.089 -11.933 -1.332 1.00 0.00 C ATOM 169 O MET A 13 0.666 -12.992 -0.865 1.00 0.00 O ATOM 170 CB MET A 13 0.102 -9.946 -0.034 1.00 0.00 C ATOM 171 CG MET A 13 1.412 -9.300 0.432 1.00 0.00 C ATOM 172 SD MET A 13 2.730 -10.393 1.028 1.00 0.00 S ATOM 173 CE MET A 13 1.838 -11.322 2.303 1.00 0.00 C ATOM 0 H MET A 13 -1.635 -11.678 -1.078 1.00 0.00 H new ATOM 0 HA MET A 13 0.637 -10.020 -2.105 1.00 0.00 H new ATOM 0 HB2 MET A 13 -0.660 -9.170 -0.113 1.00 0.00 H new ATOM 0 HB3 MET A 13 -0.233 -10.645 0.733 1.00 0.00 H new ATOM 0 HG2 MET A 13 1.811 -8.716 -0.398 1.00 0.00 H new ATOM 0 HG3 MET A 13 1.173 -8.597 1.230 1.00 0.00 H new ATOM 0 HE1 MET A 13 2.552 -11.753 3.005 1.00 0.00 H new ATOM 0 HE2 MET A 13 1.164 -10.652 2.836 1.00 0.00 H new ATOM 0 HE3 MET A 13 1.262 -12.120 1.835 1.00 0.00 H new ATOM 183 N THR A 14 2.308 -11.821 -1.880 1.00 0.00 N ATOM 184 CA THR A 14 3.186 -12.952 -2.253 1.00 0.00 C ATOM 185 C THR A 14 4.649 -12.541 -2.518 1.00 0.00 C ATOM 186 O THR A 14 5.425 -13.348 -3.035 1.00 0.00 O ATOM 187 CB THR A 14 2.518 -13.773 -3.369 1.00 0.00 C ATOM 188 OG1 THR A 14 3.252 -14.909 -3.750 1.00 0.00 O ATOM 189 CG2 THR A 14 2.264 -12.923 -4.596 1.00 0.00 C ATOM 0 H THR A 14 2.728 -10.914 -2.084 1.00 0.00 H new ATOM 0 HA THR A 14 3.292 -13.614 -1.394 1.00 0.00 H new ATOM 0 HB THR A 14 1.575 -14.116 -2.943 1.00 0.00 H new ATOM 0 HG1 THR A 14 4.208 -14.742 -3.614 1.00 0.00 H new ATOM 0 HG21 THR A 14 1.791 -13.530 -5.368 1.00 0.00 H new ATOM 0 HG22 THR A 14 1.607 -12.093 -4.334 1.00 0.00 H new ATOM 0 HG23 THR A 14 3.210 -12.533 -4.970 1.00 0.00 H new ATOM 197 N CYS A 15 5.039 -11.309 -2.167 1.00 0.00 N ATOM 198 CA CYS A 15 6.383 -10.776 -2.385 1.00 0.00 C ATOM 199 C CYS A 15 6.854 -9.710 -1.345 1.00 0.00 C ATOM 200 O CYS A 15 6.338 -9.607 -0.225 1.00 0.00 O ATOM 201 CB CYS A 15 6.525 -10.433 -3.888 1.00 0.00 C ATOM 202 SG CYS A 15 5.718 -8.890 -4.385 1.00 0.00 S ATOM 0 H CYS A 15 4.413 -10.643 -1.714 1.00 0.00 H new ATOM 0 HA CYS A 15 7.128 -11.540 -2.164 1.00 0.00 H new ATOM 0 HB2 CYS A 15 7.585 -10.370 -4.135 1.00 0.00 H new ATOM 0 HB3 CYS A 15 6.109 -11.252 -4.475 1.00 0.00 H new ATOM 207 N ASN A 16 7.962 -9.036 -1.665 1.00 0.00 N ATOM 208 CA ASN A 16 9.092 -8.863 -0.739 1.00 0.00 C ATOM 209 C ASN A 16 9.152 -7.506 -0.011 1.00 0.00 C ATOM 210 O ASN A 16 9.696 -7.435 1.093 1.00 0.00 O ATOM 211 CB ASN A 16 10.403 -9.089 -1.508 1.00 0.00 C ATOM 212 CG ASN A 16 10.461 -10.452 -2.190 1.00 0.00 C ATOM 213 OD1 ASN A 16 10.738 -11.481 -1.579 1.00 0.00 O ATOM 214 ND2 ASN A 16 10.170 -10.488 -3.476 1.00 0.00 N ATOM 0 H ASN A 16 8.104 -8.594 -2.573 1.00 0.00 H new ATOM 0 HA ASN A 16 8.943 -9.601 0.049 1.00 0.00 H new ATOM 0 HB2 ASN A 16 10.518 -8.307 -2.259 1.00 0.00 H new ATOM 0 HB3 ASN A 16 11.243 -8.996 -0.820 1.00 0.00 H new ATOM 0 HD21 ASN A 16 10.173 -11.378 -3.975 1.00 0.00 H new ATOM 0 HD22 ASN A 16 9.942 -9.626 -3.972 1.00 0.00 H new ATOM 221 N SER A 17 8.593 -6.439 -0.585 1.00 0.00 N ATOM 222 CA SER A 17 8.314 -5.171 0.127 1.00 0.00 C ATOM 223 C SER A 17 6.808 -4.953 0.366 1.00 0.00 C ATOM 224 O SER A 17 6.405 -4.009 1.056 1.00 0.00 O ATOM 225 CB SER A 17 8.895 -3.973 -0.628 1.00 0.00 C ATOM 226 OG SER A 17 10.308 -3.999 -0.621 1.00 0.00 O ATOM 0 H SER A 17 8.315 -6.421 -1.566 1.00 0.00 H new ATOM 0 HA SER A 17 8.800 -5.252 1.099 1.00 0.00 H new ATOM 0 HB2 SER A 17 8.534 -3.978 -1.656 1.00 0.00 H new ATOM 0 HB3 SER A 17 8.544 -3.047 -0.172 1.00 0.00 H new ATOM 0 HG SER A 17 10.632 -4.403 -1.453 1.00 0.00 H new ATOM 232 N CYS A 18 5.973 -5.844 -0.169 1.00 0.00 N ATOM 233 CA CYS A 18 4.546 -5.911 0.050 1.00 0.00 C ATOM 234 C CYS A 18 4.269 -6.141 1.555 1.00 0.00 C ATOM 235 O CYS A 18 3.590 -5.335 2.189 1.00 0.00 O ATOM 236 CB CYS A 18 4.043 -7.028 -0.888 1.00 0.00 C ATOM 237 SG CYS A 18 4.792 -6.884 -2.537 1.00 0.00 S ATOM 0 H CYS A 18 6.302 -6.574 -0.800 1.00 0.00 H new ATOM 0 HA CYS A 18 4.010 -4.992 -0.187 1.00 0.00 H new ATOM 0 HB2 CYS A 18 4.282 -8.002 -0.460 1.00 0.00 H new ATOM 0 HB3 CYS A 18 2.958 -6.975 -0.972 1.00 0.00 H new ATOM 242 N VAL A 19 4.910 -7.167 2.127 1.00 0.00 N ATOM 243 CA VAL A 19 4.943 -7.467 3.576 1.00 0.00 C ATOM 244 C VAL A 19 5.260 -6.230 4.437 1.00 0.00 C ATOM 245 O VAL A 19 4.490 -5.881 5.336 1.00 0.00 O ATOM 246 CB VAL A 19 5.933 -8.616 3.914 1.00 0.00 C ATOM 247 CG1 VAL A 19 5.351 -9.964 3.471 1.00 0.00 C ATOM 248 CG2 VAL A 19 7.335 -8.467 3.287 1.00 0.00 C ATOM 0 H VAL A 19 5.443 -7.841 1.578 1.00 0.00 H new ATOM 0 HA VAL A 19 3.934 -7.795 3.825 1.00 0.00 H new ATOM 0 HB VAL A 19 6.061 -8.565 4.995 1.00 0.00 H new ATOM 0 HG11 VAL A 19 6.054 -10.761 3.713 1.00 0.00 H new ATOM 0 HG12 VAL A 19 4.409 -10.141 3.989 1.00 0.00 H new ATOM 0 HG13 VAL A 19 5.176 -9.949 2.395 1.00 0.00 H new ATOM 0 HG21 VAL A 19 7.956 -9.314 3.578 1.00 0.00 H new ATOM 0 HG22 VAL A 19 7.247 -8.438 2.201 1.00 0.00 H new ATOM 0 HG23 VAL A 19 7.794 -7.543 3.638 1.00 0.00 H new ATOM 258 N TRP A 20 6.334 -5.501 4.104 1.00 0.00 N ATOM 259 CA TRP A 20 6.779 -4.308 4.834 1.00 0.00 C ATOM 260 C TRP A 20 5.706 -3.208 4.879 1.00 0.00 C ATOM 261 O TRP A 20 5.592 -2.507 5.888 1.00 0.00 O ATOM 262 CB TRP A 20 8.077 -3.804 4.184 1.00 0.00 C ATOM 263 CG TRP A 20 8.637 -2.535 4.751 1.00 0.00 C ATOM 264 CD1 TRP A 20 9.545 -2.455 5.748 1.00 0.00 C ATOM 265 CD2 TRP A 20 8.348 -1.152 4.373 1.00 0.00 C ATOM 266 NE1 TRP A 20 9.846 -1.133 6.002 1.00 0.00 N ATOM 267 CE2 TRP A 20 9.138 -0.283 5.184 1.00 0.00 C ATOM 268 CE3 TRP A 20 7.491 -0.541 3.432 1.00 0.00 C ATOM 269 CZ2 TRP A 20 9.086 1.114 5.069 1.00 0.00 C ATOM 270 CZ3 TRP A 20 7.418 0.859 3.319 1.00 0.00 C ATOM 271 CH2 TRP A 20 8.210 1.689 4.135 1.00 0.00 C ATOM 0 H TRP A 20 6.927 -5.728 3.306 1.00 0.00 H new ATOM 0 HA TRP A 20 6.962 -4.577 5.874 1.00 0.00 H new ATOM 0 HB2 TRP A 20 8.833 -4.584 4.272 1.00 0.00 H new ATOM 0 HB3 TRP A 20 7.895 -3.656 3.120 1.00 0.00 H new ATOM 0 HD1 TRP A 20 9.972 -3.300 6.268 1.00 0.00 H new ATOM 0 HE1 TRP A 20 10.512 -0.823 6.710 1.00 0.00 H new ATOM 0 HE3 TRP A 20 6.882 -1.159 2.789 1.00 0.00 H new ATOM 0 HZ2 TRP A 20 9.711 1.738 5.690 1.00 0.00 H new ATOM 0 HZ3 TRP A 20 6.747 1.302 2.598 1.00 0.00 H new ATOM 0 HH2 TRP A 20 8.144 2.763 4.043 1.00 0.00 H new ATOM 282 N THR A 21 4.879 -3.098 3.827 1.00 0.00 N ATOM 283 CA THR A 21 3.786 -2.115 3.722 1.00 0.00 C ATOM 284 C THR A 21 2.795 -2.275 4.870 1.00 0.00 C ATOM 285 O THR A 21 2.530 -1.308 5.578 1.00 0.00 O ATOM 286 CB THR A 21 3.047 -2.216 2.380 1.00 0.00 C ATOM 287 OG1 THR A 21 3.965 -2.208 1.307 1.00 0.00 O ATOM 288 CG2 THR A 21 2.116 -1.019 2.192 1.00 0.00 C ATOM 0 H THR A 21 4.952 -3.702 3.008 1.00 0.00 H new ATOM 0 HA THR A 21 4.245 -1.128 3.781 1.00 0.00 H new ATOM 0 HB THR A 21 2.479 -3.146 2.390 1.00 0.00 H new ATOM 0 HG1 THR A 21 4.355 -3.101 1.204 1.00 0.00 H new ATOM 0 HG21 THR A 21 1.600 -1.106 1.236 1.00 0.00 H new ATOM 0 HG22 THR A 21 1.384 -0.997 2.999 1.00 0.00 H new ATOM 0 HG23 THR A 21 2.699 -0.098 2.207 1.00 0.00 H new ATOM 296 N ILE A 22 2.294 -3.494 5.104 1.00 0.00 N ATOM 297 CA ILE A 22 1.337 -3.783 6.192 1.00 0.00 C ATOM 298 C ILE A 22 1.938 -3.392 7.543 1.00 0.00 C ATOM 299 O ILE A 22 1.266 -2.764 8.357 1.00 0.00 O ATOM 300 CB ILE A 22 0.918 -5.278 6.205 1.00 0.00 C ATOM 301 CG1 ILE A 22 0.126 -5.741 4.960 1.00 0.00 C ATOM 302 CG2 ILE A 22 0.032 -5.579 7.436 1.00 0.00 C ATOM 303 CD1 ILE A 22 0.915 -5.878 3.661 1.00 0.00 C ATOM 0 H ILE A 22 2.538 -4.313 4.546 1.00 0.00 H new ATOM 0 HA ILE A 22 0.441 -3.189 6.012 1.00 0.00 H new ATOM 0 HB ILE A 22 1.863 -5.821 6.225 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -0.330 -6.705 5.185 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -0.688 -5.035 4.792 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -0.253 -6.631 7.430 1.00 0.00 H new ATOM 0 HG22 ILE A 22 0.588 -5.359 8.347 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -0.864 -4.960 7.399 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.249 -6.209 2.864 1.00 0.00 H new ATOM 0 HD12 ILE A 22 1.349 -4.914 3.395 1.00 0.00 H new ATOM 0 HD13 ILE A 22 1.712 -6.610 3.795 1.00 0.00 H new ATOM 315 N GLU A 23 3.209 -3.730 7.755 1.00 0.00 N ATOM 316 CA GLU A 23 3.945 -3.477 8.993 1.00 0.00 C ATOM 317 C GLU A 23 4.055 -1.969 9.305 1.00 0.00 C ATOM 318 O GLU A 23 4.031 -1.580 10.473 1.00 0.00 O ATOM 319 CB GLU A 23 5.307 -4.192 8.860 1.00 0.00 C ATOM 320 CG GLU A 23 5.960 -4.596 10.186 1.00 0.00 C ATOM 321 CD GLU A 23 7.112 -5.575 9.935 1.00 0.00 C ATOM 322 OE1 GLU A 23 8.242 -5.122 9.639 1.00 0.00 O ATOM 323 OE2 GLU A 23 6.896 -6.815 10.012 1.00 0.00 O ATOM 0 H GLU A 23 3.773 -4.202 7.048 1.00 0.00 H new ATOM 0 HA GLU A 23 3.414 -3.879 9.856 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.173 -5.086 8.251 1.00 0.00 H new ATOM 0 HB3 GLU A 23 5.992 -3.539 8.320 1.00 0.00 H new ATOM 0 HG2 GLU A 23 6.332 -3.710 10.701 1.00 0.00 H new ATOM 0 HG3 GLU A 23 5.218 -5.056 10.839 1.00 0.00 H new ATOM 330 N GLN A 24 4.133 -1.102 8.283 1.00 0.00 N ATOM 331 CA GLN A 24 4.024 0.355 8.452 1.00 0.00 C ATOM 332 C GLN A 24 2.576 0.850 8.653 1.00 0.00 C ATOM 333 O GLN A 24 2.345 1.754 9.459 1.00 0.00 O ATOM 334 CB GLN A 24 4.665 1.123 7.280 1.00 0.00 C ATOM 335 CG GLN A 24 6.083 0.719 6.836 1.00 0.00 C ATOM 336 CD GLN A 24 6.978 0.145 7.933 1.00 0.00 C ATOM 337 OE1 GLN A 24 7.484 0.845 8.803 1.00 0.00 O ATOM 338 NE2 GLN A 24 7.204 -1.150 7.938 1.00 0.00 N ATOM 0 H GLN A 24 4.274 -1.392 7.315 1.00 0.00 H new ATOM 0 HA GLN A 24 4.575 0.566 9.369 1.00 0.00 H new ATOM 0 HB2 GLN A 24 4.005 1.026 6.418 1.00 0.00 H new ATOM 0 HB3 GLN A 24 4.688 2.180 7.547 1.00 0.00 H new ATOM 0 HG2 GLN A 24 5.998 -0.018 6.038 1.00 0.00 H new ATOM 0 HG3 GLN A 24 6.575 1.594 6.411 1.00 0.00 H new ATOM 0 HE21 GLN A 24 6.789 -1.743 7.219 1.00 0.00 H new ATOM 0 HE22 GLN A 24 7.795 -1.562 8.660 1.00 0.00 H new ATOM 347 N GLN A 25 1.625 0.339 7.861 1.00 0.00 N ATOM 348 CA GLN A 25 0.229 0.808 7.796 1.00 0.00 C ATOM 349 C GLN A 25 -0.601 0.407 9.027 1.00 0.00 C ATOM 350 O GLN A 25 -1.391 1.210 9.527 1.00 0.00 O ATOM 351 CB GLN A 25 -0.437 0.257 6.520 1.00 0.00 C ATOM 352 CG GLN A 25 0.159 0.776 5.196 1.00 0.00 C ATOM 353 CD GLN A 25 -0.464 2.079 4.694 1.00 0.00 C ATOM 354 OE1 GLN A 25 -0.404 3.124 5.333 1.00 0.00 O ATOM 355 NE2 GLN A 25 -1.056 2.072 3.520 1.00 0.00 N ATOM 0 H GLN A 25 1.809 -0.438 7.226 1.00 0.00 H new ATOM 0 HA GLN A 25 0.258 1.897 7.777 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -0.365 -0.831 6.532 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -1.498 0.506 6.546 1.00 0.00 H new ATOM 0 HG2 GLN A 25 1.231 0.926 5.328 1.00 0.00 H new ATOM 0 HG3 GLN A 25 0.036 0.010 4.431 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -1.111 1.207 2.982 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -1.461 2.931 3.148 1.00 0.00 H new ATOM 364 N ILE A 26 -0.456 -0.835 9.509 1.00 0.00 N ATOM 365 CA ILE A 26 -1.115 -1.309 10.738 1.00 0.00 C ATOM 366 C ILE A 26 -0.447 -0.697 11.976 1.00 0.00 C ATOM 367 O ILE A 26 -1.145 -0.154 12.834 1.00 0.00 O ATOM 368 CB ILE A 26 -1.240 -2.861 10.718 1.00 0.00 C ATOM 369 CG1 ILE A 26 -2.699 -3.323 10.961 1.00 0.00 C ATOM 370 CG2 ILE A 26 -0.286 -3.609 11.667 1.00 0.00 C ATOM 371 CD1 ILE A 26 -3.029 -4.618 10.209 1.00 0.00 C ATOM 0 H ILE A 26 0.123 -1.543 9.057 1.00 0.00 H new ATOM 0 HA ILE A 26 -2.145 -0.955 10.790 1.00 0.00 H new ATOM 0 HB ILE A 26 -0.930 -3.134 9.709 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -2.857 -3.474 12.029 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -3.385 -2.537 10.645 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -0.452 -4.683 11.578 1.00 0.00 H new ATOM 0 HG22 ILE A 26 0.746 -3.378 11.402 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -0.475 -3.297 12.694 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -4.062 -4.902 10.410 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -2.898 -4.461 9.138 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -2.362 -5.413 10.543 1.00 0.00 H new ATOM 383 N GLY A 27 0.895 -0.680 12.014 1.00 0.00 N ATOM 384 CA GLY A 27 1.728 -0.113 13.090 1.00 0.00 C ATOM 385 C GLY A 27 1.350 1.304 13.524 1.00 0.00 C ATOM 386 O GLY A 27 1.470 1.646 14.700 1.00 0.00 O ATOM 0 H GLY A 27 1.456 -1.079 11.261 1.00 0.00 H new ATOM 0 HA2 GLY A 27 1.670 -0.770 13.958 1.00 0.00 H new ATOM 0 HA3 GLY A 27 2.767 -0.111 12.761 1.00 0.00 H new ATOM 390 N LYS A 28 0.819 2.108 12.597 1.00 0.00 N ATOM 391 CA LYS A 28 0.358 3.477 12.829 1.00 0.00 C ATOM 392 C LYS A 28 -0.937 3.530 13.662 1.00 0.00 C ATOM 393 O LYS A 28 -1.194 4.549 14.302 1.00 0.00 O ATOM 394 CB LYS A 28 0.203 4.138 11.442 1.00 0.00 C ATOM 395 CG LYS A 28 -0.082 5.652 11.441 1.00 0.00 C ATOM 396 CD LYS A 28 1.058 6.537 11.975 1.00 0.00 C ATOM 397 CE LYS A 28 2.288 6.513 11.058 1.00 0.00 C ATOM 398 NZ LYS A 28 3.320 7.483 11.496 1.00 0.00 N ATOM 0 H LYS A 28 0.695 1.810 11.629 1.00 0.00 H new ATOM 0 HA LYS A 28 1.084 4.026 13.428 1.00 0.00 H new ATOM 0 HB2 LYS A 28 1.116 3.960 10.873 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -0.606 3.636 10.911 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -0.312 5.961 10.421 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -0.974 5.837 12.039 1.00 0.00 H new ATOM 0 HD2 LYS A 28 0.703 7.562 12.077 1.00 0.00 H new ATOM 0 HD3 LYS A 28 1.343 6.198 12.971 1.00 0.00 H new ATOM 0 HE2 LYS A 28 2.714 5.510 11.047 1.00 0.00 H new ATOM 0 HE3 LYS A 28 1.984 6.742 10.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 4.135 7.437 10.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 2.922 8.444 11.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 3.628 7.250 12.461 1.00 0.00 H new ATOM 412 N VAL A 29 -1.727 2.452 13.701 1.00 0.00 N ATOM 413 CA VAL A 29 -2.891 2.337 14.589 1.00 0.00 C ATOM 414 C VAL A 29 -2.421 1.716 15.902 1.00 0.00 C ATOM 415 O VAL A 29 -2.255 0.506 16.022 1.00 0.00 O ATOM 416 CB VAL A 29 -4.049 1.514 13.990 1.00 0.00 C ATOM 417 CG1 VAL A 29 -5.284 1.593 14.906 1.00 0.00 C ATOM 418 CG2 VAL A 29 -4.439 1.992 12.584 1.00 0.00 C ATOM 0 H VAL A 29 -1.577 1.630 13.115 1.00 0.00 H new ATOM 0 HA VAL A 29 -3.296 3.337 14.743 1.00 0.00 H new ATOM 0 HB VAL A 29 -3.699 0.485 13.912 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -6.096 1.008 14.473 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -5.034 1.195 15.889 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -5.598 2.632 15.005 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -5.259 1.381 12.206 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -4.755 3.034 12.629 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -3.581 1.901 11.918 1.00 0.00 H new ATOM 428 N ASN A 30 -2.227 2.578 16.892 1.00 0.00 N ATOM 429 CA ASN A 30 -1.711 2.276 18.239 1.00 0.00 C ATOM 430 C ASN A 30 -2.277 1.003 18.911 1.00 0.00 C ATOM 431 O ASN A 30 -1.583 0.357 19.695 1.00 0.00 O ATOM 432 CB ASN A 30 -1.978 3.498 19.128 1.00 0.00 C ATOM 433 CG ASN A 30 -1.322 3.374 20.497 1.00 0.00 C ATOM 434 OD1 ASN A 30 -1.999 3.252 21.511 1.00 0.00 O ATOM 435 ND2 ASN A 30 -0.004 3.372 20.563 1.00 0.00 N ATOM 0 H ASN A 30 -2.436 3.570 16.778 1.00 0.00 H new ATOM 0 HA ASN A 30 -0.649 2.063 18.120 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -1.607 4.394 18.630 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -3.053 3.625 19.253 1.00 0.00 H new ATOM 0 HD21 ASN A 30 0.461 3.268 21.465 1.00 0.00 H new ATOM 0 HD22 ASN A 30 0.549 3.474 19.712 1.00 0.00 H new ATOM 442 N GLY A 31 -3.510 0.599 18.571 1.00 0.00 N ATOM 443 CA GLY A 31 -4.154 -0.621 19.073 1.00 0.00 C ATOM 444 C GLY A 31 -3.638 -1.939 18.497 1.00 0.00 C ATOM 445 O GLY A 31 -4.098 -2.987 18.935 1.00 0.00 O ATOM 0 H GLY A 31 -4.099 1.124 17.925 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -4.036 -0.650 20.156 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -5.223 -0.553 18.870 1.00 0.00 H new ATOM 449 N VAL A 32 -2.734 -1.936 17.520 1.00 0.00 N ATOM 450 CA VAL A 32 -2.039 -3.166 17.090 1.00 0.00 C ATOM 451 C VAL A 32 -1.054 -3.582 18.189 1.00 0.00 C ATOM 452 O VAL A 32 -0.200 -2.794 18.585 1.00 0.00 O ATOM 453 CB VAL A 32 -1.385 -3.038 15.701 1.00 0.00 C ATOM 454 CG1 VAL A 32 -2.481 -2.603 14.710 1.00 0.00 C ATOM 455 CG2 VAL A 32 -0.160 -2.120 15.625 1.00 0.00 C ATOM 0 H VAL A 32 -2.459 -1.099 17.005 1.00 0.00 H new ATOM 0 HA VAL A 32 -2.774 -3.960 16.959 1.00 0.00 H new ATOM 0 HB VAL A 32 -0.973 -4.014 15.446 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -2.051 -2.502 13.713 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -3.272 -3.353 14.690 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -2.896 -1.646 15.024 1.00 0.00 H new ATOM 0 HG21 VAL A 32 0.220 -2.104 14.603 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -0.443 -1.110 15.923 1.00 0.00 H new ATOM 0 HG23 VAL A 32 0.616 -2.492 16.294 1.00 0.00 H new ATOM 465 N HIS A 33 -1.202 -4.790 18.734 1.00 0.00 N ATOM 466 CA HIS A 33 -0.375 -5.252 19.853 1.00 0.00 C ATOM 467 C HIS A 33 0.896 -5.946 19.328 1.00 0.00 C ATOM 468 O HIS A 33 1.991 -5.632 19.796 1.00 0.00 O ATOM 469 CB HIS A 33 -1.228 -6.148 20.769 1.00 0.00 C ATOM 470 CG HIS A 33 -0.601 -6.480 22.105 1.00 0.00 C ATOM 471 ND1 HIS A 33 -1.099 -6.158 23.351 1.00 0.00 N ATOM 472 CD2 HIS A 33 0.529 -7.227 22.310 1.00 0.00 C ATOM 473 CE1 HIS A 33 -0.282 -6.691 24.275 1.00 0.00 C ATOM 474 NE2 HIS A 33 0.724 -7.363 23.689 1.00 0.00 N ATOM 0 H HIS A 33 -1.892 -5.472 18.417 1.00 0.00 H new ATOM 0 HA HIS A 33 -0.030 -4.409 20.451 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -2.184 -5.655 20.946 1.00 0.00 H new ATOM 0 HB3 HIS A 33 -1.442 -7.079 20.244 1.00 0.00 H new ATOM 0 HD2 HIS A 33 1.162 -7.641 21.539 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -0.415 -6.593 25.342 1.00 0.00 H new ATOM 0 HE2 HIS A 33 1.477 -7.869 24.155 1.00 0.00 H new ATOM 482 N HIS A 34 0.781 -6.830 18.325 1.00 0.00 N ATOM 483 CA HIS A 34 1.929 -7.437 17.627 1.00 0.00 C ATOM 484 C HIS A 34 1.555 -7.929 16.204 1.00 0.00 C ATOM 485 O HIS A 34 0.719 -8.832 16.065 1.00 0.00 O ATOM 486 CB HIS A 34 2.499 -8.578 18.497 1.00 0.00 C ATOM 487 CG HIS A 34 3.862 -9.065 18.066 1.00 0.00 C ATOM 488 ND1 HIS A 34 5.078 -8.679 18.592 1.00 0.00 N ATOM 489 CD2 HIS A 34 4.126 -10.021 17.123 1.00 0.00 C ATOM 490 CE1 HIS A 34 6.043 -9.373 17.972 1.00 0.00 C ATOM 491 NE2 HIS A 34 5.511 -10.217 17.070 1.00 0.00 N ATOM 0 H HIS A 34 -0.121 -7.148 17.971 1.00 0.00 H new ATOM 0 HA HIS A 34 2.697 -6.676 17.486 1.00 0.00 H new ATOM 0 HB2 HIS A 34 2.558 -8.237 19.531 1.00 0.00 H new ATOM 0 HB3 HIS A 34 1.803 -9.417 18.477 1.00 0.00 H new ATOM 0 HD2 HIS A 34 3.391 -10.536 16.522 1.00 0.00 H new ATOM 0 HE1 HIS A 34 7.100 -9.269 18.169 1.00 0.00 H new ATOM 0 HE2 HIS A 34 6.015 -10.869 16.469 1.00 0.00 H new ATOM 499 N ILE A 35 2.163 -7.370 15.142 1.00 0.00 N ATOM 500 CA ILE A 35 1.962 -7.791 13.733 1.00 0.00 C ATOM 501 C ILE A 35 3.065 -8.732 13.215 1.00 0.00 C ATOM 502 O ILE A 35 4.260 -8.453 13.337 1.00 0.00 O ATOM 503 CB ILE A 35 1.768 -6.567 12.784 1.00 0.00 C ATOM 504 CG1 ILE A 35 1.434 -7.002 11.329 1.00 0.00 C ATOM 505 CG2 ILE A 35 2.922 -5.548 12.839 1.00 0.00 C ATOM 506 CD1 ILE A 35 2.599 -7.137 10.336 1.00 0.00 C ATOM 0 H ILE A 35 2.822 -6.597 15.235 1.00 0.00 H new ATOM 0 HA ILE A 35 1.039 -8.370 13.727 1.00 0.00 H new ATOM 0 HB ILE A 35 0.898 -6.035 13.170 1.00 0.00 H new ATOM 0 HG12 ILE A 35 0.921 -7.963 11.376 1.00 0.00 H new ATOM 0 HG13 ILE A 35 0.726 -6.282 10.919 1.00 0.00 H new ATOM 0 HG21 ILE A 35 2.715 -4.727 12.153 1.00 0.00 H new ATOM 0 HG22 ILE A 35 3.016 -5.159 13.853 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.853 -6.036 12.550 1.00 0.00 H new ATOM 0 HD11 ILE A 35 2.215 -7.446 9.364 1.00 0.00 H new ATOM 0 HD12 ILE A 35 3.106 -6.177 10.237 1.00 0.00 H new ATOM 0 HD13 ILE A 35 3.304 -7.884 10.702 1.00 0.00 H new ATOM 518 N LYS A 36 2.645 -9.805 12.541 1.00 0.00 N ATOM 519 CA LYS A 36 3.423 -10.581 11.564 1.00 0.00 C ATOM 520 C LYS A 36 2.683 -10.604 10.204 1.00 0.00 C ATOM 521 O LYS A 36 1.456 -10.675 10.170 1.00 0.00 O ATOM 522 CB LYS A 36 3.643 -12.010 12.109 1.00 0.00 C ATOM 523 CG LYS A 36 4.438 -12.909 11.143 1.00 0.00 C ATOM 524 CD LYS A 36 4.844 -14.249 11.775 1.00 0.00 C ATOM 525 CE LYS A 36 5.638 -15.080 10.753 1.00 0.00 C ATOM 526 NZ LYS A 36 6.267 -16.277 11.362 1.00 0.00 N ATOM 0 H LYS A 36 1.704 -10.178 12.666 1.00 0.00 H new ATOM 0 HA LYS A 36 4.397 -10.117 11.408 1.00 0.00 H new ATOM 0 HB2 LYS A 36 4.172 -11.952 13.060 1.00 0.00 H new ATOM 0 HB3 LYS A 36 2.675 -12.469 12.310 1.00 0.00 H new ATOM 0 HG2 LYS A 36 3.837 -13.099 10.254 1.00 0.00 H new ATOM 0 HG3 LYS A 36 5.333 -12.381 10.816 1.00 0.00 H new ATOM 0 HD2 LYS A 36 5.448 -14.075 12.665 1.00 0.00 H new ATOM 0 HD3 LYS A 36 3.957 -14.796 12.094 1.00 0.00 H new ATOM 0 HE2 LYS A 36 4.973 -15.393 9.948 1.00 0.00 H new ATOM 0 HE3 LYS A 36 6.411 -14.456 10.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 6.790 -16.803 10.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 6.923 -15.981 12.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 5.530 -16.888 11.768 1.00 0.00 H new ATOM 540 N VAL A 37 3.394 -10.590 9.077 1.00 0.00 N ATOM 541 CA VAL A 37 2.827 -10.944 7.761 1.00 0.00 C ATOM 542 C VAL A 37 3.831 -11.773 6.950 1.00 0.00 C ATOM 543 O VAL A 37 5.008 -11.432 6.862 1.00 0.00 O ATOM 544 CB VAL A 37 2.278 -9.709 7.003 1.00 0.00 C ATOM 545 CG1 VAL A 37 3.332 -8.631 6.733 1.00 0.00 C ATOM 546 CG2 VAL A 37 1.609 -10.102 5.678 1.00 0.00 C ATOM 0 H VAL A 37 4.381 -10.334 9.043 1.00 0.00 H new ATOM 0 HA VAL A 37 1.954 -11.577 7.922 1.00 0.00 H new ATOM 0 HB VAL A 37 1.535 -9.282 7.676 1.00 0.00 H new ATOM 0 HG11 VAL A 37 2.873 -7.799 6.199 1.00 0.00 H new ATOM 0 HG12 VAL A 37 3.739 -8.275 7.679 1.00 0.00 H new ATOM 0 HG13 VAL A 37 4.135 -9.051 6.128 1.00 0.00 H new ATOM 0 HG21 VAL A 37 1.238 -9.207 5.178 1.00 0.00 H new ATOM 0 HG22 VAL A 37 2.336 -10.600 5.037 1.00 0.00 H new ATOM 0 HG23 VAL A 37 0.777 -10.778 5.877 1.00 0.00 H new ATOM 556 N SER A 38 3.360 -12.894 6.403 1.00 0.00 N ATOM 557 CA SER A 38 4.170 -13.960 5.801 1.00 0.00 C ATOM 558 C SER A 38 3.828 -14.139 4.316 1.00 0.00 C ATOM 559 O SER A 38 2.702 -14.503 3.963 1.00 0.00 O ATOM 560 CB SER A 38 3.896 -15.255 6.575 1.00 0.00 C ATOM 561 OG SER A 38 4.580 -16.381 6.050 1.00 0.00 O ATOM 0 H SER A 38 2.361 -13.095 6.364 1.00 0.00 H new ATOM 0 HA SER A 38 5.227 -13.699 5.860 1.00 0.00 H new ATOM 0 HB2 SER A 38 4.187 -15.116 7.616 1.00 0.00 H new ATOM 0 HB3 SER A 38 2.824 -15.454 6.567 1.00 0.00 H new ATOM 0 HG SER A 38 4.439 -17.153 6.638 1.00 0.00 H new ATOM 567 N LEU A 39 4.801 -13.894 3.428 1.00 0.00 N ATOM 568 CA LEU A 39 4.575 -13.921 1.975 1.00 0.00 C ATOM 569 C LEU A 39 4.414 -15.337 1.422 1.00 0.00 C ATOM 570 O LEU A 39 3.671 -15.523 0.462 1.00 0.00 O ATOM 571 CB LEU A 39 5.675 -13.118 1.255 1.00 0.00 C ATOM 572 CG LEU A 39 7.085 -13.750 1.289 1.00 0.00 C ATOM 573 CD1 LEU A 39 7.396 -14.526 -0.002 1.00 0.00 C ATOM 574 CD2 LEU A 39 8.148 -12.659 1.487 1.00 0.00 C ATOM 0 H LEU A 39 5.761 -13.673 3.693 1.00 0.00 H new ATOM 0 HA LEU A 39 3.619 -13.436 1.776 1.00 0.00 H new ATOM 0 HB2 LEU A 39 5.381 -12.983 0.214 1.00 0.00 H new ATOM 0 HB3 LEU A 39 5.729 -12.126 1.702 1.00 0.00 H new ATOM 0 HG LEU A 39 7.106 -14.451 2.124 1.00 0.00 H new ATOM 0 HD11 LEU A 39 8.396 -14.954 0.063 1.00 0.00 H new ATOM 0 HD12 LEU A 39 6.666 -15.326 -0.131 1.00 0.00 H new ATOM 0 HD13 LEU A 39 7.346 -13.849 -0.855 1.00 0.00 H new ATOM 0 HD21 LEU A 39 9.138 -13.115 1.510 1.00 0.00 H new ATOM 0 HD22 LEU A 39 8.096 -11.946 0.664 1.00 0.00 H new ATOM 0 HD23 LEU A 39 7.966 -12.140 2.428 1.00 0.00 H new ATOM 586 N GLU A 40 5.078 -16.335 2.016 1.00 0.00 N ATOM 587 CA GLU A 40 5.010 -17.727 1.553 1.00 0.00 C ATOM 588 C GLU A 40 3.859 -18.524 2.190 1.00 0.00 C ATOM 589 O GLU A 40 3.450 -19.551 1.649 1.00 0.00 O ATOM 590 CB GLU A 40 6.366 -18.423 1.733 1.00 0.00 C ATOM 591 CG GLU A 40 6.772 -18.691 3.188 1.00 0.00 C ATOM 592 CD GLU A 40 8.132 -19.382 3.238 1.00 0.00 C ATOM 593 OE1 GLU A 40 9.161 -18.687 3.053 1.00 0.00 O ATOM 594 OE2 GLU A 40 8.182 -20.614 3.473 1.00 0.00 O ATOM 0 H GLU A 40 5.677 -16.201 2.830 1.00 0.00 H new ATOM 0 HA GLU A 40 4.782 -17.697 0.488 1.00 0.00 H new ATOM 0 HB2 GLU A 40 6.344 -19.372 1.198 1.00 0.00 H new ATOM 0 HB3 GLU A 40 7.136 -17.811 1.264 1.00 0.00 H new ATOM 0 HG2 GLU A 40 6.813 -17.752 3.740 1.00 0.00 H new ATOM 0 HG3 GLU A 40 6.021 -19.314 3.674 1.00 0.00 H new ATOM 601 N GLU A 41 3.300 -18.058 3.311 1.00 0.00 N ATOM 602 CA GLU A 41 2.006 -18.542 3.815 1.00 0.00 C ATOM 603 C GLU A 41 0.825 -17.773 3.187 1.00 0.00 C ATOM 604 O GLU A 41 -0.310 -18.252 3.232 1.00 0.00 O ATOM 605 CB GLU A 41 1.961 -18.435 5.346 1.00 0.00 C ATOM 606 CG GLU A 41 3.001 -19.343 6.015 1.00 0.00 C ATOM 607 CD GLU A 41 3.031 -19.152 7.528 1.00 0.00 C ATOM 608 OE1 GLU A 41 2.268 -19.828 8.263 1.00 0.00 O ATOM 609 OE2 GLU A 41 3.857 -18.332 8.004 1.00 0.00 O ATOM 0 H GLU A 41 3.727 -17.338 3.894 1.00 0.00 H new ATOM 0 HA GLU A 41 1.907 -19.588 3.526 1.00 0.00 H new ATOM 0 HB2 GLU A 41 2.138 -17.401 5.643 1.00 0.00 H new ATOM 0 HB3 GLU A 41 0.965 -18.702 5.699 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.776 -20.384 5.785 1.00 0.00 H new ATOM 0 HG3 GLU A 41 3.987 -19.131 5.602 1.00 0.00 H new ATOM 616 N LYS A 42 1.085 -16.593 2.604 1.00 0.00 N ATOM 617 CA LYS A 42 0.100 -15.640 2.064 1.00 0.00 C ATOM 618 C LYS A 42 -0.914 -15.191 3.138 1.00 0.00 C ATOM 619 O LYS A 42 -2.096 -14.960 2.859 1.00 0.00 O ATOM 620 CB LYS A 42 -0.533 -16.168 0.756 1.00 0.00 C ATOM 621 CG LYS A 42 0.534 -16.440 -0.320 1.00 0.00 C ATOM 622 CD LYS A 42 -0.032 -16.781 -1.704 1.00 0.00 C ATOM 623 CE LYS A 42 -0.749 -15.588 -2.354 1.00 0.00 C ATOM 624 NZ LYS A 42 -0.973 -15.811 -3.803 1.00 0.00 N ATOM 0 H LYS A 42 2.042 -16.258 2.490 1.00 0.00 H new ATOM 0 HA LYS A 42 0.621 -14.726 1.781 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -1.085 -17.085 0.962 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -1.253 -15.441 0.380 1.00 0.00 H new ATOM 0 HG2 LYS A 42 1.174 -15.562 -0.409 1.00 0.00 H new ATOM 0 HG3 LYS A 42 1.166 -17.263 0.013 1.00 0.00 H new ATOM 0 HD2 LYS A 42 0.778 -17.112 -2.353 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -0.729 -17.615 -1.613 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -1.706 -15.423 -1.858 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -0.156 -14.684 -2.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -1.843 -15.325 -4.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -0.166 -15.435 -4.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -1.067 -16.830 -3.987 1.00 0.00 H new ATOM 638 N ASN A 43 -0.468 -15.090 4.394 1.00 0.00 N ATOM 639 CA ASN A 43 -1.301 -14.745 5.544 1.00 0.00 C ATOM 640 C ASN A 43 -0.688 -13.616 6.391 1.00 0.00 C ATOM 641 O ASN A 43 0.523 -13.395 6.408 1.00 0.00 O ATOM 642 CB ASN A 43 -1.673 -16.009 6.352 1.00 0.00 C ATOM 643 CG ASN A 43 -0.598 -16.556 7.292 1.00 0.00 C ATOM 644 OD1 ASN A 43 0.543 -16.120 7.306 1.00 0.00 O ATOM 645 ND2 ASN A 43 -0.948 -17.511 8.128 1.00 0.00 N ATOM 0 H ASN A 43 0.508 -15.251 4.643 1.00 0.00 H new ATOM 0 HA ASN A 43 -2.240 -14.332 5.175 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -2.562 -15.788 6.942 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -1.945 -16.796 5.649 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -0.266 -17.887 8.787 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -1.901 -17.875 8.116 1.00 0.00 H new ATOM 652 N ALA A 44 -1.563 -12.885 7.072 1.00 0.00 N ATOM 653 CA ALA A 44 -1.272 -11.745 7.928 1.00 0.00 C ATOM 654 C ALA A 44 -1.802 -12.051 9.343 1.00 0.00 C ATOM 655 O ALA A 44 -3.013 -12.192 9.519 1.00 0.00 O ATOM 656 CB ALA A 44 -1.950 -10.535 7.257 1.00 0.00 C ATOM 0 H ALA A 44 -2.562 -13.089 7.037 1.00 0.00 H new ATOM 0 HA ALA A 44 -0.209 -11.533 8.042 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -1.769 -9.640 7.853 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -1.538 -10.395 6.258 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -3.023 -10.713 7.185 1.00 0.00 H new ATOM 662 N THR A 45 -0.910 -12.205 10.328 1.00 0.00 N ATOM 663 CA THR A 45 -1.217 -12.695 11.686 1.00 0.00 C ATOM 664 C THR A 45 -0.988 -11.595 12.709 1.00 0.00 C ATOM 665 O THR A 45 0.069 -10.969 12.745 1.00 0.00 O ATOM 666 CB THR A 45 -0.338 -13.899 12.029 1.00 0.00 C ATOM 667 OG1 THR A 45 -0.509 -14.898 11.052 1.00 0.00 O ATOM 668 CG2 THR A 45 -0.707 -14.496 13.384 1.00 0.00 C ATOM 0 H THR A 45 0.078 -11.986 10.203 1.00 0.00 H new ATOM 0 HA THR A 45 -2.264 -12.997 11.711 1.00 0.00 H new ATOM 0 HB THR A 45 0.695 -13.553 12.062 1.00 0.00 H new ATOM 0 HG1 THR A 45 0.055 -15.669 11.270 1.00 0.00 H new ATOM 0 HG21 THR A 45 -0.062 -15.349 13.594 1.00 0.00 H new ATOM 0 HG22 THR A 45 -0.577 -13.743 14.161 1.00 0.00 H new ATOM 0 HG23 THR A 45 -1.747 -14.823 13.366 1.00 0.00 H new ATOM 676 N ILE A 46 -1.951 -11.355 13.592 1.00 0.00 N ATOM 677 CA ILE A 46 -1.954 -10.166 14.447 1.00 0.00 C ATOM 678 C ILE A 46 -2.674 -10.396 15.779 1.00 0.00 C ATOM 679 O ILE A 46 -3.732 -11.027 15.851 1.00 0.00 O ATOM 680 CB ILE A 46 -2.473 -8.947 13.638 1.00 0.00 C ATOM 681 CG1 ILE A 46 -2.432 -7.638 14.459 1.00 0.00 C ATOM 682 CG2 ILE A 46 -3.878 -9.189 13.058 1.00 0.00 C ATOM 683 CD1 ILE A 46 -2.557 -6.377 13.600 1.00 0.00 C ATOM 0 H ILE A 46 -2.749 -11.973 13.738 1.00 0.00 H new ATOM 0 HA ILE A 46 -0.931 -9.941 14.747 1.00 0.00 H new ATOM 0 HB ILE A 46 -1.787 -8.828 12.799 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -3.240 -7.652 15.191 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.497 -7.597 15.017 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -4.198 -8.309 12.501 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -3.853 -10.051 12.392 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -4.579 -9.379 13.871 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -2.521 -5.496 14.240 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -1.735 -6.341 12.885 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -3.505 -6.396 13.062 1.00 0.00 H new ATOM 695 N ILE A 47 -2.087 -9.845 16.841 1.00 0.00 N ATOM 696 CA ILE A 47 -2.798 -9.567 18.096 1.00 0.00 C ATOM 697 C ILE A 47 -3.154 -8.079 18.129 1.00 0.00 C ATOM 698 O ILE A 47 -2.294 -7.234 17.855 1.00 0.00 O ATOM 699 CB ILE A 47 -1.979 -10.001 19.337 1.00 0.00 C ATOM 700 CG1 ILE A 47 -1.652 -11.513 19.273 1.00 0.00 C ATOM 701 CG2 ILE A 47 -2.767 -9.679 20.622 1.00 0.00 C ATOM 702 CD1 ILE A 47 -0.962 -12.068 20.527 1.00 0.00 C ATOM 0 H ILE A 47 -1.103 -9.577 16.859 1.00 0.00 H new ATOM 0 HA ILE A 47 -3.714 -10.157 18.133 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.040 -9.448 19.347 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -2.577 -12.065 19.108 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -1.012 -11.697 18.410 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -2.186 -9.986 21.492 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -2.957 -8.607 20.673 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -3.716 -10.216 20.611 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -0.770 -13.133 20.396 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -0.018 -11.546 20.684 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -1.607 -11.920 21.393 1.00 0.00 H new ATOM 714 N TYR A 48 -4.400 -7.766 18.484 1.00 0.00 N ATOM 715 CA TYR A 48 -4.927 -6.403 18.597 1.00 0.00 C ATOM 716 C TYR A 48 -5.631 -6.135 19.942 1.00 0.00 C ATOM 717 O TYR A 48 -6.138 -7.046 20.600 1.00 0.00 O ATOM 718 CB TYR A 48 -5.844 -6.109 17.399 1.00 0.00 C ATOM 719 CG TYR A 48 -7.183 -6.834 17.367 1.00 0.00 C ATOM 720 CD1 TYR A 48 -7.284 -8.115 16.787 1.00 0.00 C ATOM 721 CD2 TYR A 48 -8.341 -6.211 17.877 1.00 0.00 C ATOM 722 CE1 TYR A 48 -8.532 -8.769 16.708 1.00 0.00 C ATOM 723 CE2 TYR A 48 -9.591 -6.854 17.792 1.00 0.00 C ATOM 724 CZ TYR A 48 -9.693 -8.134 17.202 1.00 0.00 C ATOM 725 OH TYR A 48 -10.908 -8.748 17.127 1.00 0.00 O ATOM 0 H TYR A 48 -5.095 -8.478 18.709 1.00 0.00 H new ATOM 0 HA TYR A 48 -4.082 -5.715 18.578 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -6.037 -5.037 17.374 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -5.301 -6.357 16.487 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -6.400 -8.599 16.400 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -8.269 -5.236 18.335 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -8.599 -9.754 16.270 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -10.474 -6.367 18.179 1.00 0.00 H new ATOM 0 HH TYR A 48 -11.593 -8.166 17.516 1.00 0.00 H new ATOM 735 N ASP A 49 -5.642 -4.863 20.343 1.00 0.00 N ATOM 736 CA ASP A 49 -6.233 -4.342 21.576 1.00 0.00 C ATOM 737 C ASP A 49 -7.733 -4.024 21.386 1.00 0.00 C ATOM 738 O ASP A 49 -8.088 -3.340 20.417 1.00 0.00 O ATOM 739 CB ASP A 49 -5.465 -3.075 21.976 1.00 0.00 C ATOM 740 CG ASP A 49 -5.882 -2.564 23.352 1.00 0.00 C ATOM 741 OD1 ASP A 49 -6.852 -1.774 23.437 1.00 0.00 O ATOM 742 OD2 ASP A 49 -5.218 -2.960 24.337 1.00 0.00 O ATOM 0 H ASP A 49 -5.214 -4.126 19.783 1.00 0.00 H new ATOM 0 HA ASP A 49 -6.159 -5.094 22.361 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -4.395 -3.284 21.976 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -5.638 -2.297 21.233 1.00 0.00 H new ATOM 747 N PRO A 50 -8.621 -4.475 22.294 1.00 0.00 N ATOM 748 CA PRO A 50 -10.065 -4.422 22.086 1.00 0.00 C ATOM 749 C PRO A 50 -10.659 -3.005 22.111 1.00 0.00 C ATOM 750 O PRO A 50 -11.720 -2.806 21.522 1.00 0.00 O ATOM 751 CB PRO A 50 -10.670 -5.316 23.177 1.00 0.00 C ATOM 752 CG PRO A 50 -9.622 -5.284 24.287 1.00 0.00 C ATOM 753 CD PRO A 50 -8.312 -5.208 23.514 1.00 0.00 C ATOM 0 HA PRO A 50 -10.306 -4.772 21.082 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -11.631 -4.934 23.521 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -10.841 -6.330 22.816 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -9.755 -4.424 24.943 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -9.670 -6.174 24.914 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -7.543 -4.698 24.094 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -7.932 -6.204 23.288 1.00 0.00 H new ATOM 761 N LYS A 51 -10.002 -2.012 22.733 1.00 0.00 N ATOM 762 CA LYS A 51 -10.491 -0.621 22.754 1.00 0.00 C ATOM 763 C LYS A 51 -10.015 0.198 21.546 1.00 0.00 C ATOM 764 O LYS A 51 -10.753 1.034 21.016 1.00 0.00 O ATOM 765 CB LYS A 51 -10.017 0.087 24.033 1.00 0.00 C ATOM 766 CG LYS A 51 -10.465 -0.618 25.319 1.00 0.00 C ATOM 767 CD LYS A 51 -10.314 0.280 26.553 1.00 0.00 C ATOM 768 CE LYS A 51 -8.860 0.722 26.752 1.00 0.00 C ATOM 769 NZ LYS A 51 -8.708 1.669 27.877 1.00 0.00 N ATOM 0 H LYS A 51 -9.123 -2.148 23.232 1.00 0.00 H new ATOM 0 HA LYS A 51 -11.579 -0.679 22.718 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -8.929 0.151 24.022 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -10.396 1.109 24.036 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -11.506 -0.925 25.220 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -9.877 -1.526 25.458 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -10.951 1.158 26.445 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -10.657 -0.256 27.438 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -8.238 -0.155 26.932 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -8.496 1.188 25.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -7.708 1.938 27.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -9.280 2.519 27.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -9.029 1.217 28.757 1.00 0.00 H new ATOM 783 N LEU A 52 -8.763 -0.023 21.136 1.00 0.00 N ATOM 784 CA LEU A 52 -8.054 0.793 20.147 1.00 0.00 C ATOM 785 C LEU A 52 -8.100 0.215 18.721 1.00 0.00 C ATOM 786 O LEU A 52 -7.696 0.908 17.789 1.00 0.00 O ATOM 787 CB LEU A 52 -6.603 0.938 20.639 1.00 0.00 C ATOM 788 CG LEU A 52 -6.410 1.773 21.920 1.00 0.00 C ATOM 789 CD1 LEU A 52 -4.984 1.559 22.440 1.00 0.00 C ATOM 790 CD2 LEU A 52 -6.634 3.266 21.649 1.00 0.00 C ATOM 0 H LEU A 52 -8.200 -0.795 21.492 1.00 0.00 H new ATOM 0 HA LEU A 52 -8.549 1.761 20.068 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -6.197 -0.058 20.813 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -6.012 1.389 19.842 1.00 0.00 H new ATOM 0 HG LEU A 52 -7.141 1.449 22.661 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -4.836 2.145 23.347 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -4.832 0.503 22.662 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -4.269 1.877 21.681 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -6.491 3.829 22.571 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -5.922 3.611 20.899 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -7.649 3.421 21.283 1.00 0.00 H new ATOM 802 N GLN A 53 -8.567 -1.023 18.532 1.00 0.00 N ATOM 803 CA GLN A 53 -8.614 -1.707 17.235 1.00 0.00 C ATOM 804 C GLN A 53 -9.908 -2.520 17.044 1.00 0.00 C ATOM 805 O GLN A 53 -10.631 -2.797 18.008 1.00 0.00 O ATOM 806 CB GLN A 53 -7.375 -2.624 17.113 1.00 0.00 C ATOM 807 CG GLN A 53 -6.226 -2.008 16.299 1.00 0.00 C ATOM 808 CD GLN A 53 -6.533 -1.932 14.808 1.00 0.00 C ATOM 809 OE1 GLN A 53 -7.662 -2.098 14.377 1.00 0.00 O ATOM 810 NE2 GLN A 53 -5.549 -1.709 13.964 1.00 0.00 N ATOM 0 H GLN A 53 -8.932 -1.592 19.296 1.00 0.00 H new ATOM 0 HA GLN A 53 -8.606 -0.952 16.449 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -7.012 -2.864 18.112 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -7.674 -3.564 16.648 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -6.018 -1.006 16.674 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -5.323 -2.599 16.450 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -4.601 -1.569 14.312 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -5.734 -1.676 12.962 1.00 0.00 H new ATOM 819 N THR A 54 -10.177 -2.920 15.791 1.00 0.00 N ATOM 820 CA THR A 54 -11.286 -3.803 15.375 1.00 0.00 C ATOM 821 C THR A 54 -10.860 -4.672 14.188 1.00 0.00 C ATOM 822 O THR A 54 -9.995 -4.250 13.416 1.00 0.00 O ATOM 823 CB THR A 54 -12.551 -3.026 14.969 1.00 0.00 C ATOM 824 OG1 THR A 54 -12.241 -2.051 14.009 1.00 0.00 O ATOM 825 CG2 THR A 54 -13.257 -2.385 16.155 1.00 0.00 C ATOM 0 H THR A 54 -9.603 -2.625 15.002 1.00 0.00 H new ATOM 0 HA THR A 54 -11.523 -4.417 16.244 1.00 0.00 H new ATOM 0 HB THR A 54 -13.240 -3.754 14.542 1.00 0.00 H new ATOM 0 HG1 THR A 54 -13.056 -1.567 13.760 1.00 0.00 H new ATOM 0 HG21 THR A 54 -14.141 -1.851 15.807 1.00 0.00 H new ATOM 0 HG22 THR A 54 -13.555 -3.159 16.863 1.00 0.00 H new ATOM 0 HG23 THR A 54 -12.581 -1.685 16.646 1.00 0.00 H new ATOM 833 N PRO A 55 -11.495 -5.842 13.969 1.00 0.00 N ATOM 834 CA PRO A 55 -11.185 -6.694 12.823 1.00 0.00 C ATOM 835 C PRO A 55 -11.465 -5.990 11.484 1.00 0.00 C ATOM 836 O PRO A 55 -10.759 -6.230 10.508 1.00 0.00 O ATOM 837 CB PRO A 55 -12.013 -7.970 13.017 1.00 0.00 C ATOM 838 CG PRO A 55 -13.168 -7.539 13.922 1.00 0.00 C ATOM 839 CD PRO A 55 -12.563 -6.425 14.775 1.00 0.00 C ATOM 0 HA PRO A 55 -10.122 -6.931 12.777 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -12.377 -8.356 12.065 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -11.422 -8.762 13.477 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -14.019 -7.182 13.342 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -13.525 -8.365 14.537 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -13.313 -5.677 15.030 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -12.174 -6.819 15.714 1.00 0.00 H new ATOM 847 N LYS A 56 -12.422 -5.055 11.430 1.00 0.00 N ATOM 848 CA LYS A 56 -12.651 -4.237 10.234 1.00 0.00 C ATOM 849 C LYS A 56 -11.516 -3.227 9.987 1.00 0.00 C ATOM 850 O LYS A 56 -11.048 -3.125 8.852 1.00 0.00 O ATOM 851 CB LYS A 56 -14.030 -3.560 10.320 1.00 0.00 C ATOM 852 CG LYS A 56 -15.208 -4.541 10.476 1.00 0.00 C ATOM 853 CD LYS A 56 -15.293 -5.634 9.401 1.00 0.00 C ATOM 854 CE LYS A 56 -15.548 -5.053 8.003 1.00 0.00 C ATOM 855 NZ LYS A 56 -15.583 -6.110 6.969 1.00 0.00 N ATOM 0 H LYS A 56 -13.052 -4.846 12.204 1.00 0.00 H new ATOM 0 HA LYS A 56 -12.648 -4.895 9.365 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -14.032 -2.871 11.165 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -14.186 -2.963 9.421 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -15.135 -5.019 11.453 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -16.138 -3.972 10.468 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -14.365 -6.205 9.392 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -16.093 -6.330 9.655 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -16.494 -4.511 8.001 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -14.767 -4.332 7.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -15.638 -5.673 6.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -14.720 -6.687 7.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -16.416 -6.715 7.119 1.00 0.00 H new ATOM 869 N THR A 57 -10.999 -2.550 11.022 1.00 0.00 N ATOM 870 CA THR A 57 -9.832 -1.646 10.914 1.00 0.00 C ATOM 871 C THR A 57 -8.561 -2.395 10.497 1.00 0.00 C ATOM 872 O THR A 57 -7.734 -1.813 9.796 1.00 0.00 O ATOM 873 CB THR A 57 -9.671 -0.874 12.230 1.00 0.00 C ATOM 874 OG1 THR A 57 -10.804 -0.037 12.340 1.00 0.00 O ATOM 875 CG2 THR A 57 -8.433 0.025 12.310 1.00 0.00 C ATOM 0 H THR A 57 -11.378 -2.611 11.967 1.00 0.00 H new ATOM 0 HA THR A 57 -10.008 -0.924 10.116 1.00 0.00 H new ATOM 0 HB THR A 57 -9.563 -1.612 13.025 1.00 0.00 H new ATOM 0 HG1 THR A 57 -11.490 -0.484 12.879 1.00 0.00 H new ATOM 0 HG21 THR A 57 -8.410 0.527 13.277 1.00 0.00 H new ATOM 0 HG22 THR A 57 -7.535 -0.582 12.194 1.00 0.00 H new ATOM 0 HG23 THR A 57 -8.473 0.770 11.516 1.00 0.00 H new ATOM 883 N LEU A 58 -8.444 -3.691 10.816 1.00 0.00 N ATOM 884 CA LEU A 58 -7.408 -4.593 10.289 1.00 0.00 C ATOM 885 C LEU A 58 -7.554 -4.813 8.772 1.00 0.00 C ATOM 886 O LEU A 58 -6.580 -4.651 8.046 1.00 0.00 O ATOM 887 CB LEU A 58 -7.460 -5.927 11.067 1.00 0.00 C ATOM 888 CG LEU A 58 -6.473 -6.076 12.241 1.00 0.00 C ATOM 889 CD1 LEU A 58 -6.450 -4.886 13.204 1.00 0.00 C ATOM 890 CD2 LEU A 58 -6.826 -7.340 13.034 1.00 0.00 C ATOM 0 H LEU A 58 -9.082 -4.154 11.463 1.00 0.00 H new ATOM 0 HA LEU A 58 -6.431 -4.132 10.434 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -8.471 -6.058 11.452 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -7.279 -6.740 10.364 1.00 0.00 H new ATOM 0 HG LEU A 58 -5.480 -6.134 11.795 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -5.729 -5.075 13.999 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -6.164 -3.985 12.662 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -7.441 -4.750 13.638 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -6.132 -7.453 13.867 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -7.843 -7.257 13.418 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -6.755 -8.210 12.382 1.00 0.00 H new ATOM 902 N GLN A 59 -8.750 -5.144 8.273 1.00 0.00 N ATOM 903 CA GLN A 59 -9.020 -5.249 6.829 1.00 0.00 C ATOM 904 C GLN A 59 -8.739 -3.925 6.085 1.00 0.00 C ATOM 905 O GLN A 59 -8.113 -3.948 5.025 1.00 0.00 O ATOM 906 CB GLN A 59 -10.473 -5.708 6.598 1.00 0.00 C ATOM 907 CG GLN A 59 -10.737 -7.123 7.135 1.00 0.00 C ATOM 908 CD GLN A 59 -12.146 -7.622 6.809 1.00 0.00 C ATOM 909 OE1 GLN A 59 -13.104 -7.394 7.535 1.00 0.00 O ATOM 910 NE2 GLN A 59 -12.341 -8.325 5.719 1.00 0.00 N ATOM 0 H GLN A 59 -9.561 -5.347 8.857 1.00 0.00 H new ATOM 0 HA GLN A 59 -8.338 -5.993 6.417 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -11.153 -5.007 7.082 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -10.694 -5.681 5.531 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -10.005 -7.811 6.712 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -10.594 -7.130 8.216 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -11.559 -8.529 5.097 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -13.275 -8.668 5.493 1.00 0.00 H new ATOM 919 N GLU A 60 -9.139 -2.775 6.643 1.00 0.00 N ATOM 920 CA GLU A 60 -8.912 -1.437 6.056 1.00 0.00 C ATOM 921 C GLU A 60 -7.444 -0.994 6.078 1.00 0.00 C ATOM 922 O GLU A 60 -7.043 -0.125 5.302 1.00 0.00 O ATOM 923 CB GLU A 60 -9.765 -0.384 6.786 1.00 0.00 C ATOM 924 CG GLU A 60 -11.248 -0.645 6.528 1.00 0.00 C ATOM 925 CD GLU A 60 -12.173 0.448 7.070 1.00 0.00 C ATOM 926 OE1 GLU A 60 -11.939 0.972 8.186 1.00 0.00 O ATOM 927 OE2 GLU A 60 -13.158 0.806 6.380 1.00 0.00 O ATOM 0 H GLU A 60 -9.639 -2.742 7.531 1.00 0.00 H new ATOM 0 HA GLU A 60 -9.207 -1.517 5.010 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -9.562 -0.418 7.856 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -9.498 0.615 6.442 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -11.408 -0.744 5.454 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -11.523 -1.598 6.980 1.00 0.00 H new ATOM 934 N ALA A 61 -6.636 -1.596 6.949 1.00 0.00 N ATOM 935 CA ALA A 61 -5.174 -1.427 6.942 1.00 0.00 C ATOM 936 C ALA A 61 -4.500 -2.108 5.739 1.00 0.00 C ATOM 937 O ALA A 61 -3.455 -1.652 5.280 1.00 0.00 O ATOM 938 CB ALA A 61 -4.577 -1.976 8.241 1.00 0.00 C ATOM 0 H ALA A 61 -6.973 -2.218 7.684 1.00 0.00 H new ATOM 0 HA ALA A 61 -4.981 -0.357 6.859 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -3.495 -1.847 8.227 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -4.996 -1.437 9.090 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -4.815 -3.036 8.331 1.00 0.00 H new ATOM 944 N ILE A 62 -5.070 -3.214 5.242 1.00 0.00 N ATOM 945 CA ILE A 62 -4.656 -3.833 3.973 1.00 0.00 C ATOM 946 C ILE A 62 -5.112 -2.994 2.776 1.00 0.00 C ATOM 947 O ILE A 62 -4.389 -2.881 1.792 1.00 0.00 O ATOM 948 CB ILE A 62 -5.188 -5.285 3.838 1.00 0.00 C ATOM 949 CG1 ILE A 62 -5.088 -6.145 5.119 1.00 0.00 C ATOM 950 CG2 ILE A 62 -4.476 -5.999 2.673 1.00 0.00 C ATOM 951 CD1 ILE A 62 -3.708 -6.169 5.790 1.00 0.00 C ATOM 0 H ILE A 62 -5.832 -3.706 5.708 1.00 0.00 H new ATOM 0 HA ILE A 62 -3.567 -3.872 3.980 1.00 0.00 H new ATOM 0 HB ILE A 62 -6.255 -5.182 3.642 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -5.818 -5.778 5.841 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -5.371 -7.168 4.872 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -4.855 -7.017 2.585 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -4.666 -5.459 1.745 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -3.403 -6.026 2.864 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -3.746 -6.800 6.678 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.971 -6.568 5.093 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.425 -5.156 6.076 1.00 0.00 H new ATOM 963 N ASP A 63 -6.336 -2.472 2.834 1.00 0.00 N ATOM 964 CA ASP A 63 -7.047 -1.941 1.670 1.00 0.00 C ATOM 965 C ASP A 63 -6.564 -0.576 1.135 1.00 0.00 C ATOM 966 O ASP A 63 -6.963 -0.186 0.039 1.00 0.00 O ATOM 967 CB ASP A 63 -8.556 -1.947 1.957 1.00 0.00 C ATOM 968 CG ASP A 63 -9.370 -2.110 0.672 1.00 0.00 C ATOM 969 OD1 ASP A 63 -9.105 -3.064 -0.094 1.00 0.00 O ATOM 970 OD2 ASP A 63 -10.323 -1.328 0.444 1.00 0.00 O ATOM 0 H ASP A 63 -6.869 -2.405 3.701 1.00 0.00 H new ATOM 0 HA ASP A 63 -6.809 -2.613 0.845 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -8.793 -2.759 2.645 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -8.837 -1.017 2.452 1.00 0.00 H new ATOM 975 N ASP A 64 -5.717 0.154 1.869 1.00 0.00 N ATOM 976 CA ASP A 64 -5.220 1.490 1.477 1.00 0.00 C ATOM 977 C ASP A 64 -4.408 1.455 0.166 1.00 0.00 C ATOM 978 O ASP A 64 -4.515 2.352 -0.671 1.00 0.00 O ATOM 979 CB ASP A 64 -4.362 2.060 2.622 1.00 0.00 C ATOM 980 CG ASP A 64 -4.120 3.576 2.520 1.00 0.00 C ATOM 981 OD1 ASP A 64 -5.081 4.309 2.186 1.00 0.00 O ATOM 982 OD2 ASP A 64 -3.033 4.062 2.915 1.00 0.00 O ATOM 0 H ASP A 64 -5.349 -0.165 2.765 1.00 0.00 H new ATOM 0 HA ASP A 64 -6.082 2.132 1.294 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -4.850 1.842 3.572 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -3.400 1.548 2.633 1.00 0.00 H new ATOM 987 N MET A 65 -3.655 0.368 -0.024 1.00 0.00 N ATOM 988 CA MET A 65 -2.858 0.032 -1.210 1.00 0.00 C ATOM 989 C MET A 65 -3.433 -1.196 -1.950 1.00 0.00 C ATOM 990 O MET A 65 -2.698 -1.985 -2.541 1.00 0.00 O ATOM 991 CB MET A 65 -1.396 -0.174 -0.770 1.00 0.00 C ATOM 992 CG MET A 65 -1.186 -1.340 0.204 1.00 0.00 C ATOM 993 SD MET A 65 -1.445 -0.922 1.945 1.00 0.00 S ATOM 994 CE MET A 65 -1.312 -2.592 2.610 1.00 0.00 C ATOM 0 H MET A 65 -3.580 -0.351 0.696 1.00 0.00 H new ATOM 0 HA MET A 65 -2.898 0.850 -1.929 1.00 0.00 H new ATOM 0 HB2 MET A 65 -0.783 -0.341 -1.656 1.00 0.00 H new ATOM 0 HB3 MET A 65 -1.037 0.743 -0.303 1.00 0.00 H new ATOM 0 HG2 MET A 65 -1.864 -2.149 -0.067 1.00 0.00 H new ATOM 0 HG3 MET A 65 -0.172 -1.720 0.082 1.00 0.00 H new ATOM 0 HE1 MET A 65 -1.684 -2.606 3.635 1.00 0.00 H new ATOM 0 HE2 MET A 65 -1.903 -3.275 2.000 1.00 0.00 H new ATOM 0 HE3 MET A 65 -0.268 -2.906 2.598 1.00 0.00 H new ATOM 1004 N GLY A 66 -4.751 -1.393 -1.846 1.00 0.00 N ATOM 1005 CA GLY A 66 -5.343 -2.674 -1.457 1.00 0.00 C ATOM 1006 C GLY A 66 -4.968 -3.919 -2.254 1.00 0.00 C ATOM 1007 O GLY A 66 -5.300 -4.059 -3.436 1.00 0.00 O ATOM 0 H GLY A 66 -5.440 -0.664 -2.031 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -5.083 -2.857 -0.414 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -6.427 -2.566 -1.501 1.00 0.00 H new ATOM 1011 N PHE A 67 -4.374 -4.869 -1.523 1.00 0.00 N ATOM 1012 CA PHE A 67 -4.308 -6.297 -1.853 1.00 0.00 C ATOM 1013 C PHE A 67 -5.673 -6.983 -1.623 1.00 0.00 C ATOM 1014 O PHE A 67 -6.644 -6.332 -1.231 1.00 0.00 O ATOM 1015 CB PHE A 67 -3.181 -6.956 -1.031 1.00 0.00 C ATOM 1016 CG PHE A 67 -1.806 -6.329 -1.195 1.00 0.00 C ATOM 1017 CD1 PHE A 67 -1.187 -6.309 -2.461 1.00 0.00 C ATOM 1018 CD2 PHE A 67 -1.134 -5.775 -0.086 1.00 0.00 C ATOM 1019 CE1 PHE A 67 0.089 -5.739 -2.616 1.00 0.00 C ATOM 1020 CE2 PHE A 67 0.149 -5.215 -0.241 1.00 0.00 C ATOM 1021 CZ PHE A 67 0.760 -5.196 -1.508 1.00 0.00 C ATOM 0 H PHE A 67 -3.904 -4.653 -0.644 1.00 0.00 H new ATOM 0 HA PHE A 67 -4.077 -6.416 -2.912 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -3.455 -6.921 0.023 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -3.118 -8.008 -1.309 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -1.694 -6.733 -3.315 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -1.605 -5.780 0.886 1.00 0.00 H new ATOM 0 HE1 PHE A 67 0.555 -5.719 -3.590 1.00 0.00 H new ATOM 0 HE2 PHE A 67 0.664 -4.800 0.613 1.00 0.00 H new ATOM 0 HZ PHE A 67 1.743 -4.765 -1.628 1.00 0.00 H new ATOM 1031 N ASP A 68 -5.757 -8.299 -1.844 1.00 0.00 N ATOM 1032 CA ASP A 68 -6.969 -9.090 -1.578 1.00 0.00 C ATOM 1033 C ASP A 68 -6.793 -9.803 -0.229 1.00 0.00 C ATOM 1034 O ASP A 68 -5.707 -10.320 0.043 1.00 0.00 O ATOM 1035 CB ASP A 68 -7.227 -10.106 -2.706 1.00 0.00 C ATOM 1036 CG ASP A 68 -7.305 -9.491 -4.109 1.00 0.00 C ATOM 1037 OD1 ASP A 68 -8.330 -8.860 -4.466 1.00 0.00 O ATOM 1038 OD2 ASP A 68 -6.335 -9.690 -4.882 1.00 0.00 O ATOM 0 H ASP A 68 -4.983 -8.851 -2.214 1.00 0.00 H new ATOM 0 HA ASP A 68 -7.836 -8.430 -1.539 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -6.433 -10.853 -2.694 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -8.161 -10.630 -2.500 1.00 0.00 H new ATOM 1043 N ALA A 69 -7.835 -9.828 0.613 1.00 0.00 N ATOM 1044 CA ALA A 69 -7.761 -10.297 2.003 1.00 0.00 C ATOM 1045 C ALA A 69 -9.096 -10.840 2.557 1.00 0.00 C ATOM 1046 O ALA A 69 -10.162 -10.331 2.200 1.00 0.00 O ATOM 1047 CB ALA A 69 -7.204 -9.157 2.872 1.00 0.00 C ATOM 0 H ALA A 69 -8.768 -9.518 0.343 1.00 0.00 H new ATOM 0 HA ALA A 69 -7.091 -11.156 2.030 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -7.142 -9.487 3.909 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -6.210 -8.882 2.518 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -7.865 -8.293 2.805 1.00 0.00 H new ATOM 1053 N VAL A 70 -9.038 -11.854 3.434 1.00 0.00 N ATOM 1054 CA VAL A 70 -10.195 -12.557 4.042 1.00 0.00 C ATOM 1055 C VAL A 70 -9.835 -13.042 5.457 1.00 0.00 C ATOM 1056 O VAL A 70 -8.725 -13.528 5.658 1.00 0.00 O ATOM 1057 CB VAL A 70 -10.601 -13.790 3.186 1.00 0.00 C ATOM 1058 CG1 VAL A 70 -11.884 -14.444 3.713 1.00 0.00 C ATOM 1059 CG2 VAL A 70 -10.817 -13.443 1.705 1.00 0.00 C ATOM 0 H VAL A 70 -8.146 -12.229 3.758 1.00 0.00 H new ATOM 0 HA VAL A 70 -11.028 -11.855 4.087 1.00 0.00 H new ATOM 0 HB VAL A 70 -9.763 -14.483 3.268 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -12.137 -15.302 3.090 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -11.729 -14.774 4.740 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -12.699 -13.721 3.684 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -11.098 -14.343 1.158 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -11.611 -12.702 1.617 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -9.895 -13.038 1.288 1.00 0.00 H new ATOM 1069 N ILE A 71 -10.725 -12.928 6.453 1.00 0.00 N ATOM 1070 CA ILE A 71 -10.414 -13.297 7.853 1.00 0.00 C ATOM 1071 C ILE A 71 -10.567 -14.803 8.093 1.00 0.00 C ATOM 1072 O ILE A 71 -11.606 -15.392 7.789 1.00 0.00 O ATOM 1073 CB ILE A 71 -11.239 -12.465 8.868 1.00 0.00 C ATOM 1074 CG1 ILE A 71 -11.116 -10.946 8.588 1.00 0.00 C ATOM 1075 CG2 ILE A 71 -10.793 -12.804 10.306 1.00 0.00 C ATOM 1076 CD1 ILE A 71 -11.859 -10.053 9.588 1.00 0.00 C ATOM 0 H ILE A 71 -11.675 -12.581 6.319 1.00 0.00 H new ATOM 0 HA ILE A 71 -9.365 -13.052 8.020 1.00 0.00 H new ATOM 0 HB ILE A 71 -12.291 -12.727 8.755 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -10.061 -10.673 8.591 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -11.495 -10.742 7.587 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -11.376 -12.217 11.016 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -10.953 -13.865 10.496 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -9.735 -12.570 10.424 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -11.719 -9.007 9.316 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -12.922 -10.293 9.570 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -11.465 -10.223 10.590 1.00 0.00 H new ATOM 1088 N HIS A 72 -9.544 -15.440 8.667 1.00 0.00 N ATOM 1089 CA HIS A 72 -9.478 -16.893 8.798 1.00 0.00 C ATOM 1090 C HIS A 72 -8.417 -17.324 9.830 1.00 0.00 C ATOM 1091 O HIS A 72 -7.220 -17.253 9.539 1.00 0.00 O ATOM 1092 CB HIS A 72 -9.171 -17.479 7.407 1.00 0.00 C ATOM 1093 CG HIS A 72 -9.509 -18.934 7.323 1.00 0.00 C ATOM 1094 ND1 HIS A 72 -8.639 -19.998 7.286 1.00 0.00 N ATOM 1095 CD2 HIS A 72 -10.777 -19.433 7.329 1.00 0.00 C ATOM 1096 CE1 HIS A 72 -9.374 -21.123 7.259 1.00 0.00 C ATOM 1097 NE2 HIS A 72 -10.687 -20.828 7.305 1.00 0.00 N ATOM 0 H HIS A 72 -8.734 -14.957 9.056 1.00 0.00 H new ATOM 0 HA HIS A 72 -10.432 -17.272 9.164 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -9.734 -16.932 6.651 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -8.114 -17.339 7.180 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -11.689 -18.854 7.349 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -8.969 -22.123 7.208 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -11.462 -21.491 7.319 1.00 0.00 H new ATOM 1105 N ASN A 73 -8.834 -17.775 11.022 1.00 0.00 N ATOM 1106 CA ASN A 73 -7.929 -18.009 12.161 1.00 0.00 C ATOM 1107 C ASN A 73 -8.243 -19.252 13.002 1.00 0.00 C ATOM 1108 O ASN A 73 -9.237 -19.226 13.765 1.00 0.00 O ATOM 1109 CB ASN A 73 -7.915 -16.729 13.018 1.00 0.00 C ATOM 1110 CG ASN A 73 -6.910 -16.826 14.149 1.00 0.00 C ATOM 1111 OD1 ASN A 73 -5.715 -16.948 13.922 1.00 0.00 O ATOM 1112 ND2 ASN A 73 -7.350 -16.831 15.378 1.00 0.00 N ATOM 1113 OXT ASN A 73 -7.438 -20.211 12.931 1.00 0.00 O ATOM 0 H ASN A 73 -9.810 -17.989 11.226 1.00 0.00 H new ATOM 0 HA ASN A 73 -6.941 -18.227 11.756 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -7.674 -15.872 12.389 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -8.910 -16.554 13.428 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -6.696 -16.937 16.153 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -8.348 -16.729 15.563 1.00 0.00 H new TER 1120 ASN A 73 ATOM 1121 N MET B 74 -2.897 17.821 -19.188 1.00 0.00 N ATOM 1122 CA MET B 74 -2.320 19.158 -19.442 1.00 0.00 C ATOM 1123 C MET B 74 -0.789 19.039 -19.500 1.00 0.00 C ATOM 1124 O MET B 74 -0.348 18.618 -20.569 1.00 0.00 O ATOM 1125 CB MET B 74 -2.909 20.260 -18.542 1.00 0.00 C ATOM 1126 CG MET B 74 -4.343 20.647 -18.916 1.00 0.00 C ATOM 1127 SD MET B 74 -5.596 19.386 -18.569 1.00 0.00 S ATOM 1128 CE MET B 74 -7.079 20.171 -19.251 1.00 0.00 C ATOM 0 HA MET B 74 -2.625 19.522 -20.423 1.00 0.00 H new ATOM 0 HB2 MET B 74 -2.890 19.922 -17.506 1.00 0.00 H new ATOM 0 HB3 MET B 74 -2.275 21.144 -18.600 1.00 0.00 H new ATOM 0 HG2 MET B 74 -4.608 21.558 -18.379 1.00 0.00 H new ATOM 0 HG3 MET B 74 -4.373 20.884 -19.980 1.00 0.00 H new ATOM 0 HE1 MET B 74 -7.936 19.512 -19.111 1.00 0.00 H new ATOM 0 HE2 MET B 74 -7.260 21.115 -18.738 1.00 0.00 H new ATOM 0 HE3 MET B 74 -6.935 20.358 -20.315 1.00 0.00 H new ATOM 1140 N PRO B 75 0.047 19.327 -18.474 1.00 0.00 N ATOM 1141 CA PRO B 75 1.477 19.038 -18.560 1.00 0.00 C ATOM 1142 C PRO B 75 1.761 17.550 -18.301 1.00 0.00 C ATOM 1143 O PRO B 75 0.876 16.789 -17.902 1.00 0.00 O ATOM 1144 CB PRO B 75 2.127 19.925 -17.495 1.00 0.00 C ATOM 1145 CG PRO B 75 1.081 19.909 -16.385 1.00 0.00 C ATOM 1146 CD PRO B 75 -0.234 19.910 -17.164 1.00 0.00 C ATOM 0 HA PRO B 75 1.874 19.244 -19.554 1.00 0.00 H new ATOM 0 HB2 PRO B 75 3.084 19.525 -17.159 1.00 0.00 H new ATOM 0 HB3 PRO B 75 2.315 20.933 -17.864 1.00 0.00 H new ATOM 0 HG2 PRO B 75 1.176 19.027 -15.752 1.00 0.00 H new ATOM 0 HG3 PRO B 75 1.167 20.779 -15.735 1.00 0.00 H new ATOM 0 HD2 PRO B 75 -0.994 19.331 -16.639 1.00 0.00 H new ATOM 0 HD3 PRO B 75 -0.620 20.924 -17.268 1.00 0.00 H new ATOM 1154 N LYS B 76 3.024 17.159 -18.487 1.00 0.00 N ATOM 1155 CA LYS B 76 3.586 15.907 -17.966 1.00 0.00 C ATOM 1156 C LYS B 76 4.573 16.136 -16.808 1.00 0.00 C ATOM 1157 O LYS B 76 5.229 17.174 -16.709 1.00 0.00 O ATOM 1158 CB LYS B 76 4.245 15.098 -19.100 1.00 0.00 C ATOM 1159 CG LYS B 76 3.191 14.618 -20.105 1.00 0.00 C ATOM 1160 CD LYS B 76 3.707 13.597 -21.124 1.00 0.00 C ATOM 1161 CE LYS B 76 4.117 12.272 -20.465 1.00 0.00 C ATOM 1162 NZ LYS B 76 4.228 11.183 -21.462 1.00 0.00 N ATOM 0 H LYS B 76 3.699 17.713 -19.014 1.00 0.00 H new ATOM 0 HA LYS B 76 2.756 15.331 -17.557 1.00 0.00 H new ATOM 0 HB2 LYS B 76 4.987 15.713 -19.609 1.00 0.00 H new ATOM 0 HB3 LYS B 76 4.774 14.241 -18.683 1.00 0.00 H new ATOM 0 HG2 LYS B 76 2.358 14.177 -19.557 1.00 0.00 H new ATOM 0 HG3 LYS B 76 2.798 15.482 -20.641 1.00 0.00 H new ATOM 0 HD2 LYS B 76 2.933 13.406 -21.868 1.00 0.00 H new ATOM 0 HD3 LYS B 76 4.562 14.016 -21.654 1.00 0.00 H new ATOM 0 HE2 LYS B 76 5.072 12.398 -19.954 1.00 0.00 H new ATOM 0 HE3 LYS B 76 3.383 11.999 -19.706 1.00 0.00 H new ATOM 0 HZ1 LYS B 76 4.506 10.302 -20.984 1.00 0.00 H new ATOM 0 HZ2 LYS B 76 3.310 11.047 -21.931 1.00 0.00 H new ATOM 0 HZ3 LYS B 76 4.946 11.434 -22.172 1.00 0.00 H new ATOM 1176 N HIS B 77 4.720 15.138 -15.942 1.00 0.00 N ATOM 1177 CA HIS B 77 5.574 15.178 -14.747 1.00 0.00 C ATOM 1178 C HIS B 77 6.092 13.773 -14.382 1.00 0.00 C ATOM 1179 O HIS B 77 5.463 12.764 -14.717 1.00 0.00 O ATOM 1180 CB HIS B 77 4.868 15.873 -13.551 1.00 0.00 C ATOM 1181 CG HIS B 77 3.351 15.900 -13.539 1.00 0.00 C ATOM 1182 ND1 HIS B 77 2.547 16.933 -13.102 1.00 0.00 N ATOM 1183 CD2 HIS B 77 2.510 14.910 -13.970 1.00 0.00 C ATOM 1184 CE1 HIS B 77 1.267 16.578 -13.302 1.00 0.00 C ATOM 1185 NE2 HIS B 77 1.192 15.346 -13.833 1.00 0.00 N ATOM 0 H HIS B 77 4.235 14.248 -16.051 1.00 0.00 H new ATOM 0 HA HIS B 77 6.444 15.789 -14.988 1.00 0.00 H new ATOM 0 HB2 HIS B 77 5.201 15.383 -12.636 1.00 0.00 H new ATOM 0 HB3 HIS B 77 5.221 16.903 -13.507 1.00 0.00 H new ATOM 0 HD1 HIS B 77 2.869 17.813 -12.698 1.00 0.00 H new ATOM 0 HD2 HIS B 77 2.817 13.948 -14.354 1.00 0.00 H new ATOM 0 HE1 HIS B 77 0.414 17.198 -13.068 1.00 0.00 H new ATOM 1193 N GLU B 78 7.251 13.709 -13.720 1.00 0.00 N ATOM 1194 CA GLU B 78 7.991 12.472 -13.441 1.00 0.00 C ATOM 1195 C GLU B 78 8.116 12.232 -11.924 1.00 0.00 C ATOM 1196 O GLU B 78 8.202 13.177 -11.142 1.00 0.00 O ATOM 1197 CB GLU B 78 9.361 12.568 -14.140 1.00 0.00 C ATOM 1198 CG GLU B 78 10.120 11.239 -14.252 1.00 0.00 C ATOM 1199 CD GLU B 78 11.403 11.410 -15.071 1.00 0.00 C ATOM 1200 OE1 GLU B 78 11.322 11.611 -16.306 1.00 0.00 O ATOM 1201 OE2 GLU B 78 12.513 11.337 -14.495 1.00 0.00 O ATOM 0 H GLU B 78 7.715 14.540 -13.352 1.00 0.00 H new ATOM 0 HA GLU B 78 7.454 11.609 -13.834 1.00 0.00 H new ATOM 0 HB2 GLU B 78 9.215 12.972 -15.142 1.00 0.00 H new ATOM 0 HB3 GLU B 78 9.982 13.280 -13.596 1.00 0.00 H new ATOM 0 HG2 GLU B 78 10.366 10.871 -13.256 1.00 0.00 H new ATOM 0 HG3 GLU B 78 9.482 10.489 -14.720 1.00 0.00 H new ATOM 1208 N PHE B 79 8.112 10.961 -11.511 1.00 0.00 N ATOM 1209 CA PHE B 79 8.056 10.498 -10.118 1.00 0.00 C ATOM 1210 C PHE B 79 8.850 9.188 -9.941 1.00 0.00 C ATOM 1211 O PHE B 79 9.006 8.425 -10.896 1.00 0.00 O ATOM 1212 CB PHE B 79 6.587 10.262 -9.709 1.00 0.00 C ATOM 1213 CG PHE B 79 5.655 11.460 -9.800 1.00 0.00 C ATOM 1214 CD1 PHE B 79 5.013 11.768 -11.017 1.00 0.00 C ATOM 1215 CD2 PHE B 79 5.396 12.245 -8.660 1.00 0.00 C ATOM 1216 CE1 PHE B 79 4.140 12.866 -11.099 1.00 0.00 C ATOM 1217 CE2 PHE B 79 4.506 13.333 -8.739 1.00 0.00 C ATOM 1218 CZ PHE B 79 3.884 13.649 -9.961 1.00 0.00 C ATOM 0 H PHE B 79 8.150 10.186 -12.173 1.00 0.00 H new ATOM 0 HA PHE B 79 8.501 11.265 -9.484 1.00 0.00 H new ATOM 0 HB2 PHE B 79 6.182 9.467 -10.335 1.00 0.00 H new ATOM 0 HB3 PHE B 79 6.574 9.897 -8.682 1.00 0.00 H new ATOM 0 HD1 PHE B 79 5.193 11.158 -11.890 1.00 0.00 H new ATOM 0 HD2 PHE B 79 5.881 12.012 -7.724 1.00 0.00 H new ATOM 0 HE1 PHE B 79 3.665 13.108 -12.038 1.00 0.00 H new ATOM 0 HE2 PHE B 79 4.300 13.926 -7.860 1.00 0.00 H new ATOM 0 HZ PHE B 79 3.211 14.492 -10.024 1.00 0.00 H new ATOM 1228 N SER B 80 9.303 8.876 -8.724 1.00 0.00 N ATOM 1229 CA SER B 80 10.097 7.674 -8.392 1.00 0.00 C ATOM 1230 C SER B 80 9.718 7.078 -7.024 1.00 0.00 C ATOM 1231 O SER B 80 9.364 7.828 -6.110 1.00 0.00 O ATOM 1232 CB SER B 80 11.589 8.021 -8.452 1.00 0.00 C ATOM 1233 OG SER B 80 12.407 6.882 -8.261 1.00 0.00 O ATOM 0 H SER B 80 9.126 9.467 -7.912 1.00 0.00 H new ATOM 0 HA SER B 80 9.873 6.904 -9.130 1.00 0.00 H new ATOM 0 HB2 SER B 80 11.817 8.473 -9.417 1.00 0.00 H new ATOM 0 HB3 SER B 80 11.819 8.765 -7.689 1.00 0.00 H new ATOM 0 HG SER B 80 13.350 7.145 -8.308 1.00 0.00 H new ATOM 1239 N VAL B 81 9.781 5.744 -6.878 1.00 0.00 N ATOM 1240 CA VAL B 81 9.137 4.992 -5.773 1.00 0.00 C ATOM 1241 C VAL B 81 9.965 3.806 -5.252 1.00 0.00 C ATOM 1242 O VAL B 81 10.628 3.101 -6.009 1.00 0.00 O ATOM 1243 CB VAL B 81 7.735 4.459 -6.176 1.00 0.00 C ATOM 1244 CG1 VAL B 81 6.666 5.555 -6.084 1.00 0.00 C ATOM 1245 CG2 VAL B 81 7.694 3.839 -7.586 1.00 0.00 C ATOM 0 H VAL B 81 10.286 5.144 -7.530 1.00 0.00 H new ATOM 0 HA VAL B 81 9.053 5.725 -4.971 1.00 0.00 H new ATOM 0 HB VAL B 81 7.519 3.668 -5.457 1.00 0.00 H new ATOM 0 HG11 VAL B 81 5.698 5.145 -6.373 1.00 0.00 H new ATOM 0 HG12 VAL B 81 6.612 5.925 -5.060 1.00 0.00 H new ATOM 0 HG13 VAL B 81 6.927 6.375 -6.753 1.00 0.00 H new ATOM 0 HG21 VAL B 81 6.684 3.488 -7.800 1.00 0.00 H new ATOM 0 HG22 VAL B 81 7.981 4.590 -8.322 1.00 0.00 H new ATOM 0 HG23 VAL B 81 8.388 3.000 -7.635 1.00 0.00 H new ATOM 1255 N ASP B 82 9.848 3.546 -3.943 1.00 0.00 N ATOM 1256 CA ASP B 82 10.556 2.496 -3.184 1.00 0.00 C ATOM 1257 C ASP B 82 9.967 1.068 -3.343 1.00 0.00 C ATOM 1258 O ASP B 82 10.168 0.195 -2.500 1.00 0.00 O ATOM 1259 CB ASP B 82 10.615 2.954 -1.714 1.00 0.00 C ATOM 1260 CG ASP B 82 11.597 2.180 -0.836 1.00 0.00 C ATOM 1261 OD1 ASP B 82 12.807 2.164 -1.174 1.00 0.00 O ATOM 1262 OD2 ASP B 82 11.158 1.667 0.223 1.00 0.00 O ATOM 0 H ASP B 82 9.223 4.091 -3.349 1.00 0.00 H new ATOM 0 HA ASP B 82 11.559 2.387 -3.597 1.00 0.00 H new ATOM 0 HB2 ASP B 82 10.883 4.010 -1.689 1.00 0.00 H new ATOM 0 HB3 ASP B 82 9.618 2.867 -1.282 1.00 0.00 H new ATOM 1267 N MET B 83 9.219 0.811 -4.421 1.00 0.00 N ATOM 1268 CA MET B 83 8.748 -0.534 -4.797 1.00 0.00 C ATOM 1269 C MET B 83 9.896 -1.417 -5.328 1.00 0.00 C ATOM 1270 O MET B 83 10.800 -0.918 -6.005 1.00 0.00 O ATOM 1271 CB MET B 83 7.529 -0.452 -5.736 1.00 0.00 C ATOM 1272 CG MET B 83 7.771 0.227 -7.090 1.00 0.00 C ATOM 1273 SD MET B 83 8.421 -0.847 -8.394 1.00 0.00 S ATOM 1274 CE MET B 83 8.282 0.309 -9.779 1.00 0.00 C ATOM 0 H MET B 83 8.917 1.539 -5.069 1.00 0.00 H new ATOM 0 HA MET B 83 8.397 -1.040 -3.898 1.00 0.00 H new ATOM 0 HB2 MET B 83 7.166 -1.464 -5.918 1.00 0.00 H new ATOM 0 HB3 MET B 83 6.732 0.084 -5.220 1.00 0.00 H new ATOM 0 HG2 MET B 83 6.831 0.659 -7.434 1.00 0.00 H new ATOM 0 HG3 MET B 83 8.467 1.053 -6.943 1.00 0.00 H new ATOM 0 HE1 MET B 83 8.782 -0.108 -10.653 1.00 0.00 H new ATOM 0 HE2 MET B 83 7.230 0.477 -10.009 1.00 0.00 H new ATOM 0 HE3 MET B 83 8.750 1.256 -9.511 1.00 0.00 H new ATOM 1284 N THR B 84 9.908 -2.706 -4.955 1.00 0.00 N ATOM 1285 CA THR B 84 10.977 -3.681 -5.281 1.00 0.00 C ATOM 1286 C THR B 84 10.498 -4.903 -6.064 1.00 0.00 C ATOM 1287 O THR B 84 11.330 -5.697 -6.506 1.00 0.00 O ATOM 1288 CB THR B 84 11.663 -4.183 -4.002 1.00 0.00 C ATOM 1289 OG1 THR B 84 10.736 -4.854 -3.169 1.00 0.00 O ATOM 1290 CG2 THR B 84 12.310 -3.050 -3.203 1.00 0.00 C ATOM 0 H THR B 84 9.156 -3.117 -4.402 1.00 0.00 H new ATOM 0 HA THR B 84 11.669 -3.129 -5.917 1.00 0.00 H new ATOM 0 HB THR B 84 12.447 -4.869 -4.323 1.00 0.00 H new ATOM 0 HG1 THR B 84 10.089 -5.338 -3.723 1.00 0.00 H new ATOM 0 HG21 THR B 84 12.781 -3.458 -2.309 1.00 0.00 H new ATOM 0 HG22 THR B 84 13.063 -2.556 -3.817 1.00 0.00 H new ATOM 0 HG23 THR B 84 11.547 -2.327 -2.914 1.00 0.00 H new ATOM 1298 N CYS B 85 9.184 -5.087 -6.176 1.00 0.00 N ATOM 1299 CA CYS B 85 8.533 -6.353 -6.485 1.00 0.00 C ATOM 1300 C CYS B 85 7.044 -6.164 -6.898 1.00 0.00 C ATOM 1301 O CYS B 85 6.452 -5.094 -6.715 1.00 0.00 O ATOM 1302 CB CYS B 85 8.785 -7.303 -5.290 1.00 0.00 C ATOM 1303 SG CYS B 85 8.135 -6.630 -3.735 1.00 0.00 S ATOM 0 H CYS B 85 8.519 -4.325 -6.048 1.00 0.00 H new ATOM 0 HA CYS B 85 8.961 -6.818 -7.373 1.00 0.00 H new ATOM 0 HB2 CYS B 85 8.319 -8.268 -5.490 1.00 0.00 H new ATOM 0 HB3 CYS B 85 9.856 -7.481 -5.188 1.00 0.00 H new ATOM 1308 N GLY B 86 6.446 -7.202 -7.496 1.00 0.00 N ATOM 1309 CA GLY B 86 5.235 -7.109 -8.326 1.00 0.00 C ATOM 1310 C GLY B 86 3.956 -6.690 -7.598 1.00 0.00 C ATOM 1311 O GLY B 86 3.098 -6.057 -8.218 1.00 0.00 O ATOM 0 H GLY B 86 6.799 -8.155 -7.415 1.00 0.00 H new ATOM 0 HA2 GLY B 86 5.423 -6.397 -9.129 1.00 0.00 H new ATOM 0 HA3 GLY B 86 5.063 -8.079 -8.793 1.00 0.00 H new ATOM 1315 N GLY B 87 3.827 -6.993 -6.302 1.00 0.00 N ATOM 1316 CA GLY B 87 2.695 -6.572 -5.471 1.00 0.00 C ATOM 1317 C GLY B 87 2.754 -5.080 -5.160 1.00 0.00 C ATOM 1318 O GLY B 87 1.882 -4.319 -5.579 1.00 0.00 O ATOM 0 H GLY B 87 4.517 -7.546 -5.794 1.00 0.00 H new ATOM 0 HA2 GLY B 87 1.761 -6.801 -5.984 1.00 0.00 H new ATOM 0 HA3 GLY B 87 2.695 -7.139 -4.540 1.00 0.00 H new ATOM 1322 N CYS B 88 3.807 -4.650 -4.457 1.00 0.00 N ATOM 1323 CA CYS B 88 4.032 -3.247 -4.099 1.00 0.00 C ATOM 1324 C CYS B 88 4.204 -2.323 -5.323 1.00 0.00 C ATOM 1325 O CYS B 88 3.950 -1.124 -5.204 1.00 0.00 O ATOM 1326 CB CYS B 88 5.189 -3.161 -3.084 1.00 0.00 C ATOM 1327 SG CYS B 88 6.801 -3.485 -3.852 1.00 0.00 S ATOM 0 H CYS B 88 4.537 -5.276 -4.116 1.00 0.00 H new ATOM 0 HA CYS B 88 3.133 -2.862 -3.618 1.00 0.00 H new ATOM 0 HB2 CYS B 88 5.198 -2.171 -2.629 1.00 0.00 H new ATOM 0 HB3 CYS B 88 5.020 -3.879 -2.281 1.00 0.00 H new ATOM 0 HG CYS B 88 7.116 -4.736 -3.689 1.00 0.00 H new ATOM 1333 N ALA B 89 4.555 -2.873 -6.493 1.00 0.00 N ATOM 1334 CA ALA B 89 4.433 -2.217 -7.794 1.00 0.00 C ATOM 1335 C ALA B 89 2.963 -2.067 -8.233 1.00 0.00 C ATOM 1336 O ALA B 89 2.495 -0.938 -8.354 1.00 0.00 O ATOM 1337 CB ALA B 89 5.273 -2.986 -8.823 1.00 0.00 C ATOM 0 H ALA B 89 4.943 -3.814 -6.558 1.00 0.00 H new ATOM 0 HA ALA B 89 4.818 -1.200 -7.716 1.00 0.00 H new ATOM 0 HB1 ALA B 89 5.187 -2.503 -9.796 1.00 0.00 H new ATOM 0 HB2 ALA B 89 6.317 -2.990 -8.510 1.00 0.00 H new ATOM 0 HB3 ALA B 89 4.912 -4.012 -8.894 1.00 0.00 H new ATOM 1343 N GLU B 90 2.208 -3.159 -8.435 1.00 0.00 N ATOM 1344 CA GLU B 90 0.818 -3.095 -8.935 1.00 0.00 C ATOM 1345 C GLU B 90 -0.093 -2.218 -8.051 1.00 0.00 C ATOM 1346 O GLU B 90 -0.998 -1.550 -8.553 1.00 0.00 O ATOM 1347 CB GLU B 90 0.244 -4.518 -9.103 1.00 0.00 C ATOM 1348 CG GLU B 90 -1.060 -4.515 -9.921 1.00 0.00 C ATOM 1349 CD GLU B 90 -1.674 -5.900 -10.131 1.00 0.00 C ATOM 1350 OE1 GLU B 90 -0.946 -6.897 -10.364 1.00 0.00 O ATOM 1351 OE2 GLU B 90 -2.925 -5.992 -10.103 1.00 0.00 O ATOM 0 H GLU B 90 2.538 -4.108 -8.259 1.00 0.00 H new ATOM 0 HA GLU B 90 0.845 -2.612 -9.912 1.00 0.00 H new ATOM 0 HB2 GLU B 90 0.981 -5.151 -9.596 1.00 0.00 H new ATOM 0 HB3 GLU B 90 0.056 -4.953 -8.121 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -1.789 -3.880 -9.418 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -0.863 -4.066 -10.895 1.00 0.00 H new ATOM 1358 N ALA B 91 0.199 -2.120 -6.750 1.00 0.00 N ATOM 1359 CA ALA B 91 -0.430 -1.166 -5.838 1.00 0.00 C ATOM 1360 C ALA B 91 -0.412 0.292 -6.346 1.00 0.00 C ATOM 1361 O ALA B 91 -1.408 0.999 -6.166 1.00 0.00 O ATOM 1362 CB ALA B 91 0.272 -1.288 -4.481 1.00 0.00 C ATOM 0 H ALA B 91 0.893 -2.714 -6.295 1.00 0.00 H new ATOM 0 HA ALA B 91 -1.488 -1.415 -5.759 1.00 0.00 H new ATOM 0 HB1 ALA B 91 -0.175 -0.587 -3.776 1.00 0.00 H new ATOM 0 HB2 ALA B 91 0.160 -2.304 -4.103 1.00 0.00 H new ATOM 0 HB3 ALA B 91 1.331 -1.059 -4.598 1.00 0.00 H new ATOM 1368 N VAL B 92 0.663 0.746 -7.008 1.00 0.00 N ATOM 1369 CA VAL B 92 0.740 2.134 -7.513 1.00 0.00 C ATOM 1370 C VAL B 92 -0.259 2.359 -8.652 1.00 0.00 C ATOM 1371 O VAL B 92 -0.867 3.424 -8.721 1.00 0.00 O ATOM 1372 CB VAL B 92 2.163 2.619 -7.906 1.00 0.00 C ATOM 1373 CG1 VAL B 92 3.244 2.117 -6.935 1.00 0.00 C ATOM 1374 CG2 VAL B 92 2.591 2.303 -9.349 1.00 0.00 C ATOM 0 H VAL B 92 1.488 0.180 -7.207 1.00 0.00 H new ATOM 0 HA VAL B 92 0.465 2.757 -6.662 1.00 0.00 H new ATOM 0 HB VAL B 92 2.079 3.704 -7.837 1.00 0.00 H new ATOM 0 HG11 VAL B 92 4.219 2.484 -7.255 1.00 0.00 H new ATOM 0 HG12 VAL B 92 3.030 2.483 -5.931 1.00 0.00 H new ATOM 0 HG13 VAL B 92 3.250 1.027 -6.930 1.00 0.00 H new ATOM 0 HG21 VAL B 92 3.598 2.683 -9.521 1.00 0.00 H new ATOM 0 HG22 VAL B 92 2.579 1.224 -9.504 1.00 0.00 H new ATOM 0 HG23 VAL B 92 1.900 2.778 -10.046 1.00 0.00 H new ATOM 1384 N SER B 93 -0.503 1.341 -9.488 1.00 0.00 N ATOM 1385 CA SER B 93 -1.561 1.372 -10.502 1.00 0.00 C ATOM 1386 C SER B 93 -2.934 1.503 -9.829 1.00 0.00 C ATOM 1387 O SER B 93 -3.707 2.404 -10.150 1.00 0.00 O ATOM 1388 CB SER B 93 -1.529 0.104 -11.378 1.00 0.00 C ATOM 1389 OG SER B 93 -0.243 -0.181 -11.895 1.00 0.00 O ATOM 0 H SER B 93 0.030 0.471 -9.479 1.00 0.00 H new ATOM 0 HA SER B 93 -1.388 2.237 -11.143 1.00 0.00 H new ATOM 0 HB2 SER B 93 -1.874 -0.746 -10.789 1.00 0.00 H new ATOM 0 HB3 SER B 93 -2.228 0.223 -12.205 1.00 0.00 H new ATOM 0 HG SER B 93 -0.282 -0.995 -12.440 1.00 0.00 H new ATOM 1395 N ARG B 94 -3.207 0.654 -8.826 1.00 0.00 N ATOM 1396 CA ARG B 94 -4.475 0.650 -8.085 1.00 0.00 C ATOM 1397 C ARG B 94 -4.745 1.986 -7.384 1.00 0.00 C ATOM 1398 O ARG B 94 -5.869 2.480 -7.447 1.00 0.00 O ATOM 1399 CB ARG B 94 -4.501 -0.499 -7.061 1.00 0.00 C ATOM 1400 CG ARG B 94 -4.431 -1.878 -7.730 1.00 0.00 C ATOM 1401 CD ARG B 94 -4.363 -3.009 -6.698 1.00 0.00 C ATOM 1402 NE ARG B 94 -4.162 -4.295 -7.379 1.00 0.00 N ATOM 1403 CZ ARG B 94 -4.193 -5.502 -6.834 1.00 0.00 C ATOM 1404 NH1 ARG B 94 -4.420 -5.683 -5.555 1.00 0.00 N ATOM 1405 NH2 ARG B 94 -3.996 -6.561 -7.581 1.00 0.00 N ATOM 0 H ARG B 94 -2.547 -0.055 -8.505 1.00 0.00 H new ATOM 0 HA ARG B 94 -5.269 0.499 -8.817 1.00 0.00 H new ATOM 0 HB2 ARG B 94 -3.663 -0.389 -6.373 1.00 0.00 H new ATOM 0 HB3 ARG B 94 -5.412 -0.432 -6.466 1.00 0.00 H new ATOM 0 HG2 ARG B 94 -5.305 -2.018 -8.366 1.00 0.00 H new ATOM 0 HG3 ARG B 94 -3.555 -1.924 -8.378 1.00 0.00 H new ATOM 0 HD2 ARG B 94 -3.547 -2.826 -5.999 1.00 0.00 H new ATOM 0 HD3 ARG B 94 -5.283 -3.036 -6.114 1.00 0.00 H new ATOM 0 HE ARG B 94 -3.978 -4.254 -8.382 1.00 0.00 H new ATOM 0 HH11 ARG B 94 -4.580 -4.880 -4.947 1.00 0.00 H new ATOM 0 HH12 ARG B 94 -4.437 -6.627 -5.169 1.00 0.00 H new ATOM 0 HH21 ARG B 94 -3.819 -6.455 -8.580 1.00 0.00 H new ATOM 0 HH22 ARG B 94 -4.019 -7.491 -7.163 1.00 0.00 H new ATOM 1419 N VAL B 95 -3.735 2.573 -6.740 1.00 0.00 N ATOM 1420 CA VAL B 95 -3.861 3.851 -6.017 1.00 0.00 C ATOM 1421 C VAL B 95 -4.045 5.045 -6.974 1.00 0.00 C ATOM 1422 O VAL B 95 -4.898 5.894 -6.717 1.00 0.00 O ATOM 1423 CB VAL B 95 -2.677 4.036 -5.038 1.00 0.00 C ATOM 1424 CG1 VAL B 95 -2.561 5.457 -4.474 1.00 0.00 C ATOM 1425 CG2 VAL B 95 -2.819 3.060 -3.854 1.00 0.00 C ATOM 0 H VAL B 95 -2.796 2.176 -6.702 1.00 0.00 H new ATOM 0 HA VAL B 95 -4.772 3.817 -5.420 1.00 0.00 H new ATOM 0 HB VAL B 95 -1.776 3.836 -5.618 1.00 0.00 H new ATOM 0 HG11 VAL B 95 -1.709 5.511 -3.796 1.00 0.00 H new ATOM 0 HG12 VAL B 95 -2.419 6.163 -5.292 1.00 0.00 H new ATOM 0 HG13 VAL B 95 -3.473 5.709 -3.932 1.00 0.00 H new ATOM 0 HG21 VAL B 95 -1.982 3.195 -3.169 1.00 0.00 H new ATOM 0 HG22 VAL B 95 -3.754 3.258 -3.329 1.00 0.00 H new ATOM 0 HG23 VAL B 95 -2.822 2.035 -4.225 1.00 0.00 H new ATOM 1435 N LEU B 96 -3.324 5.097 -8.106 1.00 0.00 N ATOM 1436 CA LEU B 96 -3.539 6.126 -9.138 1.00 0.00 C ATOM 1437 C LEU B 96 -4.937 6.029 -9.762 1.00 0.00 C ATOM 1438 O LEU B 96 -5.589 7.054 -9.972 1.00 0.00 O ATOM 1439 CB LEU B 96 -2.454 6.013 -10.230 1.00 0.00 C ATOM 1440 CG LEU B 96 -1.074 6.570 -9.826 1.00 0.00 C ATOM 1441 CD1 LEU B 96 -0.041 6.209 -10.905 1.00 0.00 C ATOM 1442 CD2 LEU B 96 -1.104 8.098 -9.644 1.00 0.00 C ATOM 0 H LEU B 96 -2.582 4.434 -8.331 1.00 0.00 H new ATOM 0 HA LEU B 96 -3.466 7.101 -8.655 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -2.341 4.964 -10.504 1.00 0.00 H new ATOM 0 HB3 LEU B 96 -2.797 6.540 -11.120 1.00 0.00 H new ATOM 0 HG LEU B 96 -0.800 6.122 -8.871 1.00 0.00 H new ATOM 0 HD11 LEU B 96 0.935 6.602 -10.620 1.00 0.00 H new ATOM 0 HD12 LEU B 96 0.019 5.125 -11.003 1.00 0.00 H new ATOM 0 HD13 LEU B 96 -0.343 6.643 -11.858 1.00 0.00 H new ATOM 0 HD21 LEU B 96 -0.112 8.450 -9.360 1.00 0.00 H new ATOM 0 HD22 LEU B 96 -1.402 8.570 -10.580 1.00 0.00 H new ATOM 0 HD23 LEU B 96 -1.819 8.357 -8.863 1.00 0.00 H new ATOM 1454 N ASN B 97 -5.432 4.813 -10.005 1.00 0.00 N ATOM 1455 CA ASN B 97 -6.741 4.594 -10.619 1.00 0.00 C ATOM 1456 C ASN B 97 -7.932 5.051 -9.744 1.00 0.00 C ATOM 1457 O ASN B 97 -9.029 5.221 -10.280 1.00 0.00 O ATOM 1458 CB ASN B 97 -6.871 3.118 -11.022 1.00 0.00 C ATOM 1459 CG ASN B 97 -6.014 2.706 -12.221 1.00 0.00 C ATOM 1460 OD1 ASN B 97 -5.475 3.516 -12.974 1.00 0.00 O ATOM 1461 ND2 ASN B 97 -5.893 1.412 -12.457 1.00 0.00 N ATOM 0 H ASN B 97 -4.934 3.952 -9.780 1.00 0.00 H new ATOM 0 HA ASN B 97 -6.791 5.227 -11.505 1.00 0.00 H new ATOM 0 HB2 ASN B 97 -6.600 2.497 -10.168 1.00 0.00 H new ATOM 0 HB3 ASN B 97 -7.916 2.908 -11.250 1.00 0.00 H new ATOM 0 HD21 ASN B 97 -5.355 1.088 -13.261 1.00 0.00 H new ATOM 0 HD22 ASN B 97 -6.338 0.736 -11.836 1.00 0.00 H new ATOM 1468 N LYS B 98 -7.754 5.307 -8.436 1.00 0.00 N ATOM 1469 CA LYS B 98 -8.779 5.965 -7.600 1.00 0.00 C ATOM 1470 C LYS B 98 -8.947 7.449 -7.964 1.00 0.00 C ATOM 1471 O LYS B 98 -10.066 7.913 -8.182 1.00 0.00 O ATOM 1472 CB LYS B 98 -8.432 5.841 -6.102 1.00 0.00 C ATOM 1473 CG LYS B 98 -8.236 4.415 -5.574 1.00 0.00 C ATOM 1474 CD LYS B 98 -9.449 3.500 -5.801 1.00 0.00 C ATOM 1475 CE LYS B 98 -9.203 2.090 -5.252 1.00 0.00 C ATOM 1476 NZ LYS B 98 -8.085 1.424 -5.958 1.00 0.00 N ATOM 0 H LYS B 98 -6.902 5.066 -7.929 1.00 0.00 H new ATOM 0 HA LYS B 98 -9.721 5.453 -7.796 1.00 0.00 H new ATOM 0 HB2 LYS B 98 -7.519 6.406 -5.913 1.00 0.00 H new ATOM 0 HB3 LYS B 98 -9.226 6.315 -5.525 1.00 0.00 H new ATOM 0 HG2 LYS B 98 -7.364 3.975 -6.058 1.00 0.00 H new ATOM 0 HG3 LYS B 98 -8.020 4.459 -4.507 1.00 0.00 H new ATOM 0 HD2 LYS B 98 -10.326 3.931 -5.318 1.00 0.00 H new ATOM 0 HD3 LYS B 98 -9.668 3.443 -6.867 1.00 0.00 H new ATOM 0 HE2 LYS B 98 -8.981 2.146 -4.186 1.00 0.00 H new ATOM 0 HE3 LYS B 98 -10.109 1.493 -5.357 1.00 0.00 H new ATOM 0 HZ1 LYS B 98 -8.418 0.528 -6.368 1.00 0.00 H new ATOM 0 HZ2 LYS B 98 -7.735 2.043 -6.717 1.00 0.00 H new ATOM 0 HZ3 LYS B 98 -7.315 1.232 -5.286 1.00 0.00 H new ATOM 1490 N LEU B 99 -7.823 8.169 -8.062 1.00 0.00 N ATOM 1491 CA LEU B 99 -7.751 9.604 -8.358 1.00 0.00 C ATOM 1492 C LEU B 99 -8.252 9.892 -9.781 1.00 0.00 C ATOM 1493 O LEU B 99 -9.077 10.790 -9.965 1.00 0.00 O ATOM 1494 CB LEU B 99 -6.292 10.030 -8.082 1.00 0.00 C ATOM 1495 CG LEU B 99 -5.918 11.525 -8.146 1.00 0.00 C ATOM 1496 CD1 LEU B 99 -5.781 12.047 -9.580 1.00 0.00 C ATOM 1497 CD2 LEU B 99 -6.871 12.409 -7.331 1.00 0.00 C ATOM 0 H LEU B 99 -6.902 7.750 -7.932 1.00 0.00 H new ATOM 0 HA LEU B 99 -8.410 10.200 -7.726 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -6.027 9.668 -7.088 1.00 0.00 H new ATOM 0 HB3 LEU B 99 -5.656 9.502 -8.793 1.00 0.00 H new ATOM 0 HG LEU B 99 -4.933 11.592 -7.684 1.00 0.00 H new ATOM 0 HD11 LEU B 99 -5.517 13.104 -9.559 1.00 0.00 H new ATOM 0 HD12 LEU B 99 -5.001 11.488 -10.098 1.00 0.00 H new ATOM 0 HD13 LEU B 99 -6.728 11.920 -10.105 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -6.560 13.451 -7.412 1.00 0.00 H new ATOM 0 HD22 LEU B 99 -7.885 12.302 -7.716 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -6.846 12.103 -6.285 1.00 0.00 H new ATOM 1509 N GLY B 100 -7.839 9.068 -10.751 1.00 0.00 N ATOM 1510 CA GLY B 100 -8.467 8.966 -12.074 1.00 0.00 C ATOM 1511 C GLY B 100 -8.063 10.055 -13.071 1.00 0.00 C ATOM 1512 O GLY B 100 -7.571 11.127 -12.712 1.00 0.00 O ATOM 0 H GLY B 100 -7.043 8.441 -10.636 1.00 0.00 H new ATOM 0 HA2 GLY B 100 -8.221 7.994 -12.502 1.00 0.00 H new ATOM 0 HA3 GLY B 100 -9.549 8.994 -11.948 1.00 0.00 H new ATOM 1516 N GLY B 101 -8.291 9.766 -14.354 1.00 0.00 N ATOM 1517 CA GLY B 101 -8.072 10.680 -15.482 1.00 0.00 C ATOM 1518 C GLY B 101 -6.604 10.890 -15.847 1.00 0.00 C ATOM 1519 O GLY B 101 -6.224 11.965 -16.319 1.00 0.00 O ATOM 0 H GLY B 101 -8.646 8.856 -14.649 1.00 0.00 H new ATOM 0 HA2 GLY B 101 -8.599 10.294 -16.354 1.00 0.00 H new ATOM 0 HA3 GLY B 101 -8.516 11.646 -15.243 1.00 0.00 H new ATOM 1523 N VAL B 102 -5.771 9.888 -15.588 1.00 0.00 N ATOM 1524 CA VAL B 102 -4.304 9.969 -15.656 1.00 0.00 C ATOM 1525 C VAL B 102 -3.731 8.955 -16.648 1.00 0.00 C ATOM 1526 O VAL B 102 -3.928 7.747 -16.525 1.00 0.00 O ATOM 1527 CB VAL B 102 -3.637 9.811 -14.264 1.00 0.00 C ATOM 1528 CG1 VAL B 102 -3.743 11.129 -13.478 1.00 0.00 C ATOM 1529 CG2 VAL B 102 -4.211 8.670 -13.403 1.00 0.00 C ATOM 0 H VAL B 102 -6.103 8.963 -15.315 1.00 0.00 H new ATOM 0 HA VAL B 102 -4.068 10.970 -16.016 1.00 0.00 H new ATOM 0 HB VAL B 102 -2.599 9.551 -14.470 1.00 0.00 H new ATOM 0 HG11 VAL B 102 -3.272 11.010 -12.502 1.00 0.00 H new ATOM 0 HG12 VAL B 102 -3.239 11.923 -14.029 1.00 0.00 H new ATOM 0 HG13 VAL B 102 -4.793 11.390 -13.345 1.00 0.00 H new ATOM 0 HG21 VAL B 102 -3.685 8.634 -12.449 1.00 0.00 H new ATOM 0 HG22 VAL B 102 -5.272 8.846 -13.226 1.00 0.00 H new ATOM 0 HG23 VAL B 102 -4.082 7.721 -13.924 1.00 0.00 H new ATOM 1539 N LYS B 103 -2.982 9.465 -17.628 1.00 0.00 N ATOM 1540 CA LYS B 103 -2.154 8.675 -18.538 1.00 0.00 C ATOM 1541 C LYS B 103 -0.762 8.454 -17.928 1.00 0.00 C ATOM 1542 O LYS B 103 -0.124 9.420 -17.509 1.00 0.00 O ATOM 1543 CB LYS B 103 -2.080 9.406 -19.889 1.00 0.00 C ATOM 1544 CG LYS B 103 -3.034 8.774 -20.909 1.00 0.00 C ATOM 1545 CD LYS B 103 -3.021 9.580 -22.207 1.00 0.00 C ATOM 1546 CE LYS B 103 -3.880 8.886 -23.265 1.00 0.00 C ATOM 1547 NZ LYS B 103 -3.962 9.704 -24.494 1.00 0.00 N ATOM 0 H LYS B 103 -2.934 10.467 -17.815 1.00 0.00 H new ATOM 0 HA LYS B 103 -2.593 7.690 -18.697 1.00 0.00 H new ATOM 0 HB2 LYS B 103 -2.333 10.457 -19.752 1.00 0.00 H new ATOM 0 HB3 LYS B 103 -1.059 9.371 -20.270 1.00 0.00 H new ATOM 0 HG2 LYS B 103 -2.737 7.744 -21.108 1.00 0.00 H new ATOM 0 HG3 LYS B 103 -4.045 8.741 -20.502 1.00 0.00 H new ATOM 0 HD2 LYS B 103 -3.399 10.586 -22.023 1.00 0.00 H new ATOM 0 HD3 LYS B 103 -1.998 9.685 -22.569 1.00 0.00 H new ATOM 0 HE2 LYS B 103 -3.457 7.910 -23.500 1.00 0.00 H new ATOM 0 HE3 LYS B 103 -4.881 8.713 -22.871 1.00 0.00 H new ATOM 0 HZ1 LYS B 103 -4.550 9.214 -25.198 1.00 0.00 H new ATOM 0 HZ2 LYS B 103 -4.387 10.626 -24.269 1.00 0.00 H new ATOM 0 HZ3 LYS B 103 -3.007 9.848 -24.880 1.00 0.00 H new ATOM 1561 N TYR B 104 -0.299 7.203 -17.850 1.00 0.00 N ATOM 1562 CA TYR B 104 1.003 6.851 -17.259 1.00 0.00 C ATOM 1563 C TYR B 104 1.583 5.506 -17.734 1.00 0.00 C ATOM 1564 O TYR B 104 0.871 4.654 -18.268 1.00 0.00 O ATOM 1565 CB TYR B 104 0.929 6.930 -15.718 1.00 0.00 C ATOM 1566 CG TYR B 104 0.009 5.940 -15.016 1.00 0.00 C ATOM 1567 CD1 TYR B 104 -1.355 6.250 -14.849 1.00 0.00 C ATOM 1568 CD2 TYR B 104 0.518 4.743 -14.472 1.00 0.00 C ATOM 1569 CE1 TYR B 104 -2.217 5.359 -14.181 1.00 0.00 C ATOM 1570 CE2 TYR B 104 -0.333 3.852 -13.786 1.00 0.00 C ATOM 1571 CZ TYR B 104 -1.710 4.152 -13.655 1.00 0.00 C ATOM 1572 OH TYR B 104 -2.551 3.260 -13.064 1.00 0.00 O ATOM 0 H TYR B 104 -0.819 6.397 -18.197 1.00 0.00 H new ATOM 0 HA TYR B 104 1.711 7.594 -17.626 1.00 0.00 H new ATOM 0 HB2 TYR B 104 1.936 6.794 -15.324 1.00 0.00 H new ATOM 0 HB3 TYR B 104 0.613 7.937 -15.446 1.00 0.00 H new ATOM 0 HD1 TYR B 104 -1.743 7.180 -15.237 1.00 0.00 H new ATOM 0 HD2 TYR B 104 1.566 4.507 -14.581 1.00 0.00 H new ATOM 0 HE1 TYR B 104 -3.264 5.599 -14.072 1.00 0.00 H new ATOM 0 HE2 TYR B 104 0.065 2.942 -13.361 1.00 0.00 H new ATOM 0 HH TYR B 104 -3.476 3.566 -13.166 1.00 0.00 H new ATOM 1582 N ASP B 105 2.875 5.290 -17.467 1.00 0.00 N ATOM 1583 CA ASP B 105 3.572 4.000 -17.572 1.00 0.00 C ATOM 1584 C ASP B 105 4.650 3.886 -16.481 1.00 0.00 C ATOM 1585 O ASP B 105 5.377 4.842 -16.207 1.00 0.00 O ATOM 1586 CB ASP B 105 4.182 3.811 -18.972 1.00 0.00 C ATOM 1587 CG ASP B 105 4.962 2.493 -19.083 1.00 0.00 C ATOM 1588 OD1 ASP B 105 4.348 1.415 -18.891 1.00 0.00 O ATOM 1589 OD2 ASP B 105 6.199 2.540 -19.296 1.00 0.00 O ATOM 0 H ASP B 105 3.492 6.041 -17.158 1.00 0.00 H new ATOM 0 HA ASP B 105 2.843 3.204 -17.421 1.00 0.00 H new ATOM 0 HB2 ASP B 105 3.388 3.827 -19.719 1.00 0.00 H new ATOM 0 HB3 ASP B 105 4.846 4.646 -19.194 1.00 0.00 H new ATOM 1594 N ILE B 106 4.756 2.700 -15.878 1.00 0.00 N ATOM 1595 CA ILE B 106 5.673 2.374 -14.771 1.00 0.00 C ATOM 1596 C ILE B 106 6.941 1.734 -15.346 1.00 0.00 C ATOM 1597 O ILE B 106 6.853 0.799 -16.145 1.00 0.00 O ATOM 1598 CB ILE B 106 4.949 1.427 -13.778 1.00 0.00 C ATOM 1599 CG1 ILE B 106 3.650 2.058 -13.214 1.00 0.00 C ATOM 1600 CG2 ILE B 106 5.871 1.020 -12.612 1.00 0.00 C ATOM 1601 CD1 ILE B 106 2.694 1.030 -12.601 1.00 0.00 C ATOM 0 H ILE B 106 4.183 1.903 -16.156 1.00 0.00 H new ATOM 0 HA ILE B 106 5.964 3.274 -14.229 1.00 0.00 H new ATOM 0 HB ILE B 106 4.681 0.536 -14.346 1.00 0.00 H new ATOM 0 HG12 ILE B 106 3.912 2.797 -12.457 1.00 0.00 H new ATOM 0 HG13 ILE B 106 3.136 2.590 -14.014 1.00 0.00 H new ATOM 0 HG21 ILE B 106 5.331 0.357 -11.936 1.00 0.00 H new ATOM 0 HG22 ILE B 106 6.747 0.504 -13.004 1.00 0.00 H new ATOM 0 HG23 ILE B 106 6.187 1.911 -12.070 1.00 0.00 H new ATOM 0 HD11 ILE B 106 1.806 1.538 -12.225 1.00 0.00 H new ATOM 0 HD12 ILE B 106 2.403 0.305 -13.361 1.00 0.00 H new ATOM 0 HD13 ILE B 106 3.192 0.515 -11.780 1.00 0.00 H new ATOM 1613 N ASP B 107 8.113 2.226 -14.953 1.00 0.00 N ATOM 1614 CA ASP B 107 9.419 1.767 -15.430 1.00 0.00 C ATOM 1615 C ASP B 107 10.030 0.753 -14.449 1.00 0.00 C ATOM 1616 O ASP B 107 10.318 1.083 -13.294 1.00 0.00 O ATOM 1617 CB ASP B 107 10.328 2.988 -15.621 1.00 0.00 C ATOM 1618 CG ASP B 107 11.502 2.686 -16.548 1.00 0.00 C ATOM 1619 OD1 ASP B 107 12.479 2.045 -16.098 1.00 0.00 O ATOM 1620 OD2 ASP B 107 11.445 3.101 -17.733 1.00 0.00 O ATOM 0 H ASP B 107 8.184 2.981 -14.271 1.00 0.00 H new ATOM 0 HA ASP B 107 9.307 1.255 -16.386 1.00 0.00 H new ATOM 0 HB2 ASP B 107 9.746 3.813 -16.030 1.00 0.00 H new ATOM 0 HB3 ASP B 107 10.706 3.314 -14.652 1.00 0.00 H new ATOM 1625 N LEU B 108 10.205 -0.494 -14.898 1.00 0.00 N ATOM 1626 CA LEU B 108 10.561 -1.616 -14.021 1.00 0.00 C ATOM 1627 C LEU B 108 12.046 -1.594 -13.598 1.00 0.00 C ATOM 1628 O LEU B 108 12.296 -1.750 -12.397 1.00 0.00 O ATOM 1629 CB LEU B 108 10.122 -2.959 -14.656 1.00 0.00 C ATOM 1630 CG LEU B 108 8.628 -3.341 -14.535 1.00 0.00 C ATOM 1631 CD1 LEU B 108 8.193 -3.540 -13.075 1.00 0.00 C ATOM 1632 CD2 LEU B 108 7.683 -2.348 -15.227 1.00 0.00 C ATOM 0 H LEU B 108 10.104 -0.755 -15.879 1.00 0.00 H new ATOM 0 HA LEU B 108 10.007 -1.504 -13.089 1.00 0.00 H new ATOM 0 HB2 LEU B 108 10.380 -2.933 -15.715 1.00 0.00 H new ATOM 0 HB3 LEU B 108 10.713 -3.756 -14.204 1.00 0.00 H new ATOM 0 HG LEU B 108 8.544 -4.293 -15.060 1.00 0.00 H new ATOM 0 HD11 LEU B 108 7.137 -3.807 -13.043 1.00 0.00 H new ATOM 0 HD12 LEU B 108 8.783 -4.339 -12.625 1.00 0.00 H new ATOM 0 HD13 LEU B 108 8.351 -2.616 -12.519 1.00 0.00 H new ATOM 0 HD21 LEU B 108 6.652 -2.679 -15.102 1.00 0.00 H new ATOM 0 HD22 LEU B 108 7.804 -1.360 -14.782 1.00 0.00 H new ATOM 0 HD23 LEU B 108 7.922 -2.299 -16.289 1.00 0.00 H new ATOM 1644 N PRO B 109 13.035 -1.375 -14.496 1.00 0.00 N ATOM 1645 CA PRO B 109 14.428 -1.203 -14.092 1.00 0.00 C ATOM 1646 C PRO B 109 14.622 0.018 -13.181 1.00 0.00 C ATOM 1647 O PRO B 109 15.125 -0.131 -12.067 1.00 0.00 O ATOM 1648 CB PRO B 109 15.244 -1.093 -15.389 1.00 0.00 C ATOM 1649 CG PRO B 109 14.361 -1.790 -16.421 1.00 0.00 C ATOM 1650 CD PRO B 109 12.953 -1.441 -15.949 1.00 0.00 C ATOM 0 HA PRO B 109 14.763 -2.051 -13.495 1.00 0.00 H new ATOM 0 HB2 PRO B 109 15.433 -0.054 -15.658 1.00 0.00 H new ATOM 0 HB3 PRO B 109 16.215 -1.580 -15.296 1.00 0.00 H new ATOM 0 HG2 PRO B 109 14.552 -1.425 -17.430 1.00 0.00 H new ATOM 0 HG3 PRO B 109 14.528 -2.867 -16.435 1.00 0.00 H new ATOM 0 HD2 PRO B 109 12.623 -0.490 -16.367 1.00 0.00 H new ATOM 0 HD3 PRO B 109 12.234 -2.196 -16.268 1.00 0.00 H new ATOM 1658 N ASN B 110 14.210 1.213 -13.622 1.00 0.00 N ATOM 1659 CA ASN B 110 14.570 2.472 -12.956 1.00 0.00 C ATOM 1660 C ASN B 110 13.707 2.801 -11.717 1.00 0.00 C ATOM 1661 O ASN B 110 14.142 3.575 -10.864 1.00 0.00 O ATOM 1662 CB ASN B 110 14.512 3.596 -14.000 1.00 0.00 C ATOM 1663 CG ASN B 110 15.020 4.919 -13.445 1.00 0.00 C ATOM 1664 OD1 ASN B 110 14.253 5.762 -13.000 1.00 0.00 O ATOM 1665 ND2 ASN B 110 16.320 5.131 -13.430 1.00 0.00 N ATOM 0 H ASN B 110 13.621 1.335 -14.446 1.00 0.00 H new ATOM 0 HA ASN B 110 15.579 2.366 -12.558 1.00 0.00 H new ATOM 0 HB2 ASN B 110 15.108 3.315 -14.868 1.00 0.00 H new ATOM 0 HB3 ASN B 110 13.485 3.718 -14.344 1.00 0.00 H new ATOM 0 HD21 ASN B 110 16.691 6.000 -13.046 1.00 0.00 H new ATOM 0 HD22 ASN B 110 16.956 4.426 -13.802 1.00 0.00 H new ATOM 1672 N LYS B 111 12.503 2.220 -11.602 1.00 0.00 N ATOM 1673 CA LYS B 111 11.532 2.416 -10.503 1.00 0.00 C ATOM 1674 C LYS B 111 10.831 3.798 -10.553 1.00 0.00 C ATOM 1675 O LYS B 111 10.397 4.337 -9.526 1.00 0.00 O ATOM 1676 CB LYS B 111 12.142 2.106 -9.111 1.00 0.00 C ATOM 1677 CG LYS B 111 12.981 0.830 -8.964 1.00 0.00 C ATOM 1678 CD LYS B 111 12.098 -0.385 -9.203 1.00 0.00 C ATOM 1679 CE LYS B 111 12.832 -1.718 -9.022 1.00 0.00 C ATOM 1680 NZ LYS B 111 13.912 -1.914 -10.016 1.00 0.00 N ATOM 0 H LYS B 111 12.158 1.567 -12.306 1.00 0.00 H new ATOM 0 HA LYS B 111 10.745 1.679 -10.664 1.00 0.00 H new ATOM 0 HB2 LYS B 111 12.766 2.952 -8.823 1.00 0.00 H new ATOM 0 HB3 LYS B 111 11.325 2.054 -8.392 1.00 0.00 H new ATOM 0 HG2 LYS B 111 13.806 0.840 -9.677 1.00 0.00 H new ATOM 0 HG3 LYS B 111 13.421 0.783 -7.968 1.00 0.00 H new ATOM 0 HD2 LYS B 111 11.251 -0.349 -8.518 1.00 0.00 H new ATOM 0 HD3 LYS B 111 11.693 -0.337 -10.214 1.00 0.00 H new ATOM 0 HE2 LYS B 111 13.255 -1.762 -8.018 1.00 0.00 H new ATOM 0 HE3 LYS B 111 12.116 -2.536 -9.103 1.00 0.00 H new ATOM 0 HZ1 LYS B 111 14.376 -2.830 -9.849 1.00 0.00 H new ATOM 0 HZ2 LYS B 111 13.508 -1.900 -10.974 1.00 0.00 H new ATOM 0 HZ3 LYS B 111 14.612 -1.150 -9.924 1.00 0.00 H new ATOM 1694 N LYS B 112 10.715 4.378 -11.755 1.00 0.00 N ATOM 1695 CA LYS B 112 10.037 5.658 -12.009 1.00 0.00 C ATOM 1696 C LYS B 112 8.642 5.487 -12.635 1.00 0.00 C ATOM 1697 O LYS B 112 8.286 4.414 -13.120 1.00 0.00 O ATOM 1698 CB LYS B 112 10.939 6.599 -12.837 1.00 0.00 C ATOM 1699 CG LYS B 112 11.217 6.117 -14.267 1.00 0.00 C ATOM 1700 CD LYS B 112 12.019 7.132 -15.092 1.00 0.00 C ATOM 1701 CE LYS B 112 12.321 6.516 -16.462 1.00 0.00 C ATOM 1702 NZ LYS B 112 13.081 7.439 -17.332 1.00 0.00 N ATOM 0 H LYS B 112 11.100 3.959 -12.601 1.00 0.00 H new ATOM 0 HA LYS B 112 9.863 6.126 -11.040 1.00 0.00 H new ATOM 0 HB2 LYS B 112 10.471 7.583 -12.883 1.00 0.00 H new ATOM 0 HB3 LYS B 112 11.889 6.722 -12.317 1.00 0.00 H new ATOM 0 HG2 LYS B 112 11.764 5.175 -14.228 1.00 0.00 H new ATOM 0 HG3 LYS B 112 10.270 5.916 -14.768 1.00 0.00 H new ATOM 0 HD2 LYS B 112 11.453 8.056 -15.209 1.00 0.00 H new ATOM 0 HD3 LYS B 112 12.946 7.388 -14.579 1.00 0.00 H new ATOM 0 HE2 LYS B 112 12.889 5.595 -16.328 1.00 0.00 H new ATOM 0 HE3 LYS B 112 11.385 6.245 -16.951 1.00 0.00 H new ATOM 0 HZ1 LYS B 112 13.263 6.982 -18.248 1.00 0.00 H new ATOM 0 HZ2 LYS B 112 12.529 8.308 -17.482 1.00 0.00 H new ATOM 0 HZ3 LYS B 112 13.986 7.678 -16.878 1.00 0.00 H new ATOM 1716 N VAL B 113 7.870 6.569 -12.654 1.00 0.00 N ATOM 1717 CA VAL B 113 6.588 6.706 -13.360 1.00 0.00 C ATOM 1718 C VAL B 113 6.552 8.112 -13.964 1.00 0.00 C ATOM 1719 O VAL B 113 6.952 9.059 -13.291 1.00 0.00 O ATOM 1720 CB VAL B 113 5.373 6.518 -12.410 1.00 0.00 C ATOM 1721 CG1 VAL B 113 4.048 6.485 -13.193 1.00 0.00 C ATOM 1722 CG2 VAL B 113 5.474 5.234 -11.565 1.00 0.00 C ATOM 0 H VAL B 113 8.129 7.420 -12.154 1.00 0.00 H new ATOM 0 HA VAL B 113 6.515 5.933 -14.125 1.00 0.00 H new ATOM 0 HB VAL B 113 5.388 7.378 -11.740 1.00 0.00 H new ATOM 0 HG11 VAL B 113 3.218 6.352 -12.499 1.00 0.00 H new ATOM 0 HG12 VAL B 113 3.922 7.423 -13.734 1.00 0.00 H new ATOM 0 HG13 VAL B 113 4.064 5.657 -13.901 1.00 0.00 H new ATOM 0 HG21 VAL B 113 4.599 5.153 -10.920 1.00 0.00 H new ATOM 0 HG22 VAL B 113 5.520 4.367 -12.224 1.00 0.00 H new ATOM 0 HG23 VAL B 113 6.375 5.272 -10.952 1.00 0.00 H new ATOM 1732 N CYS B 114 6.079 8.263 -15.203 1.00 0.00 N ATOM 1733 CA CYS B 114 5.754 9.576 -15.775 1.00 0.00 C ATOM 1734 C CYS B 114 4.252 9.660 -16.071 1.00 0.00 C ATOM 1735 O CYS B 114 3.693 8.746 -16.683 1.00 0.00 O ATOM 1736 CB CYS B 114 6.621 9.839 -17.012 1.00 0.00 C ATOM 1737 SG CYS B 114 6.236 11.498 -17.649 1.00 0.00 S ATOM 0 H CYS B 114 5.910 7.483 -15.838 1.00 0.00 H new ATOM 0 HA CYS B 114 5.981 10.363 -15.056 1.00 0.00 H new ATOM 0 HB2 CYS B 114 7.678 9.768 -16.755 1.00 0.00 H new ATOM 0 HB3 CYS B 114 6.428 9.086 -17.776 1.00 0.00 H new ATOM 0 HG CYS B 114 5.876 12.268 -16.665 1.00 0.00 H new ATOM 1743 N ILE B 115 3.615 10.744 -15.629 1.00 0.00 N ATOM 1744 CA ILE B 115 2.163 10.976 -15.686 1.00 0.00 C ATOM 1745 C ILE B 115 1.860 12.161 -16.625 1.00 0.00 C ATOM 1746 O ILE B 115 2.653 13.101 -16.704 1.00 0.00 O ATOM 1747 CB ILE B 115 1.611 11.200 -14.247 1.00 0.00 C ATOM 1748 CG1 ILE B 115 1.879 9.971 -13.339 1.00 0.00 C ATOM 1749 CG2 ILE B 115 0.111 11.556 -14.271 1.00 0.00 C ATOM 1750 CD1 ILE B 115 1.470 10.145 -11.869 1.00 0.00 C ATOM 0 H ILE B 115 4.116 11.523 -15.201 1.00 0.00 H new ATOM 0 HA ILE B 115 1.658 10.101 -16.096 1.00 0.00 H new ATOM 0 HB ILE B 115 2.147 12.048 -13.821 1.00 0.00 H new ATOM 0 HG12 ILE B 115 1.346 9.113 -13.749 1.00 0.00 H new ATOM 0 HG13 ILE B 115 2.942 9.735 -13.379 1.00 0.00 H new ATOM 0 HG21 ILE B 115 -0.244 11.706 -13.251 1.00 0.00 H new ATOM 0 HG22 ILE B 115 -0.037 12.471 -14.845 1.00 0.00 H new ATOM 0 HG23 ILE B 115 -0.449 10.743 -14.734 1.00 0.00 H new ATOM 0 HD11 ILE B 115 1.697 9.233 -11.318 1.00 0.00 H new ATOM 0 HD12 ILE B 115 2.021 10.979 -11.434 1.00 0.00 H new ATOM 0 HD13 ILE B 115 0.401 10.347 -11.810 1.00 0.00 H new ATOM 1762 N GLU B 116 0.711 12.117 -17.307 1.00 0.00 N ATOM 1763 CA GLU B 116 0.067 13.239 -17.999 1.00 0.00 C ATOM 1764 C GLU B 116 -1.298 13.529 -17.340 1.00 0.00 C ATOM 1765 O GLU B 116 -2.245 12.749 -17.483 1.00 0.00 O ATOM 1766 CB GLU B 116 -0.086 12.897 -19.494 1.00 0.00 C ATOM 1767 CG GLU B 116 -0.497 14.106 -20.349 1.00 0.00 C ATOM 1768 CD GLU B 116 -0.643 13.726 -21.828 1.00 0.00 C ATOM 1769 OE1 GLU B 116 0.313 13.176 -22.425 1.00 0.00 O ATOM 1770 OE2 GLU B 116 -1.692 14.028 -22.449 1.00 0.00 O ATOM 0 H GLU B 116 0.177 11.253 -17.396 1.00 0.00 H new ATOM 0 HA GLU B 116 0.680 14.137 -17.919 1.00 0.00 H new ATOM 0 HB2 GLU B 116 0.857 12.499 -19.868 1.00 0.00 H new ATOM 0 HB3 GLU B 116 -0.831 12.110 -19.606 1.00 0.00 H new ATOM 0 HG2 GLU B 116 -1.441 14.509 -19.981 1.00 0.00 H new ATOM 0 HG3 GLU B 116 0.248 14.895 -20.247 1.00 0.00 H new ATOM 1777 N SER B 117 -1.408 14.639 -16.603 1.00 0.00 N ATOM 1778 CA SER B 117 -2.581 14.968 -15.770 1.00 0.00 C ATOM 1779 C SER B 117 -3.100 16.409 -15.952 1.00 0.00 C ATOM 1780 O SER B 117 -2.411 17.276 -16.496 1.00 0.00 O ATOM 1781 CB SER B 117 -2.225 14.734 -14.288 1.00 0.00 C ATOM 1782 OG SER B 117 -3.345 14.868 -13.424 1.00 0.00 O ATOM 0 H SER B 117 -0.676 15.348 -16.564 1.00 0.00 H new ATOM 0 HA SER B 117 -3.388 14.312 -16.096 1.00 0.00 H new ATOM 0 HB2 SER B 117 -1.802 13.736 -14.174 1.00 0.00 H new ATOM 0 HB3 SER B 117 -1.454 15.444 -13.988 1.00 0.00 H new ATOM 0 HG SER B 117 -3.229 14.284 -12.646 1.00 0.00 H new ATOM 1788 N GLU B 118 -4.323 16.678 -15.472 1.00 0.00 N ATOM 1789 CA GLU B 118 -4.859 18.030 -15.251 1.00 0.00 C ATOM 1790 C GLU B 118 -4.559 18.591 -13.849 1.00 0.00 C ATOM 1791 O GLU B 118 -4.742 19.785 -13.599 1.00 0.00 O ATOM 1792 CB GLU B 118 -6.371 18.049 -15.550 1.00 0.00 C ATOM 1793 CG GLU B 118 -7.251 17.258 -14.573 1.00 0.00 C ATOM 1794 CD GLU B 118 -8.698 17.224 -15.064 1.00 0.00 C ATOM 1795 OE1 GLU B 118 -8.979 16.545 -16.080 1.00 0.00 O ATOM 1796 OE2 GLU B 118 -9.562 17.906 -14.463 1.00 0.00 O ATOM 0 H GLU B 118 -4.984 15.943 -15.220 1.00 0.00 H new ATOM 0 HA GLU B 118 -4.343 18.694 -15.944 1.00 0.00 H new ATOM 0 HB2 GLU B 118 -6.709 19.085 -15.557 1.00 0.00 H new ATOM 0 HB3 GLU B 118 -6.529 17.655 -16.554 1.00 0.00 H new ATOM 0 HG2 GLU B 118 -6.871 16.241 -14.473 1.00 0.00 H new ATOM 0 HG3 GLU B 118 -7.207 17.714 -13.584 1.00 0.00 H new ATOM 1803 N HIS B 119 -4.091 17.747 -12.934 1.00 0.00 N ATOM 1804 CA HIS B 119 -3.787 18.088 -11.544 1.00 0.00 C ATOM 1805 C HIS B 119 -2.322 18.542 -11.367 1.00 0.00 C ATOM 1806 O HIS B 119 -1.535 18.555 -12.316 1.00 0.00 O ATOM 1807 CB HIS B 119 -4.118 16.866 -10.668 1.00 0.00 C ATOM 1808 CG HIS B 119 -5.537 16.368 -10.816 1.00 0.00 C ATOM 1809 ND1 HIS B 119 -6.685 17.081 -10.556 1.00 0.00 N ATOM 1810 CD2 HIS B 119 -5.929 15.118 -11.218 1.00 0.00 C ATOM 1811 CE1 HIS B 119 -7.738 16.276 -10.781 1.00 0.00 C ATOM 1812 NE2 HIS B 119 -7.329 15.059 -11.186 1.00 0.00 N ATOM 0 H HIS B 119 -3.905 16.767 -13.147 1.00 0.00 H new ATOM 0 HA HIS B 119 -4.397 18.937 -11.235 1.00 0.00 H new ATOM 0 HB2 HIS B 119 -3.432 16.057 -10.918 1.00 0.00 H new ATOM 0 HB3 HIS B 119 -3.941 17.122 -9.623 1.00 0.00 H new ATOM 0 HD2 HIS B 119 -5.270 14.314 -11.510 1.00 0.00 H new ATOM 0 HE1 HIS B 119 -8.771 16.566 -10.654 1.00 0.00 H new ATOM 0 HE2 HIS B 119 -7.917 14.259 -11.421 1.00 0.00 H new ATOM 1820 N SER B 120 -1.934 18.918 -10.148 1.00 0.00 N ATOM 1821 CA SER B 120 -0.552 19.274 -9.790 1.00 0.00 C ATOM 1822 C SER B 120 0.118 18.194 -8.919 1.00 0.00 C ATOM 1823 O SER B 120 -0.554 17.445 -8.202 1.00 0.00 O ATOM 1824 CB SER B 120 -0.542 20.618 -9.049 1.00 0.00 C ATOM 1825 OG SER B 120 -1.069 21.653 -9.865 1.00 0.00 O ATOM 0 H SER B 120 -2.581 18.986 -9.363 1.00 0.00 H new ATOM 0 HA SER B 120 0.020 19.351 -10.715 1.00 0.00 H new ATOM 0 HB2 SER B 120 -1.129 20.537 -8.134 1.00 0.00 H new ATOM 0 HB3 SER B 120 0.477 20.867 -8.753 1.00 0.00 H new ATOM 0 HG SER B 120 -1.054 22.499 -9.371 1.00 0.00 H new ATOM 1831 N MET B 121 1.455 18.133 -8.945 1.00 0.00 N ATOM 1832 CA MET B 121 2.272 17.131 -8.241 1.00 0.00 C ATOM 1833 C MET B 121 1.953 16.953 -6.749 1.00 0.00 C ATOM 1834 O MET B 121 1.951 15.824 -6.274 1.00 0.00 O ATOM 1835 CB MET B 121 3.769 17.421 -8.467 1.00 0.00 C ATOM 1836 CG MET B 121 4.349 18.600 -7.664 1.00 0.00 C ATOM 1837 SD MET B 121 3.554 20.213 -7.896 1.00 0.00 S ATOM 1838 CE MET B 121 4.526 21.175 -6.715 1.00 0.00 C ATOM 0 H MET B 121 2.018 18.800 -9.473 1.00 0.00 H new ATOM 0 HA MET B 121 2.006 16.171 -8.683 1.00 0.00 H new ATOM 0 HB2 MET B 121 4.336 16.523 -8.220 1.00 0.00 H new ATOM 0 HB3 MET B 121 3.927 17.615 -9.528 1.00 0.00 H new ATOM 0 HG2 MET B 121 4.301 18.346 -6.605 1.00 0.00 H new ATOM 0 HG3 MET B 121 5.404 18.700 -7.921 1.00 0.00 H new ATOM 0 HE1 MET B 121 4.180 22.208 -6.715 1.00 0.00 H new ATOM 0 HE2 MET B 121 4.408 20.753 -5.717 1.00 0.00 H new ATOM 0 HE3 MET B 121 5.578 21.145 -6.999 1.00 0.00 H new ATOM 1848 N ASP B 122 1.640 18.023 -6.011 1.00 0.00 N ATOM 1849 CA ASP B 122 1.306 17.984 -4.577 1.00 0.00 C ATOM 1850 C ASP B 122 0.064 17.114 -4.279 1.00 0.00 C ATOM 1851 O ASP B 122 0.051 16.357 -3.301 1.00 0.00 O ATOM 1852 CB ASP B 122 1.103 19.436 -4.112 1.00 0.00 C ATOM 1853 CG ASP B 122 0.849 19.566 -2.609 1.00 0.00 C ATOM 1854 OD1 ASP B 122 1.826 19.717 -1.838 1.00 0.00 O ATOM 1855 OD2 ASP B 122 -0.330 19.587 -2.193 1.00 0.00 O ATOM 0 H ASP B 122 1.610 18.965 -6.401 1.00 0.00 H new ATOM 0 HA ASP B 122 2.122 17.515 -4.027 1.00 0.00 H new ATOM 0 HB2 ASP B 122 1.985 20.020 -4.375 1.00 0.00 H new ATOM 0 HB3 ASP B 122 0.261 19.868 -4.653 1.00 0.00 H new ATOM 1860 N THR B 123 -0.943 17.183 -5.161 1.00 0.00 N ATOM 1861 CA THR B 123 -2.165 16.360 -5.154 1.00 0.00 C ATOM 1862 C THR B 123 -1.845 14.923 -5.542 1.00 0.00 C ATOM 1863 O THR B 123 -2.305 13.996 -4.877 1.00 0.00 O ATOM 1864 CB THR B 123 -3.187 16.961 -6.126 1.00 0.00 C ATOM 1865 OG1 THR B 123 -3.516 18.258 -5.676 1.00 0.00 O ATOM 1866 CG2 THR B 123 -4.486 16.166 -6.270 1.00 0.00 C ATOM 0 H THR B 123 -0.929 17.845 -5.937 1.00 0.00 H new ATOM 0 HA THR B 123 -2.585 16.352 -4.148 1.00 0.00 H new ATOM 0 HB THR B 123 -2.712 16.953 -7.107 1.00 0.00 H new ATOM 0 HG1 THR B 123 -4.168 18.660 -6.287 1.00 0.00 H new ATOM 0 HG21 THR B 123 -5.144 16.670 -6.978 1.00 0.00 H new ATOM 0 HG22 THR B 123 -4.261 15.164 -6.634 1.00 0.00 H new ATOM 0 HG23 THR B 123 -4.980 16.097 -5.301 1.00 0.00 H new ATOM 1874 N LEU B 124 -1.043 14.721 -6.591 1.00 0.00 N ATOM 1875 CA LEU B 124 -0.640 13.383 -7.042 1.00 0.00 C ATOM 1876 C LEU B 124 0.179 12.644 -5.970 1.00 0.00 C ATOM 1877 O LEU B 124 -0.078 11.469 -5.719 1.00 0.00 O ATOM 1878 CB LEU B 124 0.108 13.491 -8.387 1.00 0.00 C ATOM 1879 CG LEU B 124 -0.750 14.034 -9.554 1.00 0.00 C ATOM 1880 CD1 LEU B 124 0.130 14.237 -10.792 1.00 0.00 C ATOM 1881 CD2 LEU B 124 -1.918 13.097 -9.910 1.00 0.00 C ATOM 0 H LEU B 124 -0.654 15.479 -7.152 1.00 0.00 H new ATOM 0 HA LEU B 124 -1.534 12.780 -7.201 1.00 0.00 H new ATOM 0 HB2 LEU B 124 0.974 14.140 -8.256 1.00 0.00 H new ATOM 0 HB3 LEU B 124 0.487 12.506 -8.658 1.00 0.00 H new ATOM 0 HG LEU B 124 -1.175 14.983 -9.227 1.00 0.00 H new ATOM 0 HD11 LEU B 124 -0.478 14.620 -11.612 1.00 0.00 H new ATOM 0 HD12 LEU B 124 0.921 14.951 -10.563 1.00 0.00 H new ATOM 0 HD13 LEU B 124 0.574 13.285 -11.083 1.00 0.00 H new ATOM 0 HD21 LEU B 124 -2.489 13.524 -10.735 1.00 0.00 H new ATOM 0 HD22 LEU B 124 -1.527 12.124 -10.205 1.00 0.00 H new ATOM 0 HD23 LEU B 124 -2.567 12.979 -9.042 1.00 0.00 H new ATOM 1893 N LEU B 125 1.083 13.337 -5.267 1.00 0.00 N ATOM 1894 CA LEU B 125 1.807 12.819 -4.101 1.00 0.00 C ATOM 1895 C LEU B 125 0.859 12.442 -2.956 1.00 0.00 C ATOM 1896 O LEU B 125 1.043 11.389 -2.352 1.00 0.00 O ATOM 1897 CB LEU B 125 2.839 13.866 -3.630 1.00 0.00 C ATOM 1898 CG LEU B 125 4.080 14.013 -4.536 1.00 0.00 C ATOM 1899 CD1 LEU B 125 4.854 15.275 -4.129 1.00 0.00 C ATOM 1900 CD2 LEU B 125 5.003 12.788 -4.451 1.00 0.00 C ATOM 0 H LEU B 125 1.337 14.297 -5.499 1.00 0.00 H new ATOM 0 HA LEU B 125 2.322 11.906 -4.400 1.00 0.00 H new ATOM 0 HB2 LEU B 125 2.344 14.834 -3.557 1.00 0.00 H new ATOM 0 HB3 LEU B 125 3.170 13.601 -2.626 1.00 0.00 H new ATOM 0 HG LEU B 125 3.738 14.093 -5.568 1.00 0.00 H new ATOM 0 HD11 LEU B 125 5.732 15.384 -4.766 1.00 0.00 H new ATOM 0 HD12 LEU B 125 4.212 16.148 -4.243 1.00 0.00 H new ATOM 0 HD13 LEU B 125 5.168 15.189 -3.089 1.00 0.00 H new ATOM 0 HD21 LEU B 125 5.863 12.934 -5.104 1.00 0.00 H new ATOM 0 HD22 LEU B 125 5.345 12.661 -3.424 1.00 0.00 H new ATOM 0 HD23 LEU B 125 4.457 11.898 -4.764 1.00 0.00 H new ATOM 1912 N ALA B 126 -0.171 13.246 -2.672 1.00 0.00 N ATOM 1913 CA ALA B 126 -1.154 12.945 -1.622 1.00 0.00 C ATOM 1914 C ALA B 126 -1.999 11.689 -1.924 1.00 0.00 C ATOM 1915 O ALA B 126 -2.451 11.025 -0.988 1.00 0.00 O ATOM 1916 CB ALA B 126 -2.028 14.185 -1.400 1.00 0.00 C ATOM 0 H ALA B 126 -0.348 14.123 -3.162 1.00 0.00 H new ATOM 0 HA ALA B 126 -0.616 12.705 -0.705 1.00 0.00 H new ATOM 0 HB1 ALA B 126 -2.763 13.977 -0.623 1.00 0.00 H new ATOM 0 HB2 ALA B 126 -1.401 15.022 -1.092 1.00 0.00 H new ATOM 0 HB3 ALA B 126 -2.542 14.439 -2.327 1.00 0.00 H new ATOM 1922 N THR B 127 -2.186 11.342 -3.206 1.00 0.00 N ATOM 1923 CA THR B 127 -2.688 10.030 -3.646 1.00 0.00 C ATOM 1924 C THR B 127 -1.617 8.958 -3.464 1.00 0.00 C ATOM 1925 O THR B 127 -1.852 8.004 -2.734 1.00 0.00 O ATOM 1926 CB THR B 127 -3.227 10.119 -5.079 1.00 0.00 C ATOM 1927 OG1 THR B 127 -4.490 10.733 -4.995 1.00 0.00 O ATOM 1928 CG2 THR B 127 -3.417 8.774 -5.781 1.00 0.00 C ATOM 0 H THR B 127 -1.989 11.976 -3.980 1.00 0.00 H new ATOM 0 HA THR B 127 -3.528 9.730 -3.019 1.00 0.00 H new ATOM 0 HB THR B 127 -2.491 10.669 -5.666 1.00 0.00 H new ATOM 0 HG1 THR B 127 -4.486 11.562 -5.517 1.00 0.00 H new ATOM 0 HG21 THR B 127 -3.801 8.940 -6.787 1.00 0.00 H new ATOM 0 HG22 THR B 127 -2.460 8.255 -5.839 1.00 0.00 H new ATOM 0 HG23 THR B 127 -4.126 8.167 -5.218 1.00 0.00 H new ATOM 1936 N LEU B 128 -0.444 9.105 -4.087 1.00 0.00 N ATOM 1937 CA LEU B 128 0.603 8.072 -4.128 1.00 0.00 C ATOM 1938 C LEU B 128 1.093 7.622 -2.742 1.00 0.00 C ATOM 1939 O LEU B 128 1.400 6.444 -2.565 1.00 0.00 O ATOM 1940 CB LEU B 128 1.783 8.583 -4.977 1.00 0.00 C ATOM 1941 CG LEU B 128 1.521 8.585 -6.498 1.00 0.00 C ATOM 1942 CD1 LEU B 128 2.594 9.421 -7.213 1.00 0.00 C ATOM 1943 CD2 LEU B 128 1.528 7.153 -7.060 1.00 0.00 C ATOM 0 H LEU B 128 -0.188 9.957 -4.586 1.00 0.00 H new ATOM 0 HA LEU B 128 0.157 7.186 -4.580 1.00 0.00 H new ATOM 0 HB2 LEU B 128 2.029 9.597 -4.662 1.00 0.00 H new ATOM 0 HB3 LEU B 128 2.657 7.965 -4.772 1.00 0.00 H new ATOM 0 HG LEU B 128 0.538 9.022 -6.672 1.00 0.00 H new ATOM 0 HD11 LEU B 128 2.403 9.418 -8.286 1.00 0.00 H new ATOM 0 HD12 LEU B 128 2.564 10.446 -6.842 1.00 0.00 H new ATOM 0 HD13 LEU B 128 3.578 8.993 -7.019 1.00 0.00 H new ATOM 0 HD21 LEU B 128 1.341 7.183 -8.133 1.00 0.00 H new ATOM 0 HD22 LEU B 128 2.499 6.694 -6.873 1.00 0.00 H new ATOM 0 HD23 LEU B 128 0.749 6.567 -6.572 1.00 0.00 H new ATOM 1955 N LYS B 129 1.116 8.504 -1.740 1.00 0.00 N ATOM 1956 CA LYS B 129 1.462 8.152 -0.353 1.00 0.00 C ATOM 1957 C LYS B 129 0.563 7.048 0.242 1.00 0.00 C ATOM 1958 O LYS B 129 1.035 6.263 1.061 1.00 0.00 O ATOM 1959 CB LYS B 129 1.429 9.430 0.502 1.00 0.00 C ATOM 1960 CG LYS B 129 2.652 10.322 0.234 1.00 0.00 C ATOM 1961 CD LYS B 129 2.410 11.755 0.718 1.00 0.00 C ATOM 1962 CE LYS B 129 3.596 12.647 0.342 1.00 0.00 C ATOM 1963 NZ LYS B 129 3.284 14.077 0.561 1.00 0.00 N ATOM 0 H LYS B 129 0.894 9.492 -1.865 1.00 0.00 H new ATOM 0 HA LYS B 129 2.466 7.728 -0.352 1.00 0.00 H new ATOM 0 HB2 LYS B 129 0.517 9.988 0.288 1.00 0.00 H new ATOM 0 HB3 LYS B 129 1.398 9.161 1.558 1.00 0.00 H new ATOM 0 HG2 LYS B 129 3.525 9.908 0.738 1.00 0.00 H new ATOM 0 HG3 LYS B 129 2.874 10.328 -0.833 1.00 0.00 H new ATOM 0 HD2 LYS B 129 1.495 12.147 0.274 1.00 0.00 H new ATOM 0 HD3 LYS B 129 2.268 11.763 1.799 1.00 0.00 H new ATOM 0 HE2 LYS B 129 4.467 12.367 0.935 1.00 0.00 H new ATOM 0 HE3 LYS B 129 3.858 12.486 -0.704 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 4.107 14.656 0.297 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 2.468 14.348 -0.024 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 3.058 14.233 1.564 1.00 0.00 H new ATOM 1977 N LYS B 130 -0.679 6.887 -0.237 1.00 0.00 N ATOM 1978 CA LYS B 130 -1.603 5.809 0.170 1.00 0.00 C ATOM 1979 C LYS B 130 -1.111 4.395 -0.223 1.00 0.00 C ATOM 1980 O LYS B 130 -1.597 3.401 0.310 1.00 0.00 O ATOM 1981 CB LYS B 130 -3.008 6.095 -0.397 1.00 0.00 C ATOM 1982 CG LYS B 130 -3.586 7.449 0.061 1.00 0.00 C ATOM 1983 CD LYS B 130 -4.903 7.772 -0.657 1.00 0.00 C ATOM 1984 CE LYS B 130 -5.418 9.157 -0.242 1.00 0.00 C ATOM 1985 NZ LYS B 130 -6.664 9.518 -0.958 1.00 0.00 N ATOM 0 H LYS B 130 -1.081 7.514 -0.933 1.00 0.00 H new ATOM 0 HA LYS B 130 -1.642 5.807 1.259 1.00 0.00 H new ATOM 0 HB2 LYS B 130 -2.964 6.076 -1.486 1.00 0.00 H new ATOM 0 HB3 LYS B 130 -3.685 5.297 -0.092 1.00 0.00 H new ATOM 0 HG2 LYS B 130 -3.753 7.428 1.138 1.00 0.00 H new ATOM 0 HG3 LYS B 130 -2.861 8.239 -0.134 1.00 0.00 H new ATOM 0 HD2 LYS B 130 -4.752 7.742 -1.736 1.00 0.00 H new ATOM 0 HD3 LYS B 130 -5.649 7.014 -0.419 1.00 0.00 H new ATOM 0 HE2 LYS B 130 -5.599 9.170 0.833 1.00 0.00 H new ATOM 0 HE3 LYS B 130 -4.652 9.905 -0.445 1.00 0.00 H new ATOM 0 HZ1 LYS B 130 -6.980 10.460 -0.651 1.00 0.00 H new ATOM 0 HZ2 LYS B 130 -6.485 9.530 -1.982 1.00 0.00 H new ATOM 0 HZ3 LYS B 130 -7.403 8.818 -0.744 1.00 0.00 H new ATOM 1999 N THR B 131 -0.096 4.286 -1.101 1.00 0.00 N ATOM 2000 CA THR B 131 0.634 3.026 -1.363 1.00 0.00 C ATOM 2001 C THR B 131 1.451 2.547 -0.158 1.00 0.00 C ATOM 2002 O THR B 131 1.852 1.384 -0.141 1.00 0.00 O ATOM 2003 CB THR B 131 1.553 3.118 -2.588 1.00 0.00 C ATOM 2004 OG1 THR B 131 2.577 4.053 -2.357 1.00 0.00 O ATOM 2005 CG2 THR B 131 0.831 3.480 -3.884 1.00 0.00 C ATOM 0 H THR B 131 0.244 5.073 -1.653 1.00 0.00 H new ATOM 0 HA THR B 131 -0.147 2.293 -1.565 1.00 0.00 H new ATOM 0 HB THR B 131 1.961 2.117 -2.724 1.00 0.00 H new ATOM 0 HG1 THR B 131 2.231 4.959 -2.498 1.00 0.00 H new ATOM 0 HG21 THR B 131 1.551 3.525 -4.701 1.00 0.00 H new ATOM 0 HG22 THR B 131 0.078 2.723 -4.105 1.00 0.00 H new ATOM 0 HG23 THR B 131 0.348 4.451 -3.772 1.00 0.00 H new ATOM 2013 N GLY B 132 1.725 3.423 0.821 1.00 0.00 N ATOM 2014 CA GLY B 132 2.542 3.154 2.006 1.00 0.00 C ATOM 2015 C GLY B 132 4.013 3.009 1.632 1.00 0.00 C ATOM 2016 O GLY B 132 4.546 1.904 1.703 1.00 0.00 O ATOM 0 H GLY B 132 1.366 4.378 0.804 1.00 0.00 H new ATOM 0 HA2 GLY B 132 2.424 3.964 2.726 1.00 0.00 H new ATOM 0 HA3 GLY B 132 2.195 2.242 2.493 1.00 0.00 H new ATOM 2020 N LYS B 133 4.647 4.088 1.159 1.00 0.00 N ATOM 2021 CA LYS B 133 6.007 4.087 0.588 1.00 0.00 C ATOM 2022 C LYS B 133 6.703 5.456 0.612 1.00 0.00 C ATOM 2023 O LYS B 133 6.038 6.496 0.607 1.00 0.00 O ATOM 2024 CB LYS B 133 5.958 3.495 -0.842 1.00 0.00 C ATOM 2025 CG LYS B 133 6.586 2.091 -0.923 1.00 0.00 C ATOM 2026 CD LYS B 133 6.016 1.225 -2.058 1.00 0.00 C ATOM 2027 CE LYS B 133 4.550 0.826 -1.831 1.00 0.00 C ATOM 2028 NZ LYS B 133 4.344 0.157 -0.521 1.00 0.00 N ATOM 0 H LYS B 133 4.220 5.014 1.161 1.00 0.00 H new ATOM 0 HA LYS B 133 6.624 3.459 1.230 1.00 0.00 H new ATOM 0 HB2 LYS B 133 4.921 3.445 -1.175 1.00 0.00 H new ATOM 0 HB3 LYS B 133 6.481 4.163 -1.526 1.00 0.00 H new ATOM 0 HG2 LYS B 133 7.663 2.191 -1.060 1.00 0.00 H new ATOM 0 HG3 LYS B 133 6.432 1.578 0.026 1.00 0.00 H new ATOM 0 HD2 LYS B 133 6.097 1.770 -2.999 1.00 0.00 H new ATOM 0 HD3 LYS B 133 6.621 0.324 -2.158 1.00 0.00 H new ATOM 0 HE2 LYS B 133 3.921 1.715 -1.885 1.00 0.00 H new ATOM 0 HE3 LYS B 133 4.229 0.159 -2.631 1.00 0.00 H new ATOM 0 HZ1 LYS B 133 3.364 -0.184 -0.456 1.00 0.00 H new ATOM 0 HZ2 LYS B 133 4.997 -0.648 -0.436 1.00 0.00 H new ATOM 0 HZ3 LYS B 133 4.527 0.834 0.247 1.00 0.00 H new ATOM 2042 N THR B 134 8.043 5.443 0.569 1.00 0.00 N ATOM 2043 CA THR B 134 8.865 6.605 0.208 1.00 0.00 C ATOM 2044 C THR B 134 8.662 6.870 -1.280 1.00 0.00 C ATOM 2045 O THR B 134 9.111 6.084 -2.115 1.00 0.00 O ATOM 2046 CB THR B 134 10.351 6.377 0.516 1.00 0.00 C ATOM 2047 OG1 THR B 134 10.515 5.897 1.829 1.00 0.00 O ATOM 2048 CG2 THR B 134 11.146 7.679 0.401 1.00 0.00 C ATOM 0 H THR B 134 8.593 4.612 0.787 1.00 0.00 H new ATOM 0 HA THR B 134 8.556 7.465 0.802 1.00 0.00 H new ATOM 0 HB THR B 134 10.718 5.650 -0.209 1.00 0.00 H new ATOM 0 HG1 THR B 134 11.468 5.755 2.009 1.00 0.00 H new ATOM 0 HG21 THR B 134 12.195 7.486 0.625 1.00 0.00 H new ATOM 0 HG22 THR B 134 11.057 8.071 -0.612 1.00 0.00 H new ATOM 0 HG23 THR B 134 10.753 8.409 1.108 1.00 0.00 H new ATOM 2056 N VAL B 135 7.967 7.958 -1.587 1.00 0.00 N ATOM 2057 CA VAL B 135 7.659 8.432 -2.951 1.00 0.00 C ATOM 2058 C VAL B 135 8.217 9.841 -3.192 1.00 0.00 C ATOM 2059 O VAL B 135 8.105 10.715 -2.335 1.00 0.00 O ATOM 2060 CB VAL B 135 6.141 8.367 -3.253 1.00 0.00 C ATOM 2061 CG1 VAL B 135 5.257 9.147 -2.260 1.00 0.00 C ATOM 2062 CG2 VAL B 135 5.832 8.845 -4.683 1.00 0.00 C ATOM 0 H VAL B 135 7.581 8.569 -0.867 1.00 0.00 H new ATOM 0 HA VAL B 135 8.155 7.756 -3.647 1.00 0.00 H new ATOM 0 HB VAL B 135 5.888 7.312 -3.143 1.00 0.00 H new ATOM 0 HG11 VAL B 135 4.211 9.046 -2.548 1.00 0.00 H new ATOM 0 HG12 VAL B 135 5.397 8.747 -1.256 1.00 0.00 H new ATOM 0 HG13 VAL B 135 5.537 10.200 -2.273 1.00 0.00 H new ATOM 0 HG21 VAL B 135 4.758 8.787 -4.862 1.00 0.00 H new ATOM 0 HG22 VAL B 135 6.164 9.876 -4.802 1.00 0.00 H new ATOM 0 HG23 VAL B 135 6.354 8.211 -5.399 1.00 0.00 H new ATOM 2072 N SER B 136 8.798 10.062 -4.374 1.00 0.00 N ATOM 2073 CA SER B 136 9.432 11.331 -4.760 1.00 0.00 C ATOM 2074 C SER B 136 8.932 11.860 -6.107 1.00 0.00 C ATOM 2075 O SER B 136 8.720 11.094 -7.047 1.00 0.00 O ATOM 2076 CB SER B 136 10.954 11.163 -4.881 1.00 0.00 C ATOM 2077 OG SER B 136 11.531 10.652 -3.692 1.00 0.00 O ATOM 0 H SER B 136 8.843 9.352 -5.105 1.00 0.00 H new ATOM 0 HA SER B 136 9.169 12.039 -3.974 1.00 0.00 H new ATOM 0 HB2 SER B 136 11.179 10.492 -5.710 1.00 0.00 H new ATOM 0 HB3 SER B 136 11.407 12.126 -5.118 1.00 0.00 H new ATOM 0 HG SER B 136 12.499 10.559 -3.812 1.00 0.00 H new ATOM 2083 N TYR B 137 8.829 13.185 -6.221 1.00 0.00 N ATOM 2084 CA TYR B 137 8.585 13.923 -7.465 1.00 0.00 C ATOM 2085 C TYR B 137 9.907 14.438 -8.077 1.00 0.00 C ATOM 2086 O TYR B 137 10.762 14.958 -7.354 1.00 0.00 O ATOM 2087 CB TYR B 137 7.622 15.071 -7.132 1.00 0.00 C ATOM 2088 CG TYR B 137 7.563 16.185 -8.155 1.00 0.00 C ATOM 2089 CD1 TYR B 137 6.928 15.986 -9.396 1.00 0.00 C ATOM 2090 CD2 TYR B 137 8.162 17.424 -7.861 1.00 0.00 C ATOM 2091 CE1 TYR B 137 6.859 17.041 -10.325 1.00 0.00 C ATOM 2092 CE2 TYR B 137 8.113 18.473 -8.794 1.00 0.00 C ATOM 2093 CZ TYR B 137 7.449 18.287 -10.025 1.00 0.00 C ATOM 2094 OH TYR B 137 7.397 19.295 -10.933 1.00 0.00 O ATOM 0 H TYR B 137 8.917 13.802 -5.414 1.00 0.00 H new ATOM 0 HA TYR B 137 8.141 13.272 -8.218 1.00 0.00 H new ATOM 0 HB2 TYR B 137 6.620 14.659 -7.010 1.00 0.00 H new ATOM 0 HB3 TYR B 137 7.910 15.498 -6.171 1.00 0.00 H new ATOM 0 HD1 TYR B 137 6.495 15.026 -9.634 1.00 0.00 H new ATOM 0 HD2 TYR B 137 8.661 17.569 -6.914 1.00 0.00 H new ATOM 0 HE1 TYR B 137 6.354 16.897 -11.269 1.00 0.00 H new ATOM 0 HE2 TYR B 137 8.582 19.419 -8.570 1.00 0.00 H new ATOM 0 HH TYR B 137 7.849 20.085 -10.571 1.00 0.00 H new ATOM 2104 N LEU B 138 10.063 14.298 -9.401 1.00 0.00 N ATOM 2105 CA LEU B 138 11.290 14.573 -10.166 1.00 0.00 C ATOM 2106 C LEU B 138 11.008 15.426 -11.425 1.00 0.00 C ATOM 2107 O LEU B 138 11.413 15.096 -12.549 1.00 0.00 O ATOM 2108 CB LEU B 138 11.964 13.225 -10.516 1.00 0.00 C ATOM 2109 CG LEU B 138 12.435 12.373 -9.318 1.00 0.00 C ATOM 2110 CD1 LEU B 138 12.977 11.038 -9.844 1.00 0.00 C ATOM 2111 CD2 LEU B 138 13.533 13.068 -8.498 1.00 0.00 C ATOM 0 H LEU B 138 9.301 13.974 -9.997 1.00 0.00 H new ATOM 0 HA LEU B 138 11.970 15.167 -9.556 1.00 0.00 H new ATOM 0 HB2 LEU B 138 11.263 12.633 -11.104 1.00 0.00 H new ATOM 0 HB3 LEU B 138 12.825 13.427 -11.154 1.00 0.00 H new ATOM 0 HG LEU B 138 11.579 12.223 -8.661 1.00 0.00 H new ATOM 0 HD11 LEU B 138 13.313 10.427 -9.007 1.00 0.00 H new ATOM 0 HD12 LEU B 138 12.189 10.513 -10.384 1.00 0.00 H new ATOM 0 HD13 LEU B 138 13.815 11.225 -10.516 1.00 0.00 H new ATOM 0 HD21 LEU B 138 13.828 12.426 -7.668 1.00 0.00 H new ATOM 0 HD22 LEU B 138 14.397 13.258 -9.135 1.00 0.00 H new ATOM 0 HD23 LEU B 138 13.154 14.013 -8.109 1.00 0.00 H new ATOM 2123 N GLY B 139 10.371 16.580 -11.213 1.00 0.00 N ATOM 2124 CA GLY B 139 10.266 17.669 -12.190 1.00 0.00 C ATOM 2125 C GLY B 139 9.058 17.628 -13.135 1.00 0.00 C ATOM 2126 O GLY B 139 8.403 16.600 -13.332 1.00 0.00 O ATOM 0 H GLY B 139 9.900 16.790 -10.333 1.00 0.00 H new ATOM 0 HA2 GLY B 139 10.242 18.614 -11.647 1.00 0.00 H new ATOM 0 HA3 GLY B 139 11.172 17.673 -12.795 1.00 0.00 H new ATOM 2130 N LEU B 140 8.808 18.792 -13.743 1.00 0.00 N ATOM 2131 CA LEU B 140 7.785 19.060 -14.758 1.00 0.00 C ATOM 2132 C LEU B 140 8.434 19.074 -16.151 1.00 0.00 C ATOM 2133 O LEU B 140 9.582 19.509 -16.305 1.00 0.00 O ATOM 2134 CB LEU B 140 7.123 20.416 -14.419 1.00 0.00 C ATOM 2135 CG LEU B 140 5.753 20.681 -15.079 1.00 0.00 C ATOM 2136 CD1 LEU B 140 4.664 19.760 -14.510 1.00 0.00 C ATOM 2137 CD2 LEU B 140 5.328 22.134 -14.826 1.00 0.00 C ATOM 0 H LEU B 140 9.351 19.627 -13.524 1.00 0.00 H new ATOM 0 HA LEU B 140 7.020 18.283 -14.764 1.00 0.00 H new ATOM 0 HB2 LEU B 140 7.002 20.479 -13.338 1.00 0.00 H new ATOM 0 HB3 LEU B 140 7.805 21.214 -14.710 1.00 0.00 H new ATOM 0 HG LEU B 140 5.862 20.487 -16.146 1.00 0.00 H new ATOM 0 HD11 LEU B 140 3.714 19.975 -14.998 1.00 0.00 H new ATOM 0 HD12 LEU B 140 4.937 18.720 -14.689 1.00 0.00 H new ATOM 0 HD13 LEU B 140 4.568 19.930 -13.438 1.00 0.00 H new ATOM 0 HD21 LEU B 140 4.360 22.317 -15.294 1.00 0.00 H new ATOM 0 HD22 LEU B 140 5.251 22.309 -13.753 1.00 0.00 H new ATOM 0 HD23 LEU B 140 6.070 22.810 -15.252 1.00 0.00 H new ATOM 2149 N GLU B 141 7.715 18.607 -17.170 1.00 0.00 N ATOM 2150 CA GLU B 141 8.214 18.457 -18.547 1.00 0.00 C ATOM 2151 C GLU B 141 8.294 19.779 -19.323 1.00 0.00 C ATOM 2152 O GLU B 141 7.364 20.615 -19.257 1.00 0.00 O ATOM 2153 CB GLU B 141 7.355 17.392 -19.253 1.00 0.00 C ATOM 2154 CG GLU B 141 7.803 17.030 -20.675 1.00 0.00 C ATOM 2155 CD GLU B 141 9.257 16.536 -20.772 1.00 0.00 C ATOM 2156 OE1 GLU B 141 9.767 15.844 -19.857 1.00 0.00 O ATOM 2157 OE2 GLU B 141 9.945 16.876 -21.769 1.00 0.00 O ATOM 2158 OXT GLU B 141 9.318 19.989 -20.013 1.00 0.00 O ATOM 0 H GLU B 141 6.744 18.313 -17.064 1.00 0.00 H new ATOM 0 HA GLU B 141 9.251 18.124 -18.512 1.00 0.00 H new ATOM 0 HB2 GLU B 141 7.357 16.486 -18.647 1.00 0.00 H new ATOM 0 HB3 GLU B 141 6.325 17.747 -19.293 1.00 0.00 H new ATOM 0 HG2 GLU B 141 7.142 16.257 -21.066 1.00 0.00 H new ATOM 0 HG3 GLU B 141 7.685 17.905 -21.315 1.00 0.00 H new TER 2165 GLU B 141 HETATM 2166 CU CU A 142 6.040 -6.762 -4.258 1.00 0.00 CU