USER MOD reduce.3.24.130724 H: found=0, std=0, add=1215, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1224 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 102 HIS : no HD1:sc= -0.984 K(o=-3.4,f=-6.7) USER MOD Set 1.2: A 126 GLN :FLIP amide:sc= -2.39! C(o=-6.3!,f=-3.4!) USER MOD Set 2.1: A 66 MET CE :methyl -170:sc= -0.0241 (180deg=0) USER MOD Set 2.2: A 106 HIS :FLIP no HD1:sc= -5.85! C(o=-24!,f=-18!) USER MOD Set 2.3: A 110 TYR OH : rot -68:sc= 0.0485 USER MOD Set 2.4: A 112 HIS :FLIP no HD1:sc= -0.02 F(o=-19,f=-18) USER MOD Set 2.5: A 122 MET CE :methyl -120:sc= -12.4! (180deg=-16.7!) USER MOD Single : A 1 MET CE :methyl -103:sc= -4.55 (180deg=-11.8!) USER MOD Single : A 1 MET N :NH3+ -141:sc= -0.167 (180deg=-1.73!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot 180:sc= -0.0622 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= -1.79 K(o=-1.8,f=-4.6!) USER MOD Single : A 18 LYS NZ :NH3+ 139:sc= -0.321 (180deg=-1.24) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HD1:sc= -0.509 X(o=-0.51,f=-0.056) USER MOD Single : A 35 ASN : amide:sc= -2.06! C(o=-2.1!,f=-4.3!) USER MOD Single : A 40 SER OG : rot 180:sc= -1.02 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc= -1.18! K(o=-1.2!,f=-3) USER MOD Single : A 49 GLN : amide:sc= -0.0506 K(o=-0.051,f=-1.9!) USER MOD Single : A 50 GLN : amide:sc= -0.428 K(o=-0.43,f=-1.2) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 58 THR OG1 : rot 180:sc= -0.388 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 TYR OH : rot -50:sc= 1.12 USER MOD Single : A 77 CYS SG : rot 39:sc= -5.84! USER MOD Single : A 84 ASN : amide:sc= -4.08! C(o=-4.1!,f=-6.6!) USER MOD Single : A 89 ASN :FLIP amide:sc= -1.48! C(o=-2.2!,f=-1.5!) USER MOD Single : A 90 ASN : amide:sc= -0.116 X(o=-0.12,f=-0.11) USER MOD Single : A 91 THR OG1 : rot 170:sc= 0.349 USER MOD Single : A 94 LYS NZ :NH3+ -155:sc= -2.95! (180deg=-3.36!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 ASN : amide:sc= -0.199 K(o=-0.2,f=-2.5!) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ 158:sc= 0.0306 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ -142:sc= 0.28 (180deg=-1.55!) USER MOD Single : A 128 LYS NZ :NH3+ -179:sc= -0.0158 (180deg=-0.0159) USER MOD Single : A 129 TYR OH : rot 165:sc= 0 USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 140 ASN : amide:sc= -1.98 X(o=-2,f=-1.8) USER MOD Single : A 142 SER OG : rot 180:sc= -0.0177 USER MOD Single : A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.869 -0.327 14.661 1.00 0.00 N ATOM 2 CA MET A 1 -0.065 -1.421 14.457 1.00 0.00 C ATOM 3 C MET A 1 0.250 -2.175 13.163 1.00 0.00 C ATOM 4 O MET A 1 0.008 -3.377 13.066 1.00 0.00 O ATOM 5 CB MET A 1 -1.491 -0.870 14.393 1.00 0.00 C ATOM 6 CG MET A 1 -2.503 -1.995 14.168 1.00 0.00 C ATOM 7 SD MET A 1 -3.557 -2.163 15.600 1.00 0.00 S ATOM 8 CE MET A 1 -4.801 -3.262 14.942 1.00 0.00 C ATOM 0 H1 MET A 1 1.112 -0.261 15.670 1.00 0.00 H new ATOM 0 H2 MET A 1 1.732 -0.500 14.108 1.00 0.00 H new ATOM 0 H3 MET A 1 0.432 0.565 14.351 1.00 0.00 H new ATOM 0 HA MET A 1 0.028 -2.115 15.292 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.724 -0.346 15.320 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.567 -0.141 13.587 1.00 0.00 H new ATOM 0 HG2 MET A 1 -3.106 -1.782 13.285 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.981 -2.933 13.978 1.00 0.00 H new ATOM 0 HE1 MET A 1 -5.701 -2.694 14.708 1.00 0.00 H new ATOM 0 HE2 MET A 1 -4.425 -3.736 14.035 1.00 0.00 H new ATOM 0 HE3 MET A 1 -5.037 -4.028 15.680 1.00 0.00 H new ATOM 18 N ILE A 2 0.784 -1.438 12.201 1.00 0.00 N ATOM 19 CA ILE A 2 1.134 -2.022 10.917 1.00 0.00 C ATOM 20 C ILE A 2 2.620 -2.384 10.914 1.00 0.00 C ATOM 21 O ILE A 2 3.401 -1.822 11.681 1.00 0.00 O ATOM 22 CB ILE A 2 0.726 -1.088 9.775 1.00 0.00 C ATOM 23 CG1 ILE A 2 -0.791 -0.895 9.740 1.00 0.00 C ATOM 24 CG2 ILE A 2 1.271 -1.590 8.436 1.00 0.00 C ATOM 25 CD1 ILE A 2 -1.216 0.271 10.635 1.00 0.00 C ATOM 0 H ILE A 2 0.983 -0.441 12.285 1.00 0.00 H new ATOM 0 HA ILE A 2 0.580 -2.947 10.755 1.00 0.00 H new ATOM 0 HB ILE A 2 1.171 -0.110 9.958 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -1.114 -0.708 8.716 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -1.285 -1.809 10.069 1.00 0.00 H new ATOM 0 HG21 ILE A 2 0.967 -0.909 7.641 1.00 0.00 H new ATOM 0 HG22 ILE A 2 2.359 -1.634 8.480 1.00 0.00 H new ATOM 0 HG23 ILE A 2 0.875 -2.585 8.232 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -2.299 0.387 10.592 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -0.913 0.070 11.663 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -0.739 1.188 10.289 1.00 0.00 H new ATOM 37 N ARG A 3 2.967 -3.320 10.044 1.00 0.00 N ATOM 38 CA ARG A 3 4.346 -3.764 9.931 1.00 0.00 C ATOM 39 C ARG A 3 5.036 -3.061 8.760 1.00 0.00 C ATOM 40 O ARG A 3 4.563 -3.126 7.627 1.00 0.00 O ATOM 41 CB ARG A 3 4.423 -5.278 9.725 1.00 0.00 C ATOM 42 CG ARG A 3 4.453 -6.013 11.066 1.00 0.00 C ATOM 43 CD ARG A 3 3.445 -7.164 11.084 1.00 0.00 C ATOM 44 NE ARG A 3 2.490 -6.984 12.200 1.00 0.00 N ATOM 45 CZ ARG A 3 2.852 -6.879 13.496 1.00 0.00 C ATOM 46 NH1 ARG A 3 4.154 -6.936 13.851 1.00 0.00 N ATOM 47 NH2 ARG A 3 1.915 -6.721 14.412 1.00 0.00 N ATOM 0 H ARG A 3 2.317 -3.784 9.410 1.00 0.00 H new ATOM 0 HA ARG A 3 4.853 -3.510 10.862 1.00 0.00 H new ATOM 0 HB2 ARG A 3 3.565 -5.613 9.142 1.00 0.00 H new ATOM 0 HB3 ARG A 3 5.316 -5.525 9.151 1.00 0.00 H new ATOM 0 HG2 ARG A 3 5.455 -6.400 11.250 1.00 0.00 H new ATOM 0 HG3 ARG A 3 4.228 -5.315 11.872 1.00 0.00 H new ATOM 0 HD2 ARG A 3 2.907 -7.202 10.137 1.00 0.00 H new ATOM 0 HD3 ARG A 3 3.968 -8.114 11.192 1.00 0.00 H new ATOM 0 HE ARG A 3 1.496 -6.936 11.976 1.00 0.00 H new ATOM 0 HH11 ARG A 3 4.872 -7.059 13.137 1.00 0.00 H new ATOM 0 HH12 ARG A 3 4.419 -6.856 14.833 1.00 0.00 H new ATOM 0 HH21 ARG A 3 0.934 -6.680 14.136 1.00 0.00 H new ATOM 0 HH22 ARG A 3 2.172 -6.640 15.396 1.00 0.00 H new ATOM 60 N ILE A 4 6.143 -2.405 9.075 1.00 0.00 N ATOM 61 CA ILE A 4 6.903 -1.691 8.063 1.00 0.00 C ATOM 62 C ILE A 4 8.193 -2.457 7.764 1.00 0.00 C ATOM 63 O ILE A 4 9.115 -2.469 8.577 1.00 0.00 O ATOM 64 CB ILE A 4 7.135 -0.240 8.491 1.00 0.00 C ATOM 65 CG1 ILE A 4 6.215 0.142 9.652 1.00 0.00 C ATOM 66 CG2 ILE A 4 6.986 0.713 7.303 1.00 0.00 C ATOM 67 CD1 ILE A 4 6.373 1.621 10.013 1.00 0.00 C ATOM 0 H ILE A 4 6.532 -2.353 10.017 1.00 0.00 H new ATOM 0 HA ILE A 4 6.340 -1.638 7.131 1.00 0.00 H new ATOM 0 HB ILE A 4 8.160 -0.149 8.849 1.00 0.00 H new ATOM 0 HG12 ILE A 4 5.179 -0.061 9.382 1.00 0.00 H new ATOM 0 HG13 ILE A 4 6.445 -0.475 10.521 1.00 0.00 H new ATOM 0 HG21 ILE A 4 7.156 1.737 7.635 1.00 0.00 H new ATOM 0 HG22 ILE A 4 7.715 0.454 6.535 1.00 0.00 H new ATOM 0 HG23 ILE A 4 5.980 0.627 6.891 1.00 0.00 H new ATOM 0 HD11 ILE A 4 5.708 1.866 10.841 1.00 0.00 H new ATOM 0 HD12 ILE A 4 7.405 1.816 10.306 1.00 0.00 H new ATOM 0 HD13 ILE A 4 6.119 2.235 9.149 1.00 0.00 H new ATOM 79 N LEU A 5 8.216 -3.079 6.594 1.00 0.00 N ATOM 80 CA LEU A 5 9.378 -3.847 6.178 1.00 0.00 C ATOM 81 C LEU A 5 10.340 -2.934 5.416 1.00 0.00 C ATOM 82 O LEU A 5 9.910 -2.023 4.710 1.00 0.00 O ATOM 83 CB LEU A 5 8.947 -5.083 5.386 1.00 0.00 C ATOM 84 CG LEU A 5 8.964 -6.409 6.151 1.00 0.00 C ATOM 85 CD1 LEU A 5 10.228 -7.210 5.832 1.00 0.00 C ATOM 86 CD2 LEU A 5 8.797 -6.176 7.654 1.00 0.00 C ATOM 0 H LEU A 5 7.449 -3.067 5.921 1.00 0.00 H new ATOM 0 HA LEU A 5 9.917 -4.225 7.047 1.00 0.00 H new ATOM 0 HB2 LEU A 5 7.937 -4.916 5.010 1.00 0.00 H new ATOM 0 HB3 LEU A 5 9.598 -5.179 4.517 1.00 0.00 H new ATOM 0 HG LEU A 5 8.113 -7.005 5.821 1.00 0.00 H new ATOM 0 HD11 LEU A 5 10.215 -8.147 6.388 1.00 0.00 H new ATOM 0 HD12 LEU A 5 10.264 -7.423 4.764 1.00 0.00 H new ATOM 0 HD13 LEU A 5 11.107 -6.631 6.117 1.00 0.00 H new ATOM 0 HD21 LEU A 5 8.812 -7.134 8.175 1.00 0.00 H new ATOM 0 HD22 LEU A 5 9.613 -5.552 8.018 1.00 0.00 H new ATOM 0 HD23 LEU A 5 7.846 -5.676 7.841 1.00 0.00 H new ATOM 98 N GLY A 6 11.625 -3.209 5.585 1.00 0.00 N ATOM 99 CA GLY A 6 12.653 -2.424 4.923 1.00 0.00 C ATOM 100 C GLY A 6 12.478 -0.932 5.218 1.00 0.00 C ATOM 101 O GLY A 6 12.015 -0.559 6.294 1.00 0.00 O ATOM 0 H GLY A 6 11.978 -3.965 6.171 1.00 0.00 H new ATOM 0 HA2 GLY A 6 13.637 -2.752 5.257 1.00 0.00 H new ATOM 0 HA3 GLY A 6 12.609 -2.593 3.847 1.00 0.00 H new ATOM 105 N GLU A 7 12.859 -0.120 4.242 1.00 0.00 N ATOM 106 CA GLU A 7 12.751 1.322 4.384 1.00 0.00 C ATOM 107 C GLU A 7 12.833 1.997 3.013 1.00 0.00 C ATOM 108 O GLU A 7 13.176 1.356 2.021 1.00 0.00 O ATOM 109 CB GLU A 7 13.828 1.862 5.327 1.00 0.00 C ATOM 110 CG GLU A 7 15.207 1.313 4.956 1.00 0.00 C ATOM 111 CD GLU A 7 15.706 0.327 6.014 1.00 0.00 C ATOM 112 OE1 GLU A 7 16.643 0.643 6.763 1.00 0.00 O ATOM 113 OE2 GLU A 7 15.084 -0.803 6.043 1.00 0.00 O ATOM 0 H GLU A 7 13.243 -0.433 3.350 1.00 0.00 H new ATOM 0 HA GLU A 7 11.781 1.553 4.824 1.00 0.00 H new ATOM 0 HB2 GLU A 7 13.842 2.951 5.283 1.00 0.00 H new ATOM 0 HB3 GLU A 7 13.588 1.588 6.354 1.00 0.00 H new ATOM 0 HG2 GLU A 7 15.156 0.817 3.987 1.00 0.00 H new ATOM 0 HG3 GLU A 7 15.915 2.135 4.857 1.00 0.00 H new ATOM 121 N GLY A 8 12.510 3.282 3.002 1.00 0.00 N ATOM 122 CA GLY A 8 12.543 4.051 1.770 1.00 0.00 C ATOM 123 C GLY A 8 11.313 4.953 1.654 1.00 0.00 C ATOM 124 O GLY A 8 10.296 4.710 2.303 1.00 0.00 O ATOM 0 H GLY A 8 12.224 3.810 3.827 1.00 0.00 H new ATOM 0 HA2 GLY A 8 13.448 4.658 1.740 1.00 0.00 H new ATOM 0 HA3 GLY A 8 12.584 3.375 0.916 1.00 0.00 H new ATOM 128 N LYS A 9 11.445 5.977 0.823 1.00 0.00 N ATOM 129 CA LYS A 9 10.357 6.917 0.614 1.00 0.00 C ATOM 130 C LYS A 9 9.032 6.154 0.570 1.00 0.00 C ATOM 131 O LYS A 9 8.720 5.501 -0.425 1.00 0.00 O ATOM 132 CB LYS A 9 10.618 7.770 -0.629 1.00 0.00 C ATOM 133 CG LYS A 9 10.113 9.200 -0.428 1.00 0.00 C ATOM 134 CD LYS A 9 9.955 9.920 -1.769 1.00 0.00 C ATOM 135 CE LYS A 9 9.069 11.159 -1.625 1.00 0.00 C ATOM 136 NZ LYS A 9 9.794 12.369 -2.072 1.00 0.00 N ATOM 0 H LYS A 9 12.289 6.176 0.286 1.00 0.00 H new ATOM 0 HA LYS A 9 10.294 7.619 1.446 1.00 0.00 H new ATOM 0 HB2 LYS A 9 11.686 7.785 -0.847 1.00 0.00 H new ATOM 0 HB3 LYS A 9 10.123 7.323 -1.491 1.00 0.00 H new ATOM 0 HG2 LYS A 9 9.156 9.181 0.094 1.00 0.00 H new ATOM 0 HG3 LYS A 9 10.810 9.750 0.204 1.00 0.00 H new ATOM 0 HD2 LYS A 9 10.935 10.211 -2.147 1.00 0.00 H new ATOM 0 HD3 LYS A 9 9.520 9.240 -2.502 1.00 0.00 H new ATOM 0 HE2 LYS A 9 8.160 11.034 -2.214 1.00 0.00 H new ATOM 0 HE3 LYS A 9 8.762 11.275 -0.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 9.179 13.201 -1.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 10.648 12.496 -1.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 10.065 12.262 -3.070 1.00 0.00 H new ATOM 149 N GLY A 10 8.287 6.262 1.660 1.00 0.00 N ATOM 150 CA GLY A 10 7.002 5.590 1.758 1.00 0.00 C ATOM 151 C GLY A 10 6.650 5.290 3.216 1.00 0.00 C ATOM 152 O GLY A 10 5.488 5.383 3.610 1.00 0.00 O ATOM 0 H GLY A 10 8.548 6.805 2.483 1.00 0.00 H new ATOM 0 HA2 GLY A 10 6.226 6.214 1.314 1.00 0.00 H new ATOM 0 HA3 GLY A 10 7.029 4.661 1.188 1.00 0.00 H new ATOM 156 N SER A 11 7.674 4.936 3.978 1.00 0.00 N ATOM 157 CA SER A 11 7.488 4.621 5.384 1.00 0.00 C ATOM 158 C SER A 11 6.797 5.787 6.094 1.00 0.00 C ATOM 159 O SER A 11 5.768 5.602 6.742 1.00 0.00 O ATOM 160 CB SER A 11 8.824 4.305 6.060 1.00 0.00 C ATOM 161 OG SER A 11 9.770 5.357 5.891 1.00 0.00 O ATOM 0 H SER A 11 8.636 4.860 3.648 1.00 0.00 H new ATOM 0 HA SER A 11 6.857 3.735 5.455 1.00 0.00 H new ATOM 0 HB2 SER A 11 8.660 4.132 7.124 1.00 0.00 H new ATOM 0 HB3 SER A 11 9.230 3.382 5.646 1.00 0.00 H new ATOM 0 HG SER A 11 10.609 5.118 6.338 1.00 0.00 H new ATOM 167 N LYS A 12 7.390 6.963 5.948 1.00 0.00 N ATOM 168 CA LYS A 12 6.845 8.159 6.567 1.00 0.00 C ATOM 169 C LYS A 12 5.446 8.425 6.007 1.00 0.00 C ATOM 170 O LYS A 12 4.529 8.763 6.753 1.00 0.00 O ATOM 171 CB LYS A 12 7.808 9.336 6.401 1.00 0.00 C ATOM 172 CG LYS A 12 8.462 9.318 5.017 1.00 0.00 C ATOM 173 CD LYS A 12 8.870 10.728 4.586 1.00 0.00 C ATOM 174 CE LYS A 12 9.476 10.717 3.180 1.00 0.00 C ATOM 175 NZ LYS A 12 9.129 11.961 2.458 1.00 0.00 N ATOM 0 H LYS A 12 8.243 7.113 5.410 1.00 0.00 H new ATOM 0 HA LYS A 12 6.737 8.016 7.642 1.00 0.00 H new ATOM 0 HB2 LYS A 12 7.270 10.273 6.541 1.00 0.00 H new ATOM 0 HB3 LYS A 12 8.578 9.292 7.172 1.00 0.00 H new ATOM 0 HG2 LYS A 12 9.339 8.671 5.033 1.00 0.00 H new ATOM 0 HG3 LYS A 12 7.769 8.897 4.289 1.00 0.00 H new ATOM 0 HD2 LYS A 12 8.000 11.384 4.606 1.00 0.00 H new ATOM 0 HD3 LYS A 12 9.592 11.134 5.294 1.00 0.00 H new ATOM 0 HE2 LYS A 12 10.559 10.617 3.245 1.00 0.00 H new ATOM 0 HE3 LYS A 12 9.109 9.853 2.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 9.547 11.938 1.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 8.095 12.040 2.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 9.500 12.780 2.980 1.00 0.00 H new ATOM 188 N LEU A 13 5.328 8.263 4.697 1.00 0.00 N ATOM 189 CA LEU A 13 4.056 8.482 4.028 1.00 0.00 C ATOM 190 C LEU A 13 2.984 7.607 4.681 1.00 0.00 C ATOM 191 O LEU A 13 1.818 7.993 4.746 1.00 0.00 O ATOM 192 CB LEU A 13 4.199 8.258 2.521 1.00 0.00 C ATOM 193 CG LEU A 13 3.287 7.191 1.912 1.00 0.00 C ATOM 194 CD1 LEU A 13 1.833 7.666 1.877 1.00 0.00 C ATOM 195 CD2 LEU A 13 3.786 6.768 0.529 1.00 0.00 C ATOM 0 H LEU A 13 6.091 7.983 4.081 1.00 0.00 H new ATOM 0 HA LEU A 13 3.737 9.518 4.145 1.00 0.00 H new ATOM 0 HB2 LEU A 13 4.008 9.204 2.013 1.00 0.00 H new ATOM 0 HB3 LEU A 13 5.233 7.987 2.311 1.00 0.00 H new ATOM 0 HG LEU A 13 3.321 6.308 2.550 1.00 0.00 H new ATOM 0 HD11 LEU A 13 1.207 6.889 1.440 1.00 0.00 H new ATOM 0 HD12 LEU A 13 1.495 7.877 2.891 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.761 8.572 1.275 1.00 0.00 H new ATOM 0 HD21 LEU A 13 3.120 6.009 0.118 1.00 0.00 H new ATOM 0 HD22 LEU A 13 3.801 7.634 -0.133 1.00 0.00 H new ATOM 0 HD23 LEU A 13 4.793 6.359 0.615 1.00 0.00 H new ATOM 207 N LEU A 14 3.417 6.445 5.147 1.00 0.00 N ATOM 208 CA LEU A 14 2.509 5.512 5.793 1.00 0.00 C ATOM 209 C LEU A 14 2.187 6.013 7.202 1.00 0.00 C ATOM 210 O LEU A 14 1.020 6.151 7.564 1.00 0.00 O ATOM 211 CB LEU A 14 3.084 4.095 5.760 1.00 0.00 C ATOM 212 CG LEU A 14 2.063 2.956 5.755 1.00 0.00 C ATOM 213 CD1 LEU A 14 0.762 3.384 6.438 1.00 0.00 C ATOM 214 CD2 LEU A 14 1.822 2.441 4.335 1.00 0.00 C ATOM 0 H LEU A 14 4.385 6.128 5.090 1.00 0.00 H new ATOM 0 HA LEU A 14 1.565 5.461 5.250 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.710 3.999 4.873 1.00 0.00 H new ATOM 0 HB3 LEU A 14 3.735 3.968 6.625 1.00 0.00 H new ATOM 0 HG LEU A 14 2.473 2.127 6.332 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.053 2.556 6.421 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.968 3.664 7.471 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.337 4.237 5.909 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.092 1.632 4.360 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.443 3.252 3.713 1.00 0.00 H new ATOM 0 HD23 LEU A 14 2.759 2.072 3.918 1.00 0.00 H new ATOM 226 N GLU A 15 3.243 6.271 7.959 1.00 0.00 N ATOM 227 CA GLU A 15 3.088 6.754 9.321 1.00 0.00 C ATOM 228 C GLU A 15 2.167 7.975 9.349 1.00 0.00 C ATOM 229 O GLU A 15 1.613 8.315 10.393 1.00 0.00 O ATOM 230 CB GLU A 15 4.446 7.076 9.947 1.00 0.00 C ATOM 231 CG GLU A 15 5.330 5.829 10.011 1.00 0.00 C ATOM 232 CD GLU A 15 6.383 5.960 11.114 1.00 0.00 C ATOM 233 OE1 GLU A 15 7.363 6.701 10.951 1.00 0.00 O ATOM 234 OE2 GLU A 15 6.154 5.258 12.172 1.00 0.00 O ATOM 0 H GLU A 15 4.210 6.155 7.655 1.00 0.00 H new ATOM 0 HA GLU A 15 2.630 5.964 9.916 1.00 0.00 H new ATOM 0 HB2 GLU A 15 4.945 7.850 9.364 1.00 0.00 H new ATOM 0 HB3 GLU A 15 4.302 7.476 10.951 1.00 0.00 H new ATOM 0 HG2 GLU A 15 4.712 4.950 10.195 1.00 0.00 H new ATOM 0 HG3 GLU A 15 5.822 5.677 9.050 1.00 0.00 H new ATOM 242 N ASN A 16 2.032 8.602 8.190 1.00 0.00 N ATOM 243 CA ASN A 16 1.188 9.778 8.068 1.00 0.00 C ATOM 244 C ASN A 16 -0.280 9.359 8.162 1.00 0.00 C ATOM 245 O ASN A 16 -1.096 10.070 8.747 1.00 0.00 O ATOM 246 CB ASN A 16 1.397 10.470 6.720 1.00 0.00 C ATOM 247 CG ASN A 16 2.806 11.057 6.617 1.00 0.00 C ATOM 248 OD1 ASN A 16 3.645 10.879 7.485 1.00 0.00 O ATOM 249 ND2 ASN A 16 3.018 11.763 5.511 1.00 0.00 N ATOM 0 H ASN A 16 2.494 8.317 7.326 1.00 0.00 H new ATOM 0 HA ASN A 16 1.452 10.466 8.871 1.00 0.00 H new ATOM 0 HB2 ASN A 16 1.237 9.756 5.912 1.00 0.00 H new ATOM 0 HB3 ASN A 16 0.659 11.263 6.596 1.00 0.00 H new ATOM 0 HD21 ASN A 16 3.927 12.195 5.348 1.00 0.00 H new ATOM 0 HD22 ASN A 16 2.271 11.872 4.825 1.00 0.00 H new ATOM 256 N LEU A 17 -0.572 8.207 7.577 1.00 0.00 N ATOM 257 CA LEU A 17 -1.928 7.684 7.587 1.00 0.00 C ATOM 258 C LEU A 17 -1.911 6.244 8.103 1.00 0.00 C ATOM 259 O LEU A 17 -2.641 5.392 7.599 1.00 0.00 O ATOM 260 CB LEU A 17 -2.571 7.836 6.208 1.00 0.00 C ATOM 261 CG LEU A 17 -1.619 7.764 5.012 1.00 0.00 C ATOM 262 CD1 LEU A 17 -0.947 6.392 4.927 1.00 0.00 C ATOM 263 CD2 LEU A 17 -2.340 8.131 3.714 1.00 0.00 C ATOM 0 H LEU A 17 0.108 7.620 7.093 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.553 8.260 8.269 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -3.326 7.058 6.093 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -3.092 8.793 6.175 1.00 0.00 H new ATOM 0 HG LEU A 17 -0.829 8.500 5.160 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -0.276 6.368 4.068 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -0.377 6.209 5.838 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -1.708 5.620 4.814 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -1.641 8.072 2.880 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -3.164 7.437 3.547 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -2.730 9.146 3.789 1.00 0.00 H new ATOM 275 N LYS A 18 -1.069 6.016 9.100 1.00 0.00 N ATOM 276 CA LYS A 18 -0.948 4.693 9.689 1.00 0.00 C ATOM 277 C LYS A 18 -2.258 4.329 10.390 1.00 0.00 C ATOM 278 O LYS A 18 -2.845 3.284 10.112 1.00 0.00 O ATOM 279 CB LYS A 18 0.278 4.624 10.603 1.00 0.00 C ATOM 280 CG LYS A 18 1.221 3.499 10.172 1.00 0.00 C ATOM 281 CD LYS A 18 2.054 2.999 11.353 1.00 0.00 C ATOM 282 CE LYS A 18 1.160 2.402 12.441 1.00 0.00 C ATOM 283 NZ LYS A 18 1.033 3.339 13.580 1.00 0.00 N ATOM 0 H LYS A 18 -0.464 6.725 9.515 1.00 0.00 H new ATOM 0 HA LYS A 18 -0.783 3.945 8.914 1.00 0.00 H new ATOM 0 HB2 LYS A 18 0.808 5.576 10.579 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -0.040 4.462 11.633 1.00 0.00 H new ATOM 0 HG2 LYS A 18 0.643 2.674 9.756 1.00 0.00 H new ATOM 0 HG3 LYS A 18 1.882 3.856 9.382 1.00 0.00 H new ATOM 0 HD2 LYS A 18 2.765 2.248 11.009 1.00 0.00 H new ATOM 0 HD3 LYS A 18 2.636 3.823 11.767 1.00 0.00 H new ATOM 0 HE2 LYS A 18 0.174 2.184 12.031 1.00 0.00 H new ATOM 0 HE3 LYS A 18 1.579 1.456 12.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 0.050 3.342 13.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 1.664 3.037 14.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 1.296 4.297 13.272 1.00 0.00 H new ATOM 296 N GLU A 19 -2.679 5.211 11.284 1.00 0.00 N ATOM 297 CA GLU A 19 -3.909 4.996 12.026 1.00 0.00 C ATOM 298 C GLU A 19 -5.094 4.870 11.066 1.00 0.00 C ATOM 299 O GLU A 19 -6.135 4.323 11.426 1.00 0.00 O ATOM 300 CB GLU A 19 -4.142 6.118 13.040 1.00 0.00 C ATOM 301 CG GLU A 19 -4.221 7.478 12.343 1.00 0.00 C ATOM 302 CD GLU A 19 -5.267 8.375 13.008 1.00 0.00 C ATOM 303 OE1 GLU A 19 -6.377 7.913 13.310 1.00 0.00 O ATOM 304 OE2 GLU A 19 -4.891 9.592 13.211 1.00 0.00 O ATOM 0 H GLU A 19 -2.190 6.077 11.511 1.00 0.00 H new ATOM 0 HA GLU A 19 -3.816 4.063 12.581 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -5.066 5.932 13.588 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -3.334 6.126 13.771 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -3.246 7.964 12.375 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -4.472 7.338 11.292 1.00 0.00 H new ATOM 312 N LYS A 20 -4.895 5.385 9.861 1.00 0.00 N ATOM 313 CA LYS A 20 -5.934 5.338 8.846 1.00 0.00 C ATOM 314 C LYS A 20 -6.243 3.878 8.508 1.00 0.00 C ATOM 315 O LYS A 20 -7.397 3.523 8.271 1.00 0.00 O ATOM 316 CB LYS A 20 -5.535 6.179 7.632 1.00 0.00 C ATOM 317 CG LYS A 20 -6.475 7.374 7.461 1.00 0.00 C ATOM 318 CD LYS A 20 -6.318 8.365 8.616 1.00 0.00 C ATOM 319 CE LYS A 20 -7.275 9.548 8.458 1.00 0.00 C ATOM 320 NZ LYS A 20 -8.268 9.562 9.555 1.00 0.00 N ATOM 0 H LYS A 20 -4.030 5.837 9.565 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.856 5.781 9.223 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -4.510 6.532 7.750 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -5.558 5.562 6.734 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -6.264 7.875 6.516 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -7.507 7.026 7.414 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -6.512 7.860 9.562 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -5.290 8.726 8.652 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -6.712 10.481 8.458 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -7.786 9.484 7.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -8.910 10.371 9.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.817 8.679 9.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -7.776 9.646 10.467 1.00 0.00 H new ATOM 333 N LEU A 21 -5.193 3.071 8.496 1.00 0.00 N ATOM 334 CA LEU A 21 -5.338 1.658 8.190 1.00 0.00 C ATOM 335 C LEU A 21 -5.821 0.918 9.439 1.00 0.00 C ATOM 336 O LEU A 21 -6.586 -0.040 9.340 1.00 0.00 O ATOM 337 CB LEU A 21 -4.038 1.099 7.609 1.00 0.00 C ATOM 338 CG LEU A 21 -3.429 1.887 6.447 1.00 0.00 C ATOM 339 CD1 LEU A 21 -1.968 1.493 6.223 1.00 0.00 C ATOM 340 CD2 LEU A 21 -4.268 1.727 5.177 1.00 0.00 C ATOM 0 H LEU A 21 -4.238 3.369 8.693 1.00 0.00 H new ATOM 0 HA LEU A 21 -6.094 1.511 7.418 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -3.300 1.042 8.410 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -4.223 0.079 7.273 1.00 0.00 H new ATOM 0 HG LEU A 21 -3.440 2.945 6.709 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -1.560 2.068 5.392 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -1.393 1.701 7.125 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -1.909 0.429 5.992 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -3.814 2.297 4.367 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -4.312 0.674 4.900 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -5.277 2.096 5.359 1.00 0.00 H new ATOM 352 N GLU A 22 -5.354 1.390 10.586 1.00 0.00 N ATOM 353 CA GLU A 22 -5.729 0.785 11.852 1.00 0.00 C ATOM 354 C GLU A 22 -7.252 0.735 11.987 1.00 0.00 C ATOM 355 O GLU A 22 -7.785 -0.056 12.764 1.00 0.00 O ATOM 356 CB GLU A 22 -5.099 1.536 13.027 1.00 0.00 C ATOM 357 CG GLU A 22 -3.576 1.390 13.018 1.00 0.00 C ATOM 358 CD GLU A 22 -2.998 1.591 14.421 1.00 0.00 C ATOM 359 OE1 GLU A 22 -3.590 1.127 15.407 1.00 0.00 O ATOM 360 OE2 GLU A 22 -1.893 2.254 14.465 1.00 0.00 O ATOM 0 H GLU A 22 -4.719 2.185 10.664 1.00 0.00 H new ATOM 0 HA GLU A 22 -5.349 -0.236 11.870 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -5.367 2.591 12.974 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -5.499 1.152 13.965 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -3.304 0.402 12.647 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -3.141 2.119 12.334 1.00 0.00 H new ATOM 368 N GLU A 23 -7.911 1.589 11.217 1.00 0.00 N ATOM 369 CA GLU A 23 -9.362 1.653 11.241 1.00 0.00 C ATOM 370 C GLU A 23 -9.958 0.443 10.517 1.00 0.00 C ATOM 371 O GLU A 23 -10.806 -0.258 11.067 1.00 0.00 O ATOM 372 CB GLU A 23 -9.864 2.961 10.626 1.00 0.00 C ATOM 373 CG GLU A 23 -8.925 4.121 10.965 1.00 0.00 C ATOM 374 CD GLU A 23 -9.700 5.434 11.090 1.00 0.00 C ATOM 375 OE1 GLU A 23 -10.162 5.980 10.077 1.00 0.00 O ATOM 376 OE2 GLU A 23 -9.815 5.887 12.293 1.00 0.00 O ATOM 0 H GLU A 23 -7.466 2.242 10.572 1.00 0.00 H new ATOM 0 HA GLU A 23 -9.690 1.629 12.280 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -9.939 2.853 9.544 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -10.866 3.180 10.995 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -8.404 3.911 11.899 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -8.164 4.216 10.191 1.00 0.00 H new ATOM 384 N ILE A 24 -9.490 0.236 9.295 1.00 0.00 N ATOM 385 CA ILE A 24 -9.966 -0.876 8.490 1.00 0.00 C ATOM 386 C ILE A 24 -9.422 -2.186 9.065 1.00 0.00 C ATOM 387 O ILE A 24 -10.031 -3.241 8.899 1.00 0.00 O ATOM 388 CB ILE A 24 -9.616 -0.660 7.017 1.00 0.00 C ATOM 389 CG1 ILE A 24 -8.145 -0.275 6.853 1.00 0.00 C ATOM 390 CG2 ILE A 24 -10.553 0.367 6.376 1.00 0.00 C ATOM 391 CD1 ILE A 24 -7.672 -0.514 5.418 1.00 0.00 C ATOM 0 H ILE A 24 -8.786 0.820 8.843 1.00 0.00 H new ATOM 0 HA ILE A 24 -11.054 -0.936 8.530 1.00 0.00 H new ATOM 0 HB ILE A 24 -9.762 -1.603 6.490 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -8.009 0.774 7.114 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -7.534 -0.857 7.543 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -10.283 0.502 5.329 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -11.582 0.012 6.442 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -10.463 1.319 6.900 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -6.623 -0.232 5.329 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -7.787 -1.569 5.168 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -8.269 0.088 4.733 1.00 0.00 H new ATOM 403 N VAL A 25 -8.282 -2.074 9.731 1.00 0.00 N ATOM 404 CA VAL A 25 -7.649 -3.236 10.331 1.00 0.00 C ATOM 405 C VAL A 25 -8.473 -3.693 11.537 1.00 0.00 C ATOM 406 O VAL A 25 -8.686 -4.889 11.730 1.00 0.00 O ATOM 407 CB VAL A 25 -6.196 -2.915 10.687 1.00 0.00 C ATOM 408 CG1 VAL A 25 -6.035 -2.700 12.193 1.00 0.00 C ATOM 409 CG2 VAL A 25 -5.254 -4.011 10.186 1.00 0.00 C ATOM 0 H VAL A 25 -7.780 -1.196 9.868 1.00 0.00 H new ATOM 0 HA VAL A 25 -7.621 -4.064 9.623 1.00 0.00 H new ATOM 0 HB VAL A 25 -5.926 -1.986 10.185 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -4.993 -2.473 12.419 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.664 -1.869 12.511 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.333 -3.604 12.724 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -4.228 -3.758 10.452 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.525 -4.961 10.646 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -5.338 -4.095 9.102 1.00 0.00 H new ATOM 419 N LYS A 26 -8.913 -2.717 12.317 1.00 0.00 N ATOM 420 CA LYS A 26 -9.708 -3.005 13.499 1.00 0.00 C ATOM 421 C LYS A 26 -11.077 -3.537 13.070 1.00 0.00 C ATOM 422 O LYS A 26 -11.506 -4.596 13.524 1.00 0.00 O ATOM 423 CB LYS A 26 -9.783 -1.775 14.406 1.00 0.00 C ATOM 424 CG LYS A 26 -10.347 -2.142 15.781 1.00 0.00 C ATOM 425 CD LYS A 26 -9.691 -1.307 16.883 1.00 0.00 C ATOM 426 CE LYS A 26 -8.768 -2.169 17.748 1.00 0.00 C ATOM 427 NZ LYS A 26 -9.427 -2.509 19.028 1.00 0.00 N ATOM 0 H LYS A 26 -8.734 -1.726 12.154 1.00 0.00 H new ATOM 0 HA LYS A 26 -9.235 -3.785 14.096 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -8.789 -1.342 14.520 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -10.411 -1.014 13.942 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -11.425 -1.981 15.791 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -10.181 -3.202 15.975 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -9.121 -0.492 16.436 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -10.461 -0.853 17.507 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -8.506 -3.082 17.213 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -7.838 -1.635 17.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -8.788 -3.094 19.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -9.655 -1.635 19.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -10.303 -3.037 18.838 1.00 0.00 H new ATOM 440 N LYS A 27 -11.726 -2.776 12.199 1.00 0.00 N ATOM 441 CA LYS A 27 -13.037 -3.158 11.704 1.00 0.00 C ATOM 442 C LYS A 27 -12.983 -4.595 11.183 1.00 0.00 C ATOM 443 O LYS A 27 -13.863 -5.401 11.480 1.00 0.00 O ATOM 444 CB LYS A 27 -13.534 -2.147 10.668 1.00 0.00 C ATOM 445 CG LYS A 27 -14.888 -2.569 10.096 1.00 0.00 C ATOM 446 CD LYS A 27 -15.395 -1.548 9.075 1.00 0.00 C ATOM 447 CE LYS A 27 -16.263 -0.483 9.750 1.00 0.00 C ATOM 448 NZ LYS A 27 -16.026 0.843 9.137 1.00 0.00 N ATOM 0 H LYS A 27 -11.368 -1.898 11.824 1.00 0.00 H new ATOM 0 HA LYS A 27 -13.769 -3.139 12.512 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -13.620 -1.162 11.128 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -12.806 -2.059 9.862 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -14.798 -3.547 9.623 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -15.612 -2.671 10.904 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -14.549 -1.072 8.580 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -15.972 -2.056 8.302 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -17.316 -0.750 9.657 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -16.037 -0.443 10.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -16.622 1.554 9.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -15.025 1.103 9.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -16.264 0.805 8.125 1.00 0.00 H new ATOM 461 N GLU A 28 -11.939 -4.873 10.415 1.00 0.00 N ATOM 462 CA GLU A 28 -11.758 -6.200 9.850 1.00 0.00 C ATOM 463 C GLU A 28 -11.958 -7.267 10.927 1.00 0.00 C ATOM 464 O GLU A 28 -12.851 -8.106 10.816 1.00 0.00 O ATOM 465 CB GLU A 28 -10.382 -6.333 9.194 1.00 0.00 C ATOM 466 CG GLU A 28 -10.346 -7.523 8.233 1.00 0.00 C ATOM 467 CD GLU A 28 -10.275 -8.845 9.000 1.00 0.00 C ATOM 468 OE1 GLU A 28 -11.318 -9.427 9.331 1.00 0.00 O ATOM 469 OE2 GLU A 28 -9.082 -9.266 9.251 1.00 0.00 O ATOM 0 H GLU A 28 -11.210 -4.202 10.171 1.00 0.00 H new ATOM 0 HA GLU A 28 -12.509 -6.350 9.075 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -10.143 -5.417 8.654 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -9.619 -6.458 9.963 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -11.234 -7.512 7.602 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -9.484 -7.435 7.572 1.00 0.00 H new ATOM 477 N ILE A 29 -11.113 -7.202 11.945 1.00 0.00 N ATOM 478 CA ILE A 29 -11.185 -8.152 13.041 1.00 0.00 C ATOM 479 C ILE A 29 -10.799 -7.451 14.345 1.00 0.00 C ATOM 480 O ILE A 29 -11.545 -7.496 15.322 1.00 0.00 O ATOM 481 CB ILE A 29 -10.339 -9.390 12.734 1.00 0.00 C ATOM 482 CG1 ILE A 29 -10.337 -10.360 13.917 1.00 0.00 C ATOM 483 CG2 ILE A 29 -8.922 -8.994 12.315 1.00 0.00 C ATOM 484 CD1 ILE A 29 -9.404 -11.543 13.654 1.00 0.00 C ATOM 0 H ILE A 29 -10.374 -6.505 12.034 1.00 0.00 H new ATOM 0 HA ILE A 29 -12.206 -8.514 13.164 1.00 0.00 H new ATOM 0 HB ILE A 29 -10.791 -9.912 11.891 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -10.022 -9.837 14.820 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -11.349 -10.723 14.096 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -8.341 -9.892 12.102 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -8.967 -8.371 11.422 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -8.446 -8.437 13.122 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -9.421 -12.217 14.510 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -9.736 -12.078 12.764 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -8.389 -11.178 13.500 1.00 0.00 H new ATOM 496 N GLY A 30 -9.635 -6.820 14.318 1.00 0.00 N ATOM 497 CA GLY A 30 -9.141 -6.110 15.485 1.00 0.00 C ATOM 498 C GLY A 30 -7.628 -5.896 15.397 1.00 0.00 C ATOM 499 O GLY A 30 -7.099 -4.943 15.967 1.00 0.00 O ATOM 0 H GLY A 30 -9.019 -6.786 13.506 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -9.644 -5.147 15.569 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -9.380 -6.674 16.387 1.00 0.00 H new ATOM 503 N ASP A 31 -6.976 -6.797 14.679 1.00 0.00 N ATOM 504 CA ASP A 31 -5.535 -6.718 14.509 1.00 0.00 C ATOM 505 C ASP A 31 -5.120 -7.568 13.306 1.00 0.00 C ATOM 506 O ASP A 31 -5.513 -8.728 13.196 1.00 0.00 O ATOM 507 CB ASP A 31 -4.804 -7.255 15.741 1.00 0.00 C ATOM 508 CG ASP A 31 -3.286 -7.064 15.728 1.00 0.00 C ATOM 509 OD1 ASP A 31 -2.608 -7.404 14.747 1.00 0.00 O ATOM 510 OD2 ASP A 31 -2.795 -6.533 16.796 1.00 0.00 O ATOM 0 H ASP A 31 -7.419 -7.586 14.208 1.00 0.00 H new ATOM 0 HA ASP A 31 -5.271 -5.671 14.361 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -5.209 -6.766 16.627 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -5.020 -8.319 15.838 1.00 0.00 H new ATOM 516 N VAL A 32 -4.332 -6.957 12.433 1.00 0.00 N ATOM 517 CA VAL A 32 -3.860 -7.643 11.243 1.00 0.00 C ATOM 518 C VAL A 32 -2.342 -7.482 11.135 1.00 0.00 C ATOM 519 O VAL A 32 -1.766 -6.576 11.735 1.00 0.00 O ATOM 520 CB VAL A 32 -4.605 -7.125 10.011 1.00 0.00 C ATOM 521 CG1 VAL A 32 -4.331 -8.009 8.793 1.00 0.00 C ATOM 522 CG2 VAL A 32 -6.106 -7.017 10.283 1.00 0.00 C ATOM 0 H VAL A 32 -4.009 -5.994 12.527 1.00 0.00 H new ATOM 0 HA VAL A 32 -4.070 -8.711 11.309 1.00 0.00 H new ATOM 0 HB VAL A 32 -4.232 -6.125 9.790 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -4.872 -7.619 7.931 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -3.262 -8.013 8.579 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -4.663 -9.026 9.000 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -6.612 -6.647 9.391 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -6.500 -8.000 10.542 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -6.277 -6.328 11.110 1.00 0.00 H new ATOM 532 N HIS A 33 -1.738 -8.376 10.366 1.00 0.00 N ATOM 533 CA HIS A 33 -0.298 -8.345 10.172 1.00 0.00 C ATOM 534 C HIS A 33 0.016 -8.079 8.698 1.00 0.00 C ATOM 535 O HIS A 33 -0.215 -8.936 7.846 1.00 0.00 O ATOM 536 CB HIS A 33 0.348 -9.630 10.693 1.00 0.00 C ATOM 537 CG HIS A 33 -0.163 -10.071 12.044 1.00 0.00 C ATOM 538 ND1 HIS A 33 0.630 -10.081 13.178 1.00 0.00 N ATOM 539 CD2 HIS A 33 -1.393 -10.515 12.430 1.00 0.00 C ATOM 540 CE1 HIS A 33 -0.101 -10.514 14.195 1.00 0.00 C ATOM 541 NE2 HIS A 33 -1.354 -10.783 13.729 1.00 0.00 N ATOM 0 H HIS A 33 -2.219 -9.126 9.870 1.00 0.00 H new ATOM 0 HA HIS A 33 0.133 -7.529 10.752 1.00 0.00 H new ATOM 0 HB2 HIS A 33 0.175 -10.429 9.972 1.00 0.00 H new ATOM 0 HB3 HIS A 33 1.426 -9.483 10.754 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -2.253 -10.629 11.787 1.00 0.00 H new ATOM 0 HE1 HIS A 33 0.236 -10.633 15.214 1.00 0.00 H new ATOM 0 HE2 HIS A 33 -2.133 -11.133 14.287 1.00 0.00 H new ATOM 549 N VAL A 34 0.536 -6.888 8.443 1.00 0.00 N ATOM 550 CA VAL A 34 0.883 -6.498 7.087 1.00 0.00 C ATOM 551 C VAL A 34 2.265 -5.841 7.088 1.00 0.00 C ATOM 552 O VAL A 34 2.409 -4.690 7.498 1.00 0.00 O ATOM 553 CB VAL A 34 -0.207 -5.596 6.506 1.00 0.00 C ATOM 554 CG1 VAL A 34 0.398 -4.501 5.626 1.00 0.00 C ATOM 555 CG2 VAL A 34 -1.240 -6.415 5.729 1.00 0.00 C ATOM 0 H VAL A 34 0.726 -6.180 9.152 1.00 0.00 H new ATOM 0 HA VAL A 34 0.939 -7.374 6.441 1.00 0.00 H new ATOM 0 HB VAL A 34 -0.719 -5.112 7.338 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -0.399 -3.874 5.226 1.00 0.00 H new ATOM 0 HG12 VAL A 34 1.077 -3.890 6.221 1.00 0.00 H new ATOM 0 HG13 VAL A 34 0.948 -4.958 4.803 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -2.004 -5.750 5.326 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -0.747 -6.939 4.910 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -1.706 -7.140 6.396 1.00 0.00 H new ATOM 565 N ASN A 35 3.247 -6.600 6.624 1.00 0.00 N ATOM 566 CA ASN A 35 4.612 -6.106 6.566 1.00 0.00 C ATOM 567 C ASN A 35 4.925 -5.650 5.140 1.00 0.00 C ATOM 568 O ASN A 35 5.233 -6.471 4.276 1.00 0.00 O ATOM 569 CB ASN A 35 5.611 -7.202 6.943 1.00 0.00 C ATOM 570 CG ASN A 35 4.997 -8.182 7.945 1.00 0.00 C ATOM 571 OD1 ASN A 35 3.949 -8.765 7.720 1.00 0.00 O ATOM 572 ND2 ASN A 35 5.707 -8.331 9.060 1.00 0.00 N ATOM 0 H ASN A 35 3.124 -7.554 6.285 1.00 0.00 H new ATOM 0 HA ASN A 35 4.701 -5.279 7.271 1.00 0.00 H new ATOM 0 HB2 ASN A 35 5.922 -7.739 6.047 1.00 0.00 H new ATOM 0 HB3 ASN A 35 6.506 -6.751 7.371 1.00 0.00 H new ATOM 0 HD21 ASN A 35 5.382 -8.964 9.791 1.00 0.00 H new ATOM 0 HD22 ASN A 35 6.576 -7.812 9.184 1.00 0.00 H new ATOM 579 N VAL A 36 4.836 -4.344 4.937 1.00 0.00 N ATOM 580 CA VAL A 36 5.106 -3.770 3.629 1.00 0.00 C ATOM 581 C VAL A 36 6.611 -3.543 3.478 1.00 0.00 C ATOM 582 O VAL A 36 7.234 -2.903 4.323 1.00 0.00 O ATOM 583 CB VAL A 36 4.286 -2.492 3.440 1.00 0.00 C ATOM 584 CG1 VAL A 36 2.995 -2.542 4.259 1.00 0.00 C ATOM 585 CG2 VAL A 36 5.112 -1.254 3.793 1.00 0.00 C ATOM 0 H VAL A 36 4.581 -3.667 5.656 1.00 0.00 H new ATOM 0 HA VAL A 36 4.800 -4.456 2.839 1.00 0.00 H new ATOM 0 HB VAL A 36 4.012 -2.423 2.387 1.00 0.00 H new ATOM 0 HG11 VAL A 36 2.431 -1.622 4.106 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.394 -3.393 3.939 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.239 -2.647 5.316 1.00 0.00 H new ATOM 0 HG21 VAL A 36 4.506 -0.359 3.650 1.00 0.00 H new ATOM 0 HG22 VAL A 36 5.431 -1.314 4.834 1.00 0.00 H new ATOM 0 HG23 VAL A 36 5.989 -1.205 3.147 1.00 0.00 H new ATOM 595 N ILE A 37 7.152 -4.080 2.394 1.00 0.00 N ATOM 596 CA ILE A 37 8.573 -3.944 2.121 1.00 0.00 C ATOM 597 C ILE A 37 8.799 -2.740 1.205 1.00 0.00 C ATOM 598 O ILE A 37 8.469 -2.786 0.021 1.00 0.00 O ATOM 599 CB ILE A 37 9.140 -5.253 1.568 1.00 0.00 C ATOM 600 CG1 ILE A 37 8.577 -6.458 2.324 1.00 0.00 C ATOM 601 CG2 ILE A 37 10.670 -5.235 1.576 1.00 0.00 C ATOM 602 CD1 ILE A 37 7.324 -7.002 1.636 1.00 0.00 C ATOM 0 H ILE A 37 6.632 -4.610 1.695 1.00 0.00 H new ATOM 0 HA ILE A 37 9.121 -3.751 3.043 1.00 0.00 H new ATOM 0 HB ILE A 37 8.825 -5.349 0.529 1.00 0.00 H new ATOM 0 HG12 ILE A 37 9.333 -7.241 2.382 1.00 0.00 H new ATOM 0 HG13 ILE A 37 8.338 -6.170 3.348 1.00 0.00 H new ATOM 0 HG21 ILE A 37 11.047 -6.177 1.178 1.00 0.00 H new ATOM 0 HG22 ILE A 37 11.027 -4.411 0.958 1.00 0.00 H new ATOM 0 HG23 ILE A 37 11.027 -5.104 2.598 1.00 0.00 H new ATOM 0 HD11 ILE A 37 6.945 -7.858 2.194 1.00 0.00 H new ATOM 0 HD12 ILE A 37 6.561 -6.224 1.602 1.00 0.00 H new ATOM 0 HD13 ILE A 37 7.572 -7.312 0.621 1.00 0.00 H new ATOM 614 N LEU A 38 9.360 -1.690 1.788 1.00 0.00 N ATOM 615 CA LEU A 38 9.633 -0.476 1.038 1.00 0.00 C ATOM 616 C LEU A 38 10.973 -0.621 0.313 1.00 0.00 C ATOM 617 O LEU A 38 12.026 -0.652 0.947 1.00 0.00 O ATOM 618 CB LEU A 38 9.559 0.747 1.954 1.00 0.00 C ATOM 619 CG LEU A 38 8.281 0.887 2.784 1.00 0.00 C ATOM 620 CD1 LEU A 38 8.509 1.798 3.992 1.00 0.00 C ATOM 621 CD2 LEU A 38 7.114 1.364 1.918 1.00 0.00 C ATOM 0 H LEU A 38 9.633 -1.655 2.770 1.00 0.00 H new ATOM 0 HA LEU A 38 8.871 -0.320 0.274 1.00 0.00 H new ATOM 0 HB2 LEU A 38 10.410 0.718 2.635 1.00 0.00 H new ATOM 0 HB3 LEU A 38 9.671 1.642 1.342 1.00 0.00 H new ATOM 0 HG LEU A 38 8.014 -0.097 3.169 1.00 0.00 H new ATOM 0 HD11 LEU A 38 7.585 1.881 4.565 1.00 0.00 H new ATOM 0 HD12 LEU A 38 9.291 1.376 4.623 1.00 0.00 H new ATOM 0 HD13 LEU A 38 8.813 2.787 3.650 1.00 0.00 H new ATOM 0 HD21 LEU A 38 6.218 1.455 2.532 1.00 0.00 H new ATOM 0 HD22 LEU A 38 7.356 2.334 1.483 1.00 0.00 H new ATOM 0 HD23 LEU A 38 6.935 0.643 1.120 1.00 0.00 H new ATOM 633 N VAL A 39 10.889 -0.704 -1.007 1.00 0.00 N ATOM 634 CA VAL A 39 12.081 -0.844 -1.825 1.00 0.00 C ATOM 635 C VAL A 39 11.967 0.071 -3.046 1.00 0.00 C ATOM 636 O VAL A 39 10.942 0.080 -3.726 1.00 0.00 O ATOM 637 CB VAL A 39 12.291 -2.313 -2.197 1.00 0.00 C ATOM 638 CG1 VAL A 39 12.466 -3.176 -0.945 1.00 0.00 C ATOM 639 CG2 VAL A 39 11.140 -2.830 -3.062 1.00 0.00 C ATOM 0 H VAL A 39 10.014 -0.677 -1.530 1.00 0.00 H new ATOM 0 HA VAL A 39 12.965 -0.534 -1.268 1.00 0.00 H new ATOM 0 HB VAL A 39 13.208 -2.382 -2.783 1.00 0.00 H new ATOM 0 HG11 VAL A 39 12.614 -4.216 -1.237 1.00 0.00 H new ATOM 0 HG12 VAL A 39 13.334 -2.830 -0.383 1.00 0.00 H new ATOM 0 HG13 VAL A 39 11.575 -3.097 -0.322 1.00 0.00 H new ATOM 0 HG21 VAL A 39 11.314 -3.876 -3.312 1.00 0.00 H new ATOM 0 HG22 VAL A 39 10.203 -2.740 -2.513 1.00 0.00 H new ATOM 0 HG23 VAL A 39 11.081 -2.243 -3.978 1.00 0.00 H new ATOM 649 N SER A 40 13.034 0.819 -3.287 1.00 0.00 N ATOM 650 CA SER A 40 13.066 1.735 -4.414 1.00 0.00 C ATOM 651 C SER A 40 13.111 0.950 -5.726 1.00 0.00 C ATOM 652 O SER A 40 12.840 -0.250 -5.745 1.00 0.00 O ATOM 653 CB SER A 40 14.265 2.681 -4.320 1.00 0.00 C ATOM 654 OG SER A 40 15.455 2.086 -4.830 1.00 0.00 O ATOM 0 H SER A 40 13.882 0.809 -2.721 1.00 0.00 H new ATOM 0 HA SER A 40 12.158 2.338 -4.390 1.00 0.00 H new ATOM 0 HB2 SER A 40 14.050 3.595 -4.874 1.00 0.00 H new ATOM 0 HB3 SER A 40 14.420 2.968 -3.280 1.00 0.00 H new ATOM 0 HG SER A 40 16.197 2.722 -4.754 1.00 0.00 H new ATOM 660 N GLU A 41 13.453 1.659 -6.792 1.00 0.00 N ATOM 661 CA GLU A 41 13.536 1.043 -8.105 1.00 0.00 C ATOM 662 C GLU A 41 14.739 0.099 -8.173 1.00 0.00 C ATOM 663 O GLU A 41 14.612 -1.042 -8.615 1.00 0.00 O ATOM 664 CB GLU A 41 13.609 2.104 -9.205 1.00 0.00 C ATOM 665 CG GLU A 41 14.125 1.503 -10.514 1.00 0.00 C ATOM 666 CD GLU A 41 14.142 2.550 -11.629 1.00 0.00 C ATOM 667 OE1 GLU A 41 15.223 2.989 -12.051 1.00 0.00 O ATOM 668 OE2 GLU A 41 12.980 2.908 -12.059 1.00 0.00 O ATOM 0 H GLU A 41 13.676 2.654 -6.773 1.00 0.00 H new ATOM 0 HA GLU A 41 12.630 0.459 -8.269 1.00 0.00 H new ATOM 0 HB2 GLU A 41 12.621 2.537 -9.364 1.00 0.00 H new ATOM 0 HB3 GLU A 41 14.265 2.915 -8.890 1.00 0.00 H new ATOM 0 HG2 GLU A 41 15.130 1.108 -10.366 1.00 0.00 H new ATOM 0 HG3 GLU A 41 13.493 0.665 -10.807 1.00 0.00 H new ATOM 676 N ASP A 42 15.878 0.610 -7.730 1.00 0.00 N ATOM 677 CA ASP A 42 17.102 -0.173 -7.735 1.00 0.00 C ATOM 678 C ASP A 42 17.012 -1.259 -6.661 1.00 0.00 C ATOM 679 O ASP A 42 17.502 -2.370 -6.854 1.00 0.00 O ATOM 680 CB ASP A 42 18.317 0.702 -7.422 1.00 0.00 C ATOM 681 CG ASP A 42 19.657 0.144 -7.905 1.00 0.00 C ATOM 682 OD1 ASP A 42 20.552 -0.154 -7.100 1.00 0.00 O ATOM 683 OD2 ASP A 42 19.766 0.017 -9.184 1.00 0.00 O ATOM 0 H ASP A 42 15.979 1.557 -7.365 1.00 0.00 H new ATOM 0 HA ASP A 42 17.218 -0.610 -8.727 1.00 0.00 H new ATOM 0 HB2 ASP A 42 18.165 1.683 -7.873 1.00 0.00 H new ATOM 0 HB3 ASP A 42 18.370 0.851 -6.344 1.00 0.00 H new ATOM 689 N GLU A 43 16.382 -0.899 -5.552 1.00 0.00 N ATOM 690 CA GLU A 43 16.222 -1.829 -4.447 1.00 0.00 C ATOM 691 C GLU A 43 15.353 -3.014 -4.873 1.00 0.00 C ATOM 692 O GLU A 43 15.627 -4.154 -4.502 1.00 0.00 O ATOM 693 CB GLU A 43 15.631 -1.128 -3.222 1.00 0.00 C ATOM 694 CG GLU A 43 16.460 0.100 -2.841 1.00 0.00 C ATOM 695 CD GLU A 43 17.719 -0.306 -2.072 1.00 0.00 C ATOM 696 OE1 GLU A 43 17.687 -0.403 -0.836 1.00 0.00 O ATOM 697 OE2 GLU A 43 18.759 -0.524 -2.804 1.00 0.00 O ATOM 0 H GLU A 43 15.976 0.024 -5.395 1.00 0.00 H new ATOM 0 HA GLU A 43 17.206 -2.206 -4.169 1.00 0.00 H new ATOM 0 HB2 GLU A 43 14.604 -0.828 -3.430 1.00 0.00 H new ATOM 0 HB3 GLU A 43 15.596 -1.822 -2.383 1.00 0.00 H new ATOM 0 HG2 GLU A 43 16.740 0.648 -3.741 1.00 0.00 H new ATOM 0 HG3 GLU A 43 15.859 0.774 -2.231 1.00 0.00 H new ATOM 705 N ILE A 44 14.322 -2.704 -5.645 1.00 0.00 N ATOM 706 CA ILE A 44 13.411 -3.729 -6.125 1.00 0.00 C ATOM 707 C ILE A 44 14.042 -4.447 -7.320 1.00 0.00 C ATOM 708 O ILE A 44 13.841 -5.646 -7.506 1.00 0.00 O ATOM 709 CB ILE A 44 12.037 -3.128 -6.424 1.00 0.00 C ATOM 710 CG1 ILE A 44 10.952 -4.207 -6.419 1.00 0.00 C ATOM 711 CG2 ILE A 44 12.056 -2.342 -7.737 1.00 0.00 C ATOM 712 CD1 ILE A 44 9.746 -3.768 -5.587 1.00 0.00 C ATOM 0 H ILE A 44 14.097 -1.757 -5.950 1.00 0.00 H new ATOM 0 HA ILE A 44 13.243 -4.480 -5.354 1.00 0.00 H new ATOM 0 HB ILE A 44 11.794 -2.423 -5.629 1.00 0.00 H new ATOM 0 HG12 ILE A 44 10.637 -4.415 -7.441 1.00 0.00 H new ATOM 0 HG13 ILE A 44 11.358 -5.134 -6.016 1.00 0.00 H new ATOM 0 HG21 ILE A 44 11.067 -1.925 -7.926 1.00 0.00 H new ATOM 0 HG22 ILE A 44 12.783 -1.533 -7.666 1.00 0.00 H new ATOM 0 HG23 ILE A 44 12.332 -3.007 -8.555 1.00 0.00 H new ATOM 0 HD11 ILE A 44 8.990 -4.553 -5.600 1.00 0.00 H new ATOM 0 HD12 ILE A 44 10.060 -3.584 -4.560 1.00 0.00 H new ATOM 0 HD13 ILE A 44 9.327 -2.854 -6.008 1.00 0.00 H new ATOM 724 N LYS A 45 14.792 -3.683 -8.100 1.00 0.00 N ATOM 725 CA LYS A 45 15.453 -4.230 -9.272 1.00 0.00 C ATOM 726 C LYS A 45 16.192 -5.513 -8.883 1.00 0.00 C ATOM 727 O LYS A 45 16.063 -6.535 -9.555 1.00 0.00 O ATOM 728 CB LYS A 45 16.352 -3.176 -9.922 1.00 0.00 C ATOM 729 CG LYS A 45 17.203 -3.792 -11.035 1.00 0.00 C ATOM 730 CD LYS A 45 18.632 -4.051 -10.553 1.00 0.00 C ATOM 731 CE LYS A 45 19.649 -3.706 -11.642 1.00 0.00 C ATOM 732 NZ LYS A 45 20.865 -3.109 -11.045 1.00 0.00 N ATOM 0 H LYS A 45 14.957 -2.689 -7.943 1.00 0.00 H new ATOM 0 HA LYS A 45 14.719 -4.501 -10.031 1.00 0.00 H new ATOM 0 HB2 LYS A 45 15.739 -2.372 -10.330 1.00 0.00 H new ATOM 0 HB3 LYS A 45 17.001 -2.731 -9.168 1.00 0.00 H new ATOM 0 HG2 LYS A 45 16.752 -4.727 -11.367 1.00 0.00 H new ATOM 0 HG3 LYS A 45 17.221 -3.124 -11.896 1.00 0.00 H new ATOM 0 HD2 LYS A 45 18.832 -3.456 -9.662 1.00 0.00 H new ATOM 0 HD3 LYS A 45 18.740 -5.098 -10.268 1.00 0.00 H new ATOM 0 HE2 LYS A 45 19.914 -4.605 -12.199 1.00 0.00 H new ATOM 0 HE3 LYS A 45 19.206 -3.009 -12.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 21.545 -2.881 -11.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 20.610 -2.240 -10.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 21.295 -3.786 -10.383 1.00 0.00 H new ATOM 745 N GLU A 46 16.949 -5.416 -7.800 1.00 0.00 N ATOM 746 CA GLU A 46 17.708 -6.556 -7.314 1.00 0.00 C ATOM 747 C GLU A 46 16.797 -7.506 -6.534 1.00 0.00 C ATOM 748 O GLU A 46 16.803 -8.713 -6.773 1.00 0.00 O ATOM 749 CB GLU A 46 18.890 -6.102 -6.455 1.00 0.00 C ATOM 750 CG GLU A 46 19.802 -5.154 -7.236 1.00 0.00 C ATOM 751 CD GLU A 46 21.275 -5.512 -7.024 1.00 0.00 C ATOM 752 OE1 GLU A 46 22.051 -4.680 -6.533 1.00 0.00 O ATOM 753 OE2 GLU A 46 21.603 -6.705 -7.389 1.00 0.00 O ATOM 0 H GLU A 46 17.053 -4.566 -7.246 1.00 0.00 H new ATOM 0 HA GLU A 46 18.111 -7.093 -8.173 1.00 0.00 H new ATOM 0 HB2 GLU A 46 18.522 -5.603 -5.559 1.00 0.00 H new ATOM 0 HB3 GLU A 46 19.459 -6.971 -6.125 1.00 0.00 H new ATOM 0 HG2 GLU A 46 19.561 -5.204 -8.298 1.00 0.00 H new ATOM 0 HG3 GLU A 46 19.624 -4.127 -6.917 1.00 0.00 H new ATOM 761 N LEU A 47 16.036 -6.927 -5.617 1.00 0.00 N ATOM 762 CA LEU A 47 15.122 -7.707 -4.800 1.00 0.00 C ATOM 763 C LEU A 47 14.372 -8.700 -5.690 1.00 0.00 C ATOM 764 O LEU A 47 14.191 -9.859 -5.318 1.00 0.00 O ATOM 765 CB LEU A 47 14.203 -6.786 -3.996 1.00 0.00 C ATOM 766 CG LEU A 47 13.419 -7.446 -2.859 1.00 0.00 C ATOM 767 CD1 LEU A 47 12.285 -8.314 -3.408 1.00 0.00 C ATOM 768 CD2 LEU A 47 14.351 -8.235 -1.938 1.00 0.00 C ATOM 0 H LEU A 47 16.034 -5.926 -5.422 1.00 0.00 H new ATOM 0 HA LEU A 47 15.673 -8.291 -4.063 1.00 0.00 H new ATOM 0 HB2 LEU A 47 14.806 -5.981 -3.576 1.00 0.00 H new ATOM 0 HB3 LEU A 47 13.492 -6.326 -4.682 1.00 0.00 H new ATOM 0 HG LEU A 47 12.961 -6.661 -2.258 1.00 0.00 H new ATOM 0 HD11 LEU A 47 11.744 -8.772 -2.580 1.00 0.00 H new ATOM 0 HD12 LEU A 47 11.602 -7.695 -3.990 1.00 0.00 H new ATOM 0 HD13 LEU A 47 12.700 -9.095 -4.045 1.00 0.00 H new ATOM 0 HD21 LEU A 47 13.769 -8.694 -1.139 1.00 0.00 H new ATOM 0 HD22 LEU A 47 14.857 -9.012 -2.511 1.00 0.00 H new ATOM 0 HD23 LEU A 47 15.092 -7.562 -1.507 1.00 0.00 H new ATOM 780 N ASN A 48 13.955 -8.211 -6.848 1.00 0.00 N ATOM 781 CA ASN A 48 13.228 -9.041 -7.794 1.00 0.00 C ATOM 782 C ASN A 48 14.082 -10.257 -8.159 1.00 0.00 C ATOM 783 O ASN A 48 13.571 -11.371 -8.258 1.00 0.00 O ATOM 784 CB ASN A 48 12.924 -8.273 -9.081 1.00 0.00 C ATOM 785 CG ASN A 48 11.632 -8.775 -9.728 1.00 0.00 C ATOM 786 OD1 ASN A 48 11.321 -9.955 -9.719 1.00 0.00 O ATOM 787 ND2 ASN A 48 10.899 -7.816 -10.287 1.00 0.00 N ATOM 0 H ASN A 48 14.107 -7.250 -7.153 1.00 0.00 H new ATOM 0 HA ASN A 48 12.291 -9.345 -7.326 1.00 0.00 H new ATOM 0 HB2 ASN A 48 12.835 -7.209 -8.861 1.00 0.00 H new ATOM 0 HB3 ASN A 48 13.753 -8.386 -9.780 1.00 0.00 H new ATOM 0 HD21 ASN A 48 10.017 -8.049 -10.744 1.00 0.00 H new ATOM 0 HD22 ASN A 48 11.218 -6.848 -10.258 1.00 0.00 H new ATOM 794 N GLN A 49 15.368 -10.002 -8.349 1.00 0.00 N ATOM 795 CA GLN A 49 16.297 -11.061 -8.702 1.00 0.00 C ATOM 796 C GLN A 49 16.693 -11.856 -7.455 1.00 0.00 C ATOM 797 O GLN A 49 17.055 -13.028 -7.551 1.00 0.00 O ATOM 798 CB GLN A 49 17.532 -10.496 -9.406 1.00 0.00 C ATOM 799 CG GLN A 49 18.734 -11.428 -9.238 1.00 0.00 C ATOM 800 CD GLN A 49 19.766 -11.196 -10.343 1.00 0.00 C ATOM 801 OE1 GLN A 49 19.575 -10.403 -11.250 1.00 0.00 O ATOM 802 NE2 GLN A 49 20.868 -11.930 -10.217 1.00 0.00 N ATOM 0 H GLN A 49 15.789 -9.077 -8.265 1.00 0.00 H new ATOM 0 HA GLN A 49 15.800 -11.736 -9.398 1.00 0.00 H new ATOM 0 HB2 GLN A 49 17.319 -10.358 -10.466 1.00 0.00 H new ATOM 0 HB3 GLN A 49 17.770 -9.513 -8.998 1.00 0.00 H new ATOM 0 HG2 GLN A 49 19.195 -11.261 -8.264 1.00 0.00 H new ATOM 0 HG3 GLN A 49 18.400 -12.465 -9.259 1.00 0.00 H new ATOM 0 HE21 GLN A 49 20.964 -12.575 -9.433 1.00 0.00 H new ATOM 0 HE22 GLN A 49 21.617 -11.847 -10.904 1.00 0.00 H new ATOM 811 N GLN A 50 16.609 -11.188 -6.315 1.00 0.00 N ATOM 812 CA GLN A 50 16.953 -11.817 -5.051 1.00 0.00 C ATOM 813 C GLN A 50 16.106 -13.073 -4.835 1.00 0.00 C ATOM 814 O GLN A 50 16.503 -13.974 -4.098 1.00 0.00 O ATOM 815 CB GLN A 50 16.789 -10.838 -3.888 1.00 0.00 C ATOM 816 CG GLN A 50 17.863 -9.750 -3.930 1.00 0.00 C ATOM 817 CD GLN A 50 17.836 -8.902 -2.657 1.00 0.00 C ATOM 818 OE1 GLN A 50 17.542 -9.374 -1.572 1.00 0.00 O ATOM 819 NE2 GLN A 50 18.159 -7.626 -2.850 1.00 0.00 N ATOM 0 H GLN A 50 16.307 -10.217 -6.240 1.00 0.00 H new ATOM 0 HA GLN A 50 18.002 -12.112 -5.088 1.00 0.00 H new ATOM 0 HB2 GLN A 50 15.801 -10.380 -3.930 1.00 0.00 H new ATOM 0 HB3 GLN A 50 16.850 -11.377 -2.943 1.00 0.00 H new ATOM 0 HG2 GLN A 50 18.845 -10.208 -4.045 1.00 0.00 H new ATOM 0 HG3 GLN A 50 17.705 -9.112 -4.799 1.00 0.00 H new ATOM 0 HE21 GLN A 50 18.395 -7.296 -3.786 1.00 0.00 H new ATOM 0 HE22 GLN A 50 18.171 -6.978 -2.062 1.00 0.00 H new ATOM 828 N PHE A 51 14.955 -13.091 -5.491 1.00 0.00 N ATOM 829 CA PHE A 51 14.048 -14.221 -5.380 1.00 0.00 C ATOM 830 C PHE A 51 13.631 -14.727 -6.762 1.00 0.00 C ATOM 831 O PHE A 51 13.724 -15.920 -7.045 1.00 0.00 O ATOM 832 CB PHE A 51 12.807 -13.727 -4.635 1.00 0.00 C ATOM 833 CG PHE A 51 13.083 -13.271 -3.201 1.00 0.00 C ATOM 834 CD1 PHE A 51 13.977 -13.948 -2.432 1.00 0.00 C ATOM 835 CD2 PHE A 51 12.433 -12.188 -2.694 1.00 0.00 C ATOM 836 CE1 PHE A 51 14.233 -13.525 -1.101 1.00 0.00 C ATOM 837 CE2 PHE A 51 12.689 -11.765 -1.363 1.00 0.00 C ATOM 838 CZ PHE A 51 13.584 -12.443 -0.594 1.00 0.00 C ATOM 0 H PHE A 51 14.630 -12.341 -6.101 1.00 0.00 H new ATOM 0 HA PHE A 51 14.538 -15.041 -4.855 1.00 0.00 H new ATOM 0 HB2 PHE A 51 12.368 -12.898 -5.191 1.00 0.00 H new ATOM 0 HB3 PHE A 51 12.066 -14.526 -4.615 1.00 0.00 H new ATOM 0 HD1 PHE A 51 14.493 -14.808 -2.834 1.00 0.00 H new ATOM 0 HD2 PHE A 51 11.722 -11.650 -3.304 1.00 0.00 H new ATOM 0 HE1 PHE A 51 14.944 -14.063 -0.491 1.00 0.00 H new ATOM 0 HE2 PHE A 51 12.174 -10.905 -0.961 1.00 0.00 H new ATOM 0 HZ PHE A 51 13.779 -12.122 0.419 1.00 0.00 H new ATOM 848 N ARG A 52 13.179 -13.793 -7.587 1.00 0.00 N ATOM 849 CA ARG A 52 12.747 -14.130 -8.933 1.00 0.00 C ATOM 850 C ARG A 52 13.951 -14.514 -9.797 1.00 0.00 C ATOM 851 O ARG A 52 13.795 -15.157 -10.834 1.00 0.00 O ATOM 852 CB ARG A 52 12.014 -12.956 -9.586 1.00 0.00 C ATOM 853 CG ARG A 52 10.912 -13.451 -10.524 1.00 0.00 C ATOM 854 CD ARG A 52 9.530 -13.254 -9.899 1.00 0.00 C ATOM 855 NE ARG A 52 8.541 -12.926 -10.950 1.00 0.00 N ATOM 856 CZ ARG A 52 7.990 -13.836 -11.781 1.00 0.00 C ATOM 857 NH1 ARG A 52 8.327 -15.140 -11.690 1.00 0.00 N ATOM 858 NH2 ARG A 52 7.116 -13.432 -12.684 1.00 0.00 N ATOM 0 H ARG A 52 13.103 -12.804 -7.349 1.00 0.00 H new ATOM 0 HA ARG A 52 12.063 -14.976 -8.860 1.00 0.00 H new ATOM 0 HB2 ARG A 52 11.581 -12.319 -8.815 1.00 0.00 H new ATOM 0 HB3 ARG A 52 12.723 -12.344 -10.143 1.00 0.00 H new ATOM 0 HG2 ARG A 52 10.967 -12.913 -11.471 1.00 0.00 H new ATOM 0 HG3 ARG A 52 11.067 -14.507 -10.747 1.00 0.00 H new ATOM 0 HD2 ARG A 52 9.227 -14.159 -9.373 1.00 0.00 H new ATOM 0 HD3 ARG A 52 9.567 -12.453 -9.160 1.00 0.00 H new ATOM 0 HE ARG A 52 8.258 -11.951 -11.053 1.00 0.00 H new ATOM 0 HH11 ARG A 52 9.003 -15.444 -10.989 1.00 0.00 H new ATOM 0 HH12 ARG A 52 7.906 -15.821 -12.322 1.00 0.00 H new ATOM 0 HH21 ARG A 52 6.866 -12.445 -12.746 1.00 0.00 H new ATOM 0 HH22 ARG A 52 6.690 -14.107 -13.320 1.00 0.00 H new ATOM 871 N GLY A 53 15.124 -14.104 -9.337 1.00 0.00 N ATOM 872 CA GLY A 53 16.353 -14.397 -10.054 1.00 0.00 C ATOM 873 C GLY A 53 16.434 -13.593 -11.354 1.00 0.00 C ATOM 874 O GLY A 53 17.348 -13.790 -12.153 1.00 0.00 O ATOM 0 H GLY A 53 15.249 -13.571 -8.476 1.00 0.00 H new ATOM 0 HA2 GLY A 53 17.211 -14.163 -9.423 1.00 0.00 H new ATOM 0 HA3 GLY A 53 16.403 -15.463 -10.277 1.00 0.00 H new ATOM 878 N GLN A 54 15.466 -12.705 -11.524 1.00 0.00 N ATOM 879 CA GLN A 54 15.417 -11.871 -12.713 1.00 0.00 C ATOM 880 C GLN A 54 15.715 -10.415 -12.353 1.00 0.00 C ATOM 881 O GLN A 54 15.324 -9.943 -11.286 1.00 0.00 O ATOM 882 CB GLN A 54 14.063 -11.996 -13.415 1.00 0.00 C ATOM 883 CG GLN A 54 14.050 -13.187 -14.374 1.00 0.00 C ATOM 884 CD GLN A 54 13.119 -12.926 -15.560 1.00 0.00 C ATOM 885 OE1 GLN A 54 12.121 -12.231 -15.458 1.00 0.00 O ATOM 886 NE2 GLN A 54 13.499 -13.521 -16.687 1.00 0.00 N ATOM 0 H GLN A 54 14.710 -12.545 -10.859 1.00 0.00 H new ATOM 0 HA GLN A 54 16.183 -12.217 -13.407 1.00 0.00 H new ATOM 0 HB2 GLN A 54 13.274 -12.114 -12.672 1.00 0.00 H new ATOM 0 HB3 GLN A 54 13.849 -11.080 -13.965 1.00 0.00 H new ATOM 0 HG2 GLN A 54 15.060 -13.378 -14.735 1.00 0.00 H new ATOM 0 HG3 GLN A 54 13.726 -14.082 -13.843 1.00 0.00 H new ATOM 0 HE21 GLN A 54 14.346 -14.089 -16.703 1.00 0.00 H new ATOM 0 HE22 GLN A 54 12.944 -13.409 -17.535 1.00 0.00 H new ATOM 895 N ASP A 55 16.406 -9.743 -13.262 1.00 0.00 N ATOM 896 CA ASP A 55 16.761 -8.350 -13.053 1.00 0.00 C ATOM 897 C ASP A 55 15.780 -7.457 -13.816 1.00 0.00 C ATOM 898 O ASP A 55 15.958 -7.211 -15.009 1.00 0.00 O ATOM 899 CB ASP A 55 18.170 -8.057 -13.573 1.00 0.00 C ATOM 900 CG ASP A 55 18.798 -6.765 -13.047 1.00 0.00 C ATOM 901 OD1 ASP A 55 18.494 -5.664 -13.531 1.00 0.00 O ATOM 902 OD2 ASP A 55 19.644 -6.922 -12.086 1.00 0.00 O ATOM 0 H ASP A 55 16.730 -10.138 -14.145 1.00 0.00 H new ATOM 0 HA ASP A 55 16.722 -8.149 -11.982 1.00 0.00 H new ATOM 0 HB2 ASP A 55 18.819 -8.892 -13.310 1.00 0.00 H new ATOM 0 HB3 ASP A 55 18.137 -8.010 -14.661 1.00 0.00 H new ATOM 908 N ARG A 56 14.767 -6.997 -13.098 1.00 0.00 N ATOM 909 CA ARG A 56 13.757 -6.137 -13.693 1.00 0.00 C ATOM 910 C ARG A 56 12.788 -5.636 -12.620 1.00 0.00 C ATOM 911 O ARG A 56 12.263 -6.424 -11.835 1.00 0.00 O ATOM 912 CB ARG A 56 12.970 -6.879 -14.775 1.00 0.00 C ATOM 913 CG ARG A 56 12.165 -8.033 -14.173 1.00 0.00 C ATOM 914 CD ARG A 56 10.673 -7.697 -14.131 1.00 0.00 C ATOM 915 NE ARG A 56 9.924 -8.798 -13.485 1.00 0.00 N ATOM 916 CZ ARG A 56 8.577 -8.871 -13.438 1.00 0.00 C ATOM 917 NH1 ARG A 56 7.818 -7.907 -14.000 1.00 0.00 N ATOM 918 NH2 ARG A 56 8.013 -9.901 -12.834 1.00 0.00 N ATOM 0 H ARG A 56 14.623 -7.203 -12.109 1.00 0.00 H new ATOM 0 HA ARG A 56 14.269 -5.290 -14.149 1.00 0.00 H new ATOM 0 HB2 ARG A 56 12.297 -6.186 -15.280 1.00 0.00 H new ATOM 0 HB3 ARG A 56 13.656 -7.264 -15.529 1.00 0.00 H new ATOM 0 HG2 ARG A 56 12.322 -8.937 -14.762 1.00 0.00 H new ATOM 0 HG3 ARG A 56 12.523 -8.244 -13.165 1.00 0.00 H new ATOM 0 HD2 ARG A 56 10.516 -6.768 -13.582 1.00 0.00 H new ATOM 0 HD3 ARG A 56 10.299 -7.536 -15.142 1.00 0.00 H new ATOM 0 HE ARG A 56 10.459 -9.548 -13.048 1.00 0.00 H new ATOM 0 HH11 ARG A 56 8.262 -7.115 -14.465 1.00 0.00 H new ATOM 0 HH12 ARG A 56 6.801 -7.970 -13.960 1.00 0.00 H new ATOM 0 HH21 ARG A 56 8.594 -10.626 -12.412 1.00 0.00 H new ATOM 0 HH22 ARG A 56 6.996 -9.972 -12.789 1.00 0.00 H new ATOM 931 N PRO A 57 12.575 -4.293 -12.621 1.00 0.00 N ATOM 932 CA PRO A 57 11.679 -3.676 -11.658 1.00 0.00 C ATOM 933 C PRO A 57 10.217 -3.943 -12.021 1.00 0.00 C ATOM 934 O PRO A 57 9.923 -4.433 -13.110 1.00 0.00 O ATOM 935 CB PRO A 57 12.036 -2.199 -11.678 1.00 0.00 C ATOM 936 CG PRO A 57 12.790 -1.970 -12.977 1.00 0.00 C ATOM 937 CD PRO A 57 13.180 -3.328 -13.536 1.00 0.00 C ATOM 0 HA PRO A 57 11.793 -4.086 -10.654 1.00 0.00 H new ATOM 0 HB2 PRO A 57 11.140 -1.580 -11.632 1.00 0.00 H new ATOM 0 HB3 PRO A 57 12.651 -1.934 -10.818 1.00 0.00 H new ATOM 0 HG2 PRO A 57 12.167 -1.429 -13.689 1.00 0.00 H new ATOM 0 HG3 PRO A 57 13.677 -1.361 -12.801 1.00 0.00 H new ATOM 0 HD2 PRO A 57 12.809 -3.459 -14.552 1.00 0.00 H new ATOM 0 HD3 PRO A 57 14.263 -3.444 -13.575 1.00 0.00 H new ATOM 945 N THR A 58 9.338 -3.610 -11.087 1.00 0.00 N ATOM 946 CA THR A 58 7.914 -3.807 -11.294 1.00 0.00 C ATOM 947 C THR A 58 7.110 -2.802 -10.468 1.00 0.00 C ATOM 948 O THR A 58 7.670 -2.085 -9.640 1.00 0.00 O ATOM 949 CB THR A 58 7.586 -5.265 -10.965 1.00 0.00 C ATOM 950 OG1 THR A 58 6.162 -5.311 -10.975 1.00 0.00 O ATOM 951 CG2 THR A 58 7.961 -5.640 -9.530 1.00 0.00 C ATOM 0 H THR A 58 9.585 -3.205 -10.184 1.00 0.00 H new ATOM 0 HA THR A 58 7.636 -3.622 -12.332 1.00 0.00 H new ATOM 0 HB THR A 58 8.110 -5.921 -11.660 1.00 0.00 H new ATOM 0 HG1 THR A 58 5.863 -6.222 -10.773 1.00 0.00 H new ATOM 0 HG21 THR A 58 7.707 -6.685 -9.349 1.00 0.00 H new ATOM 0 HG22 THR A 58 9.032 -5.496 -9.384 1.00 0.00 H new ATOM 0 HG23 THR A 58 7.412 -5.007 -8.833 1.00 0.00 H new ATOM 959 N ASP A 59 5.810 -2.781 -10.722 1.00 0.00 N ATOM 960 CA ASP A 59 4.923 -1.875 -10.011 1.00 0.00 C ATOM 961 C ASP A 59 4.957 -2.202 -8.517 1.00 0.00 C ATOM 962 O ASP A 59 5.370 -1.375 -7.706 1.00 0.00 O ATOM 963 CB ASP A 59 3.479 -2.025 -10.495 1.00 0.00 C ATOM 964 CG ASP A 59 3.180 -1.374 -11.847 1.00 0.00 C ATOM 965 OD1 ASP A 59 4.096 -0.969 -12.578 1.00 0.00 O ATOM 966 OD2 ASP A 59 1.928 -1.290 -12.146 1.00 0.00 O ATOM 0 H ASP A 59 5.349 -3.377 -11.410 1.00 0.00 H new ATOM 0 HA ASP A 59 5.262 -0.856 -10.198 1.00 0.00 H new ATOM 0 HB2 ASP A 59 3.242 -3.087 -10.559 1.00 0.00 H new ATOM 0 HB3 ASP A 59 2.814 -1.595 -9.746 1.00 0.00 H new ATOM 972 N VAL A 60 4.517 -3.411 -8.198 1.00 0.00 N ATOM 973 CA VAL A 60 4.492 -3.858 -6.816 1.00 0.00 C ATOM 974 C VAL A 60 4.775 -5.360 -6.765 1.00 0.00 C ATOM 975 O VAL A 60 4.271 -6.119 -7.592 1.00 0.00 O ATOM 976 CB VAL A 60 3.158 -3.479 -6.168 1.00 0.00 C ATOM 977 CG1 VAL A 60 1.989 -4.167 -6.875 1.00 0.00 C ATOM 978 CG2 VAL A 60 3.163 -3.805 -4.673 1.00 0.00 C ATOM 0 H VAL A 60 4.175 -4.095 -8.873 1.00 0.00 H new ATOM 0 HA VAL A 60 5.272 -3.361 -6.240 1.00 0.00 H new ATOM 0 HB VAL A 60 3.027 -2.402 -6.276 1.00 0.00 H new ATOM 0 HG11 VAL A 60 1.054 -3.880 -6.394 1.00 0.00 H new ATOM 0 HG12 VAL A 60 1.967 -3.863 -7.922 1.00 0.00 H new ATOM 0 HG13 VAL A 60 2.112 -5.248 -6.813 1.00 0.00 H new ATOM 0 HG21 VAL A 60 2.204 -3.526 -4.237 1.00 0.00 H new ATOM 0 HG22 VAL A 60 3.328 -4.873 -4.534 1.00 0.00 H new ATOM 0 HG23 VAL A 60 3.961 -3.248 -4.182 1.00 0.00 H new ATOM 988 N LEU A 61 5.581 -5.745 -5.786 1.00 0.00 N ATOM 989 CA LEU A 61 5.938 -7.143 -5.617 1.00 0.00 C ATOM 990 C LEU A 61 5.091 -7.749 -4.495 1.00 0.00 C ATOM 991 O LEU A 61 4.993 -7.178 -3.410 1.00 0.00 O ATOM 992 CB LEU A 61 7.445 -7.289 -5.396 1.00 0.00 C ATOM 993 CG LEU A 61 8.253 -7.788 -6.596 1.00 0.00 C ATOM 994 CD1 LEU A 61 9.218 -6.710 -7.094 1.00 0.00 C ATOM 995 CD2 LEU A 61 8.975 -9.095 -6.265 1.00 0.00 C ATOM 0 H LEU A 61 5.997 -5.113 -5.102 1.00 0.00 H new ATOM 0 HA LEU A 61 5.716 -7.705 -6.524 1.00 0.00 H new ATOM 0 HB2 LEU A 61 7.843 -6.321 -5.092 1.00 0.00 H new ATOM 0 HB3 LEU A 61 7.606 -7.975 -4.564 1.00 0.00 H new ATOM 0 HG LEU A 61 7.560 -8.000 -7.410 1.00 0.00 H new ATOM 0 HD11 LEU A 61 9.780 -7.091 -7.947 1.00 0.00 H new ATOM 0 HD12 LEU A 61 8.654 -5.828 -7.396 1.00 0.00 H new ATOM 0 HD13 LEU A 61 9.909 -6.443 -6.295 1.00 0.00 H new ATOM 0 HD21 LEU A 61 9.542 -9.428 -7.135 1.00 0.00 H new ATOM 0 HD22 LEU A 61 9.655 -8.933 -5.429 1.00 0.00 H new ATOM 0 HD23 LEU A 61 8.243 -9.857 -5.995 1.00 0.00 H new ATOM 1007 N THR A 62 4.502 -8.896 -4.796 1.00 0.00 N ATOM 1008 CA THR A 62 3.667 -9.585 -3.827 1.00 0.00 C ATOM 1009 C THR A 62 4.321 -10.900 -3.398 1.00 0.00 C ATOM 1010 O THR A 62 5.023 -11.534 -4.185 1.00 0.00 O ATOM 1011 CB THR A 62 2.279 -9.770 -4.445 1.00 0.00 C ATOM 1012 OG1 THR A 62 1.841 -8.442 -4.719 1.00 0.00 O ATOM 1013 CG2 THR A 62 1.256 -10.300 -3.438 1.00 0.00 C ATOM 0 H THR A 62 4.586 -9.366 -5.697 1.00 0.00 H new ATOM 0 HA THR A 62 3.557 -9.000 -2.914 1.00 0.00 H new ATOM 0 HB THR A 62 2.346 -10.456 -5.289 1.00 0.00 H new ATOM 0 HG1 THR A 62 0.949 -8.469 -5.123 1.00 0.00 H new ATOM 0 HG21 THR A 62 0.289 -10.413 -3.927 1.00 0.00 H new ATOM 0 HG22 THR A 62 1.586 -11.267 -3.059 1.00 0.00 H new ATOM 0 HG23 THR A 62 1.164 -9.598 -2.609 1.00 0.00 H new ATOM 1021 N PHE A 63 4.068 -11.272 -2.152 1.00 0.00 N ATOM 1022 CA PHE A 63 4.624 -12.500 -1.609 1.00 0.00 C ATOM 1023 C PHE A 63 3.830 -13.718 -2.086 1.00 0.00 C ATOM 1024 O PHE A 63 2.618 -13.637 -2.280 1.00 0.00 O ATOM 1025 CB PHE A 63 4.520 -12.403 -0.086 1.00 0.00 C ATOM 1026 CG PHE A 63 5.821 -12.733 0.648 1.00 0.00 C ATOM 1027 CD1 PHE A 63 6.979 -12.116 0.291 1.00 0.00 C ATOM 1028 CD2 PHE A 63 5.819 -13.643 1.659 1.00 0.00 C ATOM 1029 CE1 PHE A 63 8.186 -12.423 0.973 1.00 0.00 C ATOM 1030 CE2 PHE A 63 7.027 -13.950 2.340 1.00 0.00 C ATOM 1031 CZ PHE A 63 8.185 -13.333 1.983 1.00 0.00 C ATOM 0 H PHE A 63 3.485 -10.744 -1.502 1.00 0.00 H new ATOM 0 HA PHE A 63 5.656 -12.620 -1.939 1.00 0.00 H new ATOM 0 HB2 PHE A 63 4.209 -11.394 0.183 1.00 0.00 H new ATOM 0 HB3 PHE A 63 3.738 -13.080 0.259 1.00 0.00 H new ATOM 0 HD1 PHE A 63 6.981 -11.393 -0.511 1.00 0.00 H new ATOM 0 HD2 PHE A 63 4.899 -14.132 1.944 1.00 0.00 H new ATOM 0 HE1 PHE A 63 9.106 -11.933 0.689 1.00 0.00 H new ATOM 0 HE2 PHE A 63 7.026 -14.674 3.142 1.00 0.00 H new ATOM 0 HZ PHE A 63 9.103 -13.566 2.502 1.00 0.00 H new ATOM 1041 N PRO A 64 4.565 -14.848 -2.266 1.00 0.00 N ATOM 1042 CA PRO A 64 3.943 -16.082 -2.716 1.00 0.00 C ATOM 1043 C PRO A 64 3.147 -16.738 -1.587 1.00 0.00 C ATOM 1044 O PRO A 64 3.725 -17.323 -0.672 1.00 0.00 O ATOM 1045 CB PRO A 64 5.093 -16.944 -3.211 1.00 0.00 C ATOM 1046 CG PRO A 64 6.352 -16.355 -2.594 1.00 0.00 C ATOM 1047 CD PRO A 64 6.002 -14.981 -2.046 1.00 0.00 C ATOM 0 HA PRO A 64 3.213 -15.921 -3.510 1.00 0.00 H new ATOM 0 HB2 PRO A 64 4.960 -17.983 -2.910 1.00 0.00 H new ATOM 0 HB3 PRO A 64 5.149 -16.932 -4.299 1.00 0.00 H new ATOM 0 HG2 PRO A 64 6.725 -17.000 -1.798 1.00 0.00 H new ATOM 0 HG3 PRO A 64 7.143 -16.279 -3.340 1.00 0.00 H new ATOM 0 HD2 PRO A 64 6.249 -14.902 -0.987 1.00 0.00 H new ATOM 0 HD3 PRO A 64 6.556 -14.196 -2.562 1.00 0.00 H new ATOM 1055 N LEU A 65 1.831 -16.619 -1.687 1.00 0.00 N ATOM 1056 CA LEU A 65 0.949 -17.193 -0.686 1.00 0.00 C ATOM 1057 C LEU A 65 -0.506 -16.940 -1.088 1.00 0.00 C ATOM 1058 O LEU A 65 -1.040 -15.858 -0.851 1.00 0.00 O ATOM 1059 CB LEU A 65 1.302 -16.665 0.706 1.00 0.00 C ATOM 1060 CG LEU A 65 0.895 -15.220 0.999 1.00 0.00 C ATOM 1061 CD1 LEU A 65 1.368 -14.788 2.388 1.00 0.00 C ATOM 1062 CD2 LEU A 65 1.396 -14.276 -0.097 1.00 0.00 C ATOM 0 H LEU A 65 1.354 -16.133 -2.447 1.00 0.00 H new ATOM 0 HA LEU A 65 1.083 -18.274 -0.636 1.00 0.00 H new ATOM 0 HB2 LEU A 65 0.832 -17.311 1.448 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.380 -16.753 0.843 1.00 0.00 H new ATOM 0 HG LEU A 65 -0.194 -15.165 0.998 1.00 0.00 H new ATOM 0 HD11 LEU A 65 1.066 -13.757 2.571 1.00 0.00 H new ATOM 0 HD12 LEU A 65 0.922 -15.436 3.142 1.00 0.00 H new ATOM 0 HD13 LEU A 65 2.454 -14.863 2.442 1.00 0.00 H new ATOM 0 HD21 LEU A 65 1.093 -13.255 0.136 1.00 0.00 H new ATOM 0 HD22 LEU A 65 2.483 -14.328 -0.153 1.00 0.00 H new ATOM 0 HD23 LEU A 65 0.969 -14.572 -1.055 1.00 0.00 H new ATOM 1074 N MET A 66 -1.105 -17.957 -1.690 1.00 0.00 N ATOM 1075 CA MET A 66 -2.487 -17.858 -2.128 1.00 0.00 C ATOM 1076 C MET A 66 -3.413 -18.651 -1.203 1.00 0.00 C ATOM 1077 O MET A 66 -3.496 -19.874 -1.302 1.00 0.00 O ATOM 1078 CB MET A 66 -2.610 -18.393 -3.556 1.00 0.00 C ATOM 1079 CG MET A 66 -3.822 -17.787 -4.266 1.00 0.00 C ATOM 1080 SD MET A 66 -3.396 -17.364 -5.947 1.00 0.00 S ATOM 1081 CE MET A 66 -3.374 -15.584 -5.823 1.00 0.00 C ATOM 0 H MET A 66 -0.659 -18.853 -1.885 1.00 0.00 H new ATOM 0 HA MET A 66 -2.784 -16.810 -2.097 1.00 0.00 H new ATOM 0 HB2 MET A 66 -1.703 -18.161 -4.115 1.00 0.00 H new ATOM 0 HB3 MET A 66 -2.702 -19.479 -3.535 1.00 0.00 H new ATOM 0 HG2 MET A 66 -4.650 -18.496 -4.259 1.00 0.00 H new ATOM 0 HG3 MET A 66 -4.159 -16.898 -3.733 1.00 0.00 H new ATOM 0 HE1 MET A 66 -3.300 -15.151 -6.820 1.00 0.00 H new ATOM 0 HE2 MET A 66 -4.292 -15.241 -5.346 1.00 0.00 H new ATOM 0 HE3 MET A 66 -2.517 -15.271 -5.227 1.00 0.00 H new ATOM 1091 N GLU A 67 -4.086 -17.922 -0.325 1.00 0.00 N ATOM 1092 CA GLU A 67 -5.003 -18.542 0.616 1.00 0.00 C ATOM 1093 C GLU A 67 -5.979 -17.502 1.170 1.00 0.00 C ATOM 1094 O GLU A 67 -5.939 -16.337 0.778 1.00 0.00 O ATOM 1095 CB GLU A 67 -4.241 -19.236 1.747 1.00 0.00 C ATOM 1096 CG GLU A 67 -3.705 -20.596 1.294 1.00 0.00 C ATOM 1097 CD GLU A 67 -3.390 -21.489 2.495 1.00 0.00 C ATOM 1098 OE1 GLU A 67 -2.224 -21.589 2.905 1.00 0.00 O ATOM 1099 OE2 GLU A 67 -4.409 -22.093 3.008 1.00 0.00 O ATOM 0 H GLU A 67 -4.014 -16.908 -0.245 1.00 0.00 H new ATOM 0 HA GLU A 67 -5.576 -19.304 0.087 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -3.414 -18.606 2.073 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -4.899 -19.368 2.606 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -4.440 -21.086 0.655 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -2.805 -20.455 0.695 1.00 0.00 H new ATOM 1107 N GLU A 68 -6.833 -17.961 2.073 1.00 0.00 N ATOM 1108 CA GLU A 68 -7.817 -17.085 2.685 1.00 0.00 C ATOM 1109 C GLU A 68 -7.180 -16.282 3.821 1.00 0.00 C ATOM 1110 O GLU A 68 -7.697 -16.262 4.937 1.00 0.00 O ATOM 1111 CB GLU A 68 -9.024 -17.881 3.186 1.00 0.00 C ATOM 1112 CG GLU A 68 -10.225 -17.699 2.257 1.00 0.00 C ATOM 1113 CD GLU A 68 -11.355 -18.664 2.625 1.00 0.00 C ATOM 1114 OE1 GLU A 68 -11.854 -18.630 3.760 1.00 0.00 O ATOM 1115 OE2 GLU A 68 -11.712 -19.469 1.683 1.00 0.00 O ATOM 0 H GLU A 68 -6.864 -18.928 2.395 1.00 0.00 H new ATOM 0 HA GLU A 68 -8.173 -16.386 1.928 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -8.766 -18.938 3.250 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -9.286 -17.556 4.193 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -10.585 -16.672 2.319 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -9.919 -17.868 1.224 1.00 0.00 H new ATOM 1123 N ASP A 69 -6.068 -15.640 3.497 1.00 0.00 N ATOM 1124 CA ASP A 69 -5.355 -14.837 4.477 1.00 0.00 C ATOM 1125 C ASP A 69 -3.883 -14.734 4.071 1.00 0.00 C ATOM 1126 O ASP A 69 -3.197 -15.747 3.947 1.00 0.00 O ATOM 1127 CB ASP A 69 -5.418 -15.477 5.865 1.00 0.00 C ATOM 1128 CG ASP A 69 -6.425 -14.841 6.825 1.00 0.00 C ATOM 1129 OD1 ASP A 69 -6.577 -13.611 6.868 1.00 0.00 O ATOM 1130 OD2 ASP A 69 -7.079 -15.675 7.561 1.00 0.00 O ATOM 0 H ASP A 69 -5.643 -15.659 2.570 1.00 0.00 H new ATOM 0 HA ASP A 69 -5.823 -13.853 4.512 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -5.664 -16.533 5.751 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -4.427 -15.428 6.317 1.00 0.00 H new ATOM 1136 N VAL A 70 -3.442 -13.500 3.876 1.00 0.00 N ATOM 1137 CA VAL A 70 -2.064 -13.251 3.487 1.00 0.00 C ATOM 1138 C VAL A 70 -1.210 -13.063 4.742 1.00 0.00 C ATOM 1139 O VAL A 70 -0.194 -13.735 4.912 1.00 0.00 O ATOM 1140 CB VAL A 70 -1.998 -12.055 2.534 1.00 0.00 C ATOM 1141 CG1 VAL A 70 -3.160 -11.091 2.782 1.00 0.00 C ATOM 1142 CG2 VAL A 70 -0.653 -11.335 2.651 1.00 0.00 C ATOM 0 H VAL A 70 -4.014 -12.662 3.980 1.00 0.00 H new ATOM 0 HA VAL A 70 -1.660 -14.105 2.944 1.00 0.00 H new ATOM 0 HB VAL A 70 -2.088 -12.433 1.516 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -3.089 -10.250 2.092 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -4.105 -11.611 2.624 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -3.115 -10.723 3.807 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -0.632 -10.489 1.964 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -0.520 -10.976 3.672 1.00 0.00 H new ATOM 0 HG23 VAL A 70 0.152 -12.026 2.401 1.00 0.00 H new ATOM 1152 N TYR A 71 -1.654 -12.146 5.589 1.00 0.00 N ATOM 1153 CA TYR A 71 -0.943 -11.861 6.824 1.00 0.00 C ATOM 1154 C TYR A 71 0.566 -12.031 6.639 1.00 0.00 C ATOM 1155 O TYR A 71 1.259 -12.485 7.548 1.00 0.00 O ATOM 1156 CB TYR A 71 -1.439 -12.890 7.843 1.00 0.00 C ATOM 1157 CG TYR A 71 -0.823 -14.280 7.673 1.00 0.00 C ATOM 1158 CD1 TYR A 71 -1.313 -15.140 6.711 1.00 0.00 C ATOM 1159 CD2 TYR A 71 0.223 -14.675 8.482 1.00 0.00 C ATOM 1160 CE1 TYR A 71 -0.734 -16.448 6.551 1.00 0.00 C ATOM 1161 CE2 TYR A 71 0.803 -15.984 8.323 1.00 0.00 C ATOM 1162 CZ TYR A 71 0.296 -16.805 7.365 1.00 0.00 C ATOM 1163 OH TYR A 71 0.843 -18.041 7.215 1.00 0.00 O ATOM 0 H TYR A 71 -2.497 -11.591 5.444 1.00 0.00 H new ATOM 0 HA TYR A 71 -1.124 -10.835 7.144 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -1.220 -12.527 8.847 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -2.523 -12.972 7.763 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -2.132 -14.831 6.078 1.00 0.00 H new ATOM 0 HD2 TYR A 71 0.607 -14.002 9.235 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -1.108 -17.130 5.802 1.00 0.00 H new ATOM 0 HE2 TYR A 71 1.621 -16.306 8.950 1.00 0.00 H new ATOM 0 HH TYR A 71 1.569 -18.158 7.862 1.00 0.00 H new ATOM 1173 N GLY A 72 1.031 -11.656 5.457 1.00 0.00 N ATOM 1174 CA GLY A 72 2.445 -11.761 5.141 1.00 0.00 C ATOM 1175 C GLY A 72 3.060 -10.378 4.913 1.00 0.00 C ATOM 1176 O GLY A 72 2.823 -9.454 5.690 1.00 0.00 O ATOM 0 H GLY A 72 0.453 -11.279 4.706 1.00 0.00 H new ATOM 0 HA2 GLY A 72 2.967 -12.265 5.954 1.00 0.00 H new ATOM 0 HA3 GLY A 72 2.578 -12.373 4.249 1.00 0.00 H new ATOM 1180 N GLU A 73 3.837 -10.280 3.845 1.00 0.00 N ATOM 1181 CA GLU A 73 4.488 -9.026 3.505 1.00 0.00 C ATOM 1182 C GLU A 73 4.182 -8.645 2.055 1.00 0.00 C ATOM 1183 O GLU A 73 3.950 -9.515 1.217 1.00 0.00 O ATOM 1184 CB GLU A 73 5.997 -9.109 3.743 1.00 0.00 C ATOM 1185 CG GLU A 73 6.636 -10.172 2.848 1.00 0.00 C ATOM 1186 CD GLU A 73 8.139 -10.278 3.110 1.00 0.00 C ATOM 1187 OE1 GLU A 73 8.933 -9.587 2.454 1.00 0.00 O ATOM 1188 OE2 GLU A 73 8.474 -11.115 4.033 1.00 0.00 O ATOM 0 H GLU A 73 4.031 -11.049 3.203 1.00 0.00 H new ATOM 0 HA GLU A 73 4.093 -8.246 4.156 1.00 0.00 H new ATOM 0 HB2 GLU A 73 6.454 -8.139 3.545 1.00 0.00 H new ATOM 0 HB3 GLU A 73 6.191 -9.345 4.789 1.00 0.00 H new ATOM 0 HG2 GLU A 73 6.163 -11.137 3.029 1.00 0.00 H new ATOM 0 HG3 GLU A 73 6.462 -9.923 1.801 1.00 0.00 H new ATOM 1196 N ILE A 74 4.190 -7.344 1.804 1.00 0.00 N ATOM 1197 CA ILE A 74 3.916 -6.837 0.471 1.00 0.00 C ATOM 1198 C ILE A 74 4.992 -5.821 0.085 1.00 0.00 C ATOM 1199 O ILE A 74 5.139 -4.789 0.738 1.00 0.00 O ATOM 1200 CB ILE A 74 2.491 -6.285 0.389 1.00 0.00 C ATOM 1201 CG1 ILE A 74 2.090 -5.609 1.702 1.00 0.00 C ATOM 1202 CG2 ILE A 74 1.502 -7.378 -0.019 1.00 0.00 C ATOM 1203 CD1 ILE A 74 1.679 -6.646 2.749 1.00 0.00 C ATOM 0 H ILE A 74 4.382 -6.626 2.502 1.00 0.00 H new ATOM 0 HA ILE A 74 3.962 -7.644 -0.260 1.00 0.00 H new ATOM 0 HB ILE A 74 2.464 -5.521 -0.388 1.00 0.00 H new ATOM 0 HG12 ILE A 74 2.923 -5.016 2.079 1.00 0.00 H new ATOM 0 HG13 ILE A 74 1.264 -4.920 1.523 1.00 0.00 H new ATOM 0 HG21 ILE A 74 0.497 -6.959 -0.070 1.00 0.00 H new ATOM 0 HG22 ILE A 74 1.780 -7.774 -0.996 1.00 0.00 H new ATOM 0 HG23 ILE A 74 1.523 -8.181 0.717 1.00 0.00 H new ATOM 0 HD11 ILE A 74 1.399 -6.139 3.672 1.00 0.00 H new ATOM 0 HD12 ILE A 74 0.830 -7.221 2.378 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.515 -7.318 2.943 1.00 0.00 H new ATOM 1215 N TYR A 75 5.718 -6.148 -0.975 1.00 0.00 N ATOM 1216 CA TYR A 75 6.777 -5.277 -1.455 1.00 0.00 C ATOM 1217 C TYR A 75 6.220 -4.205 -2.394 1.00 0.00 C ATOM 1218 O TYR A 75 5.539 -4.521 -3.369 1.00 0.00 O ATOM 1219 CB TYR A 75 7.739 -6.173 -2.237 1.00 0.00 C ATOM 1220 CG TYR A 75 8.602 -7.077 -1.355 1.00 0.00 C ATOM 1221 CD1 TYR A 75 8.091 -8.266 -0.875 1.00 0.00 C ATOM 1222 CD2 TYR A 75 9.893 -6.704 -1.039 1.00 0.00 C ATOM 1223 CE1 TYR A 75 8.903 -9.117 -0.045 1.00 0.00 C ATOM 1224 CE2 TYR A 75 10.706 -7.555 -0.209 1.00 0.00 C ATOM 1225 CZ TYR A 75 10.171 -8.719 0.247 1.00 0.00 C ATOM 1226 OH TYR A 75 10.939 -9.523 1.031 1.00 0.00 O ATOM 0 H TYR A 75 5.593 -7.005 -1.515 1.00 0.00 H new ATOM 0 HA TYR A 75 7.263 -4.769 -0.622 1.00 0.00 H new ATOM 0 HB2 TYR A 75 7.164 -6.794 -2.924 1.00 0.00 H new ATOM 0 HB3 TYR A 75 8.391 -5.546 -2.845 1.00 0.00 H new ATOM 0 HD1 TYR A 75 7.081 -8.558 -1.122 1.00 0.00 H new ATOM 0 HD2 TYR A 75 10.293 -5.774 -1.414 1.00 0.00 H new ATOM 0 HE1 TYR A 75 8.515 -10.050 0.337 1.00 0.00 H new ATOM 0 HE2 TYR A 75 11.718 -7.275 0.045 1.00 0.00 H new ATOM 0 HH TYR A 75 10.436 -9.775 1.833 1.00 0.00 H new ATOM 1236 N VAL A 76 6.531 -2.959 -2.069 1.00 0.00 N ATOM 1237 CA VAL A 76 6.071 -1.838 -2.871 1.00 0.00 C ATOM 1238 C VAL A 76 7.266 -0.959 -3.244 1.00 0.00 C ATOM 1239 O VAL A 76 8.226 -0.854 -2.482 1.00 0.00 O ATOM 1240 CB VAL A 76 4.976 -1.074 -2.124 1.00 0.00 C ATOM 1241 CG1 VAL A 76 4.793 0.330 -2.705 1.00 0.00 C ATOM 1242 CG2 VAL A 76 3.658 -1.850 -2.138 1.00 0.00 C ATOM 0 H VAL A 76 7.097 -2.701 -1.260 1.00 0.00 H new ATOM 0 HA VAL A 76 5.625 -2.191 -3.801 1.00 0.00 H new ATOM 0 HB VAL A 76 5.290 -0.968 -1.086 1.00 0.00 H new ATOM 0 HG11 VAL A 76 4.009 0.852 -2.156 1.00 0.00 H new ATOM 0 HG12 VAL A 76 5.727 0.884 -2.618 1.00 0.00 H new ATOM 0 HG13 VAL A 76 4.512 0.255 -3.756 1.00 0.00 H new ATOM 0 HG21 VAL A 76 2.897 -1.284 -1.600 1.00 0.00 H new ATOM 0 HG22 VAL A 76 3.336 -2.002 -3.168 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.800 -2.817 -1.655 1.00 0.00 H new ATOM 1252 N CYS A 77 7.168 -0.349 -4.417 1.00 0.00 N ATOM 1253 CA CYS A 77 8.229 0.518 -4.900 1.00 0.00 C ATOM 1254 C CYS A 77 7.594 1.804 -5.432 1.00 0.00 C ATOM 1255 O CYS A 77 7.016 1.812 -6.517 1.00 0.00 O ATOM 1256 CB CYS A 77 9.087 -0.176 -5.960 1.00 0.00 C ATOM 1257 SG CYS A 77 8.061 -1.335 -6.936 1.00 0.00 S ATOM 0 H CYS A 77 6.370 -0.438 -5.046 1.00 0.00 H new ATOM 0 HA CYS A 77 8.906 0.761 -4.081 1.00 0.00 H new ATOM 0 HB2 CYS A 77 9.537 0.567 -6.618 1.00 0.00 H new ATOM 0 HB3 CYS A 77 9.905 -0.715 -5.482 1.00 0.00 H new ATOM 0 HG CYS A 77 6.892 -0.807 -7.147 1.00 0.00 H new ATOM 1263 N PRO A 78 7.726 2.888 -4.621 1.00 0.00 N ATOM 1264 CA PRO A 78 7.171 4.177 -4.998 1.00 0.00 C ATOM 1265 C PRO A 78 8.020 4.842 -6.083 1.00 0.00 C ATOM 1266 O PRO A 78 7.647 5.886 -6.615 1.00 0.00 O ATOM 1267 CB PRO A 78 7.123 4.977 -3.707 1.00 0.00 C ATOM 1268 CG PRO A 78 8.076 4.282 -2.749 1.00 0.00 C ATOM 1269 CD PRO A 78 8.403 2.915 -3.328 1.00 0.00 C ATOM 0 HA PRO A 78 6.177 4.096 -5.437 1.00 0.00 H new ATOM 0 HB2 PRO A 78 7.425 6.010 -3.877 1.00 0.00 H new ATOM 0 HB3 PRO A 78 6.112 5.003 -3.301 1.00 0.00 H new ATOM 0 HG2 PRO A 78 8.985 4.870 -2.621 1.00 0.00 H new ATOM 0 HG3 PRO A 78 7.621 4.181 -1.764 1.00 0.00 H new ATOM 0 HD2 PRO A 78 9.479 2.780 -3.441 1.00 0.00 H new ATOM 0 HD3 PRO A 78 8.048 2.115 -2.679 1.00 0.00 H new ATOM 1277 N LEU A 79 9.146 4.210 -6.379 1.00 0.00 N ATOM 1278 CA LEU A 79 10.051 4.728 -7.391 1.00 0.00 C ATOM 1279 C LEU A 79 9.451 4.488 -8.777 1.00 0.00 C ATOM 1280 O LEU A 79 9.309 5.420 -9.567 1.00 0.00 O ATOM 1281 CB LEU A 79 11.450 4.132 -7.215 1.00 0.00 C ATOM 1282 CG LEU A 79 12.620 5.052 -7.568 1.00 0.00 C ATOM 1283 CD1 LEU A 79 12.477 5.600 -8.989 1.00 0.00 C ATOM 1284 CD2 LEU A 79 12.770 6.170 -6.535 1.00 0.00 C ATOM 0 H LEU A 79 9.452 3.344 -5.936 1.00 0.00 H new ATOM 0 HA LEU A 79 10.172 5.805 -7.278 1.00 0.00 H new ATOM 0 HB2 LEU A 79 11.561 3.817 -6.177 1.00 0.00 H new ATOM 0 HB3 LEU A 79 11.521 3.235 -7.830 1.00 0.00 H new ATOM 0 HG LEU A 79 13.537 4.464 -7.540 1.00 0.00 H new ATOM 0 HD11 LEU A 79 13.322 6.251 -9.215 1.00 0.00 H new ATOM 0 HD12 LEU A 79 12.457 4.772 -9.698 1.00 0.00 H new ATOM 0 HD13 LEU A 79 11.550 6.168 -9.068 1.00 0.00 H new ATOM 0 HD21 LEU A 79 13.609 6.809 -6.810 1.00 0.00 H new ATOM 0 HD22 LEU A 79 11.856 6.763 -6.506 1.00 0.00 H new ATOM 0 HD23 LEU A 79 12.952 5.735 -5.552 1.00 0.00 H new ATOM 1296 N ILE A 80 9.113 3.232 -9.031 1.00 0.00 N ATOM 1297 CA ILE A 80 8.530 2.857 -10.309 1.00 0.00 C ATOM 1298 C ILE A 80 7.060 3.280 -10.337 1.00 0.00 C ATOM 1299 O ILE A 80 6.566 3.750 -11.361 1.00 0.00 O ATOM 1300 CB ILE A 80 8.748 1.367 -10.580 1.00 0.00 C ATOM 1301 CG1 ILE A 80 10.235 1.011 -10.526 1.00 0.00 C ATOM 1302 CG2 ILE A 80 8.107 0.953 -11.906 1.00 0.00 C ATOM 1303 CD1 ILE A 80 10.530 0.068 -9.357 1.00 0.00 C ATOM 0 H ILE A 80 9.232 2.461 -8.374 1.00 0.00 H new ATOM 0 HA ILE A 80 9.028 3.381 -11.125 1.00 0.00 H new ATOM 0 HB ILE A 80 8.253 0.800 -9.791 1.00 0.00 H new ATOM 0 HG12 ILE A 80 10.534 0.540 -11.462 1.00 0.00 H new ATOM 0 HG13 ILE A 80 10.827 1.920 -10.423 1.00 0.00 H new ATOM 0 HG21 ILE A 80 8.276 -0.110 -12.075 1.00 0.00 H new ATOM 0 HG22 ILE A 80 7.035 1.149 -11.869 1.00 0.00 H new ATOM 0 HG23 ILE A 80 8.552 1.525 -12.720 1.00 0.00 H new ATOM 0 HD11 ILE A 80 11.594 -0.170 -9.341 1.00 0.00 H new ATOM 0 HD12 ILE A 80 10.252 0.551 -8.420 1.00 0.00 H new ATOM 0 HD13 ILE A 80 9.955 -0.850 -9.476 1.00 0.00 H new ATOM 1315 N VAL A 81 6.403 3.097 -9.202 1.00 0.00 N ATOM 1316 CA VAL A 81 4.999 3.453 -9.084 1.00 0.00 C ATOM 1317 C VAL A 81 4.821 4.931 -9.438 1.00 0.00 C ATOM 1318 O VAL A 81 4.073 5.267 -10.354 1.00 0.00 O ATOM 1319 CB VAL A 81 4.487 3.107 -7.684 1.00 0.00 C ATOM 1320 CG1 VAL A 81 3.053 3.601 -7.487 1.00 0.00 C ATOM 1321 CG2 VAL A 81 4.591 1.604 -7.418 1.00 0.00 C ATOM 0 H VAL A 81 6.817 2.707 -8.355 1.00 0.00 H new ATOM 0 HA VAL A 81 4.398 2.876 -9.787 1.00 0.00 H new ATOM 0 HB VAL A 81 5.120 3.620 -6.960 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.714 3.342 -6.484 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.020 4.683 -7.613 1.00 0.00 H new ATOM 0 HG13 VAL A 81 2.402 3.130 -8.223 1.00 0.00 H new ATOM 0 HG21 VAL A 81 4.221 1.385 -6.416 1.00 0.00 H new ATOM 0 HG22 VAL A 81 3.994 1.062 -8.152 1.00 0.00 H new ATOM 0 HG23 VAL A 81 5.632 1.292 -7.496 1.00 0.00 H new ATOM 1331 N GLU A 82 5.521 5.773 -8.692 1.00 0.00 N ATOM 1332 CA GLU A 82 5.449 7.207 -8.916 1.00 0.00 C ATOM 1333 C GLU A 82 5.808 7.537 -10.366 1.00 0.00 C ATOM 1334 O GLU A 82 5.116 8.317 -11.019 1.00 0.00 O ATOM 1335 CB GLU A 82 6.357 7.960 -7.941 1.00 0.00 C ATOM 1336 CG GLU A 82 7.818 7.898 -8.394 1.00 0.00 C ATOM 1337 CD GLU A 82 8.734 8.598 -7.388 1.00 0.00 C ATOM 1338 OE1 GLU A 82 8.878 8.128 -6.250 1.00 0.00 O ATOM 1339 OE2 GLU A 82 9.308 9.667 -7.825 1.00 0.00 O ATOM 0 H GLU A 82 6.140 5.490 -7.932 1.00 0.00 H new ATOM 0 HA GLU A 82 4.425 7.533 -8.733 1.00 0.00 H new ATOM 0 HB2 GLU A 82 6.038 9.000 -7.870 1.00 0.00 H new ATOM 0 HB3 GLU A 82 6.263 7.529 -6.944 1.00 0.00 H new ATOM 0 HG2 GLU A 82 8.124 6.858 -8.507 1.00 0.00 H new ATOM 0 HG3 GLU A 82 7.919 8.368 -9.372 1.00 0.00 H new ATOM 1347 N GLU A 83 6.889 6.926 -10.828 1.00 0.00 N ATOM 1348 CA GLU A 83 7.348 7.145 -12.189 1.00 0.00 C ATOM 1349 C GLU A 83 6.207 6.905 -13.179 1.00 0.00 C ATOM 1350 O GLU A 83 6.150 7.539 -14.232 1.00 0.00 O ATOM 1351 CB GLU A 83 8.551 6.256 -12.512 1.00 0.00 C ATOM 1352 CG GLU A 83 8.992 6.437 -13.966 1.00 0.00 C ATOM 1353 CD GLU A 83 10.414 6.998 -14.041 1.00 0.00 C ATOM 1354 OE1 GLU A 83 10.861 7.681 -13.108 1.00 0.00 O ATOM 1355 OE2 GLU A 83 11.061 6.701 -15.116 1.00 0.00 O ATOM 0 H GLU A 83 7.460 6.279 -10.284 1.00 0.00 H new ATOM 0 HA GLU A 83 7.670 8.182 -12.281 1.00 0.00 H new ATOM 0 HB2 GLU A 83 9.378 6.500 -11.845 1.00 0.00 H new ATOM 0 HB3 GLU A 83 8.294 5.212 -12.333 1.00 0.00 H new ATOM 0 HG2 GLU A 83 8.947 5.480 -14.485 1.00 0.00 H new ATOM 0 HG3 GLU A 83 8.304 7.110 -14.478 1.00 0.00 H new ATOM 1363 N ASN A 84 5.326 5.988 -12.807 1.00 0.00 N ATOM 1364 CA ASN A 84 4.189 5.657 -13.649 1.00 0.00 C ATOM 1365 C ASN A 84 3.108 6.727 -13.484 1.00 0.00 C ATOM 1366 O ASN A 84 2.598 7.256 -14.471 1.00 0.00 O ATOM 1367 CB ASN A 84 3.584 4.309 -13.252 1.00 0.00 C ATOM 1368 CG ASN A 84 4.675 3.253 -13.062 1.00 0.00 C ATOM 1369 OD1 ASN A 84 4.660 2.468 -12.128 1.00 0.00 O ATOM 1370 ND2 ASN A 84 5.619 3.276 -13.998 1.00 0.00 N ATOM 0 H ASN A 84 5.377 5.464 -11.934 1.00 0.00 H new ATOM 0 HA ASN A 84 4.537 5.607 -14.681 1.00 0.00 H new ATOM 0 HB2 ASN A 84 3.015 4.419 -12.329 1.00 0.00 H new ATOM 0 HB3 ASN A 84 2.884 3.980 -14.020 1.00 0.00 H new ATOM 0 HD21 ASN A 84 6.391 2.610 -13.961 1.00 0.00 H new ATOM 0 HD22 ASN A 84 5.572 3.960 -14.753 1.00 0.00 H new ATOM 1377 N ALA A 85 2.791 7.014 -12.230 1.00 0.00 N ATOM 1378 CA ALA A 85 1.780 8.012 -11.924 1.00 0.00 C ATOM 1379 C ALA A 85 2.148 9.331 -12.607 1.00 0.00 C ATOM 1380 O ALA A 85 1.273 10.137 -12.920 1.00 0.00 O ATOM 1381 CB ALA A 85 1.650 8.158 -10.406 1.00 0.00 C ATOM 0 H ALA A 85 3.216 6.573 -11.414 1.00 0.00 H new ATOM 0 HA ALA A 85 0.807 7.703 -12.307 1.00 0.00 H new ATOM 0 HB1 ALA A 85 0.892 8.907 -10.176 1.00 0.00 H new ATOM 0 HB2 ALA A 85 1.359 7.201 -9.972 1.00 0.00 H new ATOM 0 HB3 ALA A 85 2.607 8.470 -9.987 1.00 0.00 H new ATOM 1387 N ARG A 86 3.444 9.510 -12.817 1.00 0.00 N ATOM 1388 CA ARG A 86 3.938 10.718 -13.457 1.00 0.00 C ATOM 1389 C ARG A 86 3.479 10.771 -14.916 1.00 0.00 C ATOM 1390 O ARG A 86 3.057 11.820 -15.400 1.00 0.00 O ATOM 1391 CB ARG A 86 5.466 10.782 -13.408 1.00 0.00 C ATOM 1392 CG ARG A 86 5.956 11.086 -11.991 1.00 0.00 C ATOM 1393 CD ARG A 86 7.169 12.017 -12.018 1.00 0.00 C ATOM 1394 NE ARG A 86 6.744 13.393 -12.359 1.00 0.00 N ATOM 1395 CZ ARG A 86 6.816 13.922 -13.600 1.00 0.00 C ATOM 1396 NH1 ARG A 86 7.298 13.193 -14.628 1.00 0.00 N ATOM 1397 NH2 ARG A 86 6.407 15.162 -13.791 1.00 0.00 N ATOM 0 H ARG A 86 4.167 8.839 -12.556 1.00 0.00 H new ATOM 0 HA ARG A 86 3.532 11.571 -12.913 1.00 0.00 H new ATOM 0 HB2 ARG A 86 5.884 9.834 -13.746 1.00 0.00 H new ATOM 0 HB3 ARG A 86 5.824 11.551 -14.093 1.00 0.00 H new ATOM 0 HG2 ARG A 86 5.153 11.546 -11.416 1.00 0.00 H new ATOM 0 HG3 ARG A 86 6.218 10.156 -11.486 1.00 0.00 H new ATOM 0 HD2 ARG A 86 7.664 12.011 -11.047 1.00 0.00 H new ATOM 0 HD3 ARG A 86 7.895 11.660 -12.748 1.00 0.00 H new ATOM 0 HE ARG A 86 6.374 13.978 -11.610 1.00 0.00 H new ATOM 0 HH11 ARG A 86 7.611 12.235 -14.471 1.00 0.00 H new ATOM 0 HH12 ARG A 86 7.349 13.600 -15.562 1.00 0.00 H new ATOM 0 HH21 ARG A 86 6.044 15.705 -13.008 1.00 0.00 H new ATOM 0 HH22 ARG A 86 6.454 15.577 -14.722 1.00 0.00 H new ATOM 1410 N GLU A 87 3.577 9.626 -15.576 1.00 0.00 N ATOM 1411 CA GLU A 87 3.178 9.529 -16.969 1.00 0.00 C ATOM 1412 C GLU A 87 1.652 9.483 -17.082 1.00 0.00 C ATOM 1413 O GLU A 87 1.098 9.725 -18.154 1.00 0.00 O ATOM 1414 CB GLU A 87 3.814 8.309 -17.638 1.00 0.00 C ATOM 1415 CG GLU A 87 3.307 7.011 -17.007 1.00 0.00 C ATOM 1416 CD GLU A 87 3.336 5.862 -18.017 1.00 0.00 C ATOM 1417 OE1 GLU A 87 2.288 5.493 -18.567 1.00 0.00 O ATOM 1418 OE2 GLU A 87 4.501 5.348 -18.225 1.00 0.00 O ATOM 0 H GLU A 87 3.927 8.758 -15.171 1.00 0.00 H new ATOM 0 HA GLU A 87 3.535 10.416 -17.492 1.00 0.00 H new ATOM 0 HB2 GLU A 87 3.585 8.313 -18.704 1.00 0.00 H new ATOM 0 HB3 GLU A 87 4.899 8.363 -17.545 1.00 0.00 H new ATOM 0 HG2 GLU A 87 3.923 6.757 -16.144 1.00 0.00 H new ATOM 0 HG3 GLU A 87 2.290 7.153 -16.642 1.00 0.00 H new ATOM 1426 N PHE A 88 1.017 9.172 -15.962 1.00 0.00 N ATOM 1427 CA PHE A 88 -0.433 9.091 -15.922 1.00 0.00 C ATOM 1428 C PHE A 88 -1.016 10.158 -14.993 1.00 0.00 C ATOM 1429 O PHE A 88 -2.192 10.101 -14.637 1.00 0.00 O ATOM 1430 CB PHE A 88 -0.789 7.707 -15.377 1.00 0.00 C ATOM 1431 CG PHE A 88 -2.025 7.081 -16.027 1.00 0.00 C ATOM 1432 CD1 PHE A 88 -1.914 6.440 -17.221 1.00 0.00 C ATOM 1433 CD2 PHE A 88 -3.234 7.165 -15.410 1.00 0.00 C ATOM 1434 CE1 PHE A 88 -3.060 5.859 -17.825 1.00 0.00 C ATOM 1435 CE2 PHE A 88 -4.381 6.584 -16.014 1.00 0.00 C ATOM 1436 CZ PHE A 88 -4.270 5.944 -17.208 1.00 0.00 C ATOM 0 H PHE A 88 1.480 8.973 -15.075 1.00 0.00 H new ATOM 0 HA PHE A 88 -0.842 9.253 -16.919 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.062 7.041 -15.522 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -0.955 7.783 -14.302 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -0.953 6.373 -17.710 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -3.322 7.673 -14.461 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -2.972 5.350 -18.773 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.341 6.651 -15.524 1.00 0.00 H new ATOM 0 HZ PHE A 88 -5.142 5.503 -17.667 1.00 0.00 H new ATOM 1446 N ASN A 89 -0.166 11.106 -14.626 1.00 0.00 N ATOM 1447 CA ASN A 89 -0.582 12.184 -13.745 1.00 0.00 C ATOM 1448 C ASN A 89 -1.473 11.617 -12.638 1.00 0.00 C ATOM 1449 O ASN A 89 -2.338 12.316 -12.113 1.00 0.00 O ATOM 1450 CB ASN A 89 -1.387 13.238 -14.507 1.00 0.00 C ATOM 1451 CG ASN A 89 -1.876 14.341 -13.565 1.00 0.00 C ATOM 1452 OD1 ASN A 89 -0.955 14.767 -12.706 1.00 0.00 O flip ATOM 1453 ND2 ASN A 89 -3.015 14.775 -13.615 1.00 0.00 N flip ATOM 0 H ASN A 89 0.809 11.150 -14.923 1.00 0.00 H new ATOM 0 HA ASN A 89 0.314 12.645 -13.330 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -0.770 13.673 -15.293 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -2.240 12.767 -14.995 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -3.673 14.403 -14.300 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -3.309 15.510 -12.972 1.00 0.00 H new ATOM 1460 N ASN A 90 -1.231 10.355 -12.316 1.00 0.00 N ATOM 1461 CA ASN A 90 -2.001 9.686 -11.281 1.00 0.00 C ATOM 1462 C ASN A 90 -1.438 10.062 -9.909 1.00 0.00 C ATOM 1463 O ASN A 90 -0.246 10.334 -9.777 1.00 0.00 O ATOM 1464 CB ASN A 90 -1.915 8.165 -11.426 1.00 0.00 C ATOM 1465 CG ASN A 90 -2.950 7.470 -10.539 1.00 0.00 C ATOM 1466 OD1 ASN A 90 -4.144 7.704 -10.634 1.00 0.00 O ATOM 1467 ND2 ASN A 90 -2.428 6.606 -9.674 1.00 0.00 N ATOM 0 H ASN A 90 -0.513 9.778 -12.753 1.00 0.00 H new ATOM 0 HA ASN A 90 -3.040 10.000 -11.379 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -2.077 7.886 -12.467 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -0.914 7.827 -11.157 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -3.036 6.091 -9.037 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -1.419 6.458 -9.647 1.00 0.00 H new ATOM 1474 N THR A 91 -2.322 10.064 -8.922 1.00 0.00 N ATOM 1475 CA THR A 91 -1.928 10.402 -7.565 1.00 0.00 C ATOM 1476 C THR A 91 -1.045 9.300 -6.976 1.00 0.00 C ATOM 1477 O THR A 91 -1.551 8.297 -6.474 1.00 0.00 O ATOM 1478 CB THR A 91 -3.199 10.661 -6.754 1.00 0.00 C ATOM 1479 OG1 THR A 91 -4.060 11.339 -7.665 1.00 0.00 O ATOM 1480 CG2 THR A 91 -2.979 11.673 -5.627 1.00 0.00 C ATOM 0 H THR A 91 -3.310 9.837 -9.035 1.00 0.00 H new ATOM 0 HA THR A 91 -1.321 11.307 -7.543 1.00 0.00 H new ATOM 0 HB THR A 91 -3.559 9.722 -6.334 1.00 0.00 H new ATOM 0 HG1 THR A 91 -4.959 11.403 -7.280 1.00 0.00 H new ATOM 0 HG21 THR A 91 -3.912 11.820 -5.083 1.00 0.00 H new ATOM 0 HG22 THR A 91 -2.216 11.298 -4.945 1.00 0.00 H new ATOM 0 HG23 THR A 91 -2.652 12.623 -6.050 1.00 0.00 H new ATOM 1488 N PHE A 92 0.258 9.524 -7.056 1.00 0.00 N ATOM 1489 CA PHE A 92 1.216 8.562 -6.536 1.00 0.00 C ATOM 1490 C PHE A 92 0.770 8.025 -5.175 1.00 0.00 C ATOM 1491 O PHE A 92 0.869 6.827 -4.914 1.00 0.00 O ATOM 1492 CB PHE A 92 2.545 9.301 -6.370 1.00 0.00 C ATOM 1493 CG PHE A 92 3.509 8.632 -5.388 1.00 0.00 C ATOM 1494 CD1 PHE A 92 3.947 7.366 -5.620 1.00 0.00 C ATOM 1495 CD2 PHE A 92 3.929 9.304 -4.282 1.00 0.00 C ATOM 1496 CE1 PHE A 92 4.842 6.745 -4.709 1.00 0.00 C ATOM 1497 CE2 PHE A 92 4.824 8.684 -3.371 1.00 0.00 C ATOM 1498 CZ PHE A 92 5.262 7.417 -3.604 1.00 0.00 C ATOM 0 H PHE A 92 0.673 10.357 -7.473 1.00 0.00 H new ATOM 0 HA PHE A 92 1.303 7.717 -7.218 1.00 0.00 H new ATOM 0 HB2 PHE A 92 3.030 9.379 -7.343 1.00 0.00 H new ATOM 0 HB3 PHE A 92 2.344 10.317 -6.031 1.00 0.00 H new ATOM 0 HD1 PHE A 92 3.614 6.832 -6.498 1.00 0.00 H new ATOM 0 HD2 PHE A 92 3.581 10.310 -4.097 1.00 0.00 H new ATOM 0 HE1 PHE A 92 5.189 5.739 -4.894 1.00 0.00 H new ATOM 0 HE2 PHE A 92 5.157 9.218 -2.493 1.00 0.00 H new ATOM 0 HZ PHE A 92 5.943 6.945 -2.911 1.00 0.00 H new ATOM 1508 N GLU A 93 0.289 8.937 -4.343 1.00 0.00 N ATOM 1509 CA GLU A 93 -0.173 8.570 -3.015 1.00 0.00 C ATOM 1510 C GLU A 93 -1.256 7.494 -3.108 1.00 0.00 C ATOM 1511 O GLU A 93 -1.264 6.547 -2.322 1.00 0.00 O ATOM 1512 CB GLU A 93 -0.682 9.796 -2.253 1.00 0.00 C ATOM 1513 CG GLU A 93 -1.461 10.732 -3.179 1.00 0.00 C ATOM 1514 CD GLU A 93 -0.686 12.028 -3.427 1.00 0.00 C ATOM 1515 OE1 GLU A 93 -0.753 12.956 -2.608 1.00 0.00 O ATOM 1516 OE2 GLU A 93 0.005 12.050 -4.516 1.00 0.00 O ATOM 0 H GLU A 93 0.209 9.930 -4.563 1.00 0.00 H new ATOM 0 HA GLU A 93 0.670 8.161 -2.458 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -1.322 9.477 -1.430 1.00 0.00 H new ATOM 0 HB3 GLU A 93 0.160 10.331 -1.814 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -1.654 10.232 -4.128 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -2.430 10.963 -2.737 1.00 0.00 H new ATOM 1524 N LYS A 94 -2.143 7.674 -4.076 1.00 0.00 N ATOM 1525 CA LYS A 94 -3.228 6.729 -4.281 1.00 0.00 C ATOM 1526 C LYS A 94 -2.649 5.382 -4.717 1.00 0.00 C ATOM 1527 O LYS A 94 -3.018 4.340 -4.177 1.00 0.00 O ATOM 1528 CB LYS A 94 -4.258 7.301 -5.258 1.00 0.00 C ATOM 1529 CG LYS A 94 -5.184 6.203 -5.783 1.00 0.00 C ATOM 1530 CD LYS A 94 -6.409 6.041 -4.881 1.00 0.00 C ATOM 1531 CE LYS A 94 -7.699 6.328 -5.651 1.00 0.00 C ATOM 1532 NZ LYS A 94 -8.378 5.063 -6.015 1.00 0.00 N ATOM 0 H LYS A 94 -2.133 8.460 -4.726 1.00 0.00 H new ATOM 0 HA LYS A 94 -3.767 6.558 -3.349 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -4.847 8.072 -4.761 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -3.746 7.780 -6.093 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -5.504 6.446 -6.796 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -4.641 5.260 -5.838 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -6.438 5.028 -4.480 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -6.331 6.718 -4.030 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -8.363 6.942 -5.043 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -7.473 6.898 -6.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -8.974 5.218 -6.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -7.666 4.335 -6.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -8.971 4.747 -5.222 1.00 0.00 H new ATOM 1545 N GLU A 95 -1.752 5.446 -5.690 1.00 0.00 N ATOM 1546 CA GLU A 95 -1.119 4.244 -6.205 1.00 0.00 C ATOM 1547 C GLU A 95 -0.420 3.486 -5.074 1.00 0.00 C ATOM 1548 O GLU A 95 -0.424 2.257 -5.050 1.00 0.00 O ATOM 1549 CB GLU A 95 -0.137 4.579 -7.329 1.00 0.00 C ATOM 1550 CG GLU A 95 -0.425 3.741 -8.577 1.00 0.00 C ATOM 1551 CD GLU A 95 0.555 4.079 -9.702 1.00 0.00 C ATOM 1552 OE1 GLU A 95 1.063 3.169 -10.375 1.00 0.00 O ATOM 1553 OE2 GLU A 95 0.782 5.337 -9.868 1.00 0.00 O ATOM 0 H GLU A 95 -1.449 6.312 -6.135 1.00 0.00 H new ATOM 0 HA GLU A 95 -1.893 3.601 -6.624 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -0.207 5.639 -7.574 1.00 0.00 H new ATOM 0 HB3 GLU A 95 0.883 4.397 -6.992 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -0.352 2.681 -8.333 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -1.446 3.921 -8.913 1.00 0.00 H new ATOM 1561 N LEU A 96 0.165 4.253 -4.165 1.00 0.00 N ATOM 1562 CA LEU A 96 0.867 3.670 -3.034 1.00 0.00 C ATOM 1563 C LEU A 96 -0.145 3.285 -1.954 1.00 0.00 C ATOM 1564 O LEU A 96 0.076 2.339 -1.200 1.00 0.00 O ATOM 1565 CB LEU A 96 1.965 4.614 -2.540 1.00 0.00 C ATOM 1566 CG LEU A 96 2.456 4.381 -1.110 1.00 0.00 C ATOM 1567 CD1 LEU A 96 1.444 4.908 -0.090 1.00 0.00 C ATOM 1568 CD2 LEU A 96 2.789 2.906 -0.878 1.00 0.00 C ATOM 0 H LEU A 96 0.167 5.273 -4.189 1.00 0.00 H new ATOM 0 HA LEU A 96 1.377 2.755 -3.334 1.00 0.00 H new ATOM 0 HB2 LEU A 96 2.818 4.532 -3.214 1.00 0.00 H new ATOM 0 HB3 LEU A 96 1.597 5.637 -2.615 1.00 0.00 H new ATOM 0 HG LEU A 96 3.378 4.945 -0.969 1.00 0.00 H new ATOM 0 HD11 LEU A 96 1.817 4.730 0.918 1.00 0.00 H new ATOM 0 HD12 LEU A 96 1.300 5.978 -0.240 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.493 4.392 -0.221 1.00 0.00 H new ATOM 0 HD21 LEU A 96 3.136 2.768 0.146 1.00 0.00 H new ATOM 0 HD22 LEU A 96 1.897 2.301 -1.044 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.572 2.596 -1.571 1.00 0.00 H new ATOM 1580 N LEU A 97 -1.234 4.038 -1.914 1.00 0.00 N ATOM 1581 CA LEU A 97 -2.282 3.788 -0.938 1.00 0.00 C ATOM 1582 C LEU A 97 -2.939 2.440 -1.237 1.00 0.00 C ATOM 1583 O LEU A 97 -3.266 1.688 -0.320 1.00 0.00 O ATOM 1584 CB LEU A 97 -3.267 4.958 -0.898 1.00 0.00 C ATOM 1585 CG LEU A 97 -3.146 5.897 0.303 1.00 0.00 C ATOM 1586 CD1 LEU A 97 -2.324 7.138 -0.052 1.00 0.00 C ATOM 1587 CD2 LEU A 97 -4.525 6.262 0.856 1.00 0.00 C ATOM 0 H LEU A 97 -1.414 4.822 -2.542 1.00 0.00 H new ATOM 0 HA LEU A 97 -1.861 3.722 0.065 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -3.139 5.545 -1.807 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -4.280 4.555 -0.918 1.00 0.00 H new ATOM 0 HG LEU A 97 -2.611 5.372 1.094 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -2.253 7.789 0.819 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -1.323 6.836 -0.361 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -2.809 7.675 -0.867 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -4.410 6.930 1.709 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -5.108 6.760 0.081 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -5.042 5.356 1.172 1.00 0.00 H new ATOM 1599 N GLU A 98 -3.114 2.175 -2.523 1.00 0.00 N ATOM 1600 CA GLU A 98 -3.727 0.930 -2.954 1.00 0.00 C ATOM 1601 C GLU A 98 -2.919 -0.265 -2.442 1.00 0.00 C ATOM 1602 O GLU A 98 -3.460 -1.141 -1.769 1.00 0.00 O ATOM 1603 CB GLU A 98 -3.866 0.885 -4.477 1.00 0.00 C ATOM 1604 CG GLU A 98 -5.124 1.627 -4.935 1.00 0.00 C ATOM 1605 CD GLU A 98 -4.981 2.107 -6.380 1.00 0.00 C ATOM 1606 OE1 GLU A 98 -4.117 2.947 -6.672 1.00 0.00 O ATOM 1607 OE2 GLU A 98 -5.809 1.577 -7.215 1.00 0.00 O ATOM 0 H GLU A 98 -2.842 2.801 -3.281 1.00 0.00 H new ATOM 0 HA GLU A 98 -4.729 0.876 -2.529 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -2.987 1.333 -4.939 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -3.909 -0.152 -4.811 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -5.989 0.970 -4.850 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -5.306 2.480 -4.281 1.00 0.00 H new ATOM 1615 N VAL A 99 -1.639 -0.261 -2.781 1.00 0.00 N ATOM 1616 CA VAL A 99 -0.751 -1.333 -2.364 1.00 0.00 C ATOM 1617 C VAL A 99 -0.753 -1.426 -0.837 1.00 0.00 C ATOM 1618 O VAL A 99 -0.420 -2.468 -0.274 1.00 0.00 O ATOM 1619 CB VAL A 99 0.646 -1.114 -2.948 1.00 0.00 C ATOM 1620 CG1 VAL A 99 0.590 -0.993 -4.472 1.00 0.00 C ATOM 1621 CG2 VAL A 99 1.313 0.114 -2.325 1.00 0.00 C ATOM 0 H VAL A 99 -1.195 0.468 -3.340 1.00 0.00 H new ATOM 0 HA VAL A 99 -1.102 -2.291 -2.749 1.00 0.00 H new ATOM 0 HB VAL A 99 1.253 -1.986 -2.703 1.00 0.00 H new ATOM 0 HG11 VAL A 99 1.596 -0.838 -4.862 1.00 0.00 H new ATOM 0 HG12 VAL A 99 0.174 -1.908 -4.895 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.040 -0.147 -4.747 1.00 0.00 H new ATOM 0 HG21 VAL A 99 2.305 0.248 -2.757 1.00 0.00 H new ATOM 0 HG22 VAL A 99 0.708 0.998 -2.526 1.00 0.00 H new ATOM 0 HG23 VAL A 99 1.402 -0.028 -1.248 1.00 0.00 H new ATOM 1631 N VAL A 100 -1.131 -0.323 -0.209 1.00 0.00 N ATOM 1632 CA VAL A 100 -1.181 -0.266 1.242 1.00 0.00 C ATOM 1633 C VAL A 100 -2.439 -0.985 1.733 1.00 0.00 C ATOM 1634 O VAL A 100 -2.350 -1.954 2.486 1.00 0.00 O ATOM 1635 CB VAL A 100 -1.100 1.187 1.712 1.00 0.00 C ATOM 1636 CG1 VAL A 100 -1.859 1.381 3.027 1.00 0.00 C ATOM 1637 CG2 VAL A 100 0.355 1.641 1.846 1.00 0.00 C ATOM 0 H VAL A 100 -1.406 0.540 -0.679 1.00 0.00 H new ATOM 0 HA VAL A 100 -0.323 -0.781 1.674 1.00 0.00 H new ATOM 0 HB VAL A 100 -1.576 1.810 0.955 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -1.786 2.423 3.339 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -2.907 1.118 2.884 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -1.425 0.741 3.795 1.00 0.00 H new ATOM 0 HG21 VAL A 100 0.383 2.678 2.182 1.00 0.00 H new ATOM 0 HG22 VAL A 100 0.867 1.010 2.572 1.00 0.00 H new ATOM 0 HG23 VAL A 100 0.852 1.559 0.880 1.00 0.00 H new ATOM 1647 N ILE A 101 -3.581 -0.483 1.288 1.00 0.00 N ATOM 1648 CA ILE A 101 -4.855 -1.065 1.673 1.00 0.00 C ATOM 1649 C ILE A 101 -5.022 -2.419 0.981 1.00 0.00 C ATOM 1650 O ILE A 101 -5.866 -3.222 1.376 1.00 0.00 O ATOM 1651 CB ILE A 101 -5.998 -0.086 1.393 1.00 0.00 C ATOM 1652 CG1 ILE A 101 -6.080 0.249 -0.098 1.00 0.00 C ATOM 1653 CG2 ILE A 101 -5.868 1.170 2.256 1.00 0.00 C ATOM 1654 CD1 ILE A 101 -7.377 0.992 -0.423 1.00 0.00 C ATOM 0 H ILE A 101 -3.651 0.321 0.664 1.00 0.00 H new ATOM 0 HA ILE A 101 -4.880 -1.250 2.747 1.00 0.00 H new ATOM 0 HB ILE A 101 -6.936 -0.569 1.667 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -5.225 0.861 -0.384 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -6.026 -0.669 -0.684 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -6.692 1.849 2.037 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -5.896 0.892 3.310 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -4.922 1.666 2.037 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -7.410 1.218 -1.489 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -8.230 0.368 -0.158 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -7.417 1.921 0.146 1.00 0.00 H new ATOM 1666 N HIS A 102 -4.205 -2.631 -0.040 1.00 0.00 N ATOM 1667 CA HIS A 102 -4.252 -3.874 -0.790 1.00 0.00 C ATOM 1668 C HIS A 102 -4.109 -5.058 0.168 1.00 0.00 C ATOM 1669 O HIS A 102 -4.885 -6.011 0.104 1.00 0.00 O ATOM 1670 CB HIS A 102 -3.198 -3.879 -1.900 1.00 0.00 C ATOM 1671 CG HIS A 102 -3.767 -3.713 -3.288 1.00 0.00 C ATOM 1672 ND1 HIS A 102 -3.333 -2.733 -4.164 1.00 0.00 N ATOM 1673 CD2 HIS A 102 -4.738 -4.412 -3.943 1.00 0.00 C ATOM 1674 CE1 HIS A 102 -4.020 -2.846 -5.291 1.00 0.00 C ATOM 1675 NE2 HIS A 102 -4.890 -3.887 -5.153 1.00 0.00 N ATOM 0 H HIS A 102 -3.507 -1.963 -0.365 1.00 0.00 H new ATOM 0 HA HIS A 102 -5.218 -3.967 -1.285 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -2.484 -3.077 -1.713 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -2.643 -4.816 -1.856 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -5.290 -5.251 -3.545 1.00 0.00 H new ATOM 0 HE1 HIS A 102 -3.910 -2.223 -6.166 1.00 0.00 H new ATOM 0 HE2 HIS A 102 -5.549 -4.209 -5.862 1.00 0.00 H new ATOM 1683 N GLY A 103 -3.112 -4.959 1.035 1.00 0.00 N ATOM 1684 CA GLY A 103 -2.858 -6.010 2.006 1.00 0.00 C ATOM 1685 C GLY A 103 -4.084 -6.248 2.891 1.00 0.00 C ATOM 1686 O GLY A 103 -4.554 -7.377 3.016 1.00 0.00 O ATOM 0 H GLY A 103 -2.471 -4.167 1.085 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -2.594 -6.932 1.488 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -2.004 -5.738 2.627 1.00 0.00 H new ATOM 1690 N ILE A 104 -4.566 -5.164 3.481 1.00 0.00 N ATOM 1691 CA ILE A 104 -5.728 -5.241 4.350 1.00 0.00 C ATOM 1692 C ILE A 104 -6.941 -5.693 3.535 1.00 0.00 C ATOM 1693 O ILE A 104 -7.725 -6.524 3.991 1.00 0.00 O ATOM 1694 CB ILE A 104 -5.939 -3.913 5.081 1.00 0.00 C ATOM 1695 CG1 ILE A 104 -4.882 -3.711 6.169 1.00 0.00 C ATOM 1696 CG2 ILE A 104 -7.361 -3.813 5.637 1.00 0.00 C ATOM 1697 CD1 ILE A 104 -4.765 -2.235 6.552 1.00 0.00 C ATOM 0 H ILE A 104 -4.174 -4.229 3.375 1.00 0.00 H new ATOM 0 HA ILE A 104 -5.572 -5.987 5.129 1.00 0.00 H new ATOM 0 HB ILE A 104 -5.817 -3.104 4.361 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -5.143 -4.299 7.049 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -3.918 -4.076 5.816 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -7.484 -2.860 6.152 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -8.077 -3.879 4.818 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -7.536 -4.629 6.338 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -4.007 -2.119 7.327 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -4.480 -1.653 5.676 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -5.725 -1.879 6.927 1.00 0.00 H new ATOM 1709 N LEU A 105 -7.057 -5.127 2.343 1.00 0.00 N ATOM 1710 CA LEU A 105 -8.161 -5.462 1.459 1.00 0.00 C ATOM 1711 C LEU A 105 -8.286 -6.984 1.361 1.00 0.00 C ATOM 1712 O LEU A 105 -9.362 -7.537 1.582 1.00 0.00 O ATOM 1713 CB LEU A 105 -7.992 -4.770 0.105 1.00 0.00 C ATOM 1714 CG LEU A 105 -8.723 -3.436 -0.062 1.00 0.00 C ATOM 1715 CD1 LEU A 105 -7.839 -2.412 -0.776 1.00 0.00 C ATOM 1716 CD2 LEU A 105 -10.064 -3.631 -0.774 1.00 0.00 C ATOM 0 H LEU A 105 -6.405 -4.438 1.968 1.00 0.00 H new ATOM 0 HA LEU A 105 -9.101 -5.090 1.866 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -6.928 -4.603 -0.065 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -8.336 -5.450 -0.674 1.00 0.00 H new ATOM 0 HG LEU A 105 -8.939 -3.039 0.930 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -8.382 -1.473 -0.882 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -6.934 -2.243 -0.193 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -7.570 -2.789 -1.763 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -10.563 -2.668 -0.880 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -9.893 -4.062 -1.761 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -10.692 -4.303 -0.189 1.00 0.00 H new ATOM 1728 N HIS A 106 -7.171 -7.617 1.029 1.00 0.00 N ATOM 1729 CA HIS A 106 -7.142 -9.064 0.899 1.00 0.00 C ATOM 1730 C HIS A 106 -7.626 -9.706 2.200 1.00 0.00 C ATOM 1731 O HIS A 106 -8.330 -10.715 2.174 1.00 0.00 O ATOM 1732 CB HIS A 106 -5.750 -9.544 0.483 1.00 0.00 C ATOM 1733 CG HIS A 106 -5.122 -8.726 -0.620 1.00 0.00 C ATOM 1734 ND1 HIS A 106 -5.604 -8.359 -1.842 1.00 0.00 N flip ATOM 1735 CD2 HIS A 106 -3.850 -8.190 -0.525 1.00 0.00 C flip ATOM 1736 CE1 HIS A 106 -4.676 -7.637 -2.459 1.00 0.00 C flip ATOM 1737 NE2 HIS A 106 -3.588 -7.532 -1.644 1.00 0.00 N flip ATOM 0 H HIS A 106 -6.281 -7.154 0.846 1.00 0.00 H new ATOM 0 HA HIS A 106 -7.822 -9.375 0.106 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -5.095 -9.524 1.354 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -5.817 -10.582 0.158 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -3.184 -8.291 0.319 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -4.768 -7.204 -3.444 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -2.724 -7.034 -1.858 1.00 0.00 H new ATOM 1745 N LEU A 107 -7.231 -9.095 3.307 1.00 0.00 N ATOM 1746 CA LEU A 107 -7.616 -9.595 4.616 1.00 0.00 C ATOM 1747 C LEU A 107 -8.960 -8.982 5.016 1.00 0.00 C ATOM 1748 O LEU A 107 -9.401 -9.133 6.154 1.00 0.00 O ATOM 1749 CB LEU A 107 -6.500 -9.347 5.633 1.00 0.00 C ATOM 1750 CG LEU A 107 -6.063 -10.559 6.458 1.00 0.00 C ATOM 1751 CD1 LEU A 107 -4.540 -10.604 6.602 1.00 0.00 C ATOM 1752 CD2 LEU A 107 -6.768 -10.583 7.815 1.00 0.00 C ATOM 0 H LEU A 107 -6.648 -8.258 3.325 1.00 0.00 H new ATOM 0 HA LEU A 107 -7.754 -10.676 4.586 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -5.630 -8.962 5.101 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -6.827 -8.565 6.318 1.00 0.00 H new ATOM 0 HG LEU A 107 -6.363 -11.461 5.924 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -4.256 -11.475 7.193 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -4.083 -10.670 5.615 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -4.195 -9.699 7.101 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -6.439 -11.455 8.381 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -6.522 -9.677 8.369 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -7.846 -10.634 7.664 1.00 0.00 H new ATOM 1764 N ALA A 108 -9.573 -8.304 4.057 1.00 0.00 N ATOM 1765 CA ALA A 108 -10.858 -7.668 4.294 1.00 0.00 C ATOM 1766 C ALA A 108 -11.961 -8.728 4.259 1.00 0.00 C ATOM 1767 O ALA A 108 -12.980 -8.591 4.934 1.00 0.00 O ATOM 1768 CB ALA A 108 -11.079 -6.562 3.261 1.00 0.00 C ATOM 0 H ALA A 108 -9.204 -8.181 3.114 1.00 0.00 H new ATOM 0 HA ALA A 108 -10.880 -7.202 5.279 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -12.043 -6.085 3.439 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -10.286 -5.820 3.347 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -11.066 -6.992 2.259 1.00 0.00 H new ATOM 1774 N GLY A 109 -11.720 -9.761 3.466 1.00 0.00 N ATOM 1775 CA GLY A 109 -12.680 -10.844 3.334 1.00 0.00 C ATOM 1776 C GLY A 109 -12.766 -11.327 1.885 1.00 0.00 C ATOM 1777 O GLY A 109 -13.859 -11.480 1.342 1.00 0.00 O ATOM 0 H GLY A 109 -10.873 -9.871 2.908 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -12.390 -11.672 3.981 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -13.662 -10.507 3.668 1.00 0.00 H new ATOM 1781 N TYR A 110 -11.600 -11.552 1.299 1.00 0.00 N ATOM 1782 CA TYR A 110 -11.530 -12.014 -0.077 1.00 0.00 C ATOM 1783 C TYR A 110 -10.089 -12.344 -0.472 1.00 0.00 C ATOM 1784 O TYR A 110 -9.191 -11.521 -0.302 1.00 0.00 O ATOM 1785 CB TYR A 110 -12.029 -10.852 -0.937 1.00 0.00 C ATOM 1786 CG TYR A 110 -10.952 -9.816 -1.269 1.00 0.00 C ATOM 1787 CD1 TYR A 110 -10.008 -10.088 -2.238 1.00 0.00 C ATOM 1788 CD2 TYR A 110 -10.925 -8.610 -0.598 1.00 0.00 C ATOM 1789 CE1 TYR A 110 -8.995 -9.113 -2.550 1.00 0.00 C ATOM 1790 CE2 TYR A 110 -9.912 -7.636 -0.910 1.00 0.00 C ATOM 1791 CZ TYR A 110 -8.997 -7.935 -1.870 1.00 0.00 C ATOM 1792 OH TYR A 110 -8.041 -7.015 -2.165 1.00 0.00 O ATOM 0 H TYR A 110 -10.695 -11.423 1.752 1.00 0.00 H new ATOM 0 HA TYR A 110 -12.125 -12.918 -0.210 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -12.435 -11.250 -1.867 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -12.849 -10.355 -0.418 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -10.029 -11.032 -2.762 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -11.664 -8.397 0.161 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -8.251 -9.313 -3.307 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -9.880 -6.688 -0.393 1.00 0.00 H new ATOM 0 HH TYR A 110 -7.166 -7.348 -1.876 1.00 0.00 H new ATOM 1802 N ASP A 111 -9.913 -13.551 -0.991 1.00 0.00 N ATOM 1803 CA ASP A 111 -8.597 -14.000 -1.411 1.00 0.00 C ATOM 1804 C ASP A 111 -7.984 -12.960 -2.352 1.00 0.00 C ATOM 1805 O ASP A 111 -8.607 -12.564 -3.336 1.00 0.00 O ATOM 1806 CB ASP A 111 -8.683 -15.327 -2.167 1.00 0.00 C ATOM 1807 CG ASP A 111 -9.507 -16.414 -1.473 1.00 0.00 C ATOM 1808 OD1 ASP A 111 -10.486 -16.122 -0.770 1.00 0.00 O ATOM 1809 OD2 ASP A 111 -9.101 -17.621 -1.679 1.00 0.00 O ATOM 0 H ASP A 111 -10.660 -14.231 -1.130 1.00 0.00 H new ATOM 0 HA ASP A 111 -7.985 -14.132 -0.518 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -9.112 -15.140 -3.152 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -7.673 -15.704 -2.326 1.00 0.00 H new ATOM 1815 N HIS A 112 -6.771 -12.547 -2.016 1.00 0.00 N ATOM 1816 CA HIS A 112 -6.067 -11.561 -2.818 1.00 0.00 C ATOM 1817 C HIS A 112 -6.399 -11.771 -4.297 1.00 0.00 C ATOM 1818 O HIS A 112 -6.458 -12.906 -4.768 1.00 0.00 O ATOM 1819 CB HIS A 112 -4.564 -11.603 -2.536 1.00 0.00 C ATOM 1820 CG HIS A 112 -3.703 -11.379 -3.756 1.00 0.00 C ATOM 1821 ND1 HIS A 112 -3.335 -10.228 -4.388 1.00 0.00 N flip ATOM 1822 CD2 HIS A 112 -3.119 -12.417 -4.462 1.00 0.00 C flip ATOM 1823 CE1 HIS A 112 -2.567 -10.545 -5.423 1.00 0.00 C flip ATOM 1824 NE2 HIS A 112 -2.432 -11.902 -5.470 1.00 0.00 N flip ATOM 0 H HIS A 112 -6.258 -12.877 -1.199 1.00 0.00 H new ATOM 0 HA HIS A 112 -6.401 -10.560 -2.545 1.00 0.00 H new ATOM 0 HB2 HIS A 112 -4.323 -10.845 -1.790 1.00 0.00 H new ATOM 0 HB3 HIS A 112 -4.314 -12.570 -2.100 1.00 0.00 H new ATOM 0 HD2 HIS A 112 -3.209 -13.468 -4.230 1.00 0.00 H new ATOM 0 HE1 HIS A 112 -2.122 -9.844 -6.114 1.00 0.00 H new ATOM 0 HE2 HIS A 112 -1.896 -12.428 -6.161 1.00 0.00 H new ATOM 1832 N GLU A 113 -6.605 -10.660 -4.988 1.00 0.00 N ATOM 1833 CA GLU A 113 -6.929 -10.708 -6.404 1.00 0.00 C ATOM 1834 C GLU A 113 -8.399 -11.083 -6.600 1.00 0.00 C ATOM 1835 O GLU A 113 -9.140 -10.371 -7.275 1.00 0.00 O ATOM 1836 CB GLU A 113 -6.011 -11.683 -7.143 1.00 0.00 C ATOM 1837 CG GLU A 113 -5.258 -10.978 -8.273 1.00 0.00 C ATOM 1838 CD GLU A 113 -4.850 -11.971 -9.363 1.00 0.00 C ATOM 1839 OE1 GLU A 113 -5.420 -11.952 -10.464 1.00 0.00 O ATOM 1840 OE2 GLU A 113 -3.903 -12.783 -9.035 1.00 0.00 O ATOM 0 H GLU A 113 -6.554 -9.721 -4.594 1.00 0.00 H new ATOM 0 HA GLU A 113 -6.768 -9.717 -6.828 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -5.298 -12.119 -6.443 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -6.600 -12.504 -7.551 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -5.887 -10.199 -8.703 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -4.371 -10.487 -7.873 1.00 0.00 H new ATOM 1848 N PHE A 114 -8.777 -12.200 -5.996 1.00 0.00 N ATOM 1849 CA PHE A 114 -10.146 -12.678 -6.095 1.00 0.00 C ATOM 1850 C PHE A 114 -10.466 -13.130 -7.522 1.00 0.00 C ATOM 1851 O PHE A 114 -10.747 -14.304 -7.757 1.00 0.00 O ATOM 1852 CB PHE A 114 -11.057 -11.506 -5.727 1.00 0.00 C ATOM 1853 CG PHE A 114 -12.330 -11.917 -4.985 1.00 0.00 C ATOM 1854 CD1 PHE A 114 -12.243 -12.589 -3.805 1.00 0.00 C ATOM 1855 CD2 PHE A 114 -13.549 -11.610 -5.504 1.00 0.00 C ATOM 1856 CE1 PHE A 114 -13.424 -12.970 -3.116 1.00 0.00 C ATOM 1857 CE2 PHE A 114 -14.731 -11.991 -4.815 1.00 0.00 C ATOM 1858 CZ PHE A 114 -14.643 -12.663 -3.636 1.00 0.00 C ATOM 0 H PHE A 114 -8.159 -12.788 -5.436 1.00 0.00 H new ATOM 0 HA PHE A 114 -10.292 -13.530 -5.431 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -10.498 -10.805 -5.107 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -11.335 -10.975 -6.638 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -11.275 -12.833 -3.393 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -13.618 -11.076 -6.440 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -13.355 -13.503 -2.179 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -15.699 -11.747 -5.227 1.00 0.00 H new ATOM 0 HZ PHE A 114 -15.542 -12.953 -3.112 1.00 0.00 H new ATOM 1868 N GLU A 115 -10.414 -12.173 -8.437 1.00 0.00 N ATOM 1869 CA GLU A 115 -10.696 -12.458 -9.834 1.00 0.00 C ATOM 1870 C GLU A 115 -10.024 -11.418 -10.733 1.00 0.00 C ATOM 1871 O GLU A 115 -10.330 -10.229 -10.649 1.00 0.00 O ATOM 1872 CB GLU A 115 -12.203 -12.511 -10.089 1.00 0.00 C ATOM 1873 CG GLU A 115 -12.615 -13.872 -10.656 1.00 0.00 C ATOM 1874 CD GLU A 115 -13.928 -14.351 -10.033 1.00 0.00 C ATOM 1875 OE1 GLU A 115 -14.772 -13.525 -9.654 1.00 0.00 O ATOM 1876 OE2 GLU A 115 -14.057 -15.631 -9.951 1.00 0.00 O ATOM 0 H GLU A 115 -10.181 -11.200 -8.239 1.00 0.00 H new ATOM 0 HA GLU A 115 -10.285 -13.438 -10.075 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -12.740 -12.323 -9.159 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -12.486 -11.722 -10.786 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -12.727 -13.801 -11.738 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -11.829 -14.603 -10.464 1.00 0.00 H new ATOM 1884 N ASP A 116 -9.121 -11.903 -11.572 1.00 0.00 N ATOM 1885 CA ASP A 116 -8.404 -11.031 -12.486 1.00 0.00 C ATOM 1886 C ASP A 116 -7.633 -9.982 -11.683 1.00 0.00 C ATOM 1887 O ASP A 116 -7.744 -9.926 -10.459 1.00 0.00 O ATOM 1888 CB ASP A 116 -9.369 -10.297 -13.419 1.00 0.00 C ATOM 1889 CG ASP A 116 -9.040 -10.411 -14.909 1.00 0.00 C ATOM 1890 OD1 ASP A 116 -7.899 -10.714 -15.290 1.00 0.00 O ATOM 1891 OD2 ASP A 116 -10.026 -10.169 -15.705 1.00 0.00 O ATOM 0 H ASP A 116 -8.869 -12.889 -11.638 1.00 0.00 H new ATOM 0 HA ASP A 116 -7.728 -11.647 -13.079 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -10.375 -10.683 -13.254 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -9.384 -9.242 -13.145 1.00 0.00 H new ATOM 1897 N LYS A 117 -6.868 -9.175 -12.404 1.00 0.00 N ATOM 1898 CA LYS A 117 -6.078 -8.131 -11.774 1.00 0.00 C ATOM 1899 C LYS A 117 -6.953 -7.369 -10.776 1.00 0.00 C ATOM 1900 O LYS A 117 -6.566 -7.181 -9.624 1.00 0.00 O ATOM 1901 CB LYS A 117 -5.431 -7.236 -12.833 1.00 0.00 C ATOM 1902 CG LYS A 117 -3.940 -7.040 -12.548 1.00 0.00 C ATOM 1903 CD LYS A 117 -3.083 -7.801 -13.561 1.00 0.00 C ATOM 1904 CE LYS A 117 -1.842 -8.396 -12.893 1.00 0.00 C ATOM 1905 NZ LYS A 117 -1.292 -9.500 -13.710 1.00 0.00 N ATOM 0 H LYS A 117 -6.779 -9.223 -13.419 1.00 0.00 H new ATOM 0 HA LYS A 117 -5.253 -8.565 -11.210 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -5.561 -7.681 -13.819 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -5.932 -6.268 -12.852 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -3.696 -5.978 -12.585 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -3.710 -7.385 -11.540 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -3.672 -8.597 -14.016 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -2.781 -7.129 -14.364 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -1.086 -7.622 -12.762 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -2.098 -8.764 -11.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -0.450 -9.892 -13.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -2.009 -10.246 -13.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -1.029 -9.139 -14.649 1.00 0.00 H new ATOM 1918 N ASN A 118 -8.115 -6.951 -11.255 1.00 0.00 N ATOM 1919 CA ASN A 118 -9.047 -6.213 -10.420 1.00 0.00 C ATOM 1920 C ASN A 118 -10.368 -6.034 -11.171 1.00 0.00 C ATOM 1921 O ASN A 118 -10.376 -5.894 -12.393 1.00 0.00 O ATOM 1922 CB ASN A 118 -8.503 -4.824 -10.081 1.00 0.00 C ATOM 1923 CG ASN A 118 -8.132 -4.056 -11.352 1.00 0.00 C ATOM 1924 OD1 ASN A 118 -7.150 -4.343 -12.017 1.00 0.00 O ATOM 1925 ND2 ASN A 118 -8.970 -3.067 -11.650 1.00 0.00 N ATOM 0 H ASN A 118 -8.433 -7.109 -12.211 1.00 0.00 H new ATOM 0 HA ASN A 118 -9.193 -6.777 -9.499 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -9.250 -4.264 -9.518 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -7.626 -4.919 -9.440 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -8.809 -2.495 -12.479 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -9.773 -2.881 -11.050 1.00 0.00 H new ATOM 1932 N SER A 119 -11.452 -6.044 -10.410 1.00 0.00 N ATOM 1933 CA SER A 119 -12.775 -5.884 -10.988 1.00 0.00 C ATOM 1934 C SER A 119 -13.450 -4.637 -10.415 1.00 0.00 C ATOM 1935 O SER A 119 -12.813 -3.846 -9.720 1.00 0.00 O ATOM 1936 CB SER A 119 -13.640 -7.120 -10.734 1.00 0.00 C ATOM 1937 OG SER A 119 -13.983 -7.258 -9.358 1.00 0.00 O ATOM 0 H SER A 119 -11.441 -6.161 -9.397 1.00 0.00 H new ATOM 0 HA SER A 119 -12.665 -5.766 -12.066 1.00 0.00 H new ATOM 0 HB2 SER A 119 -14.550 -7.054 -11.330 1.00 0.00 H new ATOM 0 HB3 SER A 119 -13.106 -8.011 -11.066 1.00 0.00 H new ATOM 0 HG SER A 119 -14.537 -8.058 -9.237 1.00 0.00 H new ATOM 1943 N LYS A 120 -14.730 -4.499 -10.727 1.00 0.00 N ATOM 1944 CA LYS A 120 -15.498 -3.361 -10.252 1.00 0.00 C ATOM 1945 C LYS A 120 -15.722 -3.497 -8.745 1.00 0.00 C ATOM 1946 O LYS A 120 -15.532 -2.539 -7.997 1.00 0.00 O ATOM 1947 CB LYS A 120 -16.792 -3.215 -11.055 1.00 0.00 C ATOM 1948 CG LYS A 120 -16.594 -2.279 -12.249 1.00 0.00 C ATOM 1949 CD LYS A 120 -17.778 -1.322 -12.398 1.00 0.00 C ATOM 1950 CE LYS A 120 -17.703 -0.192 -11.369 1.00 0.00 C ATOM 1951 NZ LYS A 120 -17.041 0.996 -11.952 1.00 0.00 N ATOM 0 H LYS A 120 -15.255 -5.157 -11.303 1.00 0.00 H new ATOM 0 HA LYS A 120 -14.945 -2.435 -10.411 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -17.119 -4.194 -11.406 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -17.582 -2.827 -10.411 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -15.675 -1.708 -12.119 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -16.479 -2.866 -13.160 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -17.787 -0.902 -13.404 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -18.712 -1.871 -12.273 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -18.707 0.071 -11.035 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -17.152 -0.528 -10.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -16.998 1.754 -11.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -16.076 0.745 -12.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -17.582 1.325 -12.777 1.00 0.00 H new ATOM 1964 N GLU A 121 -16.122 -4.694 -8.343 1.00 0.00 N ATOM 1965 CA GLU A 121 -16.374 -4.967 -6.938 1.00 0.00 C ATOM 1966 C GLU A 121 -15.135 -4.635 -6.103 1.00 0.00 C ATOM 1967 O GLU A 121 -15.233 -3.948 -5.087 1.00 0.00 O ATOM 1968 CB GLU A 121 -16.802 -6.421 -6.730 1.00 0.00 C ATOM 1969 CG GLU A 121 -17.952 -6.516 -5.726 1.00 0.00 C ATOM 1970 CD GLU A 121 -17.429 -6.485 -4.289 1.00 0.00 C ATOM 1971 OE1 GLU A 121 -16.548 -5.675 -3.967 1.00 0.00 O ATOM 1972 OE2 GLU A 121 -17.973 -7.342 -3.492 1.00 0.00 O ATOM 0 H GLU A 121 -16.278 -5.487 -8.966 1.00 0.00 H new ATOM 0 HA GLU A 121 -17.194 -4.331 -6.605 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -17.109 -6.853 -7.682 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -15.954 -7.006 -6.374 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -18.645 -5.690 -5.882 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -18.511 -7.437 -5.894 1.00 0.00 H new ATOM 1980 N MET A 122 -13.999 -5.138 -6.562 1.00 0.00 N ATOM 1981 CA MET A 122 -12.743 -4.903 -5.870 1.00 0.00 C ATOM 1982 C MET A 122 -12.353 -3.425 -5.928 1.00 0.00 C ATOM 1983 O MET A 122 -12.042 -2.821 -4.902 1.00 0.00 O ATOM 1984 CB MET A 122 -11.641 -5.748 -6.512 1.00 0.00 C ATOM 1985 CG MET A 122 -11.943 -7.241 -6.373 1.00 0.00 C ATOM 1986 SD MET A 122 -10.697 -8.024 -5.363 1.00 0.00 S ATOM 1987 CE MET A 122 -11.243 -7.511 -3.743 1.00 0.00 C ATOM 0 H MET A 122 -13.922 -5.707 -7.405 1.00 0.00 H new ATOM 0 HA MET A 122 -12.867 -5.185 -4.825 1.00 0.00 H new ATOM 0 HB2 MET A 122 -11.547 -5.489 -7.567 1.00 0.00 H new ATOM 0 HB3 MET A 122 -10.684 -5.522 -6.042 1.00 0.00 H new ATOM 0 HG2 MET A 122 -12.927 -7.381 -5.925 1.00 0.00 H new ATOM 0 HG3 MET A 122 -11.971 -7.708 -7.357 1.00 0.00 H new ATOM 0 HE1 MET A 122 -10.456 -6.932 -3.260 1.00 0.00 H new ATOM 0 HE2 MET A 122 -12.138 -6.897 -3.838 1.00 0.00 H new ATOM 0 HE3 MET A 122 -11.469 -8.390 -3.140 1.00 0.00 H new ATOM 1997 N PHE A 123 -12.383 -2.885 -7.137 1.00 0.00 N ATOM 1998 CA PHE A 123 -12.037 -1.489 -7.342 1.00 0.00 C ATOM 1999 C PHE A 123 -12.842 -0.581 -6.409 1.00 0.00 C ATOM 2000 O PHE A 123 -12.373 0.486 -6.018 1.00 0.00 O ATOM 2001 CB PHE A 123 -12.386 -1.149 -8.792 1.00 0.00 C ATOM 2002 CG PHE A 123 -12.478 0.352 -9.075 1.00 0.00 C ATOM 2003 CD1 PHE A 123 -11.375 1.137 -8.946 1.00 0.00 C ATOM 2004 CD2 PHE A 123 -13.663 0.901 -9.455 1.00 0.00 C ATOM 2005 CE1 PHE A 123 -11.460 2.530 -9.208 1.00 0.00 C ATOM 2006 CE2 PHE A 123 -13.748 2.294 -9.718 1.00 0.00 C ATOM 2007 CZ PHE A 123 -12.645 3.079 -9.589 1.00 0.00 C ATOM 0 H PHE A 123 -12.642 -3.389 -7.985 1.00 0.00 H new ATOM 0 HA PHE A 123 -10.979 -1.334 -7.132 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -11.633 -1.586 -9.448 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -13.339 -1.615 -9.044 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -10.434 0.701 -8.644 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -14.539 0.278 -9.557 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -10.584 3.153 -9.105 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -14.689 2.730 -10.020 1.00 0.00 H new ATOM 0 HZ PHE A 123 -12.710 4.138 -9.789 1.00 0.00 H new ATOM 2017 N GLU A 124 -14.041 -1.040 -6.080 1.00 0.00 N ATOM 2018 CA GLU A 124 -14.916 -0.283 -5.201 1.00 0.00 C ATOM 2019 C GLU A 124 -14.460 -0.424 -3.748 1.00 0.00 C ATOM 2020 O GLU A 124 -14.113 0.564 -3.103 1.00 0.00 O ATOM 2021 CB GLU A 124 -16.372 -0.724 -5.365 1.00 0.00 C ATOM 2022 CG GLU A 124 -16.961 -0.198 -6.675 1.00 0.00 C ATOM 2023 CD GLU A 124 -18.371 0.355 -6.460 1.00 0.00 C ATOM 2024 OE1 GLU A 124 -19.354 -0.394 -6.566 1.00 0.00 O ATOM 2025 OE2 GLU A 124 -18.426 1.611 -6.171 1.00 0.00 O ATOM 0 H GLU A 124 -14.427 -1.926 -6.406 1.00 0.00 H new ATOM 0 HA GLU A 124 -14.856 0.769 -5.479 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -16.430 -1.812 -5.347 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -16.963 -0.360 -4.525 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -16.318 0.584 -7.079 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -16.990 -1.000 -7.413 1.00 0.00 H new ATOM 2033 N LYS A 125 -14.476 -1.662 -3.274 1.00 0.00 N ATOM 2034 CA LYS A 125 -14.068 -1.945 -1.908 1.00 0.00 C ATOM 2035 C LYS A 125 -12.672 -1.366 -1.667 1.00 0.00 C ATOM 2036 O LYS A 125 -12.335 -0.998 -0.543 1.00 0.00 O ATOM 2037 CB LYS A 125 -14.171 -3.444 -1.619 1.00 0.00 C ATOM 2038 CG LYS A 125 -14.639 -3.694 -0.184 1.00 0.00 C ATOM 2039 CD LYS A 125 -15.294 -5.070 -0.053 1.00 0.00 C ATOM 2040 CE LYS A 125 -14.300 -6.185 -0.383 1.00 0.00 C ATOM 2041 NZ LYS A 125 -14.811 -7.026 -1.489 1.00 0.00 N ATOM 0 H LYS A 125 -14.765 -2.480 -3.811 1.00 0.00 H new ATOM 0 HA LYS A 125 -14.741 -1.460 -1.200 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -14.868 -3.906 -2.318 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -13.201 -3.916 -1.777 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -13.790 -3.625 0.496 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -15.348 -2.920 0.111 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -15.670 -5.202 0.961 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -16.152 -5.133 -0.722 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -13.339 -5.753 -0.661 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -14.129 -6.800 0.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -14.017 -7.518 -1.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -15.481 -7.726 -1.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -15.295 -6.425 -2.187 1.00 0.00 H new ATOM 2054 N GLN A 126 -11.898 -1.304 -2.741 1.00 0.00 N ATOM 2055 CA GLN A 126 -10.547 -0.776 -2.660 1.00 0.00 C ATOM 2056 C GLN A 126 -10.580 0.745 -2.496 1.00 0.00 C ATOM 2057 O GLN A 126 -9.776 1.311 -1.757 1.00 0.00 O ATOM 2058 CB GLN A 126 -9.727 -1.178 -3.887 1.00 0.00 C ATOM 2059 CG GLN A 126 -8.519 -0.256 -4.065 1.00 0.00 C ATOM 2060 CD GLN A 126 -7.639 -0.723 -5.227 1.00 0.00 C ATOM 2061 OE1 GLN A 126 -6.769 -1.674 -4.898 1.00 0.00 O flip ATOM 2062 NE2 GLN A 126 -7.744 -0.252 -6.347 1.00 0.00 N flip ATOM 0 H GLN A 126 -12.181 -1.611 -3.672 1.00 0.00 H new ATOM 0 HA GLN A 126 -10.062 -1.205 -1.783 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -9.390 -2.209 -3.782 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -10.354 -1.137 -4.777 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -8.859 0.763 -4.248 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -7.934 -0.236 -3.146 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -8.434 0.477 -6.531 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -7.142 -0.587 -7.099 1.00 0.00 H new ATOM 2071 N LYS A 127 -11.519 1.363 -3.198 1.00 0.00 N ATOM 2072 CA LYS A 127 -11.667 2.807 -3.140 1.00 0.00 C ATOM 2073 C LYS A 127 -12.287 3.198 -1.797 1.00 0.00 C ATOM 2074 O LYS A 127 -12.104 4.321 -1.328 1.00 0.00 O ATOM 2075 CB LYS A 127 -12.453 3.314 -4.350 1.00 0.00 C ATOM 2076 CG LYS A 127 -11.579 4.203 -5.238 1.00 0.00 C ATOM 2077 CD LYS A 127 -12.395 5.352 -5.836 1.00 0.00 C ATOM 2078 CE LYS A 127 -11.482 6.487 -6.303 1.00 0.00 C ATOM 2079 NZ LYS A 127 -12.208 7.776 -6.285 1.00 0.00 N ATOM 0 H LYS A 127 -12.184 0.890 -3.810 1.00 0.00 H new ATOM 0 HA LYS A 127 -10.693 3.292 -3.196 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -12.823 2.468 -4.929 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -13.325 3.875 -4.013 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -10.752 4.605 -4.654 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -11.143 3.606 -6.039 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -12.984 4.985 -6.676 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -13.098 5.728 -5.093 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -10.606 6.547 -5.657 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -11.121 6.280 -7.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -11.922 8.347 -7.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -13.232 7.598 -6.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -11.981 8.290 -5.410 1.00 0.00 H new ATOM 2092 N LYS A 128 -13.006 2.250 -1.215 1.00 0.00 N ATOM 2093 CA LYS A 128 -13.654 2.482 0.065 1.00 0.00 C ATOM 2094 C LYS A 128 -12.617 2.979 1.074 1.00 0.00 C ATOM 2095 O LYS A 128 -12.773 4.054 1.651 1.00 0.00 O ATOM 2096 CB LYS A 128 -14.404 1.228 0.521 1.00 0.00 C ATOM 2097 CG LYS A 128 -15.578 1.592 1.431 1.00 0.00 C ATOM 2098 CD LYS A 128 -16.865 0.907 0.966 1.00 0.00 C ATOM 2099 CE LYS A 128 -17.371 -0.081 2.019 1.00 0.00 C ATOM 2100 NZ LYS A 128 -16.949 -1.459 1.683 1.00 0.00 N ATOM 0 H LYS A 128 -13.154 1.320 -1.606 1.00 0.00 H new ATOM 0 HA LYS A 128 -14.410 3.262 -0.026 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -14.769 0.682 -0.349 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -13.721 0.564 1.051 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -15.354 1.296 2.456 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -15.718 2.673 1.435 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -17.630 1.658 0.769 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -16.684 0.383 0.028 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -16.985 0.195 3.000 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -18.458 -0.032 2.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -17.315 -2.119 2.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -17.324 -1.719 0.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -15.910 -1.509 1.665 1.00 0.00 H new ATOM 2113 N TYR A 129 -11.581 2.173 1.256 1.00 0.00 N ATOM 2114 CA TYR A 129 -10.519 2.517 2.185 1.00 0.00 C ATOM 2115 C TYR A 129 -9.644 3.640 1.625 1.00 0.00 C ATOM 2116 O TYR A 129 -9.292 4.575 2.343 1.00 0.00 O ATOM 2117 CB TYR A 129 -9.670 1.255 2.342 1.00 0.00 C ATOM 2118 CG TYR A 129 -10.484 -0.017 2.589 1.00 0.00 C ATOM 2119 CD1 TYR A 129 -11.447 -0.039 3.577 1.00 0.00 C ATOM 2120 CD2 TYR A 129 -10.257 -1.142 1.822 1.00 0.00 C ATOM 2121 CE1 TYR A 129 -12.214 -1.235 3.809 1.00 0.00 C ATOM 2122 CE2 TYR A 129 -11.024 -2.338 2.054 1.00 0.00 C ATOM 2123 CZ TYR A 129 -11.964 -2.326 3.036 1.00 0.00 C ATOM 2124 OH TYR A 129 -12.689 -3.456 3.255 1.00 0.00 O ATOM 0 H TYR A 129 -11.455 1.282 0.775 1.00 0.00 H new ATOM 0 HA TYR A 129 -10.934 2.861 3.132 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -9.069 1.120 1.443 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -8.977 1.397 3.171 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -11.625 0.841 4.177 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -9.504 -1.125 1.048 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -12.971 -1.265 4.579 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -10.856 -3.225 1.461 1.00 0.00 H new ATOM 0 HH TYR A 129 -12.583 -4.065 2.495 1.00 0.00 H new ATOM 2134 N VAL A 130 -9.317 3.511 0.348 1.00 0.00 N ATOM 2135 CA VAL A 130 -8.489 4.503 -0.317 1.00 0.00 C ATOM 2136 C VAL A 130 -9.129 5.884 -0.158 1.00 0.00 C ATOM 2137 O VAL A 130 -8.470 6.831 0.269 1.00 0.00 O ATOM 2138 CB VAL A 130 -8.274 4.110 -1.780 1.00 0.00 C ATOM 2139 CG1 VAL A 130 -8.519 5.300 -2.710 1.00 0.00 C ATOM 2140 CG2 VAL A 130 -6.874 3.528 -1.990 1.00 0.00 C ATOM 0 H VAL A 130 -9.610 2.734 -0.244 1.00 0.00 H new ATOM 0 HA VAL A 130 -7.502 4.546 0.143 1.00 0.00 H new ATOM 0 HB VAL A 130 -9.000 3.336 -2.030 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -8.359 4.993 -3.744 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -9.544 5.651 -2.590 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -7.828 6.105 -2.460 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -6.746 3.257 -3.038 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -6.126 4.271 -1.714 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -6.752 2.641 -1.368 1.00 0.00 H new ATOM 2150 N GLU A 131 -10.404 5.955 -0.509 1.00 0.00 N ATOM 2151 CA GLU A 131 -11.140 7.204 -0.411 1.00 0.00 C ATOM 2152 C GLU A 131 -11.168 7.690 1.040 1.00 0.00 C ATOM 2153 O GLU A 131 -11.293 8.887 1.295 1.00 0.00 O ATOM 2154 CB GLU A 131 -12.557 7.051 -0.965 1.00 0.00 C ATOM 2155 CG GLU A 131 -12.531 6.768 -2.468 1.00 0.00 C ATOM 2156 CD GLU A 131 -13.229 7.884 -3.249 1.00 0.00 C ATOM 2157 OE1 GLU A 131 -12.601 8.905 -3.566 1.00 0.00 O ATOM 2158 OE2 GLU A 131 -14.469 7.661 -3.527 1.00 0.00 O ATOM 0 H GLU A 131 -10.947 5.167 -0.862 1.00 0.00 H new ATOM 0 HA GLU A 131 -10.629 7.953 -1.016 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -13.068 6.239 -0.447 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -13.127 7.960 -0.772 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -11.499 6.673 -2.806 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -13.021 5.816 -2.671 1.00 0.00 H new ATOM 2166 N GLU A 132 -11.048 6.737 1.952 1.00 0.00 N ATOM 2167 CA GLU A 132 -11.059 7.053 3.370 1.00 0.00 C ATOM 2168 C GLU A 132 -9.669 7.504 3.824 1.00 0.00 C ATOM 2169 O GLU A 132 -9.522 8.569 4.422 1.00 0.00 O ATOM 2170 CB GLU A 132 -11.543 5.859 4.195 1.00 0.00 C ATOM 2171 CG GLU A 132 -12.951 6.104 4.741 1.00 0.00 C ATOM 2172 CD GLU A 132 -13.332 5.042 5.774 1.00 0.00 C ATOM 2173 OE1 GLU A 132 -14.391 4.409 5.651 1.00 0.00 O ATOM 2174 OE2 GLU A 132 -12.482 4.883 6.731 1.00 0.00 O ATOM 0 H GLU A 132 -10.943 5.746 1.737 1.00 0.00 H new ATOM 0 HA GLU A 132 -11.758 7.873 3.533 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -11.540 4.961 3.578 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -10.855 5.680 5.021 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.001 7.093 5.196 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.670 6.093 3.921 1.00 0.00 H new ATOM 2182 N VAL A 133 -8.683 6.672 3.521 1.00 0.00 N ATOM 2183 CA VAL A 133 -7.310 6.972 3.889 1.00 0.00 C ATOM 2184 C VAL A 133 -6.835 8.201 3.112 1.00 0.00 C ATOM 2185 O VAL A 133 -6.292 9.138 3.695 1.00 0.00 O ATOM 2186 CB VAL A 133 -6.427 5.744 3.663 1.00 0.00 C ATOM 2187 CG1 VAL A 133 -4.958 6.064 3.947 1.00 0.00 C ATOM 2188 CG2 VAL A 133 -6.904 4.562 4.510 1.00 0.00 C ATOM 0 H VAL A 133 -8.808 5.790 3.024 1.00 0.00 H new ATOM 0 HA VAL A 133 -7.243 7.212 4.950 1.00 0.00 H new ATOM 0 HB VAL A 133 -6.511 5.460 2.614 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -4.352 5.173 3.779 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -4.624 6.861 3.282 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -4.849 6.386 4.983 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -6.259 3.702 4.330 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -6.864 4.831 5.565 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -7.929 4.310 4.238 1.00 0.00 H new ATOM 2198 N TRP A 134 -7.057 8.158 1.806 1.00 0.00 N ATOM 2199 CA TRP A 134 -6.658 9.257 0.942 1.00 0.00 C ATOM 2200 C TRP A 134 -7.491 10.483 1.321 1.00 0.00 C ATOM 2201 O TRP A 134 -7.183 11.599 0.908 1.00 0.00 O ATOM 2202 CB TRP A 134 -6.796 8.873 -0.532 1.00 0.00 C ATOM 2203 CG TRP A 134 -6.303 9.947 -1.504 1.00 0.00 C ATOM 2204 CD1 TRP A 134 -5.607 11.057 -1.223 1.00 0.00 C ATOM 2205 CD2 TRP A 134 -6.499 9.968 -2.933 1.00 0.00 C ATOM 2206 NE1 TRP A 134 -5.340 11.789 -2.362 1.00 0.00 N ATOM 2207 CE2 TRP A 134 -5.900 11.106 -3.435 1.00 0.00 C ATOM 2208 CE3 TRP A 134 -7.160 9.057 -3.775 1.00 0.00 C ATOM 2209 CZ2 TRP A 134 -5.903 11.437 -4.795 1.00 0.00 C ATOM 2210 CZ3 TRP A 134 -7.154 9.402 -5.131 1.00 0.00 C ATOM 2211 CH2 TRP A 134 -6.556 10.543 -5.652 1.00 0.00 C ATOM 0 H TRP A 134 -7.508 7.380 1.325 1.00 0.00 H new ATOM 0 HA TRP A 134 -5.604 9.495 1.083 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -6.240 7.953 -0.711 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -7.843 8.659 -0.744 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -5.294 11.343 -0.230 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -4.826 12.669 -2.408 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -7.635 8.161 -3.404 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -5.427 12.334 -5.163 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -7.649 8.735 -5.821 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -6.595 10.739 -6.713 1.00 0.00 H new ATOM 2222 N GLY A 135 -8.531 10.233 2.103 1.00 0.00 N ATOM 2223 CA GLY A 135 -9.411 11.302 2.543 1.00 0.00 C ATOM 2224 C GLY A 135 -8.609 12.469 3.122 1.00 0.00 C ATOM 2225 O GLY A 135 -9.020 13.624 3.015 1.00 0.00 O ATOM 0 H GLY A 135 -8.784 9.305 2.443 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -10.013 11.651 1.704 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -10.102 10.922 3.295 1.00 0.00 H new ATOM 2229 N GLU A 136 -7.479 12.128 3.723 1.00 0.00 N ATOM 2230 CA GLU A 136 -6.615 13.133 4.320 1.00 0.00 C ATOM 2231 C GLU A 136 -5.633 13.674 3.279 1.00 0.00 C ATOM 2232 O GLU A 136 -5.576 14.880 3.043 1.00 0.00 O ATOM 2233 CB GLU A 136 -5.872 12.567 5.532 1.00 0.00 C ATOM 2234 CG GLU A 136 -5.925 13.542 6.711 1.00 0.00 C ATOM 2235 CD GLU A 136 -5.862 12.794 8.044 1.00 0.00 C ATOM 2236 OE1 GLU A 136 -5.011 11.909 8.218 1.00 0.00 O ATOM 2237 OE2 GLU A 136 -6.737 13.161 8.917 1.00 0.00 O ATOM 0 H GLU A 136 -7.141 11.169 3.810 1.00 0.00 H new ATOM 0 HA GLU A 136 -7.236 13.958 4.669 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -6.315 11.615 5.823 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -4.834 12.368 5.266 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -5.094 14.244 6.644 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -6.843 14.128 6.662 1.00 0.00 H new ATOM 2245 N TRP A 137 -4.885 12.757 2.684 1.00 0.00 N ATOM 2246 CA TRP A 137 -3.909 13.128 1.674 1.00 0.00 C ATOM 2247 C TRP A 137 -4.639 13.894 0.569 1.00 0.00 C ATOM 2248 O TRP A 137 -4.018 14.633 -0.194 1.00 0.00 O ATOM 2249 CB TRP A 137 -3.163 11.897 1.155 1.00 0.00 C ATOM 2250 CG TRP A 137 -1.934 11.518 1.984 1.00 0.00 C ATOM 2251 CD1 TRP A 137 -1.871 11.275 3.300 1.00 0.00 C ATOM 2252 CD2 TRP A 137 -0.587 11.347 1.496 1.00 0.00 C ATOM 2253 NE1 TRP A 137 -0.586 10.961 3.695 1.00 0.00 N ATOM 2254 CE2 TRP A 137 0.219 11.006 2.562 1.00 0.00 C ATOM 2255 CE3 TRP A 137 -0.067 11.475 0.196 1.00 0.00 C ATOM 2256 CZ2 TRP A 137 1.593 10.766 2.439 1.00 0.00 C ATOM 2257 CZ3 TRP A 137 1.308 11.233 0.089 1.00 0.00 C ATOM 2258 CH2 TRP A 137 2.133 10.889 1.153 1.00 0.00 C ATOM 0 H TRP A 137 -4.935 11.758 2.882 1.00 0.00 H new ATOM 0 HA TRP A 137 -3.142 13.776 2.098 1.00 0.00 H new ATOM 0 HB2 TRP A 137 -3.850 11.051 1.135 1.00 0.00 H new ATOM 0 HB3 TRP A 137 -2.852 12.080 0.126 1.00 0.00 H new ATOM 0 HD1 TRP A 137 -2.719 11.319 3.968 1.00 0.00 H new ATOM 0 HE1 TRP A 137 -0.283 10.737 4.643 1.00 0.00 H new ATOM 0 HE3 TRP A 137 -0.680 11.739 -0.653 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 2.203 10.500 3.290 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 1.759 11.320 -0.889 1.00 0.00 H new ATOM 0 HH2 TRP A 137 3.187 10.717 0.989 1.00 0.00 H new ATOM 2269 N ARG A 138 -5.948 13.693 0.519 1.00 0.00 N ATOM 2270 CA ARG A 138 -6.769 14.356 -0.479 1.00 0.00 C ATOM 2271 C ARG A 138 -6.519 15.866 -0.455 1.00 0.00 C ATOM 2272 O ARG A 138 -6.627 16.533 -1.483 1.00 0.00 O ATOM 2273 CB ARG A 138 -8.255 14.089 -0.236 1.00 0.00 C ATOM 2274 CG ARG A 138 -8.801 13.071 -1.239 1.00 0.00 C ATOM 2275 CD ARG A 138 -8.788 13.640 -2.659 1.00 0.00 C ATOM 2276 NE ARG A 138 -9.434 12.689 -3.591 1.00 0.00 N ATOM 2277 CZ ARG A 138 -10.755 12.409 -3.592 1.00 0.00 C ATOM 2278 NH1 ARG A 138 -11.582 13.007 -2.708 1.00 0.00 N ATOM 2279 NH2 ARG A 138 -11.225 11.543 -4.470 1.00 0.00 N ATOM 0 H ARG A 138 -6.460 13.080 1.154 1.00 0.00 H new ATOM 0 HA ARG A 138 -6.494 13.954 -1.454 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -8.400 13.719 0.779 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -8.814 15.021 -0.318 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -8.202 12.161 -1.202 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -9.819 12.794 -0.964 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -9.311 14.596 -2.681 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -7.762 13.831 -2.974 1.00 0.00 H new ATOM 0 HE ARG A 138 -8.844 12.215 -4.275 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -11.210 13.675 -2.033 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -12.579 12.790 -2.715 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -10.593 11.096 -5.134 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -12.220 11.320 -4.484 1.00 0.00 H new ATOM 2292 N SER A 139 -6.189 16.360 0.729 1.00 0.00 N ATOM 2293 CA SER A 139 -5.922 17.778 0.901 1.00 0.00 C ATOM 2294 C SER A 139 -4.556 18.129 0.308 1.00 0.00 C ATOM 2295 O SER A 139 -4.247 19.302 0.105 1.00 0.00 O ATOM 2296 CB SER A 139 -5.978 18.174 2.378 1.00 0.00 C ATOM 2297 OG SER A 139 -7.185 17.743 3.001 1.00 0.00 O ATOM 0 H SER A 139 -6.100 15.803 1.579 1.00 0.00 H new ATOM 0 HA SER A 139 -6.694 18.338 0.374 1.00 0.00 H new ATOM 0 HB2 SER A 139 -5.125 17.742 2.902 1.00 0.00 H new ATOM 0 HB3 SER A 139 -5.891 19.257 2.467 1.00 0.00 H new ATOM 0 HG SER A 139 -7.182 18.013 3.943 1.00 0.00 H new ATOM 2303 N ASN A 140 -3.775 17.091 0.047 1.00 0.00 N ATOM 2304 CA ASN A 140 -2.450 17.275 -0.518 1.00 0.00 C ATOM 2305 C ASN A 140 -2.213 16.225 -1.605 1.00 0.00 C ATOM 2306 O ASN A 140 -1.354 15.357 -1.459 1.00 0.00 O ATOM 2307 CB ASN A 140 -1.367 17.102 0.549 1.00 0.00 C ATOM 2308 CG ASN A 140 -1.672 15.905 1.452 1.00 0.00 C ATOM 2309 OD1 ASN A 140 -1.128 14.824 1.298 1.00 0.00 O ATOM 2310 ND2 ASN A 140 -2.571 16.157 2.399 1.00 0.00 N ATOM 0 H ASN A 140 -4.035 16.119 0.217 1.00 0.00 H new ATOM 0 HA ASN A 140 -2.396 18.284 -0.927 1.00 0.00 H new ATOM 0 HB2 ASN A 140 -0.398 16.963 0.069 1.00 0.00 H new ATOM 0 HB3 ASN A 140 -1.297 18.008 1.151 1.00 0.00 H new ATOM 0 HD21 ASN A 140 -2.843 15.422 3.052 1.00 0.00 H new ATOM 0 HD22 ASN A 140 -2.988 17.085 2.472 1.00 0.00 H new ATOM 2317 N PRO A 141 -3.011 16.341 -2.700 1.00 0.00 N ATOM 2318 CA PRO A 141 -2.897 15.413 -3.812 1.00 0.00 C ATOM 2319 C PRO A 141 -1.650 15.708 -4.647 1.00 0.00 C ATOM 2320 O PRO A 141 -0.631 15.033 -4.508 1.00 0.00 O ATOM 2321 CB PRO A 141 -4.190 15.577 -4.596 1.00 0.00 C ATOM 2322 CG PRO A 141 -4.772 16.913 -4.164 1.00 0.00 C ATOM 2323 CD PRO A 141 -4.040 17.357 -2.908 1.00 0.00 C ATOM 0 HA PRO A 141 -2.772 14.380 -3.487 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -4.001 15.562 -5.669 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -4.882 14.762 -4.383 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -4.656 17.654 -4.955 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -5.840 16.819 -3.970 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -3.600 18.346 -3.035 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -4.716 17.416 -2.055 1.00 0.00 H new ATOM 2331 N SER A 142 -1.771 16.717 -5.497 1.00 0.00 N ATOM 2332 CA SER A 142 -0.666 17.109 -6.355 1.00 0.00 C ATOM 2333 C SER A 142 0.660 16.938 -5.612 1.00 0.00 C ATOM 2334 O SER A 142 1.585 16.308 -6.122 1.00 0.00 O ATOM 2335 CB SER A 142 -0.825 18.555 -6.831 1.00 0.00 C ATOM 2336 OG SER A 142 -0.990 19.460 -5.743 1.00 0.00 O ATOM 0 H SER A 142 -2.617 17.275 -5.610 1.00 0.00 H new ATOM 0 HA SER A 142 -0.669 16.463 -7.233 1.00 0.00 H new ATOM 0 HB2 SER A 142 0.050 18.843 -7.413 1.00 0.00 H new ATOM 0 HB3 SER A 142 -1.687 18.625 -7.495 1.00 0.00 H new ATOM 0 HG SER A 142 -1.086 20.372 -6.088 1.00 0.00 H new ATOM 2342 N GLU A 143 0.710 17.509 -4.417 1.00 0.00 N ATOM 2343 CA GLU A 143 1.908 17.428 -3.598 1.00 0.00 C ATOM 2344 C GLU A 143 1.724 18.228 -2.308 1.00 0.00 C ATOM 2345 O GLU A 143 0.789 19.019 -2.191 1.00 0.00 O ATOM 2346 CB GLU A 143 3.136 17.911 -4.373 1.00 0.00 C ATOM 2347 CG GLU A 143 4.185 16.803 -4.483 1.00 0.00 C ATOM 2348 CD GLU A 143 5.399 17.276 -5.286 1.00 0.00 C ATOM 2349 OE1 GLU A 143 5.483 17.013 -6.495 1.00 0.00 O ATOM 2350 OE2 GLU A 143 6.274 17.939 -4.611 1.00 0.00 O ATOM 0 H GLU A 143 -0.060 18.030 -3.996 1.00 0.00 H new ATOM 0 HA GLU A 143 2.074 16.384 -3.334 1.00 0.00 H new ATOM 0 HB2 GLU A 143 2.837 18.234 -5.370 1.00 0.00 H new ATOM 0 HB3 GLU A 143 3.568 18.778 -3.873 1.00 0.00 H new ATOM 0 HG2 GLU A 143 4.501 16.496 -3.486 1.00 0.00 H new ATOM 0 HG3 GLU A 143 3.746 15.928 -4.962 1.00 0.00 H new ATOM 2358 N ASP A 144 2.631 17.996 -1.370 1.00 0.00 N ATOM 2359 CA ASP A 144 2.580 18.685 -0.092 1.00 0.00 C ATOM 2360 C ASP A 144 2.883 20.170 -0.306 1.00 0.00 C ATOM 2361 O ASP A 144 4.041 20.555 -0.458 1.00 0.00 O ATOM 2362 CB ASP A 144 3.623 18.126 0.878 1.00 0.00 C ATOM 2363 CG ASP A 144 3.364 18.434 2.354 1.00 0.00 C ATOM 2364 OD1 ASP A 144 2.931 17.562 3.122 1.00 0.00 O ATOM 2365 OD2 ASP A 144 3.630 19.644 2.712 1.00 0.00 O ATOM 0 H ASP A 144 3.406 17.340 -1.470 1.00 0.00 H new ATOM 0 HA ASP A 144 1.584 18.543 0.328 1.00 0.00 H new ATOM 0 HB2 ASP A 144 3.672 17.045 0.751 1.00 0.00 H new ATOM 0 HB3 ASP A 144 4.601 18.524 0.606 1.00 0.00 H new ATOM 2371 N SER A 145 1.821 20.963 -0.312 1.00 0.00 N ATOM 2372 CA SER A 145 1.959 22.396 -0.505 1.00 0.00 C ATOM 2373 C SER A 145 0.642 23.098 -0.167 1.00 0.00 C ATOM 2374 O SER A 145 0.606 23.980 0.689 1.00 0.00 O ATOM 2375 CB SER A 145 2.381 22.721 -1.939 1.00 0.00 C ATOM 2376 OG SER A 145 2.170 24.093 -2.260 1.00 0.00 O ATOM 0 H SER A 145 0.862 20.640 -0.186 1.00 0.00 H new ATOM 0 HA SER A 145 2.739 22.758 0.165 1.00 0.00 H new ATOM 0 HB2 SER A 145 3.435 22.476 -2.071 1.00 0.00 H new ATOM 0 HB3 SER A 145 1.819 22.096 -2.633 1.00 0.00 H new ATOM 0 HG SER A 145 2.453 24.260 -3.183 1.00 0.00 H new ATOM 2382 N ASP A 146 -0.409 22.681 -0.858 1.00 0.00 N ATOM 2383 CA ASP A 146 -1.724 23.259 -0.643 1.00 0.00 C ATOM 2384 C ASP A 146 -2.176 22.967 0.789 1.00 0.00 C ATOM 2385 O ASP A 146 -1.999 21.856 1.286 1.00 0.00 O ATOM 2386 CB ASP A 146 -2.755 22.652 -1.597 1.00 0.00 C ATOM 2387 CG ASP A 146 -2.725 23.210 -3.021 1.00 0.00 C ATOM 2388 OD1 ASP A 146 -3.762 23.604 -3.575 1.00 0.00 O ATOM 2389 OD2 ASP A 146 -1.560 23.230 -3.574 1.00 0.00 O ATOM 0 H ASP A 146 -0.376 21.949 -1.568 1.00 0.00 H new ATOM 0 HA ASP A 146 -1.654 24.332 -0.822 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -2.596 21.575 -1.642 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -3.750 22.811 -1.181 1.00 0.00 H new ATOM 2395 N PRO A 147 -2.767 24.011 1.430 1.00 0.00 N ATOM 2396 CA PRO A 147 -3.246 23.878 2.795 1.00 0.00 C ATOM 2397 C PRO A 147 -4.543 23.069 2.845 1.00 0.00 C ATOM 2398 O PRO A 147 -4.682 22.161 3.663 1.00 0.00 O ATOM 2399 CB PRO A 147 -3.415 25.304 3.293 1.00 0.00 C ATOM 2400 CG PRO A 147 -3.473 26.176 2.050 1.00 0.00 C ATOM 2401 CD PRO A 147 -2.994 25.342 0.873 1.00 0.00 C ATOM 0 HA PRO A 147 -2.554 23.327 3.432 1.00 0.00 H new ATOM 0 HB2 PRO A 147 -4.325 25.406 3.884 1.00 0.00 H new ATOM 0 HB3 PRO A 147 -2.584 25.594 3.935 1.00 0.00 H new ATOM 0 HG2 PRO A 147 -4.490 26.529 1.879 1.00 0.00 H new ATOM 0 HG3 PRO A 147 -2.845 27.059 2.173 1.00 0.00 H new ATOM 0 HD2 PRO A 147 -3.738 25.317 0.077 1.00 0.00 H new ATOM 0 HD3 PRO A 147 -2.080 25.752 0.443 1.00 0.00 H new ATOM 2409 N GLY A 148 -5.460 23.427 1.958 1.00 0.00 N ATOM 2410 CA GLY A 148 -6.742 22.745 1.891 1.00 0.00 C ATOM 2411 C GLY A 148 -7.876 23.736 1.621 1.00 0.00 C ATOM 2412 O GLY A 148 -8.821 23.832 2.403 1.00 0.00 O ATOM 0 H GLY A 148 -5.341 24.180 1.280 1.00 0.00 H new ATOM 0 HA2 GLY A 148 -6.717 21.992 1.103 1.00 0.00 H new ATOM 0 HA3 GLY A 148 -6.928 22.220 2.828 1.00 0.00 H new ATOM 2416 N LYS A 149 -7.746 24.448 0.511 1.00 0.00 N ATOM 2417 CA LYS A 149 -8.748 25.428 0.128 1.00 0.00 C ATOM 2418 C LYS A 149 -9.413 24.987 -1.177 1.00 0.00 C ATOM 2419 O LYS A 149 -8.796 25.034 -2.240 1.00 0.00 O ATOM 2420 CB LYS A 149 -8.132 26.827 0.062 1.00 0.00 C ATOM 2421 CG LYS A 149 -8.985 27.838 0.829 1.00 0.00 C ATOM 2422 CD LYS A 149 -10.228 28.227 0.026 1.00 0.00 C ATOM 2423 CE LYS A 149 -11.467 28.275 0.923 1.00 0.00 C ATOM 2424 NZ LYS A 149 -11.590 29.601 1.568 1.00 0.00 N ATOM 0 H LYS A 149 -6.961 24.366 -0.136 1.00 0.00 H new ATOM 0 HA LYS A 149 -9.532 25.486 0.883 1.00 0.00 H new ATOM 0 HB2 LYS A 149 -7.125 26.805 0.479 1.00 0.00 H new ATOM 0 HB3 LYS A 149 -8.040 27.139 -0.978 1.00 0.00 H new ATOM 0 HG2 LYS A 149 -9.285 27.414 1.787 1.00 0.00 H new ATOM 0 HG3 LYS A 149 -8.394 28.728 1.045 1.00 0.00 H new ATOM 0 HD2 LYS A 149 -10.074 29.200 -0.440 1.00 0.00 H new ATOM 0 HD3 LYS A 149 -10.385 27.509 -0.779 1.00 0.00 H new ATOM 0 HE2 LYS A 149 -12.359 28.068 0.332 1.00 0.00 H new ATOM 0 HE3 LYS A 149 -11.402 27.498 1.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 -12.436 29.616 2.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 -10.746 29.785 2.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 -11.674 30.336 0.837 1.00 0.00 H new ATOM 2437 N ARG A 150 -10.664 24.568 -1.054 1.00 0.00 N ATOM 2438 CA ARG A 150 -11.420 24.118 -2.211 1.00 0.00 C ATOM 2439 C ARG A 150 -12.876 24.576 -2.103 1.00 0.00 C ATOM 2440 O ARG A 150 -13.413 25.174 -3.034 1.00 0.00 O ATOM 2441 CB ARG A 150 -11.380 22.594 -2.338 1.00 0.00 C ATOM 2442 CG ARG A 150 -10.099 22.136 -3.038 1.00 0.00 C ATOM 2443 CD ARG A 150 -10.395 21.032 -4.055 1.00 0.00 C ATOM 2444 NE ARG A 150 -10.985 21.617 -5.280 1.00 0.00 N ATOM 2445 CZ ARG A 150 -10.305 22.389 -6.154 1.00 0.00 C ATOM 2446 NH1 ARG A 150 -9.003 22.676 -5.945 1.00 0.00 N ATOM 2447 NH2 ARG A 150 -10.933 22.860 -7.215 1.00 0.00 N ATOM 0 H ARG A 150 -11.173 24.531 -0.171 1.00 0.00 H new ATOM 0 HA ARG A 150 -10.961 24.556 -3.097 1.00 0.00 H new ATOM 0 HB2 ARG A 150 -11.440 22.141 -1.348 1.00 0.00 H new ATOM 0 HB3 ARG A 150 -12.249 22.249 -2.899 1.00 0.00 H new ATOM 0 HG2 ARG A 150 -9.632 22.983 -3.541 1.00 0.00 H new ATOM 0 HG3 ARG A 150 -9.386 21.772 -2.298 1.00 0.00 H new ATOM 0 HD2 ARG A 150 -9.477 20.499 -4.302 1.00 0.00 H new ATOM 0 HD3 ARG A 150 -11.081 20.303 -3.623 1.00 0.00 H new ATOM 0 HE ARG A 150 -11.967 21.425 -5.476 1.00 0.00 H new ATOM 0 HH11 ARG A 150 -8.526 22.309 -5.122 1.00 0.00 H new ATOM 0 HH12 ARG A 150 -8.496 23.260 -6.610 1.00 0.00 H new ATOM 0 HH21 ARG A 150 -11.917 22.639 -7.365 1.00 0.00 H new ATOM 0 HH22 ARG A 150 -10.434 23.445 -7.885 1.00 0.00 H new TER 2460 ARG A 150