USER MOD reduce.3.24.130724 H: found=0, std=0, add=1458, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1458 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 134 MET CE :methyl 143:sc= -2.17! (180deg=-0.0382) USER MOD Set 1.2: A 188 HIS : no HE2:sc= -2.58 K(o=-4.7,f=-10!) USER MOD Set 2.1: A 128 SER OG : rot -170:sc= 0 USER MOD Set 2.2: A 196 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 113 MET CE :methyl -171:sc= -0.0907 (180deg=-0.288) USER MOD Set 3.2: A 124 HIS : no HE2:sc= -1.52 X(o=-1.6,f=-1.6) USER MOD Set 4.1: A 109 THR OG1 : rot -55:sc= 1.37 USER MOD Set 4.2: A 176 HIS : no HD1:sc= -1.57! C(o=-0.2!,f=-7!) USER MOD Set 5.1: A 84 LYS NZ :NH3+ 151:sc= 1.23 (180deg=0.0237) USER MOD Set 5.2: A 105 SER OG : rot -55:sc= 1.45 USER MOD Set 6.1: A 29 CYS SG : rot 180:sc= 1 USER MOD Set 6.2: A 81 TYR OH : rot 3:sc= 1.05 USER MOD Set 7.1: A 5 SER OG : rot 92:sc= 1.19 USER MOD Set 7.2: A 75 ASN : amide:sc= 0.662 K(o=1.8,f=-4) USER MOD Single : A 0 THR OG1 : rot 180:sc= -0.967 USER MOD Single : A 1 MET CE :methyl -133:sc= -1.3 (180deg=-3.56!) USER MOD Single : A 7 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00289) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -5 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 ASN : amide:sc= 0.0743 K(o=0.074,f=-4.6!) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl -177:sc= -3.81! (180deg=-3.92!) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 SER OG : rot 180:sc= 0.0207 USER MOD Single : A 23 THR OG1 : rot -140:sc= -0.0597 USER MOD Single : A 24 MET CE :methyl -177:sc= -0.551 (180deg=-0.568) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 MET CE :methyl -174:sc= -3.31 (180deg=-3.48) USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 52 SER OG : rot -126:sc= 0.886 USER MOD Single : A 57 LYS NZ :NH3+ -160:sc= -0.0674 (180deg=-0.514) USER MOD Single : A 58 LYS NZ :NH3+ 176:sc= 1.3 (180deg=1.29) USER MOD Single : A 66 LYS NZ :NH3+ 176:sc= -3.43! (180deg=-3.49!) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 166:sc= -0.0388 (180deg=-0.367) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 MET CE :methyl 144:sc= -2.82 (180deg=-6.24!) USER MOD Single : A 83 LYS NZ :NH3+ 178:sc= -0.0638 (180deg=-0.0724) USER MOD Single : A 85 GLN : amide:sc= -1.75 K(o=-1.8,f=-0.54) USER MOD Single : A 89 LYS NZ :NH3+ 154:sc= -0.241 (180deg=-0.863) USER MOD Single : A 92 MET CE :methyl -131:sc= -4.42! (180deg=-6.66!) USER MOD Single : A 96 THR OG1 : rot 180:sc= -0.088 USER MOD Single : A 98 LYS NZ :NH3+ -117:sc= -1.19 (180deg=-3.23!) USER MOD Single : A 99 THR OG1 : rot 180:sc= -0.601 USER MOD Single : A 101 MET CE :methyl -164:sc= -1.23 (180deg=-2.96) USER MOD Single : A 106 LYS NZ :NH3+ -178:sc= -2.33! (180deg=-2.34!) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0.00244 USER MOD Single : A 111 MET CE :methyl 165:sc= -3.14 (180deg=-5.69!) USER MOD Single : A 114 THR OG1 : rot 79:sc= 0.0233 USER MOD Single : A 116 CYS SG : rot 79:sc= 0.984 USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 ASN : amide:sc= 0.87 K(o=0.87,f=-1.6!) USER MOD Single : A 127 TYR OH : rot 130:sc= -0.546 USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ -123:sc= -1.4! (180deg=-2.02!) USER MOD Single : A 172 ASN : amide:sc= -2.64! K(o=-2.6!,f=-0.026) USER MOD Single : A 179 THR OG1 : rot 140:sc= 0.578 USER MOD Single : A 183 GLN : amide:sc= -1.79 K(o=-1.8,f=-5.3!) USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 199 TYR OH : rot 180:sc= 0 USER MOD Single : A 200 SER OG : rot -54:sc= 0.00946 USER MOD Single : A 202 GLN : amide:sc= -1.62 K(o=-1.6,f=-0.21) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -5 -28.538 -17.102 1.794 1.00 10.08 N ATOM 2 CA GLY A -5 -29.588 -16.749 0.812 1.00 9.65 C ATOM 3 C GLY A -5 -29.817 -15.258 0.737 1.00 8.52 C ATOM 4 O GLY A -5 -28.915 -14.502 0.377 1.00 8.35 O ATOM 0 H1 GLY A -5 -28.413 -18.134 1.813 1.00 10.08 H new ATOM 0 H2 GLY A -5 -27.642 -16.650 1.522 1.00 10.08 H new ATOM 0 H3 GLY A -5 -28.820 -16.770 2.738 1.00 10.08 H new ATOM 0 HA2 GLY A -5 -29.304 -17.122 -0.172 1.00 9.65 H new ATOM 0 HA3 GLY A -5 -30.520 -17.245 1.084 1.00 9.65 H new ATOM 10 N ILE A -4 -31.019 -14.825 1.086 1.00 7.94 N ATOM 11 CA ILE A -4 -31.359 -13.414 1.036 1.00 6.97 C ATOM 12 C ILE A -4 -30.983 -12.721 2.344 1.00 6.09 C ATOM 13 O ILE A -4 -31.710 -12.782 3.335 1.00 5.96 O ATOM 14 CB ILE A -4 -32.858 -13.163 0.703 1.00 7.12 C ATOM 15 CG1 ILE A -4 -33.815 -13.889 1.675 1.00 7.77 C ATOM 16 CG2 ILE A -4 -33.150 -13.566 -0.736 1.00 7.21 C ATOM 17 CD1 ILE A -4 -33.916 -15.390 1.473 1.00 8.21 C ATOM 0 H ILE A -4 -31.774 -15.431 1.407 1.00 7.94 H new ATOM 0 HA ILE A -4 -30.777 -12.984 0.221 1.00 6.97 H new ATOM 0 HB ILE A -4 -33.040 -12.095 0.825 1.00 7.12 H new ATOM 0 HG12 ILE A -4 -33.487 -13.696 2.696 1.00 7.77 H new ATOM 0 HG13 ILE A -4 -34.810 -13.456 1.573 1.00 7.77 H new ATOM 0 HG21 ILE A -4 -34.202 -13.386 -0.958 1.00 7.21 H new ATOM 0 HG22 ILE A -4 -32.531 -12.976 -1.412 1.00 7.21 H new ATOM 0 HG23 ILE A -4 -32.927 -14.625 -0.870 1.00 7.21 H new ATOM 0 HD11 ILE A -4 -34.610 -15.809 2.201 1.00 8.21 H new ATOM 0 HD12 ILE A -4 -34.277 -15.598 0.466 1.00 8.21 H new ATOM 0 HD13 ILE A -4 -32.933 -15.842 1.607 1.00 8.21 H new ATOM 29 N ASP A -3 -29.826 -12.080 2.347 1.00 5.76 N ATOM 30 CA ASP A -3 -29.356 -11.377 3.532 1.00 5.11 C ATOM 31 C ASP A -3 -29.952 -9.978 3.574 1.00 4.13 C ATOM 32 O ASP A -3 -29.868 -9.232 2.599 1.00 4.11 O ATOM 33 CB ASP A -3 -27.826 -11.311 3.561 1.00 5.67 C ATOM 34 CG ASP A -3 -27.191 -12.684 3.663 1.00 6.72 C ATOM 35 OD1 ASP A -3 -27.349 -13.343 4.714 1.00 7.33 O ATOM 36 OD2 ASP A -3 -26.524 -13.113 2.698 1.00 7.08 O ATOM 0 H ASP A -3 -29.196 -12.031 1.546 1.00 5.76 H new ATOM 0 HA ASP A -3 -29.683 -11.928 4.414 1.00 5.11 H new ATOM 0 HB2 ASP A -3 -27.469 -10.815 2.659 1.00 5.67 H new ATOM 0 HB3 ASP A -3 -27.507 -10.702 4.407 1.00 5.67 H new ATOM 41 N PRO A -2 -30.586 -9.618 4.698 1.00 3.75 N ATOM 42 CA PRO A -2 -31.280 -8.338 4.840 1.00 3.21 C ATOM 43 C PRO A -2 -30.330 -7.149 4.899 1.00 2.50 C ATOM 44 O PRO A -2 -29.201 -7.257 5.383 1.00 2.81 O ATOM 45 CB PRO A -2 -32.032 -8.485 6.165 1.00 3.86 C ATOM 46 CG PRO A -2 -31.257 -9.495 6.936 1.00 4.50 C ATOM 47 CD PRO A -2 -30.671 -10.435 5.920 1.00 4.43 C ATOM 0 HA PRO A -2 -31.924 -8.136 3.984 1.00 3.21 H new ATOM 0 HB2 PRO A -2 -32.083 -7.535 6.698 1.00 3.86 H new ATOM 0 HB3 PRO A -2 -33.058 -8.815 6.002 1.00 3.86 H new ATOM 0 HG2 PRO A -2 -30.473 -9.019 7.524 1.00 4.50 H new ATOM 0 HG3 PRO A -2 -31.900 -10.029 7.636 1.00 4.50 H new ATOM 0 HD2 PRO A -2 -29.690 -10.798 6.228 1.00 4.43 H new ATOM 0 HD3 PRO A -2 -31.303 -11.311 5.773 1.00 4.43 H new ATOM 55 N PHE A -1 -30.798 -6.020 4.394 1.00 2.13 N ATOM 56 CA PHE A -1 -30.051 -4.785 4.429 1.00 1.78 C ATOM 57 C PHE A -1 -30.941 -3.672 4.947 1.00 1.73 C ATOM 58 O PHE A -1 -31.640 -3.003 4.184 1.00 2.21 O ATOM 59 CB PHE A -1 -29.518 -4.434 3.044 1.00 2.13 C ATOM 60 CG PHE A -1 -28.369 -5.290 2.605 1.00 2.45 C ATOM 61 CD1 PHE A -1 -27.103 -5.095 3.126 1.00 2.78 C ATOM 62 CD2 PHE A -1 -28.561 -6.290 1.667 1.00 2.89 C ATOM 63 CE1 PHE A -1 -26.045 -5.884 2.720 1.00 3.51 C ATOM 64 CE2 PHE A -1 -27.507 -7.082 1.257 1.00 3.47 C ATOM 65 CZ PHE A -1 -26.236 -6.874 1.801 1.00 3.78 C ATOM 0 H PHE A -1 -31.711 -5.939 3.947 1.00 2.13 H new ATOM 0 HA PHE A -1 -29.198 -4.908 5.097 1.00 1.78 H new ATOM 0 HB2 PHE A -1 -30.327 -4.527 2.319 1.00 2.13 H new ATOM 0 HB3 PHE A -1 -29.204 -3.390 3.039 1.00 2.13 H new ATOM 0 HD1 PHE A -1 -26.940 -4.318 3.858 1.00 2.78 H new ATOM 0 HD2 PHE A -1 -29.545 -6.452 1.252 1.00 2.89 H new ATOM 0 HE1 PHE A -1 -25.061 -5.716 3.132 1.00 3.51 H new ATOM 0 HE2 PHE A -1 -27.663 -7.857 0.521 1.00 3.47 H new ATOM 0 HZ PHE A -1 -25.408 -7.495 1.495 1.00 3.78 H new ATOM 75 N THR A 0 -30.943 -3.520 6.253 1.00 1.54 N ATOM 76 CA THR A 0 -31.746 -2.501 6.905 1.00 1.59 C ATOM 77 C THR A 0 -31.110 -1.122 6.746 1.00 1.40 C ATOM 78 O THR A 0 -30.165 -0.958 5.969 1.00 1.49 O ATOM 79 CB THR A 0 -31.949 -2.827 8.396 1.00 1.75 C ATOM 80 OG1 THR A 0 -30.686 -3.086 9.026 1.00 1.70 O ATOM 81 CG2 THR A 0 -32.857 -4.034 8.564 1.00 2.11 C ATOM 0 H THR A 0 -30.393 -4.094 6.892 1.00 1.54 H new ATOM 0 HA THR A 0 -32.723 -2.489 6.421 1.00 1.59 H new ATOM 0 HB THR A 0 -32.418 -1.964 8.870 1.00 1.75 H new ATOM 0 HG1 THR A 0 -30.829 -3.290 9.974 1.00 1.70 H new ATOM 0 HG21 THR A 0 -32.987 -4.247 9.625 1.00 2.11 H new ATOM 0 HG22 THR A 0 -33.828 -3.824 8.114 1.00 2.11 H new ATOM 0 HG23 THR A 0 -32.409 -4.898 8.073 1.00 2.11 H new ATOM 89 N MET A 1 -31.620 -0.130 7.471 1.00 1.38 N ATOM 90 CA MET A 1 -31.120 1.238 7.351 1.00 1.36 C ATOM 91 C MET A 1 -29.796 1.407 8.102 1.00 1.21 C ATOM 92 O MET A 1 -29.601 2.338 8.883 1.00 1.42 O ATOM 93 CB MET A 1 -32.172 2.239 7.844 1.00 1.66 C ATOM 94 CG MET A 1 -31.870 3.702 7.511 1.00 1.86 C ATOM 95 SD MET A 1 -31.825 4.047 5.735 1.00 2.09 S ATOM 96 CE MET A 1 -30.132 3.621 5.321 1.00 1.64 C ATOM 0 H MET A 1 -32.376 -0.246 8.145 1.00 1.38 H new ATOM 0 HA MET A 1 -30.927 1.442 6.298 1.00 1.36 H new ATOM 0 HB2 MET A 1 -33.137 1.974 7.411 1.00 1.66 H new ATOM 0 HB3 MET A 1 -32.270 2.140 8.925 1.00 1.66 H new ATOM 0 HG2 MET A 1 -32.625 4.335 7.976 1.00 1.86 H new ATOM 0 HG3 MET A 1 -30.910 3.975 7.950 1.00 1.86 H new ATOM 0 HE1 MET A 1 -29.696 4.412 4.711 1.00 1.64 H new ATOM 0 HE2 MET A 1 -29.551 3.507 6.236 1.00 1.64 H new ATOM 0 HE3 MET A 1 -30.118 2.684 4.764 1.00 1.64 H new ATOM 106 N VAL A 2 -28.893 0.489 7.833 1.00 1.00 N ATOM 107 CA VAL A 2 -27.538 0.539 8.323 1.00 0.98 C ATOM 108 C VAL A 2 -26.607 0.215 7.165 1.00 0.79 C ATOM 109 O VAL A 2 -26.060 -0.878 7.061 1.00 0.92 O ATOM 110 CB VAL A 2 -27.290 -0.436 9.500 1.00 1.21 C ATOM 111 CG1 VAL A 2 -27.966 0.065 10.766 1.00 1.56 C ATOM 112 CG2 VAL A 2 -27.783 -1.837 9.159 1.00 1.32 C ATOM 0 H VAL A 2 -29.087 -0.329 7.255 1.00 1.00 H new ATOM 0 HA VAL A 2 -27.347 1.539 8.712 1.00 0.98 H new ATOM 0 HB VAL A 2 -26.215 -0.482 9.675 1.00 1.21 H new ATOM 0 HG11 VAL A 2 -27.779 -0.635 11.580 1.00 1.56 H new ATOM 0 HG12 VAL A 2 -27.565 1.044 11.030 1.00 1.56 H new ATOM 0 HG13 VAL A 2 -29.040 0.146 10.597 1.00 1.56 H new ATOM 0 HG21 VAL A 2 -27.597 -2.503 10.002 1.00 1.32 H new ATOM 0 HG22 VAL A 2 -28.852 -1.806 8.950 1.00 1.32 H new ATOM 0 HG23 VAL A 2 -27.252 -2.206 8.281 1.00 1.32 H new ATOM 122 N ALA A 3 -26.490 1.156 6.254 1.00 0.66 N ATOM 123 CA ALA A 3 -25.665 0.970 5.085 1.00 0.55 C ATOM 124 C ALA A 3 -24.915 2.240 4.775 1.00 0.60 C ATOM 125 O ALA A 3 -25.423 3.343 4.978 1.00 1.10 O ATOM 126 CB ALA A 3 -26.508 0.540 3.895 1.00 0.63 C ATOM 0 H ALA A 3 -26.959 2.061 6.303 1.00 0.66 H new ATOM 0 HA ALA A 3 -24.943 0.179 5.290 1.00 0.55 H new ATOM 0 HB1 ALA A 3 -25.866 0.405 3.024 1.00 0.63 H new ATOM 0 HB2 ALA A 3 -27.009 -0.400 4.125 1.00 0.63 H new ATOM 0 HB3 ALA A 3 -27.253 1.306 3.681 1.00 0.63 H new ATOM 132 N LEU A 4 -23.709 2.072 4.288 1.00 0.45 N ATOM 133 CA LEU A 4 -22.838 3.186 3.982 1.00 0.41 C ATOM 134 C LEU A 4 -22.647 3.283 2.480 1.00 0.39 C ATOM 135 O LEU A 4 -22.277 2.306 1.834 1.00 0.38 O ATOM 136 CB LEU A 4 -21.482 3.015 4.677 1.00 0.41 C ATOM 137 CG LEU A 4 -21.408 3.465 6.145 1.00 0.56 C ATOM 138 CD1 LEU A 4 -22.470 2.797 6.995 1.00 1.16 C ATOM 139 CD2 LEU A 4 -20.036 3.164 6.709 1.00 1.46 C ATOM 0 H LEU A 4 -23.301 1.158 4.092 1.00 0.45 H new ATOM 0 HA LEU A 4 -23.297 4.105 4.347 1.00 0.41 H new ATOM 0 HB2 LEU A 4 -21.202 1.963 4.627 1.00 0.41 H new ATOM 0 HB3 LEU A 4 -20.735 3.571 4.111 1.00 0.41 H new ATOM 0 HG LEU A 4 -21.590 4.539 6.170 1.00 0.56 H new ATOM 0 HD11 LEU A 4 -22.382 3.143 8.025 1.00 1.16 H new ATOM 0 HD12 LEU A 4 -23.457 3.051 6.610 1.00 1.16 H new ATOM 0 HD13 LEU A 4 -22.335 1.716 6.963 1.00 1.16 H new ATOM 0 HD21 LEU A 4 -19.992 3.486 7.749 1.00 1.46 H new ATOM 0 HD22 LEU A 4 -19.846 2.092 6.652 1.00 1.46 H new ATOM 0 HD23 LEU A 4 -19.280 3.697 6.132 1.00 1.46 H new ATOM 151 N SER A 5 -22.891 4.459 1.936 1.00 0.41 N ATOM 152 CA SER A 5 -22.758 4.667 0.504 1.00 0.42 C ATOM 153 C SER A 5 -21.347 5.133 0.199 1.00 0.37 C ATOM 154 O SER A 5 -20.990 6.285 0.465 1.00 0.42 O ATOM 155 CB SER A 5 -23.787 5.677 -0.009 1.00 0.51 C ATOM 156 OG SER A 5 -25.113 5.228 0.216 1.00 1.28 O ATOM 0 H SER A 5 -23.182 5.284 2.460 1.00 0.41 H new ATOM 0 HA SER A 5 -22.948 3.725 -0.010 1.00 0.42 H new ATOM 0 HB2 SER A 5 -23.637 6.635 0.488 1.00 0.51 H new ATOM 0 HB3 SER A 5 -23.634 5.844 -1.075 1.00 0.51 H new ATOM 0 HG SER A 5 -25.432 5.568 1.078 1.00 1.28 H new ATOM 162 N LEU A 6 -20.540 4.228 -0.328 1.00 0.31 N ATOM 163 CA LEU A 6 -19.130 4.494 -0.534 1.00 0.28 C ATOM 164 C LEU A 6 -18.798 4.484 -2.019 1.00 0.28 C ATOM 165 O LEU A 6 -19.213 3.586 -2.756 1.00 0.31 O ATOM 166 CB LEU A 6 -18.285 3.446 0.202 1.00 0.26 C ATOM 167 CG LEU A 6 -18.614 3.275 1.690 1.00 0.33 C ATOM 168 CD1 LEU A 6 -17.741 2.198 2.317 1.00 0.61 C ATOM 169 CD2 LEU A 6 -18.446 4.590 2.432 1.00 0.62 C ATOM 0 H LEU A 6 -20.841 3.299 -0.622 1.00 0.31 H new ATOM 0 HA LEU A 6 -18.900 5.481 -0.134 1.00 0.28 H new ATOM 0 HB2 LEU A 6 -18.412 2.484 -0.295 1.00 0.26 H new ATOM 0 HB3 LEU A 6 -17.234 3.717 0.107 1.00 0.26 H new ATOM 0 HG LEU A 6 -19.655 2.963 1.771 1.00 0.33 H new ATOM 0 HD11 LEU A 6 -17.992 2.095 3.373 1.00 0.61 H new ATOM 0 HD12 LEU A 6 -17.912 1.249 1.809 1.00 0.61 H new ATOM 0 HD13 LEU A 6 -16.692 2.478 2.220 1.00 0.61 H new ATOM 0 HD21 LEU A 6 -18.684 4.446 3.486 1.00 0.62 H new ATOM 0 HD22 LEU A 6 -17.416 4.933 2.337 1.00 0.62 H new ATOM 0 HD23 LEU A 6 -19.117 5.336 2.007 1.00 0.62 H new ATOM 181 N LYS A 7 -18.067 5.495 -2.457 1.00 0.29 N ATOM 182 CA LYS A 7 -17.601 5.547 -3.832 1.00 0.31 C ATOM 183 C LYS A 7 -16.371 4.676 -3.997 1.00 0.29 C ATOM 184 O LYS A 7 -15.306 4.994 -3.478 1.00 0.31 O ATOM 185 CB LYS A 7 -17.272 6.976 -4.258 1.00 0.39 C ATOM 186 CG LYS A 7 -18.457 7.743 -4.810 1.00 0.52 C ATOM 187 CD LYS A 7 -18.008 9.041 -5.455 1.00 0.63 C ATOM 188 CE LYS A 7 -19.131 9.694 -6.239 1.00 0.94 C ATOM 189 NZ LYS A 7 -20.255 10.115 -5.360 1.00 1.72 N ATOM 0 H LYS A 7 -17.784 6.289 -1.882 1.00 0.29 H new ATOM 0 HA LYS A 7 -18.405 5.176 -4.468 1.00 0.31 H new ATOM 0 HB2 LYS A 7 -16.870 7.516 -3.401 1.00 0.39 H new ATOM 0 HB3 LYS A 7 -16.487 6.947 -5.014 1.00 0.39 H new ATOM 0 HG2 LYS A 7 -18.982 7.131 -5.543 1.00 0.52 H new ATOM 0 HG3 LYS A 7 -19.163 7.956 -4.008 1.00 0.52 H new ATOM 0 HD2 LYS A 7 -17.654 9.727 -4.685 1.00 0.63 H new ATOM 0 HD3 LYS A 7 -17.166 8.846 -6.119 1.00 0.63 H new ATOM 0 HE2 LYS A 7 -18.743 10.562 -6.772 1.00 0.94 H new ATOM 0 HE3 LYS A 7 -19.501 8.997 -6.991 1.00 0.94 H new ATOM 0 HZ1 LYS A 7 -20.985 10.586 -5.932 1.00 1.72 H new ATOM 0 HZ2 LYS A 7 -20.665 9.279 -4.896 1.00 1.72 H new ATOM 0 HZ3 LYS A 7 -19.902 10.774 -4.637 1.00 1.72 H new ATOM 203 N ILE A 8 -16.517 3.585 -4.721 1.00 0.28 N ATOM 204 CA ILE A 8 -15.412 2.679 -4.952 1.00 0.28 C ATOM 205 C ILE A 8 -14.687 3.075 -6.225 1.00 0.31 C ATOM 206 O ILE A 8 -15.138 2.774 -7.328 1.00 0.34 O ATOM 207 CB ILE A 8 -15.879 1.215 -5.073 1.00 0.33 C ATOM 208 CG1 ILE A 8 -16.660 0.786 -3.826 1.00 0.58 C ATOM 209 CG2 ILE A 8 -14.683 0.303 -5.297 1.00 0.32 C ATOM 210 CD1 ILE A 8 -15.876 0.910 -2.536 1.00 0.51 C ATOM 0 H ILE A 8 -17.394 3.304 -5.161 1.00 0.28 H new ATOM 0 HA ILE A 8 -14.745 2.750 -4.093 1.00 0.28 H new ATOM 0 HB ILE A 8 -16.547 1.134 -5.931 1.00 0.33 H new ATOM 0 HG12 ILE A 8 -17.564 1.391 -3.750 1.00 0.58 H new ATOM 0 HG13 ILE A 8 -16.979 -0.249 -3.948 1.00 0.58 H new ATOM 0 HG21 ILE A 8 -15.023 -0.729 -5.381 1.00 0.32 H new ATOM 0 HG22 ILE A 8 -14.172 0.593 -6.215 1.00 0.32 H new ATOM 0 HG23 ILE A 8 -13.996 0.391 -4.456 1.00 0.32 H new ATOM 0 HD11 ILE A 8 -16.497 0.588 -1.700 1.00 0.51 H new ATOM 0 HD12 ILE A 8 -14.986 0.283 -2.590 1.00 0.51 H new ATOM 0 HD13 ILE A 8 -15.580 1.949 -2.389 1.00 0.51 H new ATOM 222 N SER A 9 -13.583 3.771 -6.076 1.00 0.33 N ATOM 223 CA SER A 9 -12.817 4.202 -7.225 1.00 0.39 C ATOM 224 C SER A 9 -11.624 3.278 -7.418 1.00 0.37 C ATOM 225 O SER A 9 -10.927 2.939 -6.466 1.00 0.45 O ATOM 226 CB SER A 9 -12.379 5.656 -7.051 1.00 0.46 C ATOM 227 OG SER A 9 -13.495 6.483 -6.765 1.00 1.48 O ATOM 0 H SER A 9 -13.196 4.050 -5.175 1.00 0.33 H new ATOM 0 HA SER A 9 -13.437 4.149 -8.120 1.00 0.39 H new ATOM 0 HB2 SER A 9 -11.650 5.728 -6.244 1.00 0.46 H new ATOM 0 HB3 SER A 9 -11.885 6.004 -7.958 1.00 0.46 H new ATOM 0 HG SER A 9 -13.196 7.410 -6.655 1.00 1.48 H new ATOM 233 N ILE A 10 -11.423 2.833 -8.642 1.00 0.40 N ATOM 234 CA ILE A 10 -10.354 1.906 -8.955 1.00 0.42 C ATOM 235 C ILE A 10 -9.530 2.450 -10.116 1.00 0.50 C ATOM 236 O ILE A 10 -9.839 2.208 -11.283 1.00 0.53 O ATOM 237 CB ILE A 10 -10.919 0.506 -9.303 1.00 0.40 C ATOM 238 CG1 ILE A 10 -11.882 0.039 -8.202 1.00 0.38 C ATOM 239 CG2 ILE A 10 -9.786 -0.495 -9.487 1.00 0.45 C ATOM 240 CD1 ILE A 10 -12.675 -1.204 -8.552 1.00 0.43 C ATOM 0 H ILE A 10 -11.993 3.102 -9.444 1.00 0.40 H new ATOM 0 HA ILE A 10 -9.715 1.800 -8.078 1.00 0.42 H new ATOM 0 HB ILE A 10 -11.469 0.572 -10.241 1.00 0.40 H new ATOM 0 HG12 ILE A 10 -11.311 -0.153 -7.294 1.00 0.38 H new ATOM 0 HG13 ILE A 10 -12.577 0.848 -7.977 1.00 0.38 H new ATOM 0 HG21 ILE A 10 -10.201 -1.473 -9.731 1.00 0.45 H new ATOM 0 HG22 ILE A 10 -9.136 -0.164 -10.297 1.00 0.45 H new ATOM 0 HG23 ILE A 10 -9.209 -0.565 -8.565 1.00 0.45 H new ATOM 0 HD11 ILE A 10 -13.329 -1.464 -7.720 1.00 0.43 H new ATOM 0 HD12 ILE A 10 -13.276 -1.014 -9.441 1.00 0.43 H new ATOM 0 HD13 ILE A 10 -11.990 -2.029 -8.747 1.00 0.43 H new ATOM 252 N GLY A 11 -8.512 3.233 -9.788 1.00 0.59 N ATOM 253 CA GLY A 11 -7.709 3.873 -10.813 1.00 0.68 C ATOM 254 C GLY A 11 -8.415 5.078 -11.401 1.00 0.75 C ATOM 255 O GLY A 11 -8.279 6.195 -10.896 1.00 0.96 O ATOM 0 H GLY A 11 -8.227 3.437 -8.830 1.00 0.59 H new ATOM 0 HA2 GLY A 11 -6.754 4.181 -10.388 1.00 0.68 H new ATOM 0 HA3 GLY A 11 -7.490 3.157 -11.605 1.00 0.68 H new ATOM 259 N ASN A 12 -9.178 4.850 -12.462 1.00 0.75 N ATOM 260 CA ASN A 12 -9.962 5.911 -13.086 1.00 0.90 C ATOM 261 C ASN A 12 -11.455 5.633 -12.936 1.00 0.84 C ATOM 262 O ASN A 12 -12.267 6.557 -12.856 1.00 1.09 O ATOM 263 CB ASN A 12 -9.606 6.067 -14.573 1.00 1.09 C ATOM 264 CG ASN A 12 -9.976 4.855 -15.417 1.00 1.77 C ATOM 265 OD1 ASN A 12 -9.905 3.712 -14.962 1.00 2.62 O ATOM 266 ND2 ASN A 12 -10.391 5.101 -16.650 1.00 2.17 N ATOM 0 H ASN A 12 -9.272 3.939 -12.910 1.00 0.75 H new ATOM 0 HA ASN A 12 -9.720 6.844 -12.576 1.00 0.90 H new ATOM 0 HB2 ASN A 12 -10.115 6.945 -14.970 1.00 1.09 H new ATOM 0 HB3 ASN A 12 -8.535 6.250 -14.665 1.00 1.09 H new ATOM 0 HD21 ASN A 12 -10.666 4.330 -17.259 1.00 2.17 H new ATOM 0 HD22 ASN A 12 -10.436 6.061 -16.991 1.00 2.17 H new ATOM 273 N VAL A 13 -11.811 4.354 -12.888 1.00 0.65 N ATOM 274 CA VAL A 13 -13.202 3.947 -12.769 1.00 0.61 C ATOM 275 C VAL A 13 -13.695 4.190 -11.345 1.00 0.53 C ATOM 276 O VAL A 13 -12.908 4.174 -10.401 1.00 0.50 O ATOM 277 CB VAL A 13 -13.380 2.451 -13.145 1.00 0.61 C ATOM 278 CG1 VAL A 13 -12.775 1.542 -12.089 1.00 0.55 C ATOM 279 CG2 VAL A 13 -14.843 2.100 -13.375 1.00 0.65 C ATOM 0 H VAL A 13 -11.149 3.579 -12.930 1.00 0.65 H new ATOM 0 HA VAL A 13 -13.793 4.545 -13.463 1.00 0.61 H new ATOM 0 HB VAL A 13 -12.846 2.291 -14.082 1.00 0.61 H new ATOM 0 HG11 VAL A 13 -12.916 0.501 -12.381 1.00 0.55 H new ATOM 0 HG12 VAL A 13 -11.709 1.752 -11.995 1.00 0.55 H new ATOM 0 HG13 VAL A 13 -13.265 1.720 -11.132 1.00 0.55 H new ATOM 0 HG21 VAL A 13 -14.927 1.045 -13.636 1.00 0.65 H new ATOM 0 HG22 VAL A 13 -15.411 2.295 -12.466 1.00 0.65 H new ATOM 0 HG23 VAL A 13 -15.239 2.708 -14.188 1.00 0.65 H new ATOM 289 N VAL A 14 -14.983 4.436 -11.195 1.00 0.51 N ATOM 290 CA VAL A 14 -15.575 4.601 -9.879 1.00 0.46 C ATOM 291 C VAL A 14 -16.992 4.048 -9.866 1.00 0.41 C ATOM 292 O VAL A 14 -17.836 4.416 -10.685 1.00 0.45 O ATOM 293 CB VAL A 14 -15.548 6.075 -9.395 1.00 0.53 C ATOM 294 CG1 VAL A 14 -15.989 7.022 -10.491 1.00 0.62 C ATOM 295 CG2 VAL A 14 -16.410 6.267 -8.151 1.00 0.50 C ATOM 0 H VAL A 14 -15.641 4.526 -11.969 1.00 0.51 H new ATOM 0 HA VAL A 14 -14.966 4.033 -9.175 1.00 0.46 H new ATOM 0 HB VAL A 14 -14.516 6.310 -9.135 1.00 0.53 H new ATOM 0 HG11 VAL A 14 -15.959 8.047 -10.120 1.00 0.62 H new ATOM 0 HG12 VAL A 14 -15.320 6.926 -11.346 1.00 0.62 H new ATOM 0 HG13 VAL A 14 -17.006 6.776 -10.797 1.00 0.62 H new ATOM 0 HG21 VAL A 14 -16.369 7.310 -7.838 1.00 0.50 H new ATOM 0 HG22 VAL A 14 -17.441 5.996 -8.377 1.00 0.50 H new ATOM 0 HG23 VAL A 14 -16.036 5.632 -7.348 1.00 0.50 H new ATOM 305 N LYS A 15 -17.232 3.145 -8.940 1.00 0.39 N ATOM 306 CA LYS A 15 -18.506 2.469 -8.825 1.00 0.41 C ATOM 307 C LYS A 15 -19.112 2.757 -7.467 1.00 0.35 C ATOM 308 O LYS A 15 -18.397 2.933 -6.485 1.00 0.31 O ATOM 309 CB LYS A 15 -18.343 0.964 -9.034 1.00 0.50 C ATOM 310 CG LYS A 15 -17.892 0.586 -10.437 1.00 0.67 C ATOM 311 CD LYS A 15 -18.857 1.110 -11.489 1.00 0.80 C ATOM 312 CE LYS A 15 -18.414 0.731 -12.892 1.00 1.02 C ATOM 313 NZ LYS A 15 -19.284 1.339 -13.934 1.00 1.28 N ATOM 0 H LYS A 15 -16.546 2.858 -8.242 1.00 0.39 H new ATOM 0 HA LYS A 15 -19.175 2.842 -9.600 1.00 0.41 H new ATOM 0 HB2 LYS A 15 -17.619 0.583 -8.314 1.00 0.50 H new ATOM 0 HB3 LYS A 15 -19.292 0.472 -8.822 1.00 0.50 H new ATOM 0 HG2 LYS A 15 -16.896 0.989 -10.622 1.00 0.67 H new ATOM 0 HG3 LYS A 15 -17.817 -0.498 -10.517 1.00 0.67 H new ATOM 0 HD2 LYS A 15 -19.853 0.710 -11.301 1.00 0.80 H new ATOM 0 HD3 LYS A 15 -18.929 2.195 -11.410 1.00 0.80 H new ATOM 0 HE2 LYS A 15 -17.384 1.053 -13.046 1.00 1.02 H new ATOM 0 HE3 LYS A 15 -18.428 -0.354 -12.996 1.00 1.02 H new ATOM 0 HZ1 LYS A 15 -18.947 1.055 -14.876 1.00 1.28 H new ATOM 0 HZ2 LYS A 15 -20.263 1.012 -13.803 1.00 1.28 H new ATOM 0 HZ3 LYS A 15 -19.251 2.375 -13.852 1.00 1.28 H new ATOM 327 N THR A 16 -20.420 2.819 -7.415 1.00 0.38 N ATOM 328 CA THR A 16 -21.106 3.183 -6.195 1.00 0.37 C ATOM 329 C THR A 16 -21.593 1.928 -5.487 1.00 0.35 C ATOM 330 O THR A 16 -22.406 1.177 -6.028 1.00 0.39 O ATOM 331 CB THR A 16 -22.303 4.109 -6.485 1.00 0.45 C ATOM 332 OG1 THR A 16 -21.895 5.170 -7.361 1.00 0.50 O ATOM 333 CG2 THR A 16 -22.858 4.700 -5.196 1.00 0.45 C ATOM 0 H THR A 16 -21.034 2.622 -8.205 1.00 0.38 H new ATOM 0 HA THR A 16 -20.404 3.719 -5.557 1.00 0.37 H new ATOM 0 HB THR A 16 -23.085 3.518 -6.961 1.00 0.45 H new ATOM 0 HG1 THR A 16 -22.659 5.755 -7.544 1.00 0.50 H new ATOM 0 HG21 THR A 16 -23.702 5.350 -5.427 1.00 0.45 H new ATOM 0 HG22 THR A 16 -23.189 3.895 -4.540 1.00 0.45 H new ATOM 0 HG23 THR A 16 -22.081 5.279 -4.697 1.00 0.45 H new ATOM 341 N MET A 17 -21.083 1.691 -4.290 1.00 0.31 N ATOM 342 CA MET A 17 -21.433 0.499 -3.541 1.00 0.32 C ATOM 343 C MET A 17 -21.809 0.866 -2.121 1.00 0.32 C ATOM 344 O MET A 17 -21.315 1.850 -1.570 1.00 0.31 O ATOM 345 CB MET A 17 -20.288 -0.512 -3.514 1.00 0.34 C ATOM 346 CG MET A 17 -20.168 -1.349 -4.775 1.00 0.44 C ATOM 347 SD MET A 17 -19.134 -2.806 -4.529 1.00 1.04 S ATOM 348 CE MET A 17 -20.006 -3.592 -3.177 1.00 0.40 C ATOM 0 H MET A 17 -20.425 2.310 -3.817 1.00 0.31 H new ATOM 0 HA MET A 17 -22.283 0.038 -4.044 1.00 0.32 H new ATOM 0 HB2 MET A 17 -19.351 0.021 -3.355 1.00 0.34 H new ATOM 0 HB3 MET A 17 -20.425 -1.177 -2.661 1.00 0.34 H new ATOM 0 HG2 MET A 17 -21.161 -1.661 -5.098 1.00 0.44 H new ATOM 0 HG3 MET A 17 -19.749 -0.739 -5.575 1.00 0.44 H new ATOM 0 HE1 MET A 17 -19.465 -4.485 -2.865 1.00 0.40 H new ATOM 0 HE2 MET A 17 -20.077 -2.899 -2.338 1.00 0.40 H new ATOM 0 HE3 MET A 17 -21.008 -3.871 -3.503 1.00 0.40 H new ATOM 358 N GLN A 18 -22.694 0.088 -1.539 1.00 0.36 N ATOM 359 CA GLN A 18 -23.054 0.268 -0.150 1.00 0.37 C ATOM 360 C GLN A 18 -22.671 -0.953 0.660 1.00 0.35 C ATOM 361 O GLN A 18 -22.802 -2.087 0.196 1.00 0.38 O ATOM 362 CB GLN A 18 -24.542 0.577 -0.017 1.00 0.44 C ATOM 363 CG GLN A 18 -24.845 2.046 -0.219 1.00 0.49 C ATOM 364 CD GLN A 18 -26.278 2.309 -0.617 1.00 0.59 C ATOM 365 OE1 GLN A 18 -27.165 2.436 0.227 1.00 0.92 O ATOM 366 NE2 GLN A 18 -26.507 2.413 -1.913 1.00 0.60 N ATOM 0 H GLN A 18 -23.179 -0.677 -2.007 1.00 0.36 H new ATOM 0 HA GLN A 18 -22.500 1.119 0.246 1.00 0.37 H new ATOM 0 HB2 GLN A 18 -25.099 -0.010 -0.747 1.00 0.44 H new ATOM 0 HB3 GLN A 18 -24.888 0.270 0.970 1.00 0.44 H new ATOM 0 HG2 GLN A 18 -24.626 2.586 0.702 1.00 0.49 H new ATOM 0 HG3 GLN A 18 -24.182 2.445 -0.987 1.00 0.49 H new ATOM 0 HE21 GLN A 18 -25.741 2.300 -2.577 1.00 0.60 H new ATOM 0 HE22 GLN A 18 -27.450 2.606 -2.250 1.00 0.60 H new ATOM 375 N PHE A 19 -22.187 -0.715 1.863 1.00 0.34 N ATOM 376 CA PHE A 19 -21.749 -1.776 2.746 1.00 0.33 C ATOM 377 C PHE A 19 -22.380 -1.540 4.099 1.00 0.37 C ATOM 378 O PHE A 19 -22.788 -0.421 4.398 1.00 0.40 O ATOM 379 CB PHE A 19 -20.225 -1.773 2.907 1.00 0.29 C ATOM 380 CG PHE A 19 -19.453 -1.851 1.622 1.00 0.27 C ATOM 381 CD1 PHE A 19 -19.162 -3.076 1.047 1.00 0.33 C ATOM 382 CD2 PHE A 19 -19.035 -0.699 0.981 1.00 0.30 C ATOM 383 CE1 PHE A 19 -18.465 -3.153 -0.142 1.00 0.36 C ATOM 384 CE2 PHE A 19 -18.339 -0.767 -0.211 1.00 0.31 C ATOM 385 CZ PHE A 19 -17.996 -1.991 -0.739 1.00 0.31 C ATOM 0 H PHE A 19 -22.087 0.221 2.256 1.00 0.34 H new ATOM 0 HA PHE A 19 -22.045 -2.737 2.325 1.00 0.33 H new ATOM 0 HB2 PHE A 19 -19.932 -0.866 3.435 1.00 0.29 H new ATOM 0 HB3 PHE A 19 -19.939 -2.615 3.537 1.00 0.29 H new ATOM 0 HD1 PHE A 19 -19.485 -3.984 1.535 1.00 0.33 H new ATOM 0 HD2 PHE A 19 -19.255 0.264 1.417 1.00 0.30 H new ATOM 0 HE1 PHE A 19 -18.286 -4.112 -0.605 1.00 0.36 H new ATOM 0 HE2 PHE A 19 -18.064 0.140 -0.728 1.00 0.31 H new ATOM 0 HZ PHE A 19 -17.365 -2.047 -1.614 1.00 0.31 H new ATOM 395 N GLU A 20 -22.465 -2.565 4.913 1.00 0.39 N ATOM 396 CA GLU A 20 -22.966 -2.387 6.261 1.00 0.43 C ATOM 397 C GLU A 20 -21.841 -1.871 7.151 1.00 0.44 C ATOM 398 O GLU A 20 -20.673 -2.212 6.950 1.00 0.47 O ATOM 399 CB GLU A 20 -23.529 -3.690 6.833 1.00 0.50 C ATOM 400 CG GLU A 20 -24.720 -4.243 6.070 1.00 0.61 C ATOM 401 CD GLU A 20 -25.387 -5.388 6.804 1.00 0.90 C ATOM 402 OE1 GLU A 20 -24.791 -6.483 6.875 1.00 1.06 O ATOM 403 OE2 GLU A 20 -26.521 -5.207 7.296 1.00 1.42 O ATOM 0 H GLU A 20 -22.199 -3.520 4.673 1.00 0.39 H new ATOM 0 HA GLU A 20 -23.781 -1.663 6.230 1.00 0.43 H new ATOM 0 HB2 GLU A 20 -22.738 -4.440 6.843 1.00 0.50 H new ATOM 0 HB3 GLU A 20 -23.822 -3.522 7.869 1.00 0.50 H new ATOM 0 HG2 GLU A 20 -25.446 -3.447 5.906 1.00 0.61 H new ATOM 0 HG3 GLU A 20 -24.394 -4.584 5.088 1.00 0.61 H new ATOM 410 N PRO A 21 -22.174 -1.027 8.132 1.00 0.50 N ATOM 411 CA PRO A 21 -21.212 -0.520 9.109 1.00 0.53 C ATOM 412 C PRO A 21 -20.453 -1.656 9.794 1.00 0.53 C ATOM 413 O PRO A 21 -19.299 -1.498 10.201 1.00 0.65 O ATOM 414 CB PRO A 21 -22.082 0.252 10.122 1.00 0.57 C ATOM 415 CG PRO A 21 -23.504 -0.077 9.784 1.00 0.61 C ATOM 416 CD PRO A 21 -23.513 -0.480 8.345 1.00 0.62 C ATOM 0 HA PRO A 21 -20.446 0.103 8.648 1.00 0.53 H new ATOM 0 HB2 PRO A 21 -21.846 -0.044 11.144 1.00 0.57 H new ATOM 0 HB3 PRO A 21 -21.903 1.325 10.052 1.00 0.57 H new ATOM 0 HG2 PRO A 21 -23.877 -0.883 10.416 1.00 0.61 H new ATOM 0 HG3 PRO A 21 -24.152 0.784 9.950 1.00 0.61 H new ATOM 0 HD2 PRO A 21 -24.286 -1.221 8.141 1.00 0.62 H new ATOM 0 HD3 PRO A 21 -23.707 0.371 7.692 1.00 0.62 H new ATOM 424 N SER A 22 -21.098 -2.812 9.868 1.00 0.50 N ATOM 425 CA SER A 22 -20.533 -3.982 10.516 1.00 0.61 C ATOM 426 C SER A 22 -20.020 -5.012 9.498 1.00 0.84 C ATOM 427 O SER A 22 -19.669 -6.132 9.869 1.00 1.64 O ATOM 428 CB SER A 22 -21.600 -4.600 11.414 1.00 0.68 C ATOM 429 OG SER A 22 -22.856 -4.623 10.753 1.00 1.32 O ATOM 0 H SER A 22 -22.029 -2.963 9.479 1.00 0.50 H new ATOM 0 HA SER A 22 -19.672 -3.674 11.109 1.00 0.61 H new ATOM 0 HB2 SER A 22 -21.309 -5.614 11.689 1.00 0.68 H new ATOM 0 HB3 SER A 22 -21.680 -4.029 12.339 1.00 0.68 H new ATOM 0 HG SER A 22 -23.529 -5.024 11.342 1.00 1.32 H new ATOM 435 N THR A 23 -19.969 -4.630 8.221 1.00 0.41 N ATOM 436 CA THR A 23 -19.498 -5.528 7.167 1.00 0.49 C ATOM 437 C THR A 23 -18.061 -5.982 7.414 1.00 0.63 C ATOM 438 O THR A 23 -17.774 -7.179 7.363 1.00 1.47 O ATOM 439 CB THR A 23 -19.602 -4.853 5.783 1.00 0.51 C ATOM 440 OG1 THR A 23 -20.972 -4.784 5.382 1.00 0.68 O ATOM 441 CG2 THR A 23 -18.804 -5.597 4.728 1.00 0.50 C ATOM 0 H THR A 23 -20.248 -3.706 7.892 1.00 0.41 H new ATOM 0 HA THR A 23 -20.141 -6.408 7.184 1.00 0.49 H new ATOM 0 HB THR A 23 -19.185 -3.850 5.873 1.00 0.51 H new ATOM 0 HG1 THR A 23 -21.043 -4.980 4.424 1.00 0.68 H new ATOM 0 HG21 THR A 23 -18.905 -5.088 3.769 1.00 0.50 H new ATOM 0 HG22 THR A 23 -17.753 -5.622 5.017 1.00 0.50 H new ATOM 0 HG23 THR A 23 -19.180 -6.616 4.639 1.00 0.50 H new ATOM 449 N MET A 24 -17.179 -5.018 7.697 1.00 0.54 N ATOM 450 CA MET A 24 -15.755 -5.275 7.939 1.00 0.48 C ATOM 451 C MET A 24 -15.008 -5.453 6.614 1.00 0.43 C ATOM 452 O MET A 24 -15.498 -6.102 5.693 1.00 0.47 O ATOM 453 CB MET A 24 -15.565 -6.494 8.855 1.00 0.60 C ATOM 454 CG MET A 24 -14.392 -6.393 9.804 1.00 0.57 C ATOM 455 SD MET A 24 -14.496 -7.606 11.131 1.00 0.83 S ATOM 456 CE MET A 24 -13.343 -6.906 12.299 1.00 0.71 C ATOM 0 H MET A 24 -17.434 -4.033 7.765 1.00 0.54 H new ATOM 0 HA MET A 24 -15.332 -4.410 8.450 1.00 0.48 H new ATOM 0 HB2 MET A 24 -16.475 -6.639 9.437 1.00 0.60 H new ATOM 0 HB3 MET A 24 -15.438 -7.381 8.235 1.00 0.60 H new ATOM 0 HG2 MET A 24 -13.464 -6.538 9.251 1.00 0.57 H new ATOM 0 HG3 MET A 24 -14.355 -5.391 10.230 1.00 0.57 H new ATOM 0 HE1 MET A 24 -13.250 -7.568 13.160 1.00 0.71 H new ATOM 0 HE2 MET A 24 -12.369 -6.790 11.824 1.00 0.71 H new ATOM 0 HE3 MET A 24 -13.705 -5.932 12.628 1.00 0.71 H new ATOM 466 N VAL A 25 -13.835 -4.829 6.539 1.00 0.40 N ATOM 467 CA VAL A 25 -13.006 -4.792 5.323 1.00 0.38 C ATOM 468 C VAL A 25 -12.980 -6.117 4.545 1.00 0.39 C ATOM 469 O VAL A 25 -13.283 -6.138 3.351 1.00 0.39 O ATOM 470 CB VAL A 25 -11.566 -4.363 5.671 1.00 0.41 C ATOM 471 CG1 VAL A 25 -10.620 -4.558 4.493 1.00 0.42 C ATOM 472 CG2 VAL A 25 -11.559 -2.912 6.122 1.00 0.40 C ATOM 0 H VAL A 25 -13.423 -4.327 7.326 1.00 0.40 H new ATOM 0 HA VAL A 25 -13.473 -4.058 4.666 1.00 0.38 H new ATOM 0 HB VAL A 25 -11.210 -4.997 6.483 1.00 0.41 H new ATOM 0 HG11 VAL A 25 -9.615 -4.245 4.777 1.00 0.42 H new ATOM 0 HG12 VAL A 25 -10.605 -5.610 4.209 1.00 0.42 H new ATOM 0 HG13 VAL A 25 -10.962 -3.959 3.649 1.00 0.42 H new ATOM 0 HG21 VAL A 25 -10.540 -2.612 6.367 1.00 0.40 H new ATOM 0 HG22 VAL A 25 -11.940 -2.280 5.320 1.00 0.40 H new ATOM 0 HG23 VAL A 25 -12.192 -2.802 7.003 1.00 0.40 H new ATOM 482 N TYR A 26 -12.621 -7.211 5.213 1.00 0.42 N ATOM 483 CA TYR A 26 -12.478 -8.500 4.529 1.00 0.45 C ATOM 484 C TYR A 26 -13.782 -8.938 3.848 1.00 0.43 C ATOM 485 O TYR A 26 -13.754 -9.578 2.795 1.00 0.42 O ATOM 486 CB TYR A 26 -11.969 -9.597 5.479 1.00 0.52 C ATOM 487 CG TYR A 26 -12.902 -9.951 6.616 1.00 0.56 C ATOM 488 CD1 TYR A 26 -13.944 -10.853 6.433 1.00 0.70 C ATOM 489 CD2 TYR A 26 -12.728 -9.400 7.875 1.00 0.58 C ATOM 490 CE1 TYR A 26 -14.786 -11.191 7.471 1.00 0.78 C ATOM 491 CE2 TYR A 26 -13.567 -9.734 8.919 1.00 0.65 C ATOM 492 CZ TYR A 26 -14.593 -10.628 8.713 1.00 0.72 C ATOM 493 OH TYR A 26 -15.429 -10.965 9.754 1.00 0.83 O ATOM 0 H TYR A 26 -12.425 -7.235 6.214 1.00 0.42 H new ATOM 0 HA TYR A 26 -11.729 -8.355 3.750 1.00 0.45 H new ATOM 0 HB2 TYR A 26 -11.774 -10.498 4.897 1.00 0.52 H new ATOM 0 HB3 TYR A 26 -11.016 -9.277 5.899 1.00 0.52 H new ATOM 0 HD1 TYR A 26 -14.097 -11.297 5.460 1.00 0.70 H new ATOM 0 HD2 TYR A 26 -11.924 -8.699 8.042 1.00 0.58 H new ATOM 0 HE1 TYR A 26 -15.591 -11.893 7.311 1.00 0.78 H new ATOM 0 HE2 TYR A 26 -13.419 -9.295 9.895 1.00 0.65 H new ATOM 0 HH TYR A 26 -15.157 -10.482 10.562 1.00 0.83 H new ATOM 503 N ASP A 27 -14.916 -8.575 4.436 1.00 0.43 N ATOM 504 CA ASP A 27 -16.215 -8.950 3.880 1.00 0.44 C ATOM 505 C ASP A 27 -16.549 -8.058 2.690 1.00 0.39 C ATOM 506 O ASP A 27 -17.083 -8.513 1.684 1.00 0.40 O ATOM 507 CB ASP A 27 -17.309 -8.859 4.945 1.00 0.50 C ATOM 508 CG ASP A 27 -18.661 -9.343 4.451 1.00 0.91 C ATOM 509 OD1 ASP A 27 -19.410 -8.540 3.866 1.00 1.48 O ATOM 510 OD2 ASP A 27 -18.990 -10.528 4.665 1.00 1.24 O ATOM 0 H ASP A 27 -14.965 -8.024 5.293 1.00 0.43 H new ATOM 0 HA ASP A 27 -16.162 -9.984 3.540 1.00 0.44 H new ATOM 0 HB2 ASP A 27 -17.013 -9.449 5.813 1.00 0.50 H new ATOM 0 HB3 ASP A 27 -17.399 -7.825 5.278 1.00 0.50 H new ATOM 515 N ALA A 28 -16.212 -6.781 2.800 1.00 0.37 N ATOM 516 CA ALA A 28 -16.392 -5.849 1.694 1.00 0.33 C ATOM 517 C ALA A 28 -15.661 -6.347 0.450 1.00 0.32 C ATOM 518 O ALA A 28 -16.205 -6.327 -0.656 1.00 0.31 O ATOM 519 CB ALA A 28 -15.896 -4.463 2.084 1.00 0.33 C ATOM 0 H ALA A 28 -15.813 -6.366 3.642 1.00 0.37 H new ATOM 0 HA ALA A 28 -17.456 -5.785 1.465 1.00 0.33 H new ATOM 0 HB1 ALA A 28 -16.037 -3.778 1.248 1.00 0.33 H new ATOM 0 HB2 ALA A 28 -16.459 -4.104 2.946 1.00 0.33 H new ATOM 0 HB3 ALA A 28 -14.837 -4.513 2.337 1.00 0.33 H new ATOM 525 N CYS A 29 -14.432 -6.810 0.656 1.00 0.35 N ATOM 526 CA CYS A 29 -13.598 -7.331 -0.422 1.00 0.37 C ATOM 527 C CYS A 29 -14.267 -8.489 -1.175 1.00 0.38 C ATOM 528 O CYS A 29 -14.077 -8.632 -2.384 1.00 0.40 O ATOM 529 CB CYS A 29 -12.245 -7.784 0.138 1.00 0.45 C ATOM 530 SG CYS A 29 -11.111 -8.461 -1.102 1.00 1.37 S ATOM 0 H CYS A 29 -13.987 -6.835 1.573 1.00 0.35 H new ATOM 0 HA CYS A 29 -13.452 -6.522 -1.138 1.00 0.37 H new ATOM 0 HB2 CYS A 29 -11.765 -6.936 0.627 1.00 0.45 H new ATOM 0 HB3 CYS A 29 -12.417 -8.539 0.906 1.00 0.45 H new ATOM 0 HG CYS A 29 -9.999 -8.811 -0.527 1.00 1.37 H new ATOM 536 N ARG A 30 -15.053 -9.307 -0.479 1.00 0.40 N ATOM 537 CA ARG A 30 -15.660 -10.475 -1.122 1.00 0.44 C ATOM 538 C ARG A 30 -16.831 -10.052 -2.008 1.00 0.42 C ATOM 539 O ARG A 30 -17.025 -10.590 -3.100 1.00 0.45 O ATOM 540 CB ARG A 30 -16.105 -11.526 -0.088 1.00 0.49 C ATOM 541 CG ARG A 30 -17.352 -11.158 0.710 1.00 0.53 C ATOM 542 CD ARG A 30 -17.721 -12.231 1.729 1.00 0.71 C ATOM 543 NE ARG A 30 -16.635 -12.514 2.672 1.00 1.12 N ATOM 544 CZ ARG A 30 -16.812 -13.042 3.884 1.00 1.68 C ATOM 545 NH1 ARG A 30 -18.029 -13.321 4.330 1.00 1.94 N ATOM 546 NH2 ARG A 30 -15.755 -13.284 4.648 1.00 2.41 N ATOM 0 H ARG A 30 -15.282 -9.190 0.508 1.00 0.40 H new ATOM 0 HA ARG A 30 -14.900 -10.939 -1.751 1.00 0.44 H new ATOM 0 HB2 ARG A 30 -16.288 -12.468 -0.605 1.00 0.49 H new ATOM 0 HB3 ARG A 30 -15.284 -11.699 0.608 1.00 0.49 H new ATOM 0 HG2 ARG A 30 -17.186 -10.212 1.225 1.00 0.53 H new ATOM 0 HG3 ARG A 30 -18.187 -11.006 0.026 1.00 0.53 H new ATOM 0 HD2 ARG A 30 -18.604 -11.912 2.283 1.00 0.71 H new ATOM 0 HD3 ARG A 30 -17.989 -13.148 1.204 1.00 0.71 H new ATOM 0 HE ARG A 30 -15.682 -12.293 2.383 1.00 1.12 H new ATOM 0 HH11 ARG A 30 -18.843 -13.132 3.744 1.00 1.94 H new ATOM 0 HH12 ARG A 30 -18.152 -13.725 5.259 1.00 1.94 H new ATOM 0 HH21 ARG A 30 -14.819 -13.066 4.307 1.00 2.41 H new ATOM 0 HH22 ARG A 30 -15.879 -13.688 5.577 1.00 2.41 H new ATOM 560 N MET A 31 -17.588 -9.064 -1.547 1.00 0.39 N ATOM 561 CA MET A 31 -18.759 -8.592 -2.267 1.00 0.40 C ATOM 562 C MET A 31 -18.385 -7.740 -3.472 1.00 0.38 C ATOM 563 O MET A 31 -18.962 -7.903 -4.545 1.00 0.44 O ATOM 564 CB MET A 31 -19.650 -7.789 -1.333 1.00 0.39 C ATOM 565 CG MET A 31 -20.122 -8.581 -0.134 1.00 0.43 C ATOM 566 SD MET A 31 -21.124 -7.589 0.978 1.00 0.45 S ATOM 567 CE MET A 31 -19.884 -6.412 1.501 1.00 0.39 C ATOM 0 H MET A 31 -17.408 -8.573 -0.671 1.00 0.39 H new ATOM 0 HA MET A 31 -19.294 -9.469 -2.633 1.00 0.40 H new ATOM 0 HB2 MET A 31 -19.106 -6.910 -0.988 1.00 0.39 H new ATOM 0 HB3 MET A 31 -20.517 -7.430 -1.888 1.00 0.39 H new ATOM 0 HG2 MET A 31 -20.700 -9.441 -0.473 1.00 0.43 H new ATOM 0 HG3 MET A 31 -19.259 -8.970 0.406 1.00 0.43 H new ATOM 0 HE1 MET A 31 -20.296 -5.773 2.282 1.00 0.39 H new ATOM 0 HE2 MET A 31 -19.016 -6.946 1.889 1.00 0.39 H new ATOM 0 HE3 MET A 31 -19.583 -5.799 0.652 1.00 0.39 H new ATOM 577 N ILE A 32 -17.429 -6.832 -3.294 1.00 0.34 N ATOM 578 CA ILE A 32 -17.027 -5.927 -4.369 1.00 0.33 C ATOM 579 C ILE A 32 -16.548 -6.707 -5.597 1.00 0.36 C ATOM 580 O ILE A 32 -16.976 -6.434 -6.717 1.00 0.40 O ATOM 581 CB ILE A 32 -15.943 -4.924 -3.900 1.00 0.30 C ATOM 582 CG1 ILE A 32 -15.576 -3.979 -5.043 1.00 0.40 C ATOM 583 CG2 ILE A 32 -14.704 -5.636 -3.373 1.00 0.30 C ATOM 584 CD1 ILE A 32 -14.528 -2.965 -4.666 1.00 0.48 C ATOM 0 H ILE A 32 -16.920 -6.703 -2.420 1.00 0.34 H new ATOM 0 HA ILE A 32 -17.909 -5.352 -4.652 1.00 0.33 H new ATOM 0 HB ILE A 32 -16.357 -4.344 -3.076 1.00 0.30 H new ATOM 0 HG12 ILE A 32 -15.216 -4.565 -5.888 1.00 0.40 H new ATOM 0 HG13 ILE A 32 -16.473 -3.457 -5.376 1.00 0.40 H new ATOM 0 HG21 ILE A 32 -13.968 -4.898 -3.054 1.00 0.30 H new ATOM 0 HG22 ILE A 32 -14.978 -6.264 -2.526 1.00 0.30 H new ATOM 0 HG23 ILE A 32 -14.278 -6.256 -4.162 1.00 0.30 H new ATOM 0 HD11 ILE A 32 -14.315 -2.326 -5.523 1.00 0.48 H new ATOM 0 HD12 ILE A 32 -14.893 -2.354 -3.840 1.00 0.48 H new ATOM 0 HD13 ILE A 32 -13.617 -3.480 -4.361 1.00 0.48 H new ATOM 596 N ARG A 33 -15.689 -7.694 -5.367 1.00 0.36 N ATOM 597 CA ARG A 33 -15.208 -8.580 -6.426 1.00 0.41 C ATOM 598 C ARG A 33 -16.354 -9.308 -7.129 1.00 0.45 C ATOM 599 O ARG A 33 -16.230 -9.713 -8.285 1.00 0.49 O ATOM 600 CB ARG A 33 -14.204 -9.587 -5.868 1.00 0.45 C ATOM 601 CG ARG A 33 -12.817 -9.003 -5.658 1.00 1.01 C ATOM 602 CD ARG A 33 -11.867 -10.025 -5.061 1.00 0.94 C ATOM 603 NE ARG A 33 -12.192 -10.325 -3.671 1.00 0.64 N ATOM 604 CZ ARG A 33 -12.193 -11.549 -3.148 1.00 0.84 C ATOM 605 NH1 ARG A 33 -11.953 -12.606 -3.913 1.00 1.32 N ATOM 606 NH2 ARG A 33 -12.458 -11.709 -1.858 1.00 1.22 N ATOM 0 H ARG A 33 -15.306 -7.904 -4.445 1.00 0.36 H new ATOM 0 HA ARG A 33 -14.711 -7.956 -7.169 1.00 0.41 H new ATOM 0 HB2 ARG A 33 -14.576 -9.971 -4.918 1.00 0.45 H new ATOM 0 HB3 ARG A 33 -14.134 -10.435 -6.550 1.00 0.45 H new ATOM 0 HG2 ARG A 33 -12.422 -8.650 -6.611 1.00 1.01 H new ATOM 0 HG3 ARG A 33 -12.882 -8.137 -4.999 1.00 1.01 H new ATOM 0 HD2 ARG A 33 -11.905 -10.942 -5.649 1.00 0.94 H new ATOM 0 HD3 ARG A 33 -10.845 -9.650 -5.122 1.00 0.94 H new ATOM 0 HE ARG A 33 -12.434 -9.545 -3.060 1.00 0.64 H new ATOM 0 HH11 ARG A 33 -11.766 -12.483 -4.908 1.00 1.32 H new ATOM 0 HH12 ARG A 33 -11.955 -13.541 -3.506 1.00 1.32 H new ATOM 0 HH21 ARG A 33 -12.659 -10.897 -1.274 1.00 1.22 H new ATOM 0 HH22 ARG A 33 -12.461 -12.644 -1.450 1.00 1.22 H new ATOM 620 N GLU A 34 -17.458 -9.492 -6.424 1.00 0.46 N ATOM 621 CA GLU A 34 -18.595 -10.211 -6.979 1.00 0.51 C ATOM 622 C GLU A 34 -19.255 -9.400 -8.101 1.00 0.50 C ATOM 623 O GLU A 34 -19.374 -9.878 -9.233 1.00 0.54 O ATOM 624 CB GLU A 34 -19.606 -10.558 -5.882 1.00 0.55 C ATOM 625 CG GLU A 34 -20.820 -11.327 -6.383 1.00 0.90 C ATOM 626 CD GLU A 34 -21.717 -11.800 -5.257 1.00 1.51 C ATOM 627 OE1 GLU A 34 -22.332 -10.952 -4.582 1.00 2.40 O ATOM 628 OE2 GLU A 34 -21.800 -13.026 -5.028 1.00 1.50 O ATOM 0 H GLU A 34 -17.592 -9.156 -5.470 1.00 0.46 H new ATOM 0 HA GLU A 34 -18.232 -11.145 -7.408 1.00 0.51 H new ATOM 0 HB2 GLU A 34 -19.106 -11.148 -5.114 1.00 0.55 H new ATOM 0 HB3 GLU A 34 -19.943 -9.636 -5.407 1.00 0.55 H new ATOM 0 HG2 GLU A 34 -21.394 -10.692 -7.058 1.00 0.90 H new ATOM 0 HG3 GLU A 34 -20.486 -12.188 -6.962 1.00 0.90 H new ATOM 635 N ARG A 35 -19.666 -8.171 -7.798 1.00 0.51 N ATOM 636 CA ARG A 35 -20.340 -7.339 -8.793 1.00 0.55 C ATOM 637 C ARG A 35 -19.350 -6.624 -9.716 1.00 0.49 C ATOM 638 O ARG A 35 -19.560 -6.563 -10.928 1.00 0.54 O ATOM 639 CB ARG A 35 -21.287 -6.319 -8.138 1.00 0.72 C ATOM 640 CG ARG A 35 -20.636 -5.423 -7.098 1.00 0.77 C ATOM 641 CD ARG A 35 -20.831 -5.958 -5.693 1.00 0.79 C ATOM 642 NE ARG A 35 -22.241 -6.118 -5.350 1.00 1.02 N ATOM 643 CZ ARG A 35 -22.763 -7.259 -4.899 1.00 1.46 C ATOM 644 NH1 ARG A 35 -21.978 -8.314 -4.713 1.00 1.79 N ATOM 645 NH2 ARG A 35 -24.059 -7.341 -4.624 1.00 1.90 N ATOM 0 H ARG A 35 -19.547 -7.733 -6.885 1.00 0.51 H new ATOM 0 HA ARG A 35 -20.936 -8.018 -9.403 1.00 0.55 H new ATOM 0 HB2 ARG A 35 -21.719 -5.692 -8.918 1.00 0.72 H new ATOM 0 HB3 ARG A 35 -22.111 -6.858 -7.669 1.00 0.72 H new ATOM 0 HG2 ARG A 35 -19.570 -5.336 -7.309 1.00 0.77 H new ATOM 0 HG3 ARG A 35 -21.058 -4.420 -7.167 1.00 0.77 H new ATOM 0 HD2 ARG A 35 -20.326 -6.919 -5.600 1.00 0.79 H new ATOM 0 HD3 ARG A 35 -20.361 -5.280 -4.980 1.00 0.79 H new ATOM 0 HE ARG A 35 -22.859 -5.315 -5.461 1.00 1.02 H new ATOM 0 HH11 ARG A 35 -20.980 -8.249 -4.915 1.00 1.79 H new ATOM 0 HH12 ARG A 35 -22.373 -9.189 -4.368 1.00 1.79 H new ATOM 0 HH21 ARG A 35 -24.661 -6.529 -4.757 1.00 1.90 H new ATOM 0 HH22 ARG A 35 -24.453 -8.216 -4.279 1.00 1.90 H new ATOM 659 N ILE A 36 -18.271 -6.091 -9.146 1.00 0.45 N ATOM 660 CA ILE A 36 -17.327 -5.273 -9.906 1.00 0.43 C ATOM 661 C ILE A 36 -16.079 -6.076 -10.272 1.00 0.45 C ATOM 662 O ILE A 36 -15.202 -6.291 -9.435 1.00 0.44 O ATOM 663 CB ILE A 36 -16.908 -4.012 -9.112 1.00 0.43 C ATOM 664 CG1 ILE A 36 -18.130 -3.354 -8.471 1.00 0.43 C ATOM 665 CG2 ILE A 36 -16.201 -3.016 -10.022 1.00 0.44 C ATOM 666 CD1 ILE A 36 -17.788 -2.157 -7.612 1.00 0.44 C ATOM 0 H ILE A 36 -18.029 -6.210 -8.162 1.00 0.45 H new ATOM 0 HA ILE A 36 -17.835 -4.962 -10.819 1.00 0.43 H new ATOM 0 HB ILE A 36 -16.219 -4.319 -8.326 1.00 0.43 H new ATOM 0 HG12 ILE A 36 -18.819 -3.043 -9.256 1.00 0.43 H new ATOM 0 HG13 ILE A 36 -18.652 -4.091 -7.862 1.00 0.43 H new ATOM 0 HG21 ILE A 36 -15.914 -2.136 -9.446 1.00 0.44 H new ATOM 0 HG22 ILE A 36 -15.310 -3.479 -10.445 1.00 0.44 H new ATOM 0 HG23 ILE A 36 -16.873 -2.719 -10.827 1.00 0.44 H new ATOM 0 HD11 ILE A 36 -18.702 -1.740 -7.189 1.00 0.44 H new ATOM 0 HD12 ILE A 36 -17.123 -2.466 -6.806 1.00 0.44 H new ATOM 0 HD13 ILE A 36 -17.292 -1.401 -8.222 1.00 0.44 H new ATOM 678 N PRO A 37 -15.980 -6.529 -11.530 1.00 0.53 N ATOM 679 CA PRO A 37 -14.854 -7.338 -12.006 1.00 0.60 C ATOM 680 C PRO A 37 -13.589 -6.509 -12.213 1.00 0.61 C ATOM 681 O PRO A 37 -12.482 -7.046 -12.267 1.00 0.71 O ATOM 682 CB PRO A 37 -15.346 -7.900 -13.349 1.00 0.73 C ATOM 683 CG PRO A 37 -16.792 -7.538 -13.433 1.00 0.76 C ATOM 684 CD PRO A 37 -16.959 -6.308 -12.595 1.00 0.60 C ATOM 0 HA PRO A 37 -14.580 -8.107 -11.284 1.00 0.60 H new ATOM 0 HB2 PRO A 37 -14.786 -7.472 -14.181 1.00 0.73 H new ATOM 0 HB3 PRO A 37 -15.210 -8.980 -13.395 1.00 0.73 H new ATOM 0 HG2 PRO A 37 -17.088 -7.350 -14.465 1.00 0.76 H new ATOM 0 HG3 PRO A 37 -17.419 -8.349 -13.064 1.00 0.76 H new ATOM 0 HD2 PRO A 37 -16.750 -5.399 -13.159 1.00 0.60 H new ATOM 0 HD3 PRO A 37 -17.972 -6.215 -12.205 1.00 0.60 H new ATOM 692 N GLU A 38 -13.761 -5.198 -12.320 1.00 0.57 N ATOM 693 CA GLU A 38 -12.636 -4.293 -12.504 1.00 0.61 C ATOM 694 C GLU A 38 -11.788 -4.243 -11.236 1.00 0.54 C ATOM 695 O GLU A 38 -10.587 -3.988 -11.281 1.00 0.62 O ATOM 696 CB GLU A 38 -13.141 -2.893 -12.869 1.00 0.75 C ATOM 697 CG GLU A 38 -12.038 -1.917 -13.245 1.00 0.99 C ATOM 698 CD GLU A 38 -11.254 -2.358 -14.464 1.00 1.67 C ATOM 699 OE1 GLU A 38 -11.785 -2.268 -15.589 1.00 2.04 O ATOM 700 OE2 GLU A 38 -10.105 -2.812 -14.301 1.00 2.46 O ATOM 0 H GLU A 38 -14.671 -4.738 -12.282 1.00 0.57 H new ATOM 0 HA GLU A 38 -12.015 -4.662 -13.320 1.00 0.61 H new ATOM 0 HB2 GLU A 38 -13.839 -2.975 -13.702 1.00 0.75 H new ATOM 0 HB3 GLU A 38 -13.699 -2.488 -12.025 1.00 0.75 H new ATOM 0 HG2 GLU A 38 -12.476 -0.937 -13.435 1.00 0.99 H new ATOM 0 HG3 GLU A 38 -11.357 -1.804 -12.402 1.00 0.99 H new ATOM 707 N ALA A 39 -12.426 -4.512 -10.105 1.00 0.47 N ATOM 708 CA ALA A 39 -11.743 -4.522 -8.821 1.00 0.47 C ATOM 709 C ALA A 39 -10.670 -5.606 -8.786 1.00 0.49 C ATOM 710 O ALA A 39 -9.570 -5.405 -8.278 1.00 0.55 O ATOM 711 CB ALA A 39 -12.753 -4.742 -7.704 1.00 0.47 C ATOM 0 H ALA A 39 -13.422 -4.727 -10.052 1.00 0.47 H new ATOM 0 HA ALA A 39 -11.254 -3.558 -8.678 1.00 0.47 H new ATOM 0 HB1 ALA A 39 -12.238 -4.749 -6.744 1.00 0.47 H new ATOM 0 HB2 ALA A 39 -13.489 -3.938 -7.715 1.00 0.47 H new ATOM 0 HB3 ALA A 39 -13.257 -5.697 -7.852 1.00 0.47 H new ATOM 717 N LEU A 40 -10.999 -6.746 -9.363 1.00 0.50 N ATOM 718 CA LEU A 40 -10.131 -7.911 -9.336 1.00 0.59 C ATOM 719 C LEU A 40 -9.382 -8.068 -10.655 1.00 0.67 C ATOM 720 O LEU A 40 -9.084 -9.181 -11.078 1.00 0.99 O ATOM 721 CB LEU A 40 -10.987 -9.137 -9.091 1.00 0.65 C ATOM 722 CG LEU A 40 -12.042 -9.360 -10.163 1.00 0.62 C ATOM 723 CD1 LEU A 40 -11.707 -10.583 -10.981 1.00 1.29 C ATOM 724 CD2 LEU A 40 -13.417 -9.455 -9.545 1.00 1.19 C ATOM 0 H LEU A 40 -11.875 -6.892 -9.864 1.00 0.50 H new ATOM 0 HA LEU A 40 -9.393 -7.790 -8.543 1.00 0.59 H new ATOM 0 HB2 LEU A 40 -10.344 -10.015 -9.036 1.00 0.65 H new ATOM 0 HB3 LEU A 40 -11.478 -9.041 -8.123 1.00 0.65 H new ATOM 0 HG LEU A 40 -12.049 -8.504 -10.837 1.00 0.62 H new ATOM 0 HD11 LEU A 40 -12.471 -10.730 -11.745 1.00 1.29 H new ATOM 0 HD12 LEU A 40 -10.737 -10.446 -11.459 1.00 1.29 H new ATOM 0 HD13 LEU A 40 -11.671 -11.457 -10.331 1.00 1.29 H new ATOM 0 HD21 LEU A 40 -14.158 -9.615 -10.328 1.00 1.19 H new ATOM 0 HD22 LEU A 40 -13.444 -10.290 -8.844 1.00 1.19 H new ATOM 0 HD23 LEU A 40 -13.643 -8.529 -9.015 1.00 1.19 H new ATOM 736 N ALA A 41 -9.072 -6.952 -11.291 1.00 0.65 N ATOM 737 CA ALA A 41 -8.394 -6.961 -12.587 1.00 0.74 C ATOM 738 C ALA A 41 -7.077 -7.744 -12.550 1.00 0.81 C ATOM 739 O ALA A 41 -6.563 -8.157 -13.591 1.00 1.15 O ATOM 740 CB ALA A 41 -8.144 -5.539 -13.061 1.00 0.92 C ATOM 0 H ALA A 41 -9.278 -6.019 -10.933 1.00 0.65 H new ATOM 0 HA ALA A 41 -9.053 -7.468 -13.291 1.00 0.74 H new ATOM 0 HB1 ALA A 41 -7.639 -5.561 -14.027 1.00 0.92 H new ATOM 0 HB2 ALA A 41 -9.095 -5.016 -13.161 1.00 0.92 H new ATOM 0 HB3 ALA A 41 -7.518 -5.018 -12.336 1.00 0.92 H new ATOM 746 N GLY A 42 -6.542 -7.942 -11.355 1.00 0.75 N ATOM 747 CA GLY A 42 -5.351 -8.749 -11.193 1.00 0.86 C ATOM 748 C GLY A 42 -5.548 -9.813 -10.129 1.00 0.80 C ATOM 749 O GLY A 42 -6.641 -10.364 -10.006 1.00 0.82 O ATOM 0 H GLY A 42 -6.915 -7.555 -10.488 1.00 0.75 H new ATOM 0 HA2 GLY A 42 -5.098 -9.222 -12.142 1.00 0.86 H new ATOM 0 HA3 GLY A 42 -4.510 -8.111 -10.921 1.00 0.86 H new ATOM 753 N PRO A 43 -4.515 -10.116 -9.337 1.00 0.83 N ATOM 754 CA PRO A 43 -4.619 -11.067 -8.231 1.00 0.82 C ATOM 755 C PRO A 43 -5.360 -10.458 -7.045 1.00 0.72 C ATOM 756 O PRO A 43 -4.844 -9.554 -6.389 1.00 0.66 O ATOM 757 CB PRO A 43 -3.158 -11.361 -7.853 1.00 0.94 C ATOM 758 CG PRO A 43 -2.312 -10.647 -8.860 1.00 1.09 C ATOM 759 CD PRO A 43 -3.165 -9.561 -9.447 1.00 0.98 C ATOM 0 HA PRO A 43 -5.177 -11.961 -8.509 1.00 0.82 H new ATOM 0 HB2 PRO A 43 -2.940 -11.012 -6.844 1.00 0.94 H new ATOM 0 HB3 PRO A 43 -2.960 -12.433 -7.869 1.00 0.94 H new ATOM 0 HG2 PRO A 43 -1.422 -10.229 -8.391 1.00 1.09 H new ATOM 0 HG3 PRO A 43 -1.971 -11.333 -9.635 1.00 1.09 H new ATOM 0 HD2 PRO A 43 -3.066 -8.626 -8.896 1.00 0.98 H new ATOM 0 HD3 PRO A 43 -2.897 -9.351 -10.482 1.00 0.98 H new ATOM 767 N PRO A 44 -6.585 -10.938 -6.752 1.00 0.76 N ATOM 768 CA PRO A 44 -7.420 -10.390 -5.672 1.00 0.73 C ATOM 769 C PRO A 44 -6.750 -10.478 -4.304 1.00 0.69 C ATOM 770 O PRO A 44 -7.113 -9.757 -3.374 1.00 0.74 O ATOM 771 CB PRO A 44 -8.682 -11.258 -5.702 1.00 0.93 C ATOM 772 CG PRO A 44 -8.310 -12.476 -6.473 1.00 0.99 C ATOM 773 CD PRO A 44 -7.257 -12.044 -7.453 1.00 0.89 C ATOM 0 HA PRO A 44 -7.615 -9.328 -5.824 1.00 0.73 H new ATOM 0 HB2 PRO A 44 -9.005 -11.516 -4.693 1.00 0.93 H new ATOM 0 HB3 PRO A 44 -9.510 -10.731 -6.177 1.00 0.93 H new ATOM 0 HG2 PRO A 44 -7.931 -13.255 -5.812 1.00 0.99 H new ATOM 0 HG3 PRO A 44 -9.176 -12.890 -6.989 1.00 0.99 H new ATOM 0 HD2 PRO A 44 -6.565 -12.854 -7.685 1.00 0.89 H new ATOM 0 HD3 PRO A 44 -7.694 -11.717 -8.397 1.00 0.89 H new ATOM 781 N ASN A 45 -5.763 -11.358 -4.194 1.00 0.72 N ATOM 782 CA ASN A 45 -5.004 -11.518 -2.959 1.00 0.77 C ATOM 783 C ASN A 45 -4.077 -10.327 -2.755 1.00 0.71 C ATOM 784 O ASN A 45 -3.590 -10.080 -1.653 1.00 0.85 O ATOM 785 CB ASN A 45 -4.181 -12.808 -3.001 1.00 0.87 C ATOM 786 CG ASN A 45 -5.038 -14.049 -3.143 1.00 1.41 C ATOM 787 OD1 ASN A 45 -6.158 -14.110 -2.637 1.00 2.21 O ATOM 788 ND2 ASN A 45 -4.530 -15.038 -3.861 1.00 1.37 N ATOM 0 H ASN A 45 -5.468 -11.976 -4.950 1.00 0.72 H new ATOM 0 HA ASN A 45 -5.707 -11.573 -2.128 1.00 0.77 H new ATOM 0 HB2 ASN A 45 -3.480 -12.759 -3.834 1.00 0.87 H new ATOM 0 HB3 ASN A 45 -3.588 -12.884 -2.090 1.00 0.87 H new ATOM 0 HD21 ASN A 45 -5.071 -15.889 -4.011 1.00 1.37 H new ATOM 0 HD22 ASN A 45 -3.597 -14.949 -4.264 1.00 1.37 H new ATOM 795 N ASP A 46 -3.851 -9.588 -3.828 1.00 0.61 N ATOM 796 CA ASP A 46 -2.949 -8.450 -3.808 1.00 0.68 C ATOM 797 C ASP A 46 -3.729 -7.140 -3.814 1.00 0.57 C ATOM 798 O ASP A 46 -3.147 -6.068 -3.935 1.00 0.61 O ATOM 799 CB ASP A 46 -2.004 -8.498 -5.016 1.00 0.83 C ATOM 800 CG ASP A 46 -1.014 -9.648 -4.951 1.00 1.22 C ATOM 801 OD1 ASP A 46 -1.453 -10.815 -4.974 1.00 1.38 O ATOM 802 OD2 ASP A 46 0.209 -9.391 -4.884 1.00 1.90 O ATOM 0 H ASP A 46 -4.286 -9.759 -4.734 1.00 0.61 H new ATOM 0 HA ASP A 46 -2.361 -8.500 -2.892 1.00 0.68 H new ATOM 0 HB2 ASP A 46 -2.594 -8.585 -5.928 1.00 0.83 H new ATOM 0 HB3 ASP A 46 -1.456 -7.558 -5.079 1.00 0.83 H new ATOM 807 N PHE A 47 -5.047 -7.228 -3.675 1.00 0.53 N ATOM 808 CA PHE A 47 -5.901 -6.041 -3.686 1.00 0.47 C ATOM 809 C PHE A 47 -6.536 -5.812 -2.319 1.00 0.44 C ATOM 810 O PHE A 47 -6.970 -6.759 -1.661 1.00 0.48 O ATOM 811 CB PHE A 47 -6.993 -6.166 -4.752 1.00 0.49 C ATOM 812 CG PHE A 47 -6.507 -5.936 -6.155 1.00 0.51 C ATOM 813 CD1 PHE A 47 -6.354 -4.650 -6.642 1.00 0.78 C ATOM 814 CD2 PHE A 47 -6.209 -6.999 -6.986 1.00 0.79 C ATOM 815 CE1 PHE A 47 -5.909 -4.429 -7.930 1.00 0.80 C ATOM 816 CE2 PHE A 47 -5.763 -6.786 -8.275 1.00 0.85 C ATOM 817 CZ PHE A 47 -5.613 -5.498 -8.749 1.00 0.63 C ATOM 0 H PHE A 47 -5.549 -8.107 -3.553 1.00 0.53 H new ATOM 0 HA PHE A 47 -5.272 -5.184 -3.926 1.00 0.47 H new ATOM 0 HB2 PHE A 47 -7.435 -7.161 -4.690 1.00 0.49 H new ATOM 0 HB3 PHE A 47 -7.785 -5.451 -4.531 1.00 0.49 H new ATOM 0 HD1 PHE A 47 -6.586 -3.808 -6.006 1.00 0.78 H new ATOM 0 HD2 PHE A 47 -6.326 -8.009 -6.623 1.00 0.79 H new ATOM 0 HE1 PHE A 47 -5.793 -3.420 -8.296 1.00 0.80 H new ATOM 0 HE2 PHE A 47 -5.532 -7.627 -8.912 1.00 0.85 H new ATOM 0 HZ PHE A 47 -5.265 -5.328 -9.757 1.00 0.63 H new ATOM 827 N GLY A 48 -6.576 -4.554 -1.897 1.00 0.42 N ATOM 828 CA GLY A 48 -7.165 -4.214 -0.614 1.00 0.41 C ATOM 829 C GLY A 48 -7.893 -2.884 -0.641 1.00 0.35 C ATOM 830 O GLY A 48 -8.097 -2.301 -1.709 1.00 0.34 O ATOM 0 H GLY A 48 -6.210 -3.760 -2.422 1.00 0.42 H new ATOM 0 HA2 GLY A 48 -7.861 -4.999 -0.318 1.00 0.41 H new ATOM 0 HA3 GLY A 48 -6.382 -4.180 0.144 1.00 0.41 H new ATOM 834 N LEU A 49 -8.269 -2.395 0.534 1.00 0.31 N ATOM 835 CA LEU A 49 -9.081 -1.189 0.634 1.00 0.28 C ATOM 836 C LEU A 49 -8.266 0.011 1.117 1.00 0.29 C ATOM 837 O LEU A 49 -7.746 0.024 2.232 1.00 0.31 O ATOM 838 CB LEU A 49 -10.267 -1.424 1.575 1.00 0.26 C ATOM 839 CG LEU A 49 -11.213 -2.559 1.170 1.00 0.26 C ATOM 840 CD1 LEU A 49 -12.360 -2.676 2.160 1.00 0.27 C ATOM 841 CD2 LEU A 49 -11.749 -2.335 -0.233 1.00 0.25 C ATOM 0 H LEU A 49 -8.025 -2.815 1.431 1.00 0.31 H new ATOM 0 HA LEU A 49 -9.448 -0.961 -0.367 1.00 0.28 H new ATOM 0 HB2 LEU A 49 -9.881 -1.634 2.573 1.00 0.26 H new ATOM 0 HB3 LEU A 49 -10.843 -0.501 1.644 1.00 0.26 H new ATOM 0 HG LEU A 49 -10.649 -3.492 1.179 1.00 0.26 H new ATOM 0 HD11 LEU A 49 -13.022 -3.487 1.856 1.00 0.27 H new ATOM 0 HD12 LEU A 49 -11.963 -2.884 3.154 1.00 0.27 H new ATOM 0 HD13 LEU A 49 -12.919 -1.741 2.181 1.00 0.27 H new ATOM 0 HD21 LEU A 49 -12.419 -3.152 -0.501 1.00 0.25 H new ATOM 0 HD22 LEU A 49 -12.295 -1.392 -0.268 1.00 0.25 H new ATOM 0 HD23 LEU A 49 -10.919 -2.300 -0.938 1.00 0.25 H new ATOM 853 N PHE A 50 -8.132 0.995 0.246 1.00 0.29 N ATOM 854 CA PHE A 50 -7.530 2.272 0.609 1.00 0.30 C ATOM 855 C PHE A 50 -8.609 3.341 0.743 1.00 0.30 C ATOM 856 O PHE A 50 -9.477 3.472 -0.114 1.00 0.31 O ATOM 857 CB PHE A 50 -6.485 2.691 -0.432 1.00 0.34 C ATOM 858 CG PHE A 50 -5.773 3.981 -0.112 1.00 0.34 C ATOM 859 CD1 PHE A 50 -4.765 4.012 0.839 1.00 0.37 C ATOM 860 CD2 PHE A 50 -6.114 5.164 -0.758 1.00 0.36 C ATOM 861 CE1 PHE A 50 -4.111 5.192 1.141 1.00 0.38 C ATOM 862 CE2 PHE A 50 -5.462 6.346 -0.459 1.00 0.38 C ATOM 863 CZ PHE A 50 -4.458 6.364 0.467 1.00 0.37 C ATOM 0 H PHE A 50 -8.434 0.936 -0.727 1.00 0.29 H new ATOM 0 HA PHE A 50 -7.028 2.160 1.570 1.00 0.30 H new ATOM 0 HB2 PHE A 50 -5.746 1.896 -0.528 1.00 0.34 H new ATOM 0 HB3 PHE A 50 -6.974 2.790 -1.401 1.00 0.34 H new ATOM 0 HD1 PHE A 50 -4.487 3.102 1.351 1.00 0.37 H new ATOM 0 HD2 PHE A 50 -6.897 5.160 -1.502 1.00 0.36 H new ATOM 0 HE1 PHE A 50 -3.337 5.207 1.894 1.00 0.38 H new ATOM 0 HE2 PHE A 50 -5.748 7.259 -0.960 1.00 0.38 H new ATOM 0 HZ PHE A 50 -3.933 7.284 0.677 1.00 0.37 H new ATOM 873 N LEU A 51 -8.557 4.097 1.826 1.00 0.30 N ATOM 874 CA LEU A 51 -9.526 5.154 2.056 1.00 0.32 C ATOM 875 C LEU A 51 -8.966 6.468 1.524 1.00 0.36 C ATOM 876 O LEU A 51 -7.948 6.963 2.009 1.00 0.38 O ATOM 877 CB LEU A 51 -9.856 5.255 3.553 1.00 0.33 C ATOM 878 CG LEU A 51 -11.156 5.992 3.915 1.00 0.35 C ATOM 879 CD1 LEU A 51 -11.022 7.494 3.713 1.00 0.46 C ATOM 880 CD2 LEU A 51 -12.319 5.445 3.100 1.00 0.41 C ATOM 0 H LEU A 51 -7.855 3.999 2.559 1.00 0.30 H new ATOM 0 HA LEU A 51 -10.453 4.928 1.528 1.00 0.32 H new ATOM 0 HB2 LEU A 51 -9.910 4.245 3.960 1.00 0.33 H new ATOM 0 HB3 LEU A 51 -9.028 5.757 4.053 1.00 0.33 H new ATOM 0 HG LEU A 51 -11.354 5.818 4.973 1.00 0.35 H new ATOM 0 HD11 LEU A 51 -11.960 7.982 3.979 1.00 0.46 H new ATOM 0 HD12 LEU A 51 -10.222 7.876 4.347 1.00 0.46 H new ATOM 0 HD13 LEU A 51 -10.788 7.701 2.669 1.00 0.46 H new ATOM 0 HD21 LEU A 51 -13.232 5.976 3.367 1.00 0.41 H new ATOM 0 HD22 LEU A 51 -12.116 5.584 2.038 1.00 0.41 H new ATOM 0 HD23 LEU A 51 -12.443 4.383 3.310 1.00 0.41 H new ATOM 892 N SER A 52 -9.635 7.016 0.522 1.00 0.42 N ATOM 893 CA SER A 52 -9.168 8.219 -0.154 1.00 0.53 C ATOM 894 C SER A 52 -9.778 9.471 0.477 1.00 0.61 C ATOM 895 O SER A 52 -10.991 9.545 0.681 1.00 0.93 O ATOM 896 CB SER A 52 -9.539 8.143 -1.634 1.00 0.67 C ATOM 897 OG SER A 52 -9.185 6.881 -2.174 1.00 1.28 O ATOM 0 H SER A 52 -10.511 6.644 0.155 1.00 0.42 H new ATOM 0 HA SER A 52 -8.085 8.283 -0.050 1.00 0.53 H new ATOM 0 HB2 SER A 52 -10.610 8.309 -1.755 1.00 0.67 H new ATOM 0 HB3 SER A 52 -9.030 8.935 -2.183 1.00 0.67 H new ATOM 0 HG SER A 52 -8.616 7.010 -2.961 1.00 1.28 H new ATOM 903 N ASP A 53 -8.935 10.451 0.776 1.00 0.74 N ATOM 904 CA ASP A 53 -9.390 11.687 1.411 1.00 0.90 C ATOM 905 C ASP A 53 -9.062 12.903 0.553 1.00 1.04 C ATOM 906 O ASP A 53 -9.951 13.642 0.125 1.00 1.28 O ATOM 907 CB ASP A 53 -8.736 11.854 2.786 1.00 0.89 C ATOM 908 CG ASP A 53 -9.208 13.106 3.499 1.00 1.18 C ATOM 909 OD1 ASP A 53 -10.353 13.117 3.995 1.00 1.42 O ATOM 910 OD2 ASP A 53 -8.443 14.090 3.562 1.00 1.24 O ATOM 0 H ASP A 53 -7.933 10.417 0.590 1.00 0.74 H new ATOM 0 HA ASP A 53 -10.472 11.617 1.524 1.00 0.90 H new ATOM 0 HB2 ASP A 53 -8.960 10.982 3.401 1.00 0.89 H new ATOM 0 HB3 ASP A 53 -7.653 11.892 2.669 1.00 0.89 H new ATOM 915 N ASP A 54 -7.775 13.089 0.291 1.00 0.93 N ATOM 916 CA ASP A 54 -7.282 14.284 -0.387 1.00 1.10 C ATOM 917 C ASP A 54 -5.814 14.113 -0.725 1.00 1.02 C ATOM 918 O ASP A 54 -5.418 14.141 -1.887 1.00 1.22 O ATOM 919 CB ASP A 54 -7.459 15.516 0.510 1.00 1.26 C ATOM 920 CG ASP A 54 -6.911 16.781 -0.117 1.00 1.47 C ATOM 921 OD1 ASP A 54 -7.597 17.370 -0.983 1.00 1.73 O ATOM 922 OD2 ASP A 54 -5.788 17.188 0.247 1.00 1.45 O ATOM 0 H ASP A 54 -7.046 12.421 0.540 1.00 0.93 H new ATOM 0 HA ASP A 54 -7.854 14.427 -1.304 1.00 1.10 H new ATOM 0 HB2 ASP A 54 -8.518 15.653 0.727 1.00 1.26 H new ATOM 0 HB3 ASP A 54 -6.958 15.341 1.462 1.00 1.26 H new ATOM 927 N ASP A 55 -5.020 13.920 0.311 1.00 0.87 N ATOM 928 CA ASP A 55 -3.588 13.715 0.169 1.00 0.94 C ATOM 929 C ASP A 55 -3.242 12.304 0.627 1.00 0.87 C ATOM 930 O ASP A 55 -3.890 11.784 1.534 1.00 0.71 O ATOM 931 CB ASP A 55 -2.829 14.759 0.999 1.00 0.99 C ATOM 932 CG ASP A 55 -1.327 14.555 0.991 1.00 1.39 C ATOM 933 OD1 ASP A 55 -0.662 15.017 0.040 1.00 1.58 O ATOM 934 OD2 ASP A 55 -0.805 13.938 1.940 1.00 1.79 O ATOM 0 H ASP A 55 -5.348 13.901 1.276 1.00 0.87 H new ATOM 0 HA ASP A 55 -3.295 13.832 -0.874 1.00 0.94 H new ATOM 0 HB2 ASP A 55 -3.056 15.753 0.614 1.00 0.99 H new ATOM 0 HB3 ASP A 55 -3.188 14.726 2.028 1.00 0.99 H new ATOM 939 N PRO A 56 -2.262 11.650 -0.021 1.00 1.06 N ATOM 940 CA PRO A 56 -1.812 10.298 0.331 1.00 1.08 C ATOM 941 C PRO A 56 -1.641 10.067 1.836 1.00 0.98 C ATOM 942 O PRO A 56 -1.913 8.975 2.323 1.00 0.97 O ATOM 943 CB PRO A 56 -0.459 10.158 -0.383 1.00 1.35 C ATOM 944 CG PRO A 56 -0.201 11.471 -1.053 1.00 1.48 C ATOM 945 CD PRO A 56 -1.533 12.149 -1.189 1.00 1.33 C ATOM 0 HA PRO A 56 -2.556 9.561 0.030 1.00 1.08 H new ATOM 0 HB2 PRO A 56 0.333 9.922 0.327 1.00 1.35 H new ATOM 0 HB3 PRO A 56 -0.486 9.348 -1.112 1.00 1.35 H new ATOM 0 HG2 PRO A 56 0.485 12.079 -0.464 1.00 1.48 H new ATOM 0 HG3 PRO A 56 0.261 11.324 -2.029 1.00 1.48 H new ATOM 0 HD2 PRO A 56 -1.439 13.235 -1.176 1.00 1.33 H new ATOM 0 HD3 PRO A 56 -2.030 11.884 -2.122 1.00 1.33 H new ATOM 953 N LYS A 57 -1.202 11.086 2.572 1.00 0.99 N ATOM 954 CA LYS A 57 -0.985 10.935 4.012 1.00 1.02 C ATOM 955 C LYS A 57 -2.310 10.993 4.766 1.00 0.82 C ATOM 956 O LYS A 57 -2.488 10.322 5.782 1.00 0.87 O ATOM 957 CB LYS A 57 -0.051 12.023 4.538 1.00 1.25 C ATOM 958 CG LYS A 57 1.176 12.252 3.674 1.00 1.51 C ATOM 959 CD LYS A 57 2.246 11.213 3.930 1.00 1.62 C ATOM 960 CE LYS A 57 2.856 11.377 5.312 1.00 2.08 C ATOM 961 NZ LYS A 57 3.443 12.730 5.509 1.00 2.93 N ATOM 0 H LYS A 57 -0.992 12.013 2.203 1.00 0.99 H new ATOM 0 HA LYS A 57 -0.523 9.962 4.177 1.00 1.02 H new ATOM 0 HB2 LYS A 57 -0.606 12.957 4.618 1.00 1.25 H new ATOM 0 HB3 LYS A 57 0.270 11.756 5.545 1.00 1.25 H new ATOM 0 HG2 LYS A 57 0.890 12.227 2.623 1.00 1.51 H new ATOM 0 HG3 LYS A 57 1.579 13.245 3.871 1.00 1.51 H new ATOM 0 HD2 LYS A 57 1.817 10.215 3.836 1.00 1.62 H new ATOM 0 HD3 LYS A 57 3.026 11.297 3.174 1.00 1.62 H new ATOM 0 HE2 LYS A 57 2.091 11.201 6.068 1.00 2.08 H new ATOM 0 HE3 LYS A 57 3.629 10.622 5.458 1.00 2.08 H new ATOM 0 HZ1 LYS A 57 4.126 12.701 6.293 1.00 2.93 H new ATOM 0 HZ2 LYS A 57 3.928 13.028 4.639 1.00 2.93 H new ATOM 0 HZ3 LYS A 57 2.686 13.407 5.733 1.00 2.93 H new ATOM 975 N LYS A 58 -3.240 11.797 4.253 1.00 0.69 N ATOM 976 CA LYS A 58 -4.559 11.935 4.856 1.00 0.65 C ATOM 977 C LYS A 58 -5.367 10.673 4.603 1.00 0.56 C ATOM 978 O LYS A 58 -6.257 10.316 5.377 1.00 0.63 O ATOM 979 CB LYS A 58 -5.289 13.141 4.263 1.00 0.73 C ATOM 980 CG LYS A 58 -4.517 14.447 4.367 1.00 0.94 C ATOM 981 CD LYS A 58 -5.210 15.549 3.587 1.00 1.24 C ATOM 982 CE LYS A 58 -4.411 16.841 3.599 1.00 1.55 C ATOM 983 NZ LYS A 58 -5.054 17.897 2.773 1.00 2.16 N ATOM 0 H LYS A 58 -3.100 12.364 3.417 1.00 0.69 H new ATOM 0 HA LYS A 58 -4.444 12.086 5.929 1.00 0.65 H new ATOM 0 HB2 LYS A 58 -5.505 12.941 3.213 1.00 0.73 H new ATOM 0 HB3 LYS A 58 -6.248 13.257 4.769 1.00 0.73 H new ATOM 0 HG2 LYS A 58 -4.426 14.738 5.413 1.00 0.94 H new ATOM 0 HG3 LYS A 58 -3.505 14.307 3.986 1.00 0.94 H new ATOM 0 HD2 LYS A 58 -5.361 15.225 2.557 1.00 1.24 H new ATOM 0 HD3 LYS A 58 -6.197 15.729 4.012 1.00 1.24 H new ATOM 0 HE2 LYS A 58 -4.308 17.195 4.625 1.00 1.55 H new ATOM 0 HE3 LYS A 58 -3.405 16.650 3.225 1.00 1.55 H new ATOM 0 HZ1 LYS A 58 -4.516 18.782 2.861 1.00 2.16 H new ATOM 0 HZ2 LYS A 58 -5.068 17.598 1.777 1.00 2.16 H new ATOM 0 HZ3 LYS A 58 -6.028 18.050 3.103 1.00 2.16 H new ATOM 997 N GLY A 59 -5.049 10.010 3.498 1.00 0.54 N ATOM 998 CA GLY A 59 -5.669 8.745 3.184 1.00 0.59 C ATOM 999 C GLY A 59 -5.074 7.637 4.017 1.00 0.54 C ATOM 1000 O GLY A 59 -3.953 7.759 4.501 1.00 0.58 O ATOM 0 H GLY A 59 -4.367 10.332 2.811 1.00 0.54 H new ATOM 0 HA2 GLY A 59 -6.742 8.806 3.364 1.00 0.59 H new ATOM 0 HA3 GLY A 59 -5.536 8.522 2.125 1.00 0.59 H new ATOM 1004 N ILE A 60 -5.806 6.553 4.179 1.00 0.49 N ATOM 1005 CA ILE A 60 -5.375 5.485 5.067 1.00 0.47 C ATOM 1006 C ILE A 60 -5.597 4.120 4.440 1.00 0.42 C ATOM 1007 O ILE A 60 -6.507 3.937 3.631 1.00 0.41 O ATOM 1008 CB ILE A 60 -6.121 5.534 6.417 1.00 0.51 C ATOM 1009 CG1 ILE A 60 -7.632 5.615 6.183 1.00 0.55 C ATOM 1010 CG2 ILE A 60 -5.638 6.709 7.255 1.00 0.60 C ATOM 1011 CD1 ILE A 60 -8.452 5.600 7.452 1.00 0.65 C ATOM 0 H ILE A 60 -6.697 6.386 3.712 1.00 0.49 H new ATOM 0 HA ILE A 60 -4.309 5.638 5.238 1.00 0.47 H new ATOM 0 HB ILE A 60 -5.906 4.618 6.968 1.00 0.51 H new ATOM 0 HG12 ILE A 60 -7.855 6.527 5.629 1.00 0.55 H new ATOM 0 HG13 ILE A 60 -7.937 4.778 5.555 1.00 0.55 H new ATOM 0 HG21 ILE A 60 -6.176 6.726 8.203 1.00 0.60 H new ATOM 0 HG22 ILE A 60 -4.570 6.605 7.446 1.00 0.60 H new ATOM 0 HG23 ILE A 60 -5.821 7.639 6.717 1.00 0.60 H new ATOM 0 HD11 ILE A 60 -9.511 5.660 7.202 1.00 0.65 H new ATOM 0 HD12 ILE A 60 -8.260 4.676 7.998 1.00 0.65 H new ATOM 0 HD13 ILE A 60 -8.177 6.452 8.073 1.00 0.65 H new ATOM 1023 N TRP A 61 -4.756 3.169 4.810 1.00 0.42 N ATOM 1024 CA TRP A 61 -4.949 1.794 4.401 1.00 0.40 C ATOM 1025 C TRP A 61 -5.886 1.101 5.369 1.00 0.40 C ATOM 1026 O TRP A 61 -5.763 1.253 6.585 1.00 0.48 O ATOM 1027 CB TRP A 61 -3.622 1.044 4.331 1.00 0.44 C ATOM 1028 CG TRP A 61 -2.883 1.258 3.048 1.00 0.43 C ATOM 1029 CD1 TRP A 61 -1.729 1.959 2.867 1.00 0.48 C ATOM 1030 CD2 TRP A 61 -3.253 0.753 1.762 1.00 0.41 C ATOM 1031 NE1 TRP A 61 -1.356 1.910 1.547 1.00 0.49 N ATOM 1032 CE2 TRP A 61 -2.275 1.180 0.851 1.00 0.45 C ATOM 1033 CE3 TRP A 61 -4.315 -0.022 1.295 1.00 0.41 C ATOM 1034 CZ2 TRP A 61 -2.324 0.859 -0.500 1.00 0.48 C ATOM 1035 CZ3 TRP A 61 -4.366 -0.341 -0.047 1.00 0.45 C ATOM 1036 CH2 TRP A 61 -3.375 0.098 -0.931 1.00 0.48 C ATOM 0 H TRP A 61 -3.934 3.327 5.393 1.00 0.42 H new ATOM 0 HA TRP A 61 -5.387 1.793 3.403 1.00 0.40 H new ATOM 0 HB2 TRP A 61 -2.991 1.360 5.162 1.00 0.44 H new ATOM 0 HB3 TRP A 61 -3.809 -0.022 4.460 1.00 0.44 H new ATOM 0 HD1 TRP A 61 -1.188 2.476 3.646 1.00 0.48 H new ATOM 0 HE1 TRP A 61 -0.525 2.349 1.150 1.00 0.49 H new ATOM 0 HE3 TRP A 61 -5.083 -0.366 1.971 1.00 0.41 H new ATOM 0 HZ2 TRP A 61 -1.560 1.198 -1.184 1.00 0.48 H new ATOM 0 HZ3 TRP A 61 -5.184 -0.939 -0.420 1.00 0.45 H new ATOM 0 HH2 TRP A 61 -3.441 -0.170 -1.975 1.00 0.48 H new ATOM 1047 N LEU A 62 -6.830 0.359 4.833 1.00 0.36 N ATOM 1048 CA LEU A 62 -7.816 -0.304 5.653 1.00 0.37 C ATOM 1049 C LEU A 62 -7.439 -1.761 5.886 1.00 0.42 C ATOM 1050 O LEU A 62 -7.474 -2.571 4.962 1.00 0.43 O ATOM 1051 CB LEU A 62 -9.195 -0.218 4.993 1.00 0.33 C ATOM 1052 CG LEU A 62 -9.695 1.201 4.703 1.00 0.31 C ATOM 1053 CD1 LEU A 62 -11.070 1.161 4.064 1.00 0.29 C ATOM 1054 CD2 LEU A 62 -9.737 2.030 5.973 1.00 0.35 C ATOM 0 H LEU A 62 -6.934 0.200 3.831 1.00 0.36 H new ATOM 0 HA LEU A 62 -7.850 0.200 6.619 1.00 0.37 H new ATOM 0 HB2 LEU A 62 -9.166 -0.774 4.056 1.00 0.33 H new ATOM 0 HB3 LEU A 62 -9.920 -0.716 5.637 1.00 0.33 H new ATOM 0 HG LEU A 62 -8.997 1.667 4.008 1.00 0.31 H new ATOM 0 HD11 LEU A 62 -11.409 2.178 3.865 1.00 0.29 H new ATOM 0 HD12 LEU A 62 -11.020 0.606 3.127 1.00 0.29 H new ATOM 0 HD13 LEU A 62 -11.771 0.671 4.739 1.00 0.29 H new ATOM 0 HD21 LEU A 62 -10.095 3.033 5.741 1.00 0.35 H new ATOM 0 HD22 LEU A 62 -10.410 1.562 6.691 1.00 0.35 H new ATOM 0 HD23 LEU A 62 -8.736 2.092 6.400 1.00 0.35 H new ATOM 1066 N GLU A 63 -7.074 -2.093 7.122 1.00 0.48 N ATOM 1067 CA GLU A 63 -6.790 -3.473 7.488 1.00 0.55 C ATOM 1068 C GLU A 63 -8.091 -4.255 7.622 1.00 0.52 C ATOM 1069 O GLU A 63 -9.155 -3.664 7.827 1.00 0.48 O ATOM 1070 CB GLU A 63 -6.014 -3.532 8.809 1.00 0.65 C ATOM 1071 CG GLU A 63 -6.833 -3.131 10.031 1.00 0.68 C ATOM 1072 CD GLU A 63 -6.067 -3.306 11.326 1.00 1.07 C ATOM 1073 OE1 GLU A 63 -6.119 -4.414 11.902 1.00 1.42 O ATOM 1074 OE2 GLU A 63 -5.408 -2.346 11.774 1.00 1.30 O ATOM 0 H GLU A 63 -6.969 -1.424 7.885 1.00 0.48 H new ATOM 0 HA GLU A 63 -6.180 -3.919 6.703 1.00 0.55 H new ATOM 0 HB2 GLU A 63 -5.639 -4.545 8.953 1.00 0.65 H new ATOM 0 HB3 GLU A 63 -5.145 -2.878 8.737 1.00 0.65 H new ATOM 0 HG2 GLU A 63 -7.141 -2.090 9.932 1.00 0.68 H new ATOM 0 HG3 GLU A 63 -7.743 -3.730 10.067 1.00 0.68 H new ATOM 1081 N ALA A 64 -8.005 -5.573 7.526 1.00 0.58 N ATOM 1082 CA ALA A 64 -9.183 -6.427 7.616 1.00 0.58 C ATOM 1083 C ALA A 64 -9.542 -6.724 9.067 1.00 0.60 C ATOM 1084 O ALA A 64 -10.589 -7.309 9.352 1.00 0.65 O ATOM 1085 CB ALA A 64 -8.951 -7.721 6.852 1.00 0.64 C ATOM 0 H ALA A 64 -7.130 -6.077 7.385 1.00 0.58 H new ATOM 0 HA ALA A 64 -10.022 -5.895 7.167 1.00 0.58 H new ATOM 0 HB1 ALA A 64 -9.837 -8.351 6.926 1.00 0.64 H new ATOM 0 HB2 ALA A 64 -8.753 -7.494 5.804 1.00 0.64 H new ATOM 0 HB3 ALA A 64 -8.096 -8.246 7.277 1.00 0.64 H new ATOM 1091 N GLY A 65 -8.684 -6.291 9.982 1.00 0.64 N ATOM 1092 CA GLY A 65 -8.878 -6.585 11.391 1.00 0.70 C ATOM 1093 C GLY A 65 -9.809 -5.614 12.092 1.00 0.70 C ATOM 1094 O GLY A 65 -9.773 -5.495 13.317 1.00 0.84 O ATOM 0 H GLY A 65 -7.853 -5.738 9.773 1.00 0.64 H new ATOM 0 HA2 GLY A 65 -9.277 -7.594 11.491 1.00 0.70 H new ATOM 0 HA3 GLY A 65 -7.910 -6.574 11.892 1.00 0.70 H new ATOM 1098 N LYS A 66 -10.640 -4.916 11.327 1.00 0.60 N ATOM 1099 CA LYS A 66 -11.623 -4.010 11.896 1.00 0.61 C ATOM 1100 C LYS A 66 -12.672 -3.682 10.835 1.00 0.54 C ATOM 1101 O LYS A 66 -12.459 -3.944 9.644 1.00 0.47 O ATOM 1102 CB LYS A 66 -10.955 -2.729 12.429 1.00 0.66 C ATOM 1103 CG LYS A 66 -11.018 -1.548 11.481 1.00 0.60 C ATOM 1104 CD LYS A 66 -10.150 -1.756 10.263 1.00 0.56 C ATOM 1105 CE LYS A 66 -10.628 -0.906 9.106 1.00 0.61 C ATOM 1106 NZ LYS A 66 -9.638 -0.885 8.015 1.00 1.29 N ATOM 0 H LYS A 66 -10.650 -4.962 10.308 1.00 0.60 H new ATOM 0 HA LYS A 66 -12.108 -4.494 12.743 1.00 0.61 H new ATOM 0 HB2 LYS A 66 -11.431 -2.450 13.369 1.00 0.66 H new ATOM 0 HB3 LYS A 66 -9.910 -2.945 12.652 1.00 0.66 H new ATOM 0 HG2 LYS A 66 -12.050 -1.388 11.168 1.00 0.60 H new ATOM 0 HG3 LYS A 66 -10.700 -0.646 12.004 1.00 0.60 H new ATOM 0 HD2 LYS A 66 -9.116 -1.505 10.501 1.00 0.56 H new ATOM 0 HD3 LYS A 66 -10.164 -2.808 9.977 1.00 0.56 H new ATOM 0 HE2 LYS A 66 -11.576 -1.295 8.733 1.00 0.61 H new ATOM 0 HE3 LYS A 66 -10.814 0.111 9.451 1.00 0.61 H new ATOM 0 HZ1 LYS A 66 -10.021 -0.351 7.209 1.00 1.29 H new ATOM 0 HZ2 LYS A 66 -8.764 -0.430 8.348 1.00 1.29 H new ATOM 0 HZ3 LYS A 66 -9.429 -1.859 7.717 1.00 1.29 H new ATOM 1120 N ALA A 67 -13.792 -3.120 11.252 1.00 0.57 N ATOM 1121 CA ALA A 67 -14.870 -2.817 10.329 1.00 0.52 C ATOM 1122 C ALA A 67 -14.667 -1.458 9.659 1.00 0.47 C ATOM 1123 O ALA A 67 -13.710 -0.744 9.953 1.00 0.47 O ATOM 1124 CB ALA A 67 -16.204 -2.885 11.051 1.00 0.59 C ATOM 0 H ALA A 67 -13.978 -2.865 12.222 1.00 0.57 H new ATOM 0 HA ALA A 67 -14.867 -3.565 9.536 1.00 0.52 H new ATOM 0 HB1 ALA A 67 -17.008 -2.656 10.352 1.00 0.59 H new ATOM 0 HB2 ALA A 67 -16.348 -3.887 11.455 1.00 0.59 H new ATOM 0 HB3 ALA A 67 -16.214 -2.160 11.865 1.00 0.59 H new ATOM 1130 N LEU A 68 -15.566 -1.115 8.748 1.00 0.45 N ATOM 1131 CA LEU A 68 -15.457 0.124 7.983 1.00 0.40 C ATOM 1132 C LEU A 68 -15.849 1.329 8.836 1.00 0.43 C ATOM 1133 O LEU A 68 -15.097 2.297 8.946 1.00 0.44 O ATOM 1134 CB LEU A 68 -16.350 0.045 6.746 1.00 0.37 C ATOM 1135 CG LEU A 68 -15.986 -1.059 5.749 1.00 0.36 C ATOM 1136 CD1 LEU A 68 -16.999 -1.112 4.616 1.00 0.36 C ATOM 1137 CD2 LEU A 68 -14.584 -0.843 5.199 1.00 0.37 C ATOM 0 H LEU A 68 -16.384 -1.679 8.518 1.00 0.45 H new ATOM 0 HA LEU A 68 -14.419 0.250 7.674 1.00 0.40 H new ATOM 0 HB2 LEU A 68 -17.380 -0.105 7.070 1.00 0.37 H new ATOM 0 HB3 LEU A 68 -16.315 1.005 6.230 1.00 0.37 H new ATOM 0 HG LEU A 68 -16.006 -2.014 6.274 1.00 0.36 H new ATOM 0 HD11 LEU A 68 -16.723 -1.902 3.918 1.00 0.36 H new ATOM 0 HD12 LEU A 68 -17.989 -1.316 5.023 1.00 0.36 H new ATOM 0 HD13 LEU A 68 -17.011 -0.155 4.094 1.00 0.36 H new ATOM 0 HD21 LEU A 68 -14.344 -1.638 4.493 1.00 0.37 H new ATOM 0 HD22 LEU A 68 -14.537 0.120 4.691 1.00 0.37 H new ATOM 0 HD23 LEU A 68 -13.866 -0.857 6.019 1.00 0.37 H new ATOM 1149 N ASP A 69 -17.008 1.233 9.474 1.00 0.47 N ATOM 1150 CA ASP A 69 -17.570 2.338 10.252 1.00 0.52 C ATOM 1151 C ASP A 69 -16.805 2.512 11.560 1.00 0.58 C ATOM 1152 O ASP A 69 -17.018 3.469 12.304 1.00 0.65 O ATOM 1153 CB ASP A 69 -19.061 2.087 10.518 1.00 0.58 C ATOM 1154 CG ASP A 69 -19.709 3.133 11.411 1.00 0.86 C ATOM 1155 OD1 ASP A 69 -19.936 4.266 10.931 1.00 1.14 O ATOM 1156 OD2 ASP A 69 -19.973 2.841 12.596 1.00 1.16 O ATOM 0 H ASP A 69 -17.586 0.392 9.469 1.00 0.47 H new ATOM 0 HA ASP A 69 -17.472 3.260 9.680 1.00 0.52 H new ATOM 0 HB2 ASP A 69 -19.591 2.057 9.566 1.00 0.58 H new ATOM 0 HB3 ASP A 69 -19.178 1.106 10.979 1.00 0.58 H new ATOM 1161 N TYR A 70 -15.913 1.568 11.833 1.00 0.59 N ATOM 1162 CA TYR A 70 -15.011 1.667 12.960 1.00 0.65 C ATOM 1163 C TYR A 70 -14.190 2.944 12.846 1.00 0.62 C ATOM 1164 O TYR A 70 -13.950 3.640 13.831 1.00 0.67 O ATOM 1165 CB TYR A 70 -14.096 0.447 12.995 1.00 0.69 C ATOM 1166 CG TYR A 70 -13.120 0.476 14.131 1.00 0.81 C ATOM 1167 CD1 TYR A 70 -13.563 0.438 15.437 1.00 1.02 C ATOM 1168 CD2 TYR A 70 -11.761 0.563 13.896 1.00 0.84 C ATOM 1169 CE1 TYR A 70 -12.676 0.479 16.489 1.00 1.21 C ATOM 1170 CE2 TYR A 70 -10.861 0.608 14.938 1.00 1.05 C ATOM 1171 CZ TYR A 70 -11.322 0.565 16.236 1.00 1.22 C ATOM 1172 OH TYR A 70 -10.429 0.618 17.282 1.00 1.45 O ATOM 0 H TYR A 70 -15.799 0.719 11.279 1.00 0.59 H new ATOM 0 HA TYR A 70 -15.586 1.700 13.886 1.00 0.65 H new ATOM 0 HB2 TYR A 70 -14.705 -0.454 13.070 1.00 0.69 H new ATOM 0 HB3 TYR A 70 -13.548 0.384 12.055 1.00 0.69 H new ATOM 0 HD1 TYR A 70 -14.622 0.375 15.637 1.00 1.02 H new ATOM 0 HD2 TYR A 70 -11.399 0.596 12.879 1.00 0.84 H new ATOM 0 HE1 TYR A 70 -13.037 0.444 17.506 1.00 1.21 H new ATOM 0 HE2 TYR A 70 -9.802 0.676 14.739 1.00 1.05 H new ATOM 0 HH TYR A 70 -9.516 0.675 16.930 1.00 1.45 H new ATOM 1182 N TYR A 71 -13.757 3.236 11.629 1.00 0.57 N ATOM 1183 CA TYR A 71 -13.092 4.490 11.333 1.00 0.58 C ATOM 1184 C TYR A 71 -14.119 5.603 11.163 1.00 0.60 C ATOM 1185 O TYR A 71 -15.183 5.580 11.775 1.00 0.69 O ATOM 1186 CB TYR A 71 -12.228 4.351 10.078 1.00 0.56 C ATOM 1187 CG TYR A 71 -10.885 3.712 10.339 1.00 0.56 C ATOM 1188 CD1 TYR A 71 -10.765 2.334 10.466 1.00 0.62 C ATOM 1189 CD2 TYR A 71 -9.741 4.483 10.466 1.00 0.58 C ATOM 1190 CE1 TYR A 71 -9.539 1.744 10.713 1.00 0.66 C ATOM 1191 CE2 TYR A 71 -8.516 3.900 10.716 1.00 0.63 C ATOM 1192 CZ TYR A 71 -8.410 2.539 10.801 1.00 0.65 C ATOM 1193 OH TYR A 71 -7.196 1.967 11.103 1.00 0.72 O ATOM 0 H TYR A 71 -13.857 2.614 10.827 1.00 0.57 H new ATOM 0 HA TYR A 71 -12.441 4.749 12.168 1.00 0.58 H new ATOM 0 HB2 TYR A 71 -12.767 3.757 9.340 1.00 0.56 H new ATOM 0 HB3 TYR A 71 -12.073 5.338 9.642 1.00 0.56 H new ATOM 0 HD1 TYR A 71 -11.644 1.713 10.370 1.00 0.62 H new ATOM 0 HD2 TYR A 71 -9.809 5.556 10.368 1.00 0.58 H new ATOM 0 HE1 TYR A 71 -9.464 0.674 10.836 1.00 0.66 H new ATOM 0 HE2 TYR A 71 -7.640 4.519 10.845 1.00 0.63 H new ATOM 0 HH TYR A 71 -6.504 2.661 11.126 1.00 0.72 H new ATOM 1203 N MET A 72 -13.802 6.576 10.333 1.00 0.60 N ATOM 1204 CA MET A 72 -14.667 7.731 10.145 1.00 0.69 C ATOM 1205 C MET A 72 -15.490 7.609 8.865 1.00 0.63 C ATOM 1206 O MET A 72 -15.969 8.610 8.334 1.00 0.75 O ATOM 1207 CB MET A 72 -13.819 9.001 10.101 1.00 0.83 C ATOM 1208 CG MET A 72 -13.078 9.279 11.400 1.00 1.02 C ATOM 1209 SD MET A 72 -11.896 10.634 11.254 1.00 1.73 S ATOM 1210 CE MET A 72 -12.969 11.985 10.774 1.00 2.38 C ATOM 0 H MET A 72 -12.949 6.593 9.774 1.00 0.60 H new ATOM 0 HA MET A 72 -15.361 7.779 10.984 1.00 0.69 H new ATOM 0 HB2 MET A 72 -13.096 8.918 9.290 1.00 0.83 H new ATOM 0 HB3 MET A 72 -14.462 9.850 9.869 1.00 0.83 H new ATOM 0 HG2 MET A 72 -13.800 9.515 12.182 1.00 1.02 H new ATOM 0 HG3 MET A 72 -12.553 8.377 11.714 1.00 1.02 H new ATOM 0 HE1 MET A 72 -12.437 12.930 10.887 1.00 2.38 H new ATOM 0 HE2 MET A 72 -13.269 11.859 9.734 1.00 2.38 H new ATOM 0 HE3 MET A 72 -13.855 11.989 11.409 1.00 2.38 H new ATOM 1220 N LEU A 73 -15.678 6.384 8.380 1.00 0.56 N ATOM 1221 CA LEU A 73 -16.383 6.189 7.115 1.00 0.54 C ATOM 1222 C LEU A 73 -17.871 6.089 7.337 1.00 0.50 C ATOM 1223 O LEU A 73 -18.338 5.538 8.333 1.00 0.60 O ATOM 1224 CB LEU A 73 -15.929 4.941 6.347 1.00 0.71 C ATOM 1225 CG LEU A 73 -14.582 4.329 6.729 1.00 0.43 C ATOM 1226 CD1 LEU A 73 -14.285 3.148 5.823 1.00 0.88 C ATOM 1227 CD2 LEU A 73 -13.463 5.349 6.641 1.00 0.88 C ATOM 0 H LEU A 73 -15.360 5.527 8.832 1.00 0.56 H new ATOM 0 HA LEU A 73 -16.138 7.065 6.514 1.00 0.54 H new ATOM 0 HB2 LEU A 73 -16.694 4.174 6.469 1.00 0.71 H new ATOM 0 HB3 LEU A 73 -15.896 5.192 5.287 1.00 0.71 H new ATOM 0 HG LEU A 73 -14.641 3.992 7.764 1.00 0.43 H new ATOM 0 HD11 LEU A 73 -13.324 2.712 6.096 1.00 0.88 H new ATOM 0 HD12 LEU A 73 -15.068 2.398 5.934 1.00 0.88 H new ATOM 0 HD13 LEU A 73 -14.249 3.484 4.787 1.00 0.88 H new ATOM 0 HD21 LEU A 73 -12.520 4.879 6.919 1.00 0.88 H new ATOM 0 HD22 LEU A 73 -13.393 5.726 5.621 1.00 0.88 H new ATOM 0 HD23 LEU A 73 -13.671 6.176 7.320 1.00 0.88 H new ATOM 1239 N ARG A 74 -18.590 6.626 6.382 1.00 0.48 N ATOM 1240 CA ARG A 74 -20.031 6.623 6.372 1.00 0.52 C ATOM 1241 C ARG A 74 -20.517 7.051 4.998 1.00 0.46 C ATOM 1242 O ARG A 74 -19.749 7.060 4.034 1.00 0.45 O ATOM 1243 CB ARG A 74 -20.600 7.524 7.487 1.00 0.65 C ATOM 1244 CG ARG A 74 -19.861 8.843 7.709 1.00 1.17 C ATOM 1245 CD ARG A 74 -20.110 9.850 6.597 1.00 1.64 C ATOM 1246 NE ARG A 74 -18.875 10.221 5.912 1.00 2.05 N ATOM 1247 CZ ARG A 74 -18.588 11.452 5.490 1.00 2.72 C ATOM 1248 NH1 ARG A 74 -19.459 12.442 5.662 1.00 2.96 N ATOM 1249 NH2 ARG A 74 -17.428 11.687 4.890 1.00 3.29 N ATOM 0 H ARG A 74 -18.179 7.088 5.571 1.00 0.48 H new ATOM 0 HA ARG A 74 -20.392 5.615 6.575 1.00 0.52 H new ATOM 0 HB2 ARG A 74 -21.642 7.746 7.254 1.00 0.65 H new ATOM 0 HB3 ARG A 74 -20.595 6.963 8.422 1.00 0.65 H new ATOM 0 HG2 ARG A 74 -20.173 9.274 8.660 1.00 1.17 H new ATOM 0 HG3 ARG A 74 -18.791 8.647 7.783 1.00 1.17 H new ATOM 0 HD2 ARG A 74 -20.812 9.430 5.877 1.00 1.64 H new ATOM 0 HD3 ARG A 74 -20.576 10.743 7.013 1.00 1.64 H new ATOM 0 HE ARG A 74 -18.185 9.488 5.745 1.00 2.05 H new ATOM 0 HH11 ARG A 74 -20.353 12.261 6.119 1.00 2.96 H new ATOM 0 HH12 ARG A 74 -19.233 13.382 5.337 1.00 2.96 H new ATOM 0 HH21 ARG A 74 -16.761 10.927 4.754 1.00 3.29 H new ATOM 0 HH22 ARG A 74 -17.203 12.627 4.565 1.00 3.29 H new ATOM 1263 N ASN A 75 -21.781 7.396 4.910 1.00 0.49 N ATOM 1264 CA ASN A 75 -22.386 7.787 3.642 1.00 0.47 C ATOM 1265 C ASN A 75 -21.740 9.049 3.082 1.00 0.48 C ATOM 1266 O ASN A 75 -21.962 10.152 3.584 1.00 0.56 O ATOM 1267 CB ASN A 75 -23.892 7.986 3.809 1.00 0.52 C ATOM 1268 CG ASN A 75 -24.652 6.678 3.726 1.00 0.52 C ATOM 1269 OD1 ASN A 75 -25.134 6.298 2.665 1.00 0.72 O ATOM 1270 ND2 ASN A 75 -24.743 5.966 4.832 1.00 0.51 N ATOM 0 H ASN A 75 -22.421 7.416 5.704 1.00 0.49 H new ATOM 0 HA ASN A 75 -22.215 6.981 2.928 1.00 0.47 H new ATOM 0 HB2 ASN A 75 -24.090 8.460 4.770 1.00 0.52 H new ATOM 0 HB3 ASN A 75 -24.255 8.665 3.038 1.00 0.52 H new ATOM 0 HD21 ASN A 75 -25.227 5.068 4.822 1.00 0.51 H new ATOM 0 HD22 ASN A 75 -24.330 6.313 5.698 1.00 0.51 H new ATOM 1277 N GLY A 76 -20.922 8.877 2.051 1.00 0.45 N ATOM 1278 CA GLY A 76 -20.294 10.012 1.413 1.00 0.51 C ATOM 1279 C GLY A 76 -18.819 9.802 1.138 1.00 0.47 C ATOM 1280 O GLY A 76 -18.251 10.463 0.264 1.00 0.55 O ATOM 0 H GLY A 76 -20.684 7.971 1.647 1.00 0.45 H new ATOM 0 HA2 GLY A 76 -20.806 10.222 0.474 1.00 0.51 H new ATOM 0 HA3 GLY A 76 -20.417 10.891 2.046 1.00 0.51 H new ATOM 1284 N ASP A 77 -18.188 8.884 1.864 1.00 0.42 N ATOM 1285 CA ASP A 77 -16.748 8.679 1.732 1.00 0.42 C ATOM 1286 C ASP A 77 -16.401 7.914 0.461 1.00 0.38 C ATOM 1287 O ASP A 77 -17.179 7.092 -0.025 1.00 0.40 O ATOM 1288 CB ASP A 77 -16.184 7.934 2.943 1.00 0.44 C ATOM 1289 CG ASP A 77 -16.328 8.724 4.224 1.00 0.74 C ATOM 1290 OD1 ASP A 77 -15.564 9.692 4.426 1.00 1.05 O ATOM 1291 OD2 ASP A 77 -17.215 8.396 5.026 1.00 1.00 O ATOM 0 H ASP A 77 -18.645 8.275 2.543 1.00 0.42 H new ATOM 0 HA ASP A 77 -16.294 9.668 1.676 1.00 0.42 H new ATOM 0 HB2 ASP A 77 -16.697 6.978 3.049 1.00 0.44 H new ATOM 0 HB3 ASP A 77 -15.130 7.713 2.772 1.00 0.44 H new ATOM 1296 N THR A 78 -15.234 8.213 -0.083 1.00 0.36 N ATOM 1297 CA THR A 78 -14.700 7.483 -1.215 1.00 0.35 C ATOM 1298 C THR A 78 -13.717 6.431 -0.724 1.00 0.31 C ATOM 1299 O THR A 78 -12.858 6.719 0.110 1.00 0.34 O ATOM 1300 CB THR A 78 -13.982 8.436 -2.191 1.00 0.42 C ATOM 1301 OG1 THR A 78 -14.899 9.443 -2.639 1.00 0.50 O ATOM 1302 CG2 THR A 78 -13.413 7.685 -3.388 1.00 0.42 C ATOM 0 H THR A 78 -14.633 8.967 0.248 1.00 0.36 H new ATOM 0 HA THR A 78 -15.527 7.004 -1.739 1.00 0.35 H new ATOM 0 HB THR A 78 -13.150 8.901 -1.662 1.00 0.42 H new ATOM 0 HG1 THR A 78 -14.442 10.050 -3.258 1.00 0.50 H new ATOM 0 HG21 THR A 78 -12.914 8.388 -4.055 1.00 0.42 H new ATOM 0 HG22 THR A 78 -12.696 6.941 -3.043 1.00 0.42 H new ATOM 0 HG23 THR A 78 -14.222 7.188 -3.924 1.00 0.42 H new ATOM 1310 N MET A 79 -13.834 5.221 -1.237 1.00 0.27 N ATOM 1311 CA MET A 79 -12.939 4.156 -0.850 1.00 0.27 C ATOM 1312 C MET A 79 -12.378 3.507 -2.101 1.00 0.28 C ATOM 1313 O MET A 79 -13.100 2.876 -2.873 1.00 0.27 O ATOM 1314 CB MET A 79 -13.659 3.122 0.016 1.00 0.23 C ATOM 1315 CG MET A 79 -12.707 2.217 0.781 1.00 0.27 C ATOM 1316 SD MET A 79 -13.562 0.997 1.795 1.00 0.65 S ATOM 1317 CE MET A 79 -14.252 -0.061 0.531 1.00 0.24 C ATOM 0 H MET A 79 -14.541 4.955 -1.922 1.00 0.27 H new ATOM 0 HA MET A 79 -12.125 4.570 -0.255 1.00 0.27 H new ATOM 0 HB2 MET A 79 -14.307 3.638 0.724 1.00 0.23 H new ATOM 0 HB3 MET A 79 -14.302 2.511 -0.618 1.00 0.23 H new ATOM 0 HG2 MET A 79 -12.056 1.703 0.074 1.00 0.27 H new ATOM 0 HG3 MET A 79 -12.067 2.827 1.418 1.00 0.27 H new ATOM 0 HE1 MET A 79 -14.234 -1.096 0.873 1.00 0.24 H new ATOM 0 HE2 MET A 79 -15.281 0.237 0.329 1.00 0.24 H new ATOM 0 HE3 MET A 79 -13.662 0.030 -0.381 1.00 0.24 H new ATOM 1327 N GLU A 80 -11.094 3.695 -2.302 1.00 0.32 N ATOM 1328 CA GLU A 80 -10.421 3.173 -3.470 1.00 0.35 C ATOM 1329 C GLU A 80 -10.085 1.704 -3.266 1.00 0.33 C ATOM 1330 O GLU A 80 -9.447 1.337 -2.276 1.00 0.33 O ATOM 1331 CB GLU A 80 -9.144 3.979 -3.719 1.00 0.40 C ATOM 1332 CG GLU A 80 -9.217 4.907 -4.918 1.00 0.53 C ATOM 1333 CD GLU A 80 -8.014 5.822 -5.016 1.00 0.69 C ATOM 1334 OE1 GLU A 80 -6.944 5.368 -5.473 1.00 1.04 O ATOM 1335 OE2 GLU A 80 -8.135 7.008 -4.646 1.00 1.04 O ATOM 0 H GLU A 80 -10.489 4.212 -1.664 1.00 0.32 H new ATOM 0 HA GLU A 80 -11.077 3.260 -4.336 1.00 0.35 H new ATOM 0 HB2 GLU A 80 -8.921 4.569 -2.830 1.00 0.40 H new ATOM 0 HB3 GLU A 80 -8.313 3.288 -3.859 1.00 0.40 H new ATOM 0 HG2 GLU A 80 -9.293 4.313 -5.829 1.00 0.53 H new ATOM 0 HG3 GLU A 80 -10.123 5.509 -4.853 1.00 0.53 H new ATOM 1342 N TYR A 81 -10.501 0.857 -4.194 1.00 0.33 N ATOM 1343 CA TYR A 81 -10.109 -0.535 -4.157 1.00 0.33 C ATOM 1344 C TYR A 81 -8.903 -0.686 -5.051 1.00 0.36 C ATOM 1345 O TYR A 81 -9.017 -0.666 -6.275 1.00 0.39 O ATOM 1346 CB TYR A 81 -11.249 -1.448 -4.632 1.00 0.33 C ATOM 1347 CG TYR A 81 -10.986 -2.932 -4.430 1.00 0.33 C ATOM 1348 CD1 TYR A 81 -11.269 -3.543 -3.216 1.00 0.34 C ATOM 1349 CD2 TYR A 81 -10.467 -3.722 -5.450 1.00 0.37 C ATOM 1350 CE1 TYR A 81 -11.042 -4.892 -3.020 1.00 0.36 C ATOM 1351 CE2 TYR A 81 -10.238 -5.075 -5.262 1.00 0.39 C ATOM 1352 CZ TYR A 81 -10.527 -5.653 -4.045 1.00 0.38 C ATOM 1353 OH TYR A 81 -10.301 -6.999 -3.851 1.00 0.42 O ATOM 0 H TYR A 81 -11.106 1.110 -4.975 1.00 0.33 H new ATOM 0 HA TYR A 81 -9.873 -0.830 -3.135 1.00 0.33 H new ATOM 0 HB2 TYR A 81 -12.161 -1.177 -4.101 1.00 0.33 H new ATOM 0 HB3 TYR A 81 -11.430 -1.264 -5.691 1.00 0.33 H new ATOM 0 HD1 TYR A 81 -11.675 -2.952 -2.408 1.00 0.34 H new ATOM 0 HD2 TYR A 81 -10.239 -3.273 -6.405 1.00 0.37 H new ATOM 0 HE1 TYR A 81 -11.268 -5.347 -2.067 1.00 0.36 H new ATOM 0 HE2 TYR A 81 -9.835 -5.674 -6.065 1.00 0.39 H new ATOM 0 HH TYR A 81 -10.597 -7.254 -2.952 1.00 0.42 H new ATOM 1363 N ARG A 82 -7.750 -0.804 -4.441 1.00 0.37 N ATOM 1364 CA ARG A 82 -6.515 -0.808 -5.198 1.00 0.39 C ATOM 1365 C ARG A 82 -5.617 -1.932 -4.754 1.00 0.40 C ATOM 1366 O ARG A 82 -5.874 -2.602 -3.751 1.00 0.42 O ATOM 1367 CB ARG A 82 -5.770 0.528 -5.090 1.00 0.42 C ATOM 1368 CG ARG A 82 -5.486 0.978 -3.669 1.00 0.44 C ATOM 1369 CD ARG A 82 -4.393 2.034 -3.641 1.00 0.56 C ATOM 1370 NE ARG A 82 -3.063 1.458 -3.872 1.00 0.65 N ATOM 1371 CZ ARG A 82 -2.058 2.099 -4.476 1.00 0.88 C ATOM 1372 NH1 ARG A 82 -2.269 3.265 -5.074 1.00 1.08 N ATOM 1373 NH2 ARG A 82 -0.845 1.554 -4.509 1.00 1.03 N ATOM 0 H ARG A 82 -7.637 -0.898 -3.432 1.00 0.37 H new ATOM 0 HA ARG A 82 -6.785 -0.958 -6.243 1.00 0.39 H new ATOM 0 HB2 ARG A 82 -4.825 0.447 -5.627 1.00 0.42 H new ATOM 0 HB3 ARG A 82 -6.357 1.298 -5.591 1.00 0.42 H new ATOM 0 HG2 ARG A 82 -6.396 1.379 -3.222 1.00 0.44 H new ATOM 0 HG3 ARG A 82 -5.185 0.122 -3.066 1.00 0.44 H new ATOM 0 HD2 ARG A 82 -4.598 2.788 -4.401 1.00 0.56 H new ATOM 0 HD3 ARG A 82 -4.405 2.542 -2.677 1.00 0.56 H new ATOM 0 HE ARG A 82 -2.895 0.505 -3.550 1.00 0.65 H new ATOM 0 HH11 ARG A 82 -3.202 3.677 -5.074 1.00 1.08 H new ATOM 0 HH12 ARG A 82 -1.498 3.750 -5.533 1.00 1.08 H new ATOM 0 HH21 ARG A 82 -0.682 0.646 -4.073 1.00 1.03 H new ATOM 0 HH22 ARG A 82 -0.078 2.044 -4.970 1.00 1.03 H new ATOM 1387 N LYS A 83 -4.562 -2.130 -5.510 1.00 0.43 N ATOM 1388 CA LYS A 83 -3.588 -3.141 -5.200 1.00 0.45 C ATOM 1389 C LYS A 83 -2.836 -2.727 -3.943 1.00 0.42 C ATOM 1390 O LYS A 83 -2.357 -1.596 -3.844 1.00 0.42 O ATOM 1391 CB LYS A 83 -2.647 -3.313 -6.397 1.00 0.53 C ATOM 1392 CG LYS A 83 -1.768 -4.547 -6.345 1.00 0.60 C ATOM 1393 CD LYS A 83 -1.156 -4.833 -7.704 1.00 0.70 C ATOM 1394 CE LYS A 83 -0.194 -6.007 -7.654 1.00 1.25 C ATOM 1395 NZ LYS A 83 0.314 -6.356 -9.005 1.00 1.74 N ATOM 0 H LYS A 83 -4.358 -1.595 -6.354 1.00 0.43 H new ATOM 0 HA LYS A 83 -4.067 -4.101 -5.010 1.00 0.45 H new ATOM 0 HB2 LYS A 83 -3.244 -3.348 -7.308 1.00 0.53 H new ATOM 0 HB3 LYS A 83 -2.008 -2.432 -6.468 1.00 0.53 H new ATOM 0 HG2 LYS A 83 -0.977 -4.405 -5.608 1.00 0.60 H new ATOM 0 HG3 LYS A 83 -2.357 -5.404 -6.019 1.00 0.60 H new ATOM 0 HD2 LYS A 83 -1.948 -5.043 -8.422 1.00 0.70 H new ATOM 0 HD3 LYS A 83 -0.630 -3.947 -8.059 1.00 0.70 H new ATOM 0 HE2 LYS A 83 0.644 -5.764 -7.001 1.00 1.25 H new ATOM 0 HE3 LYS A 83 -0.696 -6.871 -7.219 1.00 1.25 H new ATOM 0 HZ1 LYS A 83 0.994 -7.139 -8.929 1.00 1.74 H new ATOM 0 HZ2 LYS A 83 -0.481 -6.645 -9.611 1.00 1.74 H new ATOM 0 HZ3 LYS A 83 0.785 -5.529 -9.423 1.00 1.74 H new ATOM 1409 N LYS A 84 -2.782 -3.633 -2.973 1.00 0.44 N ATOM 1410 CA LYS A 84 -2.067 -3.395 -1.725 1.00 0.46 C ATOM 1411 C LYS A 84 -0.606 -3.129 -2.016 1.00 0.46 C ATOM 1412 O LYS A 84 0.092 -2.482 -1.244 1.00 0.52 O ATOM 1413 CB LYS A 84 -2.187 -4.605 -0.798 1.00 0.54 C ATOM 1414 CG LYS A 84 -3.545 -4.745 -0.134 1.00 0.55 C ATOM 1415 CD LYS A 84 -3.839 -3.559 0.767 1.00 0.66 C ATOM 1416 CE LYS A 84 -4.017 -3.976 2.219 1.00 0.67 C ATOM 1417 NZ LYS A 84 -2.829 -4.701 2.745 1.00 1.32 N ATOM 0 H LYS A 84 -3.230 -4.548 -3.029 1.00 0.44 H new ATOM 0 HA LYS A 84 -2.508 -2.528 -1.233 1.00 0.46 H new ATOM 0 HB2 LYS A 84 -1.979 -5.509 -1.370 1.00 0.54 H new ATOM 0 HB3 LYS A 84 -1.422 -4.534 -0.025 1.00 0.54 H new ATOM 0 HG2 LYS A 84 -4.319 -4.827 -0.897 1.00 0.55 H new ATOM 0 HG3 LYS A 84 -3.574 -5.665 0.450 1.00 0.55 H new ATOM 0 HD2 LYS A 84 -3.025 -2.838 0.694 1.00 0.66 H new ATOM 0 HD3 LYS A 84 -4.742 -3.056 0.421 1.00 0.66 H new ATOM 0 HE2 LYS A 84 -4.201 -3.092 2.829 1.00 0.67 H new ATOM 0 HE3 LYS A 84 -4.897 -4.613 2.307 1.00 0.67 H new ATOM 0 HZ1 LYS A 84 -2.750 -4.541 3.770 1.00 1.32 H new ATOM 0 HZ2 LYS A 84 -2.934 -5.719 2.560 1.00 1.32 H new ATOM 0 HZ3 LYS A 84 -1.971 -4.350 2.273 1.00 1.32 H new ATOM 1431 N GLN A 85 -0.161 -3.652 -3.140 1.00 0.44 N ATOM 1432 CA GLN A 85 1.192 -3.474 -3.610 1.00 0.47 C ATOM 1433 C GLN A 85 1.284 -2.203 -4.443 1.00 0.52 C ATOM 1434 O GLN A 85 0.386 -1.909 -5.234 1.00 0.83 O ATOM 1435 CB GLN A 85 1.585 -4.653 -4.510 1.00 0.53 C ATOM 1436 CG GLN A 85 0.915 -5.973 -4.159 1.00 0.50 C ATOM 1437 CD GLN A 85 1.657 -6.754 -3.102 1.00 0.64 C ATOM 1438 OE1 GLN A 85 2.517 -7.570 -3.412 1.00 1.10 O ATOM 1439 NE2 GLN A 85 1.345 -6.499 -1.849 1.00 0.72 N ATOM 0 H GLN A 85 -0.739 -4.220 -3.759 1.00 0.44 H new ATOM 0 HA GLN A 85 1.855 -3.413 -2.747 1.00 0.47 H new ATOM 0 HB2 GLN A 85 1.342 -4.401 -5.542 1.00 0.53 H new ATOM 0 HB3 GLN A 85 2.666 -4.786 -4.460 1.00 0.53 H new ATOM 0 HG2 GLN A 85 -0.099 -5.777 -3.812 1.00 0.50 H new ATOM 0 HG3 GLN A 85 0.832 -6.581 -5.060 1.00 0.50 H new ATOM 0 HE21 GLN A 85 0.623 -5.812 -1.633 1.00 0.72 H new ATOM 0 HE22 GLN A 85 1.826 -6.988 -1.094 1.00 0.72 H new ATOM 1448 N ARG A 86 2.355 -1.459 -4.278 1.00 0.50 N ATOM 1449 CA ARG A 86 2.640 -0.343 -5.167 1.00 0.52 C ATOM 1450 C ARG A 86 3.868 -0.668 -6.007 1.00 0.50 C ATOM 1451 O ARG A 86 4.679 -1.507 -5.605 1.00 0.53 O ATOM 1452 CB ARG A 86 2.835 0.955 -4.368 1.00 0.67 C ATOM 1453 CG ARG A 86 3.959 0.921 -3.339 1.00 0.85 C ATOM 1454 CD ARG A 86 5.329 1.123 -3.967 1.00 0.98 C ATOM 1455 NE ARG A 86 6.129 2.078 -3.207 1.00 1.13 N ATOM 1456 CZ ARG A 86 6.929 2.993 -3.757 1.00 1.24 C ATOM 1457 NH1 ARG A 86 7.137 3.013 -5.070 1.00 1.62 N ATOM 1458 NH2 ARG A 86 7.545 3.879 -2.985 1.00 1.85 N ATOM 0 H ARG A 86 3.044 -1.602 -3.540 1.00 0.50 H new ATOM 0 HA ARG A 86 1.792 -0.187 -5.833 1.00 0.52 H new ATOM 0 HB2 ARG A 86 3.029 1.768 -5.068 1.00 0.67 H new ATOM 0 HB3 ARG A 86 1.902 1.191 -3.856 1.00 0.67 H new ATOM 0 HG2 ARG A 86 3.787 1.696 -2.592 1.00 0.85 H new ATOM 0 HG3 ARG A 86 3.940 -0.035 -2.816 1.00 0.85 H new ATOM 0 HD2 ARG A 86 5.852 0.168 -4.018 1.00 0.98 H new ATOM 0 HD3 ARG A 86 5.213 1.478 -4.991 1.00 0.98 H new ATOM 0 HE ARG A 86 6.073 2.044 -2.189 1.00 1.13 H new ATOM 0 HH11 ARG A 86 6.683 2.324 -5.669 1.00 1.62 H new ATOM 0 HH12 ARG A 86 7.751 3.718 -5.478 1.00 1.62 H new ATOM 0 HH21 ARG A 86 7.406 3.859 -1.975 1.00 1.85 H new ATOM 0 HH22 ARG A 86 8.157 4.580 -3.402 1.00 1.85 H new ATOM 1472 N PRO A 87 4.019 -0.046 -7.189 1.00 0.52 N ATOM 1473 CA PRO A 87 5.191 -0.265 -8.033 1.00 0.52 C ATOM 1474 C PRO A 87 6.445 0.251 -7.347 1.00 0.53 C ATOM 1475 O PRO A 87 6.682 1.456 -7.275 1.00 0.62 O ATOM 1476 CB PRO A 87 4.898 0.529 -9.313 1.00 0.57 C ATOM 1477 CG PRO A 87 3.442 0.860 -9.254 1.00 0.86 C ATOM 1478 CD PRO A 87 3.074 0.901 -7.797 1.00 0.60 C ATOM 0 HA PRO A 87 5.367 -1.321 -8.238 1.00 0.52 H new ATOM 0 HB2 PRO A 87 5.504 1.434 -9.361 1.00 0.57 H new ATOM 0 HB3 PRO A 87 5.131 -0.058 -10.201 1.00 0.57 H new ATOM 0 HG2 PRO A 87 3.242 1.819 -9.732 1.00 0.86 H new ATOM 0 HG3 PRO A 87 2.852 0.111 -9.783 1.00 0.86 H new ATOM 0 HD2 PRO A 87 3.183 1.903 -7.381 1.00 0.60 H new ATOM 0 HD3 PRO A 87 2.039 0.599 -7.634 1.00 0.60 H new ATOM 1486 N LEU A 88 7.213 -0.665 -6.793 1.00 0.50 N ATOM 1487 CA LEU A 88 8.373 -0.311 -5.999 1.00 0.53 C ATOM 1488 C LEU A 88 9.644 -0.428 -6.827 1.00 0.44 C ATOM 1489 O LEU A 88 10.010 -1.521 -7.260 1.00 0.42 O ATOM 1490 CB LEU A 88 8.448 -1.234 -4.785 1.00 0.63 C ATOM 1491 CG LEU A 88 9.485 -0.867 -3.731 1.00 0.88 C ATOM 1492 CD1 LEU A 88 9.038 0.341 -2.924 1.00 1.19 C ATOM 1493 CD2 LEU A 88 9.729 -2.052 -2.823 1.00 1.51 C ATOM 0 H LEU A 88 7.053 -1.669 -6.879 1.00 0.50 H new ATOM 0 HA LEU A 88 8.279 0.723 -5.667 1.00 0.53 H new ATOM 0 HB2 LEU A 88 7.468 -1.257 -4.309 1.00 0.63 H new ATOM 0 HB3 LEU A 88 8.656 -2.245 -5.134 1.00 0.63 H new ATOM 0 HG LEU A 88 10.416 -0.604 -4.234 1.00 0.88 H new ATOM 0 HD11 LEU A 88 9.796 0.582 -2.179 1.00 1.19 H new ATOM 0 HD12 LEU A 88 8.901 1.193 -3.590 1.00 1.19 H new ATOM 0 HD13 LEU A 88 8.096 0.116 -2.424 1.00 1.19 H new ATOM 0 HD21 LEU A 88 10.471 -1.787 -2.070 1.00 1.51 H new ATOM 0 HD22 LEU A 88 8.797 -2.332 -2.331 1.00 1.51 H new ATOM 0 HD23 LEU A 88 10.095 -2.893 -3.412 1.00 1.51 H new ATOM 1505 N LYS A 89 10.311 0.695 -7.054 1.00 0.44 N ATOM 1506 CA LYS A 89 11.568 0.691 -7.783 1.00 0.42 C ATOM 1507 C LYS A 89 12.733 0.642 -6.815 1.00 0.39 C ATOM 1508 O LYS A 89 12.881 1.520 -5.965 1.00 0.42 O ATOM 1509 CB LYS A 89 11.700 1.912 -8.703 1.00 0.51 C ATOM 1510 CG LYS A 89 10.996 1.748 -10.041 1.00 0.69 C ATOM 1511 CD LYS A 89 9.492 1.939 -9.930 1.00 0.93 C ATOM 1512 CE LYS A 89 9.122 3.411 -9.872 1.00 1.49 C ATOM 1513 NZ LYS A 89 9.608 4.143 -11.071 1.00 2.11 N ATOM 0 H LYS A 89 10.003 1.617 -6.744 1.00 0.44 H new ATOM 0 HA LYS A 89 11.580 -0.199 -8.412 1.00 0.42 H new ATOM 0 HB2 LYS A 89 11.294 2.786 -8.193 1.00 0.51 H new ATOM 0 HB3 LYS A 89 12.757 2.110 -8.880 1.00 0.51 H new ATOM 0 HG2 LYS A 89 11.400 2.469 -10.752 1.00 0.69 H new ATOM 0 HG3 LYS A 89 11.205 0.755 -10.440 1.00 0.69 H new ATOM 0 HD2 LYS A 89 9.001 1.472 -10.784 1.00 0.93 H new ATOM 0 HD3 LYS A 89 9.125 1.435 -9.036 1.00 0.93 H new ATOM 0 HE2 LYS A 89 8.039 3.512 -9.797 1.00 1.49 H new ATOM 0 HE3 LYS A 89 9.547 3.859 -8.974 1.00 1.49 H new ATOM 0 HZ1 LYS A 89 9.007 4.976 -11.236 1.00 2.11 H new ATOM 0 HZ2 LYS A 89 10.590 4.449 -10.916 1.00 2.11 H new ATOM 0 HZ3 LYS A 89 9.567 3.517 -11.900 1.00 2.11 H new ATOM 1527 N ILE A 90 13.555 -0.382 -6.961 1.00 0.36 N ATOM 1528 CA ILE A 90 14.690 -0.591 -6.080 1.00 0.33 C ATOM 1529 C ILE A 90 15.957 -0.701 -6.899 1.00 0.35 C ATOM 1530 O ILE A 90 15.984 -1.403 -7.907 1.00 0.36 O ATOM 1531 CB ILE A 90 14.547 -1.877 -5.230 1.00 0.32 C ATOM 1532 CG1 ILE A 90 13.233 -1.864 -4.443 1.00 0.35 C ATOM 1533 CG2 ILE A 90 15.733 -2.027 -4.280 1.00 0.33 C ATOM 1534 CD1 ILE A 90 13.128 -0.725 -3.446 1.00 0.36 C ATOM 0 H ILE A 90 13.455 -1.089 -7.690 1.00 0.36 H new ATOM 0 HA ILE A 90 14.731 0.264 -5.405 1.00 0.33 H new ATOM 0 HB ILE A 90 14.534 -2.731 -5.907 1.00 0.32 H new ATOM 0 HG12 ILE A 90 12.401 -1.799 -5.144 1.00 0.35 H new ATOM 0 HG13 ILE A 90 13.129 -2.810 -3.912 1.00 0.35 H new ATOM 0 HG21 ILE A 90 15.615 -2.936 -3.691 1.00 0.33 H new ATOM 0 HG22 ILE A 90 16.656 -2.086 -4.857 1.00 0.33 H new ATOM 0 HG23 ILE A 90 15.776 -1.166 -3.613 1.00 0.33 H new ATOM 0 HD11 ILE A 90 12.171 -0.782 -2.928 1.00 0.36 H new ATOM 0 HD12 ILE A 90 13.938 -0.800 -2.721 1.00 0.36 H new ATOM 0 HD13 ILE A 90 13.199 0.227 -3.972 1.00 0.36 H new ATOM 1546 N ARG A 91 16.999 -0.008 -6.482 1.00 0.38 N ATOM 1547 CA ARG A 91 18.294 -0.153 -7.104 1.00 0.43 C ATOM 1548 C ARG A 91 19.233 -0.827 -6.108 1.00 0.42 C ATOM 1549 O ARG A 91 19.530 -0.279 -5.046 1.00 0.44 O ATOM 1550 CB ARG A 91 18.842 1.206 -7.542 1.00 0.52 C ATOM 1551 CG ARG A 91 20.052 1.112 -8.452 1.00 0.57 C ATOM 1552 CD ARG A 91 20.471 2.479 -8.972 1.00 0.74 C ATOM 1553 NE ARG A 91 19.424 3.112 -9.778 1.00 0.72 N ATOM 1554 CZ ARG A 91 19.398 3.093 -11.113 1.00 1.09 C ATOM 1555 NH1 ARG A 91 20.318 2.414 -11.790 1.00 1.82 N ATOM 1556 NH2 ARG A 91 18.444 3.736 -11.772 1.00 1.12 N ATOM 0 H ARG A 91 16.970 0.662 -5.713 1.00 0.38 H new ATOM 0 HA ARG A 91 18.208 -0.768 -8.000 1.00 0.43 H new ATOM 0 HB2 ARG A 91 18.054 1.757 -8.056 1.00 0.52 H new ATOM 0 HB3 ARG A 91 19.109 1.783 -6.656 1.00 0.52 H new ATOM 0 HG2 ARG A 91 20.882 0.659 -7.909 1.00 0.57 H new ATOM 0 HG3 ARG A 91 19.825 0.456 -9.293 1.00 0.57 H new ATOM 0 HD2 ARG A 91 20.719 3.125 -8.130 1.00 0.74 H new ATOM 0 HD3 ARG A 91 21.375 2.376 -9.572 1.00 0.74 H new ATOM 0 HE ARG A 91 18.670 3.596 -9.290 1.00 0.72 H new ATOM 0 HH11 ARG A 91 21.047 1.905 -11.290 1.00 1.82 H new ATOM 0 HH12 ARG A 91 20.295 2.402 -12.810 1.00 1.82 H new ATOM 0 HH21 ARG A 91 17.726 4.248 -11.259 1.00 1.12 H new ATOM 0 HH22 ARG A 91 18.428 3.719 -12.792 1.00 1.12 H new ATOM 1570 N MET A 92 19.660 -2.032 -6.442 1.00 0.42 N ATOM 1571 CA MET A 92 20.467 -2.840 -5.538 1.00 0.44 C ATOM 1572 C MET A 92 21.955 -2.557 -5.719 1.00 0.48 C ATOM 1573 O MET A 92 22.337 -1.709 -6.530 1.00 0.51 O ATOM 1574 CB MET A 92 20.158 -4.337 -5.718 1.00 0.46 C ATOM 1575 CG MET A 92 20.138 -4.810 -7.165 1.00 0.57 C ATOM 1576 SD MET A 92 18.528 -5.452 -7.676 1.00 1.04 S ATOM 1577 CE MET A 92 17.425 -4.156 -7.114 1.00 0.34 C ATOM 0 H MET A 92 19.461 -2.477 -7.338 1.00 0.42 H new ATOM 0 HA MET A 92 20.204 -2.563 -4.517 1.00 0.44 H new ATOM 0 HB2 MET A 92 20.901 -4.916 -5.170 1.00 0.46 H new ATOM 0 HB3 MET A 92 19.190 -4.552 -5.266 1.00 0.46 H new ATOM 0 HG2 MET A 92 20.416 -3.981 -7.816 1.00 0.57 H new ATOM 0 HG3 MET A 92 20.891 -5.586 -7.298 1.00 0.57 H new ATOM 0 HE1 MET A 92 16.600 -4.597 -6.555 1.00 0.34 H new ATOM 0 HE2 MET A 92 17.972 -3.467 -6.471 1.00 0.34 H new ATOM 0 HE3 MET A 92 17.032 -3.615 -7.974 1.00 0.34 H new ATOM 1587 N LEU A 93 22.777 -3.308 -4.985 1.00 0.49 N ATOM 1588 CA LEU A 93 24.199 -3.002 -4.804 1.00 0.55 C ATOM 1589 C LEU A 93 24.943 -2.862 -6.129 1.00 0.61 C ATOM 1590 O LEU A 93 25.788 -1.978 -6.282 1.00 0.69 O ATOM 1591 CB LEU A 93 24.891 -4.076 -3.947 1.00 0.57 C ATOM 1592 CG LEU A 93 24.324 -4.307 -2.536 1.00 0.57 C ATOM 1593 CD1 LEU A 93 23.906 -2.994 -1.889 1.00 0.68 C ATOM 1594 CD2 LEU A 93 23.165 -5.295 -2.561 1.00 0.79 C ATOM 0 H LEU A 93 22.475 -4.151 -4.496 1.00 0.49 H new ATOM 0 HA LEU A 93 24.238 -2.041 -4.291 1.00 0.55 H new ATOM 0 HB2 LEU A 93 24.851 -5.021 -4.489 1.00 0.57 H new ATOM 0 HB3 LEU A 93 25.943 -3.808 -3.851 1.00 0.57 H new ATOM 0 HG LEU A 93 25.119 -4.741 -1.930 1.00 0.57 H new ATOM 0 HD11 LEU A 93 23.509 -3.189 -0.893 1.00 0.68 H new ATOM 0 HD12 LEU A 93 24.771 -2.335 -1.812 1.00 0.68 H new ATOM 0 HD13 LEU A 93 23.138 -2.516 -2.498 1.00 0.68 H new ATOM 0 HD21 LEU A 93 22.786 -5.437 -1.549 1.00 0.79 H new ATOM 0 HD22 LEU A 93 22.369 -4.906 -3.195 1.00 0.79 H new ATOM 0 HD23 LEU A 93 23.510 -6.250 -2.957 1.00 0.79 H new ATOM 1606 N ASP A 94 24.630 -3.729 -7.083 1.00 0.61 N ATOM 1607 CA ASP A 94 25.285 -3.701 -8.392 1.00 0.69 C ATOM 1608 C ASP A 94 24.995 -2.393 -9.125 1.00 0.66 C ATOM 1609 O ASP A 94 25.747 -1.977 -10.008 1.00 0.70 O ATOM 1610 CB ASP A 94 24.816 -4.881 -9.247 1.00 0.76 C ATOM 1611 CG ASP A 94 25.467 -4.902 -10.617 1.00 1.47 C ATOM 1612 OD1 ASP A 94 26.542 -5.516 -10.767 1.00 2.26 O ATOM 1613 OD2 ASP A 94 24.901 -4.305 -11.557 1.00 1.93 O ATOM 0 H ASP A 94 23.928 -4.461 -6.979 1.00 0.61 H new ATOM 0 HA ASP A 94 26.360 -3.777 -8.228 1.00 0.69 H new ATOM 0 HB2 ASP A 94 25.040 -5.813 -8.728 1.00 0.76 H new ATOM 0 HB3 ASP A 94 23.733 -4.833 -9.364 1.00 0.76 H new ATOM 1618 N GLY A 95 23.924 -1.733 -8.723 1.00 0.61 N ATOM 1619 CA GLY A 95 23.440 -0.583 -9.451 1.00 0.61 C ATOM 1620 C GLY A 95 22.244 -0.959 -10.290 1.00 0.58 C ATOM 1621 O GLY A 95 21.751 -0.166 -11.093 1.00 0.64 O ATOM 0 H GLY A 95 23.376 -1.976 -7.898 1.00 0.61 H new ATOM 0 HA2 GLY A 95 23.169 0.209 -8.754 1.00 0.61 H new ATOM 0 HA3 GLY A 95 24.231 -0.189 -10.089 1.00 0.61 H new ATOM 1625 N THR A 96 21.773 -2.182 -10.078 1.00 0.54 N ATOM 1626 CA THR A 96 20.667 -2.734 -10.841 1.00 0.54 C ATOM 1627 C THR A 96 19.347 -2.251 -10.273 1.00 0.47 C ATOM 1628 O THR A 96 19.150 -2.270 -9.062 1.00 0.47 O ATOM 1629 CB THR A 96 20.694 -4.275 -10.799 1.00 0.62 C ATOM 1630 OG1 THR A 96 22.003 -4.747 -11.130 1.00 0.81 O ATOM 1631 CG2 THR A 96 19.680 -4.870 -11.764 1.00 0.61 C ATOM 0 H THR A 96 22.148 -2.816 -9.373 1.00 0.54 H new ATOM 0 HA THR A 96 20.769 -2.399 -11.873 1.00 0.54 H new ATOM 0 HB THR A 96 20.433 -4.590 -9.789 1.00 0.62 H new ATOM 0 HG1 THR A 96 22.015 -5.726 -11.100 1.00 0.81 H new ATOM 0 HG21 THR A 96 19.723 -5.958 -11.712 1.00 0.61 H new ATOM 0 HG22 THR A 96 18.679 -4.533 -11.494 1.00 0.61 H new ATOM 0 HG23 THR A 96 19.910 -4.546 -12.779 1.00 0.61 H new ATOM 1639 N VAL A 97 18.452 -1.812 -11.136 1.00 0.45 N ATOM 1640 CA VAL A 97 17.154 -1.360 -10.685 1.00 0.41 C ATOM 1641 C VAL A 97 16.058 -2.320 -11.148 1.00 0.38 C ATOM 1642 O VAL A 97 16.079 -2.819 -12.275 1.00 0.41 O ATOM 1643 CB VAL A 97 16.853 0.088 -11.149 1.00 0.50 C ATOM 1644 CG1 VAL A 97 16.850 0.192 -12.662 1.00 1.07 C ATOM 1645 CG2 VAL A 97 15.536 0.586 -10.569 1.00 1.11 C ATOM 0 H VAL A 97 18.599 -1.759 -12.144 1.00 0.45 H new ATOM 0 HA VAL A 97 17.170 -1.353 -9.595 1.00 0.41 H new ATOM 0 HB VAL A 97 17.651 0.727 -10.772 1.00 0.50 H new ATOM 0 HG11 VAL A 97 16.636 1.220 -12.956 1.00 1.07 H new ATOM 0 HG12 VAL A 97 17.826 -0.100 -13.049 1.00 1.07 H new ATOM 0 HG13 VAL A 97 16.086 -0.469 -13.071 1.00 1.07 H new ATOM 0 HG21 VAL A 97 15.350 1.604 -10.911 1.00 1.11 H new ATOM 0 HG22 VAL A 97 14.724 -0.062 -10.900 1.00 1.11 H new ATOM 0 HG23 VAL A 97 15.590 0.573 -9.480 1.00 1.11 H new ATOM 1655 N LYS A 98 15.123 -2.584 -10.255 1.00 0.35 N ATOM 1656 CA LYS A 98 14.005 -3.466 -10.548 1.00 0.35 C ATOM 1657 C LYS A 98 12.734 -2.874 -9.977 1.00 0.36 C ATOM 1658 O LYS A 98 12.787 -2.084 -9.034 1.00 0.37 O ATOM 1659 CB LYS A 98 14.224 -4.880 -9.978 1.00 0.38 C ATOM 1660 CG LYS A 98 14.050 -4.988 -8.465 1.00 0.41 C ATOM 1661 CD LYS A 98 13.876 -6.439 -8.010 1.00 0.43 C ATOM 1662 CE LYS A 98 12.600 -7.065 -8.560 1.00 0.43 C ATOM 1663 NZ LYS A 98 12.808 -7.709 -9.886 1.00 0.94 N ATOM 0 H LYS A 98 15.115 -2.197 -9.311 1.00 0.35 H new ATOM 0 HA LYS A 98 13.923 -3.557 -11.631 1.00 0.35 H new ATOM 0 HB2 LYS A 98 13.526 -5.564 -10.461 1.00 0.38 H new ATOM 0 HB3 LYS A 98 15.229 -5.212 -10.240 1.00 0.38 H new ATOM 0 HG2 LYS A 98 14.918 -4.554 -7.968 1.00 0.41 H new ATOM 0 HG3 LYS A 98 13.182 -4.405 -8.157 1.00 0.41 H new ATOM 0 HD2 LYS A 98 14.736 -7.025 -8.334 1.00 0.43 H new ATOM 0 HD3 LYS A 98 13.857 -6.477 -6.921 1.00 0.43 H new ATOM 0 HE2 LYS A 98 12.229 -7.807 -7.853 1.00 0.43 H new ATOM 0 HE3 LYS A 98 11.831 -6.297 -8.649 1.00 0.43 H new ATOM 0 HZ1 LYS A 98 12.229 -7.225 -10.602 1.00 0.94 H new ATOM 0 HZ2 LYS A 98 13.812 -7.643 -10.150 1.00 0.94 H new ATOM 0 HZ3 LYS A 98 12.528 -8.709 -9.834 1.00 0.94 H new ATOM 1677 N THR A 99 11.599 -3.234 -10.546 1.00 0.40 N ATOM 1678 CA THR A 99 10.329 -2.823 -10.000 1.00 0.44 C ATOM 1679 C THR A 99 9.558 -4.050 -9.549 1.00 0.47 C ATOM 1680 O THR A 99 9.251 -4.935 -10.351 1.00 0.58 O ATOM 1681 CB THR A 99 9.488 -2.048 -11.026 1.00 0.48 C ATOM 1682 OG1 THR A 99 10.271 -1.000 -11.615 1.00 0.50 O ATOM 1683 CG2 THR A 99 8.258 -1.462 -10.358 1.00 0.57 C ATOM 0 H THR A 99 11.535 -3.810 -11.385 1.00 0.40 H new ATOM 0 HA THR A 99 10.526 -2.160 -9.157 1.00 0.44 H new ATOM 0 HB THR A 99 9.171 -2.736 -11.810 1.00 0.48 H new ATOM 0 HG1 THR A 99 9.727 -0.513 -12.269 1.00 0.50 H new ATOM 0 HG21 THR A 99 7.670 -0.915 -11.095 1.00 0.57 H new ATOM 0 HG22 THR A 99 7.655 -2.266 -9.937 1.00 0.57 H new ATOM 0 HG23 THR A 99 8.565 -0.783 -9.562 1.00 0.57 H new ATOM 1691 N ILE A 100 9.269 -4.112 -8.266 1.00 0.42 N ATOM 1692 CA ILE A 100 8.579 -5.248 -7.696 1.00 0.44 C ATOM 1693 C ILE A 100 7.336 -4.759 -6.961 1.00 0.45 C ATOM 1694 O ILE A 100 7.322 -3.649 -6.432 1.00 0.45 O ATOM 1695 CB ILE A 100 9.525 -6.050 -6.760 1.00 0.48 C ATOM 1696 CG1 ILE A 100 8.884 -7.372 -6.308 1.00 0.61 C ATOM 1697 CG2 ILE A 100 9.955 -5.209 -5.563 1.00 0.48 C ATOM 1698 CD1 ILE A 100 8.116 -7.300 -5.004 1.00 0.50 C ATOM 0 H ILE A 100 9.504 -3.382 -7.594 1.00 0.42 H new ATOM 0 HA ILE A 100 8.268 -5.927 -8.490 1.00 0.44 H new ATOM 0 HB ILE A 100 10.418 -6.299 -7.332 1.00 0.48 H new ATOM 0 HG12 ILE A 100 8.209 -7.717 -7.091 1.00 0.61 H new ATOM 0 HG13 ILE A 100 9.668 -8.123 -6.209 1.00 0.61 H new ATOM 0 HG21 ILE A 100 10.616 -5.795 -4.925 1.00 0.48 H new ATOM 0 HG22 ILE A 100 10.482 -4.321 -5.913 1.00 0.48 H new ATOM 0 HG23 ILE A 100 9.075 -4.909 -4.994 1.00 0.48 H new ATOM 0 HD11 ILE A 100 7.702 -8.281 -4.771 1.00 0.50 H new ATOM 0 HD12 ILE A 100 8.787 -6.990 -4.203 1.00 0.50 H new ATOM 0 HD13 ILE A 100 7.305 -6.577 -5.099 1.00 0.50 H new ATOM 1710 N MET A 101 6.283 -5.560 -6.962 1.00 0.47 N ATOM 1711 CA MET A 101 5.043 -5.145 -6.334 1.00 0.50 C ATOM 1712 C MET A 101 5.007 -5.583 -4.881 1.00 0.50 C ATOM 1713 O MET A 101 4.972 -6.772 -4.571 1.00 0.52 O ATOM 1714 CB MET A 101 3.851 -5.741 -7.082 1.00 0.56 C ATOM 1715 CG MET A 101 3.778 -5.334 -8.545 1.00 0.64 C ATOM 1716 SD MET A 101 3.731 -3.547 -8.766 1.00 0.98 S ATOM 1717 CE MET A 101 2.447 -3.108 -7.600 1.00 0.59 C ATOM 0 H MET A 101 6.262 -6.488 -7.385 1.00 0.47 H new ATOM 0 HA MET A 101 4.985 -4.057 -6.373 1.00 0.50 H new ATOM 0 HB2 MET A 101 3.901 -6.828 -7.019 1.00 0.56 H new ATOM 0 HB3 MET A 101 2.931 -5.435 -6.583 1.00 0.56 H new ATOM 0 HG2 MET A 101 4.640 -5.739 -9.074 1.00 0.64 H new ATOM 0 HG3 MET A 101 2.890 -5.776 -8.997 1.00 0.64 H new ATOM 0 HE1 MET A 101 2.096 -2.097 -7.809 1.00 0.59 H new ATOM 0 HE2 MET A 101 1.616 -3.807 -7.693 1.00 0.59 H new ATOM 0 HE3 MET A 101 2.846 -3.152 -6.586 1.00 0.59 H new ATOM 1727 N VAL A 102 5.027 -4.594 -3.998 1.00 0.50 N ATOM 1728 CA VAL A 102 5.041 -4.843 -2.563 1.00 0.53 C ATOM 1729 C VAL A 102 3.960 -4.047 -1.865 1.00 0.49 C ATOM 1730 O VAL A 102 3.713 -2.891 -2.212 1.00 0.50 O ATOM 1731 CB VAL A 102 6.388 -4.460 -1.929 1.00 0.61 C ATOM 1732 CG1 VAL A 102 6.743 -5.411 -0.801 1.00 0.73 C ATOM 1733 CG2 VAL A 102 7.477 -4.415 -2.975 1.00 0.90 C ATOM 0 H VAL A 102 5.034 -3.606 -4.252 1.00 0.50 H new ATOM 0 HA VAL A 102 4.869 -5.912 -2.437 1.00 0.53 H new ATOM 0 HB VAL A 102 6.295 -3.461 -1.502 1.00 0.61 H new ATOM 0 HG11 VAL A 102 7.700 -5.120 -0.368 1.00 0.73 H new ATOM 0 HG12 VAL A 102 5.970 -5.370 -0.034 1.00 0.73 H new ATOM 0 HG13 VAL A 102 6.815 -6.427 -1.190 1.00 0.73 H new ATOM 0 HG21 VAL A 102 8.422 -4.142 -2.505 1.00 0.90 H new ATOM 0 HG22 VAL A 102 7.574 -5.395 -3.442 1.00 0.90 H new ATOM 0 HG23 VAL A 102 7.222 -3.675 -3.734 1.00 0.90 H new ATOM 1743 N ASP A 103 3.324 -4.677 -0.891 1.00 0.48 N ATOM 1744 CA ASP A 103 2.294 -4.033 -0.087 1.00 0.47 C ATOM 1745 C ASP A 103 2.851 -2.789 0.588 1.00 0.46 C ATOM 1746 O ASP A 103 3.819 -2.870 1.341 1.00 0.51 O ATOM 1747 CB ASP A 103 1.769 -5.020 0.961 1.00 0.51 C ATOM 1748 CG ASP A 103 0.774 -4.400 1.920 1.00 1.22 C ATOM 1749 OD1 ASP A 103 1.199 -3.815 2.931 1.00 1.96 O ATOM 1750 OD2 ASP A 103 -0.437 -4.478 1.651 1.00 1.56 O ATOM 0 H ASP A 103 3.505 -5.647 -0.634 1.00 0.48 H new ATOM 0 HA ASP A 103 1.471 -3.731 -0.735 1.00 0.47 H new ATOM 0 HB2 ASP A 103 1.298 -5.862 0.454 1.00 0.51 H new ATOM 0 HB3 ASP A 103 2.610 -5.419 1.528 1.00 0.51 H new ATOM 1755 N ASP A 104 2.263 -1.642 0.299 1.00 0.46 N ATOM 1756 CA ASP A 104 2.725 -0.396 0.893 1.00 0.47 C ATOM 1757 C ASP A 104 1.904 -0.063 2.126 1.00 0.46 C ATOM 1758 O ASP A 104 2.114 0.967 2.769 1.00 0.54 O ATOM 1759 CB ASP A 104 2.687 0.763 -0.115 1.00 0.54 C ATOM 1760 CG ASP A 104 1.291 1.147 -0.558 1.00 0.66 C ATOM 1761 OD1 ASP A 104 0.728 0.437 -1.422 1.00 1.08 O ATOM 1762 OD2 ASP A 104 0.746 2.134 -0.021 1.00 0.64 O ATOM 0 H ASP A 104 1.472 -1.545 -0.337 1.00 0.46 H new ATOM 0 HA ASP A 104 3.765 -0.535 1.190 1.00 0.47 H new ATOM 0 HB2 ASP A 104 3.169 1.634 0.330 1.00 0.54 H new ATOM 0 HB3 ASP A 104 3.273 0.488 -0.992 1.00 0.54 H new ATOM 1767 N SER A 105 0.982 -0.955 2.467 1.00 0.43 N ATOM 1768 CA SER A 105 0.183 -0.786 3.669 1.00 0.49 C ATOM 1769 C SER A 105 1.023 -1.028 4.926 1.00 0.57 C ATOM 1770 O SER A 105 0.818 -0.380 5.955 1.00 0.96 O ATOM 1771 CB SER A 105 -1.000 -1.746 3.643 1.00 0.52 C ATOM 1772 OG SER A 105 -1.634 -1.737 2.377 1.00 1.27 O ATOM 0 H SER A 105 0.772 -1.797 1.931 1.00 0.43 H new ATOM 0 HA SER A 105 -0.183 0.241 3.695 1.00 0.49 H new ATOM 0 HB2 SER A 105 -0.659 -2.755 3.876 1.00 0.52 H new ATOM 0 HB3 SER A 105 -1.717 -1.466 4.415 1.00 0.52 H new ATOM 0 HG SER A 105 -1.889 -0.820 2.146 1.00 1.27 H new ATOM 1778 N LYS A 106 1.974 -1.954 4.837 1.00 0.45 N ATOM 1779 CA LYS A 106 2.779 -2.338 5.993 1.00 0.49 C ATOM 1780 C LYS A 106 4.062 -1.508 6.124 1.00 0.52 C ATOM 1781 O LYS A 106 4.268 -0.533 5.398 1.00 0.65 O ATOM 1782 CB LYS A 106 3.093 -3.845 5.959 1.00 0.58 C ATOM 1783 CG LYS A 106 3.610 -4.395 4.631 1.00 0.69 C ATOM 1784 CD LYS A 106 4.913 -3.762 4.188 1.00 0.58 C ATOM 1785 CE LYS A 106 5.656 -4.653 3.210 1.00 1.00 C ATOM 1786 NZ LYS A 106 4.754 -5.239 2.188 1.00 2.02 N ATOM 0 H LYS A 106 2.206 -2.452 3.977 1.00 0.45 H new ATOM 0 HA LYS A 106 2.183 -2.125 6.881 1.00 0.49 H new ATOM 0 HB2 LYS A 106 3.833 -4.058 6.730 1.00 0.58 H new ATOM 0 HB3 LYS A 106 2.188 -4.390 6.227 1.00 0.58 H new ATOM 0 HG2 LYS A 106 3.749 -5.472 4.721 1.00 0.69 H new ATOM 0 HG3 LYS A 106 2.856 -4.235 3.861 1.00 0.69 H new ATOM 0 HD2 LYS A 106 4.711 -2.797 3.723 1.00 0.58 H new ATOM 0 HD3 LYS A 106 5.541 -3.571 5.058 1.00 0.58 H new ATOM 0 HE2 LYS A 106 6.436 -4.075 2.715 1.00 1.00 H new ATOM 0 HE3 LYS A 106 6.152 -5.455 3.757 1.00 1.00 H new ATOM 0 HZ1 LYS A 106 5.299 -5.867 1.563 1.00 2.02 H new ATOM 0 HZ2 LYS A 106 4.004 -5.785 2.659 1.00 2.02 H new ATOM 0 HZ3 LYS A 106 4.325 -4.477 1.625 1.00 2.02 H new ATOM 1800 N THR A 107 4.916 -1.908 7.064 1.00 0.53 N ATOM 1801 CA THR A 107 6.141 -1.186 7.368 1.00 0.57 C ATOM 1802 C THR A 107 7.304 -1.612 6.461 1.00 0.52 C ATOM 1803 O THR A 107 7.132 -2.384 5.521 1.00 0.54 O ATOM 1804 CB THR A 107 6.531 -1.399 8.842 1.00 0.69 C ATOM 1805 OG1 THR A 107 6.605 -2.801 9.127 1.00 0.76 O ATOM 1806 CG2 THR A 107 5.517 -0.746 9.769 1.00 0.74 C ATOM 0 H THR A 107 4.775 -2.742 7.634 1.00 0.53 H new ATOM 0 HA THR A 107 5.946 -0.129 7.186 1.00 0.57 H new ATOM 0 HB THR A 107 7.505 -0.938 9.009 1.00 0.69 H new ATOM 0 HG1 THR A 107 6.855 -2.931 10.066 1.00 0.76 H new ATOM 0 HG21 THR A 107 5.813 -0.910 10.805 1.00 0.74 H new ATOM 0 HG22 THR A 107 5.477 0.324 9.568 1.00 0.74 H new ATOM 0 HG23 THR A 107 4.534 -1.184 9.599 1.00 0.74 H new ATOM 1814 N VAL A 108 8.492 -1.106 6.765 1.00 0.49 N ATOM 1815 CA VAL A 108 9.669 -1.300 5.920 1.00 0.47 C ATOM 1816 C VAL A 108 10.193 -2.737 5.933 1.00 0.42 C ATOM 1817 O VAL A 108 10.350 -3.359 4.886 1.00 0.44 O ATOM 1818 CB VAL A 108 10.808 -0.373 6.379 1.00 0.55 C ATOM 1819 CG1 VAL A 108 11.990 -0.456 5.426 1.00 0.61 C ATOM 1820 CG2 VAL A 108 10.305 1.056 6.517 1.00 0.60 C ATOM 0 H VAL A 108 8.670 -0.550 7.602 1.00 0.49 H new ATOM 0 HA VAL A 108 9.350 -1.066 4.904 1.00 0.47 H new ATOM 0 HB VAL A 108 11.153 -0.704 7.359 1.00 0.55 H new ATOM 0 HG11 VAL A 108 12.783 0.208 5.771 1.00 0.61 H new ATOM 0 HG12 VAL A 108 12.362 -1.480 5.396 1.00 0.61 H new ATOM 0 HG13 VAL A 108 11.674 -0.155 4.427 1.00 0.61 H new ATOM 0 HG21 VAL A 108 11.122 1.700 6.842 1.00 0.60 H new ATOM 0 HG22 VAL A 108 9.930 1.404 5.555 1.00 0.60 H new ATOM 0 HG23 VAL A 108 9.502 1.090 7.253 1.00 0.60 H new ATOM 1830 N THR A 109 10.501 -3.224 7.125 1.00 0.43 N ATOM 1831 CA THR A 109 11.169 -4.516 7.324 1.00 0.43 C ATOM 1832 C THR A 109 10.571 -5.662 6.497 1.00 0.44 C ATOM 1833 O THR A 109 11.309 -6.359 5.790 1.00 0.45 O ATOM 1834 CB THR A 109 11.152 -4.888 8.813 1.00 0.51 C ATOM 1835 OG1 THR A 109 11.633 -3.771 9.572 1.00 0.56 O ATOM 1836 CG2 THR A 109 12.024 -6.105 9.085 1.00 0.56 C ATOM 0 H THR A 109 10.295 -2.734 7.995 1.00 0.43 H new ATOM 0 HA THR A 109 12.192 -4.386 6.971 1.00 0.43 H new ATOM 0 HB THR A 109 10.131 -5.134 9.104 1.00 0.51 H new ATOM 0 HG1 THR A 109 12.514 -3.502 9.237 1.00 0.56 H new ATOM 0 HG21 THR A 109 11.992 -6.345 10.148 1.00 0.56 H new ATOM 0 HG22 THR A 109 11.654 -6.954 8.510 1.00 0.56 H new ATOM 0 HG23 THR A 109 13.051 -5.889 8.792 1.00 0.56 H new ATOM 1844 N ASP A 110 9.261 -5.862 6.590 1.00 0.47 N ATOM 1845 CA ASP A 110 8.579 -6.910 5.825 1.00 0.51 C ATOM 1846 C ASP A 110 8.888 -6.781 4.335 1.00 0.49 C ATOM 1847 O ASP A 110 9.200 -7.763 3.660 1.00 0.54 O ATOM 1848 CB ASP A 110 7.065 -6.834 6.051 1.00 0.57 C ATOM 1849 CG ASP A 110 6.298 -7.861 5.240 1.00 0.65 C ATOM 1850 OD1 ASP A 110 5.985 -7.587 4.065 1.00 0.70 O ATOM 1851 OD2 ASP A 110 5.992 -8.945 5.777 1.00 0.76 O ATOM 0 H ASP A 110 8.645 -5.312 7.189 1.00 0.47 H new ATOM 0 HA ASP A 110 8.943 -7.876 6.174 1.00 0.51 H new ATOM 0 HB2 ASP A 110 6.852 -6.981 7.110 1.00 0.57 H new ATOM 0 HB3 ASP A 110 6.713 -5.836 5.791 1.00 0.57 H new ATOM 1856 N MET A 111 8.830 -5.553 3.844 1.00 0.46 N ATOM 1857 CA MET A 111 9.109 -5.260 2.445 1.00 0.46 C ATOM 1858 C MET A 111 10.570 -5.538 2.109 1.00 0.40 C ATOM 1859 O MET A 111 10.873 -6.097 1.060 1.00 0.43 O ATOM 1860 CB MET A 111 8.767 -3.800 2.153 1.00 0.51 C ATOM 1861 CG MET A 111 9.299 -3.279 0.830 1.00 0.50 C ATOM 1862 SD MET A 111 8.950 -1.534 0.612 1.00 0.75 S ATOM 1863 CE MET A 111 9.338 -0.981 2.257 1.00 0.67 C ATOM 0 H MET A 111 8.589 -4.733 4.401 1.00 0.46 H new ATOM 0 HA MET A 111 8.493 -5.909 1.822 1.00 0.46 H new ATOM 0 HB2 MET A 111 7.683 -3.685 2.164 1.00 0.51 H new ATOM 0 HB3 MET A 111 9.162 -3.180 2.958 1.00 0.51 H new ATOM 0 HG2 MET A 111 10.375 -3.443 0.781 1.00 0.50 H new ATOM 0 HG3 MET A 111 8.853 -3.844 0.011 1.00 0.50 H new ATOM 0 HE1 MET A 111 9.442 0.104 2.261 1.00 0.67 H new ATOM 0 HE2 MET A 111 8.537 -1.271 2.937 1.00 0.67 H new ATOM 0 HE3 MET A 111 10.273 -1.436 2.583 1.00 0.67 H new ATOM 1873 N LEU A 112 11.467 -5.155 3.009 1.00 0.36 N ATOM 1874 CA LEU A 112 12.898 -5.376 2.815 1.00 0.34 C ATOM 1875 C LEU A 112 13.180 -6.868 2.654 1.00 0.37 C ATOM 1876 O LEU A 112 14.022 -7.275 1.851 1.00 0.42 O ATOM 1877 CB LEU A 112 13.683 -4.825 4.006 1.00 0.35 C ATOM 1878 CG LEU A 112 15.178 -4.605 3.766 1.00 0.38 C ATOM 1879 CD1 LEU A 112 15.386 -3.484 2.760 1.00 0.39 C ATOM 1880 CD2 LEU A 112 15.871 -4.277 5.074 1.00 0.46 C ATOM 0 H LEU A 112 11.229 -4.688 3.884 1.00 0.36 H new ATOM 0 HA LEU A 112 13.213 -4.854 1.911 1.00 0.34 H new ATOM 0 HB2 LEU A 112 13.237 -3.876 4.305 1.00 0.35 H new ATOM 0 HB3 LEU A 112 13.565 -5.511 4.845 1.00 0.35 H new ATOM 0 HG LEU A 112 15.611 -5.520 3.362 1.00 0.38 H new ATOM 0 HD11 LEU A 112 16.453 -3.335 2.596 1.00 0.39 H new ATOM 0 HD12 LEU A 112 14.908 -3.748 1.817 1.00 0.39 H new ATOM 0 HD13 LEU A 112 14.946 -2.564 3.145 1.00 0.39 H new ATOM 0 HD21 LEU A 112 16.935 -4.122 4.893 1.00 0.46 H new ATOM 0 HD22 LEU A 112 15.439 -3.370 5.497 1.00 0.46 H new ATOM 0 HD23 LEU A 112 15.738 -5.103 5.773 1.00 0.46 H new ATOM 1892 N MET A 113 12.454 -7.671 3.426 1.00 0.39 N ATOM 1893 CA MET A 113 12.536 -9.125 3.345 1.00 0.46 C ATOM 1894 C MET A 113 12.096 -9.597 1.965 1.00 0.49 C ATOM 1895 O MET A 113 12.680 -10.510 1.380 1.00 0.56 O ATOM 1896 CB MET A 113 11.637 -9.748 4.418 1.00 0.55 C ATOM 1897 CG MET A 113 11.688 -11.267 4.465 1.00 0.61 C ATOM 1898 SD MET A 113 10.391 -11.972 5.503 1.00 0.98 S ATOM 1899 CE MET A 113 10.724 -11.177 7.072 1.00 1.34 C ATOM 0 H MET A 113 11.793 -7.332 4.125 1.00 0.39 H new ATOM 0 HA MET A 113 13.568 -9.435 3.511 1.00 0.46 H new ATOM 0 HB2 MET A 113 11.927 -9.355 5.393 1.00 0.55 H new ATOM 0 HB3 MET A 113 10.608 -9.435 4.241 1.00 0.55 H new ATOM 0 HG2 MET A 113 11.594 -11.662 3.453 1.00 0.61 H new ATOM 0 HG3 MET A 113 12.661 -11.583 4.841 1.00 0.61 H new ATOM 0 HE1 MET A 113 10.108 -11.631 7.848 1.00 1.34 H new ATOM 0 HE2 MET A 113 11.777 -11.300 7.326 1.00 1.34 H new ATOM 0 HE3 MET A 113 10.490 -10.115 6.999 1.00 1.34 H new ATOM 1909 N THR A 114 11.070 -8.941 1.457 1.00 0.47 N ATOM 1910 CA THR A 114 10.495 -9.269 0.166 1.00 0.50 C ATOM 1911 C THR A 114 11.412 -8.855 -0.991 1.00 0.46 C ATOM 1912 O THR A 114 11.554 -9.592 -1.967 1.00 0.49 O ATOM 1913 CB THR A 114 9.108 -8.609 0.019 1.00 0.54 C ATOM 1914 OG1 THR A 114 8.185 -9.231 0.922 1.00 0.62 O ATOM 1915 CG2 THR A 114 8.578 -8.713 -1.405 1.00 0.60 C ATOM 0 H THR A 114 10.610 -8.163 1.930 1.00 0.47 H new ATOM 0 HA THR A 114 10.383 -10.352 0.119 1.00 0.50 H new ATOM 0 HB THR A 114 9.214 -7.551 0.258 1.00 0.54 H new ATOM 0 HG1 THR A 114 8.323 -8.878 1.826 1.00 0.62 H new ATOM 0 HG21 THR A 114 7.600 -8.236 -1.465 1.00 0.60 H new ATOM 0 HG22 THR A 114 9.267 -8.215 -2.087 1.00 0.60 H new ATOM 0 HG23 THR A 114 8.487 -9.763 -1.684 1.00 0.60 H new ATOM 1923 N ILE A 115 12.073 -7.704 -0.870 1.00 0.43 N ATOM 1924 CA ILE A 115 12.895 -7.180 -1.958 1.00 0.41 C ATOM 1925 C ILE A 115 14.138 -8.036 -2.165 1.00 0.42 C ATOM 1926 O ILE A 115 14.450 -8.439 -3.287 1.00 0.43 O ATOM 1927 CB ILE A 115 13.342 -5.729 -1.687 1.00 0.40 C ATOM 1928 CG1 ILE A 115 12.133 -4.826 -1.438 1.00 0.42 C ATOM 1929 CG2 ILE A 115 14.164 -5.204 -2.857 1.00 0.42 C ATOM 1930 CD1 ILE A 115 12.508 -3.438 -0.964 1.00 0.44 C ATOM 0 H ILE A 115 12.055 -7.120 -0.034 1.00 0.43 H new ATOM 0 HA ILE A 115 12.275 -7.203 -2.854 1.00 0.41 H new ATOM 0 HB ILE A 115 13.962 -5.722 -0.791 1.00 0.40 H new ATOM 0 HG12 ILE A 115 11.554 -4.744 -2.358 1.00 0.42 H new ATOM 0 HG13 ILE A 115 11.486 -5.293 -0.695 1.00 0.42 H new ATOM 0 HG21 ILE A 115 14.473 -4.179 -2.653 1.00 0.42 H new ATOM 0 HG22 ILE A 115 15.046 -5.830 -2.991 1.00 0.42 H new ATOM 0 HG23 ILE A 115 13.561 -5.227 -3.765 1.00 0.42 H new ATOM 0 HD11 ILE A 115 11.603 -2.850 -0.807 1.00 0.44 H new ATOM 0 HD12 ILE A 115 13.061 -3.510 -0.027 1.00 0.44 H new ATOM 0 HD13 ILE A 115 13.130 -2.952 -1.716 1.00 0.44 H new ATOM 1942 N CYS A 116 14.837 -8.321 -1.073 1.00 0.43 N ATOM 1943 CA CYS A 116 16.066 -9.100 -1.134 1.00 0.47 C ATOM 1944 C CYS A 116 15.778 -10.509 -1.643 1.00 0.50 C ATOM 1945 O CYS A 116 16.629 -11.148 -2.265 1.00 0.53 O ATOM 1946 CB CYS A 116 16.727 -9.150 0.244 1.00 0.51 C ATOM 1947 SG CYS A 116 16.962 -7.521 0.994 1.00 1.56 S ATOM 0 H CYS A 116 14.573 -8.024 -0.134 1.00 0.43 H new ATOM 0 HA CYS A 116 16.752 -8.618 -1.831 1.00 0.47 H new ATOM 0 HB2 CYS A 116 16.117 -9.762 0.908 1.00 0.51 H new ATOM 0 HB3 CYS A 116 17.695 -9.643 0.156 1.00 0.51 H new ATOM 0 HG CYS A 116 15.838 -7.110 1.501 1.00 1.56 H new ATOM 1953 N ALA A 117 14.561 -10.976 -1.400 1.00 0.50 N ATOM 1954 CA ALA A 117 14.138 -12.287 -1.863 1.00 0.54 C ATOM 1955 C ALA A 117 13.915 -12.283 -3.370 1.00 0.54 C ATOM 1956 O ALA A 117 14.075 -13.309 -4.027 1.00 0.58 O ATOM 1957 CB ALA A 117 12.873 -12.718 -1.145 1.00 0.57 C ATOM 0 H ALA A 117 13.848 -10.462 -0.882 1.00 0.50 H new ATOM 0 HA ALA A 117 14.930 -13.000 -1.636 1.00 0.54 H new ATOM 0 HB1 ALA A 117 12.569 -13.702 -1.503 1.00 0.57 H new ATOM 0 HB2 ALA A 117 13.061 -12.764 -0.072 1.00 0.57 H new ATOM 0 HB3 ALA A 117 12.079 -11.998 -1.343 1.00 0.57 H new ATOM 1963 N ARG A 118 13.557 -11.121 -3.917 1.00 0.50 N ATOM 1964 CA ARG A 118 13.329 -10.998 -5.355 1.00 0.51 C ATOM 1965 C ARG A 118 14.631 -11.197 -6.109 1.00 0.52 C ATOM 1966 O ARG A 118 14.657 -11.826 -7.166 1.00 0.55 O ATOM 1967 CB ARG A 118 12.720 -9.635 -5.725 1.00 0.49 C ATOM 1968 CG ARG A 118 11.436 -9.321 -4.979 1.00 0.49 C ATOM 1969 CD ARG A 118 10.393 -10.413 -5.159 1.00 0.58 C ATOM 1970 NE ARG A 118 9.993 -10.579 -6.559 1.00 0.84 N ATOM 1971 CZ ARG A 118 8.733 -10.777 -6.956 1.00 1.16 C ATOM 1972 NH1 ARG A 118 7.750 -10.841 -6.065 1.00 1.23 N ATOM 1973 NH2 ARG A 118 8.454 -10.915 -8.247 1.00 1.75 N ATOM 0 H ARG A 118 13.420 -10.258 -3.390 1.00 0.50 H new ATOM 0 HA ARG A 118 12.616 -11.772 -5.640 1.00 0.51 H new ATOM 0 HB2 ARG A 118 13.450 -8.852 -5.520 1.00 0.49 H new ATOM 0 HB3 ARG A 118 12.522 -9.614 -6.797 1.00 0.49 H new ATOM 0 HG2 ARG A 118 11.654 -9.198 -3.918 1.00 0.49 H new ATOM 0 HG3 ARG A 118 11.033 -8.372 -5.334 1.00 0.49 H new ATOM 0 HD2 ARG A 118 10.790 -11.356 -4.783 1.00 0.58 H new ATOM 0 HD3 ARG A 118 9.515 -10.175 -4.559 1.00 0.58 H new ATOM 0 HE ARG A 118 10.720 -10.541 -7.273 1.00 0.84 H new ATOM 0 HH11 ARG A 118 7.955 -10.739 -5.071 1.00 1.23 H new ATOM 0 HH12 ARG A 118 6.790 -10.992 -6.375 1.00 1.23 H new ATOM 0 HH21 ARG A 118 9.203 -10.870 -8.938 1.00 1.75 H new ATOM 0 HH22 ARG A 118 7.491 -11.066 -8.547 1.00 1.75 H new ATOM 1987 N ILE A 119 15.712 -10.662 -5.558 1.00 0.52 N ATOM 1988 CA ILE A 119 17.023 -10.803 -6.174 1.00 0.54 C ATOM 1989 C ILE A 119 17.560 -12.201 -5.919 1.00 0.58 C ATOM 1990 O ILE A 119 18.124 -12.838 -6.808 1.00 0.66 O ATOM 1991 CB ILE A 119 18.044 -9.782 -5.617 1.00 0.51 C ATOM 1992 CG1 ILE A 119 17.363 -8.464 -5.235 1.00 0.49 C ATOM 1993 CG2 ILE A 119 19.141 -9.528 -6.641 1.00 0.56 C ATOM 1994 CD1 ILE A 119 16.616 -7.800 -6.370 1.00 0.69 C ATOM 0 H ILE A 119 15.707 -10.128 -4.689 1.00 0.52 H new ATOM 0 HA ILE A 119 16.897 -10.619 -7.241 1.00 0.54 H new ATOM 0 HB ILE A 119 18.486 -10.205 -4.715 1.00 0.51 H new ATOM 0 HG12 ILE A 119 16.667 -8.651 -4.417 1.00 0.49 H new ATOM 0 HG13 ILE A 119 18.118 -7.774 -4.859 1.00 0.49 H new ATOM 0 HG21 ILE A 119 19.854 -8.808 -6.239 1.00 0.56 H new ATOM 0 HG22 ILE A 119 19.655 -10.463 -6.863 1.00 0.56 H new ATOM 0 HG23 ILE A 119 18.700 -9.130 -7.555 1.00 0.56 H new ATOM 0 HD11 ILE A 119 16.164 -6.874 -6.015 1.00 0.69 H new ATOM 0 HD12 ILE A 119 17.309 -7.578 -7.181 1.00 0.69 H new ATOM 0 HD13 ILE A 119 15.836 -8.469 -6.733 1.00 0.69 H new ATOM 2006 N GLY A 120 17.363 -12.675 -4.698 1.00 0.57 N ATOM 2007 CA GLY A 120 17.888 -13.965 -4.307 1.00 0.62 C ATOM 2008 C GLY A 120 18.928 -13.840 -3.213 1.00 0.64 C ATOM 2009 O GLY A 120 19.813 -14.683 -3.081 1.00 0.70 O ATOM 0 H GLY A 120 16.846 -12.185 -3.968 1.00 0.57 H new ATOM 0 HA2 GLY A 120 17.072 -14.600 -3.962 1.00 0.62 H new ATOM 0 HA3 GLY A 120 18.330 -14.456 -5.174 1.00 0.62 H new ATOM 2013 N ILE A 121 18.819 -12.772 -2.434 1.00 0.66 N ATOM 2014 CA ILE A 121 19.757 -12.506 -1.353 1.00 0.71 C ATOM 2015 C ILE A 121 19.341 -13.257 -0.089 1.00 0.82 C ATOM 2016 O ILE A 121 20.190 -13.710 0.684 1.00 1.54 O ATOM 2017 CB ILE A 121 19.839 -10.994 -1.044 1.00 0.63 C ATOM 2018 CG1 ILE A 121 20.216 -10.205 -2.305 1.00 0.59 C ATOM 2019 CG2 ILE A 121 20.844 -10.732 0.065 1.00 0.67 C ATOM 2020 CD1 ILE A 121 20.236 -8.702 -2.104 1.00 0.56 C ATOM 0 H ILE A 121 18.084 -12.071 -2.532 1.00 0.66 H new ATOM 0 HA ILE A 121 20.739 -12.852 -1.677 1.00 0.71 H new ATOM 0 HB ILE A 121 18.858 -10.659 -0.709 1.00 0.63 H new ATOM 0 HG12 ILE A 121 21.199 -10.530 -2.645 1.00 0.59 H new ATOM 0 HG13 ILE A 121 19.509 -10.447 -3.098 1.00 0.59 H new ATOM 0 HG21 ILE A 121 20.889 -9.662 0.270 1.00 0.67 H new ATOM 0 HG22 ILE A 121 20.537 -11.262 0.967 1.00 0.67 H new ATOM 0 HG23 ILE A 121 21.828 -11.084 -0.245 1.00 0.67 H new ATOM 0 HD11 ILE A 121 20.511 -8.214 -3.039 1.00 0.56 H new ATOM 0 HD12 ILE A 121 19.247 -8.363 -1.794 1.00 0.56 H new ATOM 0 HD13 ILE A 121 20.964 -8.448 -1.334 1.00 0.56 H new ATOM 2032 N THR A 122 18.027 -13.384 0.102 1.00 0.96 N ATOM 2033 CA THR A 122 17.453 -14.064 1.265 1.00 1.00 C ATOM 2034 C THR A 122 17.608 -13.230 2.541 1.00 0.90 C ATOM 2035 O THR A 122 16.616 -12.851 3.167 1.00 1.04 O ATOM 2036 CB THR A 122 18.071 -15.464 1.467 1.00 1.18 C ATOM 2037 OG1 THR A 122 17.939 -16.226 0.259 1.00 1.55 O ATOM 2038 CG2 THR A 122 17.396 -16.208 2.612 1.00 1.65 C ATOM 0 H THR A 122 17.330 -13.018 -0.546 1.00 0.96 H new ATOM 0 HA THR A 122 16.389 -14.185 1.063 1.00 1.00 H new ATOM 0 HB THR A 122 19.124 -15.337 1.716 1.00 1.18 H new ATOM 0 HG1 THR A 122 18.333 -17.114 0.388 1.00 1.55 H new ATOM 0 HG21 THR A 122 17.854 -17.190 2.728 1.00 1.65 H new ATOM 0 HG22 THR A 122 17.515 -15.641 3.535 1.00 1.65 H new ATOM 0 HG23 THR A 122 16.335 -16.326 2.393 1.00 1.65 H new ATOM 2046 N ASN A 123 18.844 -12.938 2.923 1.00 0.91 N ATOM 2047 CA ASN A 123 19.100 -12.130 4.108 1.00 0.87 C ATOM 2048 C ASN A 123 18.721 -10.684 3.818 1.00 0.77 C ATOM 2049 O ASN A 123 18.930 -10.200 2.709 1.00 1.05 O ATOM 2050 CB ASN A 123 20.572 -12.210 4.519 1.00 1.10 C ATOM 2051 CG ASN A 123 20.788 -11.762 5.953 1.00 1.31 C ATOM 2052 OD1 ASN A 123 19.936 -11.972 6.810 1.00 2.13 O ATOM 2053 ND2 ASN A 123 21.914 -11.128 6.225 1.00 1.50 N ATOM 0 H ASN A 123 19.683 -13.247 2.432 1.00 0.91 H new ATOM 0 HA ASN A 123 18.498 -12.514 4.932 1.00 0.87 H new ATOM 0 HB2 ASN A 123 20.926 -13.234 4.402 1.00 1.10 H new ATOM 0 HB3 ASN A 123 21.169 -11.589 3.851 1.00 1.10 H new ATOM 0 HD21 ASN A 123 22.096 -10.796 7.172 1.00 1.50 H new ATOM 0 HD22 ASN A 123 22.601 -10.970 5.488 1.00 1.50 H new ATOM 2060 N HIS A 124 18.148 -9.998 4.794 1.00 0.61 N ATOM 2061 CA HIS A 124 17.691 -8.634 4.562 1.00 0.59 C ATOM 2062 C HIS A 124 17.994 -7.715 5.738 1.00 0.57 C ATOM 2063 O HIS A 124 17.886 -6.500 5.616 1.00 0.66 O ATOM 2064 CB HIS A 124 16.188 -8.613 4.253 1.00 0.63 C ATOM 2065 CG HIS A 124 15.310 -9.044 5.392 1.00 0.58 C ATOM 2066 ND1 HIS A 124 14.560 -8.161 6.137 1.00 0.55 N ATOM 2067 CD2 HIS A 124 15.035 -10.274 5.884 1.00 0.66 C ATOM 2068 CE1 HIS A 124 13.861 -8.829 7.034 1.00 0.57 C ATOM 2069 NE2 HIS A 124 14.130 -10.112 6.903 1.00 0.66 N ATOM 0 H HIS A 124 17.990 -10.353 5.737 1.00 0.61 H new ATOM 0 HA HIS A 124 18.242 -8.257 3.700 1.00 0.59 H new ATOM 0 HB2 HIS A 124 15.906 -7.603 3.956 1.00 0.63 H new ATOM 0 HB3 HIS A 124 15.997 -9.262 3.398 1.00 0.63 H new ATOM 0 HD1 HIS A 124 14.547 -7.149 6.014 1.00 0.55 H new ATOM 0 HD2 HIS A 124 15.450 -11.209 5.539 1.00 0.66 H new ATOM 0 HE1 HIS A 124 13.182 -8.397 7.755 1.00 0.57 H new ATOM 2078 N ASP A 125 18.380 -8.282 6.871 1.00 0.62 N ATOM 2079 CA ASP A 125 18.618 -7.480 8.064 1.00 0.72 C ATOM 2080 C ASP A 125 19.933 -6.728 7.956 1.00 0.64 C ATOM 2081 O ASP A 125 20.198 -5.811 8.734 1.00 0.66 O ATOM 2082 CB ASP A 125 18.615 -8.349 9.320 1.00 0.97 C ATOM 2083 CG ASP A 125 17.252 -8.936 9.613 1.00 1.54 C ATOM 2084 OD1 ASP A 125 16.260 -8.177 9.603 1.00 2.14 O ATOM 2085 OD2 ASP A 125 17.165 -10.163 9.833 1.00 2.11 O ATOM 0 H ASP A 125 18.534 -9.283 6.991 1.00 0.62 H new ATOM 0 HA ASP A 125 17.806 -6.757 8.142 1.00 0.72 H new ATOM 0 HB2 ASP A 125 19.337 -9.157 9.201 1.00 0.97 H new ATOM 0 HB3 ASP A 125 18.941 -7.752 10.172 1.00 0.97 H new ATOM 2090 N GLU A 126 20.747 -7.110 6.981 1.00 0.62 N ATOM 2091 CA GLU A 126 22.035 -6.469 6.766 1.00 0.62 C ATOM 2092 C GLU A 126 21.893 -5.256 5.854 1.00 0.52 C ATOM 2093 O GLU A 126 22.866 -4.547 5.590 1.00 0.61 O ATOM 2094 CB GLU A 126 23.043 -7.465 6.178 1.00 0.76 C ATOM 2095 CG GLU A 126 22.558 -8.162 4.917 1.00 1.19 C ATOM 2096 CD GLU A 126 23.636 -8.996 4.255 1.00 1.84 C ATOM 2097 OE1 GLU A 126 24.403 -8.450 3.436 1.00 2.27 O ATOM 2098 OE2 GLU A 126 23.727 -10.199 4.560 1.00 2.30 O ATOM 0 H GLU A 126 20.536 -7.863 6.326 1.00 0.62 H new ATOM 0 HA GLU A 126 22.408 -6.128 7.732 1.00 0.62 H new ATOM 0 HB2 GLU A 126 23.971 -6.939 5.956 1.00 0.76 H new ATOM 0 HB3 GLU A 126 23.276 -8.218 6.931 1.00 0.76 H new ATOM 0 HG2 GLU A 126 21.711 -8.802 5.164 1.00 1.19 H new ATOM 0 HG3 GLU A 126 22.198 -7.415 4.210 1.00 1.19 H new ATOM 2105 N TYR A 127 20.675 -5.009 5.388 1.00 0.43 N ATOM 2106 CA TYR A 127 20.420 -3.901 4.481 1.00 0.38 C ATOM 2107 C TYR A 127 19.507 -2.885 5.118 1.00 0.39 C ATOM 2108 O TYR A 127 18.681 -3.220 5.964 1.00 0.42 O ATOM 2109 CB TYR A 127 19.785 -4.394 3.185 1.00 0.36 C ATOM 2110 CG TYR A 127 20.603 -5.452 2.516 1.00 0.36 C ATOM 2111 CD1 TYR A 127 21.821 -5.147 1.941 1.00 0.38 C ATOM 2112 CD2 TYR A 127 20.138 -6.751 2.435 1.00 0.40 C ATOM 2113 CE1 TYR A 127 22.561 -6.110 1.301 1.00 0.41 C ATOM 2114 CE2 TYR A 127 20.861 -7.721 1.791 1.00 0.43 C ATOM 2115 CZ TYR A 127 22.157 -7.412 1.338 1.00 0.43 C ATOM 2116 OH TYR A 127 22.788 -8.372 0.557 1.00 0.49 O ATOM 0 H TYR A 127 19.850 -5.561 5.624 1.00 0.43 H new ATOM 0 HA TYR A 127 21.380 -3.435 4.258 1.00 0.38 H new ATOM 0 HB2 TYR A 127 18.791 -4.787 3.397 1.00 0.36 H new ATOM 0 HB3 TYR A 127 19.656 -3.553 2.504 1.00 0.36 H new ATOM 0 HD1 TYR A 127 22.197 -4.136 1.996 1.00 0.38 H new ATOM 0 HD2 TYR A 127 19.190 -7.006 2.886 1.00 0.40 H new ATOM 0 HE1 TYR A 127 23.461 -5.837 0.770 1.00 0.41 H new ATOM 0 HE2 TYR A 127 20.444 -8.705 1.634 1.00 0.43 H new ATOM 0 HH TYR A 127 23.030 -9.140 1.115 1.00 0.49 H new ATOM 2126 N SER A 128 19.673 -1.643 4.728 1.00 0.40 N ATOM 2127 CA SER A 128 18.758 -0.596 5.127 1.00 0.42 C ATOM 2128 C SER A 128 18.181 0.056 3.884 1.00 0.41 C ATOM 2129 O SER A 128 18.874 0.196 2.874 1.00 0.54 O ATOM 2130 CB SER A 128 19.475 0.435 5.999 1.00 0.47 C ATOM 2131 OG SER A 128 20.019 -0.179 7.155 1.00 1.13 O ATOM 0 H SER A 128 20.438 -1.330 4.131 1.00 0.40 H new ATOM 0 HA SER A 128 17.947 -1.023 5.717 1.00 0.42 H new ATOM 0 HB2 SER A 128 20.270 0.913 5.427 1.00 0.47 H new ATOM 0 HB3 SER A 128 18.777 1.219 6.292 1.00 0.47 H new ATOM 0 HG SER A 128 20.334 0.512 7.775 1.00 1.13 H new ATOM 2137 N LEU A 129 16.914 0.428 3.943 1.00 0.42 N ATOM 2138 CA LEU A 129 16.252 0.994 2.783 1.00 0.42 C ATOM 2139 C LEU A 129 16.465 2.499 2.765 1.00 0.43 C ATOM 2140 O LEU A 129 16.330 3.158 3.788 1.00 0.48 O ATOM 2141 CB LEU A 129 14.758 0.646 2.801 1.00 0.43 C ATOM 2142 CG LEU A 129 14.094 0.518 1.422 1.00 0.45 C ATOM 2143 CD1 LEU A 129 12.759 -0.195 1.543 1.00 1.33 C ATOM 2144 CD2 LEU A 129 13.905 1.881 0.772 1.00 1.13 C ATOM 0 H LEU A 129 16.328 0.349 4.774 1.00 0.42 H new ATOM 0 HA LEU A 129 16.681 0.570 1.875 1.00 0.42 H new ATOM 0 HB2 LEU A 129 14.628 -0.294 3.337 1.00 0.43 H new ATOM 0 HB3 LEU A 129 14.231 1.412 3.369 1.00 0.43 H new ATOM 0 HG LEU A 129 14.754 -0.071 0.786 1.00 0.45 H new ATOM 0 HD11 LEU A 129 12.300 -0.278 0.558 1.00 1.33 H new ATOM 0 HD12 LEU A 129 12.915 -1.192 1.956 1.00 1.33 H new ATOM 0 HD13 LEU A 129 12.102 0.372 2.202 1.00 1.33 H new ATOM 0 HD21 LEU A 129 13.433 1.757 -0.203 1.00 1.13 H new ATOM 0 HD22 LEU A 129 13.272 2.502 1.406 1.00 1.13 H new ATOM 0 HD23 LEU A 129 14.875 2.362 0.647 1.00 1.13 H new ATOM 2156 N VAL A 130 16.807 3.026 1.607 1.00 0.42 N ATOM 2157 CA VAL A 130 17.079 4.444 1.458 1.00 0.46 C ATOM 2158 C VAL A 130 16.361 4.979 0.219 1.00 0.46 C ATOM 2159 O VAL A 130 16.627 4.557 -0.905 1.00 0.45 O ATOM 2160 CB VAL A 130 18.607 4.709 1.388 1.00 0.48 C ATOM 2161 CG1 VAL A 130 19.267 3.800 0.380 1.00 0.49 C ATOM 2162 CG2 VAL A 130 18.920 6.154 1.056 1.00 0.60 C ATOM 0 H VAL A 130 16.904 2.488 0.746 1.00 0.42 H new ATOM 0 HA VAL A 130 16.699 4.973 2.332 1.00 0.46 H new ATOM 0 HB VAL A 130 19.008 4.496 2.379 1.00 0.48 H new ATOM 0 HG11 VAL A 130 20.337 4.006 0.350 1.00 0.49 H new ATOM 0 HG12 VAL A 130 19.105 2.761 0.666 1.00 0.49 H new ATOM 0 HG13 VAL A 130 18.836 3.976 -0.606 1.00 0.49 H new ATOM 0 HG21 VAL A 130 20.000 6.293 1.018 1.00 0.60 H new ATOM 0 HG22 VAL A 130 18.487 6.407 0.088 1.00 0.60 H new ATOM 0 HG23 VAL A 130 18.498 6.803 1.823 1.00 0.60 H new ATOM 2172 N ARG A 131 15.426 5.889 0.431 1.00 0.48 N ATOM 2173 CA ARG A 131 14.627 6.417 -0.658 1.00 0.50 C ATOM 2174 C ARG A 131 15.215 7.718 -1.174 1.00 0.57 C ATOM 2175 O ARG A 131 15.024 8.775 -0.565 1.00 0.64 O ATOM 2176 CB ARG A 131 13.206 6.713 -0.178 1.00 0.54 C ATOM 2177 CG ARG A 131 12.443 5.529 0.378 1.00 0.51 C ATOM 2178 CD ARG A 131 11.195 5.998 1.113 1.00 0.62 C ATOM 2179 NE ARG A 131 10.491 7.068 0.402 1.00 0.96 N ATOM 2180 CZ ARG A 131 9.829 8.053 1.024 1.00 1.65 C ATOM 2181 NH1 ARG A 131 9.748 8.059 2.351 1.00 2.18 N ATOM 2182 NH2 ARG A 131 9.235 9.013 0.319 1.00 2.01 N ATOM 0 H ARG A 131 15.202 6.277 1.348 1.00 0.48 H new ATOM 0 HA ARG A 131 14.617 5.668 -1.449 1.00 0.50 H new ATOM 0 HB2 ARG A 131 13.255 7.484 0.591 1.00 0.54 H new ATOM 0 HB3 ARG A 131 12.639 7.129 -1.011 1.00 0.54 H new ATOM 0 HG2 ARG A 131 12.164 4.856 -0.432 1.00 0.51 H new ATOM 0 HG3 ARG A 131 13.081 4.963 1.057 1.00 0.51 H new ATOM 0 HD2 ARG A 131 10.520 5.153 1.251 1.00 0.62 H new ATOM 0 HD3 ARG A 131 11.473 6.349 2.107 1.00 0.62 H new ATOM 0 HE ARG A 131 10.505 7.063 -0.618 1.00 0.96 H new ATOM 0 HH11 ARG A 131 10.189 7.315 2.892 1.00 2.18 H new ATOM 0 HH12 ARG A 131 9.245 8.807 2.828 1.00 2.18 H new ATOM 0 HH21 ARG A 131 9.282 9.001 -0.700 1.00 2.01 H new ATOM 0 HH22 ARG A 131 8.732 9.760 0.798 1.00 2.01 H new ATOM 2196 N GLU A 132 15.903 7.654 -2.300 1.00 0.58 N ATOM 2197 CA GLU A 132 16.342 8.866 -2.958 1.00 0.66 C ATOM 2198 C GLU A 132 15.203 9.417 -3.795 1.00 0.73 C ATOM 2199 O GLU A 132 14.780 8.804 -4.789 1.00 0.74 O ATOM 2200 CB GLU A 132 17.576 8.633 -3.832 1.00 0.68 C ATOM 2201 CG GLU A 132 18.831 8.277 -3.053 1.00 0.64 C ATOM 2202 CD GLU A 132 20.092 8.448 -3.881 1.00 0.72 C ATOM 2203 OE1 GLU A 132 20.014 9.030 -4.987 1.00 0.90 O ATOM 2204 OE2 GLU A 132 21.169 8.000 -3.433 1.00 1.05 O ATOM 0 H GLU A 132 16.166 6.788 -2.770 1.00 0.58 H new ATOM 0 HA GLU A 132 16.626 9.586 -2.190 1.00 0.66 H new ATOM 0 HB2 GLU A 132 17.361 7.832 -4.539 1.00 0.68 H new ATOM 0 HB3 GLU A 132 17.768 9.532 -4.418 1.00 0.68 H new ATOM 0 HG2 GLU A 132 18.895 8.905 -2.164 1.00 0.64 H new ATOM 0 HG3 GLU A 132 18.762 7.245 -2.709 1.00 0.64 H new ATOM 2211 N LEU A 133 14.685 10.562 -3.390 1.00 0.80 N ATOM 2212 CA LEU A 133 13.498 11.078 -4.024 1.00 0.87 C ATOM 2213 C LEU A 133 13.799 12.245 -4.936 1.00 0.97 C ATOM 2214 O LEU A 133 14.947 12.634 -5.150 1.00 1.02 O ATOM 2215 CB LEU A 133 12.476 11.529 -2.989 1.00 0.92 C ATOM 2216 CG LEU A 133 12.248 10.577 -1.823 1.00 0.87 C ATOM 2217 CD1 LEU A 133 11.139 11.115 -0.955 1.00 0.97 C ATOM 2218 CD2 LEU A 133 11.908 9.181 -2.312 1.00 0.80 C ATOM 0 H LEU A 133 15.063 11.139 -2.639 1.00 0.80 H new ATOM 0 HA LEU A 133 13.093 10.259 -4.619 1.00 0.87 H new ATOM 0 HB2 LEU A 133 12.792 12.493 -2.590 1.00 0.92 H new ATOM 0 HB3 LEU A 133 11.523 11.690 -3.493 1.00 0.92 H new ATOM 0 HG LEU A 133 13.167 10.506 -1.242 1.00 0.87 H new ATOM 0 HD11 LEU A 133 10.971 10.437 -0.118 1.00 0.97 H new ATOM 0 HD12 LEU A 133 11.418 12.098 -0.576 1.00 0.97 H new ATOM 0 HD13 LEU A 133 10.225 11.199 -1.543 1.00 0.97 H new ATOM 0 HD21 LEU A 133 11.751 8.524 -1.457 1.00 0.80 H new ATOM 0 HD22 LEU A 133 11.000 9.217 -2.913 1.00 0.80 H new ATOM 0 HD23 LEU A 133 12.729 8.798 -2.918 1.00 0.80 H new ATOM 2230 N MET A 134 12.728 12.783 -5.462 1.00 1.04 N ATOM 2231 CA MET A 134 12.755 13.969 -6.288 1.00 1.15 C ATOM 2232 C MET A 134 11.978 15.065 -5.577 1.00 1.22 C ATOM 2233 O MET A 134 11.860 16.189 -6.063 1.00 1.29 O ATOM 2234 CB MET A 134 12.085 13.646 -7.618 1.00 1.27 C ATOM 2235 CG MET A 134 10.640 13.221 -7.427 1.00 1.36 C ATOM 2236 SD MET A 134 9.490 14.611 -7.527 1.00 1.80 S ATOM 2237 CE MET A 134 8.077 13.953 -6.649 1.00 2.03 C ATOM 0 H MET A 134 11.791 12.402 -5.327 1.00 1.04 H new ATOM 0 HA MET A 134 13.779 14.298 -6.464 1.00 1.15 H new ATOM 0 HB2 MET A 134 12.125 14.520 -8.268 1.00 1.27 H new ATOM 0 HB3 MET A 134 12.636 12.850 -8.120 1.00 1.27 H new ATOM 0 HG2 MET A 134 10.379 12.482 -8.185 1.00 1.36 H new ATOM 0 HG3 MET A 134 10.533 12.734 -6.458 1.00 1.36 H new ATOM 0 HE1 MET A 134 7.610 14.746 -6.065 1.00 2.03 H new ATOM 0 HE2 MET A 134 7.357 13.556 -7.364 1.00 2.03 H new ATOM 0 HE3 MET A 134 8.403 13.155 -5.982 1.00 2.03 H new ATOM 2247 N GLU A 135 11.457 14.703 -4.408 1.00 1.27 N ATOM 2248 CA GLU A 135 10.478 15.502 -3.696 1.00 1.39 C ATOM 2249 C GLU A 135 10.973 16.893 -3.339 1.00 1.41 C ATOM 2250 O GLU A 135 12.010 17.056 -2.699 1.00 1.45 O ATOM 2251 CB GLU A 135 10.062 14.799 -2.412 1.00 1.48 C ATOM 2252 CG GLU A 135 9.069 13.670 -2.601 1.00 1.58 C ATOM 2253 CD GLU A 135 8.360 13.342 -1.307 1.00 1.83 C ATOM 2254 OE1 GLU A 135 7.842 14.262 -0.648 1.00 2.04 O ATOM 2255 OE2 GLU A 135 8.286 12.139 -0.965 1.00 2.29 O ATOM 0 H GLU A 135 11.708 13.838 -3.928 1.00 1.27 H new ATOM 0 HA GLU A 135 9.635 15.615 -4.377 1.00 1.39 H new ATOM 0 HB2 GLU A 135 10.953 14.403 -1.926 1.00 1.48 H new ATOM 0 HB3 GLU A 135 9.630 15.535 -1.734 1.00 1.48 H new ATOM 0 HG2 GLU A 135 8.337 13.949 -3.359 1.00 1.58 H new ATOM 0 HG3 GLU A 135 9.587 12.785 -2.969 1.00 1.58 H new ATOM 2262 N GLU A 136 10.209 17.890 -3.759 1.00 1.46 N ATOM 2263 CA GLU A 136 10.355 19.238 -3.246 1.00 1.52 C ATOM 2264 C GLU A 136 9.804 19.293 -1.823 1.00 1.52 C ATOM 2265 O GLU A 136 10.107 20.200 -1.047 1.00 1.59 O ATOM 2266 CB GLU A 136 9.591 20.214 -4.141 1.00 1.67 C ATOM 2267 CG GLU A 136 8.095 19.938 -4.199 1.00 1.73 C ATOM 2268 CD GLU A 136 7.345 20.946 -5.039 1.00 1.93 C ATOM 2269 OE1 GLU A 136 7.095 22.065 -4.545 1.00 2.12 O ATOM 2270 OE2 GLU A 136 6.995 20.624 -6.194 1.00 1.99 O ATOM 0 H GLU A 136 9.476 17.786 -4.460 1.00 1.46 H new ATOM 0 HA GLU A 136 11.408 19.518 -3.238 1.00 1.52 H new ATOM 0 HB2 GLU A 136 9.752 21.229 -3.779 1.00 1.67 H new ATOM 0 HB3 GLU A 136 10.001 20.167 -5.150 1.00 1.67 H new ATOM 0 HG2 GLU A 136 7.930 18.940 -4.604 1.00 1.73 H new ATOM 0 HG3 GLU A 136 7.690 19.942 -3.187 1.00 1.73 H new ATOM 2277 N LYS A 137 8.987 18.295 -1.499 1.00 1.53 N ATOM 2278 CA LYS A 137 8.351 18.196 -0.197 1.00 1.61 C ATOM 2279 C LYS A 137 9.295 17.539 0.803 1.00 1.55 C ATOM 2280 O LYS A 137 9.792 18.192 1.719 1.00 1.63 O ATOM 2281 CB LYS A 137 7.060 17.384 -0.318 1.00 1.72 C ATOM 2282 CG LYS A 137 6.118 17.909 -1.391 1.00 1.83 C ATOM 2283 CD LYS A 137 4.949 16.966 -1.625 1.00 2.14 C ATOM 2284 CE LYS A 137 4.052 17.470 -2.743 1.00 2.31 C ATOM 2285 NZ LYS A 137 2.912 16.553 -3.001 1.00 2.98 N ATOM 0 H LYS A 137 8.750 17.534 -2.135 1.00 1.53 H new ATOM 0 HA LYS A 137 8.112 19.197 0.161 1.00 1.61 H new ATOM 0 HB2 LYS A 137 7.311 16.347 -0.540 1.00 1.72 H new ATOM 0 HB3 LYS A 137 6.544 17.389 0.642 1.00 1.72 H new ATOM 0 HG2 LYS A 137 5.742 18.889 -1.097 1.00 1.83 H new ATOM 0 HG3 LYS A 137 6.668 18.045 -2.322 1.00 1.83 H new ATOM 0 HD2 LYS A 137 5.323 15.973 -1.875 1.00 2.14 H new ATOM 0 HD3 LYS A 137 4.370 16.866 -0.707 1.00 2.14 H new ATOM 0 HE2 LYS A 137 3.671 18.458 -2.484 1.00 2.31 H new ATOM 0 HE3 LYS A 137 4.639 17.584 -3.655 1.00 2.31 H new ATOM 0 HZ1 LYS A 137 2.326 16.935 -3.771 1.00 2.98 H new ATOM 0 HZ2 LYS A 137 3.274 15.617 -3.274 1.00 2.98 H new ATOM 0 HZ3 LYS A 137 2.336 16.464 -2.139 1.00 2.98 H new ATOM 2299 N LYS A 138 9.534 16.244 0.628 1.00 1.47 N ATOM 2300 CA LYS A 138 10.464 15.512 1.472 1.00 1.45 C ATOM 2301 C LYS A 138 11.878 16.070 1.354 1.00 1.34 C ATOM 2302 O LYS A 138 12.369 16.753 2.252 1.00 1.43 O ATOM 2303 CB LYS A 138 10.489 14.045 1.053 1.00 1.48 C ATOM 2304 CG LYS A 138 10.832 13.091 2.172 1.00 1.52 C ATOM 2305 CD LYS A 138 9.665 12.926 3.124 1.00 1.58 C ATOM 2306 CE LYS A 138 8.463 12.268 2.444 1.00 1.42 C ATOM 2307 NZ LYS A 138 7.538 13.255 1.818 1.00 1.76 N ATOM 0 H LYS A 138 9.092 15.679 -0.097 1.00 1.47 H new ATOM 0 HA LYS A 138 10.128 15.614 2.504 1.00 1.45 H new ATOM 0 HB2 LYS A 138 9.513 13.777 0.648 1.00 1.48 H new ATOM 0 HB3 LYS A 138 11.214 13.920 0.248 1.00 1.48 H new ATOM 0 HG2 LYS A 138 11.106 12.121 1.756 1.00 1.52 H new ATOM 0 HG3 LYS A 138 11.700 13.461 2.717 1.00 1.52 H new ATOM 0 HD2 LYS A 138 9.975 12.322 3.977 1.00 1.58 H new ATOM 0 HD3 LYS A 138 9.373 13.901 3.513 1.00 1.58 H new ATOM 0 HE2 LYS A 138 8.818 11.576 1.681 1.00 1.42 H new ATOM 0 HE3 LYS A 138 7.914 11.679 3.179 1.00 1.42 H new ATOM 0 HZ1 LYS A 138 6.583 13.134 2.212 1.00 1.76 H new ATOM 0 HZ2 LYS A 138 7.874 14.219 2.015 1.00 1.76 H new ATOM 0 HZ3 LYS A 138 7.510 13.101 0.790 1.00 1.76 H new ATOM 2321 N ASP A 169 12.496 15.777 0.214 1.00 1.23 N ATOM 2322 CA ASP A 169 13.914 16.025 -0.020 1.00 1.18 C ATOM 2323 C ASP A 169 14.752 15.364 1.054 1.00 1.11 C ATOM 2324 O ASP A 169 15.192 15.997 2.015 1.00 1.30 O ATOM 2325 CB ASP A 169 14.257 17.511 -0.129 1.00 1.35 C ATOM 2326 CG ASP A 169 15.713 17.721 -0.506 1.00 1.44 C ATOM 2327 OD1 ASP A 169 16.054 17.532 -1.693 1.00 1.48 O ATOM 2328 OD2 ASP A 169 16.528 18.061 0.378 1.00 1.59 O ATOM 0 H ASP A 169 12.020 15.355 -0.583 1.00 1.23 H new ATOM 0 HA ASP A 169 14.150 15.582 -0.988 1.00 1.18 H new ATOM 0 HB2 ASP A 169 13.616 17.979 -0.876 1.00 1.35 H new ATOM 0 HB3 ASP A 169 14.052 18.003 0.822 1.00 1.35 H new ATOM 2333 N GLU A 170 14.938 14.073 0.883 1.00 0.96 N ATOM 2334 CA GLU A 170 15.715 13.273 1.802 1.00 0.90 C ATOM 2335 C GLU A 170 16.257 12.038 1.098 1.00 0.78 C ATOM 2336 O GLU A 170 15.718 11.597 0.066 1.00 0.77 O ATOM 2337 CB GLU A 170 14.873 12.833 3.009 1.00 0.98 C ATOM 2338 CG GLU A 170 14.796 13.842 4.140 1.00 1.24 C ATOM 2339 CD GLU A 170 14.307 13.208 5.426 1.00 1.90 C ATOM 2340 OE1 GLU A 170 13.072 13.105 5.608 1.00 2.57 O ATOM 2341 OE2 GLU A 170 15.144 12.831 6.271 1.00 2.27 O ATOM 0 H GLU A 170 14.552 13.547 0.099 1.00 0.96 H new ATOM 0 HA GLU A 170 16.541 13.890 2.156 1.00 0.90 H new ATOM 0 HB2 GLU A 170 13.861 12.615 2.667 1.00 0.98 H new ATOM 0 HB3 GLU A 170 15.284 11.902 3.400 1.00 0.98 H new ATOM 0 HG2 GLU A 170 15.780 14.282 4.303 1.00 1.24 H new ATOM 0 HG3 GLU A 170 14.126 14.654 3.858 1.00 1.24 H new ATOM 2348 N LEU A 171 17.341 11.508 1.650 1.00 0.73 N ATOM 2349 CA LEU A 171 17.847 10.200 1.265 1.00 0.67 C ATOM 2350 C LEU A 171 16.893 9.147 1.772 1.00 0.62 C ATOM 2351 O LEU A 171 16.828 8.050 1.254 1.00 0.57 O ATOM 2352 CB LEU A 171 19.228 9.957 1.867 1.00 0.71 C ATOM 2353 CG LEU A 171 20.248 11.037 1.555 1.00 0.77 C ATOM 2354 CD1 LEU A 171 21.597 10.698 2.165 1.00 0.86 C ATOM 2355 CD2 LEU A 171 20.360 11.220 0.053 1.00 0.74 C ATOM 0 H LEU A 171 17.891 11.971 2.374 1.00 0.73 H new ATOM 0 HA LEU A 171 17.929 10.154 0.179 1.00 0.67 H new ATOM 0 HB2 LEU A 171 19.129 9.870 2.949 1.00 0.71 H new ATOM 0 HB3 LEU A 171 19.606 9.001 1.504 1.00 0.71 H new ATOM 0 HG LEU A 171 19.914 11.976 1.996 1.00 0.77 H new ATOM 0 HD11 LEU A 171 22.312 11.486 1.928 1.00 0.86 H new ATOM 0 HD12 LEU A 171 21.496 10.613 3.247 1.00 0.86 H new ATOM 0 HD13 LEU A 171 21.953 9.751 1.758 1.00 0.86 H new ATOM 0 HD21 LEU A 171 21.093 11.996 -0.165 1.00 0.74 H new ATOM 0 HD22 LEU A 171 20.676 10.283 -0.405 1.00 0.74 H new ATOM 0 HD23 LEU A 171 19.391 11.513 -0.351 1.00 0.74 H new ATOM 2367 N ASN A 172 16.168 9.521 2.807 1.00 0.65 N ATOM 2368 CA ASN A 172 15.147 8.682 3.401 1.00 0.63 C ATOM 2369 C ASN A 172 15.686 7.310 3.756 1.00 0.57 C ATOM 2370 O ASN A 172 15.379 6.326 3.085 1.00 0.53 O ATOM 2371 CB ASN A 172 13.952 8.531 2.459 1.00 0.65 C ATOM 2372 CG ASN A 172 13.027 9.727 2.461 1.00 0.75 C ATOM 2373 OD1 ASN A 172 12.189 9.880 3.348 1.00 0.90 O ATOM 2374 ND2 ASN A 172 13.131 10.553 1.436 1.00 0.80 N ATOM 0 H ASN A 172 16.273 10.427 3.264 1.00 0.65 H new ATOM 0 HA ASN A 172 14.824 9.174 4.319 1.00 0.63 H new ATOM 0 HB2 ASN A 172 14.317 8.366 1.445 1.00 0.65 H new ATOM 0 HB3 ASN A 172 13.386 7.644 2.742 1.00 0.65 H new ATOM 0 HD21 ASN A 172 12.502 11.353 1.360 1.00 0.80 H new ATOM 0 HD22 ASN A 172 13.840 10.391 0.721 1.00 0.80 H new ATOM 2381 N TRP A 173 16.470 7.229 4.815 1.00 0.58 N ATOM 2382 CA TRP A 173 16.928 5.946 5.300 1.00 0.55 C ATOM 2383 C TRP A 173 15.836 5.389 6.199 1.00 0.54 C ATOM 2384 O TRP A 173 15.685 5.825 7.343 1.00 0.61 O ATOM 2385 CB TRP A 173 18.240 6.094 6.076 1.00 0.60 C ATOM 2386 CG TRP A 173 19.452 6.220 5.205 1.00 0.63 C ATOM 2387 CD1 TRP A 173 19.812 7.294 4.442 1.00 0.72 C ATOM 2388 CD2 TRP A 173 20.476 5.238 5.023 1.00 0.64 C ATOM 2389 NE1 TRP A 173 20.989 7.034 3.789 1.00 0.78 N ATOM 2390 CE2 TRP A 173 21.417 5.778 4.129 1.00 0.73 C ATOM 2391 CE3 TRP A 173 20.684 3.950 5.524 1.00 0.65 C ATOM 2392 CZ2 TRP A 173 22.553 5.079 3.731 1.00 0.80 C ATOM 2393 CZ3 TRP A 173 21.813 3.257 5.129 1.00 0.73 C ATOM 2394 CH2 TRP A 173 22.733 3.822 4.238 1.00 0.79 C ATOM 0 H TRP A 173 16.800 8.032 5.351 1.00 0.58 H new ATOM 0 HA TRP A 173 17.123 5.271 4.466 1.00 0.55 H new ATOM 0 HB2 TRP A 173 18.173 6.973 6.718 1.00 0.60 H new ATOM 0 HB3 TRP A 173 18.363 5.230 6.730 1.00 0.60 H new ATOM 0 HD1 TRP A 173 19.251 8.214 4.364 1.00 0.72 H new ATOM 0 HE1 TRP A 173 21.468 7.672 3.153 1.00 0.78 H new ATOM 0 HE3 TRP A 173 19.976 3.504 6.207 1.00 0.65 H new ATOM 0 HZ2 TRP A 173 23.266 5.514 3.047 1.00 0.80 H new ATOM 0 HZ3 TRP A 173 21.988 2.263 5.514 1.00 0.73 H new ATOM 0 HH2 TRP A 173 23.603 3.253 3.945 1.00 0.79 H new ATOM 2405 N LEU A 174 15.055 4.465 5.659 1.00 0.49 N ATOM 2406 CA LEU A 174 13.822 4.028 6.295 1.00 0.49 C ATOM 2407 C LEU A 174 14.034 3.550 7.719 1.00 0.53 C ATOM 2408 O LEU A 174 14.923 2.746 8.009 1.00 0.56 O ATOM 2409 CB LEU A 174 13.126 2.949 5.472 1.00 0.48 C ATOM 2410 CG LEU A 174 12.510 3.431 4.159 1.00 0.50 C ATOM 2411 CD1 LEU A 174 11.486 2.425 3.663 1.00 0.52 C ATOM 2412 CD2 LEU A 174 11.874 4.798 4.342 1.00 0.54 C ATOM 0 H LEU A 174 15.256 4.000 4.774 1.00 0.49 H new ATOM 0 HA LEU A 174 13.177 4.905 6.341 1.00 0.49 H new ATOM 0 HB2 LEU A 174 13.847 2.162 5.250 1.00 0.48 H new ATOM 0 HB3 LEU A 174 12.341 2.500 6.080 1.00 0.48 H new ATOM 0 HG LEU A 174 13.299 3.520 3.412 1.00 0.50 H new ATOM 0 HD11 LEU A 174 11.053 2.778 2.727 1.00 0.52 H new ATOM 0 HD12 LEU A 174 11.971 1.463 3.498 1.00 0.52 H new ATOM 0 HD13 LEU A 174 10.698 2.311 4.407 1.00 0.52 H new ATOM 0 HD21 LEU A 174 11.440 5.127 3.398 1.00 0.54 H new ATOM 0 HD22 LEU A 174 11.092 4.737 5.099 1.00 0.54 H new ATOM 0 HD23 LEU A 174 12.633 5.513 4.661 1.00 0.54 H new ATOM 2424 N ASP A 175 13.164 4.054 8.579 1.00 0.61 N ATOM 2425 CA ASP A 175 13.224 3.839 10.022 1.00 0.72 C ATOM 2426 C ASP A 175 12.873 2.407 10.413 1.00 0.68 C ATOM 2427 O ASP A 175 13.268 1.941 11.483 1.00 0.75 O ATOM 2428 CB ASP A 175 12.262 4.812 10.718 1.00 0.93 C ATOM 2429 CG ASP A 175 10.919 4.913 10.009 1.00 1.83 C ATOM 2430 OD1 ASP A 175 10.110 3.968 10.126 1.00 2.37 O ATOM 2431 OD2 ASP A 175 10.656 5.946 9.357 1.00 2.56 O ATOM 0 H ASP A 175 12.378 4.637 8.291 1.00 0.61 H new ATOM 0 HA ASP A 175 14.251 4.019 10.340 1.00 0.72 H new ATOM 0 HB2 ASP A 175 12.103 4.487 11.746 1.00 0.93 H new ATOM 0 HB3 ASP A 175 12.720 5.800 10.764 1.00 0.93 H new ATOM 2436 N HIS A 176 12.135 1.717 9.540 1.00 0.66 N ATOM 2437 CA HIS A 176 11.660 0.353 9.812 1.00 0.71 C ATOM 2438 C HIS A 176 10.594 0.360 10.898 1.00 0.83 C ATOM 2439 O HIS A 176 10.362 -0.653 11.556 1.00 1.10 O ATOM 2440 CB HIS A 176 12.804 -0.581 10.235 1.00 0.71 C ATOM 2441 CG HIS A 176 13.709 -0.998 9.124 1.00 0.69 C ATOM 2442 ND1 HIS A 176 13.512 -2.147 8.399 1.00 0.77 N ATOM 2443 CD2 HIS A 176 14.828 -0.428 8.625 1.00 0.67 C ATOM 2444 CE1 HIS A 176 14.467 -2.265 7.499 1.00 0.76 C ATOM 2445 NE2 HIS A 176 15.289 -1.237 7.614 1.00 0.69 N ATOM 0 H HIS A 176 11.850 2.082 8.631 1.00 0.66 H new ATOM 0 HA HIS A 176 11.235 -0.023 8.881 1.00 0.71 H new ATOM 0 HB2 HIS A 176 13.397 -0.083 11.002 1.00 0.71 H new ATOM 0 HB3 HIS A 176 12.377 -1.473 10.692 1.00 0.71 H new ATOM 0 HD2 HIS A 176 15.278 0.495 8.960 1.00 0.67 H new ATOM 0 HE1 HIS A 176 14.562 -3.070 6.785 1.00 0.76 H new ATOM 0 HE2 HIS A 176 16.122 -1.072 7.050 1.00 0.69 H new ATOM 2454 N GLY A 177 9.937 1.493 11.070 1.00 0.82 N ATOM 2455 CA GLY A 177 8.929 1.609 12.102 1.00 0.96 C ATOM 2456 C GLY A 177 7.589 2.037 11.551 1.00 1.00 C ATOM 2457 O GLY A 177 6.548 1.545 11.983 1.00 1.34 O ATOM 0 H GLY A 177 10.082 2.336 10.514 1.00 0.82 H new ATOM 0 HA2 GLY A 177 8.821 0.651 12.610 1.00 0.96 H new ATOM 0 HA3 GLY A 177 9.259 2.331 12.849 1.00 0.96 H new ATOM 2461 N ARG A 178 7.614 2.950 10.594 1.00 0.90 N ATOM 2462 CA ARG A 178 6.391 3.450 9.985 1.00 0.99 C ATOM 2463 C ARG A 178 6.035 2.689 8.723 1.00 0.87 C ATOM 2464 O ARG A 178 6.854 1.960 8.155 1.00 0.86 O ATOM 2465 CB ARG A 178 6.525 4.924 9.632 1.00 1.22 C ATOM 2466 CG ARG A 178 6.424 5.861 10.814 1.00 1.27 C ATOM 2467 CD ARG A 178 6.723 7.281 10.386 1.00 1.18 C ATOM 2468 NE ARG A 178 8.066 7.384 9.822 1.00 1.23 N ATOM 2469 CZ ARG A 178 8.632 8.522 9.418 1.00 1.74 C ATOM 2470 NH1 ARG A 178 7.939 9.656 9.419 1.00 2.16 N ATOM 2471 NH2 ARG A 178 9.889 8.511 8.993 1.00 2.18 N ATOM 0 H ARG A 178 8.470 3.361 10.221 1.00 0.90 H new ATOM 0 HA ARG A 178 5.600 3.310 10.721 1.00 0.99 H new ATOM 0 HB2 ARG A 178 7.485 5.081 9.140 1.00 1.22 H new ATOM 0 HB3 ARG A 178 5.751 5.184 8.910 1.00 1.22 H new ATOM 0 HG2 ARG A 178 5.424 5.807 11.245 1.00 1.27 H new ATOM 0 HG3 ARG A 178 7.123 5.553 11.591 1.00 1.27 H new ATOM 0 HD2 ARG A 178 5.989 7.605 9.648 1.00 1.18 H new ATOM 0 HD3 ARG A 178 6.631 7.950 11.242 1.00 1.18 H new ATOM 0 HE ARG A 178 8.609 6.526 9.731 1.00 1.23 H new ATOM 0 HH11 ARG A 178 6.968 9.660 9.730 1.00 2.16 H new ATOM 0 HH12 ARG A 178 8.379 10.523 9.109 1.00 2.16 H new ATOM 0 HH21 ARG A 178 10.414 7.637 8.977 1.00 2.18 H new ATOM 0 HH22 ARG A 178 10.330 9.377 8.682 1.00 2.18 H new ATOM 2485 N THR A 179 4.802 2.882 8.293 1.00 0.91 N ATOM 2486 CA THR A 179 4.339 2.372 7.017 1.00 0.89 C ATOM 2487 C THR A 179 4.711 3.346 5.906 1.00 0.86 C ATOM 2488 O THR A 179 4.952 4.530 6.158 1.00 0.91 O ATOM 2489 CB THR A 179 2.813 2.123 7.028 1.00 1.05 C ATOM 2490 OG1 THR A 179 2.297 2.045 5.692 1.00 1.20 O ATOM 2491 CG2 THR A 179 2.090 3.215 7.794 1.00 1.11 C ATOM 0 H THR A 179 4.095 3.396 8.818 1.00 0.91 H new ATOM 0 HA THR A 179 4.827 1.415 6.835 1.00 0.89 H new ATOM 0 HB THR A 179 2.639 1.170 7.528 1.00 1.05 H new ATOM 0 HG1 THR A 179 1.623 1.335 5.643 1.00 1.20 H new ATOM 0 HG21 THR A 179 1.018 3.016 7.787 1.00 1.11 H new ATOM 0 HG22 THR A 179 2.448 3.236 8.823 1.00 1.11 H new ATOM 0 HG23 THR A 179 2.283 4.179 7.323 1.00 1.11 H new ATOM 2499 N LEU A 180 4.748 2.846 4.686 1.00 0.84 N ATOM 2500 CA LEU A 180 5.211 3.619 3.544 1.00 0.84 C ATOM 2501 C LEU A 180 4.252 4.765 3.242 1.00 0.93 C ATOM 2502 O LEU A 180 4.669 5.865 2.867 1.00 0.97 O ATOM 2503 CB LEU A 180 5.338 2.693 2.336 1.00 0.85 C ATOM 2504 CG LEU A 180 5.972 1.335 2.646 1.00 0.83 C ATOM 2505 CD1 LEU A 180 6.074 0.484 1.397 1.00 1.08 C ATOM 2506 CD2 LEU A 180 7.339 1.506 3.286 1.00 0.90 C ATOM 0 H LEU A 180 4.459 1.895 4.456 1.00 0.84 H new ATOM 0 HA LEU A 180 6.184 4.054 3.774 1.00 0.84 H new ATOM 0 HB2 LEU A 180 4.347 2.530 1.913 1.00 0.85 H new ATOM 0 HB3 LEU A 180 5.933 3.192 1.571 1.00 0.85 H new ATOM 0 HG LEU A 180 5.324 0.821 3.356 1.00 0.83 H new ATOM 0 HD11 LEU A 180 6.528 -0.475 1.646 1.00 1.08 H new ATOM 0 HD12 LEU A 180 5.078 0.318 0.987 1.00 1.08 H new ATOM 0 HD13 LEU A 180 6.690 0.996 0.657 1.00 1.08 H new ATOM 0 HD21 LEU A 180 7.768 0.526 3.496 1.00 0.90 H new ATOM 0 HD22 LEU A 180 7.994 2.050 2.605 1.00 0.90 H new ATOM 0 HD23 LEU A 180 7.238 2.065 4.216 1.00 0.90 H new ATOM 2518 N ARG A 181 2.969 4.503 3.436 1.00 1.02 N ATOM 2519 CA ARG A 181 1.929 5.490 3.179 1.00 1.13 C ATOM 2520 C ARG A 181 1.960 6.590 4.249 1.00 1.18 C ATOM 2521 O ARG A 181 1.554 7.724 4.006 1.00 1.36 O ATOM 2522 CB ARG A 181 0.572 4.770 3.128 1.00 1.22 C ATOM 2523 CG ARG A 181 -0.595 5.608 2.618 1.00 1.15 C ATOM 2524 CD ARG A 181 -1.254 6.389 3.738 1.00 0.69 C ATOM 2525 NE ARG A 181 -1.576 5.530 4.876 1.00 1.10 N ATOM 2526 CZ ARG A 181 -1.710 5.978 6.123 1.00 2.02 C ATOM 2527 NH1 ARG A 181 -1.711 7.285 6.364 1.00 2.54 N ATOM 2528 NH2 ARG A 181 -1.883 5.122 7.120 1.00 2.64 N ATOM 0 H ARG A 181 2.619 3.606 3.774 1.00 1.02 H new ATOM 0 HA ARG A 181 2.099 5.980 2.220 1.00 1.13 H new ATOM 0 HB2 ARG A 181 0.670 3.890 2.492 1.00 1.22 H new ATOM 0 HB3 ARG A 181 0.331 4.414 4.130 1.00 1.22 H new ATOM 0 HG2 ARG A 181 -0.241 6.298 1.852 1.00 1.15 H new ATOM 0 HG3 ARG A 181 -1.331 4.958 2.145 1.00 1.15 H new ATOM 0 HD2 ARG A 181 -0.591 7.191 4.063 1.00 0.69 H new ATOM 0 HD3 ARG A 181 -2.165 6.859 3.367 1.00 0.69 H new ATOM 0 HE ARG A 181 -1.705 4.533 4.706 1.00 1.10 H new ATOM 0 HH11 ARG A 181 -1.609 7.946 5.594 1.00 2.54 H new ATOM 0 HH12 ARG A 181 -1.814 7.627 7.319 1.00 2.54 H new ATOM 0 HH21 ARG A 181 -1.914 4.120 6.932 1.00 2.64 H new ATOM 0 HH22 ARG A 181 -1.986 5.465 8.075 1.00 2.64 H new ATOM 2542 N GLU A 182 2.474 6.245 5.426 1.00 1.11 N ATOM 2543 CA GLU A 182 2.617 7.199 6.526 1.00 1.18 C ATOM 2544 C GLU A 182 3.891 8.022 6.349 1.00 1.16 C ATOM 2545 O GLU A 182 4.015 9.122 6.883 1.00 1.25 O ATOM 2546 CB GLU A 182 2.664 6.441 7.856 1.00 1.25 C ATOM 2547 CG GLU A 182 2.804 7.314 9.092 1.00 1.34 C ATOM 2548 CD GLU A 182 1.550 8.100 9.408 1.00 1.89 C ATOM 2549 OE1 GLU A 182 0.559 7.487 9.865 1.00 2.30 O ATOM 2550 OE2 GLU A 182 1.550 9.331 9.216 1.00 2.31 O ATOM 0 H GLU A 182 2.801 5.304 5.645 1.00 1.11 H new ATOM 0 HA GLU A 182 1.763 7.876 6.525 1.00 1.18 H new ATOM 0 HB2 GLU A 182 1.754 5.848 7.950 1.00 1.25 H new ATOM 0 HB3 GLU A 182 3.499 5.741 7.828 1.00 1.25 H new ATOM 0 HG2 GLU A 182 3.057 6.686 9.946 1.00 1.34 H new ATOM 0 HG3 GLU A 182 3.633 8.007 8.948 1.00 1.34 H new ATOM 2557 N GLN A 183 4.844 7.473 5.610 1.00 1.07 N ATOM 2558 CA GLN A 183 6.062 8.200 5.276 1.00 1.06 C ATOM 2559 C GLN A 183 5.755 9.302 4.285 1.00 1.13 C ATOM 2560 O GLN A 183 6.203 10.440 4.429 1.00 1.22 O ATOM 2561 CB GLN A 183 7.088 7.281 4.637 1.00 1.00 C ATOM 2562 CG GLN A 183 7.609 6.190 5.545 1.00 1.00 C ATOM 2563 CD GLN A 183 8.405 5.166 4.771 1.00 1.04 C ATOM 2564 OE1 GLN A 183 9.022 5.484 3.755 1.00 1.65 O ATOM 2565 NE2 GLN A 183 8.392 3.930 5.230 1.00 0.81 N ATOM 0 H GLN A 183 4.798 6.527 5.230 1.00 1.07 H new ATOM 0 HA GLN A 183 6.460 8.612 6.203 1.00 1.06 H new ATOM 0 HB2 GLN A 183 6.644 6.820 3.755 1.00 1.00 H new ATOM 0 HB3 GLN A 183 7.930 7.882 4.293 1.00 1.00 H new ATOM 0 HG2 GLN A 183 8.235 6.629 6.322 1.00 1.00 H new ATOM 0 HG3 GLN A 183 6.774 5.701 6.046 1.00 1.00 H new ATOM 0 HE21 GLN A 183 7.868 3.706 6.076 1.00 0.81 H new ATOM 0 HE22 GLN A 183 8.906 3.198 4.739 1.00 0.81 H new ATOM 2574 N GLY A 184 4.986 8.938 3.276 1.00 1.16 N ATOM 2575 CA GLY A 184 4.753 9.821 2.164 1.00 1.28 C ATOM 2576 C GLY A 184 5.586 9.425 0.971 1.00 1.23 C ATOM 2577 O GLY A 184 6.166 10.273 0.300 1.00 1.38 O ATOM 0 H GLY A 184 4.515 8.036 3.210 1.00 1.16 H new ATOM 0 HA2 GLY A 184 3.697 9.802 1.896 1.00 1.28 H new ATOM 0 HA3 GLY A 184 4.990 10.845 2.453 1.00 1.28 H new ATOM 2581 N VAL A 185 5.692 8.121 0.740 1.00 1.10 N ATOM 2582 CA VAL A 185 6.379 7.618 -0.436 1.00 1.08 C ATOM 2583 C VAL A 185 5.532 7.847 -1.685 1.00 1.02 C ATOM 2584 O VAL A 185 4.302 7.794 -1.634 1.00 1.15 O ATOM 2585 CB VAL A 185 6.705 6.106 -0.321 1.00 1.13 C ATOM 2586 CG1 VAL A 185 7.484 5.805 0.949 1.00 1.31 C ATOM 2587 CG2 VAL A 185 5.441 5.261 -0.378 1.00 1.14 C ATOM 0 H VAL A 185 5.311 7.398 1.351 1.00 1.10 H new ATOM 0 HA VAL A 185 7.318 8.167 -0.512 1.00 1.08 H new ATOM 0 HB VAL A 185 7.329 5.845 -1.176 1.00 1.13 H new ATOM 0 HG11 VAL A 185 7.697 4.737 1.001 1.00 1.31 H new ATOM 0 HG12 VAL A 185 8.421 6.362 0.942 1.00 1.31 H new ATOM 0 HG13 VAL A 185 6.893 6.099 1.817 1.00 1.31 H new ATOM 0 HG21 VAL A 185 5.704 4.207 -0.295 1.00 1.14 H new ATOM 0 HG22 VAL A 185 4.782 5.536 0.445 1.00 1.14 H new ATOM 0 HG23 VAL A 185 4.930 5.434 -1.325 1.00 1.14 H new ATOM 2597 N GLU A 186 6.191 8.121 -2.796 1.00 0.93 N ATOM 2598 CA GLU A 186 5.527 8.150 -4.076 1.00 0.92 C ATOM 2599 C GLU A 186 5.902 6.891 -4.832 1.00 0.83 C ATOM 2600 O GLU A 186 7.001 6.351 -4.653 1.00 0.82 O ATOM 2601 CB GLU A 186 5.908 9.394 -4.883 1.00 1.02 C ATOM 2602 CG GLU A 186 5.424 10.699 -4.275 1.00 1.46 C ATOM 2603 CD GLU A 186 3.913 10.779 -4.219 1.00 2.45 C ATOM 2604 OE1 GLU A 186 3.255 10.550 -5.253 1.00 2.97 O ATOM 2605 OE2 GLU A 186 3.374 11.072 -3.130 1.00 3.02 O ATOM 0 H GLU A 186 7.189 8.327 -2.832 1.00 0.93 H new ATOM 0 HA GLU A 186 4.449 8.193 -3.920 1.00 0.92 H new ATOM 0 HB2 GLU A 186 6.993 9.432 -4.982 1.00 1.02 H new ATOM 0 HB3 GLU A 186 5.499 9.301 -5.889 1.00 1.02 H new ATOM 0 HG2 GLU A 186 5.829 10.801 -3.268 1.00 1.46 H new ATOM 0 HG3 GLU A 186 5.809 11.535 -4.859 1.00 1.46 H new ATOM 2612 N GLU A 187 5.003 6.426 -5.670 1.00 0.89 N ATOM 2613 CA GLU A 187 5.185 5.159 -6.355 1.00 0.91 C ATOM 2614 C GLU A 187 6.255 5.266 -7.439 1.00 0.91 C ATOM 2615 O GLU A 187 6.809 4.263 -7.877 1.00 1.14 O ATOM 2616 CB GLU A 187 3.856 4.705 -6.943 1.00 1.05 C ATOM 2617 CG GLU A 187 2.809 4.386 -5.884 1.00 1.11 C ATOM 2618 CD GLU A 187 1.434 4.126 -6.467 1.00 1.36 C ATOM 2619 OE1 GLU A 187 0.890 5.019 -7.155 1.00 1.86 O ATOM 2620 OE2 GLU A 187 0.895 3.016 -6.256 1.00 1.72 O ATOM 0 H GLU A 187 4.133 6.907 -5.897 1.00 0.89 H new ATOM 0 HA GLU A 187 5.528 4.416 -5.635 1.00 0.91 H new ATOM 0 HB2 GLU A 187 3.472 5.485 -7.601 1.00 1.05 H new ATOM 0 HB3 GLU A 187 4.022 3.821 -7.559 1.00 1.05 H new ATOM 0 HG2 GLU A 187 3.128 3.511 -5.318 1.00 1.11 H new ATOM 0 HG3 GLU A 187 2.748 5.216 -5.180 1.00 1.11 H new ATOM 2627 N HIS A 188 6.566 6.490 -7.835 1.00 0.92 N ATOM 2628 CA HIS A 188 7.555 6.727 -8.882 1.00 0.95 C ATOM 2629 C HIS A 188 8.956 6.944 -8.308 1.00 0.92 C ATOM 2630 O HIS A 188 9.926 7.008 -9.058 1.00 1.01 O ATOM 2631 CB HIS A 188 7.152 7.940 -9.731 1.00 1.04 C ATOM 2632 CG HIS A 188 6.985 9.198 -8.939 1.00 1.03 C ATOM 2633 ND1 HIS A 188 5.759 9.736 -8.635 1.00 1.09 N ATOM 2634 CD2 HIS A 188 7.899 10.001 -8.354 1.00 1.08 C ATOM 2635 CE1 HIS A 188 5.927 10.812 -7.892 1.00 1.14 C ATOM 2636 NE2 HIS A 188 7.221 10.996 -7.704 1.00 1.15 N ATOM 0 H HIS A 188 6.149 7.337 -7.449 1.00 0.92 H new ATOM 0 HA HIS A 188 7.583 5.834 -9.507 1.00 0.95 H new ATOM 0 HB2 HIS A 188 7.908 8.102 -10.499 1.00 1.04 H new ATOM 0 HB3 HIS A 188 6.217 7.718 -10.246 1.00 1.04 H new ATOM 0 HD1 HIS A 188 4.859 9.362 -8.937 1.00 1.09 H new ATOM 0 HD2 HIS A 188 8.972 9.880 -8.392 1.00 1.08 H new ATOM 0 HE1 HIS A 188 5.138 11.438 -7.502 1.00 1.14 H new ATOM 2645 N GLU A 189 9.063 7.051 -6.985 1.00 0.89 N ATOM 2646 CA GLU A 189 10.334 7.402 -6.354 1.00 0.92 C ATOM 2647 C GLU A 189 11.315 6.240 -6.417 1.00 0.78 C ATOM 2648 O GLU A 189 10.946 5.098 -6.124 1.00 0.74 O ATOM 2649 CB GLU A 189 10.124 7.801 -4.894 1.00 1.10 C ATOM 2650 CG GLU A 189 9.226 9.009 -4.693 1.00 1.37 C ATOM 2651 CD GLU A 189 9.748 10.261 -5.368 1.00 1.82 C ATOM 2652 OE1 GLU A 189 10.975 10.369 -5.540 1.00 2.38 O ATOM 2653 OE2 GLU A 189 8.938 11.142 -5.717 1.00 2.34 O ATOM 0 H GLU A 189 8.292 6.901 -6.334 1.00 0.89 H new ATOM 0 HA GLU A 189 10.747 8.248 -6.904 1.00 0.92 H new ATOM 0 HB2 GLU A 189 9.697 6.954 -4.357 1.00 1.10 H new ATOM 0 HB3 GLU A 189 11.095 8.007 -4.444 1.00 1.10 H new ATOM 0 HG2 GLU A 189 8.232 8.783 -5.080 1.00 1.37 H new ATOM 0 HG3 GLU A 189 9.117 9.199 -3.625 1.00 1.37 H new ATOM 2660 N THR A 190 12.551 6.525 -6.812 1.00 0.74 N ATOM 2661 CA THR A 190 13.584 5.504 -6.853 1.00 0.66 C ATOM 2662 C THR A 190 14.125 5.224 -5.458 1.00 0.57 C ATOM 2663 O THR A 190 14.695 6.096 -4.807 1.00 0.61 O ATOM 2664 CB THR A 190 14.736 5.912 -7.790 1.00 0.70 C ATOM 2665 OG1 THR A 190 14.223 6.163 -9.109 1.00 0.81 O ATOM 2666 CG2 THR A 190 15.794 4.821 -7.854 1.00 0.66 C ATOM 0 H THR A 190 12.858 7.452 -7.107 1.00 0.74 H new ATOM 0 HA THR A 190 13.128 4.594 -7.243 1.00 0.66 H new ATOM 0 HB THR A 190 15.196 6.818 -7.396 1.00 0.70 H new ATOM 0 HG1 THR A 190 14.958 6.424 -9.702 1.00 0.81 H new ATOM 0 HG21 THR A 190 16.597 5.132 -8.522 1.00 0.66 H new ATOM 0 HG22 THR A 190 16.198 4.647 -6.857 1.00 0.66 H new ATOM 0 HG23 THR A 190 15.346 3.901 -8.229 1.00 0.66 H new ATOM 2674 N LEU A 191 13.948 4.001 -5.006 1.00 0.48 N ATOM 2675 CA LEU A 191 14.336 3.632 -3.659 1.00 0.42 C ATOM 2676 C LEU A 191 15.468 2.619 -3.737 1.00 0.39 C ATOM 2677 O LEU A 191 15.477 1.765 -4.618 1.00 0.38 O ATOM 2678 CB LEU A 191 13.129 3.062 -2.901 1.00 0.41 C ATOM 2679 CG LEU A 191 11.799 3.793 -3.149 1.00 0.51 C ATOM 2680 CD1 LEU A 191 10.701 3.232 -2.269 1.00 1.01 C ATOM 2681 CD2 LEU A 191 11.935 5.288 -2.917 1.00 0.82 C ATOM 0 H LEU A 191 13.537 3.243 -5.552 1.00 0.48 H new ATOM 0 HA LEU A 191 14.683 4.509 -3.113 1.00 0.42 H new ATOM 0 HB2 LEU A 191 13.007 2.015 -3.178 1.00 0.41 H new ATOM 0 HB3 LEU A 191 13.346 3.086 -1.833 1.00 0.41 H new ATOM 0 HG LEU A 191 11.531 3.631 -4.193 1.00 0.51 H new ATOM 0 HD11 LEU A 191 9.771 3.766 -2.463 1.00 1.01 H new ATOM 0 HD12 LEU A 191 10.564 2.173 -2.488 1.00 1.01 H new ATOM 0 HD13 LEU A 191 10.977 3.353 -1.221 1.00 1.01 H new ATOM 0 HD21 LEU A 191 10.977 5.773 -3.101 1.00 0.82 H new ATOM 0 HD22 LEU A 191 12.242 5.470 -1.887 1.00 0.82 H new ATOM 0 HD23 LEU A 191 12.684 5.695 -3.596 1.00 0.82 H new ATOM 2693 N LEU A 192 16.443 2.725 -2.856 1.00 0.39 N ATOM 2694 CA LEU A 192 17.621 1.879 -2.936 1.00 0.41 C ATOM 2695 C LEU A 192 17.789 1.106 -1.638 1.00 0.40 C ATOM 2696 O LEU A 192 17.261 1.507 -0.601 1.00 0.44 O ATOM 2697 CB LEU A 192 18.875 2.735 -3.162 1.00 0.44 C ATOM 2698 CG LEU A 192 18.652 4.075 -3.871 1.00 0.49 C ATOM 2699 CD1 LEU A 192 19.892 4.941 -3.759 1.00 0.56 C ATOM 2700 CD2 LEU A 192 18.294 3.873 -5.332 1.00 0.50 C ATOM 0 H LEU A 192 16.445 3.385 -2.079 1.00 0.39 H new ATOM 0 HA LEU A 192 17.494 1.188 -3.769 1.00 0.41 H new ATOM 0 HB2 LEU A 192 19.337 2.931 -2.194 1.00 0.44 H new ATOM 0 HB3 LEU A 192 19.589 2.152 -3.744 1.00 0.44 H new ATOM 0 HG LEU A 192 17.817 4.576 -3.382 1.00 0.49 H new ATOM 0 HD11 LEU A 192 19.720 5.890 -4.267 1.00 0.56 H new ATOM 0 HD12 LEU A 192 20.112 5.127 -2.708 1.00 0.56 H new ATOM 0 HD13 LEU A 192 20.736 4.430 -4.222 1.00 0.56 H new ATOM 0 HD21 LEU A 192 18.142 4.842 -5.807 1.00 0.50 H new ATOM 0 HD22 LEU A 192 19.104 3.345 -5.835 1.00 0.50 H new ATOM 0 HD23 LEU A 192 17.378 3.286 -5.404 1.00 0.50 H new ATOM 2712 N LEU A 193 18.491 -0.011 -1.694 1.00 0.43 N ATOM 2713 CA LEU A 193 18.917 -0.677 -0.479 1.00 0.50 C ATOM 2714 C LEU A 193 20.421 -0.523 -0.317 1.00 0.47 C ATOM 2715 O LEU A 193 21.161 -0.482 -1.301 1.00 0.49 O ATOM 2716 CB LEU A 193 18.504 -2.156 -0.483 1.00 0.68 C ATOM 2717 CG LEU A 193 19.171 -3.043 -1.539 1.00 0.44 C ATOM 2718 CD1 LEU A 193 20.438 -3.684 -0.995 1.00 1.09 C ATOM 2719 CD2 LEU A 193 18.206 -4.111 -2.014 1.00 1.03 C ATOM 0 H LEU A 193 18.775 -0.472 -2.559 1.00 0.43 H new ATOM 0 HA LEU A 193 18.422 -0.210 0.373 1.00 0.50 H new ATOM 0 HB2 LEU A 193 18.719 -2.574 0.500 1.00 0.68 H new ATOM 0 HB3 LEU A 193 17.424 -2.210 -0.623 1.00 0.68 H new ATOM 0 HG LEU A 193 19.446 -2.412 -2.384 1.00 0.44 H new ATOM 0 HD11 LEU A 193 20.890 -4.308 -1.766 1.00 1.09 H new ATOM 0 HD12 LEU A 193 21.141 -2.906 -0.699 1.00 1.09 H new ATOM 0 HD13 LEU A 193 20.192 -4.299 -0.129 1.00 1.09 H new ATOM 0 HD21 LEU A 193 18.693 -4.734 -2.764 1.00 1.03 H new ATOM 0 HD22 LEU A 193 17.904 -4.730 -1.169 1.00 1.03 H new ATOM 0 HD23 LEU A 193 17.326 -3.638 -2.451 1.00 1.03 H new ATOM 2731 N ARG A 194 20.864 -0.426 0.919 1.00 0.46 N ATOM 2732 CA ARG A 194 22.273 -0.237 1.214 1.00 0.46 C ATOM 2733 C ARG A 194 22.731 -1.299 2.190 1.00 0.44 C ATOM 2734 O ARG A 194 22.062 -1.555 3.194 1.00 0.49 O ATOM 2735 CB ARG A 194 22.539 1.149 1.809 1.00 0.53 C ATOM 2736 CG ARG A 194 22.210 2.305 0.877 1.00 0.60 C ATOM 2737 CD ARG A 194 23.072 2.301 -0.377 1.00 0.65 C ATOM 2738 NE ARG A 194 24.502 2.304 -0.066 1.00 0.69 N ATOM 2739 CZ ARG A 194 25.462 2.075 -0.961 1.00 0.95 C ATOM 2740 NH1 ARG A 194 25.158 1.851 -2.236 1.00 1.25 N ATOM 2741 NH2 ARG A 194 26.733 2.082 -0.583 1.00 1.06 N ATOM 0 H ARG A 194 20.265 -0.475 1.743 1.00 0.46 H new ATOM 0 HA ARG A 194 22.829 -0.319 0.280 1.00 0.46 H new ATOM 0 HB2 ARG A 194 21.955 1.257 2.723 1.00 0.53 H new ATOM 0 HB3 ARG A 194 23.589 1.214 2.093 1.00 0.53 H new ATOM 0 HG2 ARG A 194 21.159 2.251 0.593 1.00 0.60 H new ATOM 0 HG3 ARG A 194 22.349 3.247 1.407 1.00 0.60 H new ATOM 0 HD2 ARG A 194 22.834 1.422 -0.976 1.00 0.65 H new ATOM 0 HD3 ARG A 194 22.832 3.174 -0.983 1.00 0.65 H new ATOM 0 HE ARG A 194 24.781 2.493 0.897 1.00 0.69 H new ATOM 0 HH11 ARG A 194 24.183 1.854 -2.536 1.00 1.25 H new ATOM 0 HH12 ARG A 194 25.900 1.677 -2.914 1.00 1.25 H new ATOM 0 HH21 ARG A 194 26.974 2.262 0.391 1.00 1.06 H new ATOM 0 HH22 ARG A 194 27.469 1.907 -1.267 1.00 1.06 H new ATOM 2755 N ARG A 195 23.852 -1.927 1.892 1.00 0.45 N ATOM 2756 CA ARG A 195 24.404 -2.932 2.777 1.00 0.50 C ATOM 2757 C ARG A 195 25.081 -2.255 3.960 1.00 0.55 C ATOM 2758 O ARG A 195 26.173 -1.705 3.830 1.00 0.64 O ATOM 2759 CB ARG A 195 25.392 -3.822 2.026 1.00 0.59 C ATOM 2760 CG ARG A 195 25.689 -5.117 2.752 1.00 1.02 C ATOM 2761 CD ARG A 195 26.653 -6.009 1.987 1.00 1.07 C ATOM 2762 NE ARG A 195 26.537 -7.392 2.437 1.00 1.49 N ATOM 2763 CZ ARG A 195 27.351 -8.382 2.094 1.00 2.13 C ATOM 2764 NH1 ARG A 195 28.431 -8.155 1.360 1.00 2.34 N ATOM 2765 NH2 ARG A 195 27.083 -9.610 2.511 1.00 2.68 N ATOM 0 H ARG A 195 24.396 -1.759 1.046 1.00 0.45 H new ATOM 0 HA ARG A 195 23.596 -3.564 3.147 1.00 0.50 H new ATOM 0 HB2 ARG A 195 24.990 -4.049 1.038 1.00 0.59 H new ATOM 0 HB3 ARG A 195 26.323 -3.275 1.874 1.00 0.59 H new ATOM 0 HG2 ARG A 195 26.109 -4.891 3.732 1.00 1.02 H new ATOM 0 HG3 ARG A 195 24.757 -5.656 2.921 1.00 1.02 H new ATOM 0 HD2 ARG A 195 26.443 -5.949 0.919 1.00 1.07 H new ATOM 0 HD3 ARG A 195 27.675 -5.658 2.131 1.00 1.07 H new ATOM 0 HE ARG A 195 25.767 -7.616 3.067 1.00 1.49 H new ATOM 0 HH11 ARG A 195 28.647 -7.208 1.050 1.00 2.34 H new ATOM 0 HH12 ARG A 195 29.046 -8.928 1.105 1.00 2.34 H new ATOM 0 HH21 ARG A 195 26.260 -9.785 3.088 1.00 2.68 H new ATOM 0 HH22 ARG A 195 27.700 -10.381 2.255 1.00 2.68 H new ATOM 2779 N LYS A 196 24.411 -2.269 5.104 1.00 0.60 N ATOM 2780 CA LYS A 196 24.905 -1.573 6.281 1.00 0.69 C ATOM 2781 C LYS A 196 25.856 -2.466 7.073 1.00 0.76 C ATOM 2782 O LYS A 196 26.758 -1.982 7.757 1.00 0.88 O ATOM 2783 CB LYS A 196 23.737 -1.109 7.157 1.00 0.75 C ATOM 2784 CG LYS A 196 24.160 -0.205 8.304 1.00 0.88 C ATOM 2785 CD LYS A 196 22.967 0.431 9.000 1.00 1.28 C ATOM 2786 CE LYS A 196 22.048 -0.608 9.623 1.00 1.65 C ATOM 2787 NZ LYS A 196 20.946 0.024 10.396 1.00 2.15 N ATOM 0 H LYS A 196 23.525 -2.755 5.241 1.00 0.60 H new ATOM 0 HA LYS A 196 25.459 -0.693 5.956 1.00 0.69 H new ATOM 0 HB2 LYS A 196 23.015 -0.580 6.535 1.00 0.75 H new ATOM 0 HB3 LYS A 196 23.228 -1.983 7.563 1.00 0.75 H new ATOM 0 HG2 LYS A 196 24.736 -0.783 9.027 1.00 0.88 H new ATOM 0 HG3 LYS A 196 24.818 0.577 7.925 1.00 0.88 H new ATOM 0 HD2 LYS A 196 23.320 1.113 9.774 1.00 1.28 H new ATOM 0 HD3 LYS A 196 22.405 1.028 8.282 1.00 1.28 H new ATOM 0 HE2 LYS A 196 21.628 -1.238 8.839 1.00 1.65 H new ATOM 0 HE3 LYS A 196 22.626 -1.258 10.279 1.00 1.65 H new ATOM 0 HZ1 LYS A 196 20.341 -0.716 10.806 1.00 2.15 H new ATOM 0 HZ2 LYS A 196 21.347 0.606 11.159 1.00 2.15 H new ATOM 0 HZ3 LYS A 196 20.379 0.625 9.764 1.00 2.15 H new ATOM 2801 N PHE A 197 25.646 -3.774 6.980 1.00 0.77 N ATOM 2802 CA PHE A 197 26.577 -4.732 7.560 1.00 0.89 C ATOM 2803 C PHE A 197 27.259 -5.486 6.436 1.00 0.96 C ATOM 2804 O PHE A 197 26.624 -5.813 5.441 1.00 0.92 O ATOM 2805 CB PHE A 197 25.877 -5.738 8.476 1.00 0.95 C ATOM 2806 CG PHE A 197 24.917 -5.135 9.463 1.00 0.94 C ATOM 2807 CD1 PHE A 197 25.275 -4.047 10.244 1.00 1.14 C ATOM 2808 CD2 PHE A 197 23.644 -5.661 9.599 1.00 0.92 C ATOM 2809 CE1 PHE A 197 24.378 -3.500 11.143 1.00 1.19 C ATOM 2810 CE2 PHE A 197 22.743 -5.121 10.492 1.00 0.95 C ATOM 2811 CZ PHE A 197 23.109 -4.037 11.266 1.00 1.03 C ATOM 0 H PHE A 197 24.843 -4.193 6.511 1.00 0.77 H new ATOM 0 HA PHE A 197 27.297 -4.178 8.163 1.00 0.89 H new ATOM 0 HB2 PHE A 197 25.337 -6.455 7.858 1.00 0.95 H new ATOM 0 HB3 PHE A 197 26.635 -6.297 9.024 1.00 0.95 H new ATOM 0 HD1 PHE A 197 26.264 -3.623 10.149 1.00 1.14 H new ATOM 0 HD2 PHE A 197 23.352 -6.508 8.996 1.00 0.92 H new ATOM 0 HE1 PHE A 197 24.668 -2.654 11.749 1.00 1.19 H new ATOM 0 HE2 PHE A 197 21.754 -5.544 10.586 1.00 0.95 H new ATOM 0 HZ PHE A 197 22.406 -3.610 11.966 1.00 1.03 H new ATOM 2821 N PHE A 198 28.533 -5.784 6.598 1.00 1.16 N ATOM 2822 CA PHE A 198 29.293 -6.428 5.534 1.00 1.33 C ATOM 2823 C PHE A 198 29.465 -7.909 5.815 1.00 1.58 C ATOM 2824 O PHE A 198 30.154 -8.621 5.083 1.00 2.05 O ATOM 2825 CB PHE A 198 30.644 -5.743 5.338 1.00 1.51 C ATOM 2826 CG PHE A 198 30.514 -4.345 4.806 1.00 1.40 C ATOM 2827 CD1 PHE A 198 29.942 -4.104 3.567 1.00 1.61 C ATOM 2828 CD2 PHE A 198 30.975 -3.269 5.548 1.00 1.53 C ATOM 2829 CE1 PHE A 198 29.831 -2.815 3.081 1.00 1.95 C ATOM 2830 CE2 PHE A 198 30.869 -1.981 5.067 1.00 1.78 C ATOM 2831 CZ PHE A 198 30.250 -1.764 3.810 1.00 2.00 C ATOM 0 H PHE A 198 29.064 -5.594 7.448 1.00 1.16 H new ATOM 0 HA PHE A 198 28.731 -6.327 4.606 1.00 1.33 H new ATOM 0 HB2 PHE A 198 31.175 -5.717 6.290 1.00 1.51 H new ATOM 0 HB3 PHE A 198 31.250 -6.334 4.651 1.00 1.51 H new ATOM 0 HD1 PHE A 198 29.579 -4.932 2.975 1.00 1.61 H new ATOM 0 HD2 PHE A 198 31.423 -3.442 6.515 1.00 1.53 H new ATOM 0 HE1 PHE A 198 29.403 -2.649 2.104 1.00 1.95 H new ATOM 0 HE2 PHE A 198 31.252 -1.149 5.640 1.00 1.78 H new ATOM 0 HZ PHE A 198 30.115 -0.759 3.439 1.00 2.00 H new ATOM 2841 N TYR A 199 28.823 -8.350 6.885 1.00 1.48 N ATOM 2842 CA TYR A 199 28.737 -9.749 7.246 1.00 1.79 C ATOM 2843 C TYR A 199 30.079 -10.341 7.603 1.00 2.06 C ATOM 2844 O TYR A 199 30.861 -10.754 6.745 1.00 2.27 O ATOM 2845 CB TYR A 199 28.069 -10.569 6.152 1.00 2.08 C ATOM 2846 CG TYR A 199 26.890 -11.335 6.678 1.00 2.04 C ATOM 2847 CD1 TYR A 199 25.871 -10.666 7.333 1.00 2.05 C ATOM 2848 CD2 TYR A 199 26.798 -12.711 6.539 1.00 2.35 C ATOM 2849 CE1 TYR A 199 24.781 -11.346 7.836 1.00 2.47 C ATOM 2850 CE2 TYR A 199 25.711 -13.403 7.039 1.00 2.78 C ATOM 2851 CZ TYR A 199 24.705 -12.715 7.686 1.00 2.89 C ATOM 2852 OH TYR A 199 23.621 -13.396 8.191 1.00 3.53 O ATOM 0 H TYR A 199 28.340 -7.731 7.536 1.00 1.48 H new ATOM 0 HA TYR A 199 28.115 -9.792 8.140 1.00 1.79 H new ATOM 0 HB2 TYR A 199 27.745 -9.908 5.348 1.00 2.08 H new ATOM 0 HB3 TYR A 199 28.792 -11.263 5.723 1.00 2.08 H new ATOM 0 HD1 TYR A 199 25.930 -9.594 7.452 1.00 2.05 H new ATOM 0 HD2 TYR A 199 27.586 -13.249 6.033 1.00 2.35 H new ATOM 0 HE1 TYR A 199 23.993 -10.810 8.344 1.00 2.47 H new ATOM 0 HE2 TYR A 199 25.649 -14.475 6.924 1.00 2.78 H new ATOM 0 HH TYR A 199 23.718 -14.353 8.002 1.00 3.53 H new ATOM 2862 N SER A 200 30.326 -10.378 8.887 1.00 2.43 N ATOM 2863 CA SER A 200 31.481 -11.055 9.441 1.00 3.08 C ATOM 2864 C SER A 200 31.177 -12.549 9.571 1.00 3.06 C ATOM 2865 O SER A 200 31.404 -13.156 10.623 1.00 3.33 O ATOM 2866 CB SER A 200 31.794 -10.444 10.800 1.00 3.56 C ATOM 2867 OG SER A 200 33.096 -10.791 11.244 1.00 4.12 O ATOM 0 H SER A 200 29.729 -9.937 9.587 1.00 2.43 H new ATOM 0 HA SER A 200 32.347 -10.937 8.789 1.00 3.08 H new ATOM 0 HB2 SER A 200 31.707 -9.359 10.740 1.00 3.56 H new ATOM 0 HB3 SER A 200 31.058 -10.783 11.529 1.00 3.56 H new ATOM 0 HG SER A 200 33.197 -11.766 11.231 1.00 4.12 H new ATOM 2873 N ASP A 201 30.645 -13.117 8.482 1.00 2.98 N ATOM 2874 CA ASP A 201 30.173 -14.504 8.426 1.00 3.19 C ATOM 2875 C ASP A 201 28.861 -14.676 9.197 1.00 3.05 C ATOM 2876 O ASP A 201 28.038 -15.528 8.860 1.00 3.25 O ATOM 2877 CB ASP A 201 31.240 -15.473 8.935 1.00 3.87 C ATOM 2878 CG ASP A 201 30.788 -16.917 8.883 1.00 4.29 C ATOM 2879 OD1 ASP A 201 30.755 -17.494 7.776 1.00 4.31 O ATOM 2880 OD2 ASP A 201 30.474 -17.486 9.945 1.00 4.89 O ATOM 0 H ASP A 201 30.529 -12.617 7.601 1.00 2.98 H new ATOM 0 HA ASP A 201 29.978 -14.743 7.381 1.00 3.19 H new ATOM 0 HB2 ASP A 201 32.145 -15.358 8.338 1.00 3.87 H new ATOM 0 HB3 ASP A 201 31.500 -15.214 9.961 1.00 3.87 H new ATOM 2885 N GLN A 202 28.663 -13.852 10.215 1.00 3.02 N ATOM 2886 CA GLN A 202 27.432 -13.854 10.988 1.00 3.45 C ATOM 2887 C GLN A 202 26.971 -12.414 11.189 1.00 3.85 C ATOM 2888 O GLN A 202 27.668 -11.659 11.897 1.00 4.18 O ATOM 2889 CB GLN A 202 27.651 -14.552 12.339 1.00 3.65 C ATOM 2890 CG GLN A 202 26.383 -15.134 12.959 1.00 4.42 C ATOM 2891 CD GLN A 202 25.440 -14.091 13.540 1.00 5.07 C ATOM 2892 OE1 GLN A 202 24.222 -14.269 13.532 1.00 5.73 O ATOM 2893 NE2 GLN A 202 25.989 -13.006 14.063 1.00 5.30 N ATOM 2894 OXT GLN A 202 25.922 -12.037 10.632 1.00 4.27 O ATOM 0 H GLN A 202 29.350 -13.165 10.527 1.00 3.02 H new ATOM 0 HA GLN A 202 26.661 -14.405 10.450 1.00 3.45 H new ATOM 0 HB2 GLN A 202 28.378 -15.354 12.207 1.00 3.65 H new ATOM 0 HB3 GLN A 202 28.088 -13.838 13.037 1.00 3.65 H new ATOM 0 HG2 GLN A 202 25.850 -15.707 12.200 1.00 4.42 H new ATOM 0 HG3 GLN A 202 26.664 -15.833 13.747 1.00 4.42 H new ATOM 0 HE21 GLN A 202 27.002 -12.891 14.052 1.00 5.30 H new ATOM 0 HE22 GLN A 202 25.399 -12.284 14.477 1.00 5.30 H new TER 2903 GLN A 202