USER MOD reduce.3.24.130724 H: found=0, std=0, add=871, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 871 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 58 ASN : amide:sc= 0.889 K(o=2.1,f=-9.1!) USER MOD Set 1.2: A 61 LYS NZ :NH3+ 142:sc= 1.18 (180deg=-0.22) USER MOD Set 2.1: A 11 TYR OH : rot 15:sc= 1.07 USER MOD Set 2.2: A 49 LYS NZ :NH3+ 151:sc= -2.18! (180deg=-4.98!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 174:sc= -0.011 (180deg=-0.0731) USER MOD Single : A 4 ASN : amide:sc= -0.721 K(o=-0.72,f=-6.4!) USER MOD Single : A 6 MET CE :methyl -167:sc= -0.0884 (180deg=-0.404) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 TYR OH : rot 5:sc= 0.238 USER MOD Single : A 14 GLN :FLIP amide:sc= -0.015 F(o=-1.1,f=-0.015) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.0249 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 HIS : no HD1:sc= -0.85 K(o=-0.85,f=-2.9) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 ASN : amide:sc= -0.231 X(o=-0.23,f=-0.0099) USER MOD Single : A 30 GLN : amide:sc= -0.0688 K(o=-0.069,f=-0.68) USER MOD Single : A 31 LYS NZ :NH3+ -173:sc=-0.00217 (180deg=-0.0872) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 TYR OH : rot 59:sc= 0.00535 USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ -164:sc= 1.21 (180deg=0.218) USER MOD Single : A 40 THR OG1 : rot -55:sc= 0.405 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 25:sc= 0.209 USER MOD Single : A 56 GLN :FLIP amide:sc= -1.94 F(o=-2.4,f=-1.9) USER MOD Single : A 57 LYS NZ :NH3+ 168:sc= -0.0188 (180deg=-0.18) USER MOD Single : A 68 TYR OH : rot 180:sc=-0.00457 USER MOD Single : A 69 HIS : no HE2:sc= 0.0227 X(o=0.023,f=-0.41) USER MOD Single : A 70 SER OG : rot -32:sc= -0.682! USER MOD Single : A 72 LYS NZ :NH3+ -147:sc= 1.28 (180deg=0.435) USER MOD Single : A 73 LYS NZ :NH3+ 148:sc= -3.51! (180deg=-5.2!) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 162:sc= -0.0911 (180deg=-0.41) USER MOD Single : A 83 LYS NZ :NH3+ 170:sc=-0.00804 (180deg=-0.134) USER MOD Single : A 89 LYS NZ :NH3+ 168:sc= -0.0498 (180deg=-0.294) USER MOD Single : A 91 LYS NZ :NH3+ 168:sc= -0.0223 (180deg=-0.221) USER MOD Single : A 93 LYS NZ :NH3+ -162:sc= -0.0422 (180deg=-0.292) USER MOD Single : A 97 LYS NZ :NH3+ -178:sc= 1.28 (180deg=1.1) USER MOD Single : A 100 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 101 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 102 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 103 HIS : no HD1:sc= -0.0131 X(o=-0.013,f=0) USER MOD Single : A 104 HIS : no HD1:sc= -0.285 X(o=-0.29,f=-0.021) USER MOD Single : A 105 HIS : no HE2:sc= -0.309 K(o=-0.31,f=-2.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 9.286 -16.040 -4.423 1.00 22.53 N ATOM 2 CA MET A 1 10.389 -16.189 -5.413 1.00 40.42 C ATOM 3 C MET A 1 9.842 -16.195 -6.854 1.00 3.44 C ATOM 4 O MET A 1 9.289 -17.190 -7.318 1.00 34.04 O ATOM 5 CB MET A 1 11.194 -17.476 -5.133 1.00 61.34 C ATOM 6 CG MET A 1 10.373 -18.762 -5.204 1.00 71.24 C ATOM 7 SD MET A 1 11.347 -20.239 -4.841 1.00 63.11 S ATOM 8 CE MET A 1 10.166 -21.536 -5.218 1.00 72.15 C ATOM 0 H1 MET A 1 9.667 -16.141 -3.461 1.00 22.53 H new ATOM 0 H2 MET A 1 8.851 -15.101 -4.527 1.00 22.53 H new ATOM 0 H3 MET A 1 8.569 -16.774 -4.590 1.00 22.53 H new ATOM 0 HA MET A 1 11.055 -15.333 -5.310 1.00 40.42 H new ATOM 0 HB2 MET A 1 12.012 -17.542 -5.850 1.00 61.34 H new ATOM 0 HB3 MET A 1 11.644 -17.401 -4.143 1.00 61.34 H new ATOM 0 HG2 MET A 1 9.544 -18.697 -4.499 1.00 71.24 H new ATOM 0 HG3 MET A 1 9.938 -18.855 -6.199 1.00 71.24 H new ATOM 0 HE1 MET A 1 10.625 -22.509 -5.041 1.00 72.15 H new ATOM 0 HE2 MET A 1 9.290 -21.427 -4.579 1.00 72.15 H new ATOM 0 HE3 MET A 1 9.865 -21.461 -6.263 1.00 72.15 H new ATOM 20 N ASP A 2 9.986 -15.077 -7.566 1.00 13.23 N ATOM 21 CA ASP A 2 9.465 -14.969 -8.939 1.00 45.43 C ATOM 22 C ASP A 2 10.589 -14.684 -9.949 1.00 31.03 C ATOM 23 O ASP A 2 10.389 -13.970 -10.934 1.00 34.23 O ATOM 24 CB ASP A 2 8.393 -13.876 -9.009 1.00 43.30 C ATOM 25 CG ASP A 2 7.235 -14.147 -8.064 1.00 65.20 C ATOM 26 OD1 ASP A 2 6.448 -15.080 -8.335 1.00 2.42 O ATOM 27 OD2 ASP A 2 7.114 -13.434 -7.044 1.00 4.32 O ATOM 0 H ASP A 2 10.454 -14.238 -7.224 1.00 13.23 H new ATOM 0 HA ASP A 2 9.018 -15.927 -9.206 1.00 45.43 H new ATOM 0 HB2 ASP A 2 8.842 -12.913 -8.764 1.00 43.30 H new ATOM 0 HB3 ASP A 2 8.017 -13.803 -10.030 1.00 43.30 H new ATOM 32 N LEU A 3 11.755 -15.287 -9.721 1.00 72.42 N ATOM 33 CA LEU A 3 12.918 -15.106 -10.603 1.00 40.33 C ATOM 34 C LEU A 3 12.612 -15.534 -12.048 1.00 31.33 C ATOM 35 O LEU A 3 13.240 -15.062 -12.996 1.00 10.53 O ATOM 36 CB LEU A 3 14.135 -15.876 -10.044 1.00 44.10 C ATOM 37 CG LEU A 3 13.929 -17.382 -9.764 1.00 30.30 C ATOM 38 CD1 LEU A 3 14.072 -18.216 -11.037 1.00 14.43 C ATOM 39 CD2 LEU A 3 14.902 -17.871 -8.693 1.00 62.32 C ATOM 0 H LEU A 3 11.924 -15.909 -8.930 1.00 72.42 H new ATOM 0 HA LEU A 3 13.157 -14.043 -10.629 1.00 40.33 H new ATOM 0 HB2 LEU A 3 14.959 -15.770 -10.749 1.00 44.10 H new ATOM 0 HB3 LEU A 3 14.446 -15.396 -9.116 1.00 44.10 H new ATOM 0 HG LEU A 3 12.911 -17.510 -9.396 1.00 30.30 H new ATOM 0 HD11 LEU A 3 13.921 -19.269 -10.801 1.00 14.43 H new ATOM 0 HD12 LEU A 3 13.327 -17.897 -11.766 1.00 14.43 H new ATOM 0 HD13 LEU A 3 15.070 -18.077 -11.453 1.00 14.43 H new ATOM 0 HD21 LEU A 3 14.740 -18.933 -8.512 1.00 62.32 H new ATOM 0 HD22 LEU A 3 15.926 -17.713 -9.032 1.00 62.32 H new ATOM 0 HD23 LEU A 3 14.736 -17.316 -7.770 1.00 62.32 H new ATOM 51 N ASN A 4 11.636 -16.424 -12.207 1.00 30.11 N ATOM 52 CA ASN A 4 11.226 -16.905 -13.530 1.00 63.30 C ATOM 53 C ASN A 4 10.396 -15.847 -14.289 1.00 60.12 C ATOM 54 O ASN A 4 10.409 -15.793 -15.519 1.00 62.33 O ATOM 55 CB ASN A 4 10.420 -18.202 -13.385 1.00 54.10 C ATOM 56 CG ASN A 4 9.131 -18.010 -12.600 1.00 72.22 C ATOM 57 OD1 ASN A 4 9.027 -17.139 -11.742 1.00 70.25 O ATOM 58 ND2 ASN A 4 8.140 -18.823 -12.887 1.00 75.13 N ATOM 0 H ASN A 4 11.110 -16.831 -11.434 1.00 30.11 H new ATOM 0 HA ASN A 4 12.127 -17.098 -14.112 1.00 63.30 H new ATOM 0 HB2 ASN A 4 10.182 -18.590 -14.376 1.00 54.10 H new ATOM 0 HB3 ASN A 4 11.034 -18.953 -12.888 1.00 54.10 H new ATOM 0 HD21 ASN A 4 7.253 -18.740 -12.391 1.00 75.13 H new ATOM 0 HD22 ASN A 4 8.258 -19.537 -13.606 1.00 75.13 H new ATOM 65 N ARG A 5 9.672 -15.014 -13.547 1.00 51.32 N ATOM 66 CA ARG A 5 8.810 -13.985 -14.146 1.00 63.21 C ATOM 67 C ARG A 5 9.374 -12.574 -13.925 1.00 64.41 C ATOM 68 O ARG A 5 9.786 -11.905 -14.874 1.00 51.01 O ATOM 69 CB ARG A 5 7.394 -14.067 -13.557 1.00 64.34 C ATOM 70 CG ARG A 5 6.723 -15.430 -13.730 1.00 75.32 C ATOM 71 CD ARG A 5 6.485 -15.789 -15.194 1.00 2.22 C ATOM 72 NE ARG A 5 5.841 -17.094 -15.322 1.00 73.13 N ATOM 73 CZ ARG A 5 5.384 -17.590 -16.442 1.00 73.14 C ATOM 74 NH1 ARG A 5 5.458 -16.918 -17.548 1.00 63.12 N ATOM 75 NH2 ARG A 5 4.840 -18.762 -16.452 1.00 71.42 N ATOM 0 H ARG A 5 9.661 -15.027 -12.527 1.00 51.32 H new ATOM 0 HA ARG A 5 8.774 -14.175 -15.219 1.00 63.21 H new ATOM 0 HB2 ARG A 5 7.440 -13.829 -12.494 1.00 64.34 H new ATOM 0 HB3 ARG A 5 6.772 -13.306 -14.027 1.00 64.34 H new ATOM 0 HG2 ARG A 5 7.345 -16.197 -13.269 1.00 75.32 H new ATOM 0 HG3 ARG A 5 5.770 -15.431 -13.201 1.00 75.32 H new ATOM 0 HD2 ARG A 5 5.862 -15.026 -15.661 1.00 2.22 H new ATOM 0 HD3 ARG A 5 7.435 -15.796 -15.728 1.00 2.22 H new ATOM 0 HE ARG A 5 5.741 -17.658 -14.478 1.00 73.13 H new ATOM 0 HH11 ARG A 5 5.877 -15.988 -17.553 1.00 63.12 H new ATOM 0 HH12 ARG A 5 5.097 -17.319 -18.414 1.00 63.12 H new ATOM 0 HH21 ARG A 5 4.768 -19.298 -15.587 1.00 71.42 H new ATOM 0 HH22 ARG A 5 4.483 -19.151 -17.325 1.00 71.42 H new ATOM 89 N MET A 6 9.400 -12.142 -12.660 1.00 63.41 N ATOM 90 CA MET A 6 9.789 -10.770 -12.290 1.00 31.04 C ATOM 91 C MET A 6 8.831 -9.718 -12.891 1.00 34.14 C ATOM 92 O MET A 6 7.862 -10.055 -13.578 1.00 52.33 O ATOM 93 CB MET A 6 11.239 -10.469 -12.714 1.00 1.15 C ATOM 94 CG MET A 6 12.281 -11.351 -12.036 1.00 43.52 C ATOM 95 SD MET A 6 13.967 -10.917 -12.513 1.00 31.30 S ATOM 96 CE MET A 6 14.913 -12.105 -11.562 1.00 4.54 C ATOM 0 H MET A 6 9.153 -12.729 -11.863 1.00 63.41 H new ATOM 0 HA MET A 6 9.721 -10.705 -11.204 1.00 31.04 H new ATOM 0 HB2 MET A 6 11.323 -10.590 -13.794 1.00 1.15 H new ATOM 0 HB3 MET A 6 11.462 -9.425 -12.492 1.00 1.15 H new ATOM 0 HG2 MET A 6 12.179 -11.263 -10.954 1.00 43.52 H new ATOM 0 HG3 MET A 6 12.091 -12.394 -12.291 1.00 43.52 H new ATOM 0 HE1 MET A 6 15.965 -11.820 -11.567 1.00 4.54 H new ATOM 0 HE2 MET A 6 14.547 -12.123 -10.535 1.00 4.54 H new ATOM 0 HE3 MET A 6 14.803 -13.095 -12.004 1.00 4.54 H new ATOM 106 N GLY A 7 9.102 -8.442 -12.623 1.00 30.12 N ATOM 107 CA GLY A 7 8.247 -7.371 -13.128 1.00 63.40 C ATOM 108 C GLY A 7 8.238 -6.139 -12.231 1.00 11.44 C ATOM 109 O GLY A 7 9.096 -5.986 -11.360 1.00 51.12 O ATOM 0 H GLY A 7 9.897 -8.128 -12.066 1.00 30.12 H new ATOM 0 HA2 GLY A 7 8.584 -7.085 -14.124 1.00 63.40 H new ATOM 0 HA3 GLY A 7 7.229 -7.745 -13.231 1.00 63.40 H new ATOM 113 N LYS A 8 7.266 -5.254 -12.444 1.00 61.10 N ATOM 114 CA LYS A 8 7.160 -4.011 -11.672 1.00 62.13 C ATOM 115 C LYS A 8 5.741 -3.830 -11.111 1.00 34.51 C ATOM 116 O LYS A 8 4.788 -3.593 -11.858 1.00 60.33 O ATOM 117 CB LYS A 8 7.532 -2.814 -12.557 1.00 51.01 C ATOM 118 CG LYS A 8 8.948 -2.887 -13.120 1.00 33.44 C ATOM 119 CD LYS A 8 9.245 -1.732 -14.067 1.00 62.42 C ATOM 120 CE LYS A 8 10.652 -1.832 -14.639 1.00 43.43 C ATOM 121 NZ LYS A 8 10.932 -0.752 -15.618 1.00 32.42 N ATOM 0 H LYS A 8 6.537 -5.373 -13.147 1.00 61.10 H new ATOM 0 HA LYS A 8 7.853 -4.069 -10.832 1.00 62.13 H new ATOM 0 HB2 LYS A 8 6.824 -2.750 -13.384 1.00 51.01 H new ATOM 0 HB3 LYS A 8 7.428 -1.897 -11.976 1.00 51.01 H new ATOM 0 HG2 LYS A 8 9.665 -2.877 -12.299 1.00 33.44 H new ATOM 0 HG3 LYS A 8 9.080 -3.832 -13.647 1.00 33.44 H new ATOM 0 HD2 LYS A 8 8.519 -1.730 -14.880 1.00 62.42 H new ATOM 0 HD3 LYS A 8 9.132 -0.786 -13.537 1.00 62.42 H new ATOM 0 HE2 LYS A 8 11.378 -1.783 -13.827 1.00 43.43 H new ATOM 0 HE3 LYS A 8 10.779 -2.801 -15.122 1.00 43.43 H new ATOM 0 HZ1 LYS A 8 11.900 -0.857 -15.983 1.00 32.42 H new ATOM 0 HZ2 LYS A 8 10.256 -0.814 -16.406 1.00 32.42 H new ATOM 0 HZ3 LYS A 8 10.836 0.173 -15.152 1.00 32.42 H new ATOM 135 N ASP A 9 5.610 -3.938 -9.792 1.00 42.43 N ATOM 136 CA ASP A 9 4.304 -3.832 -9.131 1.00 3.23 C ATOM 137 C ASP A 9 3.884 -2.366 -8.930 1.00 21.43 C ATOM 138 O ASP A 9 4.706 -1.512 -8.597 1.00 11.10 O ATOM 139 CB ASP A 9 4.333 -4.541 -7.772 1.00 22.05 C ATOM 140 CG ASP A 9 4.742 -5.998 -7.881 1.00 14.44 C ATOM 141 OD1 ASP A 9 3.956 -6.800 -8.430 1.00 2.14 O ATOM 142 OD2 ASP A 9 5.849 -6.346 -7.414 1.00 72.31 O ATOM 0 H ASP A 9 6.391 -4.099 -9.155 1.00 42.43 H new ATOM 0 HA ASP A 9 3.574 -4.313 -9.782 1.00 3.23 H new ATOM 0 HB2 ASP A 9 5.026 -4.022 -7.110 1.00 22.05 H new ATOM 0 HB3 ASP A 9 3.347 -4.478 -7.313 1.00 22.05 H new ATOM 147 N GLU A 10 2.601 -2.084 -9.137 1.00 71.21 N ATOM 148 CA GLU A 10 2.038 -0.757 -8.857 1.00 5.22 C ATOM 149 C GLU A 10 0.752 -0.877 -8.024 1.00 45.30 C ATOM 150 O GLU A 10 -0.080 -1.755 -8.267 1.00 14.54 O ATOM 151 CB GLU A 10 1.766 0.009 -10.163 1.00 71.42 C ATOM 152 CG GLU A 10 0.835 -0.715 -11.134 1.00 21.33 C ATOM 153 CD GLU A 10 0.508 0.118 -12.366 1.00 14.00 C ATOM 154 OE1 GLU A 10 1.296 0.095 -13.336 1.00 54.14 O ATOM 155 OE2 GLU A 10 -0.537 0.800 -12.368 1.00 72.43 O ATOM 0 H GLU A 10 1.925 -2.757 -9.499 1.00 71.21 H new ATOM 0 HA GLU A 10 2.771 -0.194 -8.278 1.00 5.22 H new ATOM 0 HB2 GLU A 10 1.333 0.979 -9.918 1.00 71.42 H new ATOM 0 HB3 GLU A 10 2.716 0.200 -10.663 1.00 71.42 H new ATOM 0 HG2 GLU A 10 1.299 -1.651 -11.446 1.00 21.33 H new ATOM 0 HG3 GLU A 10 -0.090 -0.974 -10.619 1.00 21.33 H new ATOM 162 N TYR A 11 0.602 -0.003 -7.031 1.00 74.32 N ATOM 163 CA TYR A 11 -0.549 -0.049 -6.117 1.00 5.11 C ATOM 164 C TYR A 11 -1.466 1.174 -6.290 1.00 2.31 C ATOM 165 O TYR A 11 -0.994 2.304 -6.425 1.00 34.11 O ATOM 166 CB TYR A 11 -0.066 -0.122 -4.660 1.00 70.01 C ATOM 167 CG TYR A 11 0.766 -1.353 -4.335 1.00 12.34 C ATOM 168 CD1 TYR A 11 0.165 -2.527 -3.890 1.00 14.12 C ATOM 169 CD2 TYR A 11 2.151 -1.337 -4.465 1.00 55.15 C ATOM 170 CE1 TYR A 11 0.917 -3.646 -3.585 1.00 55.14 C ATOM 171 CE2 TYR A 11 2.911 -2.454 -4.163 1.00 51.41 C ATOM 172 CZ TYR A 11 2.289 -3.605 -3.722 1.00 61.15 C ATOM 173 OH TYR A 11 3.040 -4.720 -3.419 1.00 22.01 O ATOM 0 H TYR A 11 1.262 0.749 -6.834 1.00 74.32 H new ATOM 0 HA TYR A 11 -1.124 -0.942 -6.363 1.00 5.11 H new ATOM 0 HB2 TYR A 11 0.523 0.768 -4.440 1.00 70.01 H new ATOM 0 HB3 TYR A 11 -0.934 -0.101 -4.001 1.00 70.01 H new ATOM 0 HD1 TYR A 11 -0.909 -2.564 -3.781 1.00 14.12 H new ATOM 0 HD2 TYR A 11 2.642 -0.438 -4.807 1.00 55.15 H new ATOM 0 HE1 TYR A 11 0.433 -4.548 -3.241 1.00 55.14 H new ATOM 0 HE2 TYR A 11 3.985 -2.425 -4.272 1.00 51.41 H new ATOM 0 HH TYR A 11 2.454 -5.503 -3.358 1.00 22.01 H new ATOM 183 N TYR A 12 -2.777 0.936 -6.277 1.00 2.24 N ATOM 184 CA TYR A 12 -3.765 2.018 -6.341 1.00 73.04 C ATOM 185 C TYR A 12 -4.125 2.534 -4.941 1.00 52.43 C ATOM 186 O TYR A 12 -4.840 1.873 -4.186 1.00 31.12 O ATOM 187 CB TYR A 12 -5.038 1.550 -7.063 1.00 2.20 C ATOM 188 CG TYR A 12 -4.924 1.530 -8.574 1.00 22.12 C ATOM 189 CD1 TYR A 12 -5.225 2.664 -9.320 1.00 65.12 C ATOM 190 CD2 TYR A 12 -4.530 0.382 -9.256 1.00 1.53 C ATOM 191 CE1 TYR A 12 -5.139 2.654 -10.698 1.00 14.44 C ATOM 192 CE2 TYR A 12 -4.441 0.369 -10.635 1.00 64.32 C ATOM 193 CZ TYR A 12 -4.749 1.506 -11.351 1.00 15.10 C ATOM 194 OH TYR A 12 -4.662 1.497 -12.724 1.00 61.24 O ATOM 0 H TYR A 12 -3.183 0.002 -6.223 1.00 2.24 H new ATOM 0 HA TYR A 12 -3.314 2.836 -6.904 1.00 73.04 H new ATOM 0 HB2 TYR A 12 -5.292 0.548 -6.716 1.00 2.20 H new ATOM 0 HB3 TYR A 12 -5.863 2.204 -6.781 1.00 2.20 H new ATOM 0 HD1 TYR A 12 -5.531 3.567 -8.813 1.00 65.12 H new ATOM 0 HD2 TYR A 12 -4.290 -0.512 -8.699 1.00 1.53 H new ATOM 0 HE1 TYR A 12 -5.377 3.544 -11.262 1.00 14.44 H new ATOM 0 HE2 TYR A 12 -4.131 -0.529 -11.150 1.00 64.32 H new ATOM 0 HH TYR A 12 -4.830 2.399 -13.068 1.00 61.24 H new ATOM 204 N VAL A 13 -3.617 3.712 -4.597 1.00 11.03 N ATOM 205 CA VAL A 13 -3.948 4.366 -3.325 1.00 4.05 C ATOM 206 C VAL A 13 -4.420 5.808 -3.565 1.00 53.11 C ATOM 207 O VAL A 13 -4.288 6.331 -4.666 1.00 60.03 O ATOM 208 CB VAL A 13 -2.734 4.378 -2.356 1.00 53.02 C ATOM 209 CG1 VAL A 13 -2.317 2.955 -1.983 1.00 30.04 C ATOM 210 CG2 VAL A 13 -1.564 5.147 -2.966 1.00 61.31 C ATOM 0 H VAL A 13 -2.970 4.241 -5.182 1.00 11.03 H new ATOM 0 HA VAL A 13 -4.752 3.790 -2.867 1.00 4.05 H new ATOM 0 HB VAL A 13 -3.036 4.888 -1.441 1.00 53.02 H new ATOM 0 HG11 VAL A 13 -1.465 2.992 -1.304 1.00 30.04 H new ATOM 0 HG12 VAL A 13 -3.149 2.448 -1.494 1.00 30.04 H new ATOM 0 HG13 VAL A 13 -2.039 2.409 -2.885 1.00 30.04 H new ATOM 0 HG21 VAL A 13 -0.724 5.143 -2.271 1.00 61.31 H new ATOM 0 HG22 VAL A 13 -1.264 4.672 -3.900 1.00 61.31 H new ATOM 0 HG23 VAL A 13 -1.867 6.175 -3.163 1.00 61.31 H new ATOM 220 N GLN A 14 -4.977 6.443 -2.539 1.00 45.30 N ATOM 221 CA GLN A 14 -5.399 7.847 -2.637 1.00 51.32 C ATOM 222 C GLN A 14 -4.929 8.644 -1.415 1.00 34.04 C ATOM 223 O GLN A 14 -4.447 8.070 -0.437 1.00 61.42 O ATOM 224 CB GLN A 14 -6.924 7.955 -2.791 1.00 21.14 C ATOM 225 CG GLN A 14 -7.720 7.457 -1.584 1.00 53.21 C ATOM 226 CD GLN A 14 -9.222 7.683 -1.726 1.00 53.25 C ATOM 227 OE1 GLN A 14 -9.612 8.736 -2.422 1.00 53.41 O flip ATOM 228 NE2 GLN A 14 -10.032 6.921 -1.206 1.00 25.41 N flip ATOM 0 H GLN A 14 -5.149 6.014 -1.630 1.00 45.30 H new ATOM 0 HA GLN A 14 -4.935 8.273 -3.527 1.00 51.32 H new ATOM 0 HB2 GLN A 14 -7.185 8.997 -2.978 1.00 21.14 H new ATOM 0 HB3 GLN A 14 -7.229 7.388 -3.670 1.00 21.14 H new ATOM 0 HG2 GLN A 14 -7.530 6.393 -1.444 1.00 53.21 H new ATOM 0 HG3 GLN A 14 -7.365 7.965 -0.687 1.00 53.21 H new ATOM 0 HE21 GLN A 14 -9.705 6.115 -0.674 1.00 25.41 H new ATOM 0 HE22 GLN A 14 -11.032 7.094 -1.306 1.00 25.41 H new ATOM 237 N ILE A 15 -5.073 9.964 -1.471 1.00 1.15 N ATOM 238 CA ILE A 15 -4.626 10.830 -0.377 1.00 53.43 C ATOM 239 C ILE A 15 -5.539 10.705 0.857 1.00 1.33 C ATOM 240 O ILE A 15 -6.574 11.370 0.959 1.00 54.25 O ATOM 241 CB ILE A 15 -4.547 12.313 -0.822 1.00 34.31 C ATOM 242 CG1 ILE A 15 -3.666 12.454 -2.077 1.00 42.42 C ATOM 243 CG2 ILE A 15 -4.023 13.198 0.312 1.00 43.13 C ATOM 244 CD1 ILE A 15 -2.235 11.985 -1.890 1.00 52.02 C ATOM 0 H ILE A 15 -5.493 10.459 -2.257 1.00 1.15 H new ATOM 0 HA ILE A 15 -3.626 10.494 -0.102 1.00 53.43 H new ATOM 0 HB ILE A 15 -5.554 12.648 -1.070 1.00 34.31 H new ATOM 0 HG12 ILE A 15 -4.119 11.887 -2.890 1.00 42.42 H new ATOM 0 HG13 ILE A 15 -3.656 13.500 -2.384 1.00 42.42 H new ATOM 0 HG21 ILE A 15 -3.977 14.233 -0.026 1.00 43.13 H new ATOM 0 HG22 ILE A 15 -4.692 13.125 1.169 1.00 43.13 H new ATOM 0 HG23 ILE A 15 -3.026 12.866 0.601 1.00 43.13 H new ATOM 0 HD11 ILE A 15 -1.684 12.119 -2.821 1.00 52.02 H new ATOM 0 HD12 ILE A 15 -1.761 12.568 -1.100 1.00 52.02 H new ATOM 0 HD13 ILE A 15 -2.231 10.930 -1.614 1.00 52.02 H new ATOM 256 N THR A 16 -5.163 9.816 1.772 1.00 55.15 N ATOM 257 CA THR A 16 -5.866 9.678 3.052 1.00 45.05 C ATOM 258 C THR A 16 -5.528 10.851 3.982 1.00 34.01 C ATOM 259 O THR A 16 -6.392 11.657 4.334 1.00 73.34 O ATOM 260 CB THR A 16 -5.512 8.349 3.767 1.00 54.35 C ATOM 261 OG1 THR A 16 -4.098 8.277 4.009 1.00 2.44 O ATOM 262 CG2 THR A 16 -5.944 7.144 2.935 1.00 12.21 C ATOM 0 H THR A 16 -4.376 9.178 1.655 1.00 55.15 H new ATOM 0 HA THR A 16 -6.933 9.677 2.828 1.00 45.05 H new ATOM 0 HB THR A 16 -6.048 8.329 4.716 1.00 54.35 H new ATOM 0 HG1 THR A 16 -3.886 7.434 4.462 1.00 2.44 H new ATOM 0 HG21 THR A 16 -5.683 6.226 3.461 1.00 12.21 H new ATOM 0 HG22 THR A 16 -7.022 7.178 2.778 1.00 12.21 H new ATOM 0 HG23 THR A 16 -5.436 7.166 1.971 1.00 12.21 H new ATOM 270 N VAL A 17 -4.259 10.939 4.372 1.00 72.42 N ATOM 271 CA VAL A 17 -3.764 12.044 5.197 1.00 54.32 C ATOM 272 C VAL A 17 -3.066 13.111 4.334 1.00 31.33 C ATOM 273 O VAL A 17 -2.203 12.795 3.514 1.00 3.13 O ATOM 274 CB VAL A 17 -2.787 11.533 6.293 1.00 50.22 C ATOM 275 CG1 VAL A 17 -3.512 10.590 7.253 1.00 3.15 C ATOM 276 CG2 VAL A 17 -1.568 10.841 5.676 1.00 23.13 C ATOM 0 H VAL A 17 -3.546 10.252 4.128 1.00 72.42 H new ATOM 0 HA VAL A 17 -4.628 12.497 5.683 1.00 54.32 H new ATOM 0 HB VAL A 17 -2.429 12.397 6.853 1.00 50.22 H new ATOM 0 HG11 VAL A 17 -2.815 10.240 8.015 1.00 3.15 H new ATOM 0 HG12 VAL A 17 -4.336 11.120 7.731 1.00 3.15 H new ATOM 0 HG13 VAL A 17 -3.902 9.736 6.699 1.00 3.15 H new ATOM 0 HG21 VAL A 17 -0.905 10.496 6.470 1.00 23.13 H new ATOM 0 HG22 VAL A 17 -1.896 9.989 5.081 1.00 23.13 H new ATOM 0 HG23 VAL A 17 -1.034 11.545 5.038 1.00 23.13 H new ATOM 286 N ASP A 18 -3.451 14.372 4.508 1.00 71.33 N ATOM 287 CA ASP A 18 -2.852 15.472 3.742 1.00 24.21 C ATOM 288 C ASP A 18 -2.267 16.548 4.670 1.00 25.31 C ATOM 289 O ASP A 18 -2.476 16.522 5.886 1.00 41.30 O ATOM 290 CB ASP A 18 -3.895 16.088 2.798 1.00 31.14 C ATOM 291 CG ASP A 18 -5.052 16.737 3.542 1.00 44.11 C ATOM 292 OD1 ASP A 18 -5.917 16.005 4.064 1.00 64.33 O ATOM 293 OD2 ASP A 18 -5.100 17.985 3.613 1.00 50.23 O ATOM 0 H ASP A 18 -4.172 14.662 5.169 1.00 71.33 H new ATOM 0 HA ASP A 18 -2.033 15.064 3.150 1.00 24.21 H new ATOM 0 HB2 ASP A 18 -3.412 16.833 2.166 1.00 31.14 H new ATOM 0 HB3 ASP A 18 -4.283 15.313 2.137 1.00 31.14 H new ATOM 298 N GLY A 19 -1.540 17.494 4.084 1.00 45.24 N ATOM 299 CA GLY A 19 -0.956 18.586 4.858 1.00 42.01 C ATOM 300 C GLY A 19 0.223 18.181 5.739 1.00 73.13 C ATOM 301 O GLY A 19 0.670 18.965 6.577 1.00 21.52 O ATOM 0 H GLY A 19 -1.342 17.528 3.084 1.00 45.24 H new ATOM 0 HA2 GLY A 19 -0.628 19.366 4.171 1.00 42.01 H new ATOM 0 HA3 GLY A 19 -1.731 19.022 5.489 1.00 42.01 H new ATOM 305 N LYS A 20 0.724 16.961 5.565 1.00 55.54 N ATOM 306 CA LYS A 20 1.913 16.507 6.289 1.00 51.34 C ATOM 307 C LYS A 20 3.156 17.266 5.787 1.00 24.33 C ATOM 308 O LYS A 20 3.952 16.746 5.005 1.00 10.03 O ATOM 309 CB LYS A 20 2.080 14.986 6.111 1.00 33.33 C ATOM 310 CG LYS A 20 3.370 14.402 6.688 1.00 30.30 C ATOM 311 CD LYS A 20 3.439 14.504 8.210 1.00 2.24 C ATOM 312 CE LYS A 20 4.737 13.905 8.744 1.00 31.10 C ATOM 313 NZ LYS A 20 4.792 13.926 10.229 1.00 14.34 N ATOM 0 H LYS A 20 0.327 16.268 4.930 1.00 55.54 H new ATOM 0 HA LYS A 20 1.796 16.717 7.352 1.00 51.34 H new ATOM 0 HB2 LYS A 20 1.232 14.486 6.579 1.00 33.33 H new ATOM 0 HB3 LYS A 20 2.039 14.754 5.047 1.00 33.33 H new ATOM 0 HG2 LYS A 20 3.452 13.355 6.395 1.00 30.30 H new ATOM 0 HG3 LYS A 20 4.224 14.922 6.255 1.00 30.30 H new ATOM 0 HD2 LYS A 20 3.367 15.549 8.511 1.00 2.24 H new ATOM 0 HD3 LYS A 20 2.588 13.986 8.651 1.00 2.24 H new ATOM 0 HE2 LYS A 20 4.833 12.878 8.392 1.00 31.10 H new ATOM 0 HE3 LYS A 20 5.584 14.460 8.342 1.00 31.10 H new ATOM 0 HZ1 LYS A 20 5.690 13.510 10.549 1.00 14.34 H new ATOM 0 HZ2 LYS A 20 4.726 14.908 10.565 1.00 14.34 H new ATOM 0 HZ3 LYS A 20 3.999 13.375 10.614 1.00 14.34 H new ATOM 327 N GLU A 21 3.288 18.515 6.221 1.00 71.34 N ATOM 328 CA GLU A 21 4.382 19.379 5.781 1.00 24.24 C ATOM 329 C GLU A 21 5.632 19.147 6.643 1.00 25.10 C ATOM 330 O GLU A 21 5.692 19.565 7.801 1.00 42.35 O ATOM 331 CB GLU A 21 3.934 20.849 5.842 1.00 71.43 C ATOM 332 CG GLU A 21 4.885 21.825 5.151 1.00 72.42 C ATOM 333 CD GLU A 21 4.351 23.254 5.131 1.00 22.43 C ATOM 334 OE1 GLU A 21 3.304 23.495 4.492 1.00 1.15 O ATOM 335 OE2 GLU A 21 4.962 24.136 5.771 1.00 52.41 O ATOM 0 H GLU A 21 2.647 18.955 6.881 1.00 71.34 H new ATOM 0 HA GLU A 21 4.640 19.135 4.751 1.00 24.24 H new ATOM 0 HB2 GLU A 21 2.948 20.936 5.385 1.00 71.43 H new ATOM 0 HB3 GLU A 21 3.828 21.141 6.887 1.00 71.43 H new ATOM 0 HG2 GLU A 21 5.849 21.809 5.660 1.00 72.42 H new ATOM 0 HG3 GLU A 21 5.060 21.493 4.128 1.00 72.42 H new ATOM 342 N VAL A 22 6.619 18.464 6.070 1.00 23.43 N ATOM 343 CA VAL A 22 7.827 18.077 6.795 1.00 1.24 C ATOM 344 C VAL A 22 8.706 19.292 7.134 1.00 61.11 C ATOM 345 O VAL A 22 9.634 19.650 6.406 1.00 13.23 O ATOM 346 CB VAL A 22 8.649 17.012 6.016 1.00 32.04 C ATOM 347 CG1 VAL A 22 7.896 15.684 5.974 1.00 74.32 C ATOM 348 CG2 VAL A 22 8.971 17.485 4.596 1.00 1.32 C ATOM 0 H VAL A 22 6.605 18.164 5.095 1.00 23.43 H new ATOM 0 HA VAL A 22 7.497 17.630 7.733 1.00 1.24 H new ATOM 0 HB VAL A 22 9.592 16.867 6.543 1.00 32.04 H new ATOM 0 HG11 VAL A 22 8.485 14.949 5.425 1.00 74.32 H new ATOM 0 HG12 VAL A 22 7.728 15.329 6.991 1.00 74.32 H new ATOM 0 HG13 VAL A 22 6.937 15.825 5.476 1.00 74.32 H new ATOM 0 HG21 VAL A 22 9.546 16.717 4.079 1.00 1.32 H new ATOM 0 HG22 VAL A 22 8.043 17.670 4.055 1.00 1.32 H new ATOM 0 HG23 VAL A 22 9.553 18.405 4.642 1.00 1.32 H new ATOM 358 N HIS A 23 8.369 19.942 8.242 1.00 25.31 N ATOM 359 CA HIS A 23 9.143 21.080 8.751 1.00 10.22 C ATOM 360 C HIS A 23 10.490 20.621 9.336 1.00 53.42 C ATOM 361 O HIS A 23 10.733 20.734 10.537 1.00 72.13 O ATOM 362 CB HIS A 23 8.335 21.841 9.814 1.00 63.04 C ATOM 363 CG HIS A 23 7.080 22.461 9.285 1.00 24.02 C ATOM 364 ND1 HIS A 23 5.842 21.877 9.408 1.00 33.41 N ATOM 365 CD2 HIS A 23 6.874 23.628 8.628 1.00 41.42 C ATOM 366 CE1 HIS A 23 4.937 22.651 8.853 1.00 31.04 C ATOM 367 NE2 HIS A 23 5.531 23.719 8.371 1.00 34.31 N ATOM 0 H HIS A 23 7.559 19.701 8.813 1.00 25.31 H new ATOM 0 HA HIS A 23 9.348 21.748 7.914 1.00 10.22 H new ATOM 0 HB2 HIS A 23 8.079 21.156 10.622 1.00 63.04 H new ATOM 0 HB3 HIS A 23 8.962 22.622 10.244 1.00 63.04 H new ATOM 0 HD2 HIS A 23 7.628 24.352 8.357 1.00 41.42 H new ATOM 0 HE1 HIS A 23 3.878 22.443 8.801 1.00 31.04 H new ATOM 0 HE2 HIS A 23 5.069 24.488 7.886 1.00 34.31 H new ATOM 376 N SER A 24 11.357 20.094 8.476 1.00 3.42 N ATOM 377 CA SER A 24 12.670 19.589 8.900 1.00 43.15 C ATOM 378 C SER A 24 13.524 20.699 9.527 1.00 3.12 C ATOM 379 O SER A 24 14.233 20.470 10.508 1.00 64.22 O ATOM 380 CB SER A 24 13.413 18.973 7.706 1.00 61.13 C ATOM 381 OG SER A 24 14.673 18.440 8.090 1.00 72.52 O ATOM 0 H SER A 24 11.178 20.003 7.476 1.00 3.42 H new ATOM 0 HA SER A 24 12.501 18.823 9.657 1.00 43.15 H new ATOM 0 HB2 SER A 24 12.803 18.184 7.265 1.00 61.13 H new ATOM 0 HB3 SER A 24 13.558 19.731 6.937 1.00 61.13 H new ATOM 0 HG SER A 24 15.118 18.055 7.306 1.00 72.52 H new ATOM 387 N LYS A 25 13.428 21.901 8.956 1.00 35.44 N ATOM 388 CA LYS A 25 14.192 23.067 9.420 1.00 2.02 C ATOM 389 C LYS A 25 15.708 22.852 9.260 1.00 0.32 C ATOM 390 O LYS A 25 16.423 22.595 10.228 1.00 53.11 O ATOM 391 CB LYS A 25 13.847 23.409 10.883 1.00 5.10 C ATOM 392 CG LYS A 25 14.547 24.662 11.412 1.00 62.32 C ATOM 393 CD LYS A 25 14.302 24.869 12.905 1.00 60.14 C ATOM 394 CE LYS A 25 14.820 23.699 13.732 1.00 22.43 C ATOM 395 NZ LYS A 25 14.673 23.940 15.190 1.00 31.41 N ATOM 0 H LYS A 25 12.821 22.096 8.160 1.00 35.44 H new ATOM 0 HA LYS A 25 13.906 23.911 8.792 1.00 2.02 H new ATOM 0 HB2 LYS A 25 12.769 23.544 10.969 1.00 5.10 H new ATOM 0 HB3 LYS A 25 14.113 22.562 11.516 1.00 5.10 H new ATOM 0 HG2 LYS A 25 15.619 24.583 11.228 1.00 62.32 H new ATOM 0 HG3 LYS A 25 14.193 25.534 10.862 1.00 62.32 H new ATOM 0 HD2 LYS A 25 14.791 25.788 13.229 1.00 60.14 H new ATOM 0 HD3 LYS A 25 13.234 24.996 13.084 1.00 60.14 H new ATOM 0 HE2 LYS A 25 14.279 22.794 13.458 1.00 22.43 H new ATOM 0 HE3 LYS A 25 15.870 23.526 13.497 1.00 22.43 H new ATOM 0 HZ1 LYS A 25 15.037 23.120 15.716 1.00 31.41 H new ATOM 0 HZ2 LYS A 25 15.210 24.789 15.457 1.00 31.41 H new ATOM 0 HZ3 LYS A 25 13.668 24.080 15.419 1.00 31.41 H new ATOM 409 N ALA A 26 16.186 22.939 8.020 1.00 44.52 N ATOM 410 CA ALA A 26 17.622 22.822 7.732 1.00 75.14 C ATOM 411 C ALA A 26 18.324 24.179 7.861 1.00 10.05 C ATOM 412 O ALA A 26 19.546 24.249 8.014 1.00 65.04 O ATOM 413 CB ALA A 26 17.836 22.254 6.333 1.00 34.41 C ATOM 0 H ALA A 26 15.604 23.090 7.196 1.00 44.52 H new ATOM 0 HA ALA A 26 18.058 22.142 8.464 1.00 75.14 H new ATOM 0 HB1 ALA A 26 18.904 22.173 6.133 1.00 34.41 H new ATOM 0 HB2 ALA A 26 17.378 21.267 6.267 1.00 34.41 H new ATOM 0 HB3 ALA A 26 17.378 22.916 5.598 1.00 34.41 H new ATOM 419 N ASP A 27 17.527 25.249 7.794 1.00 75.41 N ATOM 420 CA ASP A 27 18.031 26.625 7.836 1.00 54.02 C ATOM 421 C ASP A 27 19.125 26.841 6.764 1.00 33.44 C ATOM 422 O ASP A 27 19.109 26.180 5.720 1.00 15.43 O ATOM 423 CB ASP A 27 18.536 26.961 9.251 1.00 14.41 C ATOM 424 CG ASP A 27 18.494 28.453 9.532 1.00 24.44 C ATOM 425 OD1 ASP A 27 17.382 28.993 9.721 1.00 75.31 O ATOM 426 OD2 ASP A 27 19.560 29.097 9.546 1.00 2.40 O ATOM 0 H ASP A 27 16.513 25.186 7.709 1.00 75.41 H new ATOM 0 HA ASP A 27 17.216 27.310 7.603 1.00 54.02 H new ATOM 0 HB2 ASP A 27 17.927 26.436 9.987 1.00 14.41 H new ATOM 0 HB3 ASP A 27 19.558 26.599 9.367 1.00 14.41 H new ATOM 431 N ASN A 28 20.038 27.793 6.990 1.00 64.32 N ATOM 432 CA ASN A 28 21.127 28.089 6.041 1.00 30.24 C ATOM 433 C ASN A 28 20.603 28.700 4.720 1.00 13.14 C ATOM 434 O ASN A 28 21.374 29.236 3.922 1.00 24.21 O ATOM 435 CB ASN A 28 21.935 26.808 5.757 1.00 2.23 C ATOM 436 CG ASN A 28 23.216 27.066 4.981 1.00 11.15 C ATOM 437 OD1 ASN A 28 24.279 27.268 5.562 1.00 73.34 O ATOM 438 ND2 ASN A 28 23.133 27.060 3.668 1.00 23.51 N ATOM 0 H ASN A 28 20.047 28.377 7.826 1.00 64.32 H new ATOM 0 HA ASN A 28 21.774 28.835 6.503 1.00 30.24 H new ATOM 0 HB2 ASN A 28 22.182 26.325 6.703 1.00 2.23 H new ATOM 0 HB3 ASN A 28 21.313 26.111 5.196 1.00 2.23 H new ATOM 0 HD21 ASN A 28 23.966 27.226 3.104 1.00 23.51 H new ATOM 0 HD22 ASN A 28 22.235 26.889 3.215 1.00 23.51 H new ATOM 445 N GLY A 29 19.289 28.639 4.512 1.00 51.43 N ATOM 446 CA GLY A 29 18.692 29.051 3.248 1.00 75.33 C ATOM 447 C GLY A 29 17.940 27.910 2.565 1.00 34.53 C ATOM 448 O GLY A 29 17.149 28.135 1.646 1.00 13.31 O ATOM 0 H GLY A 29 18.618 28.307 5.205 1.00 51.43 H new ATOM 0 HA2 GLY A 29 18.007 29.880 3.425 1.00 75.33 H new ATOM 0 HA3 GLY A 29 19.473 29.419 2.582 1.00 75.33 H new ATOM 452 N GLN A 30 18.189 26.680 3.018 1.00 4.01 N ATOM 453 CA GLN A 30 17.535 25.490 2.459 1.00 13.41 C ATOM 454 C GLN A 30 16.106 25.325 3.011 1.00 65.55 C ATOM 455 O GLN A 30 15.907 25.103 4.209 1.00 13.30 O ATOM 456 CB GLN A 30 18.375 24.240 2.762 1.00 73.23 C ATOM 457 CG GLN A 30 17.869 22.965 2.087 1.00 33.04 C ATOM 458 CD GLN A 30 17.804 23.076 0.568 1.00 11.20 C ATOM 459 OE1 GLN A 30 18.567 23.809 -0.048 1.00 21.32 O ATOM 460 NE2 GLN A 30 16.889 22.353 -0.049 1.00 71.13 N ATOM 0 H GLN A 30 18.842 26.479 3.775 1.00 4.01 H new ATOM 0 HA GLN A 30 17.460 25.617 1.379 1.00 13.41 H new ATOM 0 HB2 GLN A 30 19.402 24.421 2.446 1.00 73.23 H new ATOM 0 HB3 GLN A 30 18.396 24.083 3.840 1.00 73.23 H new ATOM 0 HG2 GLN A 30 18.522 22.135 2.357 1.00 33.04 H new ATOM 0 HG3 GLN A 30 16.877 22.728 2.470 1.00 33.04 H new ATOM 0 HE21 GLN A 30 16.266 21.751 0.490 1.00 71.13 H new ATOM 0 HE22 GLN A 30 16.804 22.396 -1.065 1.00 71.13 H new ATOM 469 N LYS A 31 15.115 25.419 2.128 1.00 33.23 N ATOM 470 CA LYS A 31 13.705 25.406 2.540 1.00 3.13 C ATOM 471 C LYS A 31 13.059 24.021 2.366 1.00 1.45 C ATOM 472 O LYS A 31 12.673 23.634 1.258 1.00 2.03 O ATOM 473 CB LYS A 31 12.918 26.456 1.739 1.00 4.22 C ATOM 474 CG LYS A 31 13.524 27.855 1.800 1.00 43.50 C ATOM 475 CD LYS A 31 12.699 28.861 1.006 1.00 73.43 C ATOM 476 CE LYS A 31 13.349 30.239 0.980 1.00 32.31 C ATOM 477 NZ LYS A 31 13.543 30.799 2.344 1.00 73.15 N ATOM 0 H LYS A 31 15.257 25.505 1.122 1.00 33.23 H new ATOM 0 HA LYS A 31 13.673 25.648 3.602 1.00 3.13 H new ATOM 0 HB2 LYS A 31 12.862 26.139 0.698 1.00 4.22 H new ATOM 0 HB3 LYS A 31 11.896 26.496 2.115 1.00 4.22 H new ATOM 0 HG2 LYS A 31 13.590 28.178 2.839 1.00 43.50 H new ATOM 0 HG3 LYS A 31 14.541 27.829 1.409 1.00 43.50 H new ATOM 0 HD2 LYS A 31 12.572 28.501 -0.015 1.00 73.43 H new ATOM 0 HD3 LYS A 31 11.703 28.938 1.443 1.00 73.43 H new ATOM 0 HE2 LYS A 31 14.313 30.174 0.476 1.00 32.31 H new ATOM 0 HE3 LYS A 31 12.730 30.919 0.395 1.00 32.31 H new ATOM 0 HZ1 LYS A 31 13.877 31.781 2.272 1.00 73.15 H new ATOM 0 HZ2 LYS A 31 12.640 30.777 2.860 1.00 73.15 H new ATOM 0 HZ3 LYS A 31 14.248 30.231 2.856 1.00 73.15 H new ATOM 491 N TYR A 32 12.959 23.268 3.462 1.00 43.44 N ATOM 492 CA TYR A 32 12.243 21.986 3.463 1.00 1.22 C ATOM 493 C TYR A 32 10.804 22.150 3.977 1.00 31.23 C ATOM 494 O TYR A 32 10.582 22.340 5.176 1.00 73.10 O ATOM 495 CB TYR A 32 12.973 20.945 4.325 1.00 23.21 C ATOM 496 CG TYR A 32 14.183 20.315 3.658 1.00 61.14 C ATOM 497 CD1 TYR A 32 14.025 19.397 2.622 1.00 63.11 C ATOM 498 CD2 TYR A 32 15.476 20.619 4.069 1.00 24.01 C ATOM 499 CE1 TYR A 32 15.119 18.805 2.018 1.00 5.12 C ATOM 500 CE2 TYR A 32 16.574 20.027 3.470 1.00 23.02 C ATOM 501 CZ TYR A 32 16.390 19.123 2.445 1.00 55.32 C ATOM 502 OH TYR A 32 17.483 18.524 1.855 1.00 62.44 O ATOM 0 H TYR A 32 13.364 23.522 4.363 1.00 43.44 H new ATOM 0 HA TYR A 32 12.212 21.638 2.431 1.00 1.22 H new ATOM 0 HB2 TYR A 32 13.291 21.419 5.254 1.00 23.21 H new ATOM 0 HB3 TYR A 32 12.270 20.157 4.594 1.00 23.21 H new ATOM 0 HD1 TYR A 32 13.031 19.143 2.285 1.00 63.11 H new ATOM 0 HD2 TYR A 32 15.626 21.329 4.869 1.00 24.01 H new ATOM 0 HE1 TYR A 32 14.978 18.097 1.215 1.00 5.12 H new ATOM 0 HE2 TYR A 32 17.571 20.272 3.804 1.00 23.02 H new ATOM 0 HH TYR A 32 18.304 18.859 2.272 1.00 62.44 H new ATOM 512 N LYS A 33 9.840 22.097 3.058 1.00 13.32 N ATOM 513 CA LYS A 33 8.413 22.106 3.406 1.00 3.13 C ATOM 514 C LYS A 33 7.592 21.293 2.391 1.00 2.43 C ATOM 515 O LYS A 33 6.722 21.832 1.702 1.00 21.34 O ATOM 516 CB LYS A 33 7.863 23.542 3.481 1.00 23.20 C ATOM 517 CG LYS A 33 8.384 24.365 4.657 1.00 4.51 C ATOM 518 CD LYS A 33 7.675 25.714 4.746 1.00 0.23 C ATOM 519 CE LYS A 33 8.131 26.529 5.950 1.00 32.34 C ATOM 520 NZ LYS A 33 7.416 27.833 6.033 1.00 72.02 N ATOM 0 H LYS A 33 10.021 22.047 2.055 1.00 13.32 H new ATOM 0 HA LYS A 33 8.320 21.645 4.389 1.00 3.13 H new ATOM 0 HB2 LYS A 33 8.111 24.060 2.555 1.00 23.20 H new ATOM 0 HB3 LYS A 33 6.776 23.497 3.540 1.00 23.20 H new ATOM 0 HG2 LYS A 33 8.236 23.812 5.585 1.00 4.51 H new ATOM 0 HG3 LYS A 33 9.457 24.522 4.547 1.00 4.51 H new ATOM 0 HD2 LYS A 33 7.862 26.281 3.834 1.00 0.23 H new ATOM 0 HD3 LYS A 33 6.599 25.553 4.806 1.00 0.23 H new ATOM 0 HE2 LYS A 33 7.957 25.959 6.863 1.00 32.34 H new ATOM 0 HE3 LYS A 33 9.205 26.706 5.885 1.00 32.34 H new ATOM 0 HZ1 LYS A 33 7.752 28.361 6.864 1.00 72.02 H new ATOM 0 HZ2 LYS A 33 7.603 28.387 5.173 1.00 72.02 H new ATOM 0 HZ3 LYS A 33 6.394 27.663 6.120 1.00 72.02 H new ATOM 534 N ASP A 34 7.881 20.001 2.298 1.00 32.34 N ATOM 535 CA ASP A 34 7.162 19.108 1.381 1.00 40.54 C ATOM 536 C ASP A 34 6.021 18.372 2.096 1.00 1.11 C ATOM 537 O ASP A 34 6.013 18.256 3.320 1.00 73.30 O ATOM 538 CB ASP A 34 8.127 18.087 0.768 1.00 40.14 C ATOM 539 CG ASP A 34 9.218 18.751 -0.045 1.00 43.11 C ATOM 540 OD1 ASP A 34 10.255 19.135 0.536 1.00 21.23 O ATOM 541 OD2 ASP A 34 9.048 18.893 -1.274 1.00 43.11 O ATOM 0 H ASP A 34 8.609 19.542 2.845 1.00 32.34 H new ATOM 0 HA ASP A 34 6.732 19.723 0.591 1.00 40.54 H new ATOM 0 HB2 ASP A 34 8.578 17.493 1.563 1.00 40.14 H new ATOM 0 HB3 ASP A 34 7.570 17.399 0.132 1.00 40.14 H new ATOM 546 N TYR A 35 5.063 17.870 1.322 1.00 53.33 N ATOM 547 CA TYR A 35 3.946 17.096 1.873 1.00 11.42 C ATOM 548 C TYR A 35 4.220 15.590 1.751 1.00 1.44 C ATOM 549 O TYR A 35 4.448 15.082 0.655 1.00 55.52 O ATOM 550 CB TYR A 35 2.639 17.477 1.165 1.00 40.34 C ATOM 551 CG TYR A 35 2.277 18.942 1.344 1.00 51.04 C ATOM 552 CD1 TYR A 35 1.727 19.398 2.539 1.00 73.50 C ATOM 553 CD2 TYR A 35 2.503 19.869 0.333 1.00 21.21 C ATOM 554 CE1 TYR A 35 1.413 20.730 2.718 1.00 64.35 C ATOM 555 CE2 TYR A 35 2.188 21.205 0.506 1.00 2.45 C ATOM 556 CZ TYR A 35 1.645 21.629 1.701 1.00 2.22 C ATOM 557 OH TYR A 35 1.337 22.958 1.884 1.00 40.33 O ATOM 0 H TYR A 35 5.035 17.984 0.309 1.00 53.33 H new ATOM 0 HA TYR A 35 3.844 17.332 2.932 1.00 11.42 H new ATOM 0 HB2 TYR A 35 2.730 17.257 0.101 1.00 40.34 H new ATOM 0 HB3 TYR A 35 1.829 16.858 1.550 1.00 40.34 H new ATOM 0 HD1 TYR A 35 1.543 18.697 3.340 1.00 73.50 H new ATOM 0 HD2 TYR A 35 2.931 19.541 -0.603 1.00 21.21 H new ATOM 0 HE1 TYR A 35 0.987 21.066 3.652 1.00 64.35 H new ATOM 0 HE2 TYR A 35 2.366 21.912 -0.290 1.00 2.45 H new ATOM 0 HH TYR A 35 1.843 23.309 2.646 1.00 40.33 H new ATOM 567 N GLU A 36 4.189 14.877 2.874 1.00 45.44 N ATOM 568 CA GLU A 36 4.613 13.463 2.897 1.00 13.22 C ATOM 569 C GLU A 36 3.415 12.535 3.135 1.00 3.12 C ATOM 570 O GLU A 36 2.556 12.818 3.970 1.00 51.22 O ATOM 571 CB GLU A 36 5.685 13.254 3.988 1.00 32.23 C ATOM 572 CG GLU A 36 6.750 12.199 3.660 1.00 75.11 C ATOM 573 CD GLU A 36 6.241 10.758 3.674 1.00 54.20 C ATOM 574 OE1 GLU A 36 6.134 10.175 4.776 1.00 10.20 O ATOM 575 OE2 GLU A 36 5.980 10.197 2.590 1.00 74.01 O ATOM 0 H GLU A 36 3.880 15.242 3.775 1.00 45.44 H new ATOM 0 HA GLU A 36 5.042 13.214 1.926 1.00 13.22 H new ATOM 0 HB2 GLU A 36 6.183 14.206 4.173 1.00 32.23 H new ATOM 0 HB3 GLU A 36 5.187 12.969 4.915 1.00 32.23 H new ATOM 0 HG2 GLU A 36 7.165 12.415 2.676 1.00 75.11 H new ATOM 0 HG3 GLU A 36 7.566 12.290 4.377 1.00 75.11 H new ATOM 582 N TYR A 37 3.363 11.424 2.409 1.00 2.14 N ATOM 583 CA TYR A 37 2.215 10.514 2.478 1.00 72.43 C ATOM 584 C TYR A 37 2.641 9.085 2.848 1.00 21.13 C ATOM 585 O TYR A 37 3.046 8.298 1.990 1.00 55.22 O ATOM 586 CB TYR A 37 1.459 10.518 1.141 1.00 44.41 C ATOM 587 CG TYR A 37 1.070 11.911 0.677 1.00 64.23 C ATOM 588 CD1 TYR A 37 -0.092 12.523 1.135 1.00 42.20 C ATOM 589 CD2 TYR A 37 1.873 12.617 -0.212 1.00 45.12 C ATOM 590 CE1 TYR A 37 -0.442 13.795 0.716 1.00 34.42 C ATOM 591 CE2 TYR A 37 1.530 13.884 -0.633 1.00 22.10 C ATOM 592 CZ TYR A 37 0.374 14.470 -0.168 1.00 43.11 C ATOM 593 OH TYR A 37 0.030 15.738 -0.587 1.00 71.33 O ATOM 0 H TYR A 37 4.098 11.128 1.766 1.00 2.14 H new ATOM 0 HA TYR A 37 1.553 10.872 3.267 1.00 72.43 H new ATOM 0 HB2 TYR A 37 2.080 10.049 0.378 1.00 44.41 H new ATOM 0 HB3 TYR A 37 0.559 9.910 1.238 1.00 44.41 H new ATOM 0 HD1 TYR A 37 -0.731 11.997 1.829 1.00 42.20 H new ATOM 0 HD2 TYR A 37 2.782 12.164 -0.579 1.00 45.12 H new ATOM 0 HE1 TYR A 37 -1.349 14.256 1.079 1.00 34.42 H new ATOM 0 HE2 TYR A 37 2.166 14.415 -1.325 1.00 22.10 H new ATOM 0 HH TYR A 37 0.711 16.074 -1.207 1.00 71.33 H new ATOM 603 N LYS A 38 2.562 8.762 4.138 1.00 32.03 N ATOM 604 CA LYS A 38 2.874 7.414 4.618 1.00 24.11 C ATOM 605 C LYS A 38 1.680 6.474 4.367 1.00 1.44 C ATOM 606 O LYS A 38 0.757 6.397 5.182 1.00 35.23 O ATOM 607 CB LYS A 38 3.217 7.449 6.118 1.00 32.43 C ATOM 608 CG LYS A 38 4.064 6.267 6.584 1.00 51.23 C ATOM 609 CD LYS A 38 5.484 6.347 6.027 1.00 62.21 C ATOM 610 CE LYS A 38 6.232 7.558 6.575 1.00 33.11 C ATOM 611 NZ LYS A 38 7.474 7.843 5.813 1.00 63.11 N ATOM 0 H LYS A 38 2.285 9.415 4.871 1.00 32.03 H new ATOM 0 HA LYS A 38 3.739 7.038 4.071 1.00 24.11 H new ATOM 0 HB2 LYS A 38 3.749 8.374 6.338 1.00 32.43 H new ATOM 0 HB3 LYS A 38 2.291 7.469 6.693 1.00 32.43 H new ATOM 0 HG2 LYS A 38 4.099 6.249 7.673 1.00 51.23 H new ATOM 0 HG3 LYS A 38 3.598 5.335 6.265 1.00 51.23 H new ATOM 0 HD2 LYS A 38 6.027 5.437 6.281 1.00 62.21 H new ATOM 0 HD3 LYS A 38 5.447 6.403 4.939 1.00 62.21 H new ATOM 0 HE2 LYS A 38 5.580 8.431 6.543 1.00 33.11 H new ATOM 0 HE3 LYS A 38 6.482 7.385 7.622 1.00 33.11 H new ATOM 0 HZ1 LYS A 38 8.081 8.483 6.365 1.00 63.11 H new ATOM 0 HZ2 LYS A 38 7.982 6.954 5.632 1.00 63.11 H new ATOM 0 HZ3 LYS A 38 7.230 8.292 4.907 1.00 63.11 H new ATOM 625 N LEU A 39 1.689 5.779 3.230 1.00 75.51 N ATOM 626 CA LEU A 39 0.529 4.981 2.801 1.00 43.03 C ATOM 627 C LEU A 39 0.842 3.473 2.787 1.00 22.22 C ATOM 628 O LEU A 39 1.902 3.052 2.331 1.00 52.51 O ATOM 629 CB LEU A 39 0.073 5.426 1.397 1.00 74.20 C ATOM 630 CG LEU A 39 -0.057 6.946 1.183 1.00 44.33 C ATOM 631 CD1 LEU A 39 -0.639 7.252 -0.195 1.00 45.31 C ATOM 632 CD2 LEU A 39 -0.899 7.591 2.281 1.00 1.21 C ATOM 0 H LEU A 39 2.481 5.749 2.588 1.00 75.51 H new ATOM 0 HA LEU A 39 -0.270 5.151 3.523 1.00 43.03 H new ATOM 0 HB2 LEU A 39 0.780 5.035 0.665 1.00 74.20 H new ATOM 0 HB3 LEU A 39 -0.892 4.965 1.186 1.00 74.20 H new ATOM 0 HG LEU A 39 0.944 7.375 1.235 1.00 44.33 H new ATOM 0 HD11 LEU A 39 -0.722 8.331 -0.324 1.00 45.31 H new ATOM 0 HD12 LEU A 39 0.015 6.844 -0.965 1.00 45.31 H new ATOM 0 HD13 LEU A 39 -1.627 6.800 -0.281 1.00 45.31 H new ATOM 0 HD21 LEU A 39 -0.972 8.664 2.101 1.00 1.21 H new ATOM 0 HD22 LEU A 39 -1.898 7.154 2.278 1.00 1.21 H new ATOM 0 HD23 LEU A 39 -0.430 7.416 3.249 1.00 1.21 H new ATOM 644 N THR A 40 -0.097 2.660 3.272 1.00 45.40 N ATOM 645 CA THR A 40 0.067 1.200 3.269 1.00 32.51 C ATOM 646 C THR A 40 -0.632 0.572 2.058 1.00 1.34 C ATOM 647 O THR A 40 -1.859 0.624 1.940 1.00 13.04 O ATOM 648 CB THR A 40 -0.494 0.557 4.561 1.00 64.21 C ATOM 649 OG1 THR A 40 0.150 1.125 5.710 1.00 25.45 O ATOM 650 CG2 THR A 40 -0.286 -0.959 4.567 1.00 62.45 C ATOM 0 H THR A 40 -0.978 2.983 3.672 1.00 45.40 H new ATOM 0 HA THR A 40 1.138 1.006 3.216 1.00 32.51 H new ATOM 0 HB THR A 40 -1.564 0.760 4.594 1.00 64.21 H new ATOM 0 HG1 THR A 40 1.121 1.027 5.623 1.00 25.45 H new ATOM 0 HG21 THR A 40 -0.691 -1.378 5.488 1.00 62.45 H new ATOM 0 HG22 THR A 40 -0.798 -1.400 3.712 1.00 62.45 H new ATOM 0 HG23 THR A 40 0.780 -1.180 4.506 1.00 62.45 H new ATOM 658 N GLY A 41 0.154 -0.011 1.157 1.00 1.12 N ATOM 659 CA GLY A 41 -0.397 -0.659 -0.027 1.00 75.03 C ATOM 660 C GLY A 41 -0.646 -2.150 0.180 1.00 54.33 C ATOM 661 O GLY A 41 0.237 -2.876 0.639 1.00 4.30 O ATOM 0 H GLY A 41 1.171 -0.047 1.225 1.00 1.12 H new ATOM 0 HA2 GLY A 41 -1.334 -0.173 -0.300 1.00 75.03 H new ATOM 0 HA3 GLY A 41 0.288 -0.522 -0.863 1.00 75.03 H new ATOM 665 N PHE A 42 -1.845 -2.612 -0.157 1.00 3.42 N ATOM 666 CA PHE A 42 -2.208 -4.023 0.024 1.00 52.32 C ATOM 667 C PHE A 42 -1.883 -4.860 -1.225 1.00 45.34 C ATOM 668 O PHE A 42 -2.136 -4.440 -2.355 1.00 35.23 O ATOM 669 CB PHE A 42 -3.698 -4.137 0.375 1.00 2.30 C ATOM 670 CG PHE A 42 -4.054 -3.452 1.672 1.00 2.21 C ATOM 671 CD1 PHE A 42 -3.903 -4.113 2.885 1.00 65.15 C ATOM 672 CD2 PHE A 42 -4.531 -2.147 1.681 1.00 63.23 C ATOM 673 CE1 PHE A 42 -4.217 -3.486 4.076 1.00 74.42 C ATOM 674 CE2 PHE A 42 -4.847 -1.517 2.871 1.00 51.14 C ATOM 675 CZ PHE A 42 -4.691 -2.188 4.068 1.00 11.42 C ATOM 0 H PHE A 42 -2.585 -2.035 -0.557 1.00 3.42 H new ATOM 0 HA PHE A 42 -1.613 -4.421 0.845 1.00 52.32 H new ATOM 0 HB2 PHE A 42 -4.290 -3.704 -0.432 1.00 2.30 H new ATOM 0 HB3 PHE A 42 -3.970 -5.190 0.440 1.00 2.30 H new ATOM 0 HD1 PHE A 42 -3.536 -5.129 2.897 1.00 65.15 H new ATOM 0 HD2 PHE A 42 -4.656 -1.618 0.748 1.00 63.23 H new ATOM 0 HE1 PHE A 42 -4.092 -4.010 5.012 1.00 74.42 H new ATOM 0 HE2 PHE A 42 -5.215 -0.502 2.864 1.00 51.14 H new ATOM 0 HZ PHE A 42 -4.939 -1.698 4.998 1.00 11.42 H new ATOM 685 N ASP A 43 -1.313 -6.044 -1.011 1.00 24.23 N ATOM 686 CA ASP A 43 -0.922 -6.925 -2.118 1.00 23.43 C ATOM 687 C ASP A 43 -2.098 -7.836 -2.546 1.00 34.45 C ATOM 688 O ASP A 43 -3.164 -7.824 -1.930 1.00 42.14 O ATOM 689 CB ASP A 43 0.304 -7.757 -1.708 1.00 34.24 C ATOM 690 CG ASP A 43 1.260 -8.010 -2.864 1.00 52.24 C ATOM 691 OD1 ASP A 43 0.958 -8.867 -3.718 1.00 62.44 O ATOM 692 OD2 ASP A 43 2.318 -7.344 -2.929 1.00 44.24 O ATOM 0 H ASP A 43 -1.110 -6.418 -0.084 1.00 24.23 H new ATOM 0 HA ASP A 43 -0.657 -6.312 -2.980 1.00 23.43 H new ATOM 0 HB2 ASP A 43 0.836 -7.241 -0.909 1.00 34.24 H new ATOM 0 HB3 ASP A 43 -0.030 -8.712 -1.303 1.00 34.24 H new ATOM 697 N LYS A 44 -1.880 -8.649 -3.578 1.00 63.40 N ATOM 698 CA LYS A 44 -2.966 -9.394 -4.241 1.00 41.43 C ATOM 699 C LYS A 44 -3.640 -10.451 -3.335 1.00 5.31 C ATOM 700 O LYS A 44 -4.833 -10.722 -3.480 1.00 12.00 O ATOM 701 CB LYS A 44 -2.429 -10.047 -5.523 1.00 23.32 C ATOM 702 CG LYS A 44 -1.749 -9.051 -6.468 1.00 21.11 C ATOM 703 CD LYS A 44 -2.699 -7.931 -6.900 1.00 1.20 C ATOM 704 CE LYS A 44 -1.961 -6.776 -7.578 1.00 14.43 C ATOM 705 NZ LYS A 44 -1.269 -7.190 -8.832 1.00 53.00 N ATOM 0 H LYS A 44 -0.957 -8.814 -3.980 1.00 63.40 H new ATOM 0 HA LYS A 44 -3.745 -8.671 -4.481 1.00 41.43 H new ATOM 0 HB2 LYS A 44 -1.717 -10.828 -5.255 1.00 23.32 H new ATOM 0 HB3 LYS A 44 -3.252 -10.533 -6.048 1.00 23.32 H new ATOM 0 HG2 LYS A 44 -0.879 -8.618 -5.974 1.00 21.11 H new ATOM 0 HG3 LYS A 44 -1.385 -9.578 -7.350 1.00 21.11 H new ATOM 0 HD2 LYS A 44 -3.446 -8.334 -7.584 1.00 1.20 H new ATOM 0 HD3 LYS A 44 -3.235 -7.555 -6.028 1.00 1.20 H new ATOM 0 HE2 LYS A 44 -2.671 -5.981 -7.806 1.00 14.43 H new ATOM 0 HE3 LYS A 44 -1.229 -6.361 -6.885 1.00 14.43 H new ATOM 0 HZ1 LYS A 44 -0.786 -6.369 -9.249 1.00 53.00 H new ATOM 0 HZ2 LYS A 44 -0.571 -7.929 -8.615 1.00 53.00 H new ATOM 0 HZ3 LYS A 44 -1.967 -7.561 -9.508 1.00 53.00 H new ATOM 719 N ASP A 45 -2.888 -11.053 -2.414 1.00 44.53 N ATOM 720 CA ASP A 45 -3.468 -12.025 -1.470 1.00 62.44 C ATOM 721 C ASP A 45 -4.072 -11.321 -0.236 1.00 13.11 C ATOM 722 O ASP A 45 -4.694 -11.958 0.618 1.00 33.31 O ATOM 723 CB ASP A 45 -2.400 -13.040 -1.032 1.00 61.41 C ATOM 724 CG ASP A 45 -2.959 -14.147 -0.148 1.00 42.43 C ATOM 725 OD1 ASP A 45 -3.639 -15.054 -0.673 1.00 4.44 O ATOM 726 OD2 ASP A 45 -2.734 -14.109 1.080 1.00 74.12 O ATOM 0 H ASP A 45 -1.888 -10.892 -2.297 1.00 44.53 H new ATOM 0 HA ASP A 45 -4.273 -12.551 -1.983 1.00 62.44 H new ATOM 0 HB2 ASP A 45 -1.944 -13.484 -1.917 1.00 61.41 H new ATOM 0 HB3 ASP A 45 -1.609 -12.518 -0.494 1.00 61.41 H new ATOM 731 N GLY A 46 -3.906 -10.001 -0.160 1.00 34.10 N ATOM 732 CA GLY A 46 -4.356 -9.245 1.011 1.00 24.25 C ATOM 733 C GLY A 46 -3.223 -8.947 1.989 1.00 32.23 C ATOM 734 O GLY A 46 -3.453 -8.786 3.190 1.00 62.21 O ATOM 0 H GLY A 46 -3.468 -9.436 -0.887 1.00 34.10 H new ATOM 0 HA2 GLY A 46 -4.804 -8.307 0.683 1.00 24.25 H new ATOM 0 HA3 GLY A 46 -5.135 -9.808 1.525 1.00 24.25 H new ATOM 738 N LYS A 47 -1.999 -8.881 1.470 1.00 33.45 N ATOM 739 CA LYS A 47 -0.814 -8.579 2.284 1.00 44.32 C ATOM 740 C LYS A 47 -0.729 -7.073 2.590 1.00 41.02 C ATOM 741 O LYS A 47 -1.335 -6.258 1.895 1.00 12.31 O ATOM 742 CB LYS A 47 0.461 -9.015 1.546 1.00 51.41 C ATOM 743 CG LYS A 47 0.430 -10.440 0.996 1.00 45.05 C ATOM 744 CD LYS A 47 0.453 -11.491 2.098 1.00 62.54 C ATOM 745 CE LYS A 47 0.571 -12.900 1.520 1.00 23.43 C ATOM 746 NZ LYS A 47 0.646 -13.939 2.580 1.00 50.31 N ATOM 0 H LYS A 47 -1.797 -9.033 0.482 1.00 33.45 H new ATOM 0 HA LYS A 47 -0.902 -9.128 3.222 1.00 44.32 H new ATOM 0 HB2 LYS A 47 0.639 -8.326 0.720 1.00 51.41 H new ATOM 0 HB3 LYS A 47 1.307 -8.922 2.227 1.00 51.41 H new ATOM 0 HG2 LYS A 47 -0.466 -10.573 0.390 1.00 45.05 H new ATOM 0 HG3 LYS A 47 1.285 -10.590 0.337 1.00 45.05 H new ATOM 0 HD2 LYS A 47 1.291 -11.299 2.768 1.00 62.54 H new ATOM 0 HD3 LYS A 47 -0.456 -11.415 2.694 1.00 62.54 H new ATOM 0 HE2 LYS A 47 -0.287 -13.100 0.878 1.00 23.43 H new ATOM 0 HE3 LYS A 47 1.460 -12.960 0.892 1.00 23.43 H new ATOM 0 HZ1 LYS A 47 0.725 -14.878 2.140 1.00 50.31 H new ATOM 0 HZ2 LYS A 47 1.479 -13.765 3.178 1.00 50.31 H new ATOM 0 HZ3 LYS A 47 -0.214 -13.902 3.164 1.00 50.31 H new ATOM 760 N GLU A 48 0.036 -6.708 3.616 1.00 11.42 N ATOM 761 CA GLU A 48 0.220 -5.294 3.976 1.00 24.42 C ATOM 762 C GLU A 48 1.661 -4.821 3.700 1.00 42.34 C ATOM 763 O GLU A 48 2.606 -5.199 4.397 1.00 41.00 O ATOM 764 CB GLU A 48 -0.156 -5.066 5.450 1.00 20.41 C ATOM 765 CG GLU A 48 0.541 -6.004 6.432 1.00 74.41 C ATOM 766 CD GLU A 48 0.057 -5.821 7.862 1.00 42.01 C ATOM 767 OE1 GLU A 48 -1.057 -6.287 8.178 1.00 54.03 O ATOM 768 OE2 GLU A 48 0.777 -5.201 8.676 1.00 71.44 O ATOM 0 H GLU A 48 0.539 -7.364 4.214 1.00 11.42 H new ATOM 0 HA GLU A 48 -0.444 -4.699 3.348 1.00 24.42 H new ATOM 0 HB2 GLU A 48 0.083 -4.037 5.718 1.00 20.41 H new ATOM 0 HB3 GLU A 48 -1.234 -5.182 5.559 1.00 20.41 H new ATOM 0 HG2 GLU A 48 0.372 -7.036 6.125 1.00 74.41 H new ATOM 0 HG3 GLU A 48 1.617 -5.832 6.392 1.00 74.41 H new ATOM 775 N LYS A 49 1.820 -3.998 2.665 1.00 25.03 N ATOM 776 CA LYS A 49 3.131 -3.460 2.284 1.00 1.12 C ATOM 777 C LYS A 49 3.208 -1.949 2.569 1.00 51.12 C ATOM 778 O LYS A 49 2.263 -1.207 2.301 1.00 54.14 O ATOM 779 CB LYS A 49 3.403 -3.747 0.801 1.00 15.51 C ATOM 780 CG LYS A 49 4.797 -3.335 0.337 1.00 71.54 C ATOM 781 CD LYS A 49 5.096 -3.798 -1.089 1.00 73.35 C ATOM 782 CE LYS A 49 5.224 -5.319 -1.201 1.00 62.54 C ATOM 783 NZ LYS A 49 3.915 -6.023 -1.160 1.00 24.30 N ATOM 0 H LYS A 49 1.053 -3.686 2.070 1.00 25.03 H new ATOM 0 HA LYS A 49 3.897 -3.952 2.884 1.00 1.12 H new ATOM 0 HB2 LYS A 49 3.270 -4.813 0.617 1.00 15.51 H new ATOM 0 HB3 LYS A 49 2.661 -3.224 0.198 1.00 15.51 H new ATOM 0 HG2 LYS A 49 4.889 -2.250 0.391 1.00 71.54 H new ATOM 0 HG3 LYS A 49 5.541 -3.752 1.015 1.00 71.54 H new ATOM 0 HD2 LYS A 49 4.302 -3.454 -1.752 1.00 73.35 H new ATOM 0 HD3 LYS A 49 6.021 -3.333 -1.431 1.00 73.35 H new ATOM 0 HE2 LYS A 49 5.733 -5.566 -2.133 1.00 62.54 H new ATOM 0 HE3 LYS A 49 5.851 -5.685 -0.388 1.00 62.54 H new ATOM 0 HZ1 LYS A 49 3.980 -6.908 -1.702 1.00 24.30 H new ATOM 0 HZ2 LYS A 49 3.668 -6.239 -0.173 1.00 24.30 H new ATOM 0 HZ3 LYS A 49 3.181 -5.415 -1.576 1.00 24.30 H new ATOM 797 N GLU A 50 4.335 -1.496 3.113 1.00 41.12 N ATOM 798 CA GLU A 50 4.491 -0.089 3.519 1.00 0.12 C ATOM 799 C GLU A 50 5.072 0.781 2.385 1.00 54.33 C ATOM 800 O GLU A 50 6.135 0.478 1.836 1.00 2.24 O ATOM 801 CB GLU A 50 5.402 0.001 4.755 1.00 12.22 C ATOM 802 CG GLU A 50 5.396 1.372 5.432 1.00 65.43 C ATOM 803 CD GLU A 50 4.238 1.561 6.410 1.00 33.43 C ATOM 804 OE1 GLU A 50 3.112 1.090 6.126 1.00 50.13 O ATOM 805 OE2 GLU A 50 4.458 2.161 7.487 1.00 15.24 O ATOM 0 H GLU A 50 5.156 -2.076 3.285 1.00 41.12 H new ATOM 0 HA GLU A 50 3.499 0.294 3.757 1.00 0.12 H new ATOM 0 HB2 GLU A 50 5.091 -0.752 5.479 1.00 12.22 H new ATOM 0 HB3 GLU A 50 6.423 -0.243 4.460 1.00 12.22 H new ATOM 0 HG2 GLU A 50 6.337 1.510 5.964 1.00 65.43 H new ATOM 0 HG3 GLU A 50 5.346 2.147 4.667 1.00 65.43 H new ATOM 812 N LEU A 51 4.367 1.864 2.039 1.00 24.30 N ATOM 813 CA LEU A 51 4.832 2.820 1.015 1.00 14.23 C ATOM 814 C LEU A 51 4.857 4.266 1.558 1.00 53.52 C ATOM 815 O LEU A 51 4.302 4.559 2.620 1.00 21.22 O ATOM 816 CB LEU A 51 3.943 2.765 -0.250 1.00 33.11 C ATOM 817 CG LEU A 51 4.032 1.483 -1.110 1.00 30.25 C ATOM 818 CD1 LEU A 51 5.487 1.114 -1.400 1.00 74.13 C ATOM 819 CD2 LEU A 51 3.287 0.319 -0.457 1.00 31.32 C ATOM 0 H LEU A 51 3.467 2.105 2.453 1.00 24.30 H new ATOM 0 HA LEU A 51 5.848 2.526 0.750 1.00 14.23 H new ATOM 0 HB2 LEU A 51 2.906 2.896 0.058 1.00 33.11 H new ATOM 0 HB3 LEU A 51 4.198 3.616 -0.882 1.00 33.11 H new ATOM 0 HG LEU A 51 3.544 1.692 -2.062 1.00 30.25 H new ATOM 0 HD11 LEU A 51 5.519 0.209 -2.006 1.00 74.13 H new ATOM 0 HD12 LEU A 51 5.969 1.929 -1.940 1.00 74.13 H new ATOM 0 HD13 LEU A 51 6.012 0.940 -0.461 1.00 74.13 H new ATOM 0 HD21 LEU A 51 3.370 -0.566 -1.088 1.00 31.32 H new ATOM 0 HD22 LEU A 51 3.723 0.110 0.520 1.00 31.32 H new ATOM 0 HD23 LEU A 51 2.236 0.581 -0.337 1.00 31.32 H new ATOM 831 N GLU A 52 5.500 5.165 0.809 1.00 20.00 N ATOM 832 CA GLU A 52 5.598 6.586 1.181 1.00 63.00 C ATOM 833 C GLU A 52 6.129 7.423 0.005 1.00 21.14 C ATOM 834 O GLU A 52 6.745 6.880 -0.910 1.00 61.11 O ATOM 835 CB GLU A 52 6.521 6.767 2.396 1.00 61.12 C ATOM 836 CG GLU A 52 7.941 6.254 2.172 1.00 61.42 C ATOM 837 CD GLU A 52 8.863 6.555 3.340 1.00 32.15 C ATOM 838 OE1 GLU A 52 8.729 5.901 4.395 1.00 53.45 O ATOM 839 OE2 GLU A 52 9.714 7.463 3.221 1.00 60.24 O ATOM 0 H GLU A 52 5.966 4.934 -0.068 1.00 20.00 H new ATOM 0 HA GLU A 52 4.597 6.931 1.439 1.00 63.00 H new ATOM 0 HB2 GLU A 52 6.563 7.825 2.654 1.00 61.12 H new ATOM 0 HB3 GLU A 52 6.087 6.248 3.251 1.00 61.12 H new ATOM 0 HG2 GLU A 52 7.912 5.177 2.005 1.00 61.42 H new ATOM 0 HG3 GLU A 52 8.348 6.706 1.267 1.00 61.42 H new ATOM 846 N PHE A 53 5.882 8.735 0.027 1.00 13.23 N ATOM 847 CA PHE A 53 6.411 9.640 -1.015 1.00 4.11 C ATOM 848 C PHE A 53 6.149 11.121 -0.687 1.00 53.10 C ATOM 849 O PHE A 53 5.141 11.468 -0.069 1.00 55.00 O ATOM 850 CB PHE A 53 5.820 9.294 -2.397 1.00 74.03 C ATOM 851 CG PHE A 53 4.314 9.284 -2.440 1.00 22.32 C ATOM 852 CD1 PHE A 53 3.606 8.139 -2.103 1.00 13.34 C ATOM 853 CD2 PHE A 53 3.607 10.416 -2.814 1.00 20.24 C ATOM 854 CE1 PHE A 53 2.229 8.124 -2.137 1.00 12.14 C ATOM 855 CE2 PHE A 53 2.228 10.405 -2.851 1.00 70.51 C ATOM 856 CZ PHE A 53 1.538 9.257 -2.510 1.00 11.30 C ATOM 0 H PHE A 53 5.325 9.198 0.745 1.00 13.23 H new ATOM 0 HA PHE A 53 7.491 9.491 -1.041 1.00 4.11 H new ATOM 0 HB2 PHE A 53 6.188 10.014 -3.128 1.00 74.03 H new ATOM 0 HB3 PHE A 53 6.187 8.314 -2.702 1.00 74.03 H new ATOM 0 HD1 PHE A 53 4.142 7.248 -1.810 1.00 13.34 H new ATOM 0 HD2 PHE A 53 4.141 11.316 -3.079 1.00 20.24 H new ATOM 0 HE1 PHE A 53 1.691 7.226 -1.872 1.00 12.14 H new ATOM 0 HE2 PHE A 53 1.688 11.293 -3.146 1.00 70.51 H new ATOM 0 HZ PHE A 53 0.458 9.248 -2.536 1.00 11.30 H new ATOM 866 N THR A 54 7.065 11.994 -1.123 1.00 13.12 N ATOM 867 CA THR A 54 6.951 13.441 -0.875 1.00 51.20 C ATOM 868 C THR A 54 6.442 14.200 -2.110 1.00 35.22 C ATOM 869 O THR A 54 7.032 14.130 -3.191 1.00 44.24 O ATOM 870 CB THR A 54 8.309 14.064 -0.456 1.00 3.11 C ATOM 871 OG1 THR A 54 9.271 13.930 -1.518 1.00 73.52 O ATOM 872 CG2 THR A 54 8.850 13.405 0.808 1.00 3.14 C ATOM 0 H THR A 54 7.896 11.725 -1.650 1.00 13.12 H new ATOM 0 HA THR A 54 6.232 13.542 -0.062 1.00 51.20 H new ATOM 0 HB THR A 54 8.140 15.121 -0.252 1.00 3.11 H new ATOM 0 HG1 THR A 54 8.803 13.859 -2.376 1.00 73.52 H new ATOM 0 HG21 THR A 54 9.802 13.862 1.078 1.00 3.14 H new ATOM 0 HG22 THR A 54 8.139 13.541 1.622 1.00 3.14 H new ATOM 0 HG23 THR A 54 8.996 12.340 0.629 1.00 3.14 H new ATOM 880 N ALA A 55 5.339 14.923 -1.945 1.00 60.01 N ATOM 881 CA ALA A 55 4.823 15.808 -2.994 1.00 13.20 C ATOM 882 C ALA A 55 5.245 17.262 -2.735 1.00 42.21 C ATOM 883 O ALA A 55 5.176 17.748 -1.605 1.00 43.30 O ATOM 884 CB ALA A 55 3.305 15.704 -3.080 1.00 71.12 C ATOM 0 H ALA A 55 4.780 14.916 -1.092 1.00 60.01 H new ATOM 0 HA ALA A 55 5.248 15.492 -3.947 1.00 13.20 H new ATOM 0 HB1 ALA A 55 2.939 16.367 -3.864 1.00 71.12 H new ATOM 0 HB2 ALA A 55 3.023 14.677 -3.313 1.00 71.12 H new ATOM 0 HB3 ALA A 55 2.866 15.993 -2.125 1.00 71.12 H new ATOM 890 N GLN A 56 5.675 17.949 -3.787 1.00 10.45 N ATOM 891 CA GLN A 56 6.154 19.329 -3.668 1.00 21.22 C ATOM 892 C GLN A 56 4.986 20.305 -3.474 1.00 33.10 C ATOM 893 O GLN A 56 5.128 21.340 -2.817 1.00 43.24 O ATOM 894 CB GLN A 56 6.964 19.724 -4.917 1.00 41.24 C ATOM 895 CG GLN A 56 8.240 18.907 -5.140 1.00 34.44 C ATOM 896 CD GLN A 56 7.973 17.438 -5.454 1.00 23.32 C ATOM 897 OE1 GLN A 56 7.980 16.594 -4.441 1.00 40.14 O flip ATOM 898 NE2 GLN A 56 7.783 17.061 -6.606 1.00 21.33 N flip ATOM 0 H GLN A 56 5.703 17.576 -4.736 1.00 10.45 H new ATOM 0 HA GLN A 56 6.798 19.385 -2.791 1.00 21.22 H new ATOM 0 HB2 GLN A 56 6.325 19.621 -5.794 1.00 41.24 H new ATOM 0 HB3 GLN A 56 7.233 20.778 -4.840 1.00 41.24 H new ATOM 0 HG2 GLN A 56 8.807 19.349 -5.960 1.00 34.44 H new ATOM 0 HG3 GLN A 56 8.865 18.973 -4.249 1.00 34.44 H new ATOM 0 HE21 GLN A 56 7.783 17.737 -7.370 1.00 21.33 H new ATOM 0 HE22 GLN A 56 7.625 16.072 -6.799 1.00 21.33 H new ATOM 907 N LYS A 57 3.835 19.965 -4.052 1.00 41.42 N ATOM 908 CA LYS A 57 2.628 20.797 -3.960 1.00 23.21 C ATOM 909 C LYS A 57 1.449 20.007 -3.378 1.00 44.40 C ATOM 910 O LYS A 57 1.465 18.774 -3.343 1.00 1.15 O ATOM 911 CB LYS A 57 2.246 21.326 -5.350 1.00 73.22 C ATOM 912 CG LYS A 57 3.353 22.108 -6.047 1.00 34.23 C ATOM 913 CD LYS A 57 2.928 22.573 -7.439 1.00 51.12 C ATOM 914 CE LYS A 57 1.751 23.544 -7.384 1.00 43.02 C ATOM 915 NZ LYS A 57 2.081 24.771 -6.614 1.00 54.44 N ATOM 0 H LYS A 57 3.709 19.111 -4.595 1.00 41.42 H new ATOM 0 HA LYS A 57 2.849 21.631 -3.294 1.00 23.21 H new ATOM 0 HB2 LYS A 57 1.959 20.484 -5.980 1.00 73.22 H new ATOM 0 HB3 LYS A 57 1.369 21.966 -5.254 1.00 73.22 H new ATOM 0 HG2 LYS A 57 3.624 22.973 -5.442 1.00 34.23 H new ATOM 0 HG3 LYS A 57 4.243 21.484 -6.128 1.00 34.23 H new ATOM 0 HD2 LYS A 57 3.772 23.054 -7.934 1.00 51.12 H new ATOM 0 HD3 LYS A 57 2.656 21.707 -8.043 1.00 51.12 H new ATOM 0 HE2 LYS A 57 1.459 23.819 -8.398 1.00 43.02 H new ATOM 0 HE3 LYS A 57 0.893 23.049 -6.929 1.00 43.02 H new ATOM 0 HZ1 LYS A 57 1.342 25.486 -6.767 1.00 54.44 H new ATOM 0 HZ2 LYS A 57 2.136 24.541 -5.601 1.00 54.44 H new ATOM 0 HZ3 LYS A 57 2.997 25.146 -6.934 1.00 54.44 H new ATOM 929 N ASN A 58 0.422 20.723 -2.923 1.00 71.12 N ATOM 930 CA ASN A 58 -0.794 20.088 -2.412 1.00 4.50 C ATOM 931 C ASN A 58 -1.686 19.644 -3.585 1.00 42.34 C ATOM 932 O ASN A 58 -2.576 20.379 -4.030 1.00 62.21 O ATOM 933 CB ASN A 58 -1.535 21.057 -1.479 1.00 0.52 C ATOM 934 CG ASN A 58 -2.591 20.384 -0.621 1.00 72.11 C ATOM 935 OD1 ASN A 58 -3.221 19.412 -1.022 1.00 22.50 O ATOM 936 ND2 ASN A 58 -2.789 20.894 0.578 1.00 33.25 N ATOM 0 H ASN A 58 0.407 21.743 -2.897 1.00 71.12 H new ATOM 0 HA ASN A 58 -0.530 19.201 -1.836 1.00 4.50 H new ATOM 0 HB2 ASN A 58 -0.811 21.549 -0.830 1.00 0.52 H new ATOM 0 HB3 ASN A 58 -2.007 21.836 -2.078 1.00 0.52 H new ATOM 0 HD21 ASN A 58 -3.482 20.479 1.201 1.00 33.25 H new ATOM 0 HD22 ASN A 58 -2.249 21.704 0.883 1.00 33.25 H new ATOM 943 N LEU A 59 -1.406 18.449 -4.105 1.00 44.20 N ATOM 944 CA LEU A 59 -2.087 17.921 -5.296 1.00 14.14 C ATOM 945 C LEU A 59 -3.546 17.506 -5.020 1.00 21.30 C ATOM 946 O LEU A 59 -4.065 17.686 -3.916 1.00 4.52 O ATOM 947 CB LEU A 59 -1.278 16.740 -5.875 1.00 24.22 C ATOM 948 CG LEU A 59 -0.802 15.669 -4.866 1.00 12.33 C ATOM 949 CD1 LEU A 59 -1.968 14.864 -4.298 1.00 61.31 C ATOM 950 CD2 LEU A 59 0.222 14.740 -5.515 1.00 13.11 C ATOM 0 H LEU A 59 -0.704 17.819 -3.717 1.00 44.20 H new ATOM 0 HA LEU A 59 -2.136 18.726 -6.029 1.00 14.14 H new ATOM 0 HB2 LEU A 59 -1.888 16.248 -6.633 1.00 24.22 H new ATOM 0 HB3 LEU A 59 -0.402 17.143 -6.383 1.00 24.22 H new ATOM 0 HG LEU A 59 -0.329 16.191 -4.034 1.00 12.33 H new ATOM 0 HD11 LEU A 59 -1.590 14.123 -3.594 1.00 61.31 H new ATOM 0 HD12 LEU A 59 -2.657 15.534 -3.784 1.00 61.31 H new ATOM 0 HD13 LEU A 59 -2.491 14.359 -5.110 1.00 61.31 H new ATOM 0 HD21 LEU A 59 0.546 13.993 -4.791 1.00 13.11 H new ATOM 0 HD22 LEU A 59 -0.231 14.242 -6.372 1.00 13.11 H new ATOM 0 HD23 LEU A 59 1.083 15.321 -5.846 1.00 13.11 H new ATOM 962 N ARG A 60 -4.200 16.951 -6.045 1.00 23.21 N ATOM 963 CA ARG A 60 -5.591 16.483 -5.934 1.00 24.51 C ATOM 964 C ARG A 60 -5.752 15.437 -4.816 1.00 52.11 C ATOM 965 O ARG A 60 -5.315 14.294 -4.946 1.00 33.54 O ATOM 966 CB ARG A 60 -6.048 15.902 -7.279 1.00 64.03 C ATOM 967 CG ARG A 60 -6.064 16.923 -8.414 1.00 75.13 C ATOM 968 CD ARG A 60 -6.396 16.284 -9.761 1.00 71.00 C ATOM 969 NE ARG A 60 -6.538 17.286 -10.813 1.00 71.23 N ATOM 970 CZ ARG A 60 -6.021 17.186 -12.008 1.00 61.22 C ATOM 971 NH1 ARG A 60 -5.280 16.178 -12.331 1.00 34.23 N ATOM 972 NH2 ARG A 60 -6.231 18.119 -12.872 1.00 51.11 N ATOM 0 H ARG A 60 -3.788 16.813 -6.968 1.00 23.21 H new ATOM 0 HA ARG A 60 -6.217 17.337 -5.674 1.00 24.51 H new ATOM 0 HB2 ARG A 60 -5.388 15.078 -7.552 1.00 64.03 H new ATOM 0 HB3 ARG A 60 -7.048 15.484 -7.163 1.00 64.03 H new ATOM 0 HG2 ARG A 60 -6.796 17.699 -8.192 1.00 75.13 H new ATOM 0 HG3 ARG A 60 -5.091 17.411 -8.475 1.00 75.13 H new ATOM 0 HD2 ARG A 60 -5.610 15.579 -10.033 1.00 71.00 H new ATOM 0 HD3 ARG A 60 -7.320 15.713 -9.675 1.00 71.00 H new ATOM 0 HE ARG A 60 -7.079 18.124 -10.600 1.00 71.23 H new ATOM 0 HH11 ARG A 60 -5.091 15.444 -11.648 1.00 34.23 H new ATOM 0 HH12 ARG A 60 -4.884 16.116 -13.269 1.00 34.23 H new ATOM 0 HH21 ARG A 60 -6.798 18.929 -12.620 1.00 51.11 H new ATOM 0 HH22 ARG A 60 -5.830 18.048 -13.807 1.00 51.11 H new ATOM 986 N LYS A 61 -6.395 15.844 -3.722 1.00 43.45 N ATOM 987 CA LYS A 61 -6.538 14.998 -2.529 1.00 31.55 C ATOM 988 C LYS A 61 -7.442 13.776 -2.781 1.00 0.34 C ATOM 989 O LYS A 61 -7.202 12.694 -2.250 1.00 13.43 O ATOM 990 CB LYS A 61 -7.094 15.833 -1.366 1.00 63.24 C ATOM 991 CG LYS A 61 -6.240 17.054 -1.026 1.00 61.35 C ATOM 992 CD LYS A 61 -6.873 17.902 0.075 1.00 34.52 C ATOM 993 CE LYS A 61 -6.041 19.143 0.387 1.00 54.23 C ATOM 994 NZ LYS A 61 -5.869 20.020 -0.801 1.00 60.24 N ATOM 0 H LYS A 61 -6.830 16.762 -3.634 1.00 43.45 H new ATOM 0 HA LYS A 61 -5.548 14.619 -2.275 1.00 31.55 H new ATOM 0 HB2 LYS A 61 -8.102 16.164 -1.616 1.00 63.24 H new ATOM 0 HB3 LYS A 61 -7.176 15.200 -0.482 1.00 63.24 H new ATOM 0 HG2 LYS A 61 -5.250 16.728 -0.709 1.00 61.35 H new ATOM 0 HG3 LYS A 61 -6.104 17.662 -1.920 1.00 61.35 H new ATOM 0 HD2 LYS A 61 -7.875 18.204 -0.230 1.00 34.52 H new ATOM 0 HD3 LYS A 61 -6.982 17.302 0.978 1.00 34.52 H new ATOM 0 HE2 LYS A 61 -6.521 19.708 1.186 1.00 54.23 H new ATOM 0 HE3 LYS A 61 -5.062 18.838 0.756 1.00 54.23 H new ATOM 0 HZ1 LYS A 61 -5.913 21.016 -0.506 1.00 60.24 H new ATOM 0 HZ2 LYS A 61 -4.947 19.830 -1.242 1.00 60.24 H new ATOM 0 HZ3 LYS A 61 -6.627 19.828 -1.487 1.00 60.24 H new ATOM 1008 N GLU A 62 -8.477 13.950 -3.592 1.00 54.12 N ATOM 1009 CA GLU A 62 -9.418 12.861 -3.885 1.00 72.15 C ATOM 1010 C GLU A 62 -8.954 11.999 -5.075 1.00 13.23 C ATOM 1011 O GLU A 62 -9.681 11.111 -5.527 1.00 51.03 O ATOM 1012 CB GLU A 62 -10.826 13.422 -4.157 1.00 14.13 C ATOM 1013 CG GLU A 62 -11.438 14.181 -2.975 1.00 42.51 C ATOM 1014 CD GLU A 62 -11.192 15.688 -3.014 1.00 70.43 C ATOM 1015 OE1 GLU A 62 -10.029 16.117 -3.162 1.00 35.51 O ATOM 1016 OE2 GLU A 62 -12.169 16.454 -2.880 1.00 13.11 O ATOM 0 H GLU A 62 -8.692 14.830 -4.061 1.00 54.12 H new ATOM 0 HA GLU A 62 -9.450 12.219 -3.005 1.00 72.15 H new ATOM 0 HB2 GLU A 62 -10.779 14.089 -5.018 1.00 14.13 H new ATOM 0 HB3 GLU A 62 -11.487 12.599 -4.427 1.00 14.13 H new ATOM 0 HG2 GLU A 62 -12.512 13.998 -2.956 1.00 42.51 H new ATOM 0 HG3 GLU A 62 -11.030 13.780 -2.047 1.00 42.51 H new ATOM 1023 N ALA A 63 -7.743 12.251 -5.567 1.00 65.20 N ATOM 1024 CA ALA A 63 -7.192 11.497 -6.700 1.00 64.21 C ATOM 1025 C ALA A 63 -6.531 10.184 -6.247 1.00 4.14 C ATOM 1026 O ALA A 63 -6.078 10.058 -5.107 1.00 65.30 O ATOM 1027 CB ALA A 63 -6.195 12.358 -7.474 1.00 34.10 C ATOM 0 H ALA A 63 -7.121 12.972 -5.201 1.00 65.20 H new ATOM 0 HA ALA A 63 -8.022 11.235 -7.357 1.00 64.21 H new ATOM 0 HB1 ALA A 63 -5.794 11.787 -8.311 1.00 34.10 H new ATOM 0 HB2 ALA A 63 -6.699 13.249 -7.850 1.00 34.10 H new ATOM 0 HB3 ALA A 63 -5.380 12.654 -6.813 1.00 34.10 H new ATOM 1033 N PHE A 64 -6.488 9.210 -7.151 1.00 40.22 N ATOM 1034 CA PHE A 64 -5.859 7.915 -6.880 1.00 4.33 C ATOM 1035 C PHE A 64 -4.456 7.846 -7.499 1.00 72.41 C ATOM 1036 O PHE A 64 -4.294 7.859 -8.721 1.00 0.03 O ATOM 1037 CB PHE A 64 -6.736 6.776 -7.417 1.00 3.33 C ATOM 1038 CG PHE A 64 -8.042 6.626 -6.673 1.00 22.22 C ATOM 1039 CD1 PHE A 64 -9.100 7.491 -6.915 1.00 5.12 C ATOM 1040 CD2 PHE A 64 -8.206 5.626 -5.723 1.00 53.31 C ATOM 1041 CE1 PHE A 64 -10.292 7.361 -6.228 1.00 10.31 C ATOM 1042 CE2 PHE A 64 -9.397 5.493 -5.033 1.00 63.11 C ATOM 1043 CZ PHE A 64 -10.441 6.362 -5.286 1.00 43.31 C ATOM 0 H PHE A 64 -6.885 9.292 -8.087 1.00 40.22 H new ATOM 0 HA PHE A 64 -5.759 7.804 -5.800 1.00 4.33 H new ATOM 0 HB2 PHE A 64 -6.945 6.954 -8.472 1.00 3.33 H new ATOM 0 HB3 PHE A 64 -6.181 5.840 -7.356 1.00 3.33 H new ATOM 0 HD1 PHE A 64 -8.990 8.275 -7.649 1.00 5.12 H new ATOM 0 HD2 PHE A 64 -7.393 4.944 -5.521 1.00 53.31 H new ATOM 0 HE1 PHE A 64 -11.107 8.041 -6.428 1.00 10.31 H new ATOM 0 HE2 PHE A 64 -9.511 4.711 -4.297 1.00 63.11 H new ATOM 0 HZ PHE A 64 -11.372 6.260 -4.748 1.00 43.31 H new ATOM 1053 N LEU A 65 -3.445 7.780 -6.647 1.00 20.42 N ATOM 1054 CA LEU A 65 -2.055 7.739 -7.092 1.00 63.42 C ATOM 1055 C LEU A 65 -1.572 6.297 -7.310 1.00 23.45 C ATOM 1056 O LEU A 65 -1.560 5.478 -6.387 1.00 25.14 O ATOM 1057 CB LEU A 65 -1.163 8.458 -6.069 1.00 4.20 C ATOM 1058 CG LEU A 65 -1.434 9.967 -5.921 1.00 33.43 C ATOM 1059 CD1 LEU A 65 -0.602 10.563 -4.792 1.00 33.54 C ATOM 1060 CD2 LEU A 65 -1.153 10.696 -7.231 1.00 73.44 C ATOM 0 H LEU A 65 -3.560 7.753 -5.634 1.00 20.42 H new ATOM 0 HA LEU A 65 -1.989 8.251 -8.052 1.00 63.42 H new ATOM 0 HB2 LEU A 65 -1.294 7.983 -5.097 1.00 4.20 H new ATOM 0 HB3 LEU A 65 -0.121 8.317 -6.355 1.00 4.20 H new ATOM 0 HG LEU A 65 -2.487 10.096 -5.672 1.00 33.43 H new ATOM 0 HD11 LEU A 65 -0.812 11.629 -4.709 1.00 33.54 H new ATOM 0 HD12 LEU A 65 -0.855 10.069 -3.854 1.00 33.54 H new ATOM 0 HD13 LEU A 65 0.457 10.418 -5.005 1.00 33.54 H new ATOM 0 HD21 LEU A 65 -1.351 11.760 -7.105 1.00 73.44 H new ATOM 0 HD22 LEU A 65 -0.110 10.551 -7.511 1.00 73.44 H new ATOM 0 HD23 LEU A 65 -1.798 10.298 -8.015 1.00 73.44 H new ATOM 1072 N ARG A 66 -1.178 5.996 -8.543 1.00 0.51 N ATOM 1073 CA ARG A 66 -0.619 4.688 -8.887 1.00 13.05 C ATOM 1074 C ARG A 66 0.861 4.635 -8.489 1.00 75.21 C ATOM 1075 O ARG A 66 1.742 5.017 -9.266 1.00 34.34 O ATOM 1076 CB ARG A 66 -0.782 4.429 -10.394 1.00 41.22 C ATOM 1077 CG ARG A 66 -2.229 4.521 -10.870 1.00 5.43 C ATOM 1078 CD ARG A 66 -2.343 4.499 -12.394 1.00 74.42 C ATOM 1079 NE ARG A 66 -1.838 3.259 -12.988 1.00 4.13 N ATOM 1080 CZ ARG A 66 -2.230 2.783 -14.142 1.00 11.12 C ATOM 1081 NH1 ARG A 66 -3.218 3.323 -14.788 1.00 40.43 N ATOM 1082 NH2 ARG A 66 -1.660 1.729 -14.623 1.00 1.12 N ATOM 0 H ARG A 66 -1.235 6.644 -9.328 1.00 0.51 H new ATOM 0 HA ARG A 66 -1.155 3.912 -8.341 1.00 13.05 H new ATOM 0 HB2 ARG A 66 -0.179 5.149 -10.947 1.00 41.22 H new ATOM 0 HB3 ARG A 66 -0.392 3.439 -10.630 1.00 41.22 H new ATOM 0 HG2 ARG A 66 -2.799 3.691 -10.454 1.00 5.43 H new ATOM 0 HG3 ARG A 66 -2.677 5.438 -10.488 1.00 5.43 H new ATOM 0 HD2 ARG A 66 -3.387 4.632 -12.677 1.00 74.42 H new ATOM 0 HD3 ARG A 66 -1.791 5.344 -12.806 1.00 74.42 H new ATOM 0 HE ARG A 66 -1.135 2.733 -12.469 1.00 4.13 H new ATOM 0 HH11 ARG A 66 -3.702 4.131 -14.397 1.00 40.43 H new ATOM 0 HH12 ARG A 66 -3.510 2.939 -15.687 1.00 40.43 H new ATOM 0 HH21 ARG A 66 -0.910 1.273 -14.104 1.00 1.12 H new ATOM 0 HH22 ARG A 66 -1.960 1.352 -15.522 1.00 1.12 H new ATOM 1096 N VAL A 67 1.120 4.199 -7.258 1.00 64.54 N ATOM 1097 CA VAL A 67 2.476 4.215 -6.694 1.00 4.41 C ATOM 1098 C VAL A 67 3.318 3.021 -7.146 1.00 24.12 C ATOM 1099 O VAL A 67 2.837 1.891 -7.256 1.00 64.22 O ATOM 1100 CB VAL A 67 2.450 4.281 -5.145 1.00 22.33 C ATOM 1101 CG1 VAL A 67 1.779 5.569 -4.669 1.00 44.03 C ATOM 1102 CG2 VAL A 67 1.755 3.055 -4.552 1.00 1.12 C ATOM 0 H VAL A 67 0.409 3.829 -6.627 1.00 64.54 H new ATOM 0 HA VAL A 67 2.946 5.120 -7.080 1.00 4.41 H new ATOM 0 HB VAL A 67 3.481 4.283 -4.793 1.00 22.33 H new ATOM 0 HG11 VAL A 67 1.772 5.594 -3.579 1.00 44.03 H new ATOM 0 HG12 VAL A 67 2.331 6.429 -5.048 1.00 44.03 H new ATOM 0 HG13 VAL A 67 0.755 5.604 -5.040 1.00 44.03 H new ATOM 0 HG21 VAL A 67 1.752 3.129 -3.465 1.00 1.12 H new ATOM 0 HG22 VAL A 67 0.728 3.007 -4.915 1.00 1.12 H new ATOM 0 HG23 VAL A 67 2.289 2.153 -4.853 1.00 1.12 H new ATOM 1112 N TYR A 68 4.591 3.302 -7.384 1.00 45.12 N ATOM 1113 CA TYR A 68 5.528 2.336 -7.943 1.00 63.41 C ATOM 1114 C TYR A 68 6.257 1.533 -6.849 1.00 42.21 C ATOM 1115 O TYR A 68 6.915 2.101 -5.973 1.00 21.31 O ATOM 1116 CB TYR A 68 6.531 3.098 -8.813 1.00 23.42 C ATOM 1117 CG TYR A 68 7.551 2.230 -9.504 1.00 22.11 C ATOM 1118 CD1 TYR A 68 7.186 1.404 -10.554 1.00 25.15 C ATOM 1119 CD2 TYR A 68 8.881 2.252 -9.114 1.00 40.24 C ATOM 1120 CE1 TYR A 68 8.123 0.618 -11.199 1.00 44.44 C ATOM 1121 CE2 TYR A 68 9.823 1.472 -9.747 1.00 21.01 C ATOM 1122 CZ TYR A 68 9.442 0.657 -10.790 1.00 20.11 C ATOM 1123 OH TYR A 68 10.385 -0.116 -11.428 1.00 4.33 O ATOM 0 H TYR A 68 5.007 4.214 -7.193 1.00 45.12 H new ATOM 0 HA TYR A 68 4.977 1.610 -8.540 1.00 63.41 H new ATOM 0 HB2 TYR A 68 5.982 3.662 -9.568 1.00 23.42 H new ATOM 0 HB3 TYR A 68 7.054 3.824 -8.190 1.00 23.42 H new ATOM 0 HD1 TYR A 68 6.155 1.373 -10.874 1.00 25.15 H new ATOM 0 HD2 TYR A 68 9.184 2.892 -8.299 1.00 40.24 H new ATOM 0 HE1 TYR A 68 7.826 -0.022 -12.017 1.00 44.44 H new ATOM 0 HE2 TYR A 68 10.854 1.499 -9.428 1.00 21.01 H new ATOM 0 HH TYR A 68 11.262 0.032 -11.016 1.00 4.33 H new ATOM 1133 N HIS A 69 6.135 0.207 -6.905 1.00 65.40 N ATOM 1134 CA HIS A 69 6.851 -0.676 -5.976 1.00 70.30 C ATOM 1135 C HIS A 69 8.337 -0.757 -6.354 1.00 31.11 C ATOM 1136 O HIS A 69 8.747 -1.606 -7.147 1.00 13.32 O ATOM 1137 CB HIS A 69 6.218 -2.078 -5.975 1.00 41.11 C ATOM 1138 CG HIS A 69 6.964 -3.102 -5.168 1.00 30.51 C ATOM 1139 ND1 HIS A 69 7.336 -4.332 -5.671 1.00 33.33 N ATOM 1140 CD2 HIS A 69 7.394 -3.083 -3.883 1.00 5.35 C ATOM 1141 CE1 HIS A 69 7.958 -5.019 -4.736 1.00 24.14 C ATOM 1142 NE2 HIS A 69 8.008 -4.288 -3.643 1.00 11.40 N ATOM 0 H HIS A 69 5.549 -0.282 -7.582 1.00 65.40 H new ATOM 0 HA HIS A 69 6.773 -0.261 -4.971 1.00 70.30 H new ATOM 0 HB2 HIS A 69 5.201 -2.002 -5.590 1.00 41.11 H new ATOM 0 HB3 HIS A 69 6.144 -2.429 -7.004 1.00 41.11 H new ATOM 0 HD1 HIS A 69 7.157 -4.658 -6.621 1.00 33.33 H new ATOM 0 HD2 HIS A 69 7.276 -2.272 -3.179 1.00 5.35 H new ATOM 0 HE1 HIS A 69 8.360 -6.015 -4.847 1.00 24.14 H new ATOM 1151 N SER A 70 9.128 0.151 -5.792 1.00 43.43 N ATOM 1152 CA SER A 70 10.564 0.236 -6.095 1.00 54.21 C ATOM 1153 C SER A 70 11.386 -0.803 -5.327 1.00 33.23 C ATOM 1154 O SER A 70 10.978 -1.279 -4.265 1.00 24.24 O ATOM 1155 CB SER A 70 11.086 1.637 -5.760 1.00 21.52 C ATOM 1156 OG SER A 70 10.364 2.626 -6.471 1.00 1.53 O ATOM 0 H SER A 70 8.802 0.845 -5.119 1.00 43.43 H new ATOM 0 HA SER A 70 10.678 0.031 -7.160 1.00 54.21 H new ATOM 0 HB2 SER A 70 10.998 1.816 -4.688 1.00 21.52 H new ATOM 0 HB3 SER A 70 12.145 1.704 -6.009 1.00 21.52 H new ATOM 0 HG SER A 70 10.082 2.265 -7.337 1.00 1.53 H new ATOM 1162 N ASP A 71 12.556 -1.127 -5.870 1.00 74.14 N ATOM 1163 CA ASP A 71 13.493 -2.060 -5.237 1.00 13.22 C ATOM 1164 C ASP A 71 13.853 -1.620 -3.806 1.00 2.14 C ATOM 1165 O ASP A 71 13.893 -2.438 -2.885 1.00 42.35 O ATOM 1166 CB ASP A 71 14.757 -2.170 -6.100 1.00 41.34 C ATOM 1167 CG ASP A 71 15.843 -3.012 -5.452 1.00 62.41 C ATOM 1168 OD1 ASP A 71 15.700 -4.251 -5.413 1.00 23.13 O ATOM 1169 OD2 ASP A 71 16.842 -2.436 -4.969 1.00 15.31 O ATOM 0 H ASP A 71 12.884 -0.753 -6.760 1.00 74.14 H new ATOM 0 HA ASP A 71 13.013 -3.036 -5.163 1.00 13.22 H new ATOM 0 HB2 ASP A 71 14.495 -2.604 -7.065 1.00 41.34 H new ATOM 0 HB3 ASP A 71 15.146 -1.171 -6.294 1.00 41.34 H new ATOM 1174 N LYS A 72 14.103 -0.323 -3.625 1.00 73.31 N ATOM 1175 CA LYS A 72 14.466 0.225 -2.307 1.00 30.14 C ATOM 1176 C LYS A 72 13.234 0.482 -1.413 1.00 20.44 C ATOM 1177 O LYS A 72 13.360 1.055 -0.328 1.00 10.34 O ATOM 1178 CB LYS A 72 15.289 1.517 -2.492 1.00 51.33 C ATOM 1179 CG LYS A 72 14.586 2.621 -3.293 1.00 74.45 C ATOM 1180 CD LYS A 72 13.827 3.599 -2.396 1.00 53.43 C ATOM 1181 CE LYS A 72 13.009 4.602 -3.206 1.00 12.22 C ATOM 1182 NZ LYS A 72 12.254 5.539 -2.328 1.00 1.55 N ATOM 0 H LYS A 72 14.062 0.372 -4.371 1.00 73.31 H new ATOM 0 HA LYS A 72 15.070 -0.522 -1.792 1.00 30.14 H new ATOM 0 HB2 LYS A 72 15.547 1.910 -1.509 1.00 51.33 H new ATOM 0 HB3 LYS A 72 16.225 1.266 -2.991 1.00 51.33 H new ATOM 0 HG2 LYS A 72 15.325 3.168 -3.878 1.00 74.45 H new ATOM 0 HG3 LYS A 72 13.892 2.167 -4.000 1.00 74.45 H new ATOM 0 HD2 LYS A 72 13.165 3.043 -1.732 1.00 53.43 H new ATOM 0 HD3 LYS A 72 14.535 4.135 -1.764 1.00 53.43 H new ATOM 0 HE2 LYS A 72 13.673 5.170 -3.858 1.00 12.22 H new ATOM 0 HE3 LYS A 72 12.312 4.066 -3.850 1.00 12.22 H new ATOM 0 HZ1 LYS A 72 11.356 5.796 -2.785 1.00 1.55 H new ATOM 0 HZ2 LYS A 72 12.059 5.079 -1.416 1.00 1.55 H new ATOM 0 HZ3 LYS A 72 12.819 6.397 -2.169 1.00 1.55 H new ATOM 1196 N LYS A 73 12.049 0.045 -1.867 1.00 34.34 N ATOM 1197 CA LYS A 73 10.791 0.236 -1.116 1.00 3.31 C ATOM 1198 C LYS A 73 10.439 1.736 -0.982 1.00 0.23 C ATOM 1199 O LYS A 73 11.263 2.606 -1.246 1.00 44.11 O ATOM 1200 CB LYS A 73 10.909 -0.457 0.268 1.00 73.13 C ATOM 1201 CG LYS A 73 9.634 -0.474 1.128 1.00 74.00 C ATOM 1202 CD LYS A 73 9.478 0.769 2.023 1.00 12.20 C ATOM 1203 CE LYS A 73 10.507 0.829 3.157 1.00 70.01 C ATOM 1204 NZ LYS A 73 11.905 0.966 2.664 1.00 4.42 N ATOM 0 H LYS A 73 11.932 -0.445 -2.754 1.00 34.34 H new ATOM 0 HA LYS A 73 9.971 -0.226 -1.666 1.00 3.31 H new ATOM 0 HB2 LYS A 73 11.230 -1.487 0.110 1.00 73.13 H new ATOM 0 HB3 LYS A 73 11.698 0.039 0.834 1.00 73.13 H new ATOM 0 HG2 LYS A 73 8.766 -0.552 0.474 1.00 74.00 H new ATOM 0 HG3 LYS A 73 9.641 -1.365 1.756 1.00 74.00 H new ATOM 0 HD2 LYS A 73 9.571 1.665 1.409 1.00 12.20 H new ATOM 0 HD3 LYS A 73 8.475 0.778 2.450 1.00 12.20 H new ATOM 0 HE2 LYS A 73 10.273 1.671 3.809 1.00 70.01 H new ATOM 0 HE3 LYS A 73 10.427 -0.075 3.761 1.00 70.01 H new ATOM 0 HZ1 LYS A 73 12.462 1.518 3.347 1.00 4.42 H new ATOM 0 HZ2 LYS A 73 12.329 0.022 2.555 1.00 4.42 H new ATOM 0 HZ3 LYS A 73 11.903 1.453 1.745 1.00 4.42 H new ATOM 1218 N GLY A 74 9.196 2.043 -0.617 1.00 22.30 N ATOM 1219 CA GLY A 74 8.832 3.430 -0.349 1.00 61.14 C ATOM 1220 C GLY A 74 8.702 4.294 -1.599 1.00 4.20 C ATOM 1221 O GLY A 74 8.834 5.512 -1.521 1.00 14.02 O ATOM 0 H GLY A 74 8.441 1.367 -0.502 1.00 22.30 H new ATOM 0 HA2 GLY A 74 7.886 3.448 0.192 1.00 61.14 H new ATOM 0 HA3 GLY A 74 9.582 3.871 0.307 1.00 61.14 H new ATOM 1225 N VAL A 75 8.508 3.655 -2.757 1.00 13.22 N ATOM 1226 CA VAL A 75 8.179 4.360 -4.011 1.00 30.14 C ATOM 1227 C VAL A 75 9.346 5.206 -4.575 1.00 70.44 C ATOM 1228 O VAL A 75 10.079 5.867 -3.838 1.00 54.42 O ATOM 1229 CB VAL A 75 6.924 5.265 -3.824 1.00 24.41 C ATOM 1230 CG1 VAL A 75 6.580 6.020 -5.107 1.00 74.25 C ATOM 1231 CG2 VAL A 75 5.730 4.434 -3.349 1.00 52.43 C ATOM 0 H VAL A 75 8.573 2.642 -2.857 1.00 13.22 H new ATOM 0 HA VAL A 75 7.972 3.577 -4.741 1.00 30.14 H new ATOM 0 HB VAL A 75 7.160 6.006 -3.060 1.00 24.41 H new ATOM 0 HG11 VAL A 75 5.700 6.641 -4.939 1.00 74.25 H new ATOM 0 HG12 VAL A 75 7.420 6.652 -5.394 1.00 74.25 H new ATOM 0 HG13 VAL A 75 6.374 5.307 -5.905 1.00 74.25 H new ATOM 0 HG21 VAL A 75 4.863 5.082 -3.224 1.00 52.43 H new ATOM 0 HG22 VAL A 75 5.505 3.665 -4.088 1.00 52.43 H new ATOM 0 HG23 VAL A 75 5.971 3.962 -2.396 1.00 52.43 H new ATOM 1241 N SER A 76 9.522 5.144 -5.896 1.00 65.15 N ATOM 1242 CA SER A 76 10.460 6.027 -6.615 1.00 25.12 C ATOM 1243 C SER A 76 9.695 7.015 -7.512 1.00 1.52 C ATOM 1244 O SER A 76 10.203 8.082 -7.865 1.00 10.32 O ATOM 1245 CB SER A 76 11.426 5.199 -7.475 1.00 1.33 C ATOM 1246 OG SER A 76 12.262 6.027 -8.270 1.00 10.53 O ATOM 0 H SER A 76 9.026 4.488 -6.499 1.00 65.15 H new ATOM 0 HA SER A 76 11.030 6.587 -5.874 1.00 25.12 H new ATOM 0 HB2 SER A 76 12.042 4.572 -6.830 1.00 1.33 H new ATOM 0 HB3 SER A 76 10.857 4.530 -8.120 1.00 1.33 H new ATOM 0 HG SER A 76 12.865 5.468 -8.803 1.00 10.53 H new ATOM 1252 N ALA A 77 8.468 6.642 -7.880 1.00 51.45 N ATOM 1253 CA ALA A 77 7.613 7.467 -8.741 1.00 42.31 C ATOM 1254 C ALA A 77 6.130 7.102 -8.563 1.00 71.04 C ATOM 1255 O ALA A 77 5.800 6.015 -8.085 1.00 10.00 O ATOM 1256 CB ALA A 77 8.024 7.312 -10.204 1.00 55.14 C ATOM 0 H ALA A 77 8.038 5.763 -7.592 1.00 51.45 H new ATOM 0 HA ALA A 77 7.743 8.508 -8.446 1.00 42.31 H new ATOM 0 HB1 ALA A 77 7.381 7.930 -10.830 1.00 55.14 H new ATOM 0 HB2 ALA A 77 9.060 7.627 -10.326 1.00 55.14 H new ATOM 0 HB3 ALA A 77 7.925 6.268 -10.501 1.00 55.14 H new ATOM 1262 N TRP A 78 5.244 8.015 -8.947 1.00 41.04 N ATOM 1263 CA TRP A 78 3.796 7.788 -8.846 1.00 44.42 C ATOM 1264 C TRP A 78 3.037 8.483 -9.986 1.00 24.45 C ATOM 1265 O TRP A 78 3.454 9.533 -10.481 1.00 35.12 O ATOM 1266 CB TRP A 78 3.261 8.263 -7.479 1.00 51.03 C ATOM 1267 CG TRP A 78 3.734 9.635 -7.069 1.00 21.01 C ATOM 1268 CD1 TRP A 78 4.772 9.920 -6.227 1.00 3.31 C ATOM 1269 CD2 TRP A 78 3.189 10.901 -7.472 1.00 10.43 C ATOM 1270 NE1 TRP A 78 4.905 11.278 -6.082 1.00 52.21 N ATOM 1271 CE2 TRP A 78 3.946 11.903 -6.835 1.00 2.11 C ATOM 1272 CE3 TRP A 78 2.134 11.286 -8.304 1.00 25.02 C ATOM 1273 CZ2 TRP A 78 3.689 13.260 -7.011 1.00 14.31 C ATOM 1274 CZ3 TRP A 78 1.880 12.632 -8.481 1.00 24.23 C ATOM 1275 CH2 TRP A 78 2.651 13.605 -7.832 1.00 33.14 C ATOM 0 H TRP A 78 5.499 8.924 -9.333 1.00 41.04 H new ATOM 0 HA TRP A 78 3.626 6.715 -8.934 1.00 44.42 H new ATOM 0 HB2 TRP A 78 2.171 8.261 -7.508 1.00 51.03 H new ATOM 0 HB3 TRP A 78 3.561 7.545 -6.716 1.00 51.03 H new ATOM 0 HD1 TRP A 78 5.397 9.183 -5.745 1.00 3.31 H new ATOM 0 HE1 TRP A 78 5.605 11.747 -5.507 1.00 52.21 H new ATOM 0 HE3 TRP A 78 1.527 10.543 -8.800 1.00 25.02 H new ATOM 0 HZ2 TRP A 78 4.287 14.012 -6.518 1.00 14.31 H new ATOM 0 HZ3 TRP A 78 1.074 12.939 -9.130 1.00 24.23 H new ATOM 0 HH2 TRP A 78 2.421 14.649 -7.983 1.00 33.14 H new ATOM 1286 N GLU A 79 1.928 7.880 -10.405 1.00 43.13 N ATOM 1287 CA GLU A 79 1.072 8.456 -11.450 1.00 21.41 C ATOM 1288 C GLU A 79 -0.253 8.951 -10.857 1.00 74.23 C ATOM 1289 O GLU A 79 -0.849 8.287 -10.011 1.00 52.35 O ATOM 1290 CB GLU A 79 0.793 7.412 -12.536 1.00 74.24 C ATOM 1291 CG GLU A 79 2.053 6.752 -13.093 1.00 12.21 C ATOM 1292 CD GLU A 79 1.753 5.686 -14.134 1.00 70.02 C ATOM 1293 OE1 GLU A 79 1.523 4.521 -13.755 1.00 44.41 O ATOM 1294 OE2 GLU A 79 1.739 6.012 -15.342 1.00 1.34 O ATOM 0 H GLU A 79 1.596 6.988 -10.038 1.00 43.13 H new ATOM 0 HA GLU A 79 1.595 9.305 -11.890 1.00 21.41 H new ATOM 0 HB2 GLU A 79 0.140 6.641 -12.127 1.00 74.24 H new ATOM 0 HB3 GLU A 79 0.251 7.887 -13.354 1.00 74.24 H new ATOM 0 HG2 GLU A 79 2.691 7.516 -13.537 1.00 12.21 H new ATOM 0 HG3 GLU A 79 2.615 6.304 -12.273 1.00 12.21 H new ATOM 1301 N GLU A 80 -0.714 10.105 -11.312 1.00 4.04 N ATOM 1302 CA GLU A 80 -1.933 10.721 -10.771 1.00 52.01 C ATOM 1303 C GLU A 80 -3.154 10.445 -11.664 1.00 60.41 C ATOM 1304 O GLU A 80 -3.283 11.009 -12.753 1.00 34.02 O ATOM 1305 CB GLU A 80 -1.728 12.236 -10.621 1.00 14.41 C ATOM 1306 CG GLU A 80 -2.895 12.956 -9.950 1.00 1.03 C ATOM 1307 CD GLU A 80 -2.804 14.468 -10.085 1.00 43.21 C ATOM 1308 OE1 GLU A 80 -3.296 15.004 -11.097 1.00 62.44 O ATOM 1309 OE2 GLU A 80 -2.233 15.125 -9.190 1.00 40.11 O ATOM 0 H GLU A 80 -0.267 10.641 -12.056 1.00 4.04 H new ATOM 0 HA GLU A 80 -2.127 10.277 -9.795 1.00 52.01 H new ATOM 0 HB2 GLU A 80 -0.822 12.414 -10.041 1.00 14.41 H new ATOM 0 HB3 GLU A 80 -1.565 12.670 -11.608 1.00 14.41 H new ATOM 0 HG2 GLU A 80 -3.831 12.611 -10.390 1.00 1.03 H new ATOM 0 HG3 GLU A 80 -2.922 12.690 -8.893 1.00 1.03 H new ATOM 1316 N VAL A 81 -4.045 9.568 -11.202 1.00 13.15 N ATOM 1317 CA VAL A 81 -5.292 9.271 -11.922 1.00 14.04 C ATOM 1318 C VAL A 81 -6.503 9.378 -10.984 1.00 22.42 C ATOM 1319 O VAL A 81 -6.356 9.645 -9.794 1.00 32.43 O ATOM 1320 CB VAL A 81 -5.268 7.854 -12.554 1.00 52.44 C ATOM 1321 CG1 VAL A 81 -4.108 7.706 -13.540 1.00 3.03 C ATOM 1322 CG2 VAL A 81 -5.207 6.773 -11.472 1.00 40.31 C ATOM 0 H VAL A 81 -3.930 9.048 -10.332 1.00 13.15 H new ATOM 0 HA VAL A 81 -5.378 10.009 -12.720 1.00 14.04 H new ATOM 0 HB VAL A 81 -6.196 7.723 -13.111 1.00 52.44 H new ATOM 0 HG11 VAL A 81 -4.118 6.703 -13.966 1.00 3.03 H new ATOM 0 HG12 VAL A 81 -4.213 8.440 -14.339 1.00 3.03 H new ATOM 0 HG13 VAL A 81 -3.165 7.869 -13.019 1.00 3.03 H new ATOM 0 HG21 VAL A 81 -5.191 5.789 -11.941 1.00 40.31 H new ATOM 0 HG22 VAL A 81 -4.304 6.905 -10.876 1.00 40.31 H new ATOM 0 HG23 VAL A 81 -6.082 6.854 -10.827 1.00 40.31 H new ATOM 1332 N LYS A 82 -7.706 9.199 -11.528 1.00 23.54 N ATOM 1333 CA LYS A 82 -8.929 9.192 -10.713 1.00 35.23 C ATOM 1334 C LYS A 82 -9.668 7.846 -10.804 1.00 51.22 C ATOM 1335 O LYS A 82 -9.329 6.983 -11.616 1.00 62.12 O ATOM 1336 CB LYS A 82 -9.873 10.342 -11.113 1.00 63.12 C ATOM 1337 CG LYS A 82 -9.403 11.726 -10.664 1.00 51.55 C ATOM 1338 CD LYS A 82 -8.282 12.283 -11.540 1.00 74.21 C ATOM 1339 CE LYS A 82 -8.778 12.644 -12.934 1.00 63.52 C ATOM 1340 NZ LYS A 82 -9.849 13.676 -12.890 1.00 32.55 N ATOM 0 H LYS A 82 -7.864 9.057 -12.526 1.00 23.54 H new ATOM 0 HA LYS A 82 -8.620 9.339 -9.678 1.00 35.23 H new ATOM 0 HB2 LYS A 82 -9.986 10.343 -12.197 1.00 63.12 H new ATOM 0 HB3 LYS A 82 -10.859 10.151 -10.690 1.00 63.12 H new ATOM 0 HG2 LYS A 82 -10.248 12.415 -10.681 1.00 51.55 H new ATOM 0 HG3 LYS A 82 -9.058 11.670 -9.632 1.00 51.55 H new ATOM 0 HD2 LYS A 82 -7.856 13.167 -11.066 1.00 74.21 H new ATOM 0 HD3 LYS A 82 -7.482 11.547 -11.618 1.00 74.21 H new ATOM 0 HE2 LYS A 82 -7.944 13.011 -13.533 1.00 63.52 H new ATOM 0 HE3 LYS A 82 -9.156 11.749 -13.428 1.00 63.52 H new ATOM 0 HZ1 LYS A 82 -9.948 14.114 -13.828 1.00 32.55 H new ATOM 0 HZ2 LYS A 82 -10.749 13.231 -12.619 1.00 32.55 H new ATOM 0 HZ3 LYS A 82 -9.600 14.405 -12.192 1.00 32.55 H new ATOM 1354 N LYS A 83 -10.695 7.686 -9.969 1.00 43.42 N ATOM 1355 CA LYS A 83 -11.505 6.456 -9.931 1.00 63.32 C ATOM 1356 C LYS A 83 -12.154 6.133 -11.292 1.00 64.22 C ATOM 1357 O LYS A 83 -12.675 5.035 -11.496 1.00 34.44 O ATOM 1358 CB LYS A 83 -12.602 6.566 -8.853 1.00 75.42 C ATOM 1359 CG LYS A 83 -13.737 7.543 -9.187 1.00 61.53 C ATOM 1360 CD LYS A 83 -13.260 8.992 -9.266 1.00 71.21 C ATOM 1361 CE LYS A 83 -14.399 9.955 -9.594 1.00 41.01 C ATOM 1362 NZ LYS A 83 -15.459 9.949 -8.550 1.00 74.43 N ATOM 0 H LYS A 83 -10.992 8.398 -9.301 1.00 43.42 H new ATOM 0 HA LYS A 83 -10.824 5.641 -9.686 1.00 63.32 H new ATOM 0 HB2 LYS A 83 -13.030 5.577 -8.688 1.00 75.42 H new ATOM 0 HB3 LYS A 83 -12.140 6.874 -7.915 1.00 75.42 H new ATOM 0 HG2 LYS A 83 -14.187 7.260 -10.139 1.00 61.53 H new ATOM 0 HG3 LYS A 83 -14.516 7.462 -8.429 1.00 61.53 H new ATOM 0 HD2 LYS A 83 -12.808 9.277 -8.316 1.00 71.21 H new ATOM 0 HD3 LYS A 83 -12.484 9.077 -10.027 1.00 71.21 H new ATOM 0 HE2 LYS A 83 -14.000 10.964 -9.699 1.00 41.01 H new ATOM 0 HE3 LYS A 83 -14.836 9.684 -10.555 1.00 41.01 H new ATOM 0 HZ1 LYS A 83 -16.122 10.731 -8.724 1.00 74.43 H new ATOM 0 HZ2 LYS A 83 -15.973 9.046 -8.583 1.00 74.43 H new ATOM 0 HZ3 LYS A 83 -15.024 10.066 -7.613 1.00 74.43 H new ATOM 1376 N ASP A 84 -12.116 7.087 -12.216 1.00 14.31 N ATOM 1377 CA ASP A 84 -12.763 6.942 -13.522 1.00 62.31 C ATOM 1378 C ASP A 84 -12.130 5.833 -14.392 1.00 33.44 C ATOM 1379 O ASP A 84 -12.730 5.403 -15.381 1.00 12.44 O ATOM 1380 CB ASP A 84 -12.730 8.283 -14.260 1.00 64.24 C ATOM 1381 CG ASP A 84 -13.425 9.379 -13.470 1.00 24.54 C ATOM 1382 OD1 ASP A 84 -12.785 9.968 -12.575 1.00 62.11 O ATOM 1383 OD2 ASP A 84 -14.619 9.644 -13.730 1.00 30.45 O ATOM 0 H ASP A 84 -11.639 7.979 -12.085 1.00 14.31 H new ATOM 0 HA ASP A 84 -13.794 6.638 -13.341 1.00 62.31 H new ATOM 0 HB2 ASP A 84 -11.695 8.570 -14.447 1.00 64.24 H new ATOM 0 HB3 ASP A 84 -13.211 8.175 -15.232 1.00 64.24 H new ATOM 1388 N GLU A 85 -10.924 5.371 -14.045 1.00 12.15 N ATOM 1389 CA GLU A 85 -10.304 4.248 -14.778 1.00 13.34 C ATOM 1390 C GLU A 85 -10.417 2.930 -13.990 1.00 21.44 C ATOM 1391 O GLU A 85 -9.983 1.876 -14.458 1.00 44.10 O ATOM 1392 CB GLU A 85 -8.822 4.530 -15.106 1.00 60.20 C ATOM 1393 CG GLU A 85 -7.849 4.326 -13.936 1.00 33.42 C ATOM 1394 CD GLU A 85 -6.410 4.076 -14.396 1.00 42.20 C ATOM 1395 OE1 GLU A 85 -6.219 3.579 -15.530 1.00 53.21 O ATOM 1396 OE2 GLU A 85 -5.468 4.354 -13.628 1.00 44.21 O ATOM 0 H GLU A 85 -10.363 5.744 -13.279 1.00 12.15 H new ATOM 0 HA GLU A 85 -10.853 4.146 -15.714 1.00 13.34 H new ATOM 0 HB2 GLU A 85 -8.518 3.883 -15.929 1.00 60.20 H new ATOM 0 HB3 GLU A 85 -8.733 5.558 -15.459 1.00 60.20 H new ATOM 0 HG2 GLU A 85 -7.872 5.206 -13.293 1.00 33.42 H new ATOM 0 HG3 GLU A 85 -8.185 3.482 -13.334 1.00 33.42 H new ATOM 1403 N LEU A 86 -11.013 2.994 -12.801 1.00 1.31 N ATOM 1404 CA LEU A 86 -11.099 1.831 -11.906 1.00 72.55 C ATOM 1405 C LEU A 86 -12.404 1.039 -12.097 1.00 23.52 C ATOM 1406 O LEU A 86 -13.495 1.615 -12.108 1.00 61.12 O ATOM 1407 CB LEU A 86 -10.981 2.285 -10.440 1.00 11.21 C ATOM 1408 CG LEU A 86 -9.617 2.865 -10.043 1.00 11.21 C ATOM 1409 CD1 LEU A 86 -9.630 3.333 -8.590 1.00 12.54 C ATOM 1410 CD2 LEU A 86 -8.513 1.835 -10.268 1.00 2.41 C ATOM 0 H LEU A 86 -11.446 3.840 -12.430 1.00 1.31 H new ATOM 0 HA LEU A 86 -10.272 1.168 -12.161 1.00 72.55 H new ATOM 0 HB2 LEU A 86 -11.747 3.036 -10.246 1.00 11.21 H new ATOM 0 HB3 LEU A 86 -11.198 1.434 -9.794 1.00 11.21 H new ATOM 0 HG LEU A 86 -9.415 3.730 -10.675 1.00 11.21 H new ATOM 0 HD11 LEU A 86 -8.653 3.740 -8.330 1.00 12.54 H new ATOM 0 HD12 LEU A 86 -10.390 4.104 -8.463 1.00 12.54 H new ATOM 0 HD13 LEU A 86 -9.856 2.489 -7.938 1.00 12.54 H new ATOM 0 HD21 LEU A 86 -7.552 2.263 -9.981 1.00 2.41 H new ATOM 0 HD22 LEU A 86 -8.712 0.951 -9.662 1.00 2.41 H new ATOM 0 HD23 LEU A 86 -8.486 1.555 -11.321 1.00 2.41 H new ATOM 1422 N PRO A 87 -12.310 -0.299 -12.251 1.00 40.34 N ATOM 1423 CA PRO A 87 -13.492 -1.175 -12.301 1.00 65.31 C ATOM 1424 C PRO A 87 -14.148 -1.338 -10.918 1.00 13.40 C ATOM 1425 O PRO A 87 -13.506 -1.785 -9.966 1.00 24.22 O ATOM 1426 CB PRO A 87 -12.918 -2.510 -12.797 1.00 31.51 C ATOM 1427 CG PRO A 87 -11.495 -2.502 -12.346 1.00 20.02 C ATOM 1428 CD PRO A 87 -11.049 -1.062 -12.404 1.00 32.14 C ATOM 0 HA PRO A 87 -14.280 -0.776 -12.940 1.00 65.31 H new ATOM 0 HB2 PRO A 87 -13.462 -3.356 -12.376 1.00 31.51 H new ATOM 0 HB3 PRO A 87 -12.989 -2.593 -13.881 1.00 31.51 H new ATOM 0 HG2 PRO A 87 -11.404 -2.898 -11.335 1.00 20.02 H new ATOM 0 HG3 PRO A 87 -10.878 -3.128 -12.990 1.00 20.02 H new ATOM 0 HD2 PRO A 87 -10.341 -0.829 -11.609 1.00 32.14 H new ATOM 0 HD3 PRO A 87 -10.554 -0.833 -13.348 1.00 32.14 H new ATOM 1436 N ALA A 88 -15.431 -0.982 -10.816 1.00 65.24 N ATOM 1437 CA ALA A 88 -16.165 -1.032 -9.542 1.00 32.41 C ATOM 1438 C ALA A 88 -16.014 -2.387 -8.819 1.00 55.44 C ATOM 1439 O ALA A 88 -16.180 -2.469 -7.598 1.00 20.50 O ATOM 1440 CB ALA A 88 -17.635 -0.713 -9.778 1.00 63.23 C ATOM 0 H ALA A 88 -15.989 -0.653 -11.604 1.00 65.24 H new ATOM 0 HA ALA A 88 -15.728 -0.279 -8.886 1.00 32.41 H new ATOM 0 HB1 ALA A 88 -18.172 -0.752 -8.830 1.00 63.23 H new ATOM 0 HB2 ALA A 88 -17.726 0.285 -10.206 1.00 63.23 H new ATOM 0 HB3 ALA A 88 -18.060 -1.444 -10.466 1.00 63.23 H new ATOM 1446 N LYS A 89 -15.687 -3.438 -9.580 1.00 1.51 N ATOM 1447 CA LYS A 89 -15.427 -4.775 -9.021 1.00 42.12 C ATOM 1448 C LYS A 89 -14.496 -4.720 -7.795 1.00 24.41 C ATOM 1449 O LYS A 89 -14.757 -5.361 -6.774 1.00 75.44 O ATOM 1450 CB LYS A 89 -14.796 -5.675 -10.093 1.00 21.25 C ATOM 1451 CG LYS A 89 -15.648 -5.837 -11.350 1.00 41.15 C ATOM 1452 CD LYS A 89 -14.914 -6.630 -12.428 1.00 44.44 C ATOM 1453 CE LYS A 89 -15.736 -6.751 -13.706 1.00 53.34 C ATOM 1454 NZ LYS A 89 -16.101 -5.421 -14.267 1.00 50.23 N ATOM 0 H LYS A 89 -15.595 -3.389 -10.595 1.00 1.51 H new ATOM 0 HA LYS A 89 -16.385 -5.183 -8.699 1.00 42.12 H new ATOM 0 HB2 LYS A 89 -13.827 -5.263 -10.374 1.00 21.25 H new ATOM 0 HB3 LYS A 89 -14.611 -6.659 -9.663 1.00 21.25 H new ATOM 0 HG2 LYS A 89 -16.579 -6.343 -11.096 1.00 41.15 H new ATOM 0 HG3 LYS A 89 -15.915 -4.854 -11.739 1.00 41.15 H new ATOM 0 HD2 LYS A 89 -13.964 -6.144 -12.652 1.00 44.44 H new ATOM 0 HD3 LYS A 89 -14.681 -7.626 -12.051 1.00 44.44 H new ATOM 0 HE2 LYS A 89 -15.170 -7.314 -14.448 1.00 53.34 H new ATOM 0 HE3 LYS A 89 -16.644 -7.318 -13.500 1.00 53.34 H new ATOM 0 HZ1 LYS A 89 -16.477 -5.541 -15.229 1.00 50.23 H new ATOM 0 HZ2 LYS A 89 -16.824 -4.977 -13.665 1.00 50.23 H new ATOM 0 HZ3 LYS A 89 -15.257 -4.814 -14.299 1.00 50.23 H new ATOM 1468 N VAL A 90 -13.417 -3.943 -7.900 1.00 63.34 N ATOM 1469 CA VAL A 90 -12.438 -3.831 -6.812 1.00 61.22 C ATOM 1470 C VAL A 90 -13.067 -3.227 -5.544 1.00 51.53 C ATOM 1471 O VAL A 90 -12.756 -3.639 -4.428 1.00 42.44 O ATOM 1472 CB VAL A 90 -11.204 -2.989 -7.240 1.00 15.44 C ATOM 1473 CG1 VAL A 90 -11.589 -1.540 -7.540 1.00 2.55 C ATOM 1474 CG2 VAL A 90 -10.106 -3.052 -6.178 1.00 44.45 C ATOM 0 H VAL A 90 -13.197 -3.383 -8.723 1.00 63.34 H new ATOM 0 HA VAL A 90 -12.106 -4.844 -6.585 1.00 61.22 H new ATOM 0 HB VAL A 90 -10.814 -3.423 -8.161 1.00 15.44 H new ATOM 0 HG11 VAL A 90 -10.701 -0.981 -7.836 1.00 2.55 H new ATOM 0 HG12 VAL A 90 -12.318 -1.518 -8.350 1.00 2.55 H new ATOM 0 HG13 VAL A 90 -12.022 -1.087 -6.649 1.00 2.55 H new ATOM 0 HG21 VAL A 90 -9.253 -2.455 -6.501 1.00 44.45 H new ATOM 0 HG22 VAL A 90 -10.488 -2.659 -5.236 1.00 44.45 H new ATOM 0 HG23 VAL A 90 -9.793 -4.087 -6.039 1.00 44.45 H new ATOM 1484 N LYS A 91 -13.974 -2.270 -5.727 1.00 53.34 N ATOM 1485 CA LYS A 91 -14.657 -1.622 -4.603 1.00 72.14 C ATOM 1486 C LYS A 91 -15.723 -2.553 -3.999 1.00 15.12 C ATOM 1487 O LYS A 91 -16.124 -2.401 -2.843 1.00 30.12 O ATOM 1488 CB LYS A 91 -15.289 -0.303 -5.074 1.00 3.24 C ATOM 1489 CG LYS A 91 -15.838 0.569 -3.944 1.00 65.43 C ATOM 1490 CD LYS A 91 -16.362 1.910 -4.466 1.00 31.24 C ATOM 1491 CE LYS A 91 -16.851 2.817 -3.339 1.00 1.32 C ATOM 1492 NZ LYS A 91 -15.764 3.156 -2.386 1.00 23.13 N ATOM 0 H LYS A 91 -14.255 -1.924 -6.644 1.00 53.34 H new ATOM 0 HA LYS A 91 -13.926 -1.406 -3.824 1.00 72.14 H new ATOM 0 HB2 LYS A 91 -14.543 0.267 -5.627 1.00 3.24 H new ATOM 0 HB3 LYS A 91 -16.098 -0.529 -5.769 1.00 3.24 H new ATOM 0 HG2 LYS A 91 -16.641 0.039 -3.433 1.00 65.43 H new ATOM 0 HG3 LYS A 91 -15.054 0.746 -3.208 1.00 65.43 H new ATOM 0 HD2 LYS A 91 -15.571 2.416 -5.020 1.00 31.24 H new ATOM 0 HD3 LYS A 91 -17.178 1.731 -5.166 1.00 31.24 H new ATOM 0 HE2 LYS A 91 -17.260 3.734 -3.763 1.00 1.32 H new ATOM 0 HE3 LYS A 91 -17.662 2.324 -2.803 1.00 1.32 H new ATOM 0 HZ1 LYS A 91 -16.078 3.925 -1.760 1.00 23.13 H new ATOM 0 HZ2 LYS A 91 -15.529 2.319 -1.815 1.00 23.13 H new ATOM 0 HZ3 LYS A 91 -14.922 3.462 -2.914 1.00 23.13 H new ATOM 1506 N GLU A 92 -16.180 -3.518 -4.798 1.00 61.52 N ATOM 1507 CA GLU A 92 -17.108 -4.553 -4.324 1.00 52.54 C ATOM 1508 C GLU A 92 -16.352 -5.697 -3.624 1.00 25.33 C ATOM 1509 O GLU A 92 -16.900 -6.390 -2.767 1.00 31.24 O ATOM 1510 CB GLU A 92 -17.907 -5.133 -5.503 1.00 23.10 C ATOM 1511 CG GLU A 92 -18.712 -4.108 -6.297 1.00 75.21 C ATOM 1512 CD GLU A 92 -19.534 -4.749 -7.409 1.00 65.33 C ATOM 1513 OE1 GLU A 92 -20.610 -5.316 -7.108 1.00 74.34 O ATOM 1514 OE2 GLU A 92 -19.107 -4.703 -8.585 1.00 24.41 O ATOM 0 H GLU A 92 -15.923 -3.607 -5.781 1.00 61.52 H new ATOM 0 HA GLU A 92 -17.786 -4.086 -3.610 1.00 52.54 H new ATOM 0 HB2 GLU A 92 -17.216 -5.635 -6.180 1.00 23.10 H new ATOM 0 HB3 GLU A 92 -18.589 -5.894 -5.122 1.00 23.10 H new ATOM 0 HG2 GLU A 92 -19.377 -3.570 -5.621 1.00 75.21 H new ATOM 0 HG3 GLU A 92 -18.033 -3.372 -6.729 1.00 75.21 H new ATOM 1521 N LYS A 93 -15.091 -5.889 -4.011 1.00 31.12 N ATOM 1522 CA LYS A 93 -14.282 -7.017 -3.530 1.00 51.44 C ATOM 1523 C LYS A 93 -13.485 -6.650 -2.262 1.00 13.23 C ATOM 1524 O LYS A 93 -13.400 -7.441 -1.322 1.00 65.32 O ATOM 1525 CB LYS A 93 -13.329 -7.466 -4.653 1.00 63.53 C ATOM 1526 CG LYS A 93 -12.668 -8.825 -4.425 1.00 73.40 C ATOM 1527 CD LYS A 93 -13.704 -9.934 -4.244 1.00 70.12 C ATOM 1528 CE LYS A 93 -13.100 -11.322 -4.439 1.00 42.42 C ATOM 1529 NZ LYS A 93 -12.688 -11.558 -5.851 1.00 32.43 N ATOM 0 H LYS A 93 -14.601 -5.274 -4.661 1.00 31.12 H new ATOM 0 HA LYS A 93 -14.952 -7.834 -3.262 1.00 51.44 H new ATOM 0 HB2 LYS A 93 -13.885 -7.500 -5.590 1.00 63.53 H new ATOM 0 HB3 LYS A 93 -12.549 -6.713 -4.772 1.00 63.53 H new ATOM 0 HG2 LYS A 93 -12.024 -9.063 -5.272 1.00 73.40 H new ATOM 0 HG3 LYS A 93 -12.030 -8.776 -3.543 1.00 73.40 H new ATOM 0 HD2 LYS A 93 -14.138 -9.865 -3.246 1.00 70.12 H new ATOM 0 HD3 LYS A 93 -14.517 -9.790 -4.956 1.00 70.12 H new ATOM 0 HE2 LYS A 93 -12.235 -11.436 -3.785 1.00 42.42 H new ATOM 0 HE3 LYS A 93 -13.826 -12.078 -4.142 1.00 42.42 H new ATOM 0 HZ1 LYS A 93 -12.573 -12.579 -6.013 1.00 32.43 H new ATOM 0 HZ2 LYS A 93 -13.417 -11.185 -6.492 1.00 32.43 H new ATOM 0 HZ3 LYS A 93 -11.786 -11.075 -6.035 1.00 32.43 H new ATOM 1543 N LEU A 94 -12.906 -5.450 -2.245 1.00 31.42 N ATOM 1544 CA LEU A 94 -12.098 -4.987 -1.106 1.00 53.31 C ATOM 1545 C LEU A 94 -12.916 -4.959 0.198 1.00 71.12 C ATOM 1546 O LEU A 94 -14.011 -4.399 0.251 1.00 44.31 O ATOM 1547 CB LEU A 94 -11.529 -3.588 -1.395 1.00 24.14 C ATOM 1548 CG LEU A 94 -10.618 -3.000 -0.298 1.00 12.31 C ATOM 1549 CD1 LEU A 94 -9.374 -3.863 -0.096 1.00 3.23 C ATOM 1550 CD2 LEU A 94 -10.231 -1.561 -0.637 1.00 73.21 C ATOM 0 H LEU A 94 -12.979 -4.776 -3.007 1.00 31.42 H new ATOM 0 HA LEU A 94 -11.279 -5.694 -0.973 1.00 53.31 H new ATOM 0 HB2 LEU A 94 -10.965 -3.630 -2.327 1.00 24.14 H new ATOM 0 HB3 LEU A 94 -12.361 -2.903 -1.557 1.00 24.14 H new ATOM 0 HG LEU A 94 -11.176 -2.995 0.638 1.00 12.31 H new ATOM 0 HD11 LEU A 94 -8.750 -3.425 0.683 1.00 3.23 H new ATOM 0 HD12 LEU A 94 -9.673 -4.868 0.201 1.00 3.23 H new ATOM 0 HD13 LEU A 94 -8.810 -3.912 -1.028 1.00 3.23 H new ATOM 0 HD21 LEU A 94 -9.588 -1.163 0.148 1.00 73.21 H new ATOM 0 HD22 LEU A 94 -9.697 -1.542 -1.587 1.00 73.21 H new ATOM 0 HD23 LEU A 94 -11.131 -0.951 -0.714 1.00 73.21 H new ATOM 1562 N GLY A 95 -12.369 -5.560 1.252 1.00 52.11 N ATOM 1563 CA GLY A 95 -13.064 -5.617 2.535 1.00 71.12 C ATOM 1564 C GLY A 95 -13.307 -7.045 3.011 1.00 51.21 C ATOM 1565 O GLY A 95 -13.174 -7.345 4.200 1.00 33.02 O ATOM 0 H GLY A 95 -11.454 -6.011 1.244 1.00 52.11 H new ATOM 0 HA2 GLY A 95 -12.479 -5.083 3.284 1.00 71.12 H new ATOM 0 HA3 GLY A 95 -14.020 -5.100 2.449 1.00 71.12 H new ATOM 1569 N VAL A 96 -13.655 -7.934 2.079 1.00 13.51 N ATOM 1570 CA VAL A 96 -13.935 -9.340 2.405 1.00 1.32 C ATOM 1571 C VAL A 96 -13.155 -10.302 1.493 1.00 3.22 C ATOM 1572 O VAL A 96 -13.204 -10.200 0.266 1.00 22.44 O ATOM 1573 CB VAL A 96 -15.455 -9.653 2.309 1.00 43.23 C ATOM 1574 CG1 VAL A 96 -16.236 -8.870 3.363 1.00 52.23 C ATOM 1575 CG2 VAL A 96 -15.993 -9.350 0.909 1.00 54.44 C ATOM 0 H VAL A 96 -13.751 -7.708 1.089 1.00 13.51 H new ATOM 0 HA VAL A 96 -13.607 -9.492 3.433 1.00 1.32 H new ATOM 0 HB VAL A 96 -15.589 -10.718 2.500 1.00 43.23 H new ATOM 0 HG11 VAL A 96 -17.297 -9.104 3.278 1.00 52.23 H new ATOM 0 HG12 VAL A 96 -15.882 -9.145 4.357 1.00 52.23 H new ATOM 0 HG13 VAL A 96 -16.086 -7.802 3.207 1.00 52.23 H new ATOM 0 HG21 VAL A 96 -17.058 -9.578 0.871 1.00 54.44 H new ATOM 0 HG22 VAL A 96 -15.840 -8.295 0.681 1.00 54.44 H new ATOM 0 HG23 VAL A 96 -15.465 -9.960 0.176 1.00 54.44 H new ATOM 1585 N LYS A 97 -12.425 -11.234 2.098 1.00 14.04 N ATOM 1586 CA LYS A 97 -11.667 -12.228 1.335 1.00 34.14 C ATOM 1587 C LYS A 97 -12.397 -13.579 1.323 1.00 24.25 C ATOM 1588 O LYS A 97 -12.698 -14.147 2.374 1.00 64.32 O ATOM 1589 CB LYS A 97 -10.253 -12.392 1.912 1.00 51.44 C ATOM 1590 CG LYS A 97 -9.368 -13.330 1.095 1.00 10.31 C ATOM 1591 CD LYS A 97 -7.947 -13.409 1.647 1.00 21.41 C ATOM 1592 CE LYS A 97 -7.055 -14.274 0.764 1.00 33.11 C ATOM 1593 NZ LYS A 97 -5.667 -14.365 1.289 1.00 2.01 N ATOM 0 H LYS A 97 -12.340 -11.324 3.110 1.00 14.04 H new ATOM 0 HA LYS A 97 -11.583 -11.872 0.308 1.00 34.14 H new ATOM 0 HB2 LYS A 97 -9.776 -11.413 1.969 1.00 51.44 H new ATOM 0 HB3 LYS A 97 -10.327 -12.771 2.931 1.00 51.44 H new ATOM 0 HG2 LYS A 97 -9.809 -14.327 1.087 1.00 10.31 H new ATOM 0 HG3 LYS A 97 -9.336 -12.987 0.061 1.00 10.31 H new ATOM 0 HD2 LYS A 97 -7.527 -12.406 1.720 1.00 21.41 H new ATOM 0 HD3 LYS A 97 -7.969 -13.819 2.657 1.00 21.41 H new ATOM 0 HE2 LYS A 97 -7.480 -15.275 0.690 1.00 33.11 H new ATOM 0 HE3 LYS A 97 -7.034 -13.861 -0.245 1.00 33.11 H new ATOM 0 HZ1 LYS A 97 -5.087 -14.934 0.640 1.00 2.01 H new ATOM 0 HZ2 LYS A 97 -5.262 -13.410 1.368 1.00 2.01 H new ATOM 0 HZ3 LYS A 97 -5.679 -14.814 2.227 1.00 2.01 H new ATOM 1607 N LEU A 98 -12.675 -14.091 0.126 1.00 13.22 N ATOM 1608 CA LEU A 98 -13.416 -15.347 -0.032 1.00 10.31 C ATOM 1609 C LEU A 98 -12.874 -16.172 -1.211 1.00 51.35 C ATOM 1610 O LEU A 98 -12.574 -15.638 -2.280 1.00 41.44 O ATOM 1611 CB LEU A 98 -14.929 -15.080 -0.197 1.00 54.12 C ATOM 1612 CG LEU A 98 -15.365 -14.286 -1.451 1.00 75.13 C ATOM 1613 CD1 LEU A 98 -16.888 -14.271 -1.573 1.00 44.33 C ATOM 1614 CD2 LEU A 98 -14.825 -12.856 -1.427 1.00 74.20 C ATOM 0 H LEU A 98 -12.398 -13.656 -0.754 1.00 13.22 H new ATOM 0 HA LEU A 98 -13.272 -15.931 0.877 1.00 10.31 H new ATOM 0 HB2 LEU A 98 -15.444 -16.040 -0.207 1.00 54.12 H new ATOM 0 HB3 LEU A 98 -15.277 -14.541 0.684 1.00 54.12 H new ATOM 0 HG LEU A 98 -14.943 -14.789 -2.321 1.00 75.13 H new ATOM 0 HD11 LEU A 98 -17.176 -13.708 -2.461 1.00 44.33 H new ATOM 0 HD12 LEU A 98 -17.256 -15.293 -1.656 1.00 44.33 H new ATOM 0 HD13 LEU A 98 -17.319 -13.801 -0.689 1.00 44.33 H new ATOM 0 HD21 LEU A 98 -15.151 -12.329 -2.323 1.00 74.20 H new ATOM 0 HD22 LEU A 98 -15.202 -12.339 -0.544 1.00 74.20 H new ATOM 0 HD23 LEU A 98 -13.736 -12.879 -1.396 1.00 74.20 H new ATOM 1626 N GLU A 99 -12.753 -17.478 -1.006 1.00 61.10 N ATOM 1627 CA GLU A 99 -12.132 -18.375 -1.988 1.00 10.31 C ATOM 1628 C GLU A 99 -13.080 -18.738 -3.148 1.00 64.55 C ATOM 1629 O GLU A 99 -12.651 -18.801 -4.304 1.00 42.50 O ATOM 1630 CB GLU A 99 -11.671 -19.660 -1.287 1.00 2.42 C ATOM 1631 CG GLU A 99 -11.055 -20.692 -2.226 1.00 42.14 C ATOM 1632 CD GLU A 99 -10.756 -22.009 -1.531 1.00 51.30 C ATOM 1633 OE1 GLU A 99 -11.698 -22.796 -1.315 1.00 62.31 O ATOM 1634 OE2 GLU A 99 -9.581 -22.259 -1.184 1.00 43.42 O ATOM 0 H GLU A 99 -13.079 -17.948 -0.162 1.00 61.10 H new ATOM 0 HA GLU A 99 -11.283 -17.844 -2.418 1.00 10.31 H new ATOM 0 HB2 GLU A 99 -10.942 -19.401 -0.519 1.00 2.42 H new ATOM 0 HB3 GLU A 99 -12.523 -20.110 -0.778 1.00 2.42 H new ATOM 0 HG2 GLU A 99 -11.735 -20.871 -3.059 1.00 42.14 H new ATOM 0 HG3 GLU A 99 -10.133 -20.290 -2.647 1.00 42.14 H new ATOM 1641 N HIS A 100 -14.364 -18.945 -2.835 1.00 23.22 N ATOM 1642 CA HIS A 100 -15.325 -19.556 -3.772 1.00 13.11 C ATOM 1643 C HIS A 100 -14.980 -21.038 -4.005 1.00 2.33 C ATOM 1644 O HIS A 100 -13.981 -21.540 -3.488 1.00 63.50 O ATOM 1645 CB HIS A 100 -15.383 -18.802 -5.109 1.00 45.25 C ATOM 1646 CG HIS A 100 -15.886 -17.396 -4.994 1.00 15.03 C ATOM 1647 ND1 HIS A 100 -15.147 -16.299 -5.378 1.00 12.11 N ATOM 1648 CD2 HIS A 100 -17.073 -16.907 -4.558 1.00 22.54 C ATOM 1649 CE1 HIS A 100 -15.848 -15.203 -5.185 1.00 11.42 C ATOM 1650 NE2 HIS A 100 -17.019 -15.541 -4.691 1.00 20.33 N ATOM 0 H HIS A 100 -14.768 -18.697 -1.932 1.00 23.22 H new ATOM 0 HA HIS A 100 -16.313 -19.488 -3.316 1.00 13.11 H new ATOM 0 HB2 HIS A 100 -14.386 -18.785 -5.549 1.00 45.25 H new ATOM 0 HB3 HIS A 100 -16.025 -19.352 -5.797 1.00 45.25 H new ATOM 0 HD2 HIS A 100 -17.904 -17.483 -4.178 1.00 22.54 H new ATOM 0 HE1 HIS A 100 -15.518 -14.197 -5.396 1.00 11.42 H new ATOM 0 HE2 HIS A 100 -17.767 -14.893 -4.446 1.00 20.33 H new ATOM 1659 N HIS A 101 -15.808 -21.751 -4.763 1.00 33.52 N ATOM 1660 CA HIS A 101 -15.553 -23.172 -5.022 1.00 64.42 C ATOM 1661 C HIS A 101 -15.575 -23.484 -6.529 1.00 40.35 C ATOM 1662 O HIS A 101 -16.639 -23.640 -7.128 1.00 63.22 O ATOM 1663 CB HIS A 101 -16.562 -24.047 -4.261 1.00 23.23 C ATOM 1664 CG HIS A 101 -16.029 -25.412 -3.926 1.00 42.21 C ATOM 1665 ND1 HIS A 101 -15.126 -25.631 -2.906 1.00 42.31 N ATOM 1666 CD2 HIS A 101 -16.258 -26.628 -4.482 1.00 0.41 C ATOM 1667 CE1 HIS A 101 -14.825 -26.909 -2.851 1.00 51.32 C ATOM 1668 NE2 HIS A 101 -15.495 -27.537 -3.791 1.00 41.02 N ATOM 0 H HIS A 101 -16.649 -21.380 -5.204 1.00 33.52 H new ATOM 0 HA HIS A 101 -14.552 -23.405 -4.658 1.00 64.42 H new ATOM 0 HB2 HIS A 101 -16.850 -23.540 -3.340 1.00 23.23 H new ATOM 0 HB3 HIS A 101 -17.465 -24.154 -4.861 1.00 23.23 H new ATOM 0 HD2 HIS A 101 -16.916 -26.841 -5.311 1.00 0.41 H new ATOM 0 HE1 HIS A 101 -14.142 -27.366 -2.151 1.00 51.32 H new ATOM 0 HE2 HIS A 101 -15.455 -28.539 -3.977 1.00 41.02 H new ATOM 1677 N HIS A 102 -14.381 -23.576 -7.118 1.00 72.54 N ATOM 1678 CA HIS A 102 -14.210 -23.807 -8.561 1.00 62.12 C ATOM 1679 C HIS A 102 -14.936 -25.091 -9.017 1.00 52.53 C ATOM 1680 O HIS A 102 -14.574 -26.198 -8.613 1.00 13.20 O ATOM 1681 CB HIS A 102 -12.705 -23.889 -8.866 1.00 74.23 C ATOM 1682 CG HIS A 102 -12.349 -23.819 -10.319 1.00 64.30 C ATOM 1683 ND1 HIS A 102 -12.219 -22.630 -11.003 1.00 12.33 N ATOM 1684 CD2 HIS A 102 -12.051 -24.795 -11.208 1.00 4.33 C ATOM 1685 CE1 HIS A 102 -11.855 -22.876 -12.244 1.00 21.22 C ATOM 1686 NE2 HIS A 102 -11.746 -24.180 -12.397 1.00 42.35 N ATOM 0 H HIS A 102 -13.501 -23.493 -6.610 1.00 72.54 H new ATOM 0 HA HIS A 102 -14.655 -22.980 -9.114 1.00 62.12 H new ATOM 0 HB2 HIS A 102 -12.199 -23.077 -8.344 1.00 74.23 H new ATOM 0 HB3 HIS A 102 -12.317 -24.822 -8.457 1.00 74.23 H new ATOM 0 HD2 HIS A 102 -12.053 -25.858 -11.018 1.00 4.33 H new ATOM 0 HE1 HIS A 102 -11.676 -22.134 -13.008 1.00 21.22 H new ATOM 0 HE2 HIS A 102 -11.478 -24.655 -13.259 1.00 42.35 H new ATOM 1695 N HIS A 103 -15.973 -24.940 -9.850 1.00 61.33 N ATOM 1696 CA HIS A 103 -16.805 -26.082 -10.270 1.00 72.34 C ATOM 1697 C HIS A 103 -16.087 -26.993 -11.276 1.00 33.04 C ATOM 1698 O HIS A 103 -15.312 -26.530 -12.115 1.00 13.14 O ATOM 1699 CB HIS A 103 -18.144 -25.603 -10.854 1.00 50.41 C ATOM 1700 CG HIS A 103 -18.045 -24.942 -12.197 1.00 3.04 C ATOM 1701 ND1 HIS A 103 -18.542 -25.511 -13.351 1.00 65.20 N ATOM 1702 CD2 HIS A 103 -17.530 -23.747 -12.566 1.00 25.21 C ATOM 1703 CE1 HIS A 103 -18.333 -24.699 -14.366 1.00 1.24 C ATOM 1704 NE2 HIS A 103 -17.721 -23.622 -13.918 1.00 30.35 N ATOM 0 H HIS A 103 -16.258 -24.044 -10.247 1.00 61.33 H new ATOM 0 HA HIS A 103 -16.998 -26.671 -9.373 1.00 72.34 H new ATOM 0 HB2 HIS A 103 -18.816 -26.458 -10.934 1.00 50.41 H new ATOM 0 HB3 HIS A 103 -18.600 -24.904 -10.153 1.00 50.41 H new ATOM 0 HD2 HIS A 103 -17.056 -23.026 -11.917 1.00 25.21 H new ATOM 0 HE1 HIS A 103 -18.615 -24.884 -15.392 1.00 1.24 H new ATOM 0 HE2 HIS A 103 -17.435 -22.824 -14.485 1.00 30.35 H new ATOM 1713 N HIS A 104 -16.358 -28.292 -11.179 1.00 31.20 N ATOM 1714 CA HIS A 104 -15.763 -29.296 -12.072 1.00 62.22 C ATOM 1715 C HIS A 104 -16.783 -29.784 -13.117 1.00 15.41 C ATOM 1716 O HIS A 104 -17.948 -30.021 -12.797 1.00 15.43 O ATOM 1717 CB HIS A 104 -15.250 -30.482 -11.235 1.00 14.51 C ATOM 1718 CG HIS A 104 -14.660 -31.612 -12.037 1.00 72.12 C ATOM 1719 ND1 HIS A 104 -13.303 -31.857 -12.115 1.00 24.23 N ATOM 1720 CD2 HIS A 104 -15.251 -32.579 -12.784 1.00 12.34 C ATOM 1721 CE1 HIS A 104 -13.090 -32.917 -12.867 1.00 63.23 C ATOM 1722 NE2 HIS A 104 -14.251 -33.373 -13.285 1.00 21.30 N ATOM 0 H HIS A 104 -16.993 -28.683 -10.483 1.00 31.20 H new ATOM 0 HA HIS A 104 -14.931 -28.838 -12.607 1.00 62.22 H new ATOM 0 HB2 HIS A 104 -14.496 -30.117 -10.538 1.00 14.51 H new ATOM 0 HB3 HIS A 104 -16.075 -30.871 -10.638 1.00 14.51 H new ATOM 0 HD2 HIS A 104 -16.311 -32.701 -12.952 1.00 12.34 H new ATOM 0 HE1 HIS A 104 -12.125 -33.341 -13.101 1.00 63.23 H new ATOM 0 HE2 HIS A 104 -14.386 -34.186 -13.885 1.00 21.30 H new ATOM 1731 N HIS A 105 -16.339 -29.931 -14.366 1.00 71.53 N ATOM 1732 CA HIS A 105 -17.181 -30.499 -15.435 1.00 41.34 C ATOM 1733 C HIS A 105 -16.452 -31.645 -16.166 1.00 31.25 C ATOM 1734 O HIS A 105 -15.623 -31.355 -17.060 1.00 37.36 O ATOM 1735 CB HIS A 105 -17.591 -29.405 -16.437 1.00 63.43 C ATOM 1736 CG HIS A 105 -18.393 -29.924 -17.600 1.00 11.54 C ATOM 1737 ND1 HIS A 105 -17.835 -30.674 -18.610 1.00 23.13 N ATOM 1738 CD2 HIS A 105 -19.710 -29.813 -17.909 1.00 52.42 C ATOM 1739 CE1 HIS A 105 -18.762 -31.003 -19.483 1.00 35.21 C ATOM 1740 NE2 HIS A 105 -19.909 -30.496 -19.084 1.00 5.14 N ATOM 1741 OXT HIS A 105 -16.714 -32.823 -15.847 1.00 37.36 O ATOM 0 H HIS A 105 -15.402 -29.666 -14.668 1.00 71.53 H new ATOM 0 HA HIS A 105 -18.080 -30.907 -14.973 1.00 41.34 H new ATOM 0 HB2 HIS A 105 -18.173 -28.645 -15.915 1.00 63.43 H new ATOM 0 HB3 HIS A 105 -16.694 -28.915 -16.815 1.00 63.43 H new ATOM 0 HD1 HIS A 105 -16.851 -30.935 -18.672 1.00 23.13 H new ATOM 0 HD2 HIS A 105 -20.461 -29.286 -17.338 1.00 52.42 H new ATOM 0 HE1 HIS A 105 -18.608 -31.590 -20.376 1.00 35.21 H new TER 1750 HIS A 105