USER MOD reduce.3.24.130724 H: found=0, std=0, add=1314, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1308 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 169 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 174 ASN : amide:sc= -0.69 K(o=-0.69,f=0.91) USER MOD Set 2.1: A 124 TYR OH : rot -142:sc= 0.856 USER MOD Set 2.2: A 128 TYR OH : rot 180:sc= 0 USER MOD Set 2.3: A 168 HIS : no HD1:sc= -1.48! C(o=-0.63!,f=-13!) USER MOD Set 3.1: A 95 SER OG : rot -131:sc= 0.958 USER MOD Set 3.2: A 96 GLN : amide:sc= -4.18! K(o=-3.2!,f=-0.3) USER MOD Set 4.1: A 87 LYS NZ :NH3+ -152:sc= 1.48 (180deg=0.136) USER MOD Set 4.2: A 103 THR OG1 : rot -114:sc= 1.48 USER MOD Set 5.1: A 72 MET CE :methyl 159:sc= -3.25 (180deg=-3.89!) USER MOD Set 5.2: A 156 HIS : no HE2:sc= -3.24 K(o=-6.5,f=-11!) USER MOD Set 6.1: A 33 HIS : no HD1:sc= -1.7 K(o=-0.78,f=-6.5!) USER MOD Set 6.2: A 77 HIS : no HD1:sc= 0.915 K(o=-0.78,f=-8.7!) USER MOD Single : A 8 LYS NZ :NH3+ -174:sc= -0.0077 (180deg=-0.0604) USER MOD Single : A 12 GLN : amide:sc= -0.983 K(o=-0.98,f=-3.6!) USER MOD Single : A 15 LYS NZ :NH3+ -173:sc= 1.28 (180deg=1.01) USER MOD Single : A 22 SER OG : rot 180:sc= -0.0884 USER MOD Single : A 25 THR OG1 : rot -16:sc= 0.951 USER MOD Single : A 26 THR OG1 : rot -170:sc= 0.0352 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 90:sc= 0.81 USER MOD Single : A 36 GLN : amide:sc= 0.932 K(o=0.93,f=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot -103:sc= 0.251 USER MOD Single : A 43 CYS SG : rot -131:sc= -0.45 USER MOD Single : A 46 MET CE :methyl 155:sc= -1.52 (180deg=-3.58!) USER MOD Single : A 50 ASN : amide:sc= 0.281 X(o=0.28,f=0) USER MOD Single : A 51 THR OG1 : rot 71:sc= 0.888 USER MOD Single : A 52 LYS NZ :NH3+ 175:sc= 0.846 (180deg=0.828) USER MOD Single : A 54 SER OG : rot -138:sc= 0.697 USER MOD Single : A 61 THR OG1 : rot -178:sc= -0.643 USER MOD Single : A 62 TYR OH : rot 41:sc= 0.505 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -0.5 X(o=-0.5,f=-0.0068) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot -137:sc= 0.0158 USER MOD Single : A 101 HIS : no HD1:sc= -0.164 X(o=-0.16,f=-0.038) USER MOD Single : A 105 LYS NZ :NH3+ 163:sc= 0.548 (180deg=0.404) USER MOD Single : A 106 LYS NZ :NH3+ -172:sc= 1.24 (180deg=1.12) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot -160:sc=-0.000928 USER MOD Single : A 119 HIS : no HD1:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 120 HIS : no HD1:sc= -1.48 K(o=-1.5,f=-4!) USER MOD Single : A 127 GLN : amide:sc= 0.269 X(o=0.27,f=0) USER MOD Single : A 130 LYS NZ :NH3+ 167:sc= -0.0412 (180deg=-0.239) USER MOD Single : A 137 MET CE :methyl -165:sc= -0.0413 (180deg=-0.358) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.0462 USER MOD Single : A 152 THR OG1 : rot 180:sc= -1.66! USER MOD Single : A 158 SER OG : rot 150:sc= -1.01 USER MOD Single : A 161 LYS NZ :NH3+ 176:sc= 1.8 (180deg=1.77) USER MOD Single : A 165 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 TYR OH : rot -106:sc= 0.393 USER MOD Single : A 171 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 173 HIS : no HD1:sc= 0.662 K(o=0.66,f=-4.6!) USER MOD Single : A 175 CYS SG : rot 3:sc= 0.712 USER MOD Single : A 179 LYS NZ :NH3+ 159:sc= 1.72 (180deg=-0.595) USER MOD ----------------------------------------------------------------- ATOM 92 N LYS A 8 -16.887 7.185 4.301 1.00 31.42 N ATOM 93 CA LYS A 8 -17.595 6.956 3.055 1.00 73.32 C ATOM 94 C LYS A 8 -16.652 6.283 2.071 1.00 32.52 C ATOM 95 O LYS A 8 -17.022 5.941 0.949 1.00 64.42 O ATOM 96 CB LYS A 8 -18.136 8.274 2.481 1.00 53.11 C ATOM 97 CG LYS A 8 -17.113 9.410 2.422 1.00 63.12 C ATOM 98 CD LYS A 8 -17.018 10.199 3.732 1.00 72.32 C ATOM 99 CE LYS A 8 -18.326 10.877 4.119 1.00 63.12 C ATOM 100 NZ LYS A 8 -18.788 11.846 3.091 1.00 55.44 N ATOM 0 HA LYS A 8 -18.451 6.307 3.239 1.00 73.32 H new ATOM 0 HB2 LYS A 8 -18.513 8.089 1.475 1.00 53.11 H new ATOM 0 HB3 LYS A 8 -18.984 8.597 3.085 1.00 53.11 H new ATOM 0 HG2 LYS A 8 -16.133 8.997 2.181 1.00 63.12 H new ATOM 0 HG3 LYS A 8 -17.380 10.090 1.613 1.00 63.12 H new ATOM 0 HD2 LYS A 8 -16.714 9.525 4.533 1.00 72.32 H new ATOM 0 HD3 LYS A 8 -16.238 10.955 3.638 1.00 72.32 H new ATOM 0 HE2 LYS A 8 -19.094 10.119 4.271 1.00 63.12 H new ATOM 0 HE3 LYS A 8 -18.197 11.394 5.070 1.00 63.12 H new ATOM 0 HZ1 LYS A 8 -19.624 12.354 3.444 1.00 55.44 H new ATOM 0 HZ2 LYS A 8 -18.028 12.527 2.890 1.00 55.44 H new ATOM 0 HZ3 LYS A 8 -19.035 11.336 2.219 1.00 55.44 H new ATOM 114 N GLU A 9 -15.422 6.111 2.534 1.00 53.55 N ATOM 115 CA GLU A 9 -14.360 5.483 1.775 1.00 43.21 C ATOM 116 C GLU A 9 -14.628 3.983 1.649 1.00 1.30 C ATOM 117 O GLU A 9 -15.114 3.360 2.596 1.00 23.04 O ATOM 118 CB GLU A 9 -13.008 5.723 2.473 1.00 74.20 C ATOM 119 CG GLU A 9 -12.496 7.163 2.400 1.00 73.42 C ATOM 120 CD GLU A 9 -13.376 8.172 3.123 1.00 72.44 C ATOM 121 OE1 GLU A 9 -13.950 7.829 4.178 1.00 71.11 O ATOM 122 OE2 GLU A 9 -13.483 9.319 2.647 1.00 33.40 O ATOM 0 H GLU A 9 -15.133 6.411 3.465 1.00 53.55 H new ATOM 0 HA GLU A 9 -14.326 5.920 0.777 1.00 43.21 H new ATOM 0 HB2 GLU A 9 -13.100 5.438 3.521 1.00 74.20 H new ATOM 0 HB3 GLU A 9 -12.263 5.064 2.027 1.00 74.20 H new ATOM 0 HG2 GLU A 9 -11.493 7.203 2.824 1.00 73.42 H new ATOM 0 HG3 GLU A 9 -12.412 7.455 1.353 1.00 73.42 H new ATOM 129 N PRO A 10 -14.327 3.393 0.479 1.00 50.35 N ATOM 130 CA PRO A 10 -14.566 1.967 0.225 1.00 14.21 C ATOM 131 C PRO A 10 -13.696 1.066 1.096 1.00 41.13 C ATOM 132 O PRO A 10 -12.736 1.528 1.723 1.00 23.03 O ATOM 133 CB PRO A 10 -14.211 1.795 -1.254 1.00 61.42 C ATOM 134 CG PRO A 10 -13.316 2.934 -1.581 1.00 54.12 C ATOM 135 CD PRO A 10 -13.731 4.069 -0.689 1.00 32.23 C ATOM 0 HA PRO A 10 -15.591 1.682 0.461 1.00 14.21 H new ATOM 0 HB2 PRO A 10 -13.713 0.841 -1.430 1.00 61.42 H new ATOM 0 HB3 PRO A 10 -15.106 1.807 -1.877 1.00 61.42 H new ATOM 0 HG2 PRO A 10 -12.272 2.669 -1.412 1.00 54.12 H new ATOM 0 HG3 PRO A 10 -13.408 3.211 -2.631 1.00 54.12 H new ATOM 0 HD2 PRO A 10 -12.879 4.686 -0.403 1.00 32.23 H new ATOM 0 HD3 PRO A 10 -14.449 4.725 -1.182 1.00 32.23 H new ATOM 143 N GLU A 11 -14.036 -0.221 1.125 1.00 11.13 N ATOM 144 CA GLU A 11 -13.339 -1.193 1.964 1.00 33.32 C ATOM 145 C GLU A 11 -11.846 -1.247 1.655 1.00 51.35 C ATOM 146 O GLU A 11 -11.045 -1.474 2.550 1.00 64.30 O ATOM 147 CB GLU A 11 -13.948 -2.588 1.806 1.00 15.42 C ATOM 148 CG GLU A 11 -14.002 -3.087 0.375 1.00 30.03 C ATOM 149 CD GLU A 11 -14.158 -4.587 0.291 1.00 23.24 C ATOM 150 OE1 GLU A 11 -15.270 -5.096 0.524 1.00 1.55 O ATOM 151 OE2 GLU A 11 -13.160 -5.268 0.000 1.00 3.12 O ATOM 0 H GLU A 11 -14.796 -0.617 0.572 1.00 11.13 H new ATOM 0 HA GLU A 11 -13.460 -0.863 2.996 1.00 33.32 H new ATOM 0 HB2 GLU A 11 -13.370 -3.294 2.403 1.00 15.42 H new ATOM 0 HB3 GLU A 11 -14.959 -2.579 2.214 1.00 15.42 H new ATOM 0 HG2 GLU A 11 -14.834 -2.609 -0.142 1.00 30.03 H new ATOM 0 HG3 GLU A 11 -13.091 -2.790 -0.145 1.00 30.03 H new ATOM 158 N GLN A 12 -11.478 -1.014 0.398 1.00 74.11 N ATOM 159 CA GLN A 12 -10.081 -1.082 -0.025 1.00 12.21 C ATOM 160 C GLN A 12 -9.229 -0.009 0.668 1.00 73.15 C ATOM 161 O GLN A 12 -8.054 -0.227 0.955 1.00 50.25 O ATOM 162 CB GLN A 12 -9.986 -0.928 -1.548 1.00 43.32 C ATOM 163 CG GLN A 12 -10.250 0.488 -2.038 1.00 70.12 C ATOM 164 CD GLN A 12 -10.427 0.577 -3.535 1.00 71.34 C ATOM 165 OE1 GLN A 12 -9.471 0.800 -4.272 1.00 41.15 O ATOM 166 NE2 GLN A 12 -11.655 0.411 -3.993 1.00 72.40 N ATOM 0 H GLN A 12 -12.131 -0.775 -0.349 1.00 74.11 H new ATOM 0 HA GLN A 12 -9.690 -2.057 0.266 1.00 12.21 H new ATOM 0 HB2 GLN A 12 -8.993 -1.236 -1.874 1.00 43.32 H new ATOM 0 HB3 GLN A 12 -10.700 -1.604 -2.018 1.00 43.32 H new ATOM 0 HG2 GLN A 12 -11.145 0.874 -1.549 1.00 70.12 H new ATOM 0 HG3 GLN A 12 -9.422 1.130 -1.738 1.00 70.12 H new ATOM 0 HE21 GLN A 12 -12.421 0.227 -3.345 1.00 72.40 H new ATOM 0 HE22 GLN A 12 -11.837 0.466 -4.995 1.00 72.40 H new ATOM 175 N LEU A 13 -9.841 1.137 0.961 1.00 1.01 N ATOM 176 CA LEU A 13 -9.126 2.265 1.544 1.00 44.45 C ATOM 177 C LEU A 13 -8.901 2.065 3.035 1.00 55.25 C ATOM 178 O LEU A 13 -8.019 2.684 3.625 1.00 52.51 O ATOM 179 CB LEU A 13 -9.894 3.572 1.311 1.00 60.14 C ATOM 180 CG LEU A 13 -9.367 4.457 0.175 1.00 15.54 C ATOM 181 CD1 LEU A 13 -9.473 3.747 -1.156 1.00 14.32 C ATOM 182 CD2 LEU A 13 -10.126 5.766 0.118 1.00 0.24 C ATOM 0 H LEU A 13 -10.834 1.307 0.803 1.00 1.01 H new ATOM 0 HA LEU A 13 -8.156 2.326 1.051 1.00 44.45 H new ATOM 0 HB2 LEU A 13 -10.936 3.328 1.104 1.00 60.14 H new ATOM 0 HB3 LEU A 13 -9.880 4.151 2.235 1.00 60.14 H new ATOM 0 HG LEU A 13 -8.317 4.666 0.378 1.00 15.54 H new ATOM 0 HD11 LEU A 13 -9.093 4.395 -1.946 1.00 14.32 H new ATOM 0 HD12 LEU A 13 -8.886 2.829 -1.126 1.00 14.32 H new ATOM 0 HD13 LEU A 13 -10.516 3.504 -1.357 1.00 14.32 H new ATOM 0 HD21 LEU A 13 -9.735 6.378 -0.695 1.00 0.24 H new ATOM 0 HD22 LEU A 13 -11.184 5.566 -0.054 1.00 0.24 H new ATOM 0 HD23 LEU A 13 -10.006 6.298 1.062 1.00 0.24 H new ATOM 194 N ARG A 14 -9.693 1.192 3.637 1.00 64.02 N ATOM 195 CA ARG A 14 -9.618 0.982 5.072 1.00 13.21 C ATOM 196 C ARG A 14 -9.198 -0.449 5.410 1.00 50.11 C ATOM 197 O ARG A 14 -9.117 -0.819 6.578 1.00 65.31 O ATOM 198 CB ARG A 14 -10.954 1.331 5.736 1.00 41.05 C ATOM 199 CG ARG A 14 -12.136 0.509 5.249 1.00 42.34 C ATOM 200 CD ARG A 14 -13.434 1.018 5.854 1.00 23.43 C ATOM 201 NE ARG A 14 -14.558 0.105 5.643 1.00 63.44 N ATOM 202 CZ ARG A 14 -15.626 0.045 6.443 1.00 53.30 C ATOM 203 NH1 ARG A 14 -15.716 0.839 7.505 1.00 5.25 N ATOM 204 NH2 ARG A 14 -16.605 -0.808 6.175 1.00 14.54 N ATOM 0 H ARG A 14 -10.390 0.622 3.158 1.00 64.02 H new ATOM 0 HA ARG A 14 -8.851 1.648 5.467 1.00 13.21 H new ATOM 0 HB2 ARG A 14 -10.855 1.198 6.813 1.00 41.05 H new ATOM 0 HB3 ARG A 14 -11.166 2.386 5.563 1.00 41.05 H new ATOM 0 HG2 ARG A 14 -12.194 0.556 4.162 1.00 42.34 H new ATOM 0 HG3 ARG A 14 -11.991 -0.538 5.516 1.00 42.34 H new ATOM 0 HD2 ARG A 14 -13.294 1.173 6.924 1.00 23.43 H new ATOM 0 HD3 ARG A 14 -13.675 1.989 5.421 1.00 23.43 H new ATOM 0 HE ARG A 14 -14.524 -0.522 4.839 1.00 63.44 H new ATOM 0 HH11 ARG A 14 -14.967 1.499 7.713 1.00 5.25 H new ATOM 0 HH12 ARG A 14 -16.534 0.788 8.112 1.00 5.25 H new ATOM 0 HH21 ARG A 14 -16.542 -1.417 5.359 1.00 14.54 H new ATOM 0 HH22 ARG A 14 -17.421 -0.855 6.785 1.00 14.54 H new ATOM 218 N LYS A 15 -8.968 -1.265 4.394 1.00 73.22 N ATOM 219 CA LYS A 15 -8.474 -2.614 4.617 1.00 20.45 C ATOM 220 C LYS A 15 -6.963 -2.712 4.429 1.00 52.32 C ATOM 221 O LYS A 15 -6.362 -2.007 3.612 1.00 41.21 O ATOM 222 CB LYS A 15 -9.182 -3.597 3.684 1.00 43.34 C ATOM 223 CG LYS A 15 -8.998 -5.061 4.062 1.00 63.10 C ATOM 224 CD LYS A 15 -9.498 -5.997 2.971 1.00 42.02 C ATOM 225 CE LYS A 15 -10.895 -5.625 2.501 1.00 73.20 C ATOM 226 NZ LYS A 15 -11.438 -6.626 1.548 1.00 64.14 N ATOM 0 H LYS A 15 -9.114 -1.020 3.415 1.00 73.22 H new ATOM 0 HA LYS A 15 -8.693 -2.872 5.653 1.00 20.45 H new ATOM 0 HB2 LYS A 15 -10.247 -3.367 3.674 1.00 43.34 H new ATOM 0 HB3 LYS A 15 -8.814 -3.447 2.669 1.00 43.34 H new ATOM 0 HG2 LYS A 15 -7.943 -5.257 4.252 1.00 63.10 H new ATOM 0 HG3 LYS A 15 -9.533 -5.266 4.989 1.00 63.10 H new ATOM 0 HD2 LYS A 15 -8.811 -5.969 2.125 1.00 42.02 H new ATOM 0 HD3 LYS A 15 -9.501 -7.021 3.345 1.00 42.02 H new ATOM 0 HE2 LYS A 15 -11.559 -5.544 3.362 1.00 73.20 H new ATOM 0 HE3 LYS A 15 -10.870 -4.645 2.025 1.00 73.20 H new ATOM 0 HZ1 LYS A 15 -12.339 -6.282 1.159 1.00 64.14 H new ATOM 0 HZ2 LYS A 15 -10.759 -6.772 0.774 1.00 64.14 H new ATOM 0 HZ3 LYS A 15 -11.597 -7.526 2.043 1.00 64.14 H new ATOM 240 N LEU A 16 -6.378 -3.616 5.191 1.00 23.04 N ATOM 241 CA LEU A 16 -4.965 -3.908 5.114 1.00 52.31 C ATOM 242 C LEU A 16 -4.746 -5.347 4.676 1.00 33.13 C ATOM 243 O LEU A 16 -5.519 -6.235 5.024 1.00 43.33 O ATOM 244 CB LEU A 16 -4.275 -3.682 6.464 1.00 21.20 C ATOM 245 CG LEU A 16 -4.153 -2.228 6.922 1.00 53.11 C ATOM 246 CD1 LEU A 16 -3.449 -2.156 8.266 1.00 52.00 C ATOM 247 CD2 LEU A 16 -3.403 -1.401 5.893 1.00 70.31 C ATOM 0 H LEU A 16 -6.877 -4.172 5.886 1.00 23.04 H new ATOM 0 HA LEU A 16 -4.529 -3.230 4.380 1.00 52.31 H new ATOM 0 HB2 LEU A 16 -4.822 -4.237 7.226 1.00 21.20 H new ATOM 0 HB3 LEU A 16 -3.274 -4.111 6.414 1.00 21.20 H new ATOM 0 HG LEU A 16 -5.157 -1.818 7.028 1.00 53.11 H new ATOM 0 HD11 LEU A 16 -3.369 -1.115 8.580 1.00 52.00 H new ATOM 0 HD12 LEU A 16 -4.021 -2.715 9.007 1.00 52.00 H new ATOM 0 HD13 LEU A 16 -2.451 -2.586 8.178 1.00 52.00 H new ATOM 0 HD21 LEU A 16 -3.328 -0.370 6.239 1.00 70.31 H new ATOM 0 HD22 LEU A 16 -2.403 -1.811 5.755 1.00 70.31 H new ATOM 0 HD23 LEU A 16 -3.939 -1.427 4.944 1.00 70.31 H new ATOM 259 N PHE A 17 -3.694 -5.556 3.913 1.00 64.32 N ATOM 260 CA PHE A 17 -3.255 -6.878 3.523 1.00 33.22 C ATOM 261 C PHE A 17 -2.133 -7.296 4.454 1.00 41.03 C ATOM 262 O PHE A 17 -1.112 -6.622 4.549 1.00 53.44 O ATOM 263 CB PHE A 17 -2.768 -6.872 2.065 1.00 12.12 C ATOM 264 CG PHE A 17 -1.869 -8.028 1.714 1.00 55.25 C ATOM 265 CD1 PHE A 17 -2.387 -9.300 1.529 1.00 62.11 C ATOM 266 CD2 PHE A 17 -0.501 -7.838 1.572 1.00 11.12 C ATOM 267 CE1 PHE A 17 -1.556 -10.357 1.209 1.00 43.01 C ATOM 268 CE2 PHE A 17 0.331 -8.892 1.254 1.00 33.20 C ATOM 269 CZ PHE A 17 -0.197 -10.154 1.072 1.00 65.21 C ATOM 0 H PHE A 17 -3.113 -4.804 3.542 1.00 64.32 H new ATOM 0 HA PHE A 17 -4.083 -7.584 3.594 1.00 33.22 H new ATOM 0 HB2 PHE A 17 -3.634 -6.885 1.403 1.00 12.12 H new ATOM 0 HB3 PHE A 17 -2.235 -5.940 1.875 1.00 12.12 H new ATOM 0 HD1 PHE A 17 -3.449 -9.467 1.636 1.00 62.11 H new ATOM 0 HD2 PHE A 17 -0.083 -6.852 1.712 1.00 11.12 H new ATOM 0 HE1 PHE A 17 -1.970 -11.344 1.066 1.00 43.01 H new ATOM 0 HE2 PHE A 17 1.393 -8.730 1.148 1.00 33.20 H new ATOM 0 HZ PHE A 17 0.451 -10.981 0.823 1.00 65.21 H new ATOM 279 N ILE A 18 -2.326 -8.382 5.160 1.00 42.23 N ATOM 280 CA ILE A 18 -1.322 -8.855 6.084 1.00 73.23 C ATOM 281 C ILE A 18 -0.540 -9.990 5.455 1.00 70.22 C ATOM 282 O ILE A 18 -1.072 -11.077 5.249 1.00 43.14 O ATOM 283 CB ILE A 18 -1.933 -9.340 7.413 1.00 64.25 C ATOM 284 CG1 ILE A 18 -3.005 -8.363 7.919 1.00 62.45 C ATOM 285 CG2 ILE A 18 -0.834 -9.515 8.451 1.00 12.13 C ATOM 286 CD1 ILE A 18 -2.492 -6.960 8.158 1.00 54.42 C ATOM 0 H ILE A 18 -3.168 -8.956 5.114 1.00 42.23 H new ATOM 0 HA ILE A 18 -0.665 -8.014 6.304 1.00 73.23 H new ATOM 0 HB ILE A 18 -2.417 -10.301 7.242 1.00 64.25 H new ATOM 0 HG12 ILE A 18 -3.818 -8.323 7.194 1.00 62.45 H new ATOM 0 HG13 ILE A 18 -3.425 -8.749 8.848 1.00 62.45 H new ATOM 0 HG21 ILE A 18 -1.271 -9.858 9.389 1.00 12.13 H new ATOM 0 HG22 ILE A 18 -0.112 -10.251 8.096 1.00 12.13 H new ATOM 0 HG23 ILE A 18 -0.331 -8.562 8.612 1.00 12.13 H new ATOM 0 HD11 ILE A 18 -3.307 -6.330 8.514 1.00 54.42 H new ATOM 0 HD12 ILE A 18 -1.700 -6.985 8.906 1.00 54.42 H new ATOM 0 HD13 ILE A 18 -2.099 -6.553 7.227 1.00 54.42 H new ATOM 298 N GLY A 19 0.714 -9.736 5.151 1.00 5.43 N ATOM 299 CA GLY A 19 1.542 -10.750 4.551 1.00 73.32 C ATOM 300 C GLY A 19 2.544 -11.281 5.540 1.00 24.04 C ATOM 301 O GLY A 19 2.942 -10.565 6.460 1.00 3.33 O ATOM 0 H GLY A 19 1.177 -8.841 5.309 1.00 5.43 H new ATOM 0 HA2 GLY A 19 0.918 -11.566 4.186 1.00 73.32 H new ATOM 0 HA3 GLY A 19 2.062 -10.336 3.687 1.00 73.32 H new ATOM 305 N GLY A 20 2.951 -12.527 5.370 1.00 45.12 N ATOM 306 CA GLY A 20 3.941 -13.096 6.254 1.00 3.02 C ATOM 307 C GLY A 20 3.366 -13.525 7.587 1.00 34.41 C ATOM 308 O GLY A 20 3.958 -13.263 8.632 1.00 10.10 O ATOM 0 H GLY A 20 2.615 -13.153 4.638 1.00 45.12 H new ATOM 0 HA2 GLY A 20 4.401 -13.957 5.769 1.00 3.02 H new ATOM 0 HA3 GLY A 20 4.732 -12.365 6.424 1.00 3.02 H new ATOM 312 N LEU A 21 2.207 -14.166 7.560 1.00 42.15 N ATOM 313 CA LEU A 21 1.626 -14.738 8.766 1.00 41.32 C ATOM 314 C LEU A 21 2.208 -16.119 9.035 1.00 64.33 C ATOM 315 O LEU A 21 2.981 -16.652 8.232 1.00 54.14 O ATOM 316 CB LEU A 21 0.104 -14.851 8.625 1.00 54.55 C ATOM 317 CG LEU A 21 -0.656 -13.530 8.555 1.00 13.12 C ATOM 318 CD1 LEU A 21 -2.136 -13.774 8.327 1.00 72.11 C ATOM 319 CD2 LEU A 21 -0.444 -12.735 9.825 1.00 4.22 C ATOM 0 H LEU A 21 1.650 -14.303 6.716 1.00 42.15 H new ATOM 0 HA LEU A 21 1.864 -14.078 9.601 1.00 41.32 H new ATOM 0 HB2 LEU A 21 -0.117 -15.424 7.724 1.00 54.55 H new ATOM 0 HB3 LEU A 21 -0.279 -15.424 9.469 1.00 54.55 H new ATOM 0 HG LEU A 21 -0.270 -12.956 7.713 1.00 13.12 H new ATOM 0 HD11 LEU A 21 -2.659 -12.819 8.280 1.00 72.11 H new ATOM 0 HD12 LEU A 21 -2.276 -14.311 7.389 1.00 72.11 H new ATOM 0 HD13 LEU A 21 -2.538 -14.368 9.148 1.00 72.11 H new ATOM 0 HD21 LEU A 21 -0.992 -11.795 9.761 1.00 4.22 H new ATOM 0 HD22 LEU A 21 -0.806 -13.309 10.678 1.00 4.22 H new ATOM 0 HD23 LEU A 21 0.619 -12.528 9.951 1.00 4.22 H new ATOM 331 N SER A 22 1.823 -16.699 10.159 1.00 14.53 N ATOM 332 CA SER A 22 2.245 -18.039 10.510 1.00 21.22 C ATOM 333 C SER A 22 1.227 -19.046 9.980 1.00 45.42 C ATOM 334 O SER A 22 0.167 -18.665 9.482 1.00 23.55 O ATOM 335 CB SER A 22 2.393 -18.162 12.033 1.00 52.31 C ATOM 336 OG SER A 22 2.921 -19.423 12.408 1.00 43.52 O ATOM 0 H SER A 22 1.214 -16.256 10.847 1.00 14.53 H new ATOM 0 HA SER A 22 3.214 -18.248 10.057 1.00 21.22 H new ATOM 0 HB2 SER A 22 3.046 -17.370 12.400 1.00 52.31 H new ATOM 0 HB3 SER A 22 1.421 -18.019 12.506 1.00 52.31 H new ATOM 0 HG SER A 22 3.003 -19.466 13.384 1.00 43.52 H new ATOM 342 N PHE A 23 1.556 -20.322 10.097 1.00 44.44 N ATOM 343 CA PHE A 23 0.689 -21.404 9.644 1.00 62.44 C ATOM 344 C PHE A 23 -0.447 -21.628 10.645 1.00 53.42 C ATOM 345 O PHE A 23 -1.434 -22.312 10.355 1.00 75.30 O ATOM 346 CB PHE A 23 1.533 -22.675 9.486 1.00 51.43 C ATOM 347 CG PHE A 23 0.905 -23.763 8.654 1.00 41.04 C ATOM 348 CD1 PHE A 23 0.408 -23.495 7.391 1.00 64.12 C ATOM 349 CD2 PHE A 23 0.832 -25.058 9.136 1.00 51.43 C ATOM 350 CE1 PHE A 23 -0.155 -24.499 6.626 1.00 5.34 C ATOM 351 CE2 PHE A 23 0.273 -26.066 8.375 1.00 54.43 C ATOM 352 CZ PHE A 23 -0.221 -25.786 7.118 1.00 41.34 C ATOM 0 H PHE A 23 2.433 -20.640 10.509 1.00 44.44 H new ATOM 0 HA PHE A 23 0.241 -21.144 8.685 1.00 62.44 H new ATOM 0 HB2 PHE A 23 2.489 -22.404 9.038 1.00 51.43 H new ATOM 0 HB3 PHE A 23 1.747 -23.075 10.477 1.00 51.43 H new ATOM 0 HD1 PHE A 23 0.461 -22.490 6.999 1.00 64.12 H new ATOM 0 HD2 PHE A 23 1.217 -25.283 10.120 1.00 51.43 H new ATOM 0 HE1 PHE A 23 -0.543 -24.276 5.643 1.00 5.34 H new ATOM 0 HE2 PHE A 23 0.223 -27.072 8.764 1.00 54.43 H new ATOM 0 HZ PHE A 23 -0.658 -26.572 6.521 1.00 41.34 H new ATOM 362 N GLU A 24 -0.317 -21.006 11.809 1.00 61.32 N ATOM 363 CA GLU A 24 -1.259 -21.201 12.899 1.00 21.03 C ATOM 364 C GLU A 24 -2.158 -19.983 13.085 1.00 3.14 C ATOM 365 O GLU A 24 -3.053 -19.998 13.929 1.00 73.21 O ATOM 366 CB GLU A 24 -0.502 -21.459 14.199 1.00 31.21 C ATOM 367 CG GLU A 24 0.601 -22.494 14.082 1.00 35.51 C ATOM 368 CD GLU A 24 1.369 -22.647 15.375 1.00 31.41 C ATOM 369 OE1 GLU A 24 0.962 -23.474 16.218 1.00 24.44 O ATOM 370 OE2 GLU A 24 2.369 -21.929 15.568 1.00 61.13 O ATOM 0 H GLU A 24 0.440 -20.356 12.022 1.00 61.32 H new ATOM 0 HA GLU A 24 -1.882 -22.059 12.647 1.00 21.03 H new ATOM 0 HB2 GLU A 24 -0.069 -20.521 14.546 1.00 31.21 H new ATOM 0 HB3 GLU A 24 -1.211 -21.784 14.961 1.00 31.21 H new ATOM 0 HG2 GLU A 24 0.169 -23.454 13.800 1.00 35.51 H new ATOM 0 HG3 GLU A 24 1.286 -22.206 13.285 1.00 35.51 H new ATOM 377 N THR A 25 -1.942 -18.948 12.278 1.00 30.22 N ATOM 378 CA THR A 25 -2.601 -17.666 12.486 1.00 72.12 C ATOM 379 C THR A 25 -4.096 -17.736 12.188 1.00 30.43 C ATOM 380 O THR A 25 -4.512 -18.185 11.118 1.00 5.04 O ATOM 381 CB THR A 25 -1.958 -16.567 11.622 1.00 44.42 C ATOM 382 OG1 THR A 25 -0.550 -16.515 11.885 1.00 0.34 O ATOM 383 CG2 THR A 25 -2.586 -15.210 11.911 1.00 63.01 C ATOM 0 H THR A 25 -1.315 -18.974 11.474 1.00 30.22 H new ATOM 0 HA THR A 25 -2.473 -17.418 13.540 1.00 72.12 H new ATOM 0 HB THR A 25 -2.129 -16.806 10.572 1.00 44.42 H new ATOM 0 HG1 THR A 25 -0.356 -16.987 12.722 1.00 0.34 H new ATOM 0 HG21 THR A 25 -2.114 -14.451 11.288 1.00 63.01 H new ATOM 0 HG22 THR A 25 -3.653 -15.249 11.691 1.00 63.01 H new ATOM 0 HG23 THR A 25 -2.441 -14.958 12.962 1.00 63.01 H new ATOM 391 N THR A 26 -4.889 -17.312 13.159 1.00 5.04 N ATOM 392 CA THR A 26 -6.334 -17.252 13.022 1.00 24.22 C ATOM 393 C THR A 26 -6.774 -15.815 12.759 1.00 73.41 C ATOM 394 O THR A 26 -5.986 -14.882 12.925 1.00 65.13 O ATOM 395 CB THR A 26 -7.017 -17.761 14.303 1.00 60.00 C ATOM 396 OG1 THR A 26 -6.503 -17.047 15.435 1.00 62.40 O ATOM 397 CG2 THR A 26 -6.787 -19.252 14.492 1.00 54.32 C ATOM 0 H THR A 26 -4.547 -16.999 14.067 1.00 5.04 H new ATOM 0 HA THR A 26 -6.625 -17.885 12.184 1.00 24.22 H new ATOM 0 HB THR A 26 -8.090 -17.590 14.212 1.00 60.00 H new ATOM 0 HG1 THR A 26 -6.816 -17.473 16.260 1.00 62.40 H new ATOM 0 HG21 THR A 26 -7.281 -19.583 15.405 1.00 54.32 H new ATOM 0 HG22 THR A 26 -7.197 -19.794 13.640 1.00 54.32 H new ATOM 0 HG23 THR A 26 -5.717 -19.449 14.566 1.00 54.32 H new ATOM 405 N ASP A 27 -8.026 -15.632 12.360 1.00 20.01 N ATOM 406 CA ASP A 27 -8.540 -14.292 12.102 1.00 72.54 C ATOM 407 C ASP A 27 -8.834 -13.586 13.417 1.00 24.43 C ATOM 408 O ASP A 27 -8.748 -12.366 13.502 1.00 74.24 O ATOM 409 CB ASP A 27 -9.791 -14.331 11.203 1.00 62.02 C ATOM 410 CG ASP A 27 -11.096 -14.086 11.948 1.00 24.24 C ATOM 411 OD1 ASP A 27 -11.506 -12.914 12.085 1.00 13.04 O ATOM 412 OD2 ASP A 27 -11.723 -15.071 12.387 1.00 72.24 O ATOM 0 H ASP A 27 -8.698 -16.384 12.209 1.00 20.01 H new ATOM 0 HA ASP A 27 -7.776 -13.730 11.566 1.00 72.54 H new ATOM 0 HB2 ASP A 27 -9.686 -13.581 10.419 1.00 62.02 H new ATOM 0 HB3 ASP A 27 -9.842 -15.302 10.711 1.00 62.02 H new ATOM 417 N GLU A 28 -9.151 -14.371 14.445 1.00 23.15 N ATOM 418 CA GLU A 28 -9.430 -13.827 15.764 1.00 31.42 C ATOM 419 C GLU A 28 -8.168 -13.233 16.385 1.00 51.23 C ATOM 420 O GLU A 28 -8.207 -12.153 16.964 1.00 31.54 O ATOM 421 CB GLU A 28 -10.032 -14.901 16.680 1.00 24.40 C ATOM 422 CG GLU A 28 -9.214 -16.181 16.769 1.00 22.23 C ATOM 423 CD GLU A 28 -9.846 -17.226 17.662 1.00 3.34 C ATOM 424 OE1 GLU A 28 -10.645 -18.040 17.155 1.00 13.10 O ATOM 425 OE2 GLU A 28 -9.541 -17.242 18.872 1.00 54.45 O ATOM 0 H GLU A 28 -9.220 -15.387 14.385 1.00 23.15 H new ATOM 0 HA GLU A 28 -10.161 -13.027 15.651 1.00 31.42 H new ATOM 0 HB2 GLU A 28 -10.145 -14.486 17.681 1.00 24.40 H new ATOM 0 HB3 GLU A 28 -11.032 -15.147 16.323 1.00 24.40 H new ATOM 0 HG2 GLU A 28 -9.087 -16.595 15.769 1.00 22.23 H new ATOM 0 HG3 GLU A 28 -8.219 -15.944 17.145 1.00 22.23 H new ATOM 432 N SER A 29 -7.047 -13.933 16.228 1.00 72.34 N ATOM 433 CA SER A 29 -5.772 -13.474 16.765 1.00 74.02 C ATOM 434 C SER A 29 -5.254 -12.295 15.947 1.00 42.33 C ATOM 435 O SER A 29 -4.758 -11.312 16.502 1.00 1.14 O ATOM 436 CB SER A 29 -4.749 -14.616 16.763 1.00 4.22 C ATOM 437 OG SER A 29 -3.604 -14.296 17.536 1.00 50.23 O ATOM 0 H SER A 29 -6.998 -14.823 15.731 1.00 72.34 H new ATOM 0 HA SER A 29 -5.922 -13.148 17.794 1.00 74.02 H new ATOM 0 HB2 SER A 29 -5.213 -15.521 17.157 1.00 4.22 H new ATOM 0 HB3 SER A 29 -4.447 -14.833 15.738 1.00 4.22 H new ATOM 0 HG SER A 29 -2.974 -15.046 17.514 1.00 50.23 H new ATOM 443 N LEU A 30 -5.389 -12.400 14.626 1.00 1.03 N ATOM 444 CA LEU A 30 -4.956 -11.349 13.709 1.00 60.02 C ATOM 445 C LEU A 30 -5.692 -10.042 14.000 1.00 10.35 C ATOM 446 O LEU A 30 -5.074 -8.982 14.125 1.00 24.03 O ATOM 447 CB LEU A 30 -5.208 -11.795 12.263 1.00 61.23 C ATOM 448 CG LEU A 30 -4.716 -10.841 11.172 1.00 64.32 C ATOM 449 CD1 LEU A 30 -3.219 -10.614 11.296 1.00 23.23 C ATOM 450 CD2 LEU A 30 -5.058 -11.389 9.795 1.00 14.11 C ATOM 0 H LEU A 30 -5.799 -13.212 14.164 1.00 1.03 H new ATOM 0 HA LEU A 30 -3.889 -11.174 13.850 1.00 60.02 H new ATOM 0 HB2 LEU A 30 -4.730 -12.763 12.114 1.00 61.23 H new ATOM 0 HB3 LEU A 30 -6.280 -11.944 12.131 1.00 61.23 H new ATOM 0 HG LEU A 30 -5.220 -9.883 11.299 1.00 64.32 H new ATOM 0 HD11 LEU A 30 -2.888 -9.933 10.512 1.00 23.23 H new ATOM 0 HD12 LEU A 30 -2.996 -10.180 12.271 1.00 23.23 H new ATOM 0 HD13 LEU A 30 -2.697 -11.566 11.194 1.00 23.23 H new ATOM 0 HD21 LEU A 30 -4.702 -10.699 9.030 1.00 14.11 H new ATOM 0 HD22 LEU A 30 -4.579 -12.359 9.660 1.00 14.11 H new ATOM 0 HD23 LEU A 30 -6.138 -11.502 9.706 1.00 14.11 H new ATOM 462 N ARG A 31 -7.013 -10.137 14.113 1.00 51.41 N ATOM 463 CA ARG A 31 -7.875 -9.005 14.413 1.00 61.34 C ATOM 464 C ARG A 31 -7.497 -8.369 15.733 1.00 34.41 C ATOM 465 O ARG A 31 -7.188 -7.183 15.792 1.00 51.55 O ATOM 466 CB ARG A 31 -9.317 -9.508 14.469 1.00 54.12 C ATOM 467 CG ARG A 31 -10.351 -8.455 14.804 1.00 3.22 C ATOM 468 CD ARG A 31 -11.724 -9.084 14.945 1.00 14.14 C ATOM 469 NE ARG A 31 -12.020 -10.001 13.838 1.00 51.32 N ATOM 470 CZ ARG A 31 -13.038 -9.869 12.991 1.00 62.23 C ATOM 471 NH1 ARG A 31 -13.887 -8.850 13.098 1.00 30.02 N ATOM 472 NH2 ARG A 31 -13.196 -10.755 12.017 1.00 14.04 N ATOM 0 H ARG A 31 -7.519 -11.015 13.997 1.00 51.41 H new ATOM 0 HA ARG A 31 -7.764 -8.247 13.638 1.00 61.34 H new ATOM 0 HB2 ARG A 31 -9.569 -9.949 13.505 1.00 54.12 H new ATOM 0 HB3 ARG A 31 -9.379 -10.305 15.210 1.00 54.12 H new ATOM 0 HG2 ARG A 31 -10.078 -7.951 15.731 1.00 3.22 H new ATOM 0 HG3 ARG A 31 -10.371 -7.695 14.023 1.00 3.22 H new ATOM 0 HD2 ARG A 31 -11.781 -9.625 15.890 1.00 14.14 H new ATOM 0 HD3 ARG A 31 -12.481 -8.300 14.980 1.00 14.14 H new ATOM 0 HE ARG A 31 -11.399 -10.800 13.708 1.00 51.32 H new ATOM 0 HH11 ARG A 31 -13.762 -8.157 13.836 1.00 30.02 H new ATOM 0 HH12 ARG A 31 -14.663 -8.761 12.442 1.00 30.02 H new ATOM 0 HH21 ARG A 31 -12.540 -11.530 11.921 1.00 14.04 H new ATOM 0 HH22 ARG A 31 -13.974 -10.661 11.364 1.00 14.04 H new ATOM 486 N SER A 32 -7.511 -9.195 16.769 1.00 25.43 N ATOM 487 CA SER A 32 -7.157 -8.810 18.128 1.00 44.53 C ATOM 488 C SER A 32 -5.893 -7.949 18.206 1.00 15.45 C ATOM 489 O SER A 32 -5.823 -7.001 18.994 1.00 5.43 O ATOM 490 CB SER A 32 -6.970 -10.082 18.931 1.00 11.44 C ATOM 491 OG SER A 32 -8.221 -10.631 19.301 1.00 42.40 O ATOM 0 H SER A 32 -7.776 -10.177 16.686 1.00 25.43 H new ATOM 0 HA SER A 32 -7.961 -8.193 18.530 1.00 44.53 H new ATOM 0 HB2 SER A 32 -6.408 -10.809 18.344 1.00 11.44 H new ATOM 0 HB3 SER A 32 -6.382 -9.871 19.824 1.00 11.44 H new ATOM 0 HG SER A 32 -8.523 -11.253 18.607 1.00 42.40 H new ATOM 497 N HIS A 33 -4.914 -8.280 17.379 1.00 22.31 N ATOM 498 CA HIS A 33 -3.658 -7.542 17.328 1.00 41.12 C ATOM 499 C HIS A 33 -3.869 -6.125 16.786 1.00 33.44 C ATOM 500 O HIS A 33 -3.483 -5.152 17.422 1.00 54.22 O ATOM 501 CB HIS A 33 -2.640 -8.295 16.462 1.00 74.23 C ATOM 502 CG HIS A 33 -1.320 -7.596 16.304 1.00 3.01 C ATOM 503 ND1 HIS A 33 -0.320 -7.731 17.232 1.00 61.24 N ATOM 504 CD2 HIS A 33 -0.894 -6.783 15.310 1.00 4.13 C ATOM 505 CE1 HIS A 33 0.688 -7.004 16.780 1.00 43.43 C ATOM 506 NE2 HIS A 33 0.385 -6.408 15.621 1.00 3.34 N ATOM 0 H HIS A 33 -4.965 -9.063 16.727 1.00 22.31 H new ATOM 0 HA HIS A 33 -3.272 -7.459 18.344 1.00 41.12 H new ATOM 0 HB2 HIS A 33 -2.466 -9.278 16.899 1.00 74.23 H new ATOM 0 HB3 HIS A 33 -3.072 -8.457 15.474 1.00 74.23 H new ATOM 0 HD2 HIS A 33 -1.456 -6.486 14.437 1.00 4.13 H new ATOM 0 HE1 HIS A 33 1.638 -6.904 17.284 1.00 43.43 H new ATOM 0 HE2 HIS A 33 0.990 -5.794 15.075 1.00 3.34 H new ATOM 514 N PHE A 34 -4.513 -6.014 15.633 1.00 73.42 N ATOM 515 CA PHE A 34 -4.588 -4.742 14.920 1.00 72.31 C ATOM 516 C PHE A 34 -5.668 -3.830 15.494 1.00 3.21 C ATOM 517 O PHE A 34 -5.629 -2.613 15.296 1.00 54.21 O ATOM 518 CB PHE A 34 -4.809 -4.984 13.425 1.00 32.51 C ATOM 519 CG PHE A 34 -3.560 -5.426 12.710 1.00 0.44 C ATOM 520 CD1 PHE A 34 -2.661 -4.490 12.221 1.00 51.25 C ATOM 521 CD2 PHE A 34 -3.278 -6.772 12.533 1.00 31.44 C ATOM 522 CE1 PHE A 34 -1.508 -4.888 11.570 1.00 70.35 C ATOM 523 CE2 PHE A 34 -2.125 -7.176 11.883 1.00 55.34 C ATOM 524 CZ PHE A 34 -1.239 -6.234 11.399 1.00 60.03 C ATOM 0 H PHE A 34 -4.991 -6.787 15.170 1.00 73.42 H new ATOM 0 HA PHE A 34 -3.636 -4.229 15.053 1.00 72.31 H new ATOM 0 HB2 PHE A 34 -5.582 -5.741 13.296 1.00 32.51 H new ATOM 0 HB3 PHE A 34 -5.180 -4.068 12.965 1.00 32.51 H new ATOM 0 HD1 PHE A 34 -2.864 -3.437 12.350 1.00 51.25 H new ATOM 0 HD2 PHE A 34 -3.967 -7.515 12.907 1.00 31.44 H new ATOM 0 HE1 PHE A 34 -0.817 -4.148 11.195 1.00 70.35 H new ATOM 0 HE2 PHE A 34 -1.918 -8.228 11.754 1.00 55.34 H new ATOM 0 HZ PHE A 34 -0.340 -6.547 10.889 1.00 60.03 H new ATOM 534 N GLU A 35 -6.618 -4.422 16.213 1.00 10.40 N ATOM 535 CA GLU A 35 -7.661 -3.672 16.911 1.00 54.14 C ATOM 536 C GLU A 35 -7.083 -2.639 17.887 1.00 13.31 C ATOM 537 O GLU A 35 -7.742 -1.656 18.221 1.00 12.23 O ATOM 538 CB GLU A 35 -8.557 -4.635 17.682 1.00 72.44 C ATOM 539 CG GLU A 35 -9.514 -5.415 16.804 1.00 15.30 C ATOM 540 CD GLU A 35 -10.432 -6.314 17.595 1.00 70.34 C ATOM 541 OE1 GLU A 35 -10.002 -7.412 17.994 1.00 60.24 O ATOM 542 OE2 GLU A 35 -11.593 -5.929 17.815 1.00 54.10 O ATOM 0 H GLU A 35 -6.687 -5.433 16.329 1.00 10.40 H new ATOM 0 HA GLU A 35 -8.233 -3.135 16.154 1.00 54.14 H new ATOM 0 HB2 GLU A 35 -7.931 -5.336 18.234 1.00 72.44 H new ATOM 0 HB3 GLU A 35 -9.131 -4.072 18.418 1.00 72.44 H new ATOM 0 HG2 GLU A 35 -10.112 -4.718 16.218 1.00 15.30 H new ATOM 0 HG3 GLU A 35 -8.943 -6.017 16.098 1.00 15.30 H new ATOM 549 N GLN A 36 -5.858 -2.882 18.340 1.00 53.25 N ATOM 550 CA GLN A 36 -5.190 -2.004 19.305 1.00 63.52 C ATOM 551 C GLN A 36 -4.948 -0.600 18.748 1.00 43.21 C ATOM 552 O GLN A 36 -4.877 0.367 19.507 1.00 12.42 O ATOM 553 CB GLN A 36 -3.852 -2.607 19.737 1.00 43.51 C ATOM 554 CG GLN A 36 -3.964 -3.984 20.375 1.00 11.12 C ATOM 555 CD GLN A 36 -2.612 -4.556 20.765 1.00 33.34 C ATOM 556 OE1 GLN A 36 -2.151 -4.381 21.894 1.00 63.02 O ATOM 557 NE2 GLN A 36 -1.962 -5.232 19.833 1.00 52.14 N ATOM 0 H GLN A 36 -5.300 -3.686 18.054 1.00 53.25 H new ATOM 0 HA GLN A 36 -5.858 -1.917 20.162 1.00 63.52 H new ATOM 0 HB2 GLN A 36 -3.199 -2.674 18.867 1.00 43.51 H new ATOM 0 HB3 GLN A 36 -3.372 -1.930 20.444 1.00 43.51 H new ATOM 0 HG2 GLN A 36 -4.597 -3.920 21.260 1.00 11.12 H new ATOM 0 HG3 GLN A 36 -4.456 -4.664 19.680 1.00 11.12 H new ATOM 0 HE21 GLN A 36 -2.377 -5.356 18.910 1.00 52.14 H new ATOM 0 HE22 GLN A 36 -1.045 -5.630 20.037 1.00 52.14 H new ATOM 566 N TRP A 37 -4.824 -0.485 17.436 1.00 30.31 N ATOM 567 CA TRP A 37 -4.518 0.799 16.817 1.00 2.22 C ATOM 568 C TRP A 37 -5.767 1.459 16.252 1.00 62.40 C ATOM 569 O TRP A 37 -5.804 2.674 16.065 1.00 51.12 O ATOM 570 CB TRP A 37 -3.451 0.626 15.738 1.00 75.52 C ATOM 571 CG TRP A 37 -2.103 0.350 16.326 1.00 61.42 C ATOM 572 CD1 TRP A 37 -1.177 1.274 16.706 1.00 3.13 C ATOM 573 CD2 TRP A 37 -1.539 -0.931 16.631 1.00 54.23 C ATOM 574 NE1 TRP A 37 -0.074 0.648 17.230 1.00 1.54 N ATOM 575 CE2 TRP A 37 -0.270 -0.704 17.192 1.00 70.04 C ATOM 576 CE3 TRP A 37 -1.983 -2.247 16.487 1.00 42.12 C ATOM 577 CZ2 TRP A 37 0.559 -1.742 17.608 1.00 11.45 C ATOM 578 CZ3 TRP A 37 -1.157 -3.277 16.897 1.00 20.35 C ATOM 579 CH2 TRP A 37 0.099 -3.019 17.453 1.00 21.32 C ATOM 0 H TRP A 37 -4.929 -1.259 16.780 1.00 30.31 H new ATOM 0 HA TRP A 37 -4.125 1.461 17.589 1.00 2.22 H new ATOM 0 HB2 TRP A 37 -3.733 -0.193 15.076 1.00 75.52 H new ATOM 0 HB3 TRP A 37 -3.403 1.527 15.127 1.00 75.52 H new ATOM 0 HD1 TRP A 37 -1.294 2.343 16.609 1.00 3.13 H new ATOM 0 HE1 TRP A 37 0.758 1.116 17.590 1.00 1.54 H new ATOM 0 HE3 TRP A 37 -2.954 -2.456 16.063 1.00 42.12 H new ATOM 0 HZ2 TRP A 37 1.530 -1.545 18.038 1.00 11.45 H new ATOM 0 HZ3 TRP A 37 -1.488 -4.299 16.786 1.00 20.35 H new ATOM 0 HH2 TRP A 37 0.719 -3.846 17.767 1.00 21.32 H new ATOM 590 N GLY A 38 -6.784 0.661 15.987 1.00 74.12 N ATOM 591 CA GLY A 38 -8.044 1.197 15.541 1.00 52.24 C ATOM 592 C GLY A 38 -9.113 0.135 15.509 1.00 71.54 C ATOM 593 O GLY A 38 -8.806 -1.054 15.426 1.00 54.10 O ATOM 0 H GLY A 38 -6.757 -0.355 16.074 1.00 74.12 H new ATOM 0 HA2 GLY A 38 -8.352 2.006 16.204 1.00 52.24 H new ATOM 0 HA3 GLY A 38 -7.927 1.627 14.546 1.00 52.24 H new ATOM 597 N THR A 39 -10.363 0.560 15.584 1.00 24.03 N ATOM 598 CA THR A 39 -11.481 -0.363 15.600 1.00 32.12 C ATOM 599 C THR A 39 -11.623 -1.078 14.261 1.00 4.52 C ATOM 600 O THR A 39 -11.771 -0.444 13.220 1.00 2.20 O ATOM 601 CB THR A 39 -12.784 0.375 15.953 1.00 1.53 C ATOM 602 OG1 THR A 39 -12.676 0.923 17.276 1.00 70.35 O ATOM 603 CG2 THR A 39 -13.984 -0.554 15.869 1.00 25.24 C ATOM 0 H THR A 39 -10.628 1.544 15.635 1.00 24.03 H new ATOM 0 HA THR A 39 -11.285 -1.114 16.365 1.00 32.12 H new ATOM 0 HB THR A 39 -12.934 1.178 15.232 1.00 1.53 H new ATOM 0 HG1 THR A 39 -13.504 1.395 17.503 1.00 70.35 H new ATOM 0 HG21 THR A 39 -14.889 -0.003 16.124 1.00 25.24 H new ATOM 0 HG22 THR A 39 -14.071 -0.945 14.855 1.00 25.24 H new ATOM 0 HG23 THR A 39 -13.854 -1.381 16.567 1.00 25.24 H new ATOM 611 N LEU A 40 -11.529 -2.397 14.296 1.00 22.10 N ATOM 612 CA LEU A 40 -11.704 -3.204 13.103 1.00 60.34 C ATOM 613 C LEU A 40 -13.180 -3.481 12.848 1.00 13.30 C ATOM 614 O LEU A 40 -13.975 -3.618 13.777 1.00 52.02 O ATOM 615 CB LEU A 40 -10.926 -4.522 13.210 1.00 42.41 C ATOM 616 CG LEU A 40 -9.397 -4.390 13.233 1.00 12.31 C ATOM 617 CD1 LEU A 40 -8.740 -5.754 13.198 1.00 1.24 C ATOM 618 CD2 LEU A 40 -8.902 -3.561 12.068 1.00 74.30 C ATOM 0 H LEU A 40 -11.332 -2.932 15.142 1.00 22.10 H new ATOM 0 HA LEU A 40 -11.307 -2.640 12.259 1.00 60.34 H new ATOM 0 HB2 LEU A 40 -11.242 -5.037 14.117 1.00 42.41 H new ATOM 0 HB3 LEU A 40 -11.205 -5.157 12.369 1.00 42.41 H new ATOM 0 HG LEU A 40 -9.127 -3.886 14.161 1.00 12.31 H new ATOM 0 HD11 LEU A 40 -7.656 -5.636 13.215 1.00 1.24 H new ATOM 0 HD12 LEU A 40 -9.056 -6.332 14.066 1.00 1.24 H new ATOM 0 HD13 LEU A 40 -9.034 -6.276 12.288 1.00 1.24 H new ATOM 0 HD21 LEU A 40 -7.815 -3.485 12.111 1.00 74.30 H new ATOM 0 HD22 LEU A 40 -9.196 -4.037 11.132 1.00 74.30 H new ATOM 0 HD23 LEU A 40 -9.338 -2.563 12.120 1.00 74.30 H new ATOM 630 N THR A 41 -13.531 -3.537 11.579 1.00 3.01 N ATOM 631 CA THR A 41 -14.882 -3.847 11.161 1.00 21.12 C ATOM 632 C THR A 41 -14.934 -5.239 10.540 1.00 12.31 C ATOM 633 O THR A 41 -15.985 -5.876 10.504 1.00 5.24 O ATOM 634 CB THR A 41 -15.403 -2.805 10.151 1.00 35.33 C ATOM 635 OG1 THR A 41 -14.439 -2.608 9.107 1.00 33.34 O ATOM 636 CG2 THR A 41 -15.688 -1.478 10.836 1.00 61.42 C ATOM 0 H THR A 41 -12.886 -3.368 10.807 1.00 3.01 H new ATOM 0 HA THR A 41 -15.522 -3.821 12.043 1.00 21.12 H new ATOM 0 HB THR A 41 -16.332 -3.183 9.724 1.00 35.33 H new ATOM 0 HG1 THR A 41 -13.966 -1.763 9.254 1.00 33.34 H new ATOM 0 HG21 THR A 41 -16.054 -0.761 10.102 1.00 61.42 H new ATOM 0 HG22 THR A 41 -16.442 -1.622 11.610 1.00 61.42 H new ATOM 0 HG23 THR A 41 -14.772 -1.098 11.289 1.00 61.42 H new ATOM 644 N ASP A 42 -13.785 -5.708 10.056 1.00 3.24 N ATOM 645 CA ASP A 42 -13.690 -7.033 9.451 1.00 51.13 C ATOM 646 C ASP A 42 -12.270 -7.570 9.557 1.00 53.20 C ATOM 647 O ASP A 42 -11.328 -6.802 9.732 1.00 63.11 O ATOM 648 CB ASP A 42 -14.104 -6.989 7.977 1.00 12.12 C ATOM 649 CG ASP A 42 -14.444 -8.364 7.432 1.00 12.24 C ATOM 650 OD1 ASP A 42 -15.534 -8.885 7.758 1.00 4.05 O ATOM 651 OD2 ASP A 42 -13.622 -8.934 6.688 1.00 1.21 O ATOM 0 H ASP A 42 -12.907 -5.189 10.072 1.00 3.24 H new ATOM 0 HA ASP A 42 -14.367 -7.694 9.993 1.00 51.13 H new ATOM 0 HB2 ASP A 42 -14.967 -6.332 7.864 1.00 12.12 H new ATOM 0 HB3 ASP A 42 -13.295 -6.557 7.388 1.00 12.12 H new ATOM 656 N CYS A 43 -12.131 -8.887 9.484 1.00 60.04 N ATOM 657 CA CYS A 43 -10.830 -9.534 9.424 1.00 13.41 C ATOM 658 C CYS A 43 -11.000 -10.968 8.945 1.00 22.13 C ATOM 659 O CYS A 43 -11.931 -11.658 9.367 1.00 44.24 O ATOM 660 CB CYS A 43 -10.151 -9.518 10.800 1.00 62.15 C ATOM 661 SG CYS A 43 -8.637 -10.503 10.905 1.00 21.34 S ATOM 0 H CYS A 43 -12.918 -9.536 9.465 1.00 60.04 H new ATOM 0 HA CYS A 43 -10.197 -8.987 8.725 1.00 13.41 H new ATOM 0 HB2 CYS A 43 -9.917 -8.486 11.063 1.00 62.15 H new ATOM 0 HB3 CYS A 43 -10.859 -9.883 11.544 1.00 62.15 H new ATOM 0 HG CYS A 43 -8.683 -11.258 11.962 1.00 21.34 H new ATOM 667 N VAL A 44 -10.131 -11.403 8.045 1.00 22.21 N ATOM 668 CA VAL A 44 -10.136 -12.783 7.598 1.00 4.42 C ATOM 669 C VAL A 44 -8.730 -13.210 7.181 1.00 64.22 C ATOM 670 O VAL A 44 -8.066 -12.537 6.388 1.00 5.22 O ATOM 671 CB VAL A 44 -11.154 -13.013 6.442 1.00 62.12 C ATOM 672 CG1 VAL A 44 -10.903 -12.070 5.275 1.00 11.45 C ATOM 673 CG2 VAL A 44 -11.126 -14.462 5.972 1.00 51.03 C ATOM 0 H VAL A 44 -9.415 -10.819 7.612 1.00 22.21 H new ATOM 0 HA VAL A 44 -10.456 -13.403 8.435 1.00 4.42 H new ATOM 0 HB VAL A 44 -12.146 -12.795 6.837 1.00 62.12 H new ATOM 0 HG11 VAL A 44 -11.633 -12.261 4.489 1.00 11.45 H new ATOM 0 HG12 VAL A 44 -10.997 -11.038 5.614 1.00 11.45 H new ATOM 0 HG13 VAL A 44 -9.899 -12.234 4.885 1.00 11.45 H new ATOM 0 HG21 VAL A 44 -11.846 -14.597 5.164 1.00 51.03 H new ATOM 0 HG22 VAL A 44 -10.127 -14.709 5.613 1.00 51.03 H new ATOM 0 HG23 VAL A 44 -11.385 -15.119 6.802 1.00 51.03 H new ATOM 683 N VAL A 45 -8.260 -14.305 7.755 1.00 2.00 N ATOM 684 CA VAL A 45 -6.984 -14.869 7.364 1.00 13.22 C ATOM 685 C VAL A 45 -7.215 -15.861 6.232 1.00 15.22 C ATOM 686 O VAL A 45 -8.131 -16.686 6.297 1.00 62.45 O ATOM 687 CB VAL A 45 -6.255 -15.535 8.568 1.00 73.32 C ATOM 688 CG1 VAL A 45 -7.155 -16.521 9.287 1.00 40.42 C ATOM 689 CG2 VAL A 45 -4.966 -16.221 8.136 1.00 54.34 C ATOM 0 H VAL A 45 -8.744 -14.818 8.492 1.00 2.00 H new ATOM 0 HA VAL A 45 -6.330 -14.069 7.017 1.00 13.22 H new ATOM 0 HB VAL A 45 -5.999 -14.734 9.261 1.00 73.32 H new ATOM 0 HG11 VAL A 45 -6.613 -16.967 10.121 1.00 40.42 H new ATOM 0 HG12 VAL A 45 -8.037 -16.002 9.663 1.00 40.42 H new ATOM 0 HG13 VAL A 45 -7.463 -17.304 8.595 1.00 40.42 H new ATOM 0 HG21 VAL A 45 -4.486 -16.674 9.004 1.00 54.34 H new ATOM 0 HG22 VAL A 45 -5.194 -16.994 7.403 1.00 54.34 H new ATOM 0 HG23 VAL A 45 -4.294 -15.486 7.692 1.00 54.34 H new ATOM 699 N MET A 46 -6.421 -15.755 5.174 1.00 51.34 N ATOM 700 CA MET A 46 -6.606 -16.609 4.014 1.00 32.12 C ATOM 701 C MET A 46 -6.086 -17.994 4.293 1.00 73.32 C ATOM 702 O MET A 46 -4.888 -18.258 4.235 1.00 72.14 O ATOM 703 CB MET A 46 -5.929 -16.048 2.780 1.00 42.44 C ATOM 704 CG MET A 46 -6.479 -14.708 2.326 1.00 64.31 C ATOM 705 SD MET A 46 -7.904 -14.841 1.218 1.00 3.13 S ATOM 706 CE MET A 46 -9.194 -15.397 2.330 1.00 32.33 C ATOM 0 H MET A 46 -5.650 -15.092 5.097 1.00 51.34 H new ATOM 0 HA MET A 46 -7.677 -16.654 3.816 1.00 32.12 H new ATOM 0 HB2 MET A 46 -4.863 -15.942 2.980 1.00 42.44 H new ATOM 0 HB3 MET A 46 -6.031 -16.765 1.965 1.00 42.44 H new ATOM 0 HG2 MET A 46 -6.765 -14.127 3.203 1.00 64.31 H new ATOM 0 HG3 MET A 46 -5.688 -14.153 1.821 1.00 64.31 H new ATOM 0 HE1 MET A 46 -10.167 -15.105 1.934 1.00 32.33 H new ATOM 0 HE2 MET A 46 -9.151 -16.482 2.423 1.00 32.33 H new ATOM 0 HE3 MET A 46 -9.050 -14.942 3.310 1.00 32.33 H new ATOM 716 N ARG A 47 -7.000 -18.848 4.659 1.00 41.21 N ATOM 717 CA ARG A 47 -6.676 -20.207 4.988 1.00 22.44 C ATOM 718 C ARG A 47 -7.017 -21.146 3.857 1.00 12.53 C ATOM 719 O ARG A 47 -7.748 -20.794 2.929 1.00 31.22 O ATOM 720 CB ARG A 47 -7.388 -20.620 6.273 1.00 43.32 C ATOM 721 CG ARG A 47 -6.844 -19.897 7.488 1.00 33.21 C ATOM 722 CD ARG A 47 -7.480 -20.368 8.777 1.00 75.43 C ATOM 723 NE ARG A 47 -6.575 -20.162 9.906 1.00 60.41 N ATOM 724 CZ ARG A 47 -6.481 -20.974 10.954 1.00 31.34 C ATOM 725 NH1 ARG A 47 -7.245 -22.056 11.043 1.00 45.54 N ATOM 726 NH2 ARG A 47 -5.594 -20.714 11.903 1.00 71.13 N ATOM 0 H ARG A 47 -7.991 -18.621 4.738 1.00 41.21 H new ATOM 0 HA ARG A 47 -5.600 -20.270 5.148 1.00 22.44 H new ATOM 0 HB2 ARG A 47 -8.454 -20.414 6.177 1.00 43.32 H new ATOM 0 HB3 ARG A 47 -7.282 -21.696 6.415 1.00 43.32 H new ATOM 0 HG2 ARG A 47 -5.766 -20.047 7.543 1.00 33.21 H new ATOM 0 HG3 ARG A 47 -7.012 -18.826 7.374 1.00 33.21 H new ATOM 0 HD2 ARG A 47 -8.411 -19.827 8.948 1.00 75.43 H new ATOM 0 HD3 ARG A 47 -7.735 -21.425 8.697 1.00 75.43 H new ATOM 0 HE ARG A 47 -5.974 -19.338 9.888 1.00 60.41 H new ATOM 0 HH11 ARG A 47 -7.913 -22.271 10.302 1.00 45.54 H new ATOM 0 HH12 ARG A 47 -7.164 -22.672 11.852 1.00 45.54 H new ATOM 0 HH21 ARG A 47 -4.990 -19.896 11.826 1.00 71.13 H new ATOM 0 HH22 ARG A 47 -5.515 -21.332 12.711 1.00 71.13 H new ATOM 740 N ASP A 48 -6.451 -22.327 3.941 1.00 53.32 N ATOM 741 CA ASP A 48 -6.659 -23.364 2.961 1.00 12.51 C ATOM 742 C ASP A 48 -8.044 -23.970 3.122 1.00 34.53 C ATOM 743 O ASP A 48 -8.391 -24.430 4.198 1.00 21.11 O ATOM 744 CB ASP A 48 -5.592 -24.441 3.154 1.00 11.51 C ATOM 745 CG ASP A 48 -5.789 -25.647 2.262 1.00 72.04 C ATOM 746 OD1 ASP A 48 -6.061 -25.472 1.056 1.00 65.43 O ATOM 747 OD2 ASP A 48 -5.664 -26.777 2.769 1.00 44.22 O ATOM 0 H ASP A 48 -5.826 -22.597 4.701 1.00 53.32 H new ATOM 0 HA ASP A 48 -6.584 -22.942 1.959 1.00 12.51 H new ATOM 0 HB2 ASP A 48 -4.611 -24.009 2.958 1.00 11.51 H new ATOM 0 HB3 ASP A 48 -5.596 -24.764 4.195 1.00 11.51 H new ATOM 752 N PRO A 49 -8.860 -23.974 2.065 1.00 42.50 N ATOM 753 CA PRO A 49 -10.200 -24.570 2.117 1.00 75.21 C ATOM 754 C PRO A 49 -10.172 -26.079 2.388 1.00 33.25 C ATOM 755 O PRO A 49 -11.166 -26.650 2.835 1.00 3.32 O ATOM 756 CB PRO A 49 -10.781 -24.287 0.727 1.00 64.35 C ATOM 757 CG PRO A 49 -9.616 -23.962 -0.143 1.00 51.53 C ATOM 758 CD PRO A 49 -8.570 -23.369 0.755 1.00 2.11 C ATOM 0 HA PRO A 49 -10.789 -24.151 2.933 1.00 75.21 H new ATOM 0 HB2 PRO A 49 -11.323 -25.153 0.347 1.00 64.35 H new ATOM 0 HB3 PRO A 49 -11.487 -23.458 0.760 1.00 64.35 H new ATOM 0 HG2 PRO A 49 -9.240 -24.857 -0.639 1.00 51.53 H new ATOM 0 HG3 PRO A 49 -9.900 -23.259 -0.926 1.00 51.53 H new ATOM 0 HD2 PRO A 49 -7.564 -23.612 0.414 1.00 2.11 H new ATOM 0 HD3 PRO A 49 -8.641 -22.282 0.790 1.00 2.11 H new ATOM 766 N ASN A 50 -9.034 -26.717 2.132 1.00 74.13 N ATOM 767 CA ASN A 50 -8.926 -28.168 2.275 1.00 4.03 C ATOM 768 C ASN A 50 -8.638 -28.584 3.716 1.00 1.20 C ATOM 769 O ASN A 50 -9.396 -29.350 4.307 1.00 12.41 O ATOM 770 CB ASN A 50 -7.832 -28.724 1.363 1.00 50.44 C ATOM 771 CG ASN A 50 -8.170 -28.559 -0.099 1.00 42.44 C ATOM 772 OD1 ASN A 50 -8.774 -29.436 -0.716 1.00 54.03 O ATOM 773 ND2 ASN A 50 -7.786 -27.431 -0.658 1.00 2.21 N ATOM 0 H ASN A 50 -8.177 -26.257 1.826 1.00 74.13 H new ATOM 0 HA ASN A 50 -9.892 -28.583 1.985 1.00 4.03 H new ATOM 0 HB2 ASN A 50 -6.891 -28.217 1.576 1.00 50.44 H new ATOM 0 HB3 ASN A 50 -7.681 -29.781 1.582 1.00 50.44 H new ATOM 0 HD21 ASN A 50 -7.987 -27.255 -1.642 1.00 2.21 H new ATOM 0 HD22 ASN A 50 -7.288 -26.732 -0.107 1.00 2.21 H new ATOM 780 N THR A 51 -7.556 -28.062 4.280 1.00 23.30 N ATOM 781 CA THR A 51 -7.096 -28.482 5.604 1.00 24.35 C ATOM 782 C THR A 51 -7.344 -27.404 6.655 1.00 71.01 C ATOM 783 O THR A 51 -7.137 -27.625 7.849 1.00 62.03 O ATOM 784 CB THR A 51 -5.595 -28.828 5.567 1.00 63.42 C ATOM 785 OG1 THR A 51 -5.208 -29.151 4.222 1.00 11.41 O ATOM 786 CG2 THR A 51 -5.276 -30.004 6.480 1.00 53.54 C ATOM 0 H THR A 51 -6.977 -27.345 3.842 1.00 23.30 H new ATOM 0 HA THR A 51 -7.669 -29.367 5.880 1.00 24.35 H new ATOM 0 HB THR A 51 -5.038 -27.959 5.919 1.00 63.42 H new ATOM 0 HG1 THR A 51 -5.218 -28.338 3.675 1.00 11.41 H new ATOM 0 HG21 THR A 51 -4.209 -30.223 6.432 1.00 53.54 H new ATOM 0 HG22 THR A 51 -5.549 -29.753 7.505 1.00 53.54 H new ATOM 0 HG23 THR A 51 -5.841 -30.879 6.158 1.00 53.54 H new ATOM 794 N LYS A 52 -7.788 -26.240 6.185 1.00 5.42 N ATOM 795 CA LYS A 52 -8.175 -25.113 7.039 1.00 12.33 C ATOM 796 C LYS A 52 -6.988 -24.561 7.830 1.00 14.13 C ATOM 797 O LYS A 52 -7.128 -24.198 9.000 1.00 41.11 O ATOM 798 CB LYS A 52 -9.320 -25.503 7.987 1.00 74.44 C ATOM 799 CG LYS A 52 -10.559 -26.065 7.291 1.00 72.44 C ATOM 800 CD LYS A 52 -10.980 -25.222 6.094 1.00 54.20 C ATOM 801 CE LYS A 52 -12.446 -25.426 5.739 1.00 34.23 C ATOM 802 NZ LYS A 52 -12.725 -26.806 5.261 1.00 44.02 N ATOM 0 H LYS A 52 -7.891 -26.048 5.189 1.00 5.42 H new ATOM 0 HA LYS A 52 -8.528 -24.321 6.379 1.00 12.33 H new ATOM 0 HB2 LYS A 52 -8.951 -26.244 8.696 1.00 74.44 H new ATOM 0 HB3 LYS A 52 -9.611 -24.626 8.565 1.00 74.44 H new ATOM 0 HG2 LYS A 52 -10.358 -27.085 6.962 1.00 72.44 H new ATOM 0 HG3 LYS A 52 -11.382 -26.117 8.004 1.00 72.44 H new ATOM 0 HD2 LYS A 52 -10.803 -24.169 6.312 1.00 54.20 H new ATOM 0 HD3 LYS A 52 -10.360 -25.478 5.235 1.00 54.20 H new ATOM 0 HE2 LYS A 52 -13.062 -25.216 6.613 1.00 34.23 H new ATOM 0 HE3 LYS A 52 -12.733 -24.712 4.967 1.00 34.23 H new ATOM 0 HZ1 LYS A 52 -13.748 -26.922 5.112 1.00 44.02 H new ATOM 0 HZ2 LYS A 52 -12.224 -26.971 4.365 1.00 44.02 H new ATOM 0 HZ3 LYS A 52 -12.399 -27.492 5.971 1.00 44.02 H new ATOM 816 N ARG A 53 -5.824 -24.477 7.191 1.00 74.21 N ATOM 817 CA ARG A 53 -4.650 -23.892 7.836 1.00 63.23 C ATOM 818 C ARG A 53 -4.261 -22.613 7.113 1.00 22.32 C ATOM 819 O ARG A 53 -4.684 -22.394 5.985 1.00 43.45 O ATOM 820 CB ARG A 53 -3.466 -24.861 7.850 1.00 34.31 C ATOM 821 CG ARG A 53 -3.764 -26.221 8.468 1.00 42.44 C ATOM 822 CD ARG A 53 -4.349 -26.101 9.868 1.00 53.31 C ATOM 823 NE ARG A 53 -3.543 -25.247 10.746 1.00 21.24 N ATOM 824 CZ ARG A 53 -3.995 -24.717 11.880 1.00 4.44 C ATOM 825 NH1 ARG A 53 -5.240 -24.955 12.282 1.00 0.44 N ATOM 826 NH2 ARG A 53 -3.204 -23.942 12.608 1.00 4.54 N ATOM 0 H ARG A 53 -5.668 -24.803 6.237 1.00 74.21 H new ATOM 0 HA ARG A 53 -4.909 -23.673 8.872 1.00 63.23 H new ATOM 0 HB2 ARG A 53 -3.123 -25.010 6.826 1.00 34.31 H new ATOM 0 HB3 ARG A 53 -2.644 -24.401 8.398 1.00 34.31 H new ATOM 0 HG2 ARG A 53 -4.462 -26.763 7.830 1.00 42.44 H new ATOM 0 HG3 ARG A 53 -2.847 -26.809 8.509 1.00 42.44 H new ATOM 0 HD2 ARG A 53 -5.359 -25.697 9.802 1.00 53.31 H new ATOM 0 HD3 ARG A 53 -4.431 -27.094 10.309 1.00 53.31 H new ATOM 0 HE ARG A 53 -2.581 -25.048 10.472 1.00 21.24 H new ATOM 0 HH11 ARG A 53 -5.853 -25.546 11.720 1.00 0.44 H new ATOM 0 HH12 ARG A 53 -5.582 -24.547 13.152 1.00 0.44 H new ATOM 0 HH21 ARG A 53 -2.251 -23.753 12.299 1.00 4.54 H new ATOM 0 HH22 ARG A 53 -3.549 -23.535 13.477 1.00 4.54 H new ATOM 840 N SER A 54 -3.454 -21.780 7.749 1.00 72.34 N ATOM 841 CA SER A 54 -3.142 -20.462 7.207 1.00 52.50 C ATOM 842 C SER A 54 -2.213 -20.550 5.999 1.00 15.23 C ATOM 843 O SER A 54 -1.216 -21.271 6.014 1.00 3.41 O ATOM 844 CB SER A 54 -2.525 -19.585 8.298 1.00 24.10 C ATOM 845 OG SER A 54 -2.139 -18.315 7.801 1.00 20.33 O ATOM 0 H SER A 54 -3.002 -21.990 8.639 1.00 72.34 H new ATOM 0 HA SER A 54 -4.073 -20.010 6.865 1.00 52.50 H new ATOM 0 HB2 SER A 54 -3.243 -19.455 9.108 1.00 24.10 H new ATOM 0 HB3 SER A 54 -1.656 -20.089 8.720 1.00 24.10 H new ATOM 0 HG SER A 54 -1.267 -18.069 8.174 1.00 20.33 H new ATOM 851 N ARG A 55 -2.561 -19.805 4.952 1.00 34.33 N ATOM 852 CA ARG A 55 -1.737 -19.716 3.753 1.00 72.24 C ATOM 853 C ARG A 55 -0.614 -18.708 3.953 1.00 20.42 C ATOM 854 O ARG A 55 0.203 -18.486 3.057 1.00 62.31 O ATOM 855 CB ARG A 55 -2.581 -19.310 2.544 1.00 31.33 C ATOM 856 CG ARG A 55 -3.529 -20.391 2.065 1.00 74.24 C ATOM 857 CD ARG A 55 -4.545 -19.840 1.075 1.00 42.33 C ATOM 858 NE ARG A 55 -5.032 -20.880 0.169 1.00 72.43 N ATOM 859 CZ ARG A 55 -5.946 -20.685 -0.783 1.00 22.52 C ATOM 860 NH1 ARG A 55 -6.489 -19.489 -0.963 1.00 64.23 N ATOM 861 NH2 ARG A 55 -6.301 -21.690 -1.576 1.00 21.14 N ATOM 0 H ARG A 55 -3.416 -19.250 4.912 1.00 34.33 H new ATOM 0 HA ARG A 55 -1.306 -20.700 3.567 1.00 72.24 H new ATOM 0 HB2 ARG A 55 -3.158 -18.421 2.798 1.00 31.33 H new ATOM 0 HB3 ARG A 55 -1.916 -19.035 1.725 1.00 31.33 H new ATOM 0 HG2 ARG A 55 -2.960 -21.194 1.596 1.00 74.24 H new ATOM 0 HG3 ARG A 55 -4.049 -20.825 2.919 1.00 74.24 H new ATOM 0 HD2 ARG A 55 -5.385 -19.407 1.618 1.00 42.33 H new ATOM 0 HD3 ARG A 55 -4.091 -19.036 0.496 1.00 42.33 H new ATOM 0 HE ARG A 55 -4.646 -21.819 0.272 1.00 72.43 H new ATOM 0 HH11 ARG A 55 -6.209 -18.707 -0.371 1.00 64.23 H new ATOM 0 HH12 ARG A 55 -7.187 -19.351 -1.694 1.00 64.23 H new ATOM 0 HH21 ARG A 55 -5.875 -22.609 -1.456 1.00 21.14 H new ATOM 0 HH22 ARG A 55 -7.000 -21.543 -2.304 1.00 21.14 H new ATOM 875 N GLY A 56 -0.574 -18.101 5.132 1.00 21.51 N ATOM 876 CA GLY A 56 0.490 -17.177 5.451 1.00 12.14 C ATOM 877 C GLY A 56 0.166 -15.730 5.144 1.00 73.24 C ATOM 878 O GLY A 56 1.061 -14.890 5.155 1.00 12.21 O ATOM 0 H GLY A 56 -1.262 -18.234 5.873 1.00 21.51 H new ATOM 0 HA2 GLY A 56 0.730 -17.267 6.510 1.00 12.14 H new ATOM 0 HA3 GLY A 56 1.384 -17.463 4.897 1.00 12.14 H new ATOM 882 N PHE A 57 -1.094 -15.424 4.862 1.00 13.20 N ATOM 883 CA PHE A 57 -1.499 -14.046 4.622 1.00 33.42 C ATOM 884 C PHE A 57 -2.991 -13.869 4.898 1.00 4.21 C ATOM 885 O PHE A 57 -3.752 -14.836 4.872 1.00 61.45 O ATOM 886 CB PHE A 57 -1.151 -13.616 3.186 1.00 43.32 C ATOM 887 CG PHE A 57 -1.913 -14.330 2.094 1.00 24.55 C ATOM 888 CD1 PHE A 57 -1.583 -15.626 1.724 1.00 14.33 C ATOM 889 CD2 PHE A 57 -2.945 -13.694 1.421 1.00 22.45 C ATOM 890 CE1 PHE A 57 -2.269 -16.271 0.713 1.00 32.31 C ATOM 891 CE2 PHE A 57 -3.630 -14.333 0.405 1.00 60.24 C ATOM 892 CZ PHE A 57 -3.290 -15.623 0.052 1.00 34.21 C ATOM 0 H PHE A 57 -1.849 -16.107 4.794 1.00 13.20 H new ATOM 0 HA PHE A 57 -0.948 -13.403 5.308 1.00 33.42 H new ATOM 0 HB2 PHE A 57 -1.332 -12.545 3.091 1.00 43.32 H new ATOM 0 HB3 PHE A 57 -0.085 -13.775 3.025 1.00 43.32 H new ATOM 0 HD1 PHE A 57 -0.779 -16.137 2.233 1.00 14.33 H new ATOM 0 HD2 PHE A 57 -3.217 -12.685 1.695 1.00 22.45 H new ATOM 0 HE1 PHE A 57 -2.005 -17.282 0.441 1.00 32.31 H new ATOM 0 HE2 PHE A 57 -4.430 -13.824 -0.112 1.00 60.24 H new ATOM 0 HZ PHE A 57 -3.824 -16.124 -0.742 1.00 34.21 H new ATOM 902 N GLY A 58 -3.391 -12.637 5.189 1.00 34.33 N ATOM 903 CA GLY A 58 -4.780 -12.333 5.482 1.00 4.25 C ATOM 904 C GLY A 58 -5.080 -10.860 5.291 1.00 34.33 C ATOM 905 O GLY A 58 -4.289 -10.148 4.681 1.00 31.32 O ATOM 0 H GLY A 58 -2.767 -11.831 5.228 1.00 34.33 H new ATOM 0 HA2 GLY A 58 -5.427 -12.924 4.834 1.00 4.25 H new ATOM 0 HA3 GLY A 58 -5.008 -12.621 6.508 1.00 4.25 H new ATOM 909 N PHE A 59 -6.226 -10.403 5.788 1.00 52.23 N ATOM 910 CA PHE A 59 -6.603 -8.994 5.694 1.00 63.54 C ATOM 911 C PHE A 59 -7.308 -8.550 6.964 1.00 51.11 C ATOM 912 O PHE A 59 -8.001 -9.338 7.612 1.00 53.41 O ATOM 913 CB PHE A 59 -7.553 -8.720 4.514 1.00 52.15 C ATOM 914 CG PHE A 59 -7.334 -9.575 3.301 1.00 41.23 C ATOM 915 CD1 PHE A 59 -6.461 -9.186 2.296 1.00 53.12 C ATOM 916 CD2 PHE A 59 -8.009 -10.769 3.169 1.00 40.32 C ATOM 917 CE1 PHE A 59 -6.268 -9.984 1.184 1.00 24.12 C ATOM 918 CE2 PHE A 59 -7.824 -11.569 2.069 1.00 24.03 C ATOM 919 CZ PHE A 59 -6.951 -11.180 1.071 1.00 75.53 C ATOM 0 H PHE A 59 -6.913 -10.990 6.262 1.00 52.23 H new ATOM 0 HA PHE A 59 -5.677 -8.439 5.543 1.00 63.54 H new ATOM 0 HB2 PHE A 59 -8.579 -8.859 4.855 1.00 52.15 H new ATOM 0 HB3 PHE A 59 -7.453 -7.674 4.224 1.00 52.15 H new ATOM 0 HD1 PHE A 59 -5.927 -8.251 2.383 1.00 53.12 H new ATOM 0 HD2 PHE A 59 -8.694 -11.080 3.943 1.00 40.32 H new ATOM 0 HE1 PHE A 59 -5.586 -9.674 0.406 1.00 24.12 H new ATOM 0 HE2 PHE A 59 -8.361 -12.502 1.984 1.00 24.03 H new ATOM 0 HZ PHE A 59 -6.803 -11.809 0.205 1.00 75.53 H new ATOM 929 N VAL A 60 -7.137 -7.283 7.300 1.00 23.32 N ATOM 930 CA VAL A 60 -7.872 -6.664 8.394 1.00 52.55 C ATOM 931 C VAL A 60 -8.520 -5.377 7.901 1.00 13.50 C ATOM 932 O VAL A 60 -7.874 -4.554 7.260 1.00 24.44 O ATOM 933 CB VAL A 60 -6.973 -6.352 9.621 1.00 43.04 C ATOM 934 CG1 VAL A 60 -6.602 -7.621 10.368 1.00 72.14 C ATOM 935 CG2 VAL A 60 -5.717 -5.614 9.201 1.00 73.02 C ATOM 0 H VAL A 60 -6.488 -6.655 6.826 1.00 23.32 H new ATOM 0 HA VAL A 60 -8.628 -7.377 8.721 1.00 52.55 H new ATOM 0 HB VAL A 60 -7.548 -5.712 10.291 1.00 43.04 H new ATOM 0 HG11 VAL A 60 -5.972 -7.370 11.222 1.00 72.14 H new ATOM 0 HG12 VAL A 60 -7.508 -8.115 10.718 1.00 72.14 H new ATOM 0 HG13 VAL A 60 -6.059 -8.290 9.701 1.00 72.14 H new ATOM 0 HG21 VAL A 60 -5.105 -5.408 10.079 1.00 73.02 H new ATOM 0 HG22 VAL A 60 -5.151 -6.228 8.501 1.00 73.02 H new ATOM 0 HG23 VAL A 60 -5.990 -4.675 8.721 1.00 73.02 H new ATOM 945 N THR A 61 -9.799 -5.217 8.163 1.00 74.44 N ATOM 946 CA THR A 61 -10.512 -4.029 7.731 1.00 64.23 C ATOM 947 C THR A 61 -10.797 -3.126 8.914 1.00 11.21 C ATOM 948 O THR A 61 -11.453 -3.536 9.869 1.00 31.15 O ATOM 949 CB THR A 61 -11.831 -4.392 7.031 1.00 21.32 C ATOM 950 OG1 THR A 61 -11.591 -5.456 6.109 1.00 70.44 O ATOM 951 CG2 THR A 61 -12.398 -3.195 6.284 1.00 34.34 C ATOM 0 H THR A 61 -10.368 -5.893 8.673 1.00 74.44 H new ATOM 0 HA THR A 61 -9.877 -3.504 7.018 1.00 64.23 H new ATOM 0 HB THR A 61 -12.555 -4.700 7.786 1.00 21.32 H new ATOM 0 HG1 THR A 61 -12.422 -5.673 5.636 1.00 70.44 H new ATOM 0 HG21 THR A 61 -13.331 -3.478 5.797 1.00 34.34 H new ATOM 0 HG22 THR A 61 -12.587 -2.384 6.987 1.00 34.34 H new ATOM 0 HG23 THR A 61 -11.683 -2.864 5.531 1.00 34.34 H new ATOM 959 N TYR A 62 -10.284 -1.910 8.855 1.00 63.14 N ATOM 960 CA TYR A 62 -10.500 -0.934 9.903 1.00 54.43 C ATOM 961 C TYR A 62 -11.821 -0.219 9.699 1.00 41.31 C ATOM 962 O TYR A 62 -12.468 -0.374 8.665 1.00 34.04 O ATOM 963 CB TYR A 62 -9.357 0.081 9.929 1.00 43.14 C ATOM 964 CG TYR A 62 -8.140 -0.393 10.690 1.00 21.35 C ATOM 965 CD1 TYR A 62 -8.017 -0.145 12.049 1.00 73.52 C ATOM 966 CD2 TYR A 62 -7.114 -1.082 10.057 1.00 54.53 C ATOM 967 CE1 TYR A 62 -6.910 -0.568 12.755 1.00 60.12 C ATOM 968 CE2 TYR A 62 -6.005 -1.509 10.760 1.00 43.01 C ATOM 969 CZ TYR A 62 -5.910 -1.248 12.108 1.00 20.41 C ATOM 970 OH TYR A 62 -4.810 -1.673 12.814 1.00 42.34 O ATOM 0 H TYR A 62 -9.709 -1.574 8.082 1.00 63.14 H new ATOM 0 HA TYR A 62 -10.529 -1.458 10.858 1.00 54.43 H new ATOM 0 HB2 TYR A 62 -9.066 0.313 8.905 1.00 43.14 H new ATOM 0 HB3 TYR A 62 -9.716 1.008 10.376 1.00 43.14 H new ATOM 0 HD1 TYR A 62 -8.802 0.389 12.564 1.00 73.52 H new ATOM 0 HD2 TYR A 62 -7.184 -1.287 8.999 1.00 54.53 H new ATOM 0 HE1 TYR A 62 -6.831 -0.365 13.813 1.00 60.12 H new ATOM 0 HE2 TYR A 62 -5.216 -2.045 10.254 1.00 43.01 H new ATOM 0 HH TYR A 62 -5.094 -2.020 13.685 1.00 42.34 H new ATOM 980 N ALA A 63 -12.229 0.531 10.707 1.00 12.12 N ATOM 981 CA ALA A 63 -13.404 1.368 10.608 1.00 65.23 C ATOM 982 C ALA A 63 -13.146 2.495 9.615 1.00 63.55 C ATOM 983 O ALA A 63 -13.856 2.642 8.630 1.00 20.45 O ATOM 984 CB ALA A 63 -13.771 1.925 11.978 1.00 54.35 C ATOM 0 H ALA A 63 -11.757 0.575 11.610 1.00 12.12 H new ATOM 0 HA ALA A 63 -14.243 0.772 10.250 1.00 65.23 H new ATOM 0 HB1 ALA A 63 -14.657 2.553 11.890 1.00 54.35 H new ATOM 0 HB2 ALA A 63 -13.977 1.102 12.662 1.00 54.35 H new ATOM 0 HB3 ALA A 63 -12.942 2.519 12.363 1.00 54.35 H new ATOM 990 N THR A 64 -12.086 3.244 9.870 1.00 70.22 N ATOM 991 CA THR A 64 -11.738 4.388 9.039 1.00 43.42 C ATOM 992 C THR A 64 -10.318 4.262 8.480 1.00 14.31 C ATOM 993 O THR A 64 -9.465 3.593 9.066 1.00 5.45 O ATOM 994 CB THR A 64 -11.894 5.703 9.843 1.00 13.23 C ATOM 995 OG1 THR A 64 -13.211 5.765 10.399 1.00 72.20 O ATOM 996 CG2 THR A 64 -11.674 6.931 8.972 1.00 65.43 C ATOM 0 H THR A 64 -11.448 3.080 10.649 1.00 70.22 H new ATOM 0 HA THR A 64 -12.424 4.410 8.193 1.00 43.42 H new ATOM 0 HB THR A 64 -11.139 5.701 10.629 1.00 13.23 H new ATOM 0 HG1 THR A 64 -13.312 6.595 10.910 1.00 72.20 H new ATOM 0 HG21 THR A 64 -11.793 7.831 9.575 1.00 65.43 H new ATOM 0 HG22 THR A 64 -10.668 6.905 8.554 1.00 65.43 H new ATOM 0 HG23 THR A 64 -12.404 6.938 8.162 1.00 65.43 H new ATOM 1004 N VAL A 65 -10.089 4.897 7.326 1.00 45.20 N ATOM 1005 CA VAL A 65 -8.776 4.931 6.687 1.00 1.53 C ATOM 1006 C VAL A 65 -7.716 5.542 7.622 1.00 55.32 C ATOM 1007 O VAL A 65 -6.569 5.104 7.635 1.00 70.53 O ATOM 1008 CB VAL A 65 -8.840 5.710 5.344 1.00 63.51 C ATOM 1009 CG1 VAL A 65 -9.437 7.100 5.532 1.00 10.42 C ATOM 1010 CG2 VAL A 65 -7.469 5.800 4.690 1.00 10.34 C ATOM 0 H VAL A 65 -10.811 5.401 6.811 1.00 45.20 H new ATOM 0 HA VAL A 65 -8.480 3.903 6.475 1.00 1.53 H new ATOM 0 HB VAL A 65 -9.497 5.150 4.679 1.00 63.51 H new ATOM 0 HG11 VAL A 65 -9.466 7.616 4.572 1.00 10.42 H new ATOM 0 HG12 VAL A 65 -10.449 7.011 5.927 1.00 10.42 H new ATOM 0 HG13 VAL A 65 -8.823 7.668 6.231 1.00 10.42 H new ATOM 0 HG21 VAL A 65 -7.548 6.351 3.753 1.00 10.34 H new ATOM 0 HG22 VAL A 65 -6.781 6.318 5.358 1.00 10.34 H new ATOM 0 HG23 VAL A 65 -7.095 4.796 4.490 1.00 10.34 H new ATOM 1020 N GLU A 66 -8.095 6.570 8.378 1.00 12.34 N ATOM 1021 CA GLU A 66 -7.241 7.139 9.422 1.00 44.41 C ATOM 1022 C GLU A 66 -6.721 6.090 10.410 1.00 73.34 C ATOM 1023 O GLU A 66 -5.551 6.133 10.797 1.00 2.41 O ATOM 1024 CB GLU A 66 -8.018 8.215 10.168 1.00 50.20 C ATOM 1025 CG GLU A 66 -8.565 9.293 9.255 1.00 64.34 C ATOM 1026 CD GLU A 66 -7.470 10.131 8.631 1.00 63.30 C ATOM 1027 OE1 GLU A 66 -6.813 9.655 7.683 1.00 43.01 O ATOM 1028 OE2 GLU A 66 -7.257 11.271 9.087 1.00 34.21 O ATOM 0 H GLU A 66 -9.000 7.032 8.286 1.00 12.34 H new ATOM 0 HA GLU A 66 -6.365 7.565 8.932 1.00 44.41 H new ATOM 0 HB2 GLU A 66 -8.844 7.751 10.707 1.00 50.20 H new ATOM 0 HB3 GLU A 66 -7.368 8.674 10.913 1.00 50.20 H new ATOM 0 HG2 GLU A 66 -9.159 8.831 8.467 1.00 64.34 H new ATOM 0 HG3 GLU A 66 -9.235 9.939 9.821 1.00 64.34 H new ATOM 1035 N GLU A 67 -7.589 5.160 10.812 1.00 13.35 N ATOM 1036 CA GLU A 67 -7.190 4.058 11.698 1.00 52.25 C ATOM 1037 C GLU A 67 -6.139 3.185 11.020 1.00 41.25 C ATOM 1038 O GLU A 67 -5.265 2.612 11.671 1.00 72.02 O ATOM 1039 CB GLU A 67 -8.391 3.184 12.060 1.00 3.23 C ATOM 1040 CG GLU A 67 -9.556 3.920 12.694 1.00 43.01 C ATOM 1041 CD GLU A 67 -9.240 4.478 14.064 1.00 13.05 C ATOM 1042 OE1 GLU A 67 -8.626 5.558 14.147 1.00 70.12 O ATOM 1043 OE2 GLU A 67 -9.631 3.846 15.063 1.00 64.01 O ATOM 0 H GLU A 67 -8.572 5.145 10.540 1.00 13.35 H new ATOM 0 HA GLU A 67 -6.778 4.499 12.606 1.00 52.25 H new ATOM 0 HB2 GLU A 67 -8.744 2.687 11.157 1.00 3.23 H new ATOM 0 HB3 GLU A 67 -8.059 2.403 12.744 1.00 3.23 H new ATOM 0 HG2 GLU A 67 -9.860 4.736 12.039 1.00 43.01 H new ATOM 0 HG3 GLU A 67 -10.405 3.241 12.773 1.00 43.01 H new ATOM 1050 N VAL A 68 -6.238 3.108 9.699 1.00 20.33 N ATOM 1051 CA VAL A 68 -5.306 2.346 8.881 1.00 1.12 C ATOM 1052 C VAL A 68 -3.928 2.994 8.876 1.00 23.14 C ATOM 1053 O VAL A 68 -2.923 2.317 9.060 1.00 43.23 O ATOM 1054 CB VAL A 68 -5.825 2.235 7.433 1.00 43.33 C ATOM 1055 CG1 VAL A 68 -4.742 1.775 6.474 1.00 5.13 C ATOM 1056 CG2 VAL A 68 -7.003 1.297 7.381 1.00 62.42 C ATOM 0 H VAL A 68 -6.970 3.575 9.164 1.00 20.33 H new ATOM 0 HA VAL A 68 -5.224 1.349 9.313 1.00 1.12 H new ATOM 0 HB VAL A 68 -6.138 3.230 7.115 1.00 43.33 H new ATOM 0 HG11 VAL A 68 -5.152 1.711 5.466 1.00 5.13 H new ATOM 0 HG12 VAL A 68 -3.918 2.489 6.486 1.00 5.13 H new ATOM 0 HG13 VAL A 68 -4.377 0.795 6.780 1.00 5.13 H new ATOM 0 HG21 VAL A 68 -7.364 1.223 6.355 1.00 62.42 H new ATOM 0 HG22 VAL A 68 -6.698 0.310 7.730 1.00 62.42 H new ATOM 0 HG23 VAL A 68 -7.800 1.678 8.020 1.00 62.42 H new ATOM 1066 N ASP A 69 -3.898 4.305 8.660 1.00 43.13 N ATOM 1067 CA ASP A 69 -2.649 5.067 8.633 1.00 70.50 C ATOM 1068 C ASP A 69 -1.863 4.871 9.929 1.00 14.42 C ATOM 1069 O ASP A 69 -0.659 4.610 9.899 1.00 62.43 O ATOM 1070 CB ASP A 69 -2.946 6.552 8.415 1.00 63.32 C ATOM 1071 CG ASP A 69 -1.702 7.359 8.099 1.00 1.54 C ATOM 1072 OD1 ASP A 69 -1.342 7.466 6.910 1.00 11.21 O ATOM 1073 OD2 ASP A 69 -1.096 7.912 9.039 1.00 3.24 O ATOM 0 H ASP A 69 -4.732 4.869 8.499 1.00 43.13 H new ATOM 0 HA ASP A 69 -2.040 4.700 7.807 1.00 70.50 H new ATOM 0 HB2 ASP A 69 -3.660 6.659 7.599 1.00 63.32 H new ATOM 0 HB3 ASP A 69 -3.420 6.958 9.309 1.00 63.32 H new ATOM 1078 N ALA A 70 -2.555 5.015 11.062 1.00 13.31 N ATOM 1079 CA ALA A 70 -1.985 4.715 12.381 1.00 0.54 C ATOM 1080 C ALA A 70 -1.375 3.312 12.454 1.00 2.01 C ATOM 1081 O ALA A 70 -0.320 3.128 13.051 1.00 22.33 O ATOM 1082 CB ALA A 70 -3.047 4.880 13.457 1.00 75.52 C ATOM 0 H ALA A 70 -3.521 5.341 11.093 1.00 13.31 H new ATOM 0 HA ALA A 70 -1.175 5.425 12.550 1.00 0.54 H new ATOM 0 HB1 ALA A 70 -2.615 4.655 14.432 1.00 75.52 H new ATOM 0 HB2 ALA A 70 -3.415 5.906 13.451 1.00 75.52 H new ATOM 0 HB3 ALA A 70 -3.873 4.197 13.260 1.00 75.52 H new ATOM 1088 N ALA A 71 -2.022 2.342 11.815 1.00 4.11 N ATOM 1089 CA ALA A 71 -1.537 0.964 11.821 1.00 20.11 C ATOM 1090 C ALA A 71 -0.316 0.819 10.917 1.00 51.44 C ATOM 1091 O ALA A 71 0.588 0.032 11.195 1.00 53.22 O ATOM 1092 CB ALA A 71 -2.630 0.012 11.374 1.00 45.15 C ATOM 0 H ALA A 71 -2.883 2.484 11.287 1.00 4.11 H new ATOM 0 HA ALA A 71 -1.248 0.711 12.841 1.00 20.11 H new ATOM 0 HB1 ALA A 71 -2.250 -1.009 11.385 1.00 45.15 H new ATOM 0 HB2 ALA A 71 -3.480 0.090 12.052 1.00 45.15 H new ATOM 0 HB3 ALA A 71 -2.947 0.270 10.364 1.00 45.15 H new ATOM 1098 N MET A 72 -0.302 1.591 9.837 1.00 4.34 N ATOM 1099 CA MET A 72 0.799 1.575 8.882 1.00 61.13 C ATOM 1100 C MET A 72 2.068 2.131 9.511 1.00 75.21 C ATOM 1101 O MET A 72 3.132 1.528 9.413 1.00 22.25 O ATOM 1102 CB MET A 72 0.438 2.386 7.635 1.00 53.34 C ATOM 1103 CG MET A 72 -0.776 1.857 6.882 1.00 55.15 C ATOM 1104 SD MET A 72 -0.360 0.751 5.517 1.00 23.01 S ATOM 1105 CE MET A 72 0.480 -0.570 6.366 1.00 2.33 C ATOM 0 H MET A 72 -1.050 2.243 9.599 1.00 4.34 H new ATOM 0 HA MET A 72 0.979 0.540 8.592 1.00 61.13 H new ATOM 0 HB2 MET A 72 0.249 3.419 7.928 1.00 53.34 H new ATOM 0 HB3 MET A 72 1.294 2.397 6.961 1.00 53.34 H new ATOM 0 HG2 MET A 72 -1.424 1.329 7.581 1.00 55.15 H new ATOM 0 HG3 MET A 72 -1.347 2.700 6.493 1.00 55.15 H new ATOM 0 HE1 MET A 72 0.463 -1.468 5.749 1.00 2.33 H new ATOM 0 HE2 MET A 72 1.513 -0.281 6.557 1.00 2.33 H new ATOM 0 HE3 MET A 72 -0.022 -0.771 7.313 1.00 2.33 H new ATOM 1115 N ASN A 73 1.937 3.270 10.183 1.00 51.23 N ATOM 1116 CA ASN A 73 3.071 3.903 10.849 1.00 3.52 C ATOM 1117 C ASN A 73 3.526 3.070 12.052 1.00 14.03 C ATOM 1118 O ASN A 73 4.700 3.081 12.415 1.00 21.20 O ATOM 1119 CB ASN A 73 2.714 5.348 11.258 1.00 52.30 C ATOM 1120 CG ASN A 73 2.713 5.594 12.762 1.00 23.33 C ATOM 1121 OD1 ASN A 73 3.749 5.891 13.354 1.00 53.30 O ATOM 1122 ND2 ASN A 73 1.546 5.496 13.382 1.00 14.23 N ATOM 0 H ASN A 73 1.056 3.775 10.281 1.00 51.23 H new ATOM 0 HA ASN A 73 3.907 3.951 10.151 1.00 3.52 H new ATOM 0 HB2 ASN A 73 3.424 6.031 10.791 1.00 52.30 H new ATOM 0 HB3 ASN A 73 1.728 5.592 10.861 1.00 52.30 H new ATOM 0 HD21 ASN A 73 1.485 5.669 14.385 1.00 14.23 H new ATOM 0 HD22 ASN A 73 0.708 5.247 12.856 1.00 14.23 H new ATOM 1129 N ALA A 74 2.588 2.331 12.639 1.00 61.35 N ATOM 1130 CA ALA A 74 2.865 1.488 13.803 1.00 23.30 C ATOM 1131 C ALA A 74 3.729 0.271 13.466 1.00 23.42 C ATOM 1132 O ALA A 74 4.131 -0.465 14.367 1.00 4.51 O ATOM 1133 CB ALA A 74 1.568 1.035 14.437 1.00 33.25 C ATOM 0 H ALA A 74 1.618 2.298 12.324 1.00 61.35 H new ATOM 0 HA ALA A 74 3.432 2.099 14.505 1.00 23.30 H new ATOM 0 HB1 ALA A 74 1.785 0.408 15.302 1.00 33.25 H new ATOM 0 HB2 ALA A 74 0.995 1.906 14.755 1.00 33.25 H new ATOM 0 HB3 ALA A 74 0.988 0.464 13.712 1.00 33.25 H new ATOM 1139 N ARG A 75 3.975 0.038 12.177 1.00 5.12 N ATOM 1140 CA ARG A 75 4.893 -1.015 11.746 1.00 64.10 C ATOM 1141 C ARG A 75 6.279 -0.823 12.367 1.00 34.30 C ATOM 1142 O ARG A 75 6.710 0.311 12.586 1.00 32.33 O ATOM 1143 CB ARG A 75 5.000 -1.037 10.219 1.00 71.55 C ATOM 1144 CG ARG A 75 3.853 -1.770 9.545 1.00 51.24 C ATOM 1145 CD ARG A 75 3.936 -1.700 8.026 1.00 43.22 C ATOM 1146 NE ARG A 75 5.276 -2.001 7.521 1.00 12.22 N ATOM 1147 CZ ARG A 75 5.537 -2.855 6.531 1.00 22.12 C ATOM 1148 NH1 ARG A 75 4.552 -3.510 5.925 1.00 23.33 N ATOM 1149 NH2 ARG A 75 6.787 -3.034 6.127 1.00 14.31 N ATOM 0 H ARG A 75 3.551 0.565 11.413 1.00 5.12 H new ATOM 0 HA ARG A 75 4.494 -1.970 12.087 1.00 64.10 H new ATOM 0 HB2 ARG A 75 5.034 -0.012 9.850 1.00 71.55 H new ATOM 0 HB3 ARG A 75 5.940 -1.509 9.935 1.00 71.55 H new ATOM 0 HG2 ARG A 75 3.857 -2.814 9.859 1.00 51.24 H new ATOM 0 HG3 ARG A 75 2.907 -1.341 9.875 1.00 51.24 H new ATOM 0 HD2 ARG A 75 3.223 -2.402 7.594 1.00 43.22 H new ATOM 0 HD3 ARG A 75 3.642 -0.704 7.695 1.00 43.22 H new ATOM 0 HE ARG A 75 6.065 -1.524 7.957 1.00 12.22 H new ATOM 0 HH11 ARG A 75 3.586 -3.361 6.216 1.00 23.33 H new ATOM 0 HH12 ARG A 75 4.762 -4.161 5.169 1.00 23.33 H new ATOM 0 HH21 ARG A 75 7.546 -2.519 6.573 1.00 14.31 H new ATOM 0 HH22 ARG A 75 6.990 -3.687 5.370 1.00 14.31 H new ATOM 1163 N PRO A 76 7.008 -1.923 12.648 1.00 64.12 N ATOM 1164 CA PRO A 76 6.588 -3.291 12.310 1.00 13.11 C ATOM 1165 C PRO A 76 5.567 -3.887 13.284 1.00 31.50 C ATOM 1166 O PRO A 76 5.345 -3.359 14.375 1.00 74.34 O ATOM 1167 CB PRO A 76 7.898 -4.072 12.379 1.00 35.43 C ATOM 1168 CG PRO A 76 8.716 -3.361 13.400 1.00 4.53 C ATOM 1169 CD PRO A 76 8.317 -1.908 13.333 1.00 62.01 C ATOM 0 HA PRO A 76 6.082 -3.322 11.345 1.00 13.11 H new ATOM 0 HB2 PRO A 76 7.725 -5.110 12.665 1.00 35.43 H new ATOM 0 HB3 PRO A 76 8.400 -4.087 11.412 1.00 35.43 H new ATOM 0 HG2 PRO A 76 8.534 -3.768 14.395 1.00 4.53 H new ATOM 0 HG3 PRO A 76 9.780 -3.481 13.197 1.00 4.53 H new ATOM 0 HD2 PRO A 76 8.241 -1.470 14.328 1.00 62.01 H new ATOM 0 HD3 PRO A 76 9.049 -1.319 12.780 1.00 62.01 H new ATOM 1177 N HIS A 77 4.948 -4.989 12.870 1.00 50.30 N ATOM 1178 CA HIS A 77 3.963 -5.684 13.698 1.00 20.03 C ATOM 1179 C HIS A 77 4.328 -7.150 13.862 1.00 5.31 C ATOM 1180 O HIS A 77 4.959 -7.747 12.987 1.00 32.22 O ATOM 1181 CB HIS A 77 2.558 -5.592 13.093 1.00 14.21 C ATOM 1182 CG HIS A 77 1.946 -4.231 13.156 1.00 53.24 C ATOM 1183 ND1 HIS A 77 1.079 -3.876 14.158 1.00 34.45 N ATOM 1184 CD2 HIS A 77 2.082 -3.199 12.305 1.00 44.04 C ATOM 1185 CE1 HIS A 77 0.710 -2.637 13.889 1.00 70.54 C ATOM 1186 NE2 HIS A 77 1.294 -2.185 12.774 1.00 13.41 N ATOM 0 H HIS A 77 5.111 -5.423 11.961 1.00 50.30 H new ATOM 0 HA HIS A 77 3.967 -5.194 14.672 1.00 20.03 H new ATOM 0 HB2 HIS A 77 2.603 -5.909 12.051 1.00 14.21 H new ATOM 0 HB3 HIS A 77 1.906 -6.295 13.612 1.00 14.21 H new ATOM 0 HD2 HIS A 77 2.698 -3.175 11.418 1.00 44.04 H new ATOM 0 HE1 HIS A 77 0.024 -2.062 14.493 1.00 70.54 H new ATOM 0 HE2 HIS A 77 1.175 -1.263 12.355 1.00 13.41 H new ATOM 1194 N LYS A 78 3.926 -7.724 14.985 1.00 72.53 N ATOM 1195 CA LYS A 78 4.138 -9.139 15.245 1.00 72.13 C ATOM 1196 C LYS A 78 2.936 -9.751 15.957 1.00 44.43 C ATOM 1197 O LYS A 78 2.644 -9.416 17.106 1.00 32.03 O ATOM 1198 CB LYS A 78 5.413 -9.357 16.069 1.00 72.22 C ATOM 1199 CG LYS A 78 5.542 -10.770 16.619 1.00 74.14 C ATOM 1200 CD LYS A 78 6.988 -11.148 16.874 1.00 71.45 C ATOM 1201 CE LYS A 78 7.662 -11.627 15.601 1.00 30.11 C ATOM 1202 NZ LYS A 78 9.112 -11.869 15.794 1.00 2.44 N ATOM 0 H LYS A 78 3.447 -7.227 15.736 1.00 72.53 H new ATOM 0 HA LYS A 78 4.257 -9.639 14.284 1.00 72.13 H new ATOM 0 HB2 LYS A 78 6.281 -9.136 15.447 1.00 72.22 H new ATOM 0 HB3 LYS A 78 5.426 -8.650 16.898 1.00 72.22 H new ATOM 0 HG2 LYS A 78 4.977 -10.851 17.547 1.00 74.14 H new ATOM 0 HG3 LYS A 78 5.101 -11.475 15.915 1.00 74.14 H new ATOM 0 HD2 LYS A 78 7.527 -10.288 17.273 1.00 71.45 H new ATOM 0 HD3 LYS A 78 7.034 -11.932 17.630 1.00 71.45 H new ATOM 0 HE2 LYS A 78 7.184 -12.546 15.262 1.00 30.11 H new ATOM 0 HE3 LYS A 78 7.520 -10.885 14.815 1.00 30.11 H new ATOM 0 HZ1 LYS A 78 9.532 -12.195 14.900 1.00 2.44 H new ATOM 0 HZ2 LYS A 78 9.575 -10.987 16.093 1.00 2.44 H new ATOM 0 HZ3 LYS A 78 9.248 -12.596 16.525 1.00 2.44 H new ATOM 1216 N VAL A 79 2.245 -10.642 15.263 1.00 15.25 N ATOM 1217 CA VAL A 79 1.105 -11.351 15.827 1.00 12.32 C ATOM 1218 C VAL A 79 1.258 -12.852 15.582 1.00 33.33 C ATOM 1219 O VAL A 79 1.819 -13.257 14.561 1.00 43.43 O ATOM 1220 CB VAL A 79 -0.236 -10.834 15.235 1.00 73.21 C ATOM 1221 CG1 VAL A 79 -0.250 -10.939 13.718 1.00 24.31 C ATOM 1222 CG2 VAL A 79 -1.424 -11.571 15.834 1.00 21.45 C ATOM 0 H VAL A 79 2.457 -10.894 14.297 1.00 15.25 H new ATOM 0 HA VAL A 79 1.082 -11.163 16.900 1.00 12.32 H new ATOM 0 HB VAL A 79 -0.322 -9.780 15.500 1.00 73.21 H new ATOM 0 HG11 VAL A 79 -1.202 -10.569 13.336 1.00 24.31 H new ATOM 0 HG12 VAL A 79 0.563 -10.342 13.304 1.00 24.31 H new ATOM 0 HG13 VAL A 79 -0.121 -11.981 13.424 1.00 24.31 H new ATOM 0 HG21 VAL A 79 -2.347 -11.187 15.400 1.00 21.45 H new ATOM 0 HG22 VAL A 79 -1.338 -12.636 15.619 1.00 21.45 H new ATOM 0 HG23 VAL A 79 -1.440 -11.419 16.913 1.00 21.45 H new ATOM 1232 N ASP A 80 0.810 -13.661 16.553 1.00 4.23 N ATOM 1233 CA ASP A 80 0.853 -15.130 16.466 1.00 72.22 C ATOM 1234 C ASP A 80 2.303 -15.629 16.491 1.00 61.25 C ATOM 1235 O ASP A 80 2.610 -16.743 16.062 1.00 51.31 O ATOM 1236 CB ASP A 80 0.111 -15.627 15.210 1.00 62.42 C ATOM 1237 CG ASP A 80 -0.264 -17.095 15.286 1.00 62.25 C ATOM 1238 OD1 ASP A 80 -0.958 -17.490 16.246 1.00 44.11 O ATOM 1239 OD2 ASP A 80 0.124 -17.859 14.381 1.00 23.13 O ATOM 0 H ASP A 80 0.406 -13.315 17.424 1.00 4.23 H new ATOM 0 HA ASP A 80 0.342 -15.542 17.336 1.00 72.22 H new ATOM 0 HB2 ASP A 80 -0.792 -15.034 15.070 1.00 62.42 H new ATOM 0 HB3 ASP A 80 0.739 -15.463 14.335 1.00 62.42 H new ATOM 1244 N GLY A 81 3.187 -14.789 17.028 1.00 45.41 N ATOM 1245 CA GLY A 81 4.596 -15.120 17.098 1.00 52.30 C ATOM 1246 C GLY A 81 5.275 -14.986 15.754 1.00 60.14 C ATOM 1247 O GLY A 81 6.311 -15.602 15.505 1.00 64.03 O ATOM 0 H GLY A 81 2.946 -13.878 17.418 1.00 45.41 H new ATOM 0 HA2 GLY A 81 5.087 -14.467 17.819 1.00 52.30 H new ATOM 0 HA3 GLY A 81 4.711 -16.141 17.463 1.00 52.30 H new ATOM 1251 N ARG A 82 4.686 -14.179 14.884 1.00 2.20 N ATOM 1252 CA ARG A 82 5.205 -13.997 13.544 1.00 20.32 C ATOM 1253 C ARG A 82 5.327 -12.518 13.216 1.00 4.54 C ATOM 1254 O ARG A 82 4.470 -11.722 13.591 1.00 0.13 O ATOM 1255 CB ARG A 82 4.281 -14.672 12.535 1.00 74.43 C ATOM 1256 CG ARG A 82 4.923 -14.890 11.180 1.00 71.24 C ATOM 1257 CD ARG A 82 5.860 -16.081 11.200 1.00 50.31 C ATOM 1258 NE ARG A 82 6.471 -16.325 9.898 1.00 32.34 N ATOM 1259 CZ ARG A 82 7.228 -17.384 9.618 1.00 74.13 C ATOM 1260 NH1 ARG A 82 7.469 -18.303 10.547 1.00 13.43 N ATOM 1261 NH2 ARG A 82 7.747 -17.525 8.406 1.00 22.32 N ATOM 0 H ARG A 82 3.845 -13.639 15.087 1.00 2.20 H new ATOM 0 HA ARG A 82 6.195 -14.451 13.490 1.00 20.32 H new ATOM 0 HB2 ARG A 82 3.960 -15.634 12.935 1.00 74.43 H new ATOM 0 HB3 ARG A 82 3.385 -14.063 12.410 1.00 74.43 H new ATOM 0 HG2 ARG A 82 4.148 -15.046 10.429 1.00 71.24 H new ATOM 0 HG3 ARG A 82 5.474 -13.996 10.888 1.00 71.24 H new ATOM 0 HD2 ARG A 82 6.642 -15.913 11.940 1.00 50.31 H new ATOM 0 HD3 ARG A 82 5.310 -16.968 11.513 1.00 50.31 H new ATOM 0 HE ARG A 82 6.308 -15.643 9.157 1.00 32.34 H new ATOM 0 HH11 ARG A 82 7.073 -18.200 11.481 1.00 13.43 H new ATOM 0 HH12 ARG A 82 8.050 -19.112 10.326 1.00 13.43 H new ATOM 0 HH21 ARG A 82 7.566 -16.822 7.689 1.00 22.32 H new ATOM 0 HH22 ARG A 82 8.327 -18.336 8.191 1.00 22.32 H new ATOM 1275 N VAL A 83 6.397 -12.158 12.522 1.00 1.12 N ATOM 1276 CA VAL A 83 6.582 -10.787 12.074 1.00 73.32 C ATOM 1277 C VAL A 83 5.795 -10.579 10.783 1.00 25.24 C ATOM 1278 O VAL A 83 6.071 -11.196 9.751 1.00 34.34 O ATOM 1279 CB VAL A 83 8.083 -10.419 11.890 1.00 25.42 C ATOM 1280 CG1 VAL A 83 8.793 -11.373 10.939 1.00 10.10 C ATOM 1281 CG2 VAL A 83 8.228 -8.977 11.419 1.00 72.43 C ATOM 0 H VAL A 83 7.148 -12.795 12.258 1.00 1.12 H new ATOM 0 HA VAL A 83 6.204 -10.116 12.846 1.00 73.32 H new ATOM 0 HB VAL A 83 8.564 -10.518 12.863 1.00 25.42 H new ATOM 0 HG11 VAL A 83 9.838 -11.078 10.841 1.00 10.10 H new ATOM 0 HG12 VAL A 83 8.738 -12.388 11.333 1.00 10.10 H new ATOM 0 HG13 VAL A 83 8.312 -11.337 9.961 1.00 10.10 H new ATOM 0 HG21 VAL A 83 9.285 -8.739 11.296 1.00 72.43 H new ATOM 0 HG22 VAL A 83 7.715 -8.852 10.466 1.00 72.43 H new ATOM 0 HG23 VAL A 83 7.789 -8.307 12.158 1.00 72.43 H new ATOM 1291 N VAL A 84 4.772 -9.749 10.860 1.00 24.34 N ATOM 1292 CA VAL A 84 3.857 -9.592 9.748 1.00 52.12 C ATOM 1293 C VAL A 84 4.051 -8.260 9.049 1.00 55.42 C ATOM 1294 O VAL A 84 4.539 -7.294 9.641 1.00 61.12 O ATOM 1295 CB VAL A 84 2.387 -9.736 10.202 1.00 75.21 C ATOM 1296 CG1 VAL A 84 2.224 -10.977 11.057 1.00 73.41 C ATOM 1297 CG2 VAL A 84 1.908 -8.499 10.952 1.00 14.54 C ATOM 0 H VAL A 84 4.555 -9.177 11.676 1.00 24.34 H new ATOM 0 HA VAL A 84 4.083 -10.389 9.040 1.00 52.12 H new ATOM 0 HB VAL A 84 1.768 -9.837 9.311 1.00 75.21 H new ATOM 0 HG11 VAL A 84 1.184 -11.068 11.371 1.00 73.41 H new ATOM 0 HG12 VAL A 84 2.507 -11.857 10.479 1.00 73.41 H new ATOM 0 HG13 VAL A 84 2.863 -10.900 11.936 1.00 73.41 H new ATOM 0 HG21 VAL A 84 0.870 -8.637 11.256 1.00 14.54 H new ATOM 0 HG22 VAL A 84 2.527 -8.347 11.836 1.00 14.54 H new ATOM 0 HG23 VAL A 84 1.983 -7.627 10.302 1.00 14.54 H new ATOM 1307 N GLU A 85 3.700 -8.236 7.781 1.00 52.31 N ATOM 1308 CA GLU A 85 3.759 -7.025 6.996 1.00 4.53 C ATOM 1309 C GLU A 85 2.374 -6.585 6.550 1.00 74.04 C ATOM 1310 O GLU A 85 1.834 -7.107 5.574 1.00 43.41 O ATOM 1311 CB GLU A 85 4.655 -7.213 5.776 1.00 43.04 C ATOM 1312 CG GLU A 85 5.925 -6.398 5.858 1.00 4.33 C ATOM 1313 CD GLU A 85 6.609 -6.235 4.526 1.00 63.14 C ATOM 1314 OE1 GLU A 85 7.271 -7.182 4.066 1.00 14.11 O ATOM 1315 OE2 GLU A 85 6.495 -5.142 3.934 1.00 75.41 O ATOM 0 H GLU A 85 3.367 -9.053 7.268 1.00 52.31 H new ATOM 0 HA GLU A 85 4.181 -6.247 7.632 1.00 4.53 H new ATOM 0 HB2 GLU A 85 4.910 -8.268 5.676 1.00 43.04 H new ATOM 0 HB3 GLU A 85 4.104 -6.932 4.878 1.00 43.04 H new ATOM 0 HG2 GLU A 85 5.692 -5.413 6.263 1.00 4.33 H new ATOM 0 HG3 GLU A 85 6.612 -6.876 6.556 1.00 4.33 H new ATOM 1322 N PRO A 86 1.767 -5.634 7.273 1.00 51.50 N ATOM 1323 CA PRO A 86 0.525 -5.018 6.844 1.00 44.05 C ATOM 1324 C PRO A 86 0.776 -4.030 5.715 1.00 14.43 C ATOM 1325 O PRO A 86 1.723 -3.241 5.765 1.00 31.45 O ATOM 1326 CB PRO A 86 0.007 -4.306 8.093 1.00 41.13 C ATOM 1327 CG PRO A 86 1.191 -4.101 8.972 1.00 44.04 C ATOM 1328 CD PRO A 86 2.242 -5.103 8.562 1.00 0.52 C ATOM 0 HA PRO A 86 -0.190 -5.743 6.455 1.00 44.05 H new ATOM 0 HB2 PRO A 86 -0.456 -3.354 7.835 1.00 41.13 H new ATOM 0 HB3 PRO A 86 -0.753 -4.904 8.596 1.00 41.13 H new ATOM 0 HG2 PRO A 86 1.571 -3.084 8.871 1.00 44.04 H new ATOM 0 HG3 PRO A 86 0.919 -4.238 10.019 1.00 44.04 H new ATOM 0 HD2 PRO A 86 3.220 -4.633 8.461 1.00 0.52 H new ATOM 0 HD3 PRO A 86 2.345 -5.895 9.303 1.00 0.52 H new ATOM 1336 N LYS A 87 -0.040 -4.129 4.682 1.00 53.32 N ATOM 1337 CA LYS A 87 0.033 -3.259 3.513 1.00 61.15 C ATOM 1338 C LYS A 87 -1.394 -2.919 3.116 1.00 24.24 C ATOM 1339 O LYS A 87 -2.310 -3.343 3.798 1.00 20.15 O ATOM 1340 CB LYS A 87 0.796 -3.956 2.372 1.00 13.23 C ATOM 1341 CG LYS A 87 2.130 -4.553 2.821 1.00 11.44 C ATOM 1342 CD LYS A 87 3.055 -4.871 1.664 1.00 14.22 C ATOM 1343 CE LYS A 87 3.964 -6.036 2.019 1.00 0.43 C ATOM 1344 NZ LYS A 87 4.770 -6.494 0.863 1.00 11.23 N ATOM 0 H LYS A 87 -0.784 -4.824 4.626 1.00 53.32 H new ATOM 0 HA LYS A 87 0.580 -2.343 3.736 1.00 61.15 H new ATOM 0 HB2 LYS A 87 0.172 -4.747 1.956 1.00 13.23 H new ATOM 0 HB3 LYS A 87 0.977 -3.238 1.572 1.00 13.23 H new ATOM 0 HG2 LYS A 87 2.626 -3.854 3.494 1.00 11.44 H new ATOM 0 HG3 LYS A 87 1.941 -5.464 3.389 1.00 11.44 H new ATOM 0 HD2 LYS A 87 2.469 -5.115 0.778 1.00 14.22 H new ATOM 0 HD3 LYS A 87 3.655 -3.995 1.418 1.00 14.22 H new ATOM 0 HE2 LYS A 87 4.630 -5.740 2.829 1.00 0.43 H new ATOM 0 HE3 LYS A 87 3.361 -6.865 2.389 1.00 0.43 H new ATOM 0 HZ1 LYS A 87 4.992 -7.504 0.973 1.00 11.23 H new ATOM 0 HZ2 LYS A 87 4.231 -6.351 -0.015 1.00 11.23 H new ATOM 0 HZ3 LYS A 87 5.654 -5.949 0.818 1.00 11.23 H new ATOM 1358 N ARG A 88 -1.616 -2.157 2.065 1.00 31.35 N ATOM 1359 CA ARG A 88 -2.988 -1.781 1.724 1.00 54.31 C ATOM 1360 C ARG A 88 -3.651 -2.828 0.842 1.00 62.41 C ATOM 1361 O ARG A 88 -3.003 -3.453 0.000 1.00 54.10 O ATOM 1362 CB ARG A 88 -3.030 -0.433 1.009 1.00 33.21 C ATOM 1363 CG ARG A 88 -4.428 0.163 0.872 1.00 44.43 C ATOM 1364 CD ARG A 88 -4.982 0.642 2.208 1.00 14.23 C ATOM 1365 NE ARG A 88 -4.541 2.004 2.539 1.00 2.13 N ATOM 1366 CZ ARG A 88 -3.407 2.297 3.189 1.00 65.21 C ATOM 1367 NH1 ARG A 88 -2.589 1.336 3.583 1.00 55.23 N ATOM 1368 NH2 ARG A 88 -3.098 3.558 3.450 1.00 1.21 N ATOM 0 H ARG A 88 -0.894 -1.791 1.444 1.00 31.35 H new ATOM 0 HA ARG A 88 -3.535 -1.709 2.664 1.00 54.31 H new ATOM 0 HB2 ARG A 88 -2.399 0.272 1.550 1.00 33.21 H new ATOM 0 HB3 ARG A 88 -2.598 -0.549 0.015 1.00 33.21 H new ATOM 0 HG2 ARG A 88 -4.398 0.998 0.172 1.00 44.43 H new ATOM 0 HG3 ARG A 88 -5.100 -0.584 0.449 1.00 44.43 H new ATOM 0 HD2 ARG A 88 -6.071 0.612 2.179 1.00 14.23 H new ATOM 0 HD3 ARG A 88 -4.666 -0.041 2.996 1.00 14.23 H new ATOM 0 HE ARG A 88 -5.139 2.779 2.254 1.00 2.13 H new ATOM 0 HH11 ARG A 88 -2.819 0.361 3.393 1.00 55.23 H new ATOM 0 HH12 ARG A 88 -1.728 1.570 4.077 1.00 55.23 H new ATOM 0 HH21 ARG A 88 -3.724 4.308 3.156 1.00 1.21 H new ATOM 0 HH22 ARG A 88 -2.234 3.779 3.945 1.00 1.21 H new ATOM 1382 N ALA A 89 -4.942 -3.045 1.063 1.00 33.00 N ATOM 1383 CA ALA A 89 -5.747 -3.778 0.108 1.00 43.14 C ATOM 1384 C ALA A 89 -6.069 -2.865 -1.067 1.00 41.22 C ATOM 1385 O ALA A 89 -7.044 -2.120 -1.044 1.00 50.04 O ATOM 1386 CB ALA A 89 -7.021 -4.293 0.758 1.00 13.20 C ATOM 0 H ALA A 89 -5.446 -2.725 1.890 1.00 33.00 H new ATOM 0 HA ALA A 89 -5.189 -4.644 -0.248 1.00 43.14 H new ATOM 0 HB1 ALA A 89 -7.610 -4.840 0.022 1.00 13.20 H new ATOM 0 HB2 ALA A 89 -6.765 -4.957 1.584 1.00 13.20 H new ATOM 0 HB3 ALA A 89 -7.603 -3.452 1.135 1.00 13.20 H new ATOM 1392 N VAL A 90 -5.216 -2.919 -2.076 1.00 72.21 N ATOM 1393 CA VAL A 90 -5.339 -2.072 -3.255 1.00 11.31 C ATOM 1394 C VAL A 90 -6.520 -2.526 -4.106 1.00 51.45 C ATOM 1395 O VAL A 90 -6.990 -3.659 -3.958 1.00 44.41 O ATOM 1396 CB VAL A 90 -4.040 -2.083 -4.103 1.00 14.23 C ATOM 1397 CG1 VAL A 90 -3.988 -0.880 -5.034 1.00 75.21 C ATOM 1398 CG2 VAL A 90 -2.806 -2.116 -3.212 1.00 31.43 C ATOM 0 H VAL A 90 -4.417 -3.552 -2.103 1.00 72.21 H new ATOM 0 HA VAL A 90 -5.509 -1.051 -2.914 1.00 11.31 H new ATOM 0 HB VAL A 90 -4.049 -2.988 -4.710 1.00 14.23 H new ATOM 0 HG11 VAL A 90 -3.068 -0.911 -5.617 1.00 75.21 H new ATOM 0 HG12 VAL A 90 -4.845 -0.903 -5.707 1.00 75.21 H new ATOM 0 HG13 VAL A 90 -4.014 0.037 -4.445 1.00 75.21 H new ATOM 0 HG21 VAL A 90 -1.910 -2.123 -3.832 1.00 31.43 H new ATOM 0 HG22 VAL A 90 -2.797 -1.235 -2.571 1.00 31.43 H new ATOM 0 HG23 VAL A 90 -2.827 -3.014 -2.594 1.00 31.43 H new ATOM 1408 N SER A 91 -7.009 -1.636 -4.968 1.00 73.10 N ATOM 1409 CA SER A 91 -8.123 -1.934 -5.863 1.00 24.31 C ATOM 1410 C SER A 91 -7.849 -3.200 -6.670 1.00 53.23 C ATOM 1411 O SER A 91 -6.695 -3.524 -6.958 1.00 11.24 O ATOM 1412 CB SER A 91 -8.348 -0.748 -6.805 1.00 15.52 C ATOM 1413 OG SER A 91 -7.111 -0.216 -7.257 1.00 53.53 O ATOM 0 H SER A 91 -6.643 -0.689 -5.065 1.00 73.10 H new ATOM 0 HA SER A 91 -9.019 -2.102 -5.265 1.00 24.31 H new ATOM 0 HB2 SER A 91 -8.945 -1.066 -7.660 1.00 15.52 H new ATOM 0 HB3 SER A 91 -8.915 0.027 -6.290 1.00 15.52 H new ATOM 0 HG SER A 91 -7.148 0.763 -7.234 1.00 53.53 H new ATOM 1419 N ARG A 92 -8.922 -3.904 -7.032 1.00 62.24 N ATOM 1420 CA ARG A 92 -8.823 -5.230 -7.646 1.00 43.13 C ATOM 1421 C ARG A 92 -8.048 -5.202 -8.961 1.00 1.34 C ATOM 1422 O ARG A 92 -7.500 -6.215 -9.380 1.00 11.20 O ATOM 1423 CB ARG A 92 -10.219 -5.820 -7.878 1.00 31.32 C ATOM 1424 CG ARG A 92 -10.787 -6.575 -6.681 1.00 14.02 C ATOM 1425 CD ARG A 92 -11.003 -5.676 -5.472 1.00 22.30 C ATOM 1426 NE ARG A 92 -11.593 -6.405 -4.352 1.00 65.23 N ATOM 1427 CZ ARG A 92 -12.073 -5.834 -3.243 1.00 44.41 C ATOM 1428 NH1 ARG A 92 -12.036 -4.514 -3.084 1.00 24.53 N ATOM 1429 NH2 ARG A 92 -12.600 -6.595 -2.296 1.00 65.23 N ATOM 0 H ARG A 92 -9.879 -3.574 -6.909 1.00 62.24 H new ATOM 0 HA ARG A 92 -8.271 -5.862 -6.950 1.00 43.13 H new ATOM 0 HB2 ARG A 92 -10.903 -5.013 -8.142 1.00 31.32 H new ATOM 0 HB3 ARG A 92 -10.178 -6.495 -8.733 1.00 31.32 H new ATOM 0 HG2 ARG A 92 -11.735 -7.034 -6.962 1.00 14.02 H new ATOM 0 HG3 ARG A 92 -10.109 -7.384 -6.411 1.00 14.02 H new ATOM 0 HD2 ARG A 92 -10.050 -5.246 -5.164 1.00 22.30 H new ATOM 0 HD3 ARG A 92 -11.653 -4.846 -5.748 1.00 22.30 H new ATOM 0 HE ARG A 92 -11.642 -7.421 -4.421 1.00 65.23 H new ATOM 0 HH11 ARG A 92 -11.638 -3.923 -3.814 1.00 24.53 H new ATOM 0 HH12 ARG A 92 -12.406 -4.092 -2.232 1.00 24.53 H new ATOM 0 HH21 ARG A 92 -12.637 -7.607 -2.417 1.00 65.23 H new ATOM 0 HH22 ARG A 92 -12.969 -6.169 -1.446 1.00 65.23 H new ATOM 1443 N GLU A 93 -8.008 -4.040 -9.599 1.00 62.15 N ATOM 1444 CA GLU A 93 -7.243 -3.846 -10.826 1.00 32.45 C ATOM 1445 C GLU A 93 -5.755 -4.070 -10.565 1.00 43.43 C ATOM 1446 O GLU A 93 -5.079 -4.770 -11.317 1.00 53.44 O ATOM 1447 CB GLU A 93 -7.460 -2.426 -11.376 1.00 15.44 C ATOM 1448 CG GLU A 93 -8.852 -2.165 -11.954 1.00 15.11 C ATOM 1449 CD GLU A 93 -9.962 -2.276 -10.926 1.00 41.32 C ATOM 1450 OE1 GLU A 93 -9.766 -1.829 -9.777 1.00 74.53 O ATOM 1451 OE2 GLU A 93 -11.027 -2.831 -11.259 1.00 23.24 O ATOM 0 H GLU A 93 -8.503 -3.206 -9.283 1.00 62.15 H new ATOM 0 HA GLU A 93 -7.591 -4.570 -11.563 1.00 32.45 H new ATOM 0 HB2 GLU A 93 -7.275 -1.710 -10.575 1.00 15.44 H new ATOM 0 HB3 GLU A 93 -6.719 -2.235 -12.152 1.00 15.44 H new ATOM 0 HG2 GLU A 93 -8.873 -1.168 -12.394 1.00 15.11 H new ATOM 0 HG3 GLU A 93 -9.041 -2.874 -12.760 1.00 15.11 H new ATOM 1458 N ASP A 94 -5.266 -3.487 -9.478 1.00 45.03 N ATOM 1459 CA ASP A 94 -3.855 -3.569 -9.125 1.00 44.52 C ATOM 1460 C ASP A 94 -3.551 -4.855 -8.354 1.00 63.54 C ATOM 1461 O ASP A 94 -2.661 -5.615 -8.735 1.00 1.51 O ATOM 1462 CB ASP A 94 -3.447 -2.346 -8.291 1.00 52.45 C ATOM 1463 CG ASP A 94 -1.948 -2.268 -8.048 1.00 42.11 C ATOM 1464 OD1 ASP A 94 -1.191 -2.173 -9.036 1.00 31.51 O ATOM 1465 OD2 ASP A 94 -1.522 -2.297 -6.875 1.00 52.31 O ATOM 0 H ASP A 94 -5.831 -2.948 -8.821 1.00 45.03 H new ATOM 0 HA ASP A 94 -3.276 -3.583 -10.049 1.00 44.52 H new ATOM 0 HB2 ASP A 94 -3.775 -1.440 -8.800 1.00 52.45 H new ATOM 0 HB3 ASP A 94 -3.964 -2.378 -7.332 1.00 52.45 H new ATOM 1470 N SER A 95 -4.336 -5.119 -7.309 1.00 45.43 N ATOM 1471 CA SER A 95 -4.031 -6.179 -6.341 1.00 32.31 C ATOM 1472 C SER A 95 -4.208 -7.592 -6.906 1.00 11.13 C ATOM 1473 O SER A 95 -3.825 -8.569 -6.264 1.00 21.34 O ATOM 1474 CB SER A 95 -4.897 -6.010 -5.091 1.00 31.24 C ATOM 1475 OG SER A 95 -6.274 -5.941 -5.426 1.00 22.34 O ATOM 0 H SER A 95 -5.196 -4.609 -7.108 1.00 45.43 H new ATOM 0 HA SER A 95 -2.976 -6.073 -6.090 1.00 32.31 H new ATOM 0 HB2 SER A 95 -4.727 -6.845 -4.412 1.00 31.24 H new ATOM 0 HB3 SER A 95 -4.603 -5.104 -4.562 1.00 31.24 H new ATOM 0 HG SER A 95 -6.682 -5.172 -4.976 1.00 22.34 H new ATOM 1481 N GLN A 96 -4.788 -7.712 -8.093 1.00 5.22 N ATOM 1482 CA GLN A 96 -4.980 -9.023 -8.710 1.00 72.01 C ATOM 1483 C GLN A 96 -3.778 -9.400 -9.570 1.00 2.43 C ATOM 1484 O GLN A 96 -3.728 -10.486 -10.146 1.00 10.42 O ATOM 1485 CB GLN A 96 -6.255 -9.041 -9.557 1.00 55.21 C ATOM 1486 CG GLN A 96 -7.383 -9.900 -8.988 1.00 43.54 C ATOM 1487 CD GLN A 96 -8.116 -9.277 -7.804 1.00 4.34 C ATOM 1488 OE1 GLN A 96 -9.314 -9.491 -7.627 1.00 34.42 O ATOM 1489 NE2 GLN A 96 -7.415 -8.525 -6.972 1.00 43.50 N ATOM 0 H GLN A 96 -5.132 -6.927 -8.646 1.00 5.22 H new ATOM 0 HA GLN A 96 -5.080 -9.757 -7.910 1.00 72.01 H new ATOM 0 HB2 GLN A 96 -6.616 -8.019 -9.669 1.00 55.21 H new ATOM 0 HB3 GLN A 96 -6.008 -9.403 -10.555 1.00 55.21 H new ATOM 0 HG2 GLN A 96 -8.104 -10.102 -9.780 1.00 43.54 H new ATOM 0 HG3 GLN A 96 -6.971 -10.861 -8.679 1.00 43.54 H new ATOM 0 HE21 GLN A 96 -6.422 -8.364 -7.143 1.00 43.50 H new ATOM 0 HE22 GLN A 96 -7.867 -8.106 -6.159 1.00 43.50 H new ATOM 1498 N ARG A 97 -2.813 -8.497 -9.657 1.00 74.12 N ATOM 1499 CA ARG A 97 -1.627 -8.725 -10.467 1.00 41.03 C ATOM 1500 C ARG A 97 -0.383 -8.752 -9.580 1.00 70.30 C ATOM 1501 O ARG A 97 -0.342 -8.079 -8.547 1.00 31.15 O ATOM 1502 CB ARG A 97 -1.492 -7.639 -11.542 1.00 14.33 C ATOM 1503 CG ARG A 97 -2.757 -7.410 -12.366 1.00 73.44 C ATOM 1504 CD ARG A 97 -3.271 -8.693 -13.011 1.00 14.20 C ATOM 1505 NE ARG A 97 -2.268 -9.332 -13.864 1.00 72.23 N ATOM 1506 CZ ARG A 97 -2.359 -10.587 -14.313 1.00 14.00 C ATOM 1507 NH1 ARG A 97 -3.405 -11.342 -13.994 1.00 14.10 N ATOM 1508 NH2 ARG A 97 -1.403 -11.087 -15.083 1.00 74.15 N ATOM 0 H ARG A 97 -2.829 -7.598 -9.175 1.00 74.12 H new ATOM 0 HA ARG A 97 -1.726 -9.690 -10.964 1.00 41.03 H new ATOM 0 HB2 ARG A 97 -1.211 -6.702 -11.062 1.00 14.33 H new ATOM 0 HB3 ARG A 97 -0.678 -7.909 -12.215 1.00 14.33 H new ATOM 0 HG2 ARG A 97 -3.534 -6.992 -11.726 1.00 73.44 H new ATOM 0 HG3 ARG A 97 -2.553 -6.673 -13.142 1.00 73.44 H new ATOM 0 HD2 ARG A 97 -3.578 -9.390 -12.231 1.00 14.20 H new ATOM 0 HD3 ARG A 97 -4.157 -8.468 -13.604 1.00 14.20 H new ATOM 0 HE ARG A 97 -1.449 -8.786 -14.132 1.00 72.23 H new ATOM 0 HH11 ARG A 97 -4.145 -10.964 -13.403 1.00 14.10 H new ATOM 0 HH12 ARG A 97 -3.468 -12.299 -14.341 1.00 14.10 H new ATOM 0 HH21 ARG A 97 -0.597 -10.514 -15.333 1.00 74.15 H new ATOM 0 HH22 ARG A 97 -1.473 -12.045 -15.426 1.00 74.15 H new ATOM 1522 N PRO A 98 0.636 -9.547 -9.961 1.00 23.04 N ATOM 1523 CA PRO A 98 1.885 -9.667 -9.192 1.00 33.23 C ATOM 1524 C PRO A 98 2.630 -8.338 -9.071 1.00 72.25 C ATOM 1525 O PRO A 98 2.717 -7.573 -10.032 1.00 2.10 O ATOM 1526 CB PRO A 98 2.716 -10.670 -10.000 1.00 3.22 C ATOM 1527 CG PRO A 98 2.110 -10.693 -11.359 1.00 51.13 C ATOM 1528 CD PRO A 98 0.651 -10.403 -11.162 1.00 43.42 C ATOM 0 HA PRO A 98 1.694 -9.981 -8.166 1.00 33.23 H new ATOM 0 HB2 PRO A 98 3.762 -10.367 -10.043 1.00 3.22 H new ATOM 0 HB3 PRO A 98 2.689 -11.659 -9.543 1.00 3.22 H new ATOM 0 HG2 PRO A 98 2.573 -9.948 -12.006 1.00 51.13 H new ATOM 0 HG3 PRO A 98 2.255 -11.663 -11.835 1.00 51.13 H new ATOM 0 HD2 PRO A 98 0.222 -9.894 -12.025 1.00 43.42 H new ATOM 0 HD3 PRO A 98 0.076 -11.317 -11.012 1.00 43.42 H new ATOM 1536 N GLY A 99 3.159 -8.067 -7.885 1.00 72.10 N ATOM 1537 CA GLY A 99 3.883 -6.828 -7.658 1.00 73.33 C ATOM 1538 C GLY A 99 3.071 -5.821 -6.867 1.00 75.01 C ATOM 1539 O GLY A 99 3.617 -4.857 -6.333 1.00 13.34 O ATOM 0 H GLY A 99 3.100 -8.683 -7.074 1.00 72.10 H new ATOM 0 HA2 GLY A 99 4.809 -7.044 -7.124 1.00 73.33 H new ATOM 0 HA3 GLY A 99 4.162 -6.392 -8.617 1.00 73.33 H new ATOM 1543 N ALA A 100 1.771 -6.061 -6.779 1.00 64.10 N ATOM 1544 CA ALA A 100 0.862 -5.156 -6.090 1.00 11.22 C ATOM 1545 C ALA A 100 1.017 -5.246 -4.583 1.00 65.10 C ATOM 1546 O ALA A 100 1.053 -4.235 -3.894 1.00 2.22 O ATOM 1547 CB ALA A 100 -0.568 -5.471 -6.462 1.00 32.42 C ATOM 0 H ALA A 100 1.319 -6.883 -7.180 1.00 64.10 H new ATOM 0 HA ALA A 100 1.113 -4.142 -6.402 1.00 11.22 H new ATOM 0 HB1 ALA A 100 -1.239 -4.788 -5.941 1.00 32.42 H new ATOM 0 HB2 ALA A 100 -0.698 -5.356 -7.538 1.00 32.42 H new ATOM 0 HB3 ALA A 100 -0.801 -6.497 -6.176 1.00 32.42 H new ATOM 1553 N HIS A 101 1.106 -6.459 -4.072 1.00 50.53 N ATOM 1554 CA HIS A 101 1.193 -6.660 -2.638 1.00 63.01 C ATOM 1555 C HIS A 101 2.636 -6.822 -2.188 1.00 32.41 C ATOM 1556 O HIS A 101 2.901 -7.225 -1.058 1.00 41.13 O ATOM 1557 CB HIS A 101 0.349 -7.858 -2.212 1.00 20.15 C ATOM 1558 CG HIS A 101 -1.112 -7.549 -2.099 1.00 4.32 C ATOM 1559 ND1 HIS A 101 -2.069 -8.468 -2.451 1.00 40.33 N ATOM 1560 CD2 HIS A 101 -1.722 -6.420 -1.659 1.00 52.23 C ATOM 1561 CE1 HIS A 101 -3.232 -7.884 -2.221 1.00 10.21 C ATOM 1562 NE2 HIS A 101 -3.074 -6.642 -1.740 1.00 44.41 N ATOM 0 H HIS A 101 1.120 -7.316 -4.625 1.00 50.53 H new ATOM 0 HA HIS A 101 0.796 -5.770 -2.150 1.00 63.01 H new ATOM 0 HB2 HIS A 101 0.487 -8.664 -2.932 1.00 20.15 H new ATOM 0 HB3 HIS A 101 0.710 -8.224 -1.251 1.00 20.15 H new ATOM 0 HD2 HIS A 101 -1.237 -5.520 -1.312 1.00 52.23 H new ATOM 0 HE1 HIS A 101 -4.190 -8.349 -2.398 1.00 10.21 H new ATOM 0 HE2 HIS A 101 -3.815 -5.989 -1.484 1.00 44.41 H new ATOM 1570 N LEU A 102 3.567 -6.485 -3.074 1.00 73.23 N ATOM 1571 CA LEU A 102 4.975 -6.449 -2.715 1.00 4.33 C ATOM 1572 C LEU A 102 5.282 -5.128 -2.028 1.00 42.10 C ATOM 1573 O LEU A 102 4.497 -4.184 -2.121 1.00 60.24 O ATOM 1574 CB LEU A 102 5.869 -6.608 -3.950 1.00 72.32 C ATOM 1575 CG LEU A 102 5.798 -7.962 -4.663 1.00 64.50 C ATOM 1576 CD1 LEU A 102 6.832 -8.022 -5.779 1.00 52.12 C ATOM 1577 CD2 LEU A 102 6.011 -9.108 -3.684 1.00 21.23 C ATOM 0 H LEU A 102 3.370 -6.234 -4.043 1.00 73.23 H new ATOM 0 HA LEU A 102 5.181 -7.280 -2.041 1.00 4.33 H new ATOM 0 HB2 LEU A 102 5.607 -5.829 -4.666 1.00 72.32 H new ATOM 0 HB3 LEU A 102 6.902 -6.431 -3.651 1.00 72.32 H new ATOM 0 HG LEU A 102 4.803 -8.067 -5.095 1.00 64.50 H new ATOM 0 HD11 LEU A 102 6.772 -8.989 -6.279 1.00 52.12 H new ATOM 0 HD12 LEU A 102 6.636 -7.228 -6.500 1.00 52.12 H new ATOM 0 HD13 LEU A 102 7.829 -7.892 -5.358 1.00 52.12 H new ATOM 0 HD21 LEU A 102 5.955 -10.057 -4.217 1.00 21.23 H new ATOM 0 HD22 LEU A 102 6.991 -9.011 -3.218 1.00 21.23 H new ATOM 0 HD23 LEU A 102 5.239 -9.078 -2.915 1.00 21.23 H new ATOM 1589 N THR A 103 6.404 -5.059 -1.328 1.00 64.34 N ATOM 1590 CA THR A 103 6.783 -3.838 -0.640 1.00 14.25 C ATOM 1591 C THR A 103 7.386 -2.847 -1.629 1.00 40.14 C ATOM 1592 O THR A 103 8.600 -2.796 -1.833 1.00 34.20 O ATOM 1593 CB THR A 103 7.774 -4.119 0.503 1.00 22.41 C ATOM 1594 OG1 THR A 103 7.389 -5.324 1.180 1.00 72.23 O ATOM 1595 CG2 THR A 103 7.792 -2.967 1.493 1.00 50.12 C ATOM 0 H THR A 103 7.063 -5.830 -1.223 1.00 64.34 H new ATOM 0 HA THR A 103 5.883 -3.406 -0.201 1.00 14.25 H new ATOM 0 HB THR A 103 8.773 -4.231 0.081 1.00 22.41 H new ATOM 0 HG1 THR A 103 7.113 -5.111 2.096 1.00 72.23 H new ATOM 0 HG21 THR A 103 8.499 -3.186 2.293 1.00 50.12 H new ATOM 0 HG22 THR A 103 8.094 -2.053 0.982 1.00 50.12 H new ATOM 0 HG23 THR A 103 6.796 -2.835 1.915 1.00 50.12 H new ATOM 1603 N VAL A 104 6.509 -2.091 -2.262 1.00 40.32 N ATOM 1604 CA VAL A 104 6.890 -1.159 -3.303 1.00 45.41 C ATOM 1605 C VAL A 104 6.722 0.263 -2.815 1.00 12.03 C ATOM 1606 O VAL A 104 5.607 0.685 -2.523 1.00 0.32 O ATOM 1607 CB VAL A 104 6.006 -1.356 -4.549 1.00 43.41 C ATOM 1608 CG1 VAL A 104 6.332 -0.324 -5.615 1.00 43.13 C ATOM 1609 CG2 VAL A 104 6.155 -2.764 -5.090 1.00 54.44 C ATOM 0 H VAL A 104 5.508 -2.107 -2.067 1.00 40.32 H new ATOM 0 HA VAL A 104 7.933 -1.345 -3.559 1.00 45.41 H new ATOM 0 HB VAL A 104 4.966 -1.213 -4.256 1.00 43.41 H new ATOM 0 HG11 VAL A 104 5.694 -0.485 -6.484 1.00 43.13 H new ATOM 0 HG12 VAL A 104 6.159 0.676 -5.218 1.00 43.13 H new ATOM 0 HG13 VAL A 104 7.377 -0.422 -5.909 1.00 43.13 H new ATOM 0 HG21 VAL A 104 5.523 -2.884 -5.970 1.00 54.44 H new ATOM 0 HG22 VAL A 104 7.195 -2.941 -5.363 1.00 54.44 H new ATOM 0 HG23 VAL A 104 5.854 -3.481 -4.326 1.00 54.44 H new ATOM 1619 N LYS A 105 7.814 1.004 -2.692 1.00 11.51 N ATOM 1620 CA LYS A 105 7.722 2.397 -2.300 1.00 2.14 C ATOM 1621 C LYS A 105 8.060 3.312 -3.476 1.00 3.52 C ATOM 1622 O LYS A 105 8.321 4.493 -3.299 1.00 21.50 O ATOM 1623 CB LYS A 105 8.668 2.658 -1.130 1.00 21.44 C ATOM 1624 CG LYS A 105 8.585 1.592 -0.051 1.00 2.44 C ATOM 1625 CD LYS A 105 9.511 1.894 1.106 1.00 54.01 C ATOM 1626 CE LYS A 105 9.387 0.851 2.203 1.00 14.21 C ATOM 1627 NZ LYS A 105 10.314 1.125 3.333 1.00 32.14 N ATOM 0 H LYS A 105 8.762 0.666 -2.856 1.00 11.51 H new ATOM 0 HA LYS A 105 6.699 2.613 -1.990 1.00 2.14 H new ATOM 0 HB2 LYS A 105 9.691 2.712 -1.502 1.00 21.44 H new ATOM 0 HB3 LYS A 105 8.437 3.629 -0.692 1.00 21.44 H new ATOM 0 HG2 LYS A 105 7.560 1.521 0.312 1.00 2.44 H new ATOM 0 HG3 LYS A 105 8.840 0.622 -0.478 1.00 2.44 H new ATOM 0 HD2 LYS A 105 10.541 1.929 0.750 1.00 54.01 H new ATOM 0 HD3 LYS A 105 9.280 2.879 1.511 1.00 54.01 H new ATOM 0 HE2 LYS A 105 8.361 0.831 2.571 1.00 14.21 H new ATOM 0 HE3 LYS A 105 9.597 -0.136 1.791 1.00 14.21 H new ATOM 0 HZ1 LYS A 105 10.012 0.585 4.169 1.00 32.14 H new ATOM 0 HZ2 LYS A 105 11.279 0.841 3.067 1.00 32.14 H new ATOM 0 HZ3 LYS A 105 10.301 2.141 3.554 1.00 32.14 H new ATOM 1641 N LYS A 106 8.056 2.754 -4.671 1.00 2.21 N ATOM 1642 CA LYS A 106 8.295 3.531 -5.881 1.00 34.30 C ATOM 1643 C LYS A 106 7.057 3.534 -6.767 1.00 12.41 C ATOM 1644 O LYS A 106 6.386 2.512 -6.899 1.00 24.33 O ATOM 1645 CB LYS A 106 9.485 2.950 -6.644 1.00 4.33 C ATOM 1646 CG LYS A 106 10.776 3.720 -6.438 1.00 61.33 C ATOM 1647 CD LYS A 106 10.823 4.968 -7.302 1.00 50.30 C ATOM 1648 CE LYS A 106 11.152 4.636 -8.747 1.00 65.22 C ATOM 1649 NZ LYS A 106 12.579 4.264 -8.924 1.00 20.04 N ATOM 0 H LYS A 106 7.889 1.761 -4.835 1.00 2.21 H new ATOM 0 HA LYS A 106 8.519 4.559 -5.598 1.00 34.30 H new ATOM 0 HB2 LYS A 106 9.635 1.916 -6.333 1.00 4.33 H new ATOM 0 HB3 LYS A 106 9.249 2.931 -7.708 1.00 4.33 H new ATOM 0 HG2 LYS A 106 10.871 3.999 -5.389 1.00 61.33 H new ATOM 0 HG3 LYS A 106 11.625 3.079 -6.676 1.00 61.33 H new ATOM 0 HD2 LYS A 106 9.862 5.480 -7.256 1.00 50.30 H new ATOM 0 HD3 LYS A 106 11.570 5.657 -6.907 1.00 50.30 H new ATOM 0 HE2 LYS A 106 10.519 3.814 -9.083 1.00 65.22 H new ATOM 0 HE3 LYS A 106 10.921 5.495 -9.377 1.00 65.22 H new ATOM 0 HZ1 LYS A 106 12.792 4.178 -9.938 1.00 20.04 H new ATOM 0 HZ2 LYS A 106 13.184 4.999 -8.504 1.00 20.04 H new ATOM 0 HZ3 LYS A 106 12.762 3.355 -8.453 1.00 20.04 H new ATOM 1663 N ILE A 107 6.736 4.677 -7.366 1.00 14.52 N ATOM 1664 CA ILE A 107 5.614 4.753 -8.297 1.00 22.55 C ATOM 1665 C ILE A 107 6.004 5.457 -9.589 1.00 73.43 C ATOM 1666 O ILE A 107 6.921 6.284 -9.622 1.00 1.02 O ATOM 1667 CB ILE A 107 4.385 5.465 -7.691 1.00 10.11 C ATOM 1668 CG1 ILE A 107 4.813 6.697 -6.908 1.00 32.13 C ATOM 1669 CG2 ILE A 107 3.596 4.511 -6.814 1.00 12.15 C ATOM 1670 CD1 ILE A 107 3.657 7.518 -6.393 1.00 13.53 C ATOM 0 H ILE A 107 7.232 5.557 -7.225 1.00 14.52 H new ATOM 0 HA ILE A 107 5.343 3.719 -8.512 1.00 22.55 H new ATOM 0 HB ILE A 107 3.737 5.790 -8.505 1.00 10.11 H new ATOM 0 HG12 ILE A 107 5.430 6.385 -6.065 1.00 32.13 H new ATOM 0 HG13 ILE A 107 5.437 7.323 -7.545 1.00 32.13 H new ATOM 0 HG21 ILE A 107 2.734 5.030 -6.396 1.00 12.15 H new ATOM 0 HG22 ILE A 107 3.256 3.665 -7.411 1.00 12.15 H new ATOM 0 HG23 ILE A 107 4.231 4.151 -6.004 1.00 12.15 H new ATOM 0 HD11 ILE A 107 4.038 8.380 -5.845 1.00 13.53 H new ATOM 0 HD12 ILE A 107 3.052 7.861 -7.232 1.00 13.53 H new ATOM 0 HD13 ILE A 107 3.045 6.908 -5.729 1.00 13.53 H new ATOM 1682 N PHE A 108 5.298 5.095 -10.646 1.00 65.44 N ATOM 1683 CA PHE A 108 5.517 5.646 -11.969 1.00 44.44 C ATOM 1684 C PHE A 108 4.530 6.775 -12.228 1.00 4.22 C ATOM 1685 O PHE A 108 3.350 6.662 -11.900 1.00 63.03 O ATOM 1686 CB PHE A 108 5.369 4.519 -13.012 1.00 42.24 C ATOM 1687 CG PHE A 108 4.942 4.962 -14.390 1.00 63.22 C ATOM 1688 CD1 PHE A 108 5.879 5.323 -15.346 1.00 14.21 C ATOM 1689 CD2 PHE A 108 3.598 4.999 -14.731 1.00 21.12 C ATOM 1690 CE1 PHE A 108 5.481 5.716 -16.612 1.00 71.21 C ATOM 1691 CE2 PHE A 108 3.194 5.387 -15.989 1.00 53.03 C ATOM 1692 CZ PHE A 108 4.136 5.747 -16.934 1.00 63.23 C ATOM 0 H PHE A 108 4.549 4.403 -10.608 1.00 65.44 H new ATOM 0 HA PHE A 108 6.523 6.060 -12.043 1.00 44.44 H new ATOM 0 HB2 PHE A 108 6.323 3.998 -13.096 1.00 42.24 H new ATOM 0 HB3 PHE A 108 4.643 3.796 -12.640 1.00 42.24 H new ATOM 0 HD1 PHE A 108 6.930 5.297 -15.100 1.00 14.21 H new ATOM 0 HD2 PHE A 108 2.856 4.719 -13.998 1.00 21.12 H new ATOM 0 HE1 PHE A 108 6.220 5.998 -17.348 1.00 71.21 H new ATOM 0 HE2 PHE A 108 2.143 5.410 -16.237 1.00 53.03 H new ATOM 0 HZ PHE A 108 3.823 6.052 -17.922 1.00 63.23 H new ATOM 1702 N VAL A 109 5.024 7.865 -12.790 1.00 74.22 N ATOM 1703 CA VAL A 109 4.181 8.988 -13.167 1.00 4.24 C ATOM 1704 C VAL A 109 4.358 9.267 -14.653 1.00 63.43 C ATOM 1705 O VAL A 109 5.410 9.717 -15.074 1.00 12.50 O ATOM 1706 CB VAL A 109 4.553 10.261 -12.369 1.00 61.12 C ATOM 1707 CG1 VAL A 109 3.567 11.387 -12.643 1.00 52.43 C ATOM 1708 CG2 VAL A 109 4.625 9.964 -10.880 1.00 2.10 C ATOM 0 H VAL A 109 6.014 7.997 -12.997 1.00 74.22 H new ATOM 0 HA VAL A 109 3.146 8.730 -12.944 1.00 4.24 H new ATOM 0 HB VAL A 109 5.539 10.587 -12.702 1.00 61.12 H new ATOM 0 HG11 VAL A 109 3.853 12.269 -12.069 1.00 52.43 H new ATOM 0 HG12 VAL A 109 3.576 11.627 -13.706 1.00 52.43 H new ATOM 0 HG13 VAL A 109 2.565 11.073 -12.350 1.00 52.43 H new ATOM 0 HG21 VAL A 109 4.888 10.874 -10.340 1.00 2.10 H new ATOM 0 HG22 VAL A 109 3.656 9.603 -10.534 1.00 2.10 H new ATOM 0 HG23 VAL A 109 5.382 9.202 -10.697 1.00 2.10 H new ATOM 1718 N GLY A 110 3.344 9.001 -15.454 1.00 33.41 N ATOM 1719 CA GLY A 110 3.499 9.161 -16.883 1.00 34.00 C ATOM 1720 C GLY A 110 2.427 10.018 -17.505 1.00 52.51 C ATOM 1721 O GLY A 110 1.325 10.136 -16.970 1.00 33.21 O ATOM 0 H GLY A 110 2.425 8.681 -15.148 1.00 33.41 H new ATOM 0 HA2 GLY A 110 4.474 9.604 -17.089 1.00 34.00 H new ATOM 0 HA3 GLY A 110 3.489 8.179 -17.355 1.00 34.00 H new ATOM 1725 N GLY A 111 2.748 10.623 -18.638 1.00 63.25 N ATOM 1726 CA GLY A 111 1.768 11.408 -19.355 1.00 74.11 C ATOM 1727 C GLY A 111 1.897 12.886 -19.076 1.00 52.30 C ATOM 1728 O GLY A 111 1.044 13.672 -19.483 1.00 44.15 O ATOM 0 H GLY A 111 3.670 10.584 -19.073 1.00 63.25 H new ATOM 0 HA2 GLY A 111 1.878 11.232 -20.425 1.00 74.11 H new ATOM 0 HA3 GLY A 111 0.768 11.075 -19.079 1.00 74.11 H new ATOM 1732 N ILE A 112 2.953 13.265 -18.360 1.00 31.34 N ATOM 1733 CA ILE A 112 3.240 14.668 -18.107 1.00 22.14 C ATOM 1734 C ILE A 112 3.746 15.330 -19.386 1.00 23.14 C ATOM 1735 O ILE A 112 4.874 15.110 -19.820 1.00 44.22 O ATOM 1736 CB ILE A 112 4.254 14.858 -16.950 1.00 32.02 C ATOM 1737 CG1 ILE A 112 5.459 13.926 -17.103 1.00 51.52 C ATOM 1738 CG2 ILE A 112 3.570 14.606 -15.618 1.00 13.11 C ATOM 1739 CD1 ILE A 112 6.559 14.179 -16.095 1.00 31.10 C ATOM 0 H ILE A 112 3.623 12.617 -17.946 1.00 31.34 H new ATOM 0 HA ILE A 112 2.313 15.149 -17.795 1.00 22.14 H new ATOM 0 HB ILE A 112 4.617 15.885 -16.985 1.00 32.02 H new ATOM 0 HG12 ILE A 112 5.122 12.894 -17.008 1.00 51.52 H new ATOM 0 HG13 ILE A 112 5.867 14.037 -18.108 1.00 51.52 H new ATOM 0 HG21 ILE A 112 4.288 14.741 -14.809 1.00 13.11 H new ATOM 0 HG22 ILE A 112 2.746 15.309 -15.493 1.00 13.11 H new ATOM 0 HG23 ILE A 112 3.184 13.587 -15.594 1.00 13.11 H new ATOM 0 HD11 ILE A 112 7.378 13.480 -16.267 1.00 31.10 H new ATOM 0 HD12 ILE A 112 6.924 15.200 -16.204 1.00 31.10 H new ATOM 0 HD13 ILE A 112 6.168 14.039 -15.087 1.00 31.10 H new ATOM 1751 N LYS A 113 2.888 16.126 -19.999 1.00 23.50 N ATOM 1752 CA LYS A 113 3.146 16.645 -21.335 1.00 52.15 C ATOM 1753 C LYS A 113 3.929 17.952 -21.293 1.00 44.10 C ATOM 1754 O LYS A 113 4.405 18.436 -22.320 1.00 1.33 O ATOM 1755 CB LYS A 113 1.818 16.819 -22.074 1.00 63.42 C ATOM 1756 CG LYS A 113 1.102 15.498 -22.319 1.00 53.11 C ATOM 1757 CD LYS A 113 -0.387 15.687 -22.561 1.00 53.10 C ATOM 1758 CE LYS A 113 -0.673 16.322 -23.911 1.00 50.12 C ATOM 1759 NZ LYS A 113 -2.132 16.487 -24.136 1.00 35.23 N ATOM 0 H LYS A 113 2.003 16.429 -19.593 1.00 23.50 H new ATOM 0 HA LYS A 113 3.766 15.928 -21.873 1.00 52.15 H new ATOM 0 HB2 LYS A 113 1.169 17.477 -21.496 1.00 63.42 H new ATOM 0 HB3 LYS A 113 2.001 17.311 -23.029 1.00 63.42 H new ATOM 0 HG2 LYS A 113 1.548 15.000 -23.180 1.00 53.11 H new ATOM 0 HG3 LYS A 113 1.248 14.843 -21.460 1.00 53.11 H new ATOM 0 HD2 LYS A 113 -0.888 14.721 -22.502 1.00 53.10 H new ATOM 0 HD3 LYS A 113 -0.805 16.312 -21.772 1.00 53.10 H new ATOM 0 HE2 LYS A 113 -0.183 17.294 -23.969 1.00 50.12 H new ATOM 0 HE3 LYS A 113 -0.249 15.704 -24.702 1.00 50.12 H new ATOM 0 HZ1 LYS A 113 -2.293 16.923 -25.066 1.00 35.23 H new ATOM 0 HZ2 LYS A 113 -2.595 15.556 -24.105 1.00 35.23 H new ATOM 0 HZ3 LYS A 113 -2.531 17.097 -23.394 1.00 35.23 H new ATOM 1773 N GLU A 114 4.071 18.515 -20.109 1.00 11.14 N ATOM 1774 CA GLU A 114 4.864 19.719 -19.931 1.00 33.42 C ATOM 1775 C GLU A 114 5.973 19.458 -18.929 1.00 10.33 C ATOM 1776 O GLU A 114 5.941 18.452 -18.216 1.00 72.01 O ATOM 1777 CB GLU A 114 3.988 20.881 -19.480 1.00 50.02 C ATOM 1778 CG GLU A 114 3.061 21.385 -20.569 1.00 72.43 C ATOM 1779 CD GLU A 114 2.113 22.451 -20.078 1.00 43.53 C ATOM 1780 OE1 GLU A 114 1.029 22.101 -19.572 1.00 24.34 O ATOM 1781 OE2 GLU A 114 2.445 23.648 -20.202 1.00 10.43 O ATOM 0 H GLU A 114 3.647 18.158 -19.253 1.00 11.14 H new ATOM 0 HA GLU A 114 5.311 19.992 -20.887 1.00 33.42 H new ATOM 0 HB2 GLU A 114 3.394 20.568 -18.621 1.00 50.02 H new ATOM 0 HB3 GLU A 114 4.625 21.700 -19.146 1.00 50.02 H new ATOM 0 HG2 GLU A 114 3.656 21.784 -21.391 1.00 72.43 H new ATOM 0 HG3 GLU A 114 2.486 20.549 -20.967 1.00 72.43 H new ATOM 1788 N ASP A 115 6.955 20.350 -18.878 1.00 62.42 N ATOM 1789 CA ASP A 115 8.114 20.135 -18.027 1.00 41.54 C ATOM 1790 C ASP A 115 7.752 20.259 -16.554 1.00 14.12 C ATOM 1791 O ASP A 115 7.537 21.345 -16.017 1.00 40.45 O ATOM 1792 CB ASP A 115 9.287 21.055 -18.405 1.00 53.44 C ATOM 1793 CG ASP A 115 8.983 22.535 -18.310 1.00 21.13 C ATOM 1794 OD1 ASP A 115 8.213 23.042 -19.151 1.00 73.10 O ATOM 1795 OD2 ASP A 115 9.555 23.205 -17.426 1.00 33.51 O ATOM 0 H ASP A 115 6.971 21.220 -19.411 1.00 62.42 H new ATOM 0 HA ASP A 115 8.451 19.112 -18.196 1.00 41.54 H new ATOM 0 HB2 ASP A 115 10.133 20.829 -17.756 1.00 53.44 H new ATOM 0 HB3 ASP A 115 9.597 20.826 -19.424 1.00 53.44 H new ATOM 1800 N THR A 116 7.672 19.106 -15.919 1.00 3.10 N ATOM 1801 CA THR A 116 7.293 19.002 -14.531 1.00 4.11 C ATOM 1802 C THR A 116 8.542 18.908 -13.668 1.00 74.44 C ATOM 1803 O THR A 116 9.534 18.290 -14.055 1.00 22.01 O ATOM 1804 CB THR A 116 6.399 17.762 -14.321 1.00 64.32 C ATOM 1805 OG1 THR A 116 5.427 17.697 -15.376 1.00 75.13 O ATOM 1806 CG2 THR A 116 5.684 17.808 -12.978 1.00 41.13 C ATOM 0 H THR A 116 7.871 18.208 -16.360 1.00 3.10 H new ATOM 0 HA THR A 116 6.729 19.889 -14.242 1.00 4.11 H new ATOM 0 HB THR A 116 7.035 16.877 -14.334 1.00 64.32 H new ATOM 0 HG1 THR A 116 4.679 17.129 -15.097 1.00 75.13 H new ATOM 0 HG21 THR A 116 5.064 16.919 -12.865 1.00 41.13 H new ATOM 0 HG22 THR A 116 6.420 17.841 -12.175 1.00 41.13 H new ATOM 0 HG23 THR A 116 5.055 18.697 -12.931 1.00 41.13 H new ATOM 1814 N GLU A 117 8.486 19.537 -12.514 1.00 35.24 N ATOM 1815 CA GLU A 117 9.636 19.582 -11.631 1.00 61.44 C ATOM 1816 C GLU A 117 9.368 18.811 -10.351 1.00 60.43 C ATOM 1817 O GLU A 117 8.232 18.394 -10.084 1.00 34.42 O ATOM 1818 CB GLU A 117 10.047 21.022 -11.330 1.00 61.12 C ATOM 1819 CG GLU A 117 8.971 21.845 -10.657 1.00 1.41 C ATOM 1820 CD GLU A 117 9.416 23.266 -10.399 1.00 45.11 C ATOM 1821 OE1 GLU A 117 10.247 23.479 -9.492 1.00 1.21 O ATOM 1822 OE2 GLU A 117 8.960 24.175 -11.123 1.00 54.33 O ATOM 0 H GLU A 117 7.660 20.023 -12.164 1.00 35.24 H new ATOM 0 HA GLU A 117 10.469 19.102 -12.144 1.00 61.44 H new ATOM 0 HB2 GLU A 117 10.932 21.010 -10.693 1.00 61.12 H new ATOM 0 HB3 GLU A 117 10.332 21.509 -12.262 1.00 61.12 H new ATOM 0 HG2 GLU A 117 8.078 21.854 -11.282 1.00 1.41 H new ATOM 0 HG3 GLU A 117 8.694 21.376 -9.713 1.00 1.41 H new ATOM 1829 N GLU A 118 10.435 18.615 -9.584 1.00 12.31 N ATOM 1830 CA GLU A 118 10.361 17.931 -8.304 1.00 23.23 C ATOM 1831 C GLU A 118 9.308 18.578 -7.417 1.00 61.33 C ATOM 1832 O GLU A 118 8.413 17.904 -6.927 1.00 2.14 O ATOM 1833 CB GLU A 118 11.715 17.950 -7.592 1.00 63.34 C ATOM 1834 CG GLU A 118 11.651 17.386 -6.185 1.00 63.12 C ATOM 1835 CD GLU A 118 12.884 17.685 -5.363 1.00 40.31 C ATOM 1836 OE1 GLU A 118 14.001 17.387 -5.826 1.00 25.35 O ATOM 1837 OE2 GLU A 118 12.736 18.214 -4.246 1.00 71.21 O ATOM 0 H GLU A 118 11.373 18.927 -9.834 1.00 12.31 H new ATOM 0 HA GLU A 118 10.083 16.895 -8.495 1.00 23.23 H new ATOM 0 HB2 GLU A 118 12.435 17.376 -8.176 1.00 63.34 H new ATOM 0 HB3 GLU A 118 12.084 18.975 -7.551 1.00 63.34 H new ATOM 0 HG2 GLU A 118 10.777 17.794 -5.677 1.00 63.12 H new ATOM 0 HG3 GLU A 118 11.513 16.306 -6.240 1.00 63.12 H new ATOM 1844 N HIS A 119 9.395 19.897 -7.269 1.00 62.51 N ATOM 1845 CA HIS A 119 8.515 20.647 -6.371 1.00 72.52 C ATOM 1846 C HIS A 119 7.035 20.476 -6.718 1.00 14.42 C ATOM 1847 O HIS A 119 6.179 20.608 -5.846 1.00 63.33 O ATOM 1848 CB HIS A 119 8.890 22.129 -6.387 1.00 52.12 C ATOM 1849 CG HIS A 119 10.135 22.441 -5.611 1.00 60.04 C ATOM 1850 ND1 HIS A 119 11.377 22.087 -6.075 1.00 13.32 N ATOM 1851 CD2 HIS A 119 10.274 23.062 -4.416 1.00 15.11 C ATOM 1852 CE1 HIS A 119 12.239 22.497 -5.160 1.00 43.34 C ATOM 1853 NE2 HIS A 119 11.617 23.096 -4.135 1.00 22.42 N ATOM 0 H HIS A 119 10.073 20.476 -7.764 1.00 62.51 H new ATOM 0 HA HIS A 119 8.658 20.241 -5.370 1.00 72.52 H new ATOM 0 HB2 HIS A 119 9.026 22.450 -7.420 1.00 52.12 H new ATOM 0 HB3 HIS A 119 8.062 22.709 -5.979 1.00 52.12 H new ATOM 0 HD2 HIS A 119 9.479 23.456 -3.800 1.00 15.11 H new ATOM 0 HE1 HIS A 119 13.309 22.366 -5.230 1.00 43.34 H new ATOM 0 HE2 HIS A 119 12.056 23.499 -3.307 1.00 22.42 H new ATOM 1861 N HIS A 120 6.737 20.159 -7.976 1.00 32.23 N ATOM 1862 CA HIS A 120 5.355 19.934 -8.398 1.00 63.21 C ATOM 1863 C HIS A 120 4.819 18.630 -7.820 1.00 25.31 C ATOM 1864 O HIS A 120 3.863 18.625 -7.035 1.00 43.32 O ATOM 1865 CB HIS A 120 5.240 19.886 -9.926 1.00 4.14 C ATOM 1866 CG HIS A 120 5.466 21.200 -10.607 1.00 14.43 C ATOM 1867 ND1 HIS A 120 5.765 21.264 -11.945 1.00 12.34 N ATOM 1868 CD2 HIS A 120 5.422 22.454 -10.102 1.00 34.24 C ATOM 1869 CE1 HIS A 120 5.896 22.549 -12.224 1.00 45.14 C ATOM 1870 NE2 HIS A 120 5.698 23.310 -11.137 1.00 52.21 N ATOM 0 H HIS A 120 7.429 20.052 -8.718 1.00 32.23 H new ATOM 0 HA HIS A 120 4.764 20.770 -8.023 1.00 63.21 H new ATOM 0 HB2 HIS A 120 5.961 19.164 -10.309 1.00 4.14 H new ATOM 0 HB3 HIS A 120 4.249 19.519 -10.192 1.00 4.14 H new ATOM 0 HD2 HIS A 120 5.210 22.729 -9.079 1.00 34.24 H new ATOM 0 HE1 HIS A 120 6.133 22.938 -13.204 1.00 45.14 H new ATOM 0 HE2 HIS A 120 5.744 24.328 -11.090 1.00 52.21 H new ATOM 1878 N LEU A 121 5.465 17.519 -8.165 1.00 24.50 N ATOM 1879 CA LEU A 121 4.928 16.220 -7.802 1.00 33.54 C ATOM 1880 C LEU A 121 5.276 15.862 -6.364 1.00 62.13 C ATOM 1881 O LEU A 121 4.552 15.117 -5.722 1.00 73.23 O ATOM 1882 CB LEU A 121 5.392 15.135 -8.784 1.00 32.04 C ATOM 1883 CG LEU A 121 6.903 14.915 -8.910 1.00 44.41 C ATOM 1884 CD1 LEU A 121 7.405 13.934 -7.860 1.00 44.02 C ATOM 1885 CD2 LEU A 121 7.231 14.412 -10.300 1.00 43.41 C ATOM 0 H LEU A 121 6.342 17.495 -8.685 1.00 24.50 H new ATOM 0 HA LEU A 121 3.842 16.277 -7.868 1.00 33.54 H new ATOM 0 HB2 LEU A 121 4.935 14.191 -8.487 1.00 32.04 H new ATOM 0 HB3 LEU A 121 5.001 15.381 -9.771 1.00 32.04 H new ATOM 0 HG LEU A 121 7.406 15.868 -8.743 1.00 44.41 H new ATOM 0 HD11 LEU A 121 8.480 13.798 -7.974 1.00 44.02 H new ATOM 0 HD12 LEU A 121 7.192 14.325 -6.865 1.00 44.02 H new ATOM 0 HD13 LEU A 121 6.902 12.975 -7.988 1.00 44.02 H new ATOM 0 HD21 LEU A 121 8.306 14.257 -10.386 1.00 43.41 H new ATOM 0 HD22 LEU A 121 6.713 13.470 -10.478 1.00 43.41 H new ATOM 0 HD23 LEU A 121 6.910 15.147 -11.038 1.00 43.41 H new ATOM 1897 N ARG A 122 6.373 16.410 -5.855 1.00 43.44 N ATOM 1898 CA ARG A 122 6.786 16.153 -4.484 1.00 22.24 C ATOM 1899 C ARG A 122 5.803 16.782 -3.512 1.00 51.41 C ATOM 1900 O ARG A 122 5.407 16.152 -2.543 1.00 43.33 O ATOM 1901 CB ARG A 122 8.201 16.681 -4.240 1.00 64.22 C ATOM 1902 CG ARG A 122 8.708 16.442 -2.829 1.00 22.23 C ATOM 1903 CD ARG A 122 8.919 17.750 -2.095 1.00 41.22 C ATOM 1904 NE ARG A 122 10.142 18.421 -2.537 1.00 62.34 N ATOM 1905 CZ ARG A 122 10.480 19.663 -2.204 1.00 71.42 C ATOM 1906 NH1 ARG A 122 9.693 20.385 -1.417 1.00 11.13 N ATOM 1907 NH2 ARG A 122 11.611 20.178 -2.663 1.00 22.34 N ATOM 0 H ARG A 122 6.991 17.035 -6.372 1.00 43.44 H new ATOM 0 HA ARG A 122 6.793 15.076 -4.319 1.00 22.24 H new ATOM 0 HB2 ARG A 122 8.883 16.207 -4.946 1.00 64.22 H new ATOM 0 HB3 ARG A 122 8.220 17.751 -4.447 1.00 64.22 H new ATOM 0 HG2 ARG A 122 7.994 15.826 -2.282 1.00 22.23 H new ATOM 0 HG3 ARG A 122 9.645 15.887 -2.865 1.00 22.23 H new ATOM 0 HD2 ARG A 122 8.063 18.404 -2.262 1.00 41.22 H new ATOM 0 HD3 ARG A 122 8.973 17.562 -1.023 1.00 41.22 H new ATOM 0 HE ARG A 122 10.778 17.901 -3.141 1.00 62.34 H new ATOM 0 HH11 ARG A 122 8.823 19.988 -1.063 1.00 11.13 H new ATOM 0 HH12 ARG A 122 9.958 21.337 -1.165 1.00 11.13 H new ATOM 0 HH21 ARG A 122 12.216 19.622 -3.268 1.00 22.34 H new ATOM 0 HH22 ARG A 122 11.877 21.130 -2.412 1.00 22.34 H new ATOM 1921 N ASP A 123 5.386 18.014 -3.793 1.00 73.24 N ATOM 1922 CA ASP A 123 4.396 18.695 -2.954 1.00 23.02 C ATOM 1923 C ASP A 123 3.065 17.951 -2.991 1.00 31.42 C ATOM 1924 O ASP A 123 2.328 17.918 -2.006 1.00 54.32 O ATOM 1925 CB ASP A 123 4.206 20.142 -3.421 1.00 34.04 C ATOM 1926 CG ASP A 123 3.112 20.872 -2.663 1.00 33.50 C ATOM 1927 OD1 ASP A 123 3.372 21.347 -1.540 1.00 62.24 O ATOM 1928 OD2 ASP A 123 1.986 20.977 -3.188 1.00 4.22 O ATOM 0 H ASP A 123 5.714 18.561 -4.589 1.00 73.24 H new ATOM 0 HA ASP A 123 4.762 18.704 -1.927 1.00 23.02 H new ATOM 0 HB2 ASP A 123 5.145 20.682 -3.302 1.00 34.04 H new ATOM 0 HB3 ASP A 123 3.968 20.146 -4.485 1.00 34.04 H new ATOM 1933 N TYR A 124 2.783 17.318 -4.119 1.00 64.33 N ATOM 1934 CA TYR A 124 1.549 16.591 -4.289 1.00 3.20 C ATOM 1935 C TYR A 124 1.600 15.210 -3.613 1.00 20.24 C ATOM 1936 O TYR A 124 0.737 14.874 -2.804 1.00 65.33 O ATOM 1937 CB TYR A 124 1.245 16.447 -5.772 1.00 71.44 C ATOM 1938 CG TYR A 124 0.042 15.595 -6.026 1.00 54.34 C ATOM 1939 CD1 TYR A 124 -1.229 16.070 -5.749 1.00 1.33 C ATOM 1940 CD2 TYR A 124 0.179 14.308 -6.512 1.00 62.15 C ATOM 1941 CE1 TYR A 124 -2.337 15.285 -5.953 1.00 50.53 C ATOM 1942 CE2 TYR A 124 -0.924 13.512 -6.716 1.00 54.11 C ATOM 1943 CZ TYR A 124 -2.183 14.011 -6.435 1.00 0.33 C ATOM 1944 OH TYR A 124 -3.293 13.233 -6.630 1.00 55.22 O ATOM 0 H TYR A 124 3.400 17.297 -4.931 1.00 64.33 H new ATOM 0 HA TYR A 124 0.752 17.156 -3.805 1.00 3.20 H new ATOM 0 HB2 TYR A 124 1.086 17.434 -6.205 1.00 71.44 H new ATOM 0 HB3 TYR A 124 2.108 16.013 -6.277 1.00 71.44 H new ATOM 0 HD1 TYR A 124 -1.351 17.073 -5.367 1.00 1.33 H new ATOM 0 HD2 TYR A 124 1.163 13.923 -6.734 1.00 62.15 H new ATOM 0 HE1 TYR A 124 -3.323 15.669 -5.735 1.00 50.53 H new ATOM 0 HE2 TYR A 124 -0.808 12.506 -7.092 1.00 54.11 H new ATOM 0 HH TYR A 124 -3.091 12.307 -6.382 1.00 55.22 H new ATOM 1954 N PHE A 125 2.606 14.416 -3.961 1.00 43.13 N ATOM 1955 CA PHE A 125 2.736 13.048 -3.461 1.00 43.25 C ATOM 1956 C PHE A 125 3.088 12.996 -1.965 1.00 31.40 C ATOM 1957 O PHE A 125 2.766 12.021 -1.291 1.00 13.33 O ATOM 1958 CB PHE A 125 3.792 12.285 -4.276 1.00 32.11 C ATOM 1959 CG PHE A 125 3.340 11.829 -5.643 1.00 11.45 C ATOM 1960 CD1 PHE A 125 2.307 10.911 -5.793 1.00 41.21 C ATOM 1961 CD2 PHE A 125 3.966 12.309 -6.780 1.00 71.32 C ATOM 1962 CE1 PHE A 125 1.911 10.486 -7.055 1.00 10.03 C ATOM 1963 CE2 PHE A 125 3.575 11.890 -8.037 1.00 52.25 C ATOM 1964 CZ PHE A 125 2.549 10.977 -8.173 1.00 54.11 C ATOM 0 H PHE A 125 3.353 14.699 -4.595 1.00 43.13 H new ATOM 0 HA PHE A 125 1.763 12.571 -3.579 1.00 43.25 H new ATOM 0 HB2 PHE A 125 4.668 12.923 -4.394 1.00 32.11 H new ATOM 0 HB3 PHE A 125 4.108 11.412 -3.705 1.00 32.11 H new ATOM 0 HD1 PHE A 125 1.806 10.524 -4.918 1.00 41.21 H new ATOM 0 HD2 PHE A 125 4.772 13.021 -6.683 1.00 71.32 H new ATOM 0 HE1 PHE A 125 1.106 9.773 -7.159 1.00 10.03 H new ATOM 0 HE2 PHE A 125 4.073 12.277 -8.914 1.00 52.25 H new ATOM 0 HZ PHE A 125 2.246 10.647 -9.156 1.00 54.11 H new ATOM 1974 N GLU A 126 3.707 14.058 -1.443 1.00 21.45 N ATOM 1975 CA GLU A 126 4.116 14.078 -0.027 1.00 22.22 C ATOM 1976 C GLU A 126 2.907 14.200 0.893 1.00 63.41 C ATOM 1977 O GLU A 126 2.999 13.945 2.091 1.00 75.33 O ATOM 1978 CB GLU A 126 5.121 15.193 0.279 1.00 4.12 C ATOM 1979 CG GLU A 126 6.563 14.714 0.299 1.00 51.52 C ATOM 1980 CD GLU A 126 7.496 15.656 1.025 1.00 13.41 C ATOM 1981 OE1 GLU A 126 7.660 16.806 0.577 1.00 24.31 O ATOM 1982 OE2 GLU A 126 8.090 15.244 2.044 1.00 45.41 O ATOM 0 H GLU A 126 3.935 14.904 -1.965 1.00 21.45 H new ATOM 0 HA GLU A 126 4.613 13.126 0.161 1.00 22.22 H new ATOM 0 HB2 GLU A 126 5.017 15.981 -0.467 1.00 4.12 H new ATOM 0 HB3 GLU A 126 4.879 15.636 1.245 1.00 4.12 H new ATOM 0 HG2 GLU A 126 6.606 13.734 0.773 1.00 51.52 H new ATOM 0 HG3 GLU A 126 6.911 14.588 -0.726 1.00 51.52 H new ATOM 1989 N GLN A 127 1.778 14.604 0.328 1.00 75.10 N ATOM 1990 CA GLN A 127 0.515 14.611 1.062 1.00 41.02 C ATOM 1991 C GLN A 127 0.119 13.195 1.490 1.00 62.21 C ATOM 1992 O GLN A 127 -0.609 13.014 2.465 1.00 54.02 O ATOM 1993 CB GLN A 127 -0.598 15.218 0.210 1.00 74.44 C ATOM 1994 CG GLN A 127 -0.271 16.595 -0.354 1.00 24.31 C ATOM 1995 CD GLN A 127 -1.438 17.197 -1.106 1.00 54.23 C ATOM 1996 OE1 GLN A 127 -2.236 17.944 -0.540 1.00 42.32 O ATOM 1997 NE2 GLN A 127 -1.558 16.858 -2.378 1.00 73.24 N ATOM 0 H GLN A 127 1.708 14.931 -0.635 1.00 75.10 H new ATOM 0 HA GLN A 127 0.655 15.220 1.955 1.00 41.02 H new ATOM 0 HB2 GLN A 127 -0.818 14.542 -0.616 1.00 74.44 H new ATOM 0 HB3 GLN A 127 -1.504 15.290 0.812 1.00 74.44 H new ATOM 0 HG2 GLN A 127 0.016 17.260 0.460 1.00 24.31 H new ATOM 0 HG3 GLN A 127 0.588 16.518 -1.021 1.00 24.31 H new ATOM 0 HE21 GLN A 127 -0.873 16.236 -2.807 1.00 73.24 H new ATOM 0 HE22 GLN A 127 -2.336 17.219 -2.931 1.00 73.24 H new ATOM 2006 N TYR A 128 0.593 12.197 0.750 1.00 54.14 N ATOM 2007 CA TYR A 128 0.299 10.801 1.058 1.00 53.44 C ATOM 2008 C TYR A 128 1.315 10.225 2.043 1.00 71.42 C ATOM 2009 O TYR A 128 1.020 9.271 2.765 1.00 64.50 O ATOM 2010 CB TYR A 128 0.280 9.970 -0.224 1.00 54.41 C ATOM 2011 CG TYR A 128 -0.813 10.365 -1.193 1.00 33.22 C ATOM 2012 CD1 TYR A 128 -0.597 11.334 -2.168 1.00 24.53 C ATOM 2013 CD2 TYR A 128 -2.062 9.762 -1.137 1.00 34.54 C ATOM 2014 CE1 TYR A 128 -1.594 11.690 -3.054 1.00 14.52 C ATOM 2015 CE2 TYR A 128 -3.065 10.110 -2.020 1.00 33.12 C ATOM 2016 CZ TYR A 128 -2.826 11.074 -2.977 1.00 0.12 C ATOM 2017 OH TYR A 128 -3.824 11.423 -3.859 1.00 43.15 O ATOM 0 H TYR A 128 1.185 12.330 -0.070 1.00 54.14 H new ATOM 0 HA TYR A 128 -0.685 10.760 1.525 1.00 53.44 H new ATOM 0 HB2 TYR A 128 1.245 10.065 -0.722 1.00 54.41 H new ATOM 0 HB3 TYR A 128 0.158 8.919 0.037 1.00 54.41 H new ATOM 0 HD1 TYR A 128 0.367 11.816 -2.233 1.00 24.53 H new ATOM 0 HD2 TYR A 128 -2.253 9.007 -0.389 1.00 34.54 H new ATOM 0 HE1 TYR A 128 -1.411 12.446 -3.803 1.00 14.52 H new ATOM 0 HE2 TYR A 128 -4.031 9.630 -1.962 1.00 33.12 H new ATOM 0 HH TYR A 128 -4.627 10.895 -3.670 1.00 43.15 H new ATOM 2027 N GLY A 129 2.510 10.800 2.054 1.00 63.14 N ATOM 2028 CA GLY A 129 3.538 10.367 2.982 1.00 5.25 C ATOM 2029 C GLY A 129 4.898 10.945 2.656 1.00 64.21 C ATOM 2030 O GLY A 129 5.029 11.752 1.740 1.00 11.21 O ATOM 0 H GLY A 129 2.787 11.562 1.435 1.00 63.14 H new ATOM 0 HA2 GLY A 129 3.256 10.660 3.993 1.00 5.25 H new ATOM 0 HA3 GLY A 129 3.598 9.279 2.970 1.00 5.25 H new ATOM 2034 N LYS A 130 5.913 10.522 3.401 1.00 70.42 N ATOM 2035 CA LYS A 130 7.265 11.039 3.227 1.00 54.20 C ATOM 2036 C LYS A 130 7.922 10.500 1.959 1.00 73.32 C ATOM 2037 O LYS A 130 7.916 9.294 1.703 1.00 33.30 O ATOM 2038 CB LYS A 130 8.131 10.679 4.439 1.00 11.14 C ATOM 2039 CG LYS A 130 9.599 11.029 4.253 1.00 2.21 C ATOM 2040 CD LYS A 130 10.451 10.564 5.417 1.00 43.13 C ATOM 2041 CE LYS A 130 11.916 10.907 5.198 1.00 63.22 C ATOM 2042 NZ LYS A 130 12.134 12.377 5.076 1.00 24.43 N ATOM 0 H LYS A 130 5.824 9.819 4.135 1.00 70.42 H new ATOM 0 HA LYS A 130 7.187 12.122 3.136 1.00 54.20 H new ATOM 0 HB2 LYS A 130 7.749 11.199 5.317 1.00 11.14 H new ATOM 0 HB3 LYS A 130 8.041 9.611 4.637 1.00 11.14 H new ATOM 0 HG2 LYS A 130 9.965 10.574 3.333 1.00 2.21 H new ATOM 0 HG3 LYS A 130 9.702 12.108 4.138 1.00 2.21 H new ATOM 0 HD2 LYS A 130 10.099 11.030 6.337 1.00 43.13 H new ATOM 0 HD3 LYS A 130 10.342 9.487 5.543 1.00 43.13 H new ATOM 0 HE2 LYS A 130 12.507 10.521 6.029 1.00 63.22 H new ATOM 0 HE3 LYS A 130 12.273 10.411 4.295 1.00 63.22 H new ATOM 0 HZ1 LYS A 130 13.150 12.584 5.149 1.00 24.43 H new ATOM 0 HZ2 LYS A 130 11.779 12.705 4.155 1.00 24.43 H new ATOM 0 HZ3 LYS A 130 11.625 12.868 5.839 1.00 24.43 H new ATOM 2056 N ILE A 131 8.503 11.404 1.185 1.00 71.20 N ATOM 2057 CA ILE A 131 9.262 11.034 0.005 1.00 30.01 C ATOM 2058 C ILE A 131 10.759 11.058 0.321 1.00 0.55 C ATOM 2059 O ILE A 131 11.228 11.924 1.056 1.00 14.42 O ATOM 2060 CB ILE A 131 8.954 11.986 -1.178 1.00 43.53 C ATOM 2061 CG1 ILE A 131 7.484 11.863 -1.587 1.00 65.01 C ATOM 2062 CG2 ILE A 131 9.862 11.695 -2.363 1.00 54.14 C ATOM 2063 CD1 ILE A 131 7.077 12.804 -2.702 1.00 21.13 C ATOM 0 H ILE A 131 8.461 12.408 1.357 1.00 71.20 H new ATOM 0 HA ILE A 131 8.970 10.025 -0.287 1.00 30.01 H new ATOM 0 HB ILE A 131 9.144 13.009 -0.852 1.00 43.53 H new ATOM 0 HG12 ILE A 131 7.289 10.838 -1.901 1.00 65.01 H new ATOM 0 HG13 ILE A 131 6.857 12.055 -0.716 1.00 65.01 H new ATOM 0 HG21 ILE A 131 9.625 12.377 -3.179 1.00 54.14 H new ATOM 0 HG22 ILE A 131 10.902 11.832 -2.067 1.00 54.14 H new ATOM 0 HG23 ILE A 131 9.711 10.667 -2.693 1.00 54.14 H new ATOM 0 HD11 ILE A 131 6.022 12.657 -2.935 1.00 21.13 H new ATOM 0 HD12 ILE A 131 7.239 13.834 -2.386 1.00 21.13 H new ATOM 0 HD13 ILE A 131 7.677 12.598 -3.589 1.00 21.13 H new ATOM 2075 N GLU A 132 11.496 10.089 -0.213 1.00 52.42 N ATOM 2076 CA GLU A 132 12.938 10.027 -0.015 1.00 32.23 C ATOM 2077 C GLU A 132 13.653 10.858 -1.075 1.00 11.32 C ATOM 2078 O GLU A 132 14.485 11.708 -0.756 1.00 22.35 O ATOM 2079 CB GLU A 132 13.444 8.584 -0.074 1.00 51.11 C ATOM 2080 CG GLU A 132 12.736 7.645 0.884 1.00 52.42 C ATOM 2081 CD GLU A 132 13.490 6.347 1.091 1.00 64.42 C ATOM 2082 OE1 GLU A 132 13.442 5.467 0.206 1.00 61.00 O ATOM 2083 OE2 GLU A 132 14.144 6.201 2.145 1.00 35.12 O ATOM 0 H GLU A 132 11.117 9.336 -0.787 1.00 52.42 H new ATOM 0 HA GLU A 132 13.154 10.431 0.974 1.00 32.23 H new ATOM 0 HB2 GLU A 132 13.324 8.209 -1.090 1.00 51.11 H new ATOM 0 HB3 GLU A 132 14.512 8.574 0.146 1.00 51.11 H new ATOM 0 HG2 GLU A 132 12.606 8.143 1.845 1.00 52.42 H new ATOM 0 HG3 GLU A 132 11.739 7.425 0.501 1.00 52.42 H new ATOM 2090 N VAL A 133 13.308 10.614 -2.335 1.00 52.12 N ATOM 2091 CA VAL A 133 13.927 11.313 -3.452 1.00 41.22 C ATOM 2092 C VAL A 133 12.975 11.317 -4.652 1.00 62.24 C ATOM 2093 O VAL A 133 12.078 10.475 -4.743 1.00 11.12 O ATOM 2094 CB VAL A 133 15.288 10.665 -3.839 1.00 52.20 C ATOM 2095 CG1 VAL A 133 15.094 9.380 -4.630 1.00 72.15 C ATOM 2096 CG2 VAL A 133 16.164 11.641 -4.610 1.00 42.41 C ATOM 0 H VAL A 133 12.599 9.933 -2.607 1.00 52.12 H new ATOM 0 HA VAL A 133 14.125 12.341 -3.148 1.00 41.22 H new ATOM 0 HB VAL A 133 15.797 10.410 -2.910 1.00 52.20 H new ATOM 0 HG11 VAL A 133 16.067 8.957 -4.882 1.00 72.15 H new ATOM 0 HG12 VAL A 133 14.532 8.665 -4.030 1.00 72.15 H new ATOM 0 HG13 VAL A 133 14.544 9.596 -5.546 1.00 72.15 H new ATOM 0 HG21 VAL A 133 17.108 11.159 -4.866 1.00 42.41 H new ATOM 0 HG22 VAL A 133 15.653 11.946 -5.523 1.00 42.41 H new ATOM 0 HG23 VAL A 133 16.360 12.519 -3.994 1.00 42.41 H new ATOM 2106 N ILE A 134 13.153 12.270 -5.547 1.00 62.24 N ATOM 2107 CA ILE A 134 12.327 12.364 -6.737 1.00 13.23 C ATOM 2108 C ILE A 134 13.182 12.145 -7.974 1.00 13.05 C ATOM 2109 O ILE A 134 14.233 12.764 -8.131 1.00 20.51 O ATOM 2110 CB ILE A 134 11.599 13.731 -6.837 1.00 54.13 C ATOM 2111 CG1 ILE A 134 10.465 13.828 -5.813 1.00 52.35 C ATOM 2112 CG2 ILE A 134 11.045 13.963 -8.239 1.00 23.23 C ATOM 2113 CD1 ILE A 134 10.908 14.236 -4.427 1.00 75.14 C ATOM 0 H ILE A 134 13.867 12.995 -5.472 1.00 62.24 H new ATOM 0 HA ILE A 134 11.563 11.589 -6.669 1.00 13.23 H new ATOM 0 HB ILE A 134 12.337 14.504 -6.621 1.00 54.13 H new ATOM 0 HG12 ILE A 134 9.728 14.547 -6.172 1.00 52.35 H new ATOM 0 HG13 ILE A 134 9.964 12.862 -5.751 1.00 52.35 H new ATOM 0 HG21 ILE A 134 10.541 14.929 -8.276 1.00 23.23 H new ATOM 0 HG22 ILE A 134 11.863 13.953 -8.960 1.00 23.23 H new ATOM 0 HG23 ILE A 134 10.335 13.174 -8.485 1.00 23.23 H new ATOM 0 HD11 ILE A 134 10.042 14.280 -3.766 1.00 75.14 H new ATOM 0 HD12 ILE A 134 11.621 13.506 -4.043 1.00 75.14 H new ATOM 0 HD13 ILE A 134 11.381 15.217 -4.470 1.00 75.14 H new ATOM 2125 N GLU A 135 12.739 11.247 -8.829 1.00 1.33 N ATOM 2126 CA GLU A 135 13.428 10.967 -10.071 1.00 62.11 C ATOM 2127 C GLU A 135 12.720 11.642 -11.247 1.00 21.34 C ATOM 2128 O GLU A 135 11.677 11.188 -11.703 1.00 3.33 O ATOM 2129 CB GLU A 135 13.474 9.453 -10.276 1.00 3.31 C ATOM 2130 CG GLU A 135 14.515 8.755 -9.420 1.00 12.20 C ATOM 2131 CD GLU A 135 14.491 7.251 -9.585 1.00 74.13 C ATOM 2132 OE1 GLU A 135 14.923 6.762 -10.646 1.00 13.32 O ATOM 2133 OE2 GLU A 135 14.047 6.550 -8.653 1.00 24.21 O ATOM 0 H GLU A 135 11.895 10.693 -8.684 1.00 1.33 H new ATOM 0 HA GLU A 135 14.442 11.364 -10.021 1.00 62.11 H new ATOM 0 HB2 GLU A 135 12.493 9.035 -10.053 1.00 3.31 H new ATOM 0 HB3 GLU A 135 13.679 9.243 -11.326 1.00 3.31 H new ATOM 0 HG2 GLU A 135 15.505 9.130 -9.681 1.00 12.20 H new ATOM 0 HG3 GLU A 135 14.345 9.005 -8.373 1.00 12.20 H new ATOM 2140 N ILE A 136 13.289 12.725 -11.741 1.00 53.01 N ATOM 2141 CA ILE A 136 12.726 13.413 -12.894 1.00 53.51 C ATOM 2142 C ILE A 136 13.384 12.893 -14.161 1.00 12.35 C ATOM 2143 O ILE A 136 14.608 12.775 -14.223 1.00 75.43 O ATOM 2144 CB ILE A 136 12.933 14.945 -12.811 1.00 73.21 C ATOM 2145 CG1 ILE A 136 12.339 15.521 -11.517 1.00 53.24 C ATOM 2146 CG2 ILE A 136 12.328 15.634 -14.027 1.00 25.51 C ATOM 2147 CD1 ILE A 136 10.824 15.516 -11.457 1.00 72.03 C ATOM 0 H ILE A 136 14.138 13.149 -11.366 1.00 53.01 H new ATOM 0 HA ILE A 136 11.654 13.216 -12.907 1.00 53.51 H new ATOM 0 HB ILE A 136 14.006 15.135 -12.800 1.00 73.21 H new ATOM 0 HG12 ILE A 136 12.724 14.951 -10.672 1.00 53.24 H new ATOM 0 HG13 ILE A 136 12.690 16.546 -11.397 1.00 53.24 H new ATOM 0 HG21 ILE A 136 12.484 16.710 -13.950 1.00 25.51 H new ATOM 0 HG22 ILE A 136 12.807 15.262 -14.932 1.00 25.51 H new ATOM 0 HG23 ILE A 136 11.259 15.424 -14.070 1.00 25.51 H new ATOM 0 HD11 ILE A 136 10.496 15.941 -10.508 1.00 72.03 H new ATOM 0 HD12 ILE A 136 10.425 16.112 -12.278 1.00 72.03 H new ATOM 0 HD13 ILE A 136 10.460 14.492 -11.541 1.00 72.03 H new ATOM 2159 N MET A 137 12.583 12.551 -15.158 1.00 70.21 N ATOM 2160 CA MET A 137 13.123 12.081 -16.417 1.00 51.33 C ATOM 2161 C MET A 137 12.997 13.177 -17.465 1.00 42.44 C ATOM 2162 O MET A 137 11.944 13.804 -17.597 1.00 44.40 O ATOM 2163 CB MET A 137 12.390 10.817 -16.879 1.00 74.20 C ATOM 2164 CG MET A 137 12.082 9.832 -15.757 1.00 55.02 C ATOM 2165 SD MET A 137 13.544 9.294 -14.852 1.00 11.35 S ATOM 2166 CE MET A 137 14.463 8.480 -16.152 1.00 10.44 C ATOM 0 H MET A 137 11.565 12.591 -15.118 1.00 70.21 H new ATOM 0 HA MET A 137 14.176 11.833 -16.281 1.00 51.33 H new ATOM 0 HB2 MET A 137 11.456 11.107 -17.360 1.00 74.20 H new ATOM 0 HB3 MET A 137 12.995 10.314 -17.634 1.00 74.20 H new ATOM 0 HG2 MET A 137 11.383 10.294 -15.060 1.00 55.02 H new ATOM 0 HG3 MET A 137 11.583 8.959 -16.177 1.00 55.02 H new ATOM 0 HE1 MET A 137 15.252 7.869 -15.713 1.00 10.44 H new ATOM 0 HE2 MET A 137 13.791 7.845 -16.729 1.00 10.44 H new ATOM 0 HE3 MET A 137 14.907 9.229 -16.808 1.00 10.44 H new ATOM 2176 N THR A 138 14.072 13.423 -18.191 1.00 12.30 N ATOM 2177 CA THR A 138 14.085 14.479 -19.183 1.00 51.21 C ATOM 2178 C THR A 138 13.802 13.941 -20.577 1.00 3.43 C ATOM 2179 O THR A 138 14.254 12.855 -20.944 1.00 45.43 O ATOM 2180 CB THR A 138 15.430 15.227 -19.184 1.00 45.23 C ATOM 2181 OG1 THR A 138 16.485 14.352 -18.758 1.00 60.04 O ATOM 2182 CG2 THR A 138 15.372 16.446 -18.279 1.00 22.33 C ATOM 0 H THR A 138 14.947 12.905 -18.111 1.00 12.30 H new ATOM 0 HA THR A 138 13.292 15.176 -18.911 1.00 51.21 H new ATOM 0 HB THR A 138 15.632 15.561 -20.202 1.00 45.23 H new ATOM 0 HG1 THR A 138 17.336 14.838 -18.764 1.00 60.04 H new ATOM 0 HG21 THR A 138 16.334 16.958 -18.296 1.00 22.33 H new ATOM 0 HG22 THR A 138 14.594 17.124 -18.631 1.00 22.33 H new ATOM 0 HG23 THR A 138 15.146 16.132 -17.260 1.00 22.33 H new ATOM 2319 N GLY A 147 7.310 13.813 -20.081 1.00 45.32 N ATOM 2320 CA GLY A 147 7.004 12.536 -20.680 1.00 0.44 C ATOM 2321 C GLY A 147 6.678 11.504 -19.633 1.00 12.20 C ATOM 2322 O GLY A 147 5.681 10.785 -19.753 1.00 13.11 O ATOM 0 HA2 GLY A 147 6.160 12.645 -21.362 1.00 0.44 H new ATOM 0 HA3 GLY A 147 7.853 12.198 -21.275 1.00 0.44 H new ATOM 2326 N PHE A 148 7.477 11.474 -18.570 1.00 54.53 N ATOM 2327 CA PHE A 148 7.232 10.615 -17.427 1.00 35.23 C ATOM 2328 C PHE A 148 8.229 10.953 -16.324 1.00 74.42 C ATOM 2329 O PHE A 148 9.299 11.497 -16.590 1.00 35.41 O ATOM 2330 CB PHE A 148 7.310 9.115 -17.794 1.00 43.31 C ATOM 2331 CG PHE A 148 8.612 8.666 -18.406 1.00 12.24 C ATOM 2332 CD1 PHE A 148 8.852 8.836 -19.761 1.00 4.43 C ATOM 2333 CD2 PHE A 148 9.585 8.056 -17.631 1.00 42.31 C ATOM 2334 CE1 PHE A 148 10.038 8.412 -20.328 1.00 2.32 C ATOM 2335 CE2 PHE A 148 10.772 7.628 -18.195 1.00 30.13 C ATOM 2336 CZ PHE A 148 10.999 7.807 -19.545 1.00 61.00 C ATOM 0 H PHE A 148 8.315 12.049 -18.482 1.00 54.53 H new ATOM 0 HA PHE A 148 6.216 10.797 -17.076 1.00 35.23 H new ATOM 0 HB2 PHE A 148 7.130 8.528 -16.893 1.00 43.31 H new ATOM 0 HB3 PHE A 148 6.503 8.886 -18.490 1.00 43.31 H new ATOM 0 HD1 PHE A 148 8.102 9.306 -20.381 1.00 4.43 H new ATOM 0 HD2 PHE A 148 9.414 7.913 -16.574 1.00 42.31 H new ATOM 0 HE1 PHE A 148 10.213 8.554 -21.384 1.00 2.32 H new ATOM 0 HE2 PHE A 148 11.522 7.153 -17.580 1.00 30.13 H new ATOM 0 HZ PHE A 148 11.927 7.474 -19.987 1.00 61.00 H new ATOM 2346 N ALA A 149 7.853 10.659 -15.097 1.00 75.50 N ATOM 2347 CA ALA A 149 8.688 10.902 -13.943 1.00 21.33 C ATOM 2348 C ALA A 149 8.568 9.738 -12.971 1.00 72.41 C ATOM 2349 O ALA A 149 7.743 8.840 -13.156 1.00 11.34 O ATOM 2350 CB ALA A 149 8.300 12.213 -13.266 1.00 71.14 C ATOM 0 H ALA A 149 6.950 10.241 -14.872 1.00 75.50 H new ATOM 0 HA ALA A 149 9.725 10.986 -14.267 1.00 21.33 H new ATOM 0 HB1 ALA A 149 8.940 12.378 -12.399 1.00 71.14 H new ATOM 0 HB2 ALA A 149 8.423 13.036 -13.970 1.00 71.14 H new ATOM 0 HB3 ALA A 149 7.260 12.162 -12.944 1.00 71.14 H new ATOM 2356 N PHE A 150 9.391 9.762 -11.948 1.00 64.24 N ATOM 2357 CA PHE A 150 9.401 8.735 -10.927 1.00 54.34 C ATOM 2358 C PHE A 150 9.564 9.381 -9.560 1.00 13.43 C ATOM 2359 O PHE A 150 10.122 10.468 -9.440 1.00 22.35 O ATOM 2360 CB PHE A 150 10.536 7.735 -11.181 1.00 64.24 C ATOM 2361 CG PHE A 150 10.260 6.744 -12.277 1.00 23.25 C ATOM 2362 CD1 PHE A 150 9.502 5.611 -12.029 1.00 25.40 C ATOM 2363 CD2 PHE A 150 10.767 6.941 -13.553 1.00 50.00 C ATOM 2364 CE1 PHE A 150 9.253 4.694 -13.032 1.00 31.22 C ATOM 2365 CE2 PHE A 150 10.522 6.027 -14.559 1.00 3.24 C ATOM 2366 CZ PHE A 150 9.764 4.902 -14.299 1.00 42.23 C ATOM 0 H PHE A 150 10.079 10.500 -11.798 1.00 64.24 H new ATOM 0 HA PHE A 150 8.456 8.193 -10.959 1.00 54.34 H new ATOM 0 HB2 PHE A 150 11.442 8.288 -11.428 1.00 64.24 H new ATOM 0 HB3 PHE A 150 10.737 7.191 -10.258 1.00 64.24 H new ATOM 0 HD1 PHE A 150 9.101 5.443 -11.040 1.00 25.40 H new ATOM 0 HD2 PHE A 150 11.360 7.819 -13.762 1.00 50.00 H new ATOM 0 HE1 PHE A 150 8.660 3.815 -12.826 1.00 31.22 H new ATOM 0 HE2 PHE A 150 10.923 6.192 -15.548 1.00 3.24 H new ATOM 0 HZ PHE A 150 9.571 4.186 -15.084 1.00 42.23 H new ATOM 2376 N VAL A 151 9.050 8.735 -8.538 1.00 23.00 N ATOM 2377 CA VAL A 151 9.172 9.257 -7.188 1.00 0.31 C ATOM 2378 C VAL A 151 9.337 8.124 -6.173 1.00 33.43 C ATOM 2379 O VAL A 151 8.618 7.119 -6.208 1.00 31.12 O ATOM 2380 CB VAL A 151 7.975 10.180 -6.826 1.00 14.23 C ATOM 2381 CG1 VAL A 151 6.647 9.519 -7.138 1.00 10.12 C ATOM 2382 CG2 VAL A 151 8.022 10.600 -5.368 1.00 31.45 C ATOM 0 H VAL A 151 8.545 7.852 -8.611 1.00 23.00 H new ATOM 0 HA VAL A 151 10.074 9.868 -7.148 1.00 0.31 H new ATOM 0 HB VAL A 151 8.064 11.073 -7.445 1.00 14.23 H new ATOM 0 HG11 VAL A 151 5.833 10.194 -6.872 1.00 10.12 H new ATOM 0 HG12 VAL A 151 6.596 9.291 -8.203 1.00 10.12 H new ATOM 0 HG13 VAL A 151 6.556 8.597 -6.564 1.00 10.12 H new ATOM 0 HG21 VAL A 151 7.171 11.245 -5.147 1.00 31.45 H new ATOM 0 HG22 VAL A 151 7.981 9.715 -4.733 1.00 31.45 H new ATOM 0 HG23 VAL A 151 8.948 11.142 -5.175 1.00 31.45 H new ATOM 2392 N THR A 152 10.315 8.297 -5.295 1.00 40.10 N ATOM 2393 CA THR A 152 10.681 7.298 -4.308 1.00 53.00 C ATOM 2394 C THR A 152 10.138 7.670 -2.927 1.00 4.43 C ATOM 2395 O THR A 152 10.421 8.748 -2.417 1.00 2.32 O ATOM 2396 CB THR A 152 12.216 7.186 -4.237 1.00 31.53 C ATOM 2397 OG1 THR A 152 12.733 6.743 -5.494 1.00 22.43 O ATOM 2398 CG2 THR A 152 12.659 6.242 -3.136 1.00 50.15 C ATOM 0 H THR A 152 10.881 9.144 -5.250 1.00 40.10 H new ATOM 0 HA THR A 152 10.248 6.343 -4.607 1.00 53.00 H new ATOM 0 HB THR A 152 12.610 8.176 -4.007 1.00 31.53 H new ATOM 0 HG1 THR A 152 13.709 6.676 -5.441 1.00 22.43 H new ATOM 0 HG21 THR A 152 13.748 6.190 -3.118 1.00 50.15 H new ATOM 0 HG22 THR A 152 12.297 6.608 -2.175 1.00 50.15 H new ATOM 0 HG23 THR A 152 12.251 5.249 -3.323 1.00 50.15 H new ATOM 2406 N PHE A 153 9.388 6.767 -2.318 1.00 44.23 N ATOM 2407 CA PHE A 153 8.772 7.023 -1.025 1.00 64.54 C ATOM 2408 C PHE A 153 9.530 6.336 0.102 1.00 32.41 C ATOM 2409 O PHE A 153 10.251 5.364 -0.123 1.00 13.13 O ATOM 2410 CB PHE A 153 7.327 6.538 -1.021 1.00 0.14 C ATOM 2411 CG PHE A 153 6.336 7.591 -1.401 1.00 52.44 C ATOM 2412 CD1 PHE A 153 5.879 8.489 -0.455 1.00 40.45 C ATOM 2413 CD2 PHE A 153 5.849 7.676 -2.692 1.00 65.54 C ATOM 2414 CE1 PHE A 153 4.955 9.454 -0.786 1.00 74.13 C ATOM 2415 CE2 PHE A 153 4.919 8.636 -3.028 1.00 11.42 C ATOM 2416 CZ PHE A 153 4.472 9.526 -2.071 1.00 41.03 C ATOM 0 H PHE A 153 9.189 5.843 -2.701 1.00 44.23 H new ATOM 0 HA PHE A 153 8.802 8.100 -0.859 1.00 64.54 H new ATOM 0 HB2 PHE A 153 7.233 5.699 -1.710 1.00 0.14 H new ATOM 0 HB3 PHE A 153 7.082 6.163 -0.027 1.00 0.14 H new ATOM 0 HD1 PHE A 153 6.252 8.433 0.557 1.00 40.45 H new ATOM 0 HD2 PHE A 153 6.200 6.984 -3.443 1.00 65.54 H new ATOM 0 HE1 PHE A 153 4.610 10.153 -0.038 1.00 74.13 H new ATOM 0 HE2 PHE A 153 4.540 8.692 -4.038 1.00 11.42 H new ATOM 0 HZ PHE A 153 3.743 10.279 -2.332 1.00 41.03 H new ATOM 2426 N ASP A 154 9.351 6.851 1.314 1.00 15.25 N ATOM 2427 CA ASP A 154 9.960 6.270 2.508 1.00 31.31 C ATOM 2428 C ASP A 154 9.206 5.015 2.932 1.00 42.11 C ATOM 2429 O ASP A 154 9.789 4.068 3.469 1.00 33.31 O ATOM 2430 CB ASP A 154 9.958 7.300 3.644 1.00 4.05 C ATOM 2431 CG ASP A 154 10.415 6.730 4.973 1.00 1.42 C ATOM 2432 OD1 ASP A 154 11.638 6.684 5.218 1.00 31.31 O ATOM 2433 OD2 ASP A 154 9.553 6.345 5.788 1.00 61.42 O ATOM 0 H ASP A 154 8.783 7.678 1.497 1.00 15.25 H new ATOM 0 HA ASP A 154 10.989 5.993 2.281 1.00 31.31 H new ATOM 0 HB2 ASP A 154 10.607 8.132 3.371 1.00 4.05 H new ATOM 0 HB3 ASP A 154 8.952 7.704 3.757 1.00 4.05 H new ATOM 2438 N ASP A 155 7.910 5.008 2.662 1.00 54.23 N ATOM 2439 CA ASP A 155 7.069 3.886 3.026 1.00 21.14 C ATOM 2440 C ASP A 155 6.216 3.459 1.845 1.00 2.35 C ATOM 2441 O ASP A 155 5.980 4.240 0.923 1.00 53.41 O ATOM 2442 CB ASP A 155 6.174 4.242 4.210 1.00 53.12 C ATOM 2443 CG ASP A 155 5.831 3.026 5.038 1.00 54.31 C ATOM 2444 OD1 ASP A 155 4.986 2.223 4.604 1.00 51.22 O ATOM 2445 OD2 ASP A 155 6.437 2.852 6.112 1.00 63.13 O ATOM 0 H ASP A 155 7.420 5.769 2.191 1.00 54.23 H new ATOM 0 HA ASP A 155 7.716 3.058 3.315 1.00 21.14 H new ATOM 0 HB2 ASP A 155 6.676 4.979 4.837 1.00 53.12 H new ATOM 0 HB3 ASP A 155 5.257 4.705 3.846 1.00 53.12 H new ATOM 2450 N HIS A 156 5.758 2.219 1.877 1.00 64.42 N ATOM 2451 CA HIS A 156 4.938 1.677 0.806 1.00 43.20 C ATOM 2452 C HIS A 156 3.482 2.098 1.003 1.00 13.20 C ATOM 2453 O HIS A 156 2.711 2.134 0.049 1.00 73.11 O ATOM 2454 CB HIS A 156 5.058 0.140 0.748 1.00 55.51 C ATOM 2455 CG HIS A 156 4.551 -0.553 1.977 1.00 1.23 C ATOM 2456 ND1 HIS A 156 3.210 -0.654 2.241 1.00 4.05 N ATOM 2457 CD2 HIS A 156 5.240 -1.090 3.002 1.00 65.32 C ATOM 2458 CE1 HIS A 156 3.118 -1.228 3.415 1.00 22.02 C ATOM 2459 NE2 HIS A 156 4.322 -1.510 3.918 1.00 43.42 N ATOM 0 H HIS A 156 5.941 1.565 2.638 1.00 64.42 H new ATOM 0 HA HIS A 156 5.294 2.076 -0.144 1.00 43.20 H new ATOM 0 HB2 HIS A 156 4.506 -0.226 -0.118 1.00 55.51 H new ATOM 0 HB3 HIS A 156 6.104 -0.128 0.596 1.00 55.51 H new ATOM 0 HD1 HIS A 156 2.441 -0.346 1.646 1.00 4.05 H new ATOM 0 HD2 HIS A 156 6.314 -1.172 3.083 1.00 65.32 H new ATOM 0 HE1 HIS A 156 2.185 -1.446 3.913 1.00 22.02 H new ATOM 2467 N ASP A 157 3.135 2.423 2.256 1.00 71.44 N ATOM 2468 CA ASP A 157 1.789 2.865 2.623 1.00 22.15 C ATOM 2469 C ASP A 157 1.335 4.027 1.755 1.00 55.22 C ATOM 2470 O ASP A 157 0.215 4.034 1.238 1.00 42.21 O ATOM 2471 CB ASP A 157 1.750 3.270 4.105 1.00 41.31 C ATOM 2472 CG ASP A 157 0.624 4.237 4.423 1.00 24.24 C ATOM 2473 OD1 ASP A 157 -0.558 3.825 4.394 1.00 1.43 O ATOM 2474 OD2 ASP A 157 0.919 5.422 4.686 1.00 20.45 O ATOM 0 H ASP A 157 3.783 2.386 3.043 1.00 71.44 H new ATOM 0 HA ASP A 157 1.106 2.032 2.460 1.00 22.15 H new ATOM 0 HB2 ASP A 157 1.638 2.376 4.718 1.00 41.31 H new ATOM 0 HB3 ASP A 157 2.702 3.726 4.377 1.00 41.31 H new ATOM 2479 N SER A 158 2.221 4.996 1.580 1.00 70.23 N ATOM 2480 CA SER A 158 1.927 6.165 0.779 1.00 14.35 C ATOM 2481 C SER A 158 1.728 5.784 -0.684 1.00 42.45 C ATOM 2482 O SER A 158 0.860 6.335 -1.354 1.00 23.24 O ATOM 2483 CB SER A 158 3.066 7.162 0.909 1.00 74.52 C ATOM 2484 OG SER A 158 3.575 7.177 2.232 1.00 14.25 O ATOM 0 H SER A 158 3.156 4.991 1.988 1.00 70.23 H new ATOM 0 HA SER A 158 1.002 6.616 1.139 1.00 14.35 H new ATOM 0 HB2 SER A 158 3.863 6.904 0.211 1.00 74.52 H new ATOM 0 HB3 SER A 158 2.716 8.158 0.638 1.00 74.52 H new ATOM 0 HG SER A 158 4.527 7.407 2.213 1.00 14.25 H new ATOM 2490 N VAL A 159 2.489 4.790 -1.148 1.00 64.10 N ATOM 2491 CA VAL A 159 2.422 4.349 -2.529 1.00 71.22 C ATOM 2492 C VAL A 159 1.115 3.611 -2.771 1.00 70.02 C ATOM 2493 O VAL A 159 0.473 3.785 -3.807 1.00 42.13 O ATOM 2494 CB VAL A 159 3.634 3.445 -2.861 1.00 50.34 C ATOM 2495 CG1 VAL A 159 3.352 2.506 -4.025 1.00 15.23 C ATOM 2496 CG2 VAL A 159 4.846 4.306 -3.158 1.00 4.23 C ATOM 0 H VAL A 159 3.161 4.277 -0.577 1.00 64.10 H new ATOM 0 HA VAL A 159 2.457 5.218 -3.185 1.00 71.22 H new ATOM 0 HB VAL A 159 3.831 2.820 -1.990 1.00 50.34 H new ATOM 0 HG11 VAL A 159 4.232 1.893 -4.219 1.00 15.23 H new ATOM 0 HG12 VAL A 159 2.509 1.862 -3.777 1.00 15.23 H new ATOM 0 HG13 VAL A 159 3.113 3.090 -4.914 1.00 15.23 H new ATOM 0 HG21 VAL A 159 5.698 3.667 -3.391 1.00 4.23 H new ATOM 0 HG22 VAL A 159 4.633 4.952 -4.009 1.00 4.23 H new ATOM 0 HG23 VAL A 159 5.080 4.918 -2.287 1.00 4.23 H new ATOM 2506 N ASP A 160 0.712 2.832 -1.782 1.00 53.44 N ATOM 2507 CA ASP A 160 -0.506 2.050 -1.858 1.00 45.43 C ATOM 2508 C ASP A 160 -1.738 2.943 -1.912 1.00 74.14 C ATOM 2509 O ASP A 160 -2.717 2.610 -2.574 1.00 12.43 O ATOM 2510 CB ASP A 160 -0.590 1.095 -0.678 1.00 32.04 C ATOM 2511 CG ASP A 160 -0.111 -0.304 -1.027 1.00 2.24 C ATOM 2512 OD1 ASP A 160 0.170 -0.556 -2.222 1.00 15.44 O ATOM 2513 OD2 ASP A 160 -0.027 -1.153 -0.113 1.00 63.31 O ATOM 0 H ASP A 160 1.221 2.725 -0.905 1.00 53.44 H new ATOM 0 HA ASP A 160 -0.478 1.471 -2.781 1.00 45.43 H new ATOM 0 HB2 ASP A 160 0.008 1.486 0.145 1.00 32.04 H new ATOM 0 HB3 ASP A 160 -1.621 1.046 -0.327 1.00 32.04 H new ATOM 2518 N LYS A 161 -1.677 4.088 -1.228 1.00 44.54 N ATOM 2519 CA LYS A 161 -2.754 5.083 -1.288 1.00 2.51 C ATOM 2520 C LYS A 161 -2.893 5.630 -2.704 1.00 43.23 C ATOM 2521 O LYS A 161 -3.997 5.867 -3.195 1.00 43.30 O ATOM 2522 CB LYS A 161 -2.465 6.258 -0.349 1.00 2.10 C ATOM 2523 CG LYS A 161 -2.303 5.877 1.109 1.00 71.33 C ATOM 2524 CD LYS A 161 -1.868 7.070 1.946 1.00 60.24 C ATOM 2525 CE LYS A 161 -1.584 6.659 3.378 1.00 64.04 C ATOM 2526 NZ LYS A 161 -0.976 7.752 4.178 1.00 62.34 N ATOM 0 H LYS A 161 -0.896 4.350 -0.627 1.00 44.54 H new ATOM 0 HA LYS A 161 -3.675 4.587 -0.983 1.00 2.51 H new ATOM 0 HB2 LYS A 161 -1.556 6.758 -0.683 1.00 2.10 H new ATOM 0 HB3 LYS A 161 -3.276 6.981 -0.434 1.00 2.10 H new ATOM 0 HG2 LYS A 161 -3.246 5.486 1.492 1.00 71.33 H new ATOM 0 HG3 LYS A 161 -1.566 5.079 1.199 1.00 71.33 H new ATOM 0 HD2 LYS A 161 -0.975 7.518 1.509 1.00 60.24 H new ATOM 0 HD3 LYS A 161 -2.647 7.832 1.931 1.00 60.24 H new ATOM 0 HE2 LYS A 161 -2.513 6.341 3.851 1.00 64.04 H new ATOM 0 HE3 LYS A 161 -0.915 5.798 3.379 1.00 64.04 H new ATOM 0 HZ1 LYS A 161 -0.865 7.440 5.164 1.00 62.34 H new ATOM 0 HZ2 LYS A 161 -0.044 7.993 3.784 1.00 62.34 H new ATOM 0 HZ3 LYS A 161 -1.592 8.589 4.147 1.00 62.34 H new ATOM 2540 N ILE A 162 -1.751 5.814 -3.344 1.00 34.44 N ATOM 2541 CA ILE A 162 -1.676 6.441 -4.651 1.00 44.31 C ATOM 2542 C ILE A 162 -2.075 5.480 -5.771 1.00 51.51 C ATOM 2543 O ILE A 162 -2.815 5.852 -6.675 1.00 24.13 O ATOM 2544 CB ILE A 162 -0.251 6.987 -4.883 1.00 70.11 C ATOM 2545 CG1 ILE A 162 -0.023 8.208 -3.998 1.00 53.43 C ATOM 2546 CG2 ILE A 162 -0.020 7.334 -6.343 1.00 64.12 C ATOM 2547 CD1 ILE A 162 1.405 8.365 -3.545 1.00 40.11 C ATOM 0 H ILE A 162 -0.846 5.531 -2.969 1.00 34.44 H new ATOM 0 HA ILE A 162 -2.388 7.266 -4.671 1.00 44.31 H new ATOM 0 HB ILE A 162 0.465 6.209 -4.617 1.00 70.11 H new ATOM 0 HG12 ILE A 162 -0.323 9.103 -4.543 1.00 53.43 H new ATOM 0 HG13 ILE A 162 -0.668 8.137 -3.122 1.00 53.43 H new ATOM 0 HG21 ILE A 162 0.993 7.715 -6.470 1.00 64.12 H new ATOM 0 HG22 ILE A 162 -0.151 6.441 -6.954 1.00 64.12 H new ATOM 0 HG23 ILE A 162 -0.736 8.095 -6.654 1.00 64.12 H new ATOM 0 HD11 ILE A 162 1.493 9.254 -2.920 1.00 40.11 H new ATOM 0 HD12 ILE A 162 1.703 7.487 -2.972 1.00 40.11 H new ATOM 0 HD13 ILE A 162 2.053 8.468 -4.415 1.00 40.11 H new ATOM 2559 N VAL A 163 -1.644 4.230 -5.681 1.00 54.40 N ATOM 2560 CA VAL A 163 -1.883 3.269 -6.760 1.00 40.10 C ATOM 2561 C VAL A 163 -3.309 2.723 -6.707 1.00 64.54 C ATOM 2562 O VAL A 163 -3.729 1.951 -7.570 1.00 15.44 O ATOM 2563 CB VAL A 163 -0.876 2.108 -6.731 1.00 53.44 C ATOM 2564 CG1 VAL A 163 0.528 2.637 -6.950 1.00 11.12 C ATOM 2565 CG2 VAL A 163 -0.964 1.339 -5.425 1.00 72.40 C ATOM 0 H VAL A 163 -1.132 3.855 -4.883 1.00 54.40 H new ATOM 0 HA VAL A 163 -1.747 3.810 -7.696 1.00 40.10 H new ATOM 0 HB VAL A 163 -1.122 1.417 -7.537 1.00 53.44 H new ATOM 0 HG11 VAL A 163 1.236 1.809 -6.928 1.00 11.12 H new ATOM 0 HG12 VAL A 163 0.582 3.135 -7.918 1.00 11.12 H new ATOM 0 HG13 VAL A 163 0.776 3.348 -6.162 1.00 11.12 H new ATOM 0 HG21 VAL A 163 -0.240 0.524 -5.433 1.00 72.40 H new ATOM 0 HG22 VAL A 163 -0.747 2.009 -4.593 1.00 72.40 H new ATOM 0 HG23 VAL A 163 -1.968 0.931 -5.310 1.00 72.40 H new ATOM 2575 N ILE A 164 -4.034 3.130 -5.672 1.00 63.24 N ATOM 2576 CA ILE A 164 -5.465 2.889 -5.576 1.00 53.15 C ATOM 2577 C ILE A 164 -6.188 3.607 -6.719 1.00 14.31 C ATOM 2578 O ILE A 164 -7.190 3.121 -7.250 1.00 53.10 O ATOM 2579 CB ILE A 164 -5.994 3.361 -4.196 1.00 41.54 C ATOM 2580 CG1 ILE A 164 -5.783 2.254 -3.159 1.00 54.05 C ATOM 2581 CG2 ILE A 164 -7.459 3.781 -4.256 1.00 22.03 C ATOM 2582 CD1 ILE A 164 -6.009 2.703 -1.730 1.00 14.04 C ATOM 0 H ILE A 164 -3.645 3.636 -4.877 1.00 63.24 H new ATOM 0 HA ILE A 164 -5.659 1.820 -5.664 1.00 53.15 H new ATOM 0 HB ILE A 164 -5.428 4.244 -3.900 1.00 41.54 H new ATOM 0 HG12 ILE A 164 -6.458 1.428 -3.381 1.00 54.05 H new ATOM 0 HG13 ILE A 164 -4.767 1.870 -3.253 1.00 54.05 H new ATOM 0 HG21 ILE A 164 -7.786 4.104 -3.267 1.00 22.03 H new ATOM 0 HG22 ILE A 164 -7.573 4.603 -4.962 1.00 22.03 H new ATOM 0 HG23 ILE A 164 -8.067 2.937 -4.581 1.00 22.03 H new ATOM 0 HD11 ILE A 164 -5.841 1.864 -1.054 1.00 14.04 H new ATOM 0 HD12 ILE A 164 -5.316 3.509 -1.488 1.00 14.04 H new ATOM 0 HD13 ILE A 164 -7.033 3.059 -1.618 1.00 14.04 H new ATOM 2594 N GLN A 165 -5.631 4.740 -7.126 1.00 15.05 N ATOM 2595 CA GLN A 165 -6.181 5.525 -8.217 1.00 73.10 C ATOM 2596 C GLN A 165 -5.265 5.398 -9.426 1.00 24.41 C ATOM 2597 O GLN A 165 -4.066 5.155 -9.278 1.00 52.43 O ATOM 2598 CB GLN A 165 -6.322 6.993 -7.808 1.00 31.44 C ATOM 2599 CG GLN A 165 -6.991 7.187 -6.457 1.00 13.32 C ATOM 2600 CD GLN A 165 -7.067 8.643 -6.041 1.00 14.04 C ATOM 2601 OE1 GLN A 165 -7.175 9.543 -6.875 1.00 3.11 O ATOM 2602 NE2 GLN A 165 -7.001 8.885 -4.746 1.00 62.31 N ATOM 0 H GLN A 165 -4.789 5.137 -6.710 1.00 15.05 H new ATOM 0 HA GLN A 165 -7.174 5.150 -8.467 1.00 73.10 H new ATOM 0 HB2 GLN A 165 -5.333 7.451 -7.784 1.00 31.44 H new ATOM 0 HB3 GLN A 165 -6.899 7.520 -8.569 1.00 31.44 H new ATOM 0 HG2 GLN A 165 -7.998 6.771 -6.493 1.00 13.32 H new ATOM 0 HG3 GLN A 165 -6.441 6.626 -5.701 1.00 13.32 H new ATOM 0 HE21 GLN A 165 -6.912 8.112 -4.087 1.00 62.31 H new ATOM 0 HE22 GLN A 165 -7.039 9.845 -4.404 1.00 62.31 H new ATOM 2611 N LYS A 166 -5.819 5.554 -10.614 1.00 23.44 N ATOM 2612 CA LYS A 166 -5.055 5.338 -11.833 1.00 3.33 C ATOM 2613 C LYS A 166 -4.408 6.633 -12.317 1.00 12.44 C ATOM 2614 O LYS A 166 -3.278 6.630 -12.802 1.00 15.25 O ATOM 2615 CB LYS A 166 -5.959 4.748 -12.911 1.00 14.44 C ATOM 2616 CG LYS A 166 -5.213 4.260 -14.139 1.00 71.34 C ATOM 2617 CD LYS A 166 -6.141 3.534 -15.097 1.00 14.34 C ATOM 2618 CE LYS A 166 -6.561 2.177 -14.553 1.00 11.34 C ATOM 2619 NZ LYS A 166 -7.491 1.470 -15.473 1.00 31.13 N ATOM 0 H LYS A 166 -6.790 5.828 -10.763 1.00 23.44 H new ATOM 0 HA LYS A 166 -4.253 4.632 -11.618 1.00 3.33 H new ATOM 0 HB2 LYS A 166 -6.521 3.917 -12.485 1.00 14.44 H new ATOM 0 HB3 LYS A 166 -6.685 5.502 -13.215 1.00 14.44 H new ATOM 0 HG2 LYS A 166 -4.752 5.107 -14.648 1.00 71.34 H new ATOM 0 HG3 LYS A 166 -4.406 3.593 -13.836 1.00 71.34 H new ATOM 0 HD2 LYS A 166 -7.026 4.143 -15.278 1.00 14.34 H new ATOM 0 HD3 LYS A 166 -5.642 3.403 -16.057 1.00 14.34 H new ATOM 0 HE2 LYS A 166 -5.676 1.562 -14.390 1.00 11.34 H new ATOM 0 HE3 LYS A 166 -7.041 2.308 -13.583 1.00 11.34 H new ATOM 0 HZ1 LYS A 166 -7.752 0.550 -15.064 1.00 31.13 H new ATOM 0 HZ2 LYS A 166 -8.348 2.044 -15.609 1.00 31.13 H new ATOM 0 HZ3 LYS A 166 -7.025 1.321 -16.391 1.00 31.13 H new ATOM 2633 N TYR A 167 -5.129 7.735 -12.186 1.00 14.33 N ATOM 2634 CA TYR A 167 -4.623 9.036 -12.607 1.00 50.51 C ATOM 2635 C TYR A 167 -4.701 10.029 -11.456 1.00 61.21 C ATOM 2636 O TYR A 167 -5.701 10.077 -10.733 1.00 63.21 O ATOM 2637 CB TYR A 167 -5.420 9.576 -13.804 1.00 74.13 C ATOM 2638 CG TYR A 167 -5.206 8.806 -15.090 1.00 22.42 C ATOM 2639 CD1 TYR A 167 -5.933 7.655 -15.368 1.00 23.13 C ATOM 2640 CD2 TYR A 167 -4.269 9.226 -16.025 1.00 24.51 C ATOM 2641 CE1 TYR A 167 -5.728 6.944 -16.535 1.00 62.32 C ATOM 2642 CE2 TYR A 167 -4.062 8.524 -17.196 1.00 4.03 C ATOM 2643 CZ TYR A 167 -4.792 7.382 -17.445 1.00 43.35 C ATOM 2644 OH TYR A 167 -4.574 6.666 -18.601 1.00 70.52 O ATOM 0 H TYR A 167 -6.069 7.757 -11.791 1.00 14.33 H new ATOM 0 HA TYR A 167 -3.583 8.909 -12.908 1.00 50.51 H new ATOM 0 HB2 TYR A 167 -6.481 9.560 -13.556 1.00 74.13 H new ATOM 0 HB3 TYR A 167 -5.146 10.618 -13.968 1.00 74.13 H new ATOM 0 HD1 TYR A 167 -6.671 7.310 -14.659 1.00 23.13 H new ATOM 0 HD2 TYR A 167 -3.692 10.118 -15.833 1.00 24.51 H new ATOM 0 HE1 TYR A 167 -6.299 6.049 -16.732 1.00 62.32 H new ATOM 0 HE2 TYR A 167 -3.332 8.868 -17.913 1.00 4.03 H new ATOM 0 HH TYR A 167 -3.719 6.191 -18.535 1.00 70.52 H new ATOM 2654 N HIS A 168 -3.647 10.816 -11.291 1.00 4.33 N ATOM 2655 CA HIS A 168 -3.588 11.819 -10.236 1.00 71.44 C ATOM 2656 C HIS A 168 -3.285 13.187 -10.829 1.00 12.25 C ATOM 2657 O HIS A 168 -2.559 13.298 -11.819 1.00 12.13 O ATOM 2658 CB HIS A 168 -2.529 11.457 -9.189 1.00 4.02 C ATOM 2659 CG HIS A 168 -2.919 10.310 -8.307 1.00 33.23 C ATOM 2660 ND1 HIS A 168 -3.234 10.483 -6.978 1.00 32.35 N ATOM 2661 CD2 HIS A 168 -3.033 9.005 -8.614 1.00 3.41 C ATOM 2662 CE1 HIS A 168 -3.532 9.281 -6.521 1.00 23.23 C ATOM 2663 NE2 HIS A 168 -3.420 8.357 -7.478 1.00 3.40 N ATOM 0 H HIS A 168 -2.815 10.779 -11.879 1.00 4.33 H new ATOM 0 HA HIS A 168 -4.560 11.848 -9.743 1.00 71.44 H new ATOM 0 HB2 HIS A 168 -1.597 11.211 -9.698 1.00 4.02 H new ATOM 0 HB3 HIS A 168 -2.332 12.331 -8.568 1.00 4.02 H new ATOM 0 HD2 HIS A 168 -2.852 8.555 -9.579 1.00 3.41 H new ATOM 0 HE1 HIS A 168 -3.828 9.072 -5.504 1.00 23.23 H new ATOM 0 HE2 HIS A 168 -3.591 7.356 -7.379 1.00 3.40 H new ATOM 2671 N THR A 169 -3.848 14.218 -10.226 1.00 63.43 N ATOM 2672 CA THR A 169 -3.682 15.573 -10.714 1.00 13.45 C ATOM 2673 C THR A 169 -2.489 16.260 -10.052 1.00 21.10 C ATOM 2674 O THR A 169 -2.513 16.557 -8.861 1.00 21.20 O ATOM 2675 CB THR A 169 -4.953 16.404 -10.459 1.00 12.55 C ATOM 2676 OG1 THR A 169 -6.111 15.660 -10.858 1.00 51.33 O ATOM 2677 CG2 THR A 169 -4.911 17.717 -11.226 1.00 75.01 C ATOM 0 H THR A 169 -4.429 14.140 -9.391 1.00 63.43 H new ATOM 0 HA THR A 169 -3.500 15.510 -11.787 1.00 13.45 H new ATOM 0 HB THR A 169 -5.004 16.624 -9.393 1.00 12.55 H new ATOM 0 HG1 THR A 169 -6.916 16.194 -10.692 1.00 51.33 H new ATOM 0 HG21 THR A 169 -5.821 18.284 -11.028 1.00 75.01 H new ATOM 0 HG22 THR A 169 -4.045 18.297 -10.907 1.00 75.01 H new ATOM 0 HG23 THR A 169 -4.837 17.512 -12.294 1.00 75.01 H new ATOM 2685 N VAL A 170 -1.448 16.496 -10.833 1.00 20.21 N ATOM 2686 CA VAL A 170 -0.287 17.240 -10.369 1.00 70.12 C ATOM 2687 C VAL A 170 -0.151 18.514 -11.192 1.00 1.14 C ATOM 2688 O VAL A 170 -0.180 18.457 -12.419 1.00 32.40 O ATOM 2689 CB VAL A 170 1.015 16.414 -10.486 1.00 1.35 C ATOM 2690 CG1 VAL A 170 2.191 17.171 -9.892 1.00 41.22 C ATOM 2691 CG2 VAL A 170 0.869 15.058 -9.813 1.00 34.12 C ATOM 0 H VAL A 170 -1.383 16.180 -11.801 1.00 20.21 H new ATOM 0 HA VAL A 170 -0.437 17.475 -9.315 1.00 70.12 H new ATOM 0 HB VAL A 170 1.206 16.250 -11.546 1.00 1.35 H new ATOM 0 HG11 VAL A 170 3.095 16.570 -9.986 1.00 41.22 H new ATOM 0 HG12 VAL A 170 2.324 18.113 -10.425 1.00 41.22 H new ATOM 0 HG13 VAL A 170 1.998 17.374 -8.839 1.00 41.22 H new ATOM 0 HG21 VAL A 170 1.800 14.501 -9.912 1.00 34.12 H new ATOM 0 HG22 VAL A 170 0.641 15.199 -8.756 1.00 34.12 H new ATOM 0 HG23 VAL A 170 0.061 14.501 -10.288 1.00 34.12 H new ATOM 2701 N ASN A 171 0.023 19.644 -10.506 1.00 53.13 N ATOM 2702 CA ASN A 171 0.046 20.974 -11.129 1.00 11.24 C ATOM 2703 C ASN A 171 -1.120 21.167 -12.115 1.00 1.52 C ATOM 2704 O ASN A 171 -0.952 21.715 -13.207 1.00 73.05 O ATOM 2705 CB ASN A 171 1.408 21.212 -11.804 1.00 12.32 C ATOM 2706 CG ASN A 171 1.737 22.689 -11.970 1.00 1.20 C ATOM 2707 OD1 ASN A 171 1.545 23.272 -13.037 1.00 13.34 O ATOM 2708 ND2 ASN A 171 2.225 23.308 -10.911 1.00 61.43 N ATOM 0 H ASN A 171 0.153 19.666 -9.495 1.00 53.13 H new ATOM 0 HA ASN A 171 -0.088 21.721 -10.346 1.00 11.24 H new ATOM 0 HB2 ASN A 171 2.189 20.735 -11.212 1.00 12.32 H new ATOM 0 HB3 ASN A 171 1.412 20.732 -12.783 1.00 12.32 H new ATOM 0 HD21 ASN A 171 2.455 24.300 -10.961 1.00 61.43 H new ATOM 0 HD22 ASN A 171 2.372 22.794 -10.042 1.00 61.43 H new ATOM 2715 N GLY A 172 -2.305 20.712 -11.708 1.00 33.11 N ATOM 2716 CA GLY A 172 -3.501 20.839 -12.534 1.00 61.05 C ATOM 2717 C GLY A 172 -3.499 19.944 -13.769 1.00 62.12 C ATOM 2718 O GLY A 172 -4.387 20.050 -14.616 1.00 61.14 O ATOM 0 H GLY A 172 -2.460 20.252 -10.811 1.00 33.11 H new ATOM 0 HA2 GLY A 172 -4.376 20.603 -11.928 1.00 61.05 H new ATOM 0 HA3 GLY A 172 -3.603 21.877 -12.850 1.00 61.05 H new ATOM 2722 N HIS A 173 -2.510 19.067 -13.876 1.00 24.21 N ATOM 2723 CA HIS A 173 -2.398 18.165 -15.013 1.00 75.33 C ATOM 2724 C HIS A 173 -2.685 16.731 -14.577 1.00 31.11 C ATOM 2725 O HIS A 173 -2.229 16.297 -13.519 1.00 51.04 O ATOM 2726 CB HIS A 173 -0.994 18.274 -15.629 1.00 62.33 C ATOM 2727 CG HIS A 173 -0.775 17.388 -16.817 1.00 42.01 C ATOM 2728 ND1 HIS A 173 -1.422 17.616 -18.005 1.00 70.34 N ATOM 2729 CD2 HIS A 173 0.001 16.285 -16.940 1.00 1.01 C ATOM 2730 CE1 HIS A 173 -1.031 16.653 -18.817 1.00 63.30 C ATOM 2731 NE2 HIS A 173 -0.170 15.824 -18.218 1.00 73.54 N ATOM 0 H HIS A 173 -1.769 18.961 -13.183 1.00 24.21 H new ATOM 0 HA HIS A 173 -3.132 18.447 -15.767 1.00 75.33 H new ATOM 0 HB2 HIS A 173 -0.818 19.309 -15.924 1.00 62.33 H new ATOM 0 HB3 HIS A 173 -0.255 18.030 -14.866 1.00 62.33 H new ATOM 0 HD2 HIS A 173 0.632 15.853 -16.178 1.00 1.01 H new ATOM 0 HE1 HIS A 173 -1.365 16.547 -19.839 1.00 63.30 H new ATOM 0 HE2 HIS A 173 0.274 15.005 -18.633 1.00 73.54 H new ATOM 2739 N ASN A 174 -3.444 16.001 -15.380 1.00 11.23 N ATOM 2740 CA ASN A 174 -3.781 14.624 -15.046 1.00 3.34 C ATOM 2741 C ASN A 174 -2.730 13.673 -15.602 1.00 62.25 C ATOM 2742 O ASN A 174 -2.625 13.481 -16.814 1.00 2.20 O ATOM 2743 CB ASN A 174 -5.161 14.246 -15.602 1.00 64.04 C ATOM 2744 CG ASN A 174 -6.284 15.137 -15.094 1.00 63.23 C ATOM 2745 OD1 ASN A 174 -7.256 15.391 -15.803 1.00 22.55 O ATOM 2746 ND2 ASN A 174 -6.171 15.608 -13.865 1.00 22.40 N ATOM 0 H ASN A 174 -3.836 16.335 -16.261 1.00 11.23 H new ATOM 0 HA ASN A 174 -3.807 14.539 -13.960 1.00 3.34 H new ATOM 0 HB2 ASN A 174 -5.132 14.297 -16.690 1.00 64.04 H new ATOM 0 HB3 ASN A 174 -5.380 13.212 -15.337 1.00 64.04 H new ATOM 0 HD21 ASN A 174 -6.904 16.202 -13.477 1.00 22.40 H new ATOM 0 HD22 ASN A 174 -5.351 15.378 -13.304 1.00 22.40 H new ATOM 2753 N CYS A 175 -1.938 13.099 -14.715 1.00 40.51 N ATOM 2754 CA CYS A 175 -0.932 12.129 -15.106 1.00 72.13 C ATOM 2755 C CYS A 175 -1.284 10.743 -14.583 1.00 51.31 C ATOM 2756 O CYS A 175 -1.998 10.610 -13.588 1.00 13.52 O ATOM 2757 CB CYS A 175 0.435 12.563 -14.584 1.00 10.24 C ATOM 2758 SG CYS A 175 0.419 13.125 -12.866 1.00 20.54 S ATOM 0 H CYS A 175 -1.973 13.289 -13.714 1.00 40.51 H new ATOM 0 HA CYS A 175 -0.899 12.081 -16.194 1.00 72.13 H new ATOM 0 HB2 CYS A 175 1.130 11.728 -14.676 1.00 10.24 H new ATOM 0 HB3 CYS A 175 0.816 13.366 -15.215 1.00 10.24 H new ATOM 0 HG CYS A 175 -0.779 12.994 -12.378 1.00 20.54 H new ATOM 2764 N GLU A 176 -0.784 9.723 -15.258 1.00 3.35 N ATOM 2765 CA GLU A 176 -1.051 8.344 -14.887 1.00 51.21 C ATOM 2766 C GLU A 176 -0.043 7.881 -13.850 1.00 22.31 C ATOM 2767 O GLU A 176 1.141 8.199 -13.944 1.00 2.33 O ATOM 2768 CB GLU A 176 -0.970 7.442 -16.120 1.00 63.33 C ATOM 2769 CG GLU A 176 -1.530 6.049 -15.894 1.00 23.32 C ATOM 2770 CD GLU A 176 -1.262 5.122 -17.060 1.00 32.44 C ATOM 2771 OE1 GLU A 176 -1.924 5.273 -18.109 1.00 32.41 O ATOM 2772 OE2 GLU A 176 -0.390 4.234 -16.936 1.00 25.44 O ATOM 0 H GLU A 176 -0.183 9.826 -16.076 1.00 3.35 H new ATOM 0 HA GLU A 176 -2.054 8.283 -14.465 1.00 51.21 H new ATOM 0 HB2 GLU A 176 -1.512 7.913 -16.940 1.00 63.33 H new ATOM 0 HB3 GLU A 176 0.071 7.359 -16.431 1.00 63.33 H new ATOM 0 HG2 GLU A 176 -1.092 5.627 -14.990 1.00 23.32 H new ATOM 0 HG3 GLU A 176 -2.605 6.116 -15.726 1.00 23.32 H new ATOM 2779 N VAL A 177 -0.514 7.138 -12.866 1.00 23.00 N ATOM 2780 CA VAL A 177 0.362 6.620 -11.834 1.00 50.24 C ATOM 2781 C VAL A 177 0.140 5.124 -11.642 1.00 41.33 C ATOM 2782 O VAL A 177 -0.930 4.594 -11.958 1.00 34.15 O ATOM 2783 CB VAL A 177 0.196 7.345 -10.473 1.00 3.30 C ATOM 2784 CG1 VAL A 177 -0.002 8.844 -10.653 1.00 35.41 C ATOM 2785 CG2 VAL A 177 -0.926 6.734 -9.657 1.00 62.45 C ATOM 0 H VAL A 177 -1.495 6.881 -12.760 1.00 23.00 H new ATOM 0 HA VAL A 177 1.379 6.806 -12.180 1.00 50.24 H new ATOM 0 HB VAL A 177 1.123 7.207 -9.917 1.00 3.30 H new ATOM 0 HG11 VAL A 177 -0.114 9.316 -9.677 1.00 35.41 H new ATOM 0 HG12 VAL A 177 0.864 9.267 -11.163 1.00 35.41 H new ATOM 0 HG13 VAL A 177 -0.897 9.024 -11.248 1.00 35.41 H new ATOM 0 HG21 VAL A 177 -1.017 7.264 -8.709 1.00 62.45 H new ATOM 0 HG22 VAL A 177 -1.863 6.814 -10.209 1.00 62.45 H new ATOM 0 HG23 VAL A 177 -0.706 5.684 -9.466 1.00 62.45 H new ATOM 2795 N ARG A 178 1.173 4.463 -11.139 1.00 55.12 N ATOM 2796 CA ARG A 178 1.109 3.027 -10.855 1.00 60.31 C ATOM 2797 C ARG A 178 2.350 2.549 -10.115 1.00 63.23 C ATOM 2798 O ARG A 178 3.318 3.290 -9.981 1.00 43.50 O ATOM 2799 CB ARG A 178 0.915 2.227 -12.156 1.00 43.14 C ATOM 2800 CG ARG A 178 2.158 2.099 -13.019 1.00 72.11 C ATOM 2801 CD ARG A 178 1.776 1.813 -14.461 1.00 12.23 C ATOM 2802 NE ARG A 178 2.933 1.520 -15.305 1.00 5.43 N ATOM 2803 CZ ARG A 178 3.016 1.856 -16.595 1.00 60.31 C ATOM 2804 NH1 ARG A 178 2.013 2.496 -17.189 1.00 2.11 N ATOM 2805 NH2 ARG A 178 4.107 1.558 -17.290 1.00 31.23 N ATOM 0 H ARG A 178 2.070 4.895 -10.917 1.00 55.12 H new ATOM 0 HA ARG A 178 0.249 2.855 -10.207 1.00 60.31 H new ATOM 0 HB2 ARG A 178 0.562 1.227 -11.902 1.00 43.14 H new ATOM 0 HB3 ARG A 178 0.130 2.702 -12.744 1.00 43.14 H new ATOM 0 HG2 ARG A 178 2.741 3.019 -12.966 1.00 72.11 H new ATOM 0 HG3 ARG A 178 2.791 1.298 -12.638 1.00 72.11 H new ATOM 0 HD2 ARG A 178 1.088 0.968 -14.489 1.00 12.23 H new ATOM 0 HD3 ARG A 178 1.243 2.672 -14.868 1.00 12.23 H new ATOM 0 HE ARG A 178 3.723 1.031 -14.884 1.00 5.43 H new ATOM 0 HH11 ARG A 178 1.174 2.733 -16.659 1.00 2.11 H new ATOM 0 HH12 ARG A 178 2.082 2.750 -18.174 1.00 2.11 H new ATOM 0 HH21 ARG A 178 4.882 1.072 -16.839 1.00 31.23 H new ATOM 0 HH22 ARG A 178 4.170 1.815 -18.275 1.00 31.23 H new ATOM 2819 N LYS A 179 2.297 1.310 -9.625 1.00 13.22 N ATOM 2820 CA LYS A 179 3.425 0.690 -8.934 1.00 3.30 C ATOM 2821 C LYS A 179 4.651 0.641 -9.841 1.00 63.32 C ATOM 2822 O LYS A 179 4.573 0.171 -10.975 1.00 1.40 O ATOM 2823 CB LYS A 179 3.067 -0.736 -8.496 1.00 42.43 C ATOM 2824 CG LYS A 179 1.990 -0.823 -7.419 1.00 41.24 C ATOM 2825 CD LYS A 179 2.524 -0.414 -6.053 1.00 34.12 C ATOM 2826 CE LYS A 179 2.257 -1.481 -5.002 1.00 60.34 C ATOM 2827 NZ LYS A 179 0.812 -1.586 -4.648 1.00 73.30 N ATOM 0 H LYS A 179 1.474 0.711 -9.696 1.00 13.22 H new ATOM 0 HA LYS A 179 3.652 1.294 -8.055 1.00 3.30 H new ATOM 0 HB2 LYS A 179 2.734 -1.296 -9.369 1.00 42.43 H new ATOM 0 HB3 LYS A 179 3.969 -1.225 -8.128 1.00 42.43 H new ATOM 0 HG2 LYS A 179 1.152 -0.180 -7.689 1.00 41.24 H new ATOM 0 HG3 LYS A 179 1.607 -1.842 -7.369 1.00 41.24 H new ATOM 0 HD2 LYS A 179 3.596 -0.231 -6.121 1.00 34.12 H new ATOM 0 HD3 LYS A 179 2.059 0.523 -5.746 1.00 34.12 H new ATOM 0 HE2 LYS A 179 2.608 -2.445 -5.370 1.00 60.34 H new ATOM 0 HE3 LYS A 179 2.832 -1.254 -4.104 1.00 60.34 H new ATOM 0 HZ1 LYS A 179 0.625 -2.517 -4.225 1.00 73.30 H new ATOM 0 HZ2 LYS A 179 0.567 -0.840 -3.966 1.00 73.30 H new ATOM 0 HZ3 LYS A 179 0.235 -1.473 -5.506 1.00 73.30 H new ATOM 2841 N ALA A 180 5.769 1.139 -9.346 1.00 51.34 N ATOM 2842 CA ALA A 180 7.012 1.105 -10.095 1.00 32.23 C ATOM 2843 C ALA A 180 8.009 0.206 -9.397 1.00 33.42 C ATOM 2844 O ALA A 180 8.380 0.440 -8.247 1.00 42.34 O ATOM 2845 CB ALA A 180 7.590 2.499 -10.267 1.00 70.31 C ATOM 0 H ALA A 180 5.842 1.573 -8.426 1.00 51.34 H new ATOM 0 HA ALA A 180 6.802 0.706 -11.087 1.00 32.23 H new ATOM 0 HB1 ALA A 180 8.520 2.440 -10.832 1.00 70.31 H new ATOM 0 HB2 ALA A 180 6.878 3.124 -10.805 1.00 70.31 H new ATOM 0 HB3 ALA A 180 7.787 2.935 -9.287 1.00 70.31 H new ATOM 2851 N LEU A 181 8.426 -0.827 -10.090 1.00 23.31 N ATOM 2852 CA LEU A 181 9.372 -1.769 -9.537 1.00 11.34 C ATOM 2853 C LEU A 181 10.766 -1.435 -10.037 1.00 13.14 C ATOM 2854 O LEU A 181 10.913 -0.795 -11.079 1.00 63.24 O ATOM 2855 CB LEU A 181 8.998 -3.199 -9.947 1.00 64.21 C ATOM 2856 CG LEU A 181 7.528 -3.584 -9.749 1.00 11.22 C ATOM 2857 CD1 LEU A 181 7.247 -4.946 -10.362 1.00 52.13 C ATOM 2858 CD2 LEU A 181 7.164 -3.584 -8.274 1.00 62.15 C ATOM 0 H LEU A 181 8.124 -1.038 -11.041 1.00 23.31 H new ATOM 0 HA LEU A 181 9.350 -1.702 -8.449 1.00 11.34 H new ATOM 0 HB2 LEU A 181 9.251 -3.334 -10.999 1.00 64.21 H new ATOM 0 HB3 LEU A 181 9.616 -3.894 -9.379 1.00 64.21 H new ATOM 0 HG LEU A 181 6.912 -2.841 -10.254 1.00 11.22 H new ATOM 0 HD11 LEU A 181 6.198 -5.203 -10.212 1.00 52.13 H new ATOM 0 HD12 LEU A 181 7.464 -4.916 -11.430 1.00 52.13 H new ATOM 0 HD13 LEU A 181 7.877 -5.697 -9.885 1.00 52.13 H new ATOM 0 HD21 LEU A 181 6.116 -3.860 -8.158 1.00 62.15 H new ATOM 0 HD22 LEU A 181 7.789 -4.303 -7.745 1.00 62.15 H new ATOM 0 HD23 LEU A 181 7.325 -2.589 -7.859 1.00 62.15 H new