USER MOD reduce.3.24.130724 H: found=0, std=0, add=1720, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 1714 hydrogens (15 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 NoAdj-H: A 301 GSH H32 : A 301 GSH O32 : A 301 GSH C3 :(short bond) USER MOD NoAdj-H: A 301 GSH H12 : A 301 GSH O12 : A 301 GSH C1 :(short bond) USER MOD Set 1.1: A 181 ASN : amide:sc= 1.94 K(o=3.1,f=-4.4!) USER MOD Set 1.2: A 184 LYS NZ :NH3+ -161:sc= 1.21 (180deg=0) USER MOD Set 2.1: A 112 SER OG : rot -109:sc= 1.75 USER MOD Set 2.2: A 116 ASN : amide:sc= 1.08 K(o=4.7,f=-3.8!) USER MOD Set 2.3: A 168 LYS NZ :NH3+ 142:sc= 1.86 (180deg=1.5) USER MOD Set 3.1: A 135 LYS NZ :NH3+ -168:sc= 1.03 (180deg=0.874) USER MOD Set 3.2: A 177 THR OG1 : rot -50:sc= 1.37 USER MOD Set 4.1: A 113 LYS NZ :NH3+ 163:sc= 1 (180deg=-0.649) USER MOD Set 4.2: A 211 ASN : amide:sc= 1.01 K(o=2,f=-8.8!) USER MOD Set 5.1: A 33 LYS NZ :NH3+ -142:sc= -0.714 (180deg=0.617) USER MOD Set 5.2: A 84 ASN : amide:sc= 0.609 K(o=-0.1,f=-2.5!) USER MOD Set 6.1: A 38 LYS NZ :NH3+ -133:sc= 1.05 (180deg=-0.8!) USER MOD Set 6.2: A 40 HIS : no HE2:sc= -9.99! C(o=-8.9!,f=-11!) USER MOD Set 7.1: A 24 GLN : amide:sc= 0.187 K(o=2.1,f=0.34) USER MOD Set 7.2: A 195 THR OG1 : rot -40:sc= 1.9 USER MOD Single : A 1 MET CE :methyl 175:sc= 0 (180deg=-0.0191) USER MOD Single : A 1 MET N :NH3+ -121:sc= -0.211 (180deg=-0.929) USER MOD Single : A 6 CYS SG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=-0.00081) USER MOD Single : A 23 CYS SG : rot 74:sc= 0.232 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ -158:sc= 1.26 (180deg=0.737) USER MOD Single : A 37 TYR OH : rot -13:sc= 1.26 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 43 ASN : amide:sc= 0.166 K(o=0.17,f=-3.8!) USER MOD Single : A 47 LYS NZ :NH3+ 172:sc= 2.42 (180deg=2.36) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.034) USER MOD Single : A 55 SER OG : rot 163:sc= 1.21 USER MOD Single : A 59 LYS NZ :NH3+ -142:sc= 0.855 (180deg=-1.16!) USER MOD Single : A 64 LYS NZ :NH3+ 149:sc= 1.31 (180deg=1.16) USER MOD Single : A 68 LYS NZ :NH3+ -166:sc= 1.26 (180deg=1.21) USER MOD Single : A 73 SER OG : rot -56:sc= 1.85 USER MOD Single : A 83 LYS NZ :NH3+ 141:sc= 0.985 (180deg=-1.79!) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -70:sc= 1.22 USER MOD Single : A 100 SER OG : rot -35:sc= 0.292 USER MOD Single : A 101 LYS NZ :NH3+ -151:sc= 1.3 (180deg=1.16) USER MOD Single : A 105 SER OG : rot -164:sc= 0.912 USER MOD Single : A 108 LYS NZ :NH3+ -146:sc= 0.732 (180deg=0.316!) USER MOD Single : A 111 LYS NZ :NH3+ -162:sc= 0.628 (180deg=-0.442) USER MOD Single : A 119 THR OG1 : rot 75:sc= 1.08 USER MOD Single : A 121 GLN : amide:sc= 1.09 K(o=1.1,f=-0.02) USER MOD Single : A 128 LYS NZ :NH3+ 155:sc= 1.26 (180deg=-0.263!) USER MOD Single : A 133 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 137 HIS : no HE2:sc= 0.863 K(o=0.86,f=-2.8!) USER MOD Single : A 145 LYS NZ :NH3+ 172:sc= -2.95! (180deg=-3.17!) USER MOD Single : A 147 THR OG1 : rot 147:sc= 0.395 USER MOD Single : A 152 SER OG : rot 71:sc= 0.249 USER MOD Single : A 156 LYS NZ :NH3+ -129:sc=-0.00339 (180deg=-2.14!) USER MOD Single : A 158 TYR OH : rot -33:sc= 1.43 USER MOD Single : A 159 HIS : no HE2:sc= -1.12 K(o=-1.1,f=-7.2!) USER MOD Single : A 166 HIS : no HD1:sc= 0 X(o=0,f=-0.0021) USER MOD Single : A 169 ASN : amide:sc= 0.181 X(o=0.18,f=-0.0085) USER MOD Single : A 175 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 178 HIS : no HE2:sc= -0.554 K(o=-0.55,f=-1.6) USER MOD Single : A 182 TYR OH : rot 8:sc= 0.959 USER MOD Single : A 188 SER OG : rot -69:sc= 1.26 USER MOD Single : A 191 SER OG : rot -121:sc= 1.64 USER MOD Single : A 193 LYS NZ :NH3+ 173:sc= 0.836 (180deg=0.806) USER MOD Single : A 194 LYS NZ :NH3+ -116:sc= 1.19 (180deg=0.000392) USER MOD Single : A 201 HIS : no HE2:sc= 0.724 K(o=0.72,f=-3.1!) USER MOD Single : A 209 LYS NZ :NH3+ -166:sc= -0.347! (180deg=-1.12!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.495 -1.077 25.833 1.00 0.00 N ATOM 2 CA MET A 1 1.603 0.077 25.563 1.00 0.00 C ATOM 3 C MET A 1 2.049 0.794 24.300 1.00 0.00 C ATOM 4 O MET A 1 3.245 0.791 24.032 1.00 0.00 O ATOM 5 CB MET A 1 1.522 1.058 26.741 1.00 0.00 C ATOM 6 CG MET A 1 0.786 0.441 27.935 1.00 0.00 C ATOM 7 SD MET A 1 0.682 1.520 29.388 1.00 0.00 S ATOM 8 CE MET A 1 -0.495 2.780 28.820 1.00 0.00 C ATOM 0 H1 MET A 1 1.934 -1.953 25.851 1.00 0.00 H new ATOM 0 H2 MET A 1 3.214 -1.142 25.085 1.00 0.00 H new ATOM 0 H3 MET A 1 2.963 -0.946 26.753 1.00 0.00 H new ATOM 0 HA MET A 1 0.598 -0.320 25.422 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.528 1.349 27.043 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.008 1.966 26.425 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.223 0.172 27.624 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.290 -0.483 28.219 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.724 3.460 29.640 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.057 3.341 27.994 1.00 0.00 H new ATOM 0 HE3 MET A 1 -1.412 2.296 28.484 1.00 0.00 H new ATOM 20 N ALA A 2 1.144 1.578 23.700 1.00 0.00 N ATOM 21 CA ALA A 2 1.397 2.500 22.583 1.00 0.00 C ATOM 22 C ALA A 2 1.947 1.837 21.298 1.00 0.00 C ATOM 23 O ALA A 2 1.946 0.610 21.164 1.00 0.00 O ATOM 24 CB ALA A 2 2.246 3.682 23.089 1.00 0.00 C ATOM 0 H ALA A 2 0.167 1.588 23.994 1.00 0.00 H new ATOM 0 HA ALA A 2 0.433 2.879 22.245 1.00 0.00 H new ATOM 0 HB1 ALA A 2 2.438 4.371 22.266 1.00 0.00 H new ATOM 0 HB2 ALA A 2 1.708 4.204 23.881 1.00 0.00 H new ATOM 0 HB3 ALA A 2 3.193 3.309 23.479 1.00 0.00 H new ATOM 30 N LEU A 3 2.226 2.682 20.299 1.00 0.00 N ATOM 31 CA LEU A 3 2.634 2.324 18.941 1.00 0.00 C ATOM 32 C LEU A 3 3.955 3.028 18.598 1.00 0.00 C ATOM 33 O LEU A 3 4.017 4.259 18.552 1.00 0.00 O ATOM 34 CB LEU A 3 1.522 2.720 17.945 1.00 0.00 C ATOM 35 CG LEU A 3 0.140 2.086 18.200 1.00 0.00 C ATOM 36 CD1 LEU A 3 -0.897 2.680 17.250 1.00 0.00 C ATOM 37 CD2 LEU A 3 0.159 0.572 17.992 1.00 0.00 C ATOM 0 H LEU A 3 2.169 3.692 20.427 1.00 0.00 H new ATOM 0 HA LEU A 3 2.790 1.247 18.873 1.00 0.00 H new ATOM 0 HB2 LEU A 3 1.413 3.804 17.963 1.00 0.00 H new ATOM 0 HB3 LEU A 3 1.846 2.449 16.940 1.00 0.00 H new ATOM 0 HG LEU A 3 -0.118 2.300 19.237 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -1.868 2.224 17.440 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -0.964 3.756 17.411 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -0.600 2.485 16.219 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -0.835 0.166 18.182 1.00 0.00 H new ATOM 0 HD22 LEU A 3 0.452 0.349 16.966 1.00 0.00 H new ATOM 0 HD23 LEU A 3 0.873 0.119 18.679 1.00 0.00 H new ATOM 49 N GLU A 4 4.998 2.247 18.322 1.00 0.00 N ATOM 50 CA GLU A 4 6.293 2.741 17.833 1.00 0.00 C ATOM 51 C GLU A 4 6.556 2.189 16.425 1.00 0.00 C ATOM 52 O GLU A 4 6.337 1.003 16.189 1.00 0.00 O ATOM 53 CB GLU A 4 7.431 2.384 18.813 1.00 0.00 C ATOM 54 CG GLU A 4 7.227 2.983 20.222 1.00 0.00 C ATOM 55 CD GLU A 4 8.514 3.197 21.054 1.00 0.00 C ATOM 56 OE1 GLU A 4 9.609 3.304 20.452 1.00 0.00 O ATOM 57 OE2 GLU A 4 8.397 3.838 22.121 1.00 0.00 O1- ATOM 0 H GLU A 4 4.971 1.233 18.433 1.00 0.00 H new ATOM 0 HA GLU A 4 6.261 3.829 17.774 1.00 0.00 H new ATOM 0 HB2 GLU A 4 7.507 1.300 18.893 1.00 0.00 H new ATOM 0 HB3 GLU A 4 8.378 2.740 18.407 1.00 0.00 H new ATOM 0 HG2 GLU A 4 6.720 3.942 20.119 1.00 0.00 H new ATOM 0 HG3 GLU A 4 6.559 2.328 20.782 1.00 0.00 H new ATOM 64 N ILE A 5 6.975 3.025 15.471 1.00 0.00 N ATOM 65 CA ILE A 5 7.122 2.641 14.059 1.00 0.00 C ATOM 66 C ILE A 5 8.506 3.016 13.532 1.00 0.00 C ATOM 67 O ILE A 5 8.982 4.130 13.729 1.00 0.00 O ATOM 68 CB ILE A 5 5.962 3.180 13.182 1.00 0.00 C ATOM 69 CG1 ILE A 5 6.044 4.695 12.892 1.00 0.00 C ATOM 70 CG2 ILE A 5 4.594 2.814 13.793 1.00 0.00 C ATOM 71 CD1 ILE A 5 4.967 5.215 11.939 1.00 0.00 C ATOM 0 H ILE A 5 7.225 3.997 15.656 1.00 0.00 H new ATOM 0 HA ILE A 5 7.048 1.555 13.996 1.00 0.00 H new ATOM 0 HB ILE A 5 6.069 2.686 12.216 1.00 0.00 H new ATOM 0 HG12 ILE A 5 5.971 5.237 13.835 1.00 0.00 H new ATOM 0 HG13 ILE A 5 7.024 4.919 12.471 1.00 0.00 H new ATOM 0 HG21 ILE A 5 3.797 3.203 13.160 1.00 0.00 H new ATOM 0 HG22 ILE A 5 4.505 1.730 13.863 1.00 0.00 H new ATOM 0 HG23 ILE A 5 4.512 3.250 14.789 1.00 0.00 H new ATOM 0 HD11 ILE A 5 5.099 6.287 11.791 1.00 0.00 H new ATOM 0 HD12 ILE A 5 5.051 4.703 10.980 1.00 0.00 H new ATOM 0 HD13 ILE A 5 3.982 5.026 12.365 1.00 0.00 H new ATOM 83 N CYS A 6 9.131 2.106 12.791 1.00 0.00 N ATOM 84 CA CYS A 6 10.435 2.311 12.173 1.00 0.00 C ATOM 85 C CYS A 6 10.287 2.371 10.650 1.00 0.00 C ATOM 86 O CYS A 6 9.764 1.444 10.023 1.00 0.00 O ATOM 87 CB CYS A 6 11.381 1.198 12.618 1.00 0.00 C ATOM 88 SG CYS A 6 11.546 1.133 14.428 1.00 0.00 S ATOM 0 H CYS A 6 8.735 1.185 12.600 1.00 0.00 H new ATOM 0 HA CYS A 6 10.861 3.262 12.493 1.00 0.00 H new ATOM 0 HB2 CYS A 6 11.012 0.240 12.252 1.00 0.00 H new ATOM 0 HB3 CYS A 6 12.362 1.354 12.169 1.00 0.00 H new ATOM 0 HG CYS A 6 12.357 0.171 14.756 1.00 0.00 H new ATOM 94 N VAL A 7 10.726 3.480 10.053 1.00 0.00 N ATOM 95 CA VAL A 7 10.420 3.845 8.661 1.00 0.00 C ATOM 96 C VAL A 7 11.645 4.394 7.930 1.00 0.00 C ATOM 97 O VAL A 7 12.621 4.807 8.550 1.00 0.00 O ATOM 98 CB VAL A 7 9.234 4.831 8.581 1.00 0.00 C ATOM 99 CG1 VAL A 7 7.940 4.230 9.145 1.00 0.00 C ATOM 100 CG2 VAL A 7 9.511 6.166 9.277 1.00 0.00 C ATOM 0 H VAL A 7 11.315 4.164 10.528 1.00 0.00 H new ATOM 0 HA VAL A 7 10.124 2.928 8.152 1.00 0.00 H new ATOM 0 HB VAL A 7 9.106 5.024 7.516 1.00 0.00 H new ATOM 0 HG11 VAL A 7 7.135 4.961 9.067 1.00 0.00 H new ATOM 0 HG12 VAL A 7 7.676 3.337 8.578 1.00 0.00 H new ATOM 0 HG13 VAL A 7 8.088 3.964 10.192 1.00 0.00 H new ATOM 0 HG21 VAL A 7 8.639 6.813 9.184 1.00 0.00 H new ATOM 0 HG22 VAL A 7 9.721 5.990 10.332 1.00 0.00 H new ATOM 0 HG23 VAL A 7 10.371 6.648 8.811 1.00 0.00 H new ATOM 110 N LYS A 8 11.599 4.392 6.595 1.00 0.00 N ATOM 111 CA LYS A 8 12.668 4.878 5.710 1.00 0.00 C ATOM 112 C LYS A 8 13.032 6.339 6.007 1.00 0.00 C ATOM 113 O LYS A 8 12.294 7.243 5.618 1.00 0.00 O ATOM 114 CB LYS A 8 12.170 4.708 4.264 1.00 0.00 C ATOM 115 CG LYS A 8 13.046 5.312 3.155 1.00 0.00 C ATOM 116 CD LYS A 8 14.257 4.459 2.772 1.00 0.00 C ATOM 117 CE LYS A 8 14.962 5.123 1.582 1.00 0.00 C ATOM 118 NZ LYS A 8 15.967 4.228 0.958 1.00 0.00 N1+ ATOM 0 H LYS A 8 10.791 4.041 6.081 1.00 0.00 H new ATOM 0 HA LYS A 8 13.581 4.305 5.872 1.00 0.00 H new ATOM 0 HB2 LYS A 8 12.058 3.642 4.066 1.00 0.00 H new ATOM 0 HB3 LYS A 8 11.177 5.151 4.192 1.00 0.00 H new ATOM 0 HG2 LYS A 8 12.432 5.468 2.268 1.00 0.00 H new ATOM 0 HG3 LYS A 8 13.395 6.293 3.478 1.00 0.00 H new ATOM 0 HD2 LYS A 8 14.941 4.371 3.616 1.00 0.00 H new ATOM 0 HD3 LYS A 8 13.942 3.449 2.510 1.00 0.00 H new ATOM 0 HE2 LYS A 8 14.221 5.410 0.836 1.00 0.00 H new ATOM 0 HE3 LYS A 8 15.450 6.039 1.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 16.419 4.717 0.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 16.690 3.974 1.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 15.498 3.365 0.616 1.00 0.00 H new ATOM 132 N ALA A 9 14.277 6.555 6.419 1.00 0.00 N ATOM 133 CA ALA A 9 14.951 7.837 6.254 1.00 0.00 C ATOM 134 C ALA A 9 15.388 8.052 4.788 1.00 0.00 C ATOM 135 O ALA A 9 15.719 7.092 4.079 1.00 0.00 O ATOM 136 CB ALA A 9 16.141 7.885 7.212 1.00 0.00 C ATOM 0 H ALA A 9 14.848 5.845 6.877 1.00 0.00 H new ATOM 0 HA ALA A 9 14.265 8.649 6.493 1.00 0.00 H new ATOM 0 HB1 ALA A 9 16.658 8.838 7.102 1.00 0.00 H new ATOM 0 HB2 ALA A 9 15.787 7.780 8.238 1.00 0.00 H new ATOM 0 HB3 ALA A 9 16.828 7.071 6.980 1.00 0.00 H new ATOM 142 N ALA A 10 15.414 9.302 4.326 1.00 0.00 N ATOM 143 CA ALA A 10 15.895 9.649 2.992 1.00 0.00 C ATOM 144 C ALA A 10 17.401 9.385 2.820 1.00 0.00 C ATOM 145 O ALA A 10 18.195 9.482 3.758 1.00 0.00 O ATOM 146 CB ALA A 10 15.541 11.101 2.673 1.00 0.00 C ATOM 0 H ALA A 10 15.100 10.105 4.871 1.00 0.00 H new ATOM 0 HA ALA A 10 15.392 8.998 2.277 1.00 0.00 H new ATOM 0 HB1 ALA A 10 15.903 11.353 1.676 1.00 0.00 H new ATOM 0 HB2 ALA A 10 14.459 11.228 2.709 1.00 0.00 H new ATOM 0 HB3 ALA A 10 16.008 11.759 3.406 1.00 0.00 H new ATOM 152 N VAL A 11 17.802 9.092 1.580 1.00 0.00 N ATOM 153 CA VAL A 11 19.213 8.916 1.208 1.00 0.00 C ATOM 154 C VAL A 11 19.948 10.253 1.360 1.00 0.00 C ATOM 155 O VAL A 11 19.469 11.277 0.885 1.00 0.00 O ATOM 156 CB VAL A 11 19.338 8.357 -0.226 1.00 0.00 C ATOM 157 CG1 VAL A 11 20.802 8.122 -0.616 1.00 0.00 C ATOM 158 CG2 VAL A 11 18.595 7.015 -0.358 1.00 0.00 C ATOM 0 H VAL A 11 17.156 8.969 0.800 1.00 0.00 H new ATOM 0 HA VAL A 11 19.675 8.188 1.875 1.00 0.00 H new ATOM 0 HB VAL A 11 18.898 9.103 -0.888 1.00 0.00 H new ATOM 0 HG11 VAL A 11 20.849 7.729 -1.631 1.00 0.00 H new ATOM 0 HG12 VAL A 11 21.348 9.064 -0.566 1.00 0.00 H new ATOM 0 HG13 VAL A 11 21.251 7.406 0.072 1.00 0.00 H new ATOM 0 HG21 VAL A 11 18.697 6.641 -1.377 1.00 0.00 H new ATOM 0 HG22 VAL A 11 19.022 6.293 0.338 1.00 0.00 H new ATOM 0 HG23 VAL A 11 17.539 7.160 -0.129 1.00 0.00 H new ATOM 168 N GLY A 12 21.018 10.277 2.160 1.00 0.00 N ATOM 169 CA GLY A 12 21.786 11.490 2.483 1.00 0.00 C ATOM 170 C GLY A 12 21.121 12.479 3.458 1.00 0.00 C ATOM 171 O GLY A 12 21.837 13.217 4.129 1.00 0.00 O ATOM 0 H GLY A 12 21.384 9.439 2.612 1.00 0.00 H new ATOM 0 HA2 GLY A 12 22.744 11.186 2.904 1.00 0.00 H new ATOM 0 HA3 GLY A 12 22.000 12.017 1.553 1.00 0.00 H new ATOM 175 N ALA A 13 19.805 12.393 3.674 1.00 0.00 N ATOM 176 CA ALA A 13 19.030 13.320 4.504 1.00 0.00 C ATOM 177 C ALA A 13 18.260 12.577 5.622 1.00 0.00 C ATOM 178 O ALA A 13 17.034 12.451 5.562 1.00 0.00 O ATOM 179 CB ALA A 13 18.136 14.152 3.572 1.00 0.00 C ATOM 0 H ALA A 13 19.233 11.655 3.264 1.00 0.00 H new ATOM 0 HA ALA A 13 19.688 14.002 5.042 1.00 0.00 H new ATOM 0 HB1 ALA A 13 17.546 14.852 4.163 1.00 0.00 H new ATOM 0 HB2 ALA A 13 18.759 14.705 2.869 1.00 0.00 H new ATOM 0 HB3 ALA A 13 17.468 13.489 3.022 1.00 0.00 H new ATOM 185 N PRO A 14 18.945 12.075 6.670 1.00 0.00 N ATOM 186 CA PRO A 14 18.360 11.139 7.636 1.00 0.00 C ATOM 187 C PRO A 14 17.198 11.703 8.478 1.00 0.00 C ATOM 188 O PRO A 14 16.482 10.942 9.123 1.00 0.00 O ATOM 189 CB PRO A 14 19.527 10.679 8.519 1.00 0.00 C ATOM 190 CG PRO A 14 20.533 11.824 8.414 1.00 0.00 C ATOM 191 CD PRO A 14 20.353 12.291 6.972 1.00 0.00 C ATOM 0 HA PRO A 14 17.887 10.319 7.096 1.00 0.00 H new ATOM 0 HB2 PRO A 14 19.210 10.517 9.549 1.00 0.00 H new ATOM 0 HB3 PRO A 14 19.951 9.739 8.165 1.00 0.00 H new ATOM 0 HG2 PRO A 14 20.319 12.619 9.128 1.00 0.00 H new ATOM 0 HG3 PRO A 14 21.552 11.488 8.608 1.00 0.00 H new ATOM 0 HD2 PRO A 14 20.622 13.342 6.863 1.00 0.00 H new ATOM 0 HD3 PRO A 14 20.992 11.726 6.293 1.00 0.00 H new ATOM 199 N ASN A 15 17.008 13.025 8.498 1.00 0.00 N ATOM 200 CA ASN A 15 15.959 13.711 9.257 1.00 0.00 C ATOM 201 C ASN A 15 14.587 13.790 8.552 1.00 0.00 C ATOM 202 O ASN A 15 13.660 14.351 9.134 1.00 0.00 O ATOM 203 CB ASN A 15 16.478 15.104 9.655 1.00 0.00 C ATOM 204 CG ASN A 15 17.744 15.024 10.484 1.00 0.00 C ATOM 205 OD1 ASN A 15 18.847 14.995 9.972 1.00 0.00 O ATOM 206 ND2 ASN A 15 17.624 14.860 11.781 1.00 0.00 N ATOM 0 H ASN A 15 17.599 13.667 7.970 1.00 0.00 H new ATOM 0 HA ASN A 15 15.755 13.108 10.142 1.00 0.00 H new ATOM 0 HB2 ASN A 15 16.670 15.690 8.756 1.00 0.00 H new ATOM 0 HB3 ASN A 15 15.708 15.630 10.219 1.00 0.00 H new ATOM 0 HD21 ASN A 15 18.454 14.709 12.355 1.00 0.00 H new ATOM 0 HD22 ASN A 15 16.701 14.884 12.215 1.00 0.00 H new ATOM 213 N ILE A 16 14.440 13.256 7.332 1.00 0.00 N ATOM 214 CA ILE A 16 13.181 13.258 6.561 1.00 0.00 C ATOM 215 C ILE A 16 12.893 11.890 5.921 1.00 0.00 C ATOM 216 O ILE A 16 13.763 11.022 5.859 1.00 0.00 O ATOM 217 CB ILE A 16 13.165 14.399 5.513 1.00 0.00 C ATOM 218 CG1 ILE A 16 14.278 14.236 4.458 1.00 0.00 C ATOM 219 CG2 ILE A 16 13.218 15.778 6.195 1.00 0.00 C ATOM 220 CD1 ILE A 16 14.170 15.211 3.282 1.00 0.00 C ATOM 0 H ILE A 16 15.208 12.800 6.839 1.00 0.00 H new ATOM 0 HA ILE A 16 12.372 13.449 7.266 1.00 0.00 H new ATOM 0 HB ILE A 16 12.219 14.333 4.976 1.00 0.00 H new ATOM 0 HG12 ILE A 16 15.245 14.372 4.942 1.00 0.00 H new ATOM 0 HG13 ILE A 16 14.254 13.216 4.074 1.00 0.00 H new ATOM 0 HG21 ILE A 16 13.206 16.560 5.436 1.00 0.00 H new ATOM 0 HG22 ILE A 16 12.354 15.894 6.849 1.00 0.00 H new ATOM 0 HG23 ILE A 16 14.132 15.858 6.783 1.00 0.00 H new ATOM 0 HD11 ILE A 16 14.989 15.032 2.585 1.00 0.00 H new ATOM 0 HD12 ILE A 16 13.219 15.061 2.771 1.00 0.00 H new ATOM 0 HD13 ILE A 16 14.226 16.235 3.652 1.00 0.00 H new ATOM 232 N LEU A 17 11.654 11.685 5.462 1.00 0.00 N ATOM 233 CA LEU A 17 11.239 10.493 4.709 1.00 0.00 C ATOM 234 C LEU A 17 11.784 10.512 3.269 1.00 0.00 C ATOM 235 O LEU A 17 11.749 11.552 2.612 1.00 0.00 O ATOM 236 CB LEU A 17 9.699 10.390 4.685 1.00 0.00 C ATOM 237 CG LEU A 17 9.024 10.224 6.059 1.00 0.00 C ATOM 238 CD1 LEU A 17 7.509 10.371 5.912 1.00 0.00 C ATOM 239 CD2 LEU A 17 9.304 8.856 6.684 1.00 0.00 C ATOM 0 H LEU A 17 10.897 12.353 5.605 1.00 0.00 H new ATOM 0 HA LEU A 17 11.655 9.621 5.214 1.00 0.00 H new ATOM 0 HB2 LEU A 17 9.300 11.286 4.209 1.00 0.00 H new ATOM 0 HB3 LEU A 17 9.419 9.544 4.057 1.00 0.00 H new ATOM 0 HG LEU A 17 9.437 10.996 6.708 1.00 0.00 H new ATOM 0 HD11 LEU A 17 7.036 10.253 6.887 1.00 0.00 H new ATOM 0 HD12 LEU A 17 7.276 11.358 5.513 1.00 0.00 H new ATOM 0 HD13 LEU A 17 7.134 9.607 5.231 1.00 0.00 H new ATOM 0 HD21 LEU A 17 8.806 8.789 7.651 1.00 0.00 H new ATOM 0 HD22 LEU A 17 8.927 8.072 6.027 1.00 0.00 H new ATOM 0 HD23 LEU A 17 10.378 8.731 6.820 1.00 0.00 H new ATOM 251 N GLY A 18 12.097 9.329 2.731 1.00 0.00 N ATOM 252 CA GLY A 18 12.384 9.099 1.304 1.00 0.00 C ATOM 253 C GLY A 18 11.662 7.857 0.761 1.00 0.00 C ATOM 254 O GLY A 18 10.746 7.353 1.408 1.00 0.00 O ATOM 0 H GLY A 18 12.161 8.478 3.289 1.00 0.00 H new ATOM 0 HA2 GLY A 18 12.081 9.974 0.729 1.00 0.00 H new ATOM 0 HA3 GLY A 18 13.459 8.982 1.165 1.00 0.00 H new ATOM 258 N ASP A 19 12.136 7.280 -0.352 1.00 0.00 N ATOM 259 CA ASP A 19 11.523 6.086 -0.974 1.00 0.00 C ATOM 260 C ASP A 19 11.470 4.852 -0.039 1.00 0.00 C ATOM 261 O ASP A 19 12.393 4.027 0.042 1.00 0.00 O ATOM 262 CB ASP A 19 12.196 5.755 -2.318 1.00 0.00 C ATOM 263 CG ASP A 19 11.626 4.521 -3.051 1.00 0.00 C ATOM 264 OD1 ASP A 19 10.795 3.796 -2.451 1.00 0.00 O ATOM 265 OD2 ASP A 19 12.410 3.963 -3.846 1.00 0.00 O1- ATOM 0 H ASP A 19 12.956 7.624 -0.851 1.00 0.00 H new ATOM 0 HA ASP A 19 10.482 6.346 -1.166 1.00 0.00 H new ATOM 0 HB2 ASP A 19 12.107 6.621 -2.974 1.00 0.00 H new ATOM 0 HB3 ASP A 19 13.260 5.595 -2.144 1.00 0.00 H new ATOM 270 N CYS A 20 10.299 4.673 0.560 1.00 0.00 N ATOM 271 CA CYS A 20 9.670 3.382 0.819 1.00 0.00 C ATOM 272 C CYS A 20 8.140 3.580 0.882 1.00 0.00 C ATOM 273 O CYS A 20 7.608 3.883 1.956 1.00 0.00 O ATOM 274 CB CYS A 20 10.227 2.764 2.105 1.00 0.00 C ATOM 275 SG CYS A 20 9.871 1.003 2.164 1.00 0.00 S ATOM 0 H CYS A 20 9.737 5.456 0.893 1.00 0.00 H new ATOM 0 HA CYS A 20 9.895 2.683 0.013 1.00 0.00 H new ATOM 0 HB2 CYS A 20 11.304 2.925 2.156 1.00 0.00 H new ATOM 0 HB3 CYS A 20 9.789 3.259 2.972 1.00 0.00 H new ATOM 280 N PRO A 21 7.378 3.355 -0.219 1.00 0.00 N ATOM 281 CA PRO A 21 5.922 3.520 -0.207 1.00 0.00 C ATOM 282 C PRO A 21 5.227 2.516 0.725 1.00 0.00 C ATOM 283 O PRO A 21 4.139 2.793 1.217 1.00 0.00 O ATOM 284 CB PRO A 21 5.480 3.357 -1.664 1.00 0.00 C ATOM 285 CG PRO A 21 6.578 2.493 -2.286 1.00 0.00 C ATOM 286 CD PRO A 21 7.835 2.945 -1.543 1.00 0.00 C ATOM 0 HA PRO A 21 5.640 4.496 0.188 1.00 0.00 H new ATOM 0 HB2 PRO A 21 4.505 2.876 -1.734 1.00 0.00 H new ATOM 0 HB3 PRO A 21 5.397 4.321 -2.167 1.00 0.00 H new ATOM 0 HG2 PRO A 21 6.385 1.430 -2.142 1.00 0.00 H new ATOM 0 HG3 PRO A 21 6.662 2.659 -3.360 1.00 0.00 H new ATOM 0 HD2 PRO A 21 8.563 2.136 -1.474 1.00 0.00 H new ATOM 0 HD3 PRO A 21 8.323 3.770 -2.063 1.00 0.00 H new ATOM 294 N PHE A 22 5.892 1.409 1.070 1.00 0.00 N ATOM 295 CA PHE A 22 5.438 0.443 2.072 1.00 0.00 C ATOM 296 C PHE A 22 5.403 1.030 3.496 1.00 0.00 C ATOM 297 O PHE A 22 4.399 0.877 4.184 1.00 0.00 O ATOM 298 CB PHE A 22 6.337 -0.800 2.002 1.00 0.00 C ATOM 299 CG PHE A 22 6.529 -1.383 0.608 1.00 0.00 C ATOM 300 CD1 PHE A 22 5.525 -2.184 0.033 1.00 0.00 C ATOM 301 CD2 PHE A 22 7.728 -1.166 -0.100 1.00 0.00 C ATOM 302 CE1 PHE A 22 5.726 -2.787 -1.221 1.00 0.00 C ATOM 303 CE2 PHE A 22 7.924 -1.754 -1.362 1.00 0.00 C ATOM 304 CZ PHE A 22 6.926 -2.572 -1.921 1.00 0.00 C ATOM 0 H PHE A 22 6.785 1.154 0.648 1.00 0.00 H new ATOM 0 HA PHE A 22 4.408 0.170 1.843 1.00 0.00 H new ATOM 0 HB2 PHE A 22 7.315 -0.545 2.410 1.00 0.00 H new ATOM 0 HB3 PHE A 22 5.914 -1.571 2.646 1.00 0.00 H new ATOM 0 HD1 PHE A 22 4.594 -2.337 0.559 1.00 0.00 H new ATOM 0 HD2 PHE A 22 8.500 -0.545 0.329 1.00 0.00 H new ATOM 0 HE1 PHE A 22 4.958 -3.416 -1.647 1.00 0.00 H new ATOM 0 HE2 PHE A 22 8.842 -1.577 -1.903 1.00 0.00 H new ATOM 0 HZ PHE A 22 7.081 -3.034 -2.885 1.00 0.00 H new ATOM 314 N CYS A 23 6.367 1.887 3.870 1.00 0.00 N ATOM 315 CA CYS A 23 6.293 2.670 5.114 1.00 0.00 C ATOM 316 C CYS A 23 5.135 3.670 5.098 1.00 0.00 C ATOM 317 O CYS A 23 4.470 3.874 6.113 1.00 0.00 O ATOM 318 CB CYS A 23 7.595 3.453 5.341 1.00 0.00 C ATOM 319 SG CYS A 23 9.011 2.361 5.620 1.00 0.00 S ATOM 0 H CYS A 23 7.212 2.056 3.324 1.00 0.00 H new ATOM 0 HA CYS A 23 6.133 1.952 5.919 1.00 0.00 H new ATOM 0 HB2 CYS A 23 7.792 4.086 4.476 1.00 0.00 H new ATOM 0 HB3 CYS A 23 7.474 4.114 6.199 1.00 0.00 H new ATOM 0 HG CYS A 23 9.359 1.806 4.497 1.00 0.00 H new ATOM 325 N GLN A 24 4.887 4.281 3.940 1.00 0.00 N ATOM 326 CA GLN A 24 3.860 5.302 3.779 1.00 0.00 C ATOM 327 C GLN A 24 2.432 4.748 3.975 1.00 0.00 C ATOM 328 O GLN A 24 1.615 5.434 4.586 1.00 0.00 O ATOM 329 CB GLN A 24 4.085 5.977 2.419 1.00 0.00 C ATOM 330 CG GLN A 24 3.363 7.324 2.313 1.00 0.00 C ATOM 331 CD GLN A 24 3.437 7.969 0.930 1.00 0.00 C ATOM 332 OE1 GLN A 24 4.163 7.548 0.044 1.00 0.00 O ATOM 333 NE2 GLN A 24 2.551 8.896 0.644 1.00 0.00 N ATOM 0 H GLN A 24 5.399 4.077 3.082 1.00 0.00 H new ATOM 0 HA GLN A 24 3.949 6.052 4.565 1.00 0.00 H new ATOM 0 HB2 GLN A 24 5.153 6.126 2.262 1.00 0.00 H new ATOM 0 HB3 GLN A 24 3.736 5.316 1.626 1.00 0.00 H new ATOM 0 HG2 GLN A 24 2.316 7.184 2.580 1.00 0.00 H new ATOM 0 HG3 GLN A 24 3.789 8.010 3.045 1.00 0.00 H new ATOM 0 HE21 GLN A 24 1.937 9.258 1.374 1.00 0.00 H new ATOM 0 HE22 GLN A 24 2.477 9.254 -0.308 1.00 0.00 H new ATOM 342 N ARG A 25 2.214 3.439 3.742 1.00 0.00 N ATOM 343 CA ARG A 25 0.977 2.713 4.113 1.00 0.00 C ATOM 344 C ARG A 25 0.668 2.772 5.612 1.00 0.00 C ATOM 345 O ARG A 25 -0.485 2.933 5.999 1.00 0.00 O ATOM 346 CB ARG A 25 1.076 1.222 3.748 1.00 0.00 C ATOM 347 CG ARG A 25 1.381 0.891 2.284 1.00 0.00 C ATOM 348 CD ARG A 25 1.481 -0.635 2.165 1.00 0.00 C ATOM 349 NE ARG A 25 1.113 -1.158 0.839 1.00 0.00 N ATOM 350 CZ ARG A 25 1.277 -2.429 0.507 1.00 0.00 C ATOM 351 NH1 ARG A 25 2.103 -3.216 1.110 1.00 0.00 N1+ ATOM 352 NH2 ARG A 25 0.654 -2.968 -0.491 1.00 0.00 N ATOM 0 H ARG A 25 2.903 2.843 3.283 1.00 0.00 H new ATOM 0 HA ARG A 25 0.185 3.213 3.556 1.00 0.00 H new ATOM 0 HB2 ARG A 25 1.851 0.771 4.367 1.00 0.00 H new ATOM 0 HB3 ARG A 25 0.134 0.743 4.016 1.00 0.00 H new ATOM 0 HG2 ARG A 25 0.596 1.275 1.633 1.00 0.00 H new ATOM 0 HG3 ARG A 25 2.313 1.361 1.971 1.00 0.00 H new ATOM 0 HD2 ARG A 25 2.502 -0.941 2.394 1.00 0.00 H new ATOM 0 HD3 ARG A 25 0.835 -1.091 2.916 1.00 0.00 H new ATOM 0 HE ARG A 25 0.717 -0.518 0.151 1.00 0.00 H new ATOM 0 HH11 ARG A 25 2.669 -2.866 1.883 1.00 0.00 H new ATOM 0 HH12 ARG A 25 2.190 -4.188 0.813 1.00 0.00 H new ATOM 0 HH21 ARG A 25 0.011 -2.410 -1.052 1.00 0.00 H new ATOM 0 HH22 ARG A 25 0.806 -3.951 -0.716 1.00 0.00 H new ATOM 366 N VAL A 26 1.698 2.587 6.441 1.00 0.00 N ATOM 367 CA VAL A 26 1.579 2.505 7.907 1.00 0.00 C ATOM 368 C VAL A 26 1.269 3.878 8.504 1.00 0.00 C ATOM 369 O VAL A 26 0.352 4.001 9.307 1.00 0.00 O ATOM 370 CB VAL A 26 2.862 1.906 8.521 1.00 0.00 C ATOM 371 CG1 VAL A 26 2.784 1.797 10.048 1.00 0.00 C ATOM 372 CG2 VAL A 26 3.153 0.505 7.958 1.00 0.00 C ATOM 0 H VAL A 26 2.658 2.488 6.111 1.00 0.00 H new ATOM 0 HA VAL A 26 0.748 1.842 8.149 1.00 0.00 H new ATOM 0 HB VAL A 26 3.664 2.594 8.252 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.711 1.370 10.430 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.638 2.788 10.477 1.00 0.00 H new ATOM 0 HG13 VAL A 26 1.948 1.155 10.325 1.00 0.00 H new ATOM 0 HG21 VAL A 26 4.063 0.112 8.412 1.00 0.00 H new ATOM 0 HG22 VAL A 26 2.319 -0.159 8.185 1.00 0.00 H new ATOM 0 HG23 VAL A 26 3.284 0.567 6.878 1.00 0.00 H new ATOM 382 N LEU A 27 1.900 4.936 7.984 1.00 0.00 N ATOM 383 CA LEU A 27 1.546 6.320 8.322 1.00 0.00 C ATOM 384 C LEU A 27 0.098 6.652 7.917 1.00 0.00 C ATOM 385 O LEU A 27 -0.650 7.207 8.716 1.00 0.00 O ATOM 386 CB LEU A 27 2.540 7.284 7.644 1.00 0.00 C ATOM 387 CG LEU A 27 4.002 7.155 8.110 1.00 0.00 C ATOM 388 CD1 LEU A 27 4.931 7.897 7.145 1.00 0.00 C ATOM 389 CD2 LEU A 27 4.199 7.755 9.502 1.00 0.00 C ATOM 0 H LEU A 27 2.669 4.858 7.318 1.00 0.00 H new ATOM 0 HA LEU A 27 1.609 6.438 9.404 1.00 0.00 H new ATOM 0 HB2 LEU A 27 2.503 7.120 6.567 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.208 8.307 7.822 1.00 0.00 H new ATOM 0 HG LEU A 27 4.239 6.091 8.135 1.00 0.00 H new ATOM 0 HD11 LEU A 27 5.962 7.799 7.485 1.00 0.00 H new ATOM 0 HD12 LEU A 27 4.836 7.469 6.147 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.658 8.952 7.115 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.242 7.647 9.800 1.00 0.00 H new ATOM 0 HD22 LEU A 27 3.934 8.812 9.483 1.00 0.00 H new ATOM 0 HD23 LEU A 27 3.561 7.234 10.216 1.00 0.00 H new ATOM 401 N LEU A 28 -0.336 6.180 6.746 1.00 0.00 N ATOM 402 CA LEU A 28 -1.678 6.396 6.205 1.00 0.00 C ATOM 403 C LEU A 28 -2.795 5.831 7.101 1.00 0.00 C ATOM 404 O LEU A 28 -3.721 6.573 7.434 1.00 0.00 O ATOM 405 CB LEU A 28 -1.663 5.879 4.748 1.00 0.00 C ATOM 406 CG LEU A 28 -2.973 5.361 4.135 1.00 0.00 C ATOM 407 CD1 LEU A 28 -4.081 6.398 4.026 1.00 0.00 C ATOM 408 CD2 LEU A 28 -2.691 4.854 2.720 1.00 0.00 C ATOM 0 H LEU A 28 0.255 5.621 6.131 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.930 7.457 6.193 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.299 6.688 4.114 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -0.930 5.074 4.691 1.00 0.00 H new ATOM 0 HG LEU A 28 -3.323 4.582 4.813 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -4.965 5.940 3.582 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -4.327 6.774 5.019 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.746 7.224 3.398 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -3.615 4.484 2.275 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.297 5.669 2.113 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -1.960 4.047 2.762 1.00 0.00 H new ATOM 420 N SER A 29 -2.697 4.587 7.585 1.00 0.00 N ATOM 421 CA SER A 29 -3.749 4.032 8.458 1.00 0.00 C ATOM 422 C SER A 29 -3.745 4.626 9.873 1.00 0.00 C ATOM 423 O SER A 29 -4.815 4.925 10.410 1.00 0.00 O ATOM 424 CB SER A 29 -3.693 2.506 8.510 1.00 0.00 C ATOM 425 OG SER A 29 -2.586 2.010 9.232 1.00 0.00 O ATOM 0 H SER A 29 -1.920 3.954 7.395 1.00 0.00 H new ATOM 0 HA SER A 29 -4.693 4.328 8.001 1.00 0.00 H new ATOM 0 HB2 SER A 29 -4.611 2.131 8.964 1.00 0.00 H new ATOM 0 HB3 SER A 29 -3.658 2.116 7.493 1.00 0.00 H new ATOM 0 HG SER A 29 -2.607 1.030 9.231 1.00 0.00 H new ATOM 431 N LEU A 30 -2.570 4.974 10.412 1.00 0.00 N ATOM 432 CA LEU A 30 -2.453 5.676 11.695 1.00 0.00 C ATOM 433 C LEU A 30 -3.071 7.082 11.640 1.00 0.00 C ATOM 434 O LEU A 30 -3.824 7.456 12.539 1.00 0.00 O ATOM 435 CB LEU A 30 -0.974 5.749 12.116 1.00 0.00 C ATOM 436 CG LEU A 30 -0.331 4.381 12.412 1.00 0.00 C ATOM 437 CD1 LEU A 30 1.185 4.530 12.510 1.00 0.00 C ATOM 438 CD2 LEU A 30 -0.822 3.777 13.727 1.00 0.00 C ATOM 0 H LEU A 30 -1.672 4.776 9.970 1.00 0.00 H new ATOM 0 HA LEU A 30 -3.013 5.110 12.440 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.407 6.240 11.325 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.892 6.376 13.004 1.00 0.00 H new ATOM 0 HG LEU A 30 -0.615 3.721 11.593 1.00 0.00 H new ATOM 0 HD11 LEU A 30 1.633 3.559 12.719 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.575 4.914 11.567 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.431 5.224 13.314 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.338 2.814 13.888 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -0.576 4.448 14.550 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -1.902 3.638 13.682 1.00 0.00 H new ATOM 450 N GLU A 31 -2.866 7.813 10.545 1.00 0.00 N ATOM 451 CA GLU A 31 -3.408 9.163 10.360 1.00 0.00 C ATOM 452 C GLU A 31 -4.884 9.200 9.921 1.00 0.00 C ATOM 453 O GLU A 31 -5.600 10.104 10.345 1.00 0.00 O ATOM 454 CB GLU A 31 -2.511 9.947 9.390 1.00 0.00 C ATOM 455 CG GLU A 31 -1.112 10.256 9.957 1.00 0.00 C ATOM 456 CD GLU A 31 -1.106 11.152 11.206 1.00 0.00 C ATOM 457 OE1 GLU A 31 -2.178 11.694 11.567 1.00 0.00 O ATOM 458 OE2 GLU A 31 0.001 11.608 11.571 1.00 0.00 O1- ATOM 0 H GLU A 31 -2.314 7.484 9.753 1.00 0.00 H new ATOM 0 HA GLU A 31 -3.402 9.642 11.339 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -2.402 9.377 8.467 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -3.003 10.884 9.129 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -0.618 9.315 10.200 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -0.518 10.737 9.179 1.00 0.00 H new ATOM 465 N GLU A 32 -5.409 8.138 9.294 1.00 0.00 N ATOM 466 CA GLU A 32 -6.862 7.936 9.127 1.00 0.00 C ATOM 467 C GLU A 32 -7.566 7.732 10.483 1.00 0.00 C ATOM 468 O GLU A 32 -8.545 8.410 10.816 1.00 0.00 O ATOM 469 CB GLU A 32 -7.111 6.716 8.212 1.00 0.00 C ATOM 470 CG GLU A 32 -8.586 6.441 7.869 1.00 0.00 C ATOM 471 CD GLU A 32 -9.300 7.568 7.107 1.00 0.00 C ATOM 472 OE1 GLU A 32 -8.651 8.508 6.586 1.00 0.00 O ATOM 473 OE2 GLU A 32 -10.530 7.480 6.918 1.00 0.00 O1- ATOM 0 H GLU A 32 -4.842 7.394 8.887 1.00 0.00 H new ATOM 0 HA GLU A 32 -7.280 8.833 8.669 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -6.560 6.861 7.283 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -6.696 5.831 8.694 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -8.640 5.530 7.273 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -9.128 6.249 8.795 1.00 0.00 H new ATOM 480 N LYS A 33 -6.974 6.896 11.346 1.00 0.00 N ATOM 481 CA LYS A 33 -7.411 6.722 12.740 1.00 0.00 C ATOM 482 C LYS A 33 -7.143 7.957 13.600 1.00 0.00 C ATOM 483 O LYS A 33 -7.935 8.227 14.496 1.00 0.00 O ATOM 484 CB LYS A 33 -6.714 5.494 13.342 1.00 0.00 C ATOM 485 CG LYS A 33 -7.176 4.174 12.705 1.00 0.00 C ATOM 486 CD LYS A 33 -6.402 2.998 13.317 1.00 0.00 C ATOM 487 CE LYS A 33 -6.584 1.725 12.492 1.00 0.00 C ATOM 488 NZ LYS A 33 -7.954 1.169 12.528 1.00 0.00 N1+ ATOM 0 H LYS A 33 -6.173 6.317 11.096 1.00 0.00 H new ATOM 0 HA LYS A 33 -8.491 6.575 12.732 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -5.636 5.595 13.215 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.907 5.462 14.414 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -8.246 4.038 12.864 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -7.015 4.205 11.627 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -5.343 3.248 13.375 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -6.745 2.825 14.337 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -6.317 1.935 11.456 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -5.887 0.969 12.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -7.907 0.130 12.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -8.446 1.513 13.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -8.474 1.472 11.680 1.00 0.00 H new ATOM 502 N LYS A 34 -6.187 8.818 13.230 1.00 0.00 N ATOM 503 CA LYS A 34 -5.663 9.948 14.034 1.00 0.00 C ATOM 504 C LYS A 34 -5.052 9.484 15.372 1.00 0.00 C ATOM 505 O LYS A 34 -5.059 10.228 16.351 1.00 0.00 O ATOM 506 CB LYS A 34 -6.735 11.045 14.231 1.00 0.00 C ATOM 507 CG LYS A 34 -7.488 11.463 12.950 1.00 0.00 C ATOM 508 CD LYS A 34 -8.837 12.150 13.233 1.00 0.00 C ATOM 509 CE LYS A 34 -9.834 11.334 14.083 1.00 0.00 C ATOM 510 NZ LYS A 34 -9.946 9.917 13.651 1.00 0.00 N1+ ATOM 0 H LYS A 34 -5.731 8.749 12.320 1.00 0.00 H new ATOM 0 HA LYS A 34 -4.846 10.392 13.466 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -7.462 10.693 14.963 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -6.256 11.927 14.656 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -6.858 12.139 12.371 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -7.660 10.581 12.334 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -8.644 13.096 13.740 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -9.310 12.389 12.280 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -9.523 11.366 15.127 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -10.817 11.803 14.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -10.853 9.525 13.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -9.900 9.866 12.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -9.164 9.367 14.060 1.00 0.00 H new ATOM 524 N ILE A 35 -4.705 8.199 15.458 1.00 0.00 N ATOM 525 CA ILE A 35 -4.271 7.520 16.685 1.00 0.00 C ATOM 526 C ILE A 35 -2.835 7.954 17.045 1.00 0.00 C ATOM 527 O ILE A 35 -2.019 8.103 16.138 1.00 0.00 O ATOM 528 CB ILE A 35 -4.428 5.989 16.498 1.00 0.00 C ATOM 529 CG1 ILE A 35 -4.348 5.226 17.834 1.00 0.00 C ATOM 530 CG2 ILE A 35 -3.416 5.414 15.489 1.00 0.00 C ATOM 531 CD1 ILE A 35 -4.736 3.746 17.722 1.00 0.00 C ATOM 0 H ILE A 35 -4.718 7.579 14.648 1.00 0.00 H new ATOM 0 HA ILE A 35 -4.896 7.805 17.531 1.00 0.00 H new ATOM 0 HB ILE A 35 -5.427 5.842 16.088 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.332 5.298 18.223 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -5.002 5.710 18.559 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.568 4.339 15.394 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -3.561 5.888 14.518 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.402 5.608 15.840 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -4.656 3.274 18.701 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -5.762 3.665 17.363 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -4.066 3.246 17.022 1.00 0.00 H new ATOM 543 N PRO A 36 -2.472 8.181 18.323 1.00 0.00 N ATOM 544 CA PRO A 36 -1.111 8.585 18.678 1.00 0.00 C ATOM 545 C PRO A 36 -0.088 7.469 18.404 1.00 0.00 C ATOM 546 O PRO A 36 -0.211 6.353 18.912 1.00 0.00 O ATOM 547 CB PRO A 36 -1.170 8.991 20.154 1.00 0.00 C ATOM 548 CG PRO A 36 -2.367 8.210 20.693 1.00 0.00 C ATOM 549 CD PRO A 36 -3.324 8.180 19.502 1.00 0.00 C ATOM 0 HA PRO A 36 -0.768 9.418 18.064 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -0.251 8.729 20.679 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -1.308 10.066 20.269 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -2.084 7.206 21.009 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -2.814 8.702 21.557 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -3.957 7.293 19.529 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.987 9.045 19.509 1.00 0.00 H new ATOM 557 N TYR A 37 1.014 7.839 17.748 1.00 0.00 N ATOM 558 CA TYR A 37 2.164 6.982 17.438 1.00 0.00 C ATOM 559 C TYR A 37 3.486 7.754 17.580 1.00 0.00 C ATOM 560 O TYR A 37 3.503 8.978 17.717 1.00 0.00 O ATOM 561 CB TYR A 37 2.013 6.385 16.024 1.00 0.00 C ATOM 562 CG TYR A 37 2.102 7.392 14.884 1.00 0.00 C ATOM 563 CD1 TYR A 37 0.953 8.108 14.506 1.00 0.00 C ATOM 564 CD2 TYR A 37 3.313 7.612 14.195 1.00 0.00 C ATOM 565 CE1 TYR A 37 1.005 9.066 13.479 1.00 0.00 C ATOM 566 CE2 TYR A 37 3.366 8.563 13.152 1.00 0.00 C ATOM 567 CZ TYR A 37 2.215 9.303 12.799 1.00 0.00 C ATOM 568 OH TYR A 37 2.280 10.241 11.817 1.00 0.00 O ATOM 0 H TYR A 37 1.136 8.790 17.401 1.00 0.00 H new ATOM 0 HA TYR A 37 2.190 6.163 18.157 1.00 0.00 H new ATOM 0 HB2 TYR A 37 2.785 5.629 15.881 1.00 0.00 H new ATOM 0 HB3 TYR A 37 1.052 5.874 15.963 1.00 0.00 H new ATOM 0 HD1 TYR A 37 0.017 7.919 15.012 1.00 0.00 H new ATOM 0 HD2 TYR A 37 4.198 7.054 14.464 1.00 0.00 H new ATOM 0 HE1 TYR A 37 0.117 9.620 13.212 1.00 0.00 H new ATOM 0 HE2 TYR A 37 4.292 8.726 12.621 1.00 0.00 H new ATOM 0 HH TYR A 37 1.373 10.512 11.563 1.00 0.00 H new ATOM 578 N LYS A 38 4.605 7.030 17.528 1.00 0.00 N ATOM 579 CA LYS A 38 5.977 7.551 17.605 1.00 0.00 C ATOM 580 C LYS A 38 6.799 6.962 16.457 1.00 0.00 C ATOM 581 O LYS A 38 6.744 5.754 16.253 1.00 0.00 O ATOM 582 CB LYS A 38 6.515 7.165 18.988 1.00 0.00 C ATOM 583 CG LYS A 38 7.980 7.542 19.261 1.00 0.00 C ATOM 584 CD LYS A 38 8.402 6.854 20.566 1.00 0.00 C ATOM 585 CE LYS A 38 9.918 6.819 20.776 1.00 0.00 C ATOM 586 NZ LYS A 38 10.278 5.709 21.692 1.00 0.00 N1+ ATOM 0 H LYS A 38 4.582 6.015 17.426 1.00 0.00 H new ATOM 0 HA LYS A 38 6.027 8.634 17.497 1.00 0.00 H new ATOM 0 HB2 LYS A 38 5.890 7.637 19.746 1.00 0.00 H new ATOM 0 HB3 LYS A 38 6.407 6.087 19.112 1.00 0.00 H new ATOM 0 HG2 LYS A 38 8.617 7.223 18.437 1.00 0.00 H new ATOM 0 HG3 LYS A 38 8.087 8.623 19.346 1.00 0.00 H new ATOM 0 HD2 LYS A 38 7.939 7.371 21.406 1.00 0.00 H new ATOM 0 HD3 LYS A 38 8.019 5.833 20.570 1.00 0.00 H new ATOM 0 HE2 LYS A 38 10.423 6.690 19.819 1.00 0.00 H new ATOM 0 HE3 LYS A 38 10.258 7.768 21.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 10.940 6.056 22.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 9.419 5.348 22.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 10.727 4.944 21.150 1.00 0.00 H new ATOM 600 N SER A 39 7.471 7.808 15.674 1.00 0.00 N ATOM 601 CA SER A 39 8.147 7.419 14.425 1.00 0.00 C ATOM 602 C SER A 39 9.670 7.562 14.501 1.00 0.00 C ATOM 603 O SER A 39 10.185 8.573 14.982 1.00 0.00 O ATOM 604 CB SER A 39 7.575 8.220 13.252 1.00 0.00 C ATOM 605 OG SER A 39 8.118 7.780 12.024 1.00 0.00 O ATOM 0 H SER A 39 7.565 8.801 15.890 1.00 0.00 H new ATOM 0 HA SER A 39 7.952 6.358 14.266 1.00 0.00 H new ATOM 0 HB2 SER A 39 6.490 8.117 13.231 1.00 0.00 H new ATOM 0 HB3 SER A 39 7.792 9.279 13.391 1.00 0.00 H new ATOM 0 HG SER A 39 7.736 8.306 11.290 1.00 0.00 H new ATOM 611 N HIS A 40 10.382 6.575 13.955 1.00 0.00 N ATOM 612 CA HIS A 40 11.829 6.401 14.060 1.00 0.00 C ATOM 613 C HIS A 40 12.405 6.273 12.646 1.00 0.00 C ATOM 614 O HIS A 40 12.157 5.284 11.950 1.00 0.00 O ATOM 615 CB HIS A 40 12.153 5.145 14.899 1.00 0.00 C ATOM 616 CG HIS A 40 11.559 5.058 16.291 1.00 0.00 C ATOM 617 ND1 HIS A 40 12.233 4.621 17.435 1.00 0.00 N ATOM 618 CD2 HIS A 40 10.440 5.725 16.695 1.00 0.00 C ATOM 619 CE1 HIS A 40 11.515 5.020 18.481 1.00 0.00 C ATOM 620 NE2 HIS A 40 10.413 5.664 18.075 1.00 0.00 N ATOM 0 H HIS A 40 9.942 5.840 13.401 1.00 0.00 H new ATOM 0 HA HIS A 40 12.276 7.261 14.559 1.00 0.00 H new ATOM 0 HB2 HIS A 40 11.822 4.271 14.337 1.00 0.00 H new ATOM 0 HB3 HIS A 40 13.237 5.073 14.991 1.00 0.00 H new ATOM 0 HD1 HIS A 40 13.108 4.097 17.462 1.00 0.00 H new ATOM 0 HD2 HIS A 40 9.714 6.208 16.058 1.00 0.00 H new ATOM 0 HE1 HIS A 40 11.783 4.849 19.513 1.00 0.00 H new ATOM 628 N LEU A 41 13.123 7.301 12.192 1.00 0.00 N ATOM 629 CA LEU A 41 13.719 7.336 10.856 1.00 0.00 C ATOM 630 C LEU A 41 14.982 6.461 10.807 1.00 0.00 C ATOM 631 O LEU A 41 16.007 6.792 11.399 1.00 0.00 O ATOM 632 CB LEU A 41 14.007 8.794 10.444 1.00 0.00 C ATOM 633 CG LEU A 41 12.800 9.751 10.491 1.00 0.00 C ATOM 634 CD1 LEU A 41 13.212 11.116 9.951 1.00 0.00 C ATOM 635 CD2 LEU A 41 11.620 9.254 9.658 1.00 0.00 C ATOM 0 H LEU A 41 13.309 8.138 12.745 1.00 0.00 H new ATOM 0 HA LEU A 41 13.013 6.922 10.135 1.00 0.00 H new ATOM 0 HB2 LEU A 41 14.787 9.189 11.095 1.00 0.00 H new ATOM 0 HB3 LEU A 41 14.408 8.794 9.430 1.00 0.00 H new ATOM 0 HG LEU A 41 12.485 9.808 11.533 1.00 0.00 H new ATOM 0 HD11 LEU A 41 12.358 11.793 9.984 1.00 0.00 H new ATOM 0 HD12 LEU A 41 14.020 11.520 10.561 1.00 0.00 H new ATOM 0 HD13 LEU A 41 13.553 11.012 8.921 1.00 0.00 H new ATOM 0 HD21 LEU A 41 10.799 9.967 9.728 1.00 0.00 H new ATOM 0 HD22 LEU A 41 11.926 9.154 8.617 1.00 0.00 H new ATOM 0 HD23 LEU A 41 11.292 8.285 10.034 1.00 0.00 H new ATOM 647 N ILE A 42 14.890 5.314 10.136 1.00 0.00 N ATOM 648 CA ILE A 42 15.995 4.372 9.941 1.00 0.00 C ATOM 649 C ILE A 42 16.725 4.708 8.638 1.00 0.00 C ATOM 650 O ILE A 42 16.158 4.583 7.547 1.00 0.00 O ATOM 651 CB ILE A 42 15.484 2.913 9.939 1.00 0.00 C ATOM 652 CG1 ILE A 42 14.614 2.551 11.163 1.00 0.00 C ATOM 653 CG2 ILE A 42 16.650 1.917 9.818 1.00 0.00 C ATOM 654 CD1 ILE A 42 15.283 2.711 12.536 1.00 0.00 C ATOM 0 H ILE A 42 14.021 5.004 9.700 1.00 0.00 H new ATOM 0 HA ILE A 42 16.696 4.466 10.770 1.00 0.00 H new ATOM 0 HB ILE A 42 14.840 2.837 9.063 1.00 0.00 H new ATOM 0 HG12 ILE A 42 13.718 3.171 11.143 1.00 0.00 H new ATOM 0 HG13 ILE A 42 14.288 1.516 11.058 1.00 0.00 H new ATOM 0 HG21 ILE A 42 16.261 0.899 9.819 1.00 0.00 H new ATOM 0 HG22 ILE A 42 17.188 2.098 8.888 1.00 0.00 H new ATOM 0 HG23 ILE A 42 17.328 2.047 10.661 1.00 0.00 H new ATOM 0 HD11 ILE A 42 14.579 2.429 13.319 1.00 0.00 H new ATOM 0 HD12 ILE A 42 16.162 2.069 12.590 1.00 0.00 H new ATOM 0 HD13 ILE A 42 15.584 3.749 12.676 1.00 0.00 H new ATOM 666 N ASN A 43 18.016 5.032 8.735 1.00 32.61 N ATOM 667 CA ASN A 43 18.909 4.977 7.583 1.00 29.85 C ATOM 668 C ASN A 43 19.129 3.511 7.181 1.00 30.96 C ATOM 669 O ASN A 43 19.487 2.677 8.007 1.00 31.53 O ATOM 670 CB ASN A 43 20.227 5.696 7.908 1.00 20.00 C ATOM 671 CG ASN A 43 21.193 5.713 6.734 1.00 20.00 C ATOM 672 OD1 ASN A 43 20.863 5.382 5.603 1.00 20.00 O ATOM 673 ND2 ASN A 43 22.435 6.047 6.973 1.00 20.00 N ATOM 0 H ASN A 43 18.463 5.335 9.600 1.00 32.61 H new ATOM 0 HA ASN A 43 18.462 5.493 6.733 1.00 29.85 H new ATOM 0 HB2 ASN A 43 20.012 6.721 8.210 1.00 20.00 H new ATOM 0 HB3 ASN A 43 20.703 5.206 8.757 1.00 20.00 H new ATOM 0 HD21 ASN A 43 23.122 6.031 6.219 1.00 20.00 H new ATOM 0 HD22 ASN A 43 22.717 6.324 7.913 1.00 20.00 H new ATOM 680 N LEU A 44 18.883 3.185 5.913 1.00 29.53 N ATOM 681 CA LEU A 44 19.088 1.833 5.391 1.00 31.37 C ATOM 682 C LEU A 44 20.514 1.599 4.863 1.00 35.41 C ATOM 683 O LEU A 44 20.960 0.455 4.845 1.00 40.05 O ATOM 684 CB LEU A 44 18.006 1.511 4.345 1.00 28.36 C ATOM 685 CG LEU A 44 16.554 1.629 4.859 1.00 28.49 C ATOM 686 CD1 LEU A 44 15.562 1.338 3.733 1.00 25.58 C ATOM 687 CD2 LEU A 44 16.250 0.677 6.018 1.00 28.29 C ATOM 0 H LEU A 44 18.537 3.848 5.219 1.00 29.53 H new ATOM 0 HA LEU A 44 18.984 1.133 6.220 1.00 31.37 H new ATOM 0 HB2 LEU A 44 18.131 2.181 3.495 1.00 28.36 H new ATOM 0 HB3 LEU A 44 18.166 0.497 3.978 1.00 28.36 H new ATOM 0 HG LEU A 44 16.448 2.653 5.218 1.00 28.49 H new ATOM 0 HD11 LEU A 44 14.544 1.426 4.113 1.00 25.58 H new ATOM 0 HD12 LEU A 44 15.710 2.053 2.924 1.00 25.58 H new ATOM 0 HD13 LEU A 44 15.723 0.327 3.358 1.00 25.58 H new ATOM 0 HD21 LEU A 44 15.215 0.808 6.334 1.00 28.29 H new ATOM 0 HD22 LEU A 44 16.403 -0.352 5.693 1.00 28.29 H new ATOM 0 HD23 LEU A 44 16.915 0.897 6.853 1.00 28.29 H new ATOM 699 N GLY A 45 21.276 2.660 4.573 1.00 35.52 N ATOM 700 CA GLY A 45 22.698 2.559 4.215 1.00 39.51 C ATOM 701 C GLY A 45 23.638 2.356 5.410 1.00 39.56 C ATOM 702 O GLY A 45 24.715 1.796 5.242 1.00 41.47 O ATOM 0 H GLY A 45 20.923 3.617 4.580 1.00 35.52 H new ATOM 0 HA2 GLY A 45 22.828 1.729 3.521 1.00 39.51 H new ATOM 0 HA3 GLY A 45 22.993 3.465 3.686 1.00 39.51 H new ATOM 706 N ASP A 46 23.188 2.700 6.619 1.00 38.81 N ATOM 707 CA ASP A 46 23.893 2.494 7.888 1.00 39.47 C ATOM 708 C ASP A 46 22.856 2.238 8.991 1.00 39.74 C ATOM 709 O ASP A 46 22.141 3.158 9.401 1.00 37.65 O ATOM 710 CB ASP A 46 24.781 3.711 8.204 1.00 41.72 C ATOM 711 CG ASP A 46 25.537 3.586 9.529 1.00 45.67 C ATOM 712 OD1 ASP A 46 25.597 2.458 10.070 1.00 45.04 O ATOM 713 OD2 ASP A 46 26.022 4.641 9.996 1.00 47.17 O1- ATOM 0 H ASP A 46 22.282 3.150 6.747 1.00 38.81 H new ATOM 0 HA ASP A 46 24.550 1.627 7.822 1.00 39.47 H new ATOM 0 HB2 ASP A 46 25.500 3.846 7.396 1.00 41.72 H new ATOM 0 HB3 ASP A 46 24.160 4.607 8.232 1.00 41.72 H new ATOM 718 N LYS A 47 22.533 0.952 9.183 1.00 39.47 N ATOM 719 CA LYS A 47 21.433 0.498 10.044 1.00 35.15 C ATOM 720 C LYS A 47 21.911 0.400 11.501 1.00 39.57 C ATOM 721 O LYS A 47 22.873 -0.330 11.749 1.00 41.27 O ATOM 722 CB LYS A 47 20.876 -0.856 9.569 1.00 29.51 C ATOM 723 CG LYS A 47 20.265 -0.796 8.158 1.00 31.72 C ATOM 724 CD LYS A 47 19.646 -2.147 7.768 1.00 30.76 C ATOM 725 CE LYS A 47 19.046 -2.142 6.356 1.00 31.96 C ATOM 726 NZ LYS A 47 20.070 -2.094 5.289 1.00 30.93 N1+ ATOM 0 H LYS A 47 23.037 0.186 8.737 1.00 39.47 H new ATOM 0 HA LYS A 47 20.628 1.230 9.982 1.00 35.15 H new ATOM 0 HB2 LYS A 47 21.677 -1.596 9.581 1.00 29.51 H new ATOM 0 HB3 LYS A 47 20.117 -1.197 10.273 1.00 29.51 H new ATOM 0 HG2 LYS A 47 19.502 -0.018 8.121 1.00 31.72 H new ATOM 0 HG3 LYS A 47 21.034 -0.523 7.436 1.00 31.72 H new ATOM 0 HD2 LYS A 47 20.409 -2.923 7.830 1.00 30.76 H new ATOM 0 HD3 LYS A 47 18.869 -2.406 8.487 1.00 30.76 H new ATOM 0 HE2 LYS A 47 18.435 -3.035 6.225 1.00 31.96 H new ATOM 0 HE3 LYS A 47 18.382 -1.283 6.253 1.00 31.96 H new ATOM 0 HZ1 LYS A 47 19.614 -2.229 4.364 1.00 30.93 H new ATOM 0 HZ2 LYS A 47 20.548 -1.171 5.308 1.00 30.93 H new ATOM 0 HZ3 LYS A 47 20.769 -2.849 5.444 1.00 30.93 H new ATOM 740 N PRO A 48 21.139 0.891 12.492 1.00 38.23 N ATOM 741 CA PRO A 48 21.441 0.664 13.904 1.00 35.91 C ATOM 742 C PRO A 48 21.472 -0.831 14.245 1.00 40.29 C ATOM 743 O PRO A 48 20.569 -1.565 13.853 1.00 33.72 O ATOM 744 CB PRO A 48 20.344 1.393 14.688 1.00 35.76 C ATOM 745 CG PRO A 48 19.822 2.443 13.708 1.00 36.42 C ATOM 746 CD PRO A 48 19.980 1.759 12.353 1.00 34.95 C ATOM 0 HA PRO A 48 22.431 1.041 14.159 1.00 35.91 H new ATOM 0 HB2 PRO A 48 19.554 0.709 14.998 1.00 35.76 H new ATOM 0 HB3 PRO A 48 20.740 1.854 15.593 1.00 35.76 H new ATOM 0 HG2 PRO A 48 18.783 2.702 13.910 1.00 36.42 H new ATOM 0 HG3 PRO A 48 20.397 3.367 13.763 1.00 36.42 H new ATOM 0 HD2 PRO A 48 19.089 1.187 12.095 1.00 34.95 H new ATOM 0 HD3 PRO A 48 20.130 2.490 11.559 1.00 34.95 H new ATOM 754 N GLN A 49 22.411 -1.269 15.089 1.00 42.39 N ATOM 755 CA GLN A 49 22.575 -2.695 15.421 1.00 41.05 C ATOM 756 C GLN A 49 21.321 -3.316 16.067 1.00 41.34 C ATOM 757 O GLN A 49 20.832 -4.339 15.591 1.00 37.50 O ATOM 758 CB GLN A 49 23.792 -2.872 16.342 1.00 20.00 C ATOM 759 CG GLN A 49 25.116 -2.533 15.638 1.00 20.00 C ATOM 760 CD GLN A 49 26.313 -2.693 16.570 1.00 20.00 C ATOM 761 OE1 GLN A 49 26.347 -2.188 17.677 1.00 20.00 O ATOM 762 NE2 GLN A 49 27.368 -3.353 16.146 1.00 20.00 N ATOM 0 H GLN A 49 23.075 -0.655 15.560 1.00 42.39 H new ATOM 0 HA GLN A 49 22.732 -3.227 14.483 1.00 41.05 H new ATOM 0 HB2 GLN A 49 23.676 -2.234 17.218 1.00 20.00 H new ATOM 0 HB3 GLN A 49 23.827 -3.901 16.699 1.00 20.00 H new ATOM 0 HG2 GLN A 49 25.242 -3.181 14.771 1.00 20.00 H new ATOM 0 HG3 GLN A 49 25.078 -1.508 15.268 1.00 20.00 H new ATOM 0 HE21 GLN A 49 27.362 -3.784 15.222 1.00 20.00 H new ATOM 0 HE22 GLN A 49 28.192 -3.434 16.741 1.00 20.00 H new ATOM 771 N TRP A 50 20.670 -2.567 16.963 1.00 35.22 N ATOM 772 CA TRP A 50 19.402 -2.954 17.594 1.00 34.79 C ATOM 773 C TRP A 50 18.215 -3.037 16.624 1.00 35.29 C ATOM 774 O TRP A 50 17.177 -3.592 16.971 1.00 35.60 O ATOM 775 CB TRP A 50 19.094 -1.976 18.738 1.00 30.47 C ATOM 776 CG TRP A 50 19.074 -0.512 18.382 1.00 35.86 C ATOM 777 CD1 TRP A 50 20.043 0.372 18.712 1.00 35.18 C ATOM 778 CD2 TRP A 50 18.070 0.261 17.643 1.00 37.08 C ATOM 779 NE1 TRP A 50 19.724 1.623 18.224 1.00 35.39 N ATOM 780 CE2 TRP A 50 18.525 1.611 17.543 1.00 36.55 C ATOM 781 CE3 TRP A 50 16.821 -0.029 17.047 1.00 33.31 C ATOM 782 CZ2 TRP A 50 17.807 2.605 16.861 1.00 35.77 C ATOM 783 CZ3 TRP A 50 16.093 0.958 16.352 1.00 34.01 C ATOM 784 CH2 TRP A 50 16.586 2.270 16.251 1.00 33.78 C ATOM 0 H TRP A 50 21.014 -1.659 17.276 1.00 35.22 H new ATOM 0 HA TRP A 50 19.534 -3.967 17.974 1.00 34.79 H new ATOM 0 HB2 TRP A 50 18.124 -2.238 19.159 1.00 30.47 H new ATOM 0 HB3 TRP A 50 19.834 -2.126 19.524 1.00 30.47 H new ATOM 0 HD1 TRP A 50 20.934 0.134 19.274 1.00 35.18 H new ATOM 0 HE1 TRP A 50 20.303 2.453 18.351 1.00 35.39 H new ATOM 0 HE3 TRP A 50 16.416 -1.027 17.126 1.00 33.31 H new ATOM 0 HZ2 TRP A 50 18.188 3.614 16.806 1.00 35.77 H new ATOM 0 HZ3 TRP A 50 15.149 0.704 15.893 1.00 34.01 H new ATOM 0 HH2 TRP A 50 16.029 3.018 15.707 1.00 33.78 H new ATOM 795 N PHE A 51 18.322 -2.515 15.398 1.00 35.88 N ATOM 796 CA PHE A 51 17.227 -2.591 14.434 1.00 35.19 C ATOM 797 C PHE A 51 16.952 -4.028 13.964 1.00 33.72 C ATOM 798 O PHE A 51 15.793 -4.390 13.758 1.00 30.05 O ATOM 799 CB PHE A 51 17.516 -1.650 13.257 1.00 20.00 C ATOM 800 CG PHE A 51 16.352 -1.544 12.304 1.00 20.00 C ATOM 801 CD1 PHE A 51 15.108 -1.110 12.793 1.00 20.00 C ATOM 802 CD2 PHE A 51 16.478 -1.959 10.965 1.00 20.00 C ATOM 803 CE1 PHE A 51 13.982 -1.144 11.963 1.00 20.00 C ATOM 804 CE2 PHE A 51 15.350 -1.959 10.126 1.00 20.00 C ATOM 805 CZ PHE A 51 14.098 -1.577 10.633 1.00 20.00 C ATOM 0 H PHE A 51 19.155 -2.037 15.053 1.00 35.88 H new ATOM 0 HA PHE A 51 16.313 -2.266 14.931 1.00 35.19 H new ATOM 0 HB2 PHE A 51 17.760 -0.659 13.640 1.00 20.00 H new ATOM 0 HB3 PHE A 51 18.393 -2.008 12.717 1.00 20.00 H new ATOM 0 HD1 PHE A 51 15.021 -0.751 13.808 1.00 20.00 H new ATOM 0 HD2 PHE A 51 17.437 -2.276 10.584 1.00 20.00 H new ATOM 0 HE1 PHE A 51 13.021 -0.836 12.347 1.00 20.00 H new ATOM 0 HE2 PHE A 51 15.447 -2.253 9.091 1.00 20.00 H new ATOM 0 HZ PHE A 51 13.224 -1.616 10.000 1.00 20.00 H new ATOM 815 N LEU A 52 17.969 -4.898 13.993 1.00 33.61 N ATOM 816 CA LEU A 52 17.821 -6.329 13.702 1.00 32.79 C ATOM 817 C LEU A 52 17.061 -7.100 14.798 1.00 31.78 C ATOM 818 O LEU A 52 16.426 -8.109 14.504 1.00 33.12 O ATOM 819 CB LEU A 52 19.207 -6.951 13.449 1.00 20.00 C ATOM 820 CG LEU A 52 20.049 -6.263 12.356 1.00 20.00 C ATOM 821 CD1 LEU A 52 21.355 -7.033 12.153 1.00 20.00 C ATOM 822 CD2 LEU A 52 19.331 -6.186 11.006 1.00 20.00 C ATOM 0 H LEU A 52 18.925 -4.626 14.221 1.00 33.61 H new ATOM 0 HA LEU A 52 17.209 -6.414 12.804 1.00 32.79 H new ATOM 0 HB2 LEU A 52 19.770 -6.935 14.382 1.00 20.00 H new ATOM 0 HB3 LEU A 52 19.073 -7.998 13.176 1.00 20.00 H new ATOM 0 HG LEU A 52 20.231 -5.246 12.702 1.00 20.00 H new ATOM 0 HD11 LEU A 52 21.949 -6.545 11.380 1.00 20.00 H new ATOM 0 HD12 LEU A 52 21.917 -7.048 13.087 1.00 20.00 H new ATOM 0 HD13 LEU A 52 21.131 -8.055 11.847 1.00 20.00 H new ATOM 0 HD21 LEU A 52 19.975 -5.691 10.279 1.00 20.00 H new ATOM 0 HD22 LEU A 52 19.099 -7.193 10.659 1.00 20.00 H new ATOM 0 HD23 LEU A 52 18.407 -5.619 11.117 1.00 20.00 H new ATOM 834 N GLU A 53 17.001 -6.565 16.023 1.00 33.79 N ATOM 835 CA GLU A 53 16.163 -7.090 17.116 1.00 31.44 C ATOM 836 C GLU A 53 14.664 -6.785 16.912 1.00 32.93 C ATOM 837 O GLU A 53 13.812 -7.368 17.584 1.00 30.48 O ATOM 838 CB GLU A 53 16.611 -6.504 18.471 1.00 20.00 C ATOM 839 CG GLU A 53 18.115 -6.620 18.780 1.00 20.00 C ATOM 840 CD GLU A 53 18.513 -5.837 20.044 1.00 20.00 C ATOM 841 OE1 GLU A 53 17.704 -5.787 20.998 1.00 20.00 O ATOM 842 OE2 GLU A 53 19.634 -5.279 20.045 1.00 20.00 O1- ATOM 0 H GLU A 53 17.541 -5.742 16.291 1.00 33.79 H new ATOM 0 HA GLU A 53 16.293 -8.172 17.111 1.00 31.44 H new ATOM 0 HB2 GLU A 53 16.332 -5.451 18.501 1.00 20.00 H new ATOM 0 HB3 GLU A 53 16.055 -7.004 19.264 1.00 20.00 H new ATOM 0 HG2 GLU A 53 18.378 -7.670 18.908 1.00 20.00 H new ATOM 0 HG3 GLU A 53 18.688 -6.249 17.930 1.00 20.00 H new ATOM 849 N ILE A 54 14.341 -5.841 16.018 1.00 31.99 N ATOM 850 CA ILE A 54 12.971 -5.448 15.661 1.00 32.02 C ATOM 851 C ILE A 54 12.565 -6.059 14.310 1.00 31.77 C ATOM 852 O ILE A 54 11.458 -6.572 14.180 1.00 33.16 O ATOM 853 CB ILE A 54 12.819 -3.904 15.659 1.00 20.00 C ATOM 854 CG1 ILE A 54 13.464 -3.230 16.896 1.00 20.00 C ATOM 855 CG2 ILE A 54 11.326 -3.532 15.579 1.00 20.00 C ATOM 856 CD1 ILE A 54 13.345 -1.701 16.918 1.00 20.00 C ATOM 0 H ILE A 54 15.048 -5.313 15.507 1.00 31.99 H new ATOM 0 HA ILE A 54 12.293 -5.841 16.419 1.00 32.02 H new ATOM 0 HB ILE A 54 13.351 -3.531 14.784 1.00 20.00 H new ATOM 0 HG12 ILE A 54 13.000 -3.631 17.797 1.00 20.00 H new ATOM 0 HG13 ILE A 54 14.519 -3.501 16.933 1.00 20.00 H new ATOM 0 HG21 ILE A 54 11.221 -2.447 15.578 1.00 20.00 H new ATOM 0 HG22 ILE A 54 10.898 -3.939 14.663 1.00 20.00 H new ATOM 0 HG23 ILE A 54 10.801 -3.946 16.440 1.00 20.00 H new ATOM 0 HD11 ILE A 54 13.823 -1.312 17.817 1.00 20.00 H new ATOM 0 HD12 ILE A 54 13.835 -1.285 16.038 1.00 20.00 H new ATOM 0 HD13 ILE A 54 12.292 -1.418 16.915 1.00 20.00 H new ATOM 868 N SER A 55 13.458 -6.027 13.314 1.00 28.70 N ATOM 869 CA SER A 55 13.239 -6.543 11.957 1.00 30.81 C ATOM 870 C SER A 55 14.331 -7.557 11.588 1.00 31.21 C ATOM 871 O SER A 55 15.438 -7.143 11.232 1.00 33.58 O ATOM 872 CB SER A 55 13.219 -5.375 10.965 1.00 31.09 C ATOM 873 OG SER A 55 12.974 -5.807 9.639 1.00 27.35 O ATOM 0 H SER A 55 14.388 -5.626 13.435 1.00 28.70 H new ATOM 0 HA SER A 55 12.278 -7.057 11.916 1.00 30.81 H new ATOM 0 HB2 SER A 55 12.450 -4.661 11.261 1.00 31.09 H new ATOM 0 HB3 SER A 55 14.173 -4.850 11.004 1.00 31.09 H new ATOM 0 HG SER A 55 12.703 -5.042 9.090 1.00 27.35 H new ATOM 879 N PRO A 56 14.051 -8.876 11.590 1.00 32.14 N ATOM 880 CA PRO A 56 15.071 -9.899 11.334 1.00 34.18 C ATOM 881 C PRO A 56 15.577 -9.920 9.882 1.00 33.74 C ATOM 882 O PRO A 56 16.685 -10.380 9.627 1.00 37.90 O ATOM 883 CB PRO A 56 14.416 -11.227 11.729 1.00 20.00 C ATOM 884 CG PRO A 56 12.922 -10.968 11.536 1.00 20.00 C ATOM 885 CD PRO A 56 12.778 -9.500 11.932 1.00 20.00 C ATOM 0 HA PRO A 56 15.970 -9.692 11.914 1.00 34.18 H new ATOM 0 HB2 PRO A 56 14.764 -12.047 11.101 1.00 20.00 H new ATOM 0 HB3 PRO A 56 14.646 -11.495 12.760 1.00 20.00 H new ATOM 0 HG2 PRO A 56 12.611 -11.141 10.506 1.00 20.00 H new ATOM 0 HG3 PRO A 56 12.314 -11.618 12.166 1.00 20.00 H new ATOM 0 HD2 PRO A 56 11.954 -9.028 11.397 1.00 20.00 H new ATOM 0 HD3 PRO A 56 12.566 -9.400 12.996 1.00 20.00 H new ATOM 893 N GLU A 57 14.827 -9.352 8.932 1.00 31.78 N ATOM 894 CA GLU A 57 15.307 -9.099 7.563 1.00 32.43 C ATOM 895 C GLU A 57 16.106 -7.784 7.416 1.00 32.01 C ATOM 896 O GLU A 57 16.531 -7.439 6.314 1.00 38.99 O ATOM 897 CB GLU A 57 14.115 -9.096 6.593 1.00 20.00 C ATOM 898 CG GLU A 57 13.379 -10.442 6.501 1.00 20.00 C ATOM 899 CD GLU A 57 12.630 -10.538 5.168 1.00 20.00 C ATOM 900 OE1 GLU A 57 11.753 -9.666 4.977 1.00 20.00 O ATOM 901 OE2 GLU A 57 13.274 -10.954 4.178 1.00 20.00 O1- ATOM 0 H GLU A 57 13.865 -9.052 9.089 1.00 31.78 H new ATOM 0 HA GLU A 57 16.000 -9.906 7.322 1.00 32.43 H new ATOM 0 HB2 GLU A 57 13.408 -8.328 6.905 1.00 20.00 H new ATOM 0 HB3 GLU A 57 14.469 -8.819 5.600 1.00 20.00 H new ATOM 0 HG2 GLU A 57 14.091 -11.262 6.587 1.00 20.00 H new ATOM 0 HG3 GLU A 57 12.678 -10.540 7.330 1.00 20.00 H new ATOM 908 N GLY A 58 16.184 -6.963 8.470 1.00 29.84 N ATOM 909 CA GLY A 58 16.768 -5.620 8.433 1.00 35.47 C ATOM 910 C GLY A 58 15.976 -4.597 7.608 1.00 27.15 C ATOM 911 O GLY A 58 16.523 -3.550 7.259 1.00 26.25 O ATOM 0 H GLY A 58 15.834 -7.221 9.393 1.00 29.84 H new ATOM 0 HA2 GLY A 58 16.859 -5.250 9.454 1.00 35.47 H new ATOM 0 HA3 GLY A 58 17.778 -5.689 8.028 1.00 35.47 H new ATOM 915 N LYS A 59 14.723 -4.898 7.248 1.00 27.07 N ATOM 916 CA LYS A 59 13.857 -4.060 6.401 1.00 28.86 C ATOM 917 C LYS A 59 12.987 -3.098 7.211 1.00 27.40 C ATOM 918 O LYS A 59 12.521 -3.450 8.296 1.00 25.14 O ATOM 919 CB LYS A 59 12.964 -4.940 5.512 1.00 24.41 C ATOM 920 CG LYS A 59 13.768 -5.766 4.500 1.00 27.08 C ATOM 921 CD LYS A 59 12.829 -6.671 3.697 1.00 29.26 C ATOM 922 CE LYS A 59 13.629 -7.752 2.963 1.00 32.41 C ATOM 923 NZ LYS A 59 12.761 -8.894 2.605 1.00 34.49 N1+ ATOM 0 H LYS A 59 14.266 -5.760 7.547 1.00 27.07 H new ATOM 0 HA LYS A 59 14.519 -3.456 5.781 1.00 28.86 H new ATOM 0 HB2 LYS A 59 12.381 -5.612 6.142 1.00 24.41 H new ATOM 0 HB3 LYS A 59 12.255 -4.308 4.977 1.00 24.41 H new ATOM 0 HG2 LYS A 59 14.311 -5.103 3.827 1.00 27.08 H new ATOM 0 HG3 LYS A 59 14.511 -6.370 5.020 1.00 27.08 H new ATOM 0 HD2 LYS A 59 12.103 -7.136 4.364 1.00 29.26 H new ATOM 0 HD3 LYS A 59 12.266 -6.075 2.979 1.00 29.26 H new ATOM 0 HE2 LYS A 59 14.075 -7.332 2.062 1.00 32.41 H new ATOM 0 HE3 LYS A 59 14.449 -8.096 3.594 1.00 32.41 H new ATOM 0 HZ1 LYS A 59 13.289 -9.782 2.724 1.00 34.49 H new ATOM 0 HZ2 LYS A 59 11.925 -8.902 3.224 1.00 34.49 H new ATOM 0 HZ3 LYS A 59 12.457 -8.802 1.615 1.00 34.49 H new ATOM 937 N VAL A 60 12.570 -2.013 6.557 1.00 23.53 N ATOM 938 CA VAL A 60 11.421 -1.166 6.924 1.00 21.74 C ATOM 939 C VAL A 60 10.264 -1.341 5.919 1.00 20.73 C ATOM 940 O VAL A 60 10.525 -1.551 4.731 1.00 23.29 O ATOM 941 CB VAL A 60 11.816 0.323 7.032 1.00 20.11 C ATOM 942 CG1 VAL A 60 12.773 0.579 8.197 1.00 21.30 C ATOM 943 CG2 VAL A 60 12.403 0.885 5.732 1.00 20.28 C ATOM 0 H VAL A 60 13.043 -1.680 5.717 1.00 23.53 H new ATOM 0 HA VAL A 60 11.083 -1.493 7.907 1.00 21.74 H new ATOM 0 HB VAL A 60 10.885 0.855 7.225 1.00 20.11 H new ATOM 0 HG11 VAL A 60 13.024 1.639 8.235 1.00 21.30 H new ATOM 0 HG12 VAL A 60 12.295 0.285 9.132 1.00 21.30 H new ATOM 0 HG13 VAL A 60 13.683 -0.005 8.056 1.00 21.30 H new ATOM 0 HG21 VAL A 60 12.660 1.935 5.873 1.00 20.28 H new ATOM 0 HG22 VAL A 60 13.299 0.324 5.465 1.00 20.28 H new ATOM 0 HG23 VAL A 60 11.668 0.796 4.932 1.00 20.28 H new ATOM 953 N PRO A 61 9.009 -1.052 6.316 1.00 18.94 N ATOM 954 CA PRO A 61 8.560 -0.789 7.680 1.00 20.90 C ATOM 955 C PRO A 61 8.670 -2.005 8.599 1.00 22.88 C ATOM 956 O PRO A 61 8.442 -3.147 8.207 1.00 20.80 O ATOM 957 CB PRO A 61 7.101 -0.347 7.575 1.00 20.32 C ATOM 958 CG PRO A 61 6.633 -1.066 6.317 1.00 19.14 C ATOM 959 CD PRO A 61 7.868 -1.046 5.419 1.00 18.07 C ATOM 0 HA PRO A 61 9.199 -0.027 8.126 1.00 20.90 H new ATOM 0 HB2 PRO A 61 6.523 -0.642 8.451 1.00 20.32 H new ATOM 0 HB3 PRO A 61 7.010 0.735 7.482 1.00 20.32 H new ATOM 0 HG2 PRO A 61 6.309 -2.084 6.533 1.00 19.14 H new ATOM 0 HG3 PRO A 61 5.790 -0.555 5.852 1.00 19.14 H new ATOM 0 HD2 PRO A 61 7.885 -1.913 4.758 1.00 18.07 H new ATOM 0 HD3 PRO A 61 7.875 -0.161 4.783 1.00 18.07 H new ATOM 967 N VAL A 62 8.807 -1.685 9.878 1.00 0.00 N ATOM 968 CA VAL A 62 8.522 -2.577 10.997 1.00 0.00 C ATOM 969 C VAL A 62 7.926 -1.726 12.116 1.00 0.00 C ATOM 970 O VAL A 62 8.227 -0.533 12.220 1.00 0.00 O ATOM 971 CB VAL A 62 9.787 -3.353 11.410 1.00 0.00 C ATOM 972 CG1 VAL A 62 10.846 -2.446 12.038 1.00 0.00 C ATOM 973 CG2 VAL A 62 9.476 -4.484 12.384 1.00 0.00 C ATOM 0 H VAL A 62 9.131 -0.765 10.177 1.00 0.00 H new ATOM 0 HA VAL A 62 7.798 -3.346 10.726 1.00 0.00 H new ATOM 0 HB VAL A 62 10.181 -3.773 10.485 1.00 0.00 H new ATOM 0 HG11 VAL A 62 11.718 -3.040 12.312 1.00 0.00 H new ATOM 0 HG12 VAL A 62 11.140 -1.679 11.321 1.00 0.00 H new ATOM 0 HG13 VAL A 62 10.436 -1.971 12.929 1.00 0.00 H new ATOM 0 HG21 VAL A 62 10.398 -5.002 12.646 1.00 0.00 H new ATOM 0 HG22 VAL A 62 9.022 -4.073 13.286 1.00 0.00 H new ATOM 0 HG23 VAL A 62 8.785 -5.186 11.917 1.00 0.00 H new ATOM 983 N VAL A 63 7.013 -2.286 12.899 1.00 0.00 N ATOM 984 CA VAL A 63 6.358 -1.587 14.012 1.00 0.00 C ATOM 985 C VAL A 63 6.487 -2.391 15.292 1.00 0.00 C ATOM 986 O VAL A 63 6.658 -3.606 15.247 1.00 0.00 O ATOM 987 CB VAL A 63 4.881 -1.263 13.706 1.00 0.00 C ATOM 988 CG1 VAL A 63 4.731 -0.472 12.403 1.00 0.00 C ATOM 989 CG2 VAL A 63 3.989 -2.505 13.619 1.00 0.00 C ATOM 0 H VAL A 63 6.698 -3.249 12.783 1.00 0.00 H new ATOM 0 HA VAL A 63 6.869 -0.634 14.147 1.00 0.00 H new ATOM 0 HB VAL A 63 4.550 -0.661 14.552 1.00 0.00 H new ATOM 0 HG11 VAL A 63 3.676 -0.264 12.223 1.00 0.00 H new ATOM 0 HG12 VAL A 63 5.278 0.467 12.483 1.00 0.00 H new ATOM 0 HG13 VAL A 63 5.132 -1.056 11.575 1.00 0.00 H new ATOM 0 HG21 VAL A 63 2.965 -2.203 13.402 1.00 0.00 H new ATOM 0 HG22 VAL A 63 4.351 -3.158 12.825 1.00 0.00 H new ATOM 0 HG23 VAL A 63 4.016 -3.039 14.569 1.00 0.00 H new ATOM 999 N LYS A 64 6.245 -1.740 16.427 1.00 0.00 N ATOM 1000 CA LYS A 64 5.858 -2.369 17.684 1.00 0.00 C ATOM 1001 C LYS A 64 4.412 -2.008 18.018 1.00 0.00 C ATOM 1002 O LYS A 64 4.109 -0.835 18.240 1.00 0.00 O ATOM 1003 CB LYS A 64 6.807 -1.935 18.801 1.00 0.00 C ATOM 1004 CG LYS A 64 8.200 -2.573 18.696 1.00 0.00 C ATOM 1005 CD LYS A 64 9.042 -2.187 19.921 1.00 0.00 C ATOM 1006 CE LYS A 64 10.233 -3.134 20.094 1.00 0.00 C ATOM 1007 NZ LYS A 64 10.739 -3.094 21.485 1.00 0.00 N1+ ATOM 0 H LYS A 64 6.316 -0.725 16.498 1.00 0.00 H new ATOM 0 HA LYS A 64 5.927 -3.452 17.585 1.00 0.00 H new ATOM 0 HB2 LYS A 64 6.909 -0.850 18.780 1.00 0.00 H new ATOM 0 HB3 LYS A 64 6.367 -2.195 19.764 1.00 0.00 H new ATOM 0 HG2 LYS A 64 8.110 -3.657 18.632 1.00 0.00 H new ATOM 0 HG3 LYS A 64 8.695 -2.240 17.784 1.00 0.00 H new ATOM 0 HD2 LYS A 64 9.401 -1.164 19.811 1.00 0.00 H new ATOM 0 HD3 LYS A 64 8.420 -2.213 20.816 1.00 0.00 H new ATOM 0 HE2 LYS A 64 9.935 -4.151 19.840 1.00 0.00 H new ATOM 0 HE3 LYS A 64 11.029 -2.854 19.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 11.132 -4.023 21.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 11.482 -2.370 21.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 9.959 -2.860 22.132 1.00 0.00 H new ATOM 1021 N ILE A 65 3.563 -3.023 18.167 1.00 0.00 N ATOM 1022 CA ILE A 65 2.193 -2.914 18.681 1.00 0.00 C ATOM 1023 C ILE A 65 2.182 -3.486 20.102 1.00 0.00 C ATOM 1024 O ILE A 65 2.594 -4.623 20.318 1.00 0.00 O ATOM 1025 CB ILE A 65 1.187 -3.623 17.742 1.00 0.00 C ATOM 1026 CG1 ILE A 65 1.189 -2.951 16.348 1.00 0.00 C ATOM 1027 CG2 ILE A 65 -0.231 -3.601 18.347 1.00 0.00 C ATOM 1028 CD1 ILE A 65 0.402 -3.713 15.275 1.00 0.00 C ATOM 0 H ILE A 65 3.817 -3.981 17.925 1.00 0.00 H new ATOM 0 HA ILE A 65 1.875 -1.872 18.715 1.00 0.00 H new ATOM 0 HB ILE A 65 1.495 -4.663 17.629 1.00 0.00 H new ATOM 0 HG12 ILE A 65 0.774 -1.948 16.442 1.00 0.00 H new ATOM 0 HG13 ILE A 65 2.220 -2.839 16.014 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -0.923 -4.104 17.671 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -0.224 -4.115 19.308 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -0.550 -2.568 18.489 1.00 0.00 H new ATOM 0 HD11 ILE A 65 0.456 -3.172 14.331 1.00 0.00 H new ATOM 0 HD12 ILE A 65 0.829 -4.708 15.148 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -0.640 -3.802 15.583 1.00 0.00 H new ATOM 1040 N ASP A 66 1.905 -2.637 21.095 1.00 0.00 N ATOM 1041 CA ASP A 66 2.108 -2.943 22.521 1.00 0.00 C ATOM 1042 C ASP A 66 3.541 -3.426 22.855 1.00 0.00 C ATOM 1043 O ASP A 66 3.759 -4.426 23.529 1.00 0.00 O ATOM 1044 CB ASP A 66 0.985 -3.842 23.088 1.00 0.00 C ATOM 1045 CG ASP A 66 0.749 -3.528 24.571 1.00 0.00 C ATOM 1046 OD1 ASP A 66 0.371 -2.350 24.777 1.00 0.00 O ATOM 1047 OD2 ASP A 66 1.500 -4.052 25.421 1.00 0.00 O1- ATOM 0 H ASP A 66 1.528 -1.703 20.933 1.00 0.00 H new ATOM 0 HA ASP A 66 2.023 -1.996 23.054 1.00 0.00 H new ATOM 0 HB2 ASP A 66 0.065 -3.685 22.525 1.00 0.00 H new ATOM 0 HB3 ASP A 66 1.255 -4.891 22.970 1.00 0.00 H new ATOM 1052 N ASP A 67 4.550 -2.757 22.286 1.00 0.00 N ATOM 1053 CA ASP A 67 5.978 -3.141 22.319 1.00 0.00 C ATOM 1054 C ASP A 67 6.351 -4.443 21.551 1.00 0.00 C ATOM 1055 O ASP A 67 7.532 -4.675 21.287 1.00 0.00 O ATOM 1056 CB ASP A 67 6.525 -3.062 23.765 1.00 0.00 C ATOM 1057 CG ASP A 67 7.953 -3.573 23.933 1.00 0.00 C ATOM 1058 OD1 ASP A 67 8.890 -2.923 23.424 1.00 0.00 O ATOM 1059 OD2 ASP A 67 8.073 -4.674 24.529 1.00 0.00 O1- ATOM 0 H ASP A 67 4.394 -1.894 21.765 1.00 0.00 H new ATOM 0 HA ASP A 67 6.507 -2.395 21.725 1.00 0.00 H new ATOM 0 HB2 ASP A 67 6.482 -2.025 24.099 1.00 0.00 H new ATOM 0 HB3 ASP A 67 5.869 -3.635 24.420 1.00 0.00 H new ATOM 1064 N LYS A 68 5.393 -5.235 21.044 1.00 0.00 N ATOM 1065 CA LYS A 68 5.669 -6.490 20.308 1.00 0.00 C ATOM 1066 C LYS A 68 5.776 -6.251 18.799 1.00 0.00 C ATOM 1067 O LYS A 68 4.969 -5.515 18.235 1.00 0.00 O ATOM 1068 CB LYS A 68 4.629 -7.574 20.666 1.00 0.00 C ATOM 1069 CG LYS A 68 4.293 -7.672 22.168 1.00 0.00 C ATOM 1070 CD LYS A 68 5.507 -7.762 23.112 1.00 0.00 C ATOM 1071 CE LYS A 68 5.155 -7.151 24.469 1.00 0.00 C ATOM 1072 NZ LYS A 68 6.385 -6.717 25.175 1.00 0.00 N1+ ATOM 0 H LYS A 68 4.398 -5.026 21.131 1.00 0.00 H new ATOM 0 HA LYS A 68 6.643 -6.862 20.624 1.00 0.00 H new ATOM 0 HB2 LYS A 68 3.711 -7.374 20.114 1.00 0.00 H new ATOM 0 HB3 LYS A 68 5.000 -8.541 20.327 1.00 0.00 H new ATOM 0 HG2 LYS A 68 3.700 -6.801 22.448 1.00 0.00 H new ATOM 0 HG3 LYS A 68 3.665 -8.549 22.326 1.00 0.00 H new ATOM 0 HD2 LYS A 68 5.805 -8.803 23.238 1.00 0.00 H new ATOM 0 HD3 LYS A 68 6.358 -7.238 22.676 1.00 0.00 H new ATOM 0 HE2 LYS A 68 4.488 -6.300 24.330 1.00 0.00 H new ATOM 0 HE3 LYS A 68 4.618 -7.881 25.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 6.164 -6.527 26.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 7.102 -7.468 25.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 6.753 -5.851 24.731 1.00 0.00 H new ATOM 1086 N TRP A 69 6.867 -6.720 18.188 1.00 0.00 N ATOM 1087 CA TRP A 69 7.223 -6.344 16.818 1.00 0.00 C ATOM 1088 C TRP A 69 6.342 -7.028 15.760 1.00 0.00 C ATOM 1089 O TRP A 69 5.929 -8.174 15.925 1.00 0.00 O ATOM 1090 CB TRP A 69 8.730 -6.523 16.560 1.00 0.00 C ATOM 1091 CG TRP A 69 9.256 -7.925 16.479 1.00 0.00 C ATOM 1092 CD1 TRP A 69 9.943 -8.566 17.453 1.00 0.00 C ATOM 1093 CD2 TRP A 69 9.221 -8.853 15.347 1.00 0.00 C ATOM 1094 NE1 TRP A 69 10.291 -9.830 17.024 1.00 0.00 N ATOM 1095 CE2 TRP A 69 9.867 -10.066 15.733 1.00 0.00 C ATOM 1096 CE3 TRP A 69 8.743 -8.785 14.016 1.00 0.00 C ATOM 1097 CZ2 TRP A 69 9.995 -11.163 14.871 1.00 0.00 C ATOM 1098 CZ3 TRP A 69 8.865 -9.880 13.139 1.00 0.00 C ATOM 1099 CH2 TRP A 69 9.480 -11.071 13.565 1.00 0.00 C ATOM 0 H TRP A 69 7.524 -7.366 18.625 1.00 0.00 H new ATOM 0 HA TRP A 69 7.011 -5.280 16.714 1.00 0.00 H new ATOM 0 HB2 TRP A 69 8.974 -6.018 15.626 1.00 0.00 H new ATOM 0 HB3 TRP A 69 9.271 -6.006 17.353 1.00 0.00 H new ATOM 0 HD1 TRP A 69 10.183 -8.150 18.421 1.00 0.00 H new ATOM 0 HE1 TRP A 69 10.800 -10.507 17.592 1.00 0.00 H new ATOM 0 HE3 TRP A 69 8.276 -7.876 13.667 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 10.482 -12.067 15.205 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 8.483 -9.805 12.131 1.00 0.00 H new ATOM 0 HH2 TRP A 69 9.557 -11.912 12.892 1.00 0.00 H new ATOM 1110 N VAL A 70 6.103 -6.326 14.648 1.00 0.00 N ATOM 1111 CA VAL A 70 5.435 -6.822 13.433 1.00 0.00 C ATOM 1112 C VAL A 70 6.137 -6.223 12.212 1.00 0.00 C ATOM 1113 O VAL A 70 6.302 -5.005 12.134 1.00 0.00 O ATOM 1114 CB VAL A 70 3.931 -6.473 13.402 1.00 0.00 C ATOM 1115 CG1 VAL A 70 3.241 -7.120 12.194 1.00 0.00 C ATOM 1116 CG2 VAL A 70 3.174 -6.920 14.660 1.00 0.00 C ATOM 0 H VAL A 70 6.382 -5.349 14.563 1.00 0.00 H new ATOM 0 HA VAL A 70 5.505 -7.910 13.425 1.00 0.00 H new ATOM 0 HB VAL A 70 3.895 -5.385 13.341 1.00 0.00 H new ATOM 0 HG11 VAL A 70 2.183 -6.858 12.196 1.00 0.00 H new ATOM 0 HG12 VAL A 70 3.702 -6.759 11.275 1.00 0.00 H new ATOM 0 HG13 VAL A 70 3.347 -8.203 12.252 1.00 0.00 H new ATOM 0 HG21 VAL A 70 2.124 -6.643 14.570 1.00 0.00 H new ATOM 0 HG22 VAL A 70 3.256 -8.001 14.769 1.00 0.00 H new ATOM 0 HG23 VAL A 70 3.604 -6.433 15.536 1.00 0.00 H new ATOM 1126 N ALA A 71 6.572 -7.074 11.282 1.00 0.00 N ATOM 1127 CA ALA A 71 7.234 -6.703 10.027 1.00 0.00 C ATOM 1128 C ALA A 71 6.329 -6.974 8.808 1.00 0.00 C ATOM 1129 O ALA A 71 5.407 -7.779 8.909 1.00 0.00 O ATOM 1130 CB ALA A 71 8.563 -7.468 9.941 1.00 0.00 C ATOM 0 H ALA A 71 6.469 -8.084 11.385 1.00 0.00 H new ATOM 0 HA ALA A 71 7.434 -5.632 10.016 1.00 0.00 H new ATOM 0 HB1 ALA A 71 9.074 -7.207 9.014 1.00 0.00 H new ATOM 0 HB2 ALA A 71 9.192 -7.200 10.790 1.00 0.00 H new ATOM 0 HB3 ALA A 71 8.367 -8.540 9.958 1.00 0.00 H new ATOM 1136 N ASP A 72 6.713 -6.422 7.649 1.00 20.34 N ATOM 1137 CA ASP A 72 6.019 -6.509 6.349 1.00 22.16 C ATOM 1138 C ASP A 72 4.655 -5.781 6.316 1.00 20.65 C ATOM 1139 O ASP A 72 3.726 -6.087 7.060 1.00 20.55 O ATOM 1140 CB ASP A 72 5.983 -7.964 5.832 1.00 20.00 C ATOM 1141 CG ASP A 72 5.679 -8.076 4.333 1.00 20.00 C ATOM 1142 OD1 ASP A 72 4.938 -7.205 3.824 1.00 20.00 O ATOM 1143 OD2 ASP A 72 6.534 -8.642 3.612 1.00 20.00 O1- ATOM 0 H ASP A 72 7.568 -5.869 7.586 1.00 20.34 H new ATOM 0 HA ASP A 72 6.614 -5.945 5.631 1.00 22.16 H new ATOM 0 HB2 ASP A 72 6.944 -8.437 6.036 1.00 20.00 H new ATOM 0 HB3 ASP A 72 5.229 -8.520 6.390 1.00 20.00 H new ATOM 1148 N SER A 73 4.560 -4.718 5.514 1.00 20.77 N ATOM 1149 CA SER A 73 3.496 -3.714 5.600 1.00 19.08 C ATOM 1150 C SER A 73 2.088 -4.228 5.308 1.00 21.16 C ATOM 1151 O SER A 73 1.160 -3.745 5.950 1.00 19.15 O ATOM 1152 CB SER A 73 3.816 -2.506 4.722 1.00 18.25 C ATOM 1153 OG SER A 73 3.637 -2.771 3.357 1.00 20.15 O ATOM 0 H SER A 73 5.233 -4.527 4.772 1.00 20.77 H new ATOM 0 HA SER A 73 3.479 -3.420 6.650 1.00 19.08 H new ATOM 0 HB2 SER A 73 3.179 -1.671 5.013 1.00 18.25 H new ATOM 0 HB3 SER A 73 4.847 -2.197 4.897 1.00 18.25 H new ATOM 0 HG SER A 73 4.176 -3.548 3.101 1.00 20.15 H new ATOM 1159 N ASP A 74 1.909 -5.259 4.476 1.00 19.13 N ATOM 1160 CA ASP A 74 0.592 -5.897 4.302 1.00 21.22 C ATOM 1161 C ASP A 74 0.170 -6.716 5.548 1.00 23.31 C ATOM 1162 O ASP A 74 -0.998 -6.674 5.936 1.00 24.97 O ATOM 1163 CB ASP A 74 0.563 -6.734 3.007 1.00 20.00 C ATOM 1164 CG ASP A 74 0.670 -5.900 1.714 1.00 20.00 C ATOM 1165 OD1 ASP A 74 -0.224 -5.071 1.419 1.00 20.00 O ATOM 1166 OD2 ASP A 74 1.739 -5.916 1.064 1.00 20.00 O1- ATOM 0 H ASP A 74 2.653 -5.671 3.913 1.00 19.13 H new ATOM 0 HA ASP A 74 -0.153 -5.108 4.200 1.00 21.22 H new ATOM 0 HB2 ASP A 74 1.383 -7.451 3.033 1.00 20.00 H new ATOM 0 HB3 ASP A 74 -0.363 -7.309 2.980 1.00 20.00 H new ATOM 1171 N VAL A 75 1.125 -7.277 6.310 1.00 21.90 N ATOM 1172 CA VAL A 75 0.871 -7.913 7.624 1.00 22.94 C ATOM 1173 C VAL A 75 0.628 -6.869 8.720 1.00 22.00 C ATOM 1174 O VAL A 75 -0.317 -6.997 9.500 1.00 20.03 O ATOM 1175 CB VAL A 75 2.032 -8.843 8.044 1.00 23.85 C ATOM 1176 CG1 VAL A 75 1.756 -9.552 9.379 1.00 22.00 C ATOM 1177 CG2 VAL A 75 2.310 -9.927 6.994 1.00 22.51 C ATOM 0 H VAL A 75 2.106 -7.304 6.032 1.00 21.90 H new ATOM 0 HA VAL A 75 -0.031 -8.513 7.506 1.00 22.94 H new ATOM 0 HB VAL A 75 2.898 -8.189 8.145 1.00 23.85 H new ATOM 0 HG11 VAL A 75 2.600 -10.194 9.631 1.00 22.00 H new ATOM 0 HG12 VAL A 75 1.618 -8.809 10.164 1.00 22.00 H new ATOM 0 HG13 VAL A 75 0.854 -10.157 9.290 1.00 22.00 H new ATOM 0 HG21 VAL A 75 3.133 -10.557 7.331 1.00 22.51 H new ATOM 0 HG22 VAL A 75 1.418 -10.538 6.857 1.00 22.51 H new ATOM 0 HG23 VAL A 75 2.577 -9.457 6.047 1.00 22.51 H new ATOM 1187 N ILE A 76 1.415 -5.788 8.730 1.00 20.72 N ATOM 1188 CA ILE A 76 1.270 -4.664 9.669 1.00 23.68 C ATOM 1189 C ILE A 76 -0.102 -3.997 9.506 1.00 21.36 C ATOM 1190 O ILE A 76 -0.808 -3.814 10.495 1.00 19.78 O ATOM 1191 CB ILE A 76 2.421 -3.647 9.479 1.00 20.00 C ATOM 1192 CG1 ILE A 76 3.787 -4.262 9.864 1.00 20.00 C ATOM 1193 CG2 ILE A 76 2.175 -2.358 10.284 1.00 20.00 C ATOM 1194 CD1 ILE A 76 5.001 -3.494 9.322 1.00 20.00 C ATOM 0 H ILE A 76 2.186 -5.665 8.074 1.00 20.72 H new ATOM 0 HA ILE A 76 1.331 -5.049 10.687 1.00 23.68 H new ATOM 0 HB ILE A 76 2.445 -3.390 8.420 1.00 20.00 H new ATOM 0 HG12 ILE A 76 3.857 -4.310 10.951 1.00 20.00 H new ATOM 0 HG13 ILE A 76 3.827 -5.287 9.497 1.00 20.00 H new ATOM 0 HG21 ILE A 76 3.003 -1.667 10.127 1.00 20.00 H new ATOM 0 HG22 ILE A 76 1.247 -1.893 9.952 1.00 20.00 H new ATOM 0 HG23 ILE A 76 2.101 -2.600 11.344 1.00 20.00 H new ATOM 0 HD11 ILE A 76 5.917 -3.992 9.638 1.00 20.00 H new ATOM 0 HD12 ILE A 76 4.959 -3.468 8.233 1.00 20.00 H new ATOM 0 HD13 ILE A 76 4.990 -2.475 9.710 1.00 20.00 H new ATOM 1206 N VAL A 77 -0.530 -3.741 8.265 1.00 22.04 N ATOM 1207 CA VAL A 77 -1.874 -3.235 7.944 1.00 22.84 C ATOM 1208 C VAL A 77 -2.957 -4.235 8.350 1.00 20.38 C ATOM 1209 O VAL A 77 -3.899 -3.842 9.032 1.00 19.38 O ATOM 1210 CB VAL A 77 -1.972 -2.870 6.447 1.00 18.64 C ATOM 1211 CG1 VAL A 77 -3.415 -2.710 5.954 1.00 13.67 C ATOM 1212 CG2 VAL A 77 -1.242 -1.543 6.183 1.00 18.03 C ATOM 0 H VAL A 77 0.055 -3.881 7.441 1.00 22.04 H new ATOM 0 HA VAL A 77 -2.043 -2.327 8.523 1.00 22.84 H new ATOM 0 HB VAL A 77 -1.515 -3.699 5.907 1.00 18.64 H new ATOM 0 HG11 VAL A 77 -3.411 -2.454 4.895 1.00 13.67 H new ATOM 0 HG12 VAL A 77 -3.955 -3.646 6.099 1.00 13.67 H new ATOM 0 HG13 VAL A 77 -3.906 -1.917 6.517 1.00 13.67 H new ATOM 0 HG21 VAL A 77 -1.315 -1.292 5.125 1.00 18.03 H new ATOM 0 HG22 VAL A 77 -1.700 -0.752 6.776 1.00 18.03 H new ATOM 0 HG23 VAL A 77 -0.193 -1.644 6.460 1.00 18.03 H new ATOM 1222 N GLY A 78 -2.766 -5.531 8.082 1.00 22.81 N ATOM 1223 CA GLY A 78 -3.706 -6.575 8.495 1.00 23.33 C ATOM 1224 C GLY A 78 -3.961 -6.605 10.006 1.00 22.62 C ATOM 1225 O GLY A 78 -5.115 -6.602 10.426 1.00 23.18 O ATOM 0 H GLY A 78 -1.956 -5.884 7.573 1.00 22.81 H new ATOM 0 HA2 GLY A 78 -4.654 -6.425 7.978 1.00 23.33 H new ATOM 0 HA3 GLY A 78 -3.321 -7.545 8.180 1.00 23.33 H new ATOM 1229 N ILE A 79 -2.910 -6.467 10.822 1.00 22.09 N ATOM 1230 CA ILE A 79 -3.032 -6.443 12.288 1.00 21.91 C ATOM 1231 C ILE A 79 -3.549 -5.091 12.808 1.00 23.25 C ATOM 1232 O ILE A 79 -4.429 -5.085 13.667 1.00 23.31 O ATOM 1233 CB ILE A 79 -1.701 -6.887 12.946 1.00 20.00 C ATOM 1234 CG1 ILE A 79 -1.447 -8.378 12.607 1.00 20.00 C ATOM 1235 CG2 ILE A 79 -1.724 -6.686 14.475 1.00 20.00 C ATOM 1236 CD1 ILE A 79 -0.137 -8.961 13.151 1.00 20.00 C ATOM 0 H ILE A 79 -1.951 -6.369 10.488 1.00 22.09 H new ATOM 0 HA ILE A 79 -3.793 -7.167 12.582 1.00 21.91 H new ATOM 0 HB ILE A 79 -0.895 -6.268 12.551 1.00 20.00 H new ATOM 0 HG12 ILE A 79 -2.277 -8.968 12.996 1.00 20.00 H new ATOM 0 HG13 ILE A 79 -1.454 -8.493 11.523 1.00 20.00 H new ATOM 0 HG21 ILE A 79 -0.773 -7.009 14.899 1.00 20.00 H new ATOM 0 HG22 ILE A 79 -1.882 -5.632 14.701 1.00 20.00 H new ATOM 0 HG23 ILE A 79 -2.533 -7.275 14.907 1.00 20.00 H new ATOM 0 HD11 ILE A 79 -0.056 -10.008 12.859 1.00 20.00 H new ATOM 0 HD12 ILE A 79 0.706 -8.404 12.743 1.00 20.00 H new ATOM 0 HD13 ILE A 79 -0.129 -8.886 14.238 1.00 20.00 H new ATOM 1248 N LEU A 80 -3.099 -3.948 12.273 1.00 20.38 N ATOM 1249 CA LEU A 80 -3.601 -2.623 12.683 1.00 20.30 C ATOM 1250 C LEU A 80 -5.095 -2.441 12.378 1.00 21.83 C ATOM 1251 O LEU A 80 -5.840 -1.927 13.214 1.00 20.85 O ATOM 1252 CB LEU A 80 -2.798 -1.507 11.984 1.00 20.80 C ATOM 1253 CG LEU A 80 -1.374 -1.283 12.526 1.00 23.48 C ATOM 1254 CD1 LEU A 80 -0.633 -0.294 11.623 1.00 20.63 C ATOM 1255 CD2 LEU A 80 -1.371 -0.703 13.944 1.00 17.42 C ATOM 0 H LEU A 80 -2.382 -3.912 11.549 1.00 20.38 H new ATOM 0 HA LEU A 80 -3.471 -2.558 13.763 1.00 20.30 H new ATOM 0 HB2 LEU A 80 -2.732 -1.741 10.921 1.00 20.80 H new ATOM 0 HB3 LEU A 80 -3.353 -0.573 12.071 1.00 20.80 H new ATOM 0 HG LEU A 80 -0.888 -2.258 12.544 1.00 23.48 H new ATOM 0 HD11 LEU A 80 0.375 -0.136 12.007 1.00 20.63 H new ATOM 0 HD12 LEU A 80 -0.577 -0.696 10.612 1.00 20.63 H new ATOM 0 HD13 LEU A 80 -1.168 0.655 11.607 1.00 20.63 H new ATOM 0 HD21 LEU A 80 -0.343 -0.565 14.278 1.00 17.42 H new ATOM 0 HD22 LEU A 80 -1.885 0.258 13.945 1.00 17.42 H new ATOM 0 HD23 LEU A 80 -1.883 -1.389 14.619 1.00 17.42 H new ATOM 1267 N GLU A 81 -5.566 -2.976 11.255 1.00 21.23 N ATOM 1268 CA GLU A 81 -6.965 -2.879 10.842 1.00 24.24 C ATOM 1269 C GLU A 81 -7.856 -4.011 11.361 1.00 23.44 C ATOM 1270 O GLU A 81 -9.050 -4.019 11.062 1.00 22.39 O ATOM 1271 CB GLU A 81 -7.055 -2.689 9.320 1.00 20.00 C ATOM 1272 CG GLU A 81 -6.310 -1.451 8.793 1.00 20.00 C ATOM 1273 CD GLU A 81 -6.479 -0.225 9.696 1.00 20.00 C ATOM 1274 OE1 GLU A 81 -7.633 0.047 10.101 1.00 20.00 O ATOM 1275 OE2 GLU A 81 -5.451 0.307 10.177 1.00 20.00 O1- ATOM 0 H GLU A 81 -4.982 -3.495 10.599 1.00 21.23 H new ATOM 0 HA GLU A 81 -7.377 -1.991 11.322 1.00 24.24 H new ATOM 0 HB2 GLU A 81 -6.654 -3.576 8.830 1.00 20.00 H new ATOM 0 HB3 GLU A 81 -8.105 -2.615 9.036 1.00 20.00 H new ATOM 0 HG2 GLU A 81 -5.249 -1.684 8.700 1.00 20.00 H new ATOM 0 HG3 GLU A 81 -6.673 -1.213 7.793 1.00 20.00 H new ATOM 1282 N GLU A 82 -7.344 -4.845 12.266 1.00 24.20 N ATOM 1283 CA GLU A 82 -8.102 -5.887 12.971 1.00 24.30 C ATOM 1284 C GLU A 82 -8.030 -5.739 14.506 1.00 25.25 C ATOM 1285 O GLU A 82 -9.045 -5.856 15.191 1.00 24.04 O ATOM 1286 CB GLU A 82 -7.560 -7.257 12.526 1.00 22.86 C ATOM 1287 CG GLU A 82 -8.377 -8.453 13.052 1.00 27.99 C ATOM 1288 CD GLU A 82 -7.586 -9.762 13.219 1.00 32.05 C ATOM 1289 OE1 GLU A 82 -6.332 -9.732 13.240 1.00 32.26 O ATOM 1290 OE2 GLU A 82 -8.153 -10.644 13.902 1.00 39.26 O1- ATOM 0 H GLU A 82 -6.362 -4.816 12.539 1.00 24.20 H new ATOM 0 HA GLU A 82 -9.156 -5.789 12.712 1.00 24.30 H new ATOM 0 HB2 GLU A 82 -7.542 -7.293 11.437 1.00 22.86 H new ATOM 0 HB3 GLU A 82 -6.529 -7.357 12.866 1.00 22.86 H new ATOM 0 HG2 GLU A 82 -8.809 -8.182 14.016 1.00 27.99 H new ATOM 0 HG3 GLU A 82 -9.208 -8.633 12.370 1.00 27.99 H new ATOM 1297 N LYS A 83 -6.847 -5.427 15.053 1.00 23.58 N ATOM 1298 CA LYS A 83 -6.518 -5.491 16.487 1.00 23.91 C ATOM 1299 C LYS A 83 -5.956 -4.154 16.995 1.00 21.85 C ATOM 1300 O LYS A 83 -4.808 -4.066 17.429 1.00 24.45 O ATOM 1301 CB LYS A 83 -5.546 -6.662 16.734 1.00 20.00 C ATOM 1302 CG LYS A 83 -6.168 -8.053 16.517 1.00 20.00 C ATOM 1303 CD LYS A 83 -5.096 -9.130 16.749 1.00 20.00 C ATOM 1304 CE LYS A 83 -5.633 -10.566 16.818 1.00 20.00 C ATOM 1305 NZ LYS A 83 -6.114 -11.073 15.514 1.00 20.00 N1+ ATOM 0 H LYS A 83 -6.060 -5.110 14.487 1.00 23.58 H new ATOM 0 HA LYS A 83 -7.429 -5.673 17.057 1.00 23.91 H new ATOM 0 HB2 LYS A 83 -4.687 -6.553 16.072 1.00 20.00 H new ATOM 0 HB3 LYS A 83 -5.171 -6.599 17.755 1.00 20.00 H new ATOM 0 HG2 LYS A 83 -7.003 -8.201 17.201 1.00 20.00 H new ATOM 0 HG3 LYS A 83 -6.567 -8.132 15.506 1.00 20.00 H new ATOM 0 HD2 LYS A 83 -4.361 -9.070 15.947 1.00 20.00 H new ATOM 0 HD3 LYS A 83 -4.572 -8.908 17.679 1.00 20.00 H new ATOM 0 HE2 LYS A 83 -4.846 -11.224 17.188 1.00 20.00 H new ATOM 0 HE3 LYS A 83 -6.449 -10.607 17.540 1.00 20.00 H new ATOM 0 HZ1 LYS A 83 -5.846 -12.073 15.410 1.00 20.00 H new ATOM 0 HZ2 LYS A 83 -7.149 -10.985 15.468 1.00 20.00 H new ATOM 0 HZ3 LYS A 83 -5.685 -10.518 14.746 1.00 20.00 H new ATOM 1319 N ASN A 84 -6.785 -3.111 16.988 1.00 0.00 N ATOM 1320 CA ASN A 84 -6.464 -1.779 17.525 1.00 0.00 C ATOM 1321 C ASN A 84 -7.702 -1.160 18.237 1.00 0.00 C ATOM 1322 O ASN A 84 -8.787 -1.728 18.114 1.00 0.00 O ATOM 1323 CB ASN A 84 -5.869 -0.917 16.386 1.00 0.00 C ATOM 1324 CG ASN A 84 -6.900 -0.022 15.730 1.00 0.00 C ATOM 1325 OD1 ASN A 84 -7.089 1.096 16.169 1.00 0.00 O ATOM 1326 ND2 ASN A 84 -7.817 -0.587 14.983 1.00 0.00 N ATOM 0 H ASN A 84 -7.726 -3.166 16.599 1.00 0.00 H new ATOM 0 HA ASN A 84 -5.703 -1.839 18.303 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -5.062 -0.303 16.785 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -5.430 -1.571 15.633 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -8.682 -0.089 14.773 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -7.665 -1.525 14.611 1.00 0.00 H new ATOM 1333 N PRO A 85 -7.563 -0.089 19.049 1.00 0.00 N ATOM 1334 CA PRO A 85 -8.673 0.466 19.839 1.00 0.00 C ATOM 1335 C PRO A 85 -9.692 1.297 19.034 1.00 0.00 C ATOM 1336 O PRO A 85 -10.840 1.407 19.456 1.00 0.00 O ATOM 1337 CB PRO A 85 -7.996 1.330 20.909 1.00 0.00 C ATOM 1338 CG PRO A 85 -6.738 1.828 20.203 1.00 0.00 C ATOM 1339 CD PRO A 85 -6.330 0.626 19.351 1.00 0.00 C ATOM 0 HA PRO A 85 -9.274 -0.348 20.244 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -8.635 2.155 21.225 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -7.756 0.752 21.802 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -6.939 2.708 19.592 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -5.958 2.104 20.913 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -5.831 0.947 18.437 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -5.630 -0.013 19.888 1.00 0.00 H new ATOM 1347 N GLU A 86 -9.287 1.914 17.921 1.00 0.00 N ATOM 1348 CA GLU A 86 -10.210 2.530 16.956 1.00 0.00 C ATOM 1349 C GLU A 86 -10.860 1.442 16.077 1.00 0.00 C ATOM 1350 O GLU A 86 -10.273 0.365 15.917 1.00 0.00 O ATOM 1351 CB GLU A 86 -9.455 3.549 16.081 1.00 0.00 C ATOM 1352 CG GLU A 86 -8.970 4.790 16.852 1.00 0.00 C ATOM 1353 CD GLU A 86 -10.109 5.718 17.309 1.00 0.00 C ATOM 1354 OE1 GLU A 86 -11.198 5.663 16.690 1.00 0.00 O ATOM 1355 OE2 GLU A 86 -9.817 6.605 18.141 1.00 0.00 O1- ATOM 0 H GLU A 86 -8.305 2.002 17.660 1.00 0.00 H new ATOM 0 HA GLU A 86 -10.997 3.053 17.500 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -8.596 3.057 15.626 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -10.107 3.869 15.268 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -8.404 4.466 17.726 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -8.285 5.355 16.220 1.00 0.00 H new ATOM 1362 N PRO A 87 -11.996 1.705 15.402 1.00 0.00 N ATOM 1363 CA PRO A 87 -12.706 0.686 14.629 1.00 0.00 C ATOM 1364 C PRO A 87 -11.829 -0.077 13.609 1.00 0.00 C ATOM 1365 O PRO A 87 -10.998 0.538 12.927 1.00 0.00 O ATOM 1366 CB PRO A 87 -13.870 1.419 13.959 1.00 0.00 C ATOM 1367 CG PRO A 87 -14.187 2.524 14.967 1.00 0.00 C ATOM 1368 CD PRO A 87 -12.806 2.914 15.495 1.00 0.00 C ATOM 0 HA PRO A 87 -13.046 -0.109 15.292 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -13.589 1.824 12.987 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -14.724 0.761 13.795 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -14.692 3.367 14.496 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -14.838 2.168 15.765 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -12.374 3.722 14.904 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -12.865 3.268 16.524 1.00 0.00 H new ATOM 1376 N PRO A 88 -12.007 -1.408 13.480 1.00 0.00 N ATOM 1377 CA PRO A 88 -11.288 -2.226 12.506 1.00 0.00 C ATOM 1378 C PRO A 88 -11.750 -1.923 11.075 1.00 0.00 C ATOM 1379 O PRO A 88 -12.928 -1.656 10.827 1.00 0.00 O ATOM 1380 CB PRO A 88 -11.566 -3.679 12.907 1.00 0.00 C ATOM 1381 CG PRO A 88 -12.948 -3.605 13.549 1.00 0.00 C ATOM 1382 CD PRO A 88 -12.928 -2.243 14.242 1.00 0.00 C ATOM 0 HA PRO A 88 -10.218 -2.017 12.511 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -11.558 -4.344 12.043 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -10.817 -4.054 13.605 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -13.743 -3.669 12.806 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -13.108 -4.417 14.258 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -13.925 -1.803 14.263 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -12.600 -2.338 15.277 1.00 0.00 H new ATOM 1390 N LEU A 89 -10.828 -2.025 10.116 1.00 0.00 N ATOM 1391 CA LEU A 89 -11.049 -1.721 8.696 1.00 0.00 C ATOM 1392 C LEU A 89 -10.537 -2.827 7.750 1.00 0.00 C ATOM 1393 O LEU A 89 -10.551 -2.628 6.535 1.00 0.00 O ATOM 1394 CB LEU A 89 -10.458 -0.335 8.332 1.00 0.00 C ATOM 1395 CG LEU A 89 -10.688 0.827 9.326 1.00 0.00 C ATOM 1396 CD1 LEU A 89 -9.992 2.089 8.808 1.00 0.00 C ATOM 1397 CD2 LEU A 89 -12.165 1.177 9.568 1.00 0.00 C ATOM 0 H LEU A 89 -9.875 -2.331 10.310 1.00 0.00 H new ATOM 0 HA LEU A 89 -12.128 -1.684 8.548 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -9.383 -0.454 8.197 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -10.869 -0.038 7.367 1.00 0.00 H new ATOM 0 HG LEU A 89 -10.276 0.481 10.274 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -10.154 2.908 9.509 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -8.923 1.901 8.711 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -10.403 2.358 7.835 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -12.232 2.002 10.277 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -12.629 1.470 8.626 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -12.683 0.308 9.972 1.00 0.00 H new ATOM 1409 N ALA A 90 -10.146 -4.000 8.266 1.00 0.00 N ATOM 1410 CA ALA A 90 -9.579 -5.134 7.520 1.00 0.00 C ATOM 1411 C ALA A 90 -10.602 -5.911 6.652 1.00 0.00 C ATOM 1412 O ALA A 90 -10.636 -7.137 6.649 1.00 0.00 O ATOM 1413 CB ALA A 90 -8.843 -6.050 8.512 1.00 0.00 C ATOM 0 H ALA A 90 -10.220 -4.194 9.265 1.00 0.00 H new ATOM 0 HA ALA A 90 -8.879 -4.731 6.788 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -8.415 -6.898 7.976 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -8.046 -5.490 9.001 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -9.545 -6.412 9.263 1.00 0.00 H new ATOM 1419 N THR A 91 -11.498 -5.202 5.959 1.00 0.00 N ATOM 1420 CA THR A 91 -12.498 -5.769 5.039 1.00 0.00 C ATOM 1421 C THR A 91 -12.094 -5.501 3.581 1.00 0.00 C ATOM 1422 O THR A 91 -12.170 -4.342 3.151 1.00 0.00 O ATOM 1423 CB THR A 91 -13.879 -5.171 5.335 1.00 0.00 C ATOM 1424 OG1 THR A 91 -14.228 -5.463 6.668 1.00 0.00 O ATOM 1425 CG2 THR A 91 -14.990 -5.740 4.453 1.00 0.00 C ATOM 0 H THR A 91 -11.552 -4.185 6.022 1.00 0.00 H new ATOM 0 HA THR A 91 -12.545 -6.848 5.188 1.00 0.00 H new ATOM 0 HB THR A 91 -13.797 -4.102 5.141 1.00 0.00 H new ATOM 0 HG1 THR A 91 -15.109 -5.083 6.866 1.00 0.00 H new ATOM 0 HG21 THR A 91 -15.939 -5.273 4.716 1.00 0.00 H new ATOM 0 HG22 THR A 91 -14.764 -5.537 3.406 1.00 0.00 H new ATOM 0 HG23 THR A 91 -15.061 -6.817 4.606 1.00 0.00 H new ATOM 1433 N PRO A 92 -11.566 -6.499 2.847 1.00 0.00 N ATOM 1434 CA PRO A 92 -11.252 -6.393 1.421 1.00 0.00 C ATOM 1435 C PRO A 92 -12.483 -6.731 0.541 1.00 0.00 C ATOM 1436 O PRO A 92 -12.889 -7.891 0.507 1.00 0.00 O ATOM 1437 CB PRO A 92 -10.110 -7.393 1.210 1.00 0.00 C ATOM 1438 CG PRO A 92 -10.399 -8.505 2.221 1.00 0.00 C ATOM 1439 CD PRO A 92 -11.097 -7.780 3.371 1.00 0.00 C ATOM 0 HA PRO A 92 -10.969 -5.381 1.132 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -10.098 -7.775 0.189 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -9.138 -6.933 1.390 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -11.034 -9.280 1.792 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -9.482 -8.992 2.553 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -11.931 -8.371 3.749 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -10.411 -7.628 4.204 1.00 0.00 H new ATOM 1447 N PRO A 93 -13.064 -5.763 -0.194 1.00 0.00 N ATOM 1448 CA PRO A 93 -14.120 -6.009 -1.180 1.00 0.00 C ATOM 1449 C PRO A 93 -13.544 -6.455 -2.541 1.00 0.00 C ATOM 1450 O PRO A 93 -12.330 -6.594 -2.708 1.00 0.00 O ATOM 1451 CB PRO A 93 -14.862 -4.671 -1.257 1.00 0.00 C ATOM 1452 CG PRO A 93 -13.735 -3.655 -1.097 1.00 0.00 C ATOM 1453 CD PRO A 93 -12.779 -4.336 -0.122 1.00 0.00 C ATOM 0 HA PRO A 93 -14.783 -6.827 -0.898 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -15.384 -4.551 -2.206 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -15.609 -4.576 -0.469 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -13.251 -3.439 -2.049 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -14.102 -2.707 -0.704 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -11.742 -4.133 -0.390 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -12.926 -3.961 0.891 1.00 0.00 H new ATOM 1461 N GLU A 94 -14.393 -6.518 -3.567 1.00 0.00 N ATOM 1462 CA GLU A 94 -14.093 -6.938 -4.948 1.00 0.00 C ATOM 1463 C GLU A 94 -12.901 -6.189 -5.562 1.00 0.00 C ATOM 1464 O GLU A 94 -12.075 -6.793 -6.252 1.00 0.00 O ATOM 1465 CB GLU A 94 -15.308 -6.702 -5.877 1.00 0.00 C ATOM 1466 CG GLU A 94 -16.663 -7.289 -5.433 1.00 0.00 C ATOM 1467 CD GLU A 94 -17.227 -6.654 -4.154 1.00 0.00 C ATOM 1468 OE1 GLU A 94 -17.112 -5.413 -4.076 1.00 0.00 O ATOM 1469 OE2 GLU A 94 -17.179 -7.376 -3.138 1.00 0.00 O1- ATOM 0 H GLU A 94 -15.374 -6.262 -3.455 1.00 0.00 H new ATOM 0 HA GLU A 94 -13.850 -7.998 -4.875 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -15.432 -5.626 -6.004 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -15.068 -7.113 -6.858 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -17.385 -7.161 -6.239 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -16.549 -8.361 -5.275 1.00 0.00 H new ATOM 1476 N PHE A 95 -12.721 -4.918 -5.193 1.00 0.00 N ATOM 1477 CA PHE A 95 -11.600 -4.066 -5.598 1.00 0.00 C ATOM 1478 C PHE A 95 -10.218 -4.625 -5.223 1.00 0.00 C ATOM 1479 O PHE A 95 -9.256 -4.388 -5.953 1.00 0.00 O ATOM 1480 CB PHE A 95 -11.811 -2.669 -4.996 1.00 0.00 C ATOM 1481 CG PHE A 95 -13.068 -2.000 -5.506 1.00 0.00 C ATOM 1482 CD1 PHE A 95 -13.116 -1.582 -6.846 1.00 0.00 C ATOM 1483 CD2 PHE A 95 -14.205 -1.855 -4.687 1.00 0.00 C ATOM 1484 CE1 PHE A 95 -14.298 -1.049 -7.376 1.00 0.00 C ATOM 1485 CE2 PHE A 95 -15.391 -1.321 -5.219 1.00 0.00 C ATOM 1486 CZ PHE A 95 -15.440 -0.928 -6.567 1.00 0.00 C ATOM 0 H PHE A 95 -13.378 -4.436 -4.580 1.00 0.00 H new ATOM 0 HA PHE A 95 -11.596 -4.024 -6.687 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -11.861 -2.749 -3.910 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -10.950 -2.043 -5.230 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -12.239 -1.672 -7.470 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -14.165 -2.154 -3.650 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -14.331 -0.731 -8.408 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -16.264 -1.213 -4.592 1.00 0.00 H new ATOM 0 HZ PHE A 95 -16.356 -0.533 -6.981 1.00 0.00 H new ATOM 1496 N ALA A 96 -10.120 -5.494 -4.212 1.00 0.00 N ATOM 1497 CA ALA A 96 -8.884 -6.198 -3.872 1.00 0.00 C ATOM 1498 C ALA A 96 -8.439 -7.200 -4.959 1.00 0.00 C ATOM 1499 O ALA A 96 -7.239 -7.403 -5.143 1.00 0.00 O ATOM 1500 CB ALA A 96 -9.082 -6.900 -2.523 1.00 0.00 C ATOM 0 H ALA A 96 -10.904 -5.729 -3.603 1.00 0.00 H new ATOM 0 HA ALA A 96 -8.080 -5.465 -3.805 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -8.170 -7.431 -2.252 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -9.311 -6.159 -1.757 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -9.906 -7.610 -2.600 1.00 0.00 H new ATOM 1506 N SER A 97 -9.364 -7.749 -5.755 1.00 0.00 N ATOM 1507 CA SER A 97 -9.035 -8.690 -6.838 1.00 0.00 C ATOM 1508 C SER A 97 -8.218 -8.025 -7.954 1.00 0.00 C ATOM 1509 O SER A 97 -7.097 -8.448 -8.222 1.00 0.00 O ATOM 1510 CB SER A 97 -10.306 -9.346 -7.396 1.00 0.00 C ATOM 1511 OG SER A 97 -11.127 -8.422 -8.081 1.00 0.00 O ATOM 0 H SER A 97 -10.362 -7.555 -5.669 1.00 0.00 H new ATOM 0 HA SER A 97 -8.407 -9.471 -6.409 1.00 0.00 H new ATOM 0 HB2 SER A 97 -10.029 -10.154 -8.073 1.00 0.00 H new ATOM 0 HB3 SER A 97 -10.870 -9.794 -6.578 1.00 0.00 H new ATOM 0 HG SER A 97 -11.523 -7.797 -7.438 1.00 0.00 H new ATOM 1517 N VAL A 98 -8.648 -6.852 -8.427 1.00 0.00 N ATOM 1518 CA VAL A 98 -7.905 -6.043 -9.408 1.00 0.00 C ATOM 1519 C VAL A 98 -6.741 -5.292 -8.749 1.00 0.00 C ATOM 1520 O VAL A 98 -5.624 -5.295 -9.267 1.00 0.00 O ATOM 1521 CB VAL A 98 -8.857 -5.072 -10.134 1.00 0.00 C ATOM 1522 CG1 VAL A 98 -8.125 -4.251 -11.199 1.00 0.00 C ATOM 1523 CG2 VAL A 98 -10.008 -5.810 -10.833 1.00 0.00 C ATOM 0 H VAL A 98 -9.531 -6.429 -8.139 1.00 0.00 H new ATOM 0 HA VAL A 98 -7.475 -6.718 -10.148 1.00 0.00 H new ATOM 0 HB VAL A 98 -9.252 -4.416 -9.358 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -8.830 -3.579 -11.688 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -7.334 -3.667 -10.728 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -7.689 -4.922 -11.940 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -10.654 -5.087 -11.332 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -9.602 -6.503 -11.570 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -10.586 -6.365 -10.094 1.00 0.00 H new ATOM 1533 N GLY A 99 -6.936 -4.795 -7.525 1.00 0.00 N ATOM 1534 CA GLY A 99 -5.916 -4.069 -6.768 1.00 0.00 C ATOM 1535 C GLY A 99 -4.691 -4.911 -6.401 1.00 0.00 C ATOM 1536 O GLY A 99 -3.570 -4.417 -6.503 1.00 0.00 O ATOM 0 H GLY A 99 -7.821 -4.888 -7.026 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -5.590 -3.208 -7.352 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -6.365 -3.682 -5.853 1.00 0.00 H new ATOM 1540 N SER A 100 -4.858 -6.219 -6.187 1.00 0.00 N ATOM 1541 CA SER A 100 -3.745 -7.160 -5.974 1.00 0.00 C ATOM 1542 C SER A 100 -2.937 -7.482 -7.241 1.00 0.00 C ATOM 1543 O SER A 100 -1.789 -7.902 -7.110 1.00 0.00 O ATOM 1544 CB SER A 100 -4.247 -8.457 -5.330 1.00 0.00 C ATOM 1545 OG SER A 100 -5.077 -9.183 -6.212 1.00 0.00 O ATOM 0 H SER A 100 -5.776 -6.663 -6.156 1.00 0.00 H new ATOM 0 HA SER A 100 -3.060 -6.647 -5.299 1.00 0.00 H new ATOM 0 HB2 SER A 100 -3.396 -9.073 -5.039 1.00 0.00 H new ATOM 0 HB3 SER A 100 -4.798 -8.223 -4.419 1.00 0.00 H new ATOM 0 HG SER A 100 -5.602 -8.559 -6.755 1.00 0.00 H new ATOM 1551 N LYS A 101 -3.444 -7.157 -8.442 1.00 0.00 N ATOM 1552 CA LYS A 101 -2.678 -7.169 -9.706 1.00 0.00 C ATOM 1553 C LYS A 101 -1.938 -5.847 -9.960 1.00 0.00 C ATOM 1554 O LYS A 101 -0.732 -5.876 -10.201 1.00 0.00 O ATOM 1555 CB LYS A 101 -3.626 -7.518 -10.865 1.00 0.00 C ATOM 1556 CG LYS A 101 -2.864 -7.875 -12.152 1.00 0.00 C ATOM 1557 CD LYS A 101 -3.838 -8.232 -13.283 1.00 0.00 C ATOM 1558 CE LYS A 101 -3.071 -8.617 -14.558 1.00 0.00 C ATOM 1559 NZ LYS A 101 -3.421 -7.749 -15.706 1.00 0.00 N1+ ATOM 0 H LYS A 101 -4.416 -6.873 -8.567 1.00 0.00 H new ATOM 0 HA LYS A 101 -1.902 -7.931 -9.630 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -4.258 -8.357 -10.575 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -4.287 -6.673 -11.059 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -2.240 -7.034 -12.455 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -2.196 -8.715 -11.963 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -4.476 -9.059 -12.973 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -4.492 -7.384 -13.488 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -2.000 -8.552 -14.369 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -3.287 -9.655 -14.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -3.307 -8.282 -16.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -4.408 -7.435 -15.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -2.793 -6.920 -15.718 1.00 0.00 H new ATOM 1573 N ILE A 102 -2.592 -4.724 -9.645 1.00 0.00 N ATOM 1574 CA ILE A 102 -2.017 -3.363 -9.679 1.00 0.00 C ATOM 1575 C ILE A 102 -0.849 -3.220 -8.682 1.00 0.00 C ATOM 1576 O ILE A 102 0.179 -2.614 -8.981 1.00 0.00 O ATOM 1577 CB ILE A 102 -3.141 -2.325 -9.427 1.00 0.00 C ATOM 1578 CG1 ILE A 102 -4.138 -2.333 -10.611 1.00 0.00 C ATOM 1579 CG2 ILE A 102 -2.603 -0.897 -9.226 1.00 0.00 C ATOM 1580 CD1 ILE A 102 -5.409 -1.505 -10.384 1.00 0.00 C ATOM 0 H ILE A 102 -3.568 -4.731 -9.349 1.00 0.00 H new ATOM 0 HA ILE A 102 -1.594 -3.175 -10.666 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.640 -2.618 -8.503 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -3.630 -1.957 -11.499 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -4.425 -3.364 -10.820 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -3.436 -0.215 -9.054 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -1.935 -0.878 -8.365 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -2.057 -0.585 -10.116 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -6.047 -1.569 -11.265 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -5.946 -1.892 -9.518 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -5.138 -0.464 -10.207 1.00 0.00 H new ATOM 1592 N PHE A 103 -0.966 -3.852 -7.513 1.00 0.00 N ATOM 1593 CA PHE A 103 -0.002 -3.805 -6.410 1.00 0.00 C ATOM 1594 C PHE A 103 1.444 -4.171 -6.815 1.00 0.00 C ATOM 1595 O PHE A 103 2.328 -3.329 -6.612 1.00 0.00 O ATOM 1596 CB PHE A 103 -0.570 -4.648 -5.251 1.00 0.00 C ATOM 1597 CG PHE A 103 0.412 -5.101 -4.188 1.00 0.00 C ATOM 1598 CD1 PHE A 103 1.244 -4.170 -3.539 1.00 0.00 C ATOM 1599 CD2 PHE A 103 0.464 -6.458 -3.817 1.00 0.00 C ATOM 1600 CE1 PHE A 103 2.148 -4.601 -2.551 1.00 0.00 C ATOM 1601 CE2 PHE A 103 1.346 -6.882 -2.808 1.00 0.00 C ATOM 1602 CZ PHE A 103 2.188 -5.954 -2.175 1.00 0.00 C ATOM 0 H PHE A 103 -1.773 -4.438 -7.299 1.00 0.00 H new ATOM 0 HA PHE A 103 0.113 -2.773 -6.078 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -1.355 -4.070 -4.764 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -1.043 -5.533 -5.675 1.00 0.00 H new ATOM 0 HD1 PHE A 103 1.188 -3.123 -3.800 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -0.176 -7.176 -4.309 1.00 0.00 H new ATOM 0 HE1 PHE A 103 2.812 -3.891 -2.081 1.00 0.00 H new ATOM 0 HE2 PHE A 103 1.376 -7.922 -2.520 1.00 0.00 H new ATOM 0 HZ PHE A 103 2.866 -6.280 -1.400 1.00 0.00 H new ATOM 1612 N PRO A 104 1.720 -5.334 -7.441 1.00 0.00 N ATOM 1613 CA PRO A 104 3.027 -5.641 -8.013 1.00 0.00 C ATOM 1614 C PRO A 104 3.258 -4.990 -9.384 1.00 0.00 C ATOM 1615 O PRO A 104 4.389 -4.581 -9.651 1.00 0.00 O ATOM 1616 CB PRO A 104 3.072 -7.170 -8.110 1.00 0.00 C ATOM 1617 CG PRO A 104 1.610 -7.549 -8.333 1.00 0.00 C ATOM 1618 CD PRO A 104 0.875 -6.516 -7.484 1.00 0.00 C ATOM 0 HA PRO A 104 3.822 -5.238 -7.386 1.00 0.00 H new ATOM 0 HB2 PRO A 104 3.704 -7.503 -8.933 1.00 0.00 H new ATOM 0 HB3 PRO A 104 3.470 -7.620 -7.200 1.00 0.00 H new ATOM 0 HG2 PRO A 104 1.329 -7.486 -9.384 1.00 0.00 H new ATOM 0 HG3 PRO A 104 1.399 -8.568 -8.007 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -0.098 -6.281 -7.916 1.00 0.00 H new ATOM 0 HD3 PRO A 104 0.693 -6.899 -6.480 1.00 0.00 H new ATOM 1626 N SER A 105 2.240 -4.844 -10.247 1.00 0.00 N ATOM 1627 CA SER A 105 2.449 -4.348 -11.620 1.00 0.00 C ATOM 1628 C SER A 105 2.926 -2.886 -11.655 1.00 0.00 C ATOM 1629 O SER A 105 3.907 -2.595 -12.339 1.00 0.00 O ATOM 1630 CB SER A 105 1.200 -4.577 -12.491 1.00 0.00 C ATOM 1631 OG SER A 105 0.165 -3.680 -12.168 1.00 0.00 O ATOM 0 H SER A 105 1.269 -5.060 -10.022 1.00 0.00 H new ATOM 0 HA SER A 105 3.260 -4.935 -12.052 1.00 0.00 H new ATOM 0 HB2 SER A 105 1.464 -4.463 -13.542 1.00 0.00 H new ATOM 0 HB3 SER A 105 0.848 -5.600 -12.360 1.00 0.00 H new ATOM 0 HG SER A 105 -0.678 -4.002 -12.550 1.00 0.00 H new ATOM 1637 N PHE A 106 2.518 -2.067 -10.679 1.00 0.00 N ATOM 1638 CA PHE A 106 3.016 -0.694 -10.504 1.00 0.00 C ATOM 1639 C PHE A 106 4.392 -0.617 -9.813 1.00 0.00 C ATOM 1640 O PHE A 106 5.136 0.332 -10.054 1.00 0.00 O ATOM 1641 CB PHE A 106 1.965 0.154 -9.766 1.00 0.00 C ATOM 1642 CG PHE A 106 0.824 0.668 -10.638 1.00 0.00 C ATOM 1643 CD1 PHE A 106 0.119 -0.186 -11.512 1.00 0.00 C ATOM 1644 CD2 PHE A 106 0.477 2.033 -10.592 1.00 0.00 C ATOM 1645 CE1 PHE A 106 -0.889 0.319 -12.349 1.00 0.00 C ATOM 1646 CE2 PHE A 106 -0.530 2.540 -11.434 1.00 0.00 C ATOM 1647 CZ PHE A 106 -1.205 1.683 -12.318 1.00 0.00 C ATOM 0 H PHE A 106 1.826 -2.339 -9.981 1.00 0.00 H new ATOM 0 HA PHE A 106 3.175 -0.284 -11.501 1.00 0.00 H new ATOM 0 HB2 PHE A 106 1.544 -0.441 -8.956 1.00 0.00 H new ATOM 0 HB3 PHE A 106 2.465 1.007 -9.308 1.00 0.00 H new ATOM 0 HD1 PHE A 106 0.357 -1.239 -11.538 1.00 0.00 H new ATOM 0 HD2 PHE A 106 0.987 2.694 -9.907 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -1.420 -0.344 -13.016 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -0.784 3.589 -11.400 1.00 0.00 H new ATOM 0 HZ PHE A 106 -1.968 2.076 -12.974 1.00 0.00 H new ATOM 1657 N VAL A 107 4.825 -1.648 -9.071 1.00 0.00 N ATOM 1658 CA VAL A 107 6.248 -1.776 -8.677 1.00 0.00 C ATOM 1659 C VAL A 107 7.108 -2.180 -9.876 1.00 0.00 C ATOM 1660 O VAL A 107 8.195 -1.637 -10.065 1.00 0.00 O ATOM 1661 CB VAL A 107 6.455 -2.766 -7.510 1.00 0.00 C ATOM 1662 CG1 VAL A 107 7.934 -2.915 -7.122 1.00 0.00 C ATOM 1663 CG2 VAL A 107 5.712 -2.296 -6.254 1.00 0.00 C ATOM 0 H VAL A 107 4.224 -2.399 -8.732 1.00 0.00 H new ATOM 0 HA VAL A 107 6.564 -0.794 -8.325 1.00 0.00 H new ATOM 0 HB VAL A 107 6.069 -3.721 -7.865 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.024 -3.622 -6.297 1.00 0.00 H new ATOM 0 HG12 VAL A 107 8.500 -3.282 -7.978 1.00 0.00 H new ATOM 0 HG13 VAL A 107 8.329 -1.947 -6.815 1.00 0.00 H new ATOM 0 HG21 VAL A 107 5.874 -3.010 -5.447 1.00 0.00 H new ATOM 0 HG22 VAL A 107 6.088 -1.318 -5.954 1.00 0.00 H new ATOM 0 HG23 VAL A 107 4.645 -2.225 -6.467 1.00 0.00 H new ATOM 1673 N LYS A 108 6.596 -3.058 -10.747 1.00 0.00 N ATOM 1674 CA LYS A 108 7.290 -3.471 -11.971 1.00 0.00 C ATOM 1675 C LYS A 108 7.379 -2.358 -13.022 1.00 0.00 C ATOM 1676 O LYS A 108 8.421 -2.235 -13.657 1.00 0.00 O ATOM 1677 CB LYS A 108 6.637 -4.749 -12.524 1.00 0.00 C ATOM 1678 CG LYS A 108 7.344 -5.320 -13.764 1.00 0.00 C ATOM 1679 CD LYS A 108 8.834 -5.578 -13.506 1.00 0.00 C ATOM 1680 CE LYS A 108 9.488 -6.109 -14.772 1.00 0.00 C ATOM 1681 NZ LYS A 108 10.951 -6.218 -14.609 1.00 0.00 N1+ ATOM 0 H LYS A 108 5.687 -3.503 -10.622 1.00 0.00 H new ATOM 0 HA LYS A 108 8.326 -3.689 -11.712 1.00 0.00 H new ATOM 0 HB2 LYS A 108 6.626 -5.508 -11.742 1.00 0.00 H new ATOM 0 HB3 LYS A 108 5.598 -4.535 -12.776 1.00 0.00 H new ATOM 0 HG2 LYS A 108 6.861 -6.251 -14.061 1.00 0.00 H new ATOM 0 HG3 LYS A 108 7.235 -4.625 -14.596 1.00 0.00 H new ATOM 0 HD2 LYS A 108 9.324 -4.656 -13.191 1.00 0.00 H new ATOM 0 HD3 LYS A 108 8.954 -6.296 -12.695 1.00 0.00 H new ATOM 0 HE2 LYS A 108 9.073 -7.086 -15.017 1.00 0.00 H new ATOM 0 HE3 LYS A 108 9.260 -5.447 -15.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 11.418 -6.012 -15.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 11.272 -5.537 -13.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 11.196 -7.182 -14.305 1.00 0.00 H new ATOM 1695 N PHE A 109 6.431 -1.424 -13.026 1.00 0.00 N ATOM 1696 CA PHE A 109 6.465 -0.190 -13.821 1.00 0.00 C ATOM 1697 C PHE A 109 7.695 0.680 -13.480 1.00 0.00 C ATOM 1698 O PHE A 109 8.496 0.989 -14.363 1.00 0.00 O ATOM 1699 CB PHE A 109 5.139 0.549 -13.556 1.00 0.00 C ATOM 1700 CG PHE A 109 4.668 1.610 -14.536 1.00 0.00 C ATOM 1701 CD1 PHE A 109 5.451 2.058 -15.619 1.00 0.00 C ATOM 1702 CD2 PHE A 109 3.368 2.129 -14.365 1.00 0.00 C ATOM 1703 CE1 PHE A 109 4.926 2.999 -16.520 1.00 0.00 C ATOM 1704 CE2 PHE A 109 2.837 3.050 -15.284 1.00 0.00 C ATOM 1705 CZ PHE A 109 3.617 3.480 -16.366 1.00 0.00 C ATOM 0 H PHE A 109 5.588 -1.504 -12.458 1.00 0.00 H new ATOM 0 HA PHE A 109 6.564 -0.420 -14.882 1.00 0.00 H new ATOM 0 HB2 PHE A 109 4.353 -0.203 -13.486 1.00 0.00 H new ATOM 0 HB3 PHE A 109 5.217 1.020 -12.576 1.00 0.00 H new ATOM 0 HD1 PHE A 109 6.453 1.678 -15.756 1.00 0.00 H new ATOM 0 HD2 PHE A 109 2.774 1.815 -13.519 1.00 0.00 H new ATOM 0 HE1 PHE A 109 5.535 3.355 -17.338 1.00 0.00 H new ATOM 0 HE2 PHE A 109 1.832 3.425 -15.157 1.00 0.00 H new ATOM 0 HZ PHE A 109 3.211 4.181 -17.080 1.00 0.00 H new ATOM 1715 N LEU A 110 8.021 0.783 -12.186 1.00 0.00 N ATOM 1716 CA LEU A 110 9.232 1.428 -11.651 1.00 0.00 C ATOM 1717 C LEU A 110 10.514 0.558 -11.713 1.00 0.00 C ATOM 1718 O LEU A 110 11.576 1.011 -11.285 1.00 0.00 O ATOM 1719 CB LEU A 110 8.917 1.903 -10.216 1.00 0.00 C ATOM 1720 CG LEU A 110 7.871 3.036 -10.141 1.00 0.00 C ATOM 1721 CD1 LEU A 110 7.402 3.214 -8.697 1.00 0.00 C ATOM 1722 CD2 LEU A 110 8.432 4.374 -10.629 1.00 0.00 C ATOM 0 H LEU A 110 7.425 0.404 -11.450 1.00 0.00 H new ATOM 0 HA LEU A 110 9.476 2.273 -12.294 1.00 0.00 H new ATOM 0 HB2 LEU A 110 8.559 1.054 -9.634 1.00 0.00 H new ATOM 0 HB3 LEU A 110 9.840 2.244 -9.747 1.00 0.00 H new ATOM 0 HG LEU A 110 7.043 2.748 -10.789 1.00 0.00 H new ATOM 0 HD11 LEU A 110 6.664 4.015 -8.650 1.00 0.00 H new ATOM 0 HD12 LEU A 110 6.953 2.286 -8.343 1.00 0.00 H new ATOM 0 HD13 LEU A 110 8.254 3.468 -8.066 1.00 0.00 H new ATOM 0 HD21 LEU A 110 7.660 5.140 -10.557 1.00 0.00 H new ATOM 0 HD22 LEU A 110 9.284 4.658 -10.011 1.00 0.00 H new ATOM 0 HD23 LEU A 110 8.752 4.278 -11.666 1.00 0.00 H new ATOM 1734 N LYS A 111 10.444 -0.643 -12.310 1.00 0.00 N ATOM 1735 CA LYS A 111 11.542 -1.613 -12.540 1.00 0.00 C ATOM 1736 C LYS A 111 11.472 -2.212 -13.962 1.00 0.00 C ATOM 1737 O LYS A 111 11.713 -3.405 -14.199 1.00 0.00 O ATOM 1738 CB LYS A 111 11.542 -2.632 -11.382 1.00 0.00 C ATOM 1739 CG LYS A 111 12.662 -3.694 -11.441 1.00 0.00 C ATOM 1740 CD LYS A 111 13.054 -4.214 -10.053 1.00 0.00 C ATOM 1741 CE LYS A 111 13.922 -3.166 -9.359 1.00 0.00 C ATOM 1742 NZ LYS A 111 14.012 -3.379 -7.903 1.00 0.00 N1+ ATOM 0 H LYS A 111 9.557 -0.992 -12.673 1.00 0.00 H new ATOM 0 HA LYS A 111 12.516 -1.124 -12.522 1.00 0.00 H new ATOM 0 HB2 LYS A 111 11.628 -2.089 -10.441 1.00 0.00 H new ATOM 0 HB3 LYS A 111 10.579 -3.143 -11.369 1.00 0.00 H new ATOM 0 HG2 LYS A 111 12.333 -4.530 -12.059 1.00 0.00 H new ATOM 0 HG3 LYS A 111 13.539 -3.265 -11.926 1.00 0.00 H new ATOM 0 HD2 LYS A 111 12.162 -4.417 -9.461 1.00 0.00 H new ATOM 0 HD3 LYS A 111 13.598 -5.154 -10.142 1.00 0.00 H new ATOM 0 HE2 LYS A 111 14.924 -3.187 -9.788 1.00 0.00 H new ATOM 0 HE3 LYS A 111 13.513 -2.174 -9.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 14.339 -2.505 -7.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 13.075 -3.635 -7.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 14.685 -4.147 -7.705 1.00 0.00 H new ATOM 1756 N SER A 112 11.057 -1.379 -14.913 1.00 0.00 N ATOM 1757 CA SER A 112 10.702 -1.733 -16.291 1.00 0.00 C ATOM 1758 C SER A 112 11.914 -1.856 -17.229 1.00 0.00 C ATOM 1759 O SER A 112 12.005 -1.214 -18.272 1.00 0.00 O ATOM 1760 CB SER A 112 9.644 -0.762 -16.812 1.00 0.00 C ATOM 1761 OG SER A 112 9.990 0.591 -16.559 1.00 0.00 O ATOM 0 H SER A 112 10.952 -0.380 -14.735 1.00 0.00 H new ATOM 0 HA SER A 112 10.277 -2.736 -16.277 1.00 0.00 H new ATOM 0 HB2 SER A 112 9.515 -0.908 -17.884 1.00 0.00 H new ATOM 0 HB3 SER A 112 8.686 -0.985 -16.343 1.00 0.00 H new ATOM 0 HG SER A 112 9.401 0.955 -15.866 1.00 0.00 H new ATOM 1767 N LYS A 113 12.839 -2.751 -16.859 1.00 0.00 N ATOM 1768 CA LYS A 113 13.863 -3.309 -17.766 1.00 0.00 C ATOM 1769 C LYS A 113 13.190 -4.094 -18.903 1.00 0.00 C ATOM 1770 O LYS A 113 13.392 -3.819 -20.079 1.00 0.00 O ATOM 1771 CB LYS A 113 14.831 -4.192 -16.952 1.00 0.00 C ATOM 1772 CG LYS A 113 15.599 -3.374 -15.899 1.00 0.00 C ATOM 1773 CD LYS A 113 16.528 -4.244 -15.043 1.00 0.00 C ATOM 1774 CE LYS A 113 17.325 -3.321 -14.113 1.00 0.00 C ATOM 1775 NZ LYS A 113 18.312 -4.053 -13.285 1.00 0.00 N1+ ATOM 0 H LYS A 113 12.902 -3.116 -15.909 1.00 0.00 H new ATOM 0 HA LYS A 113 14.437 -2.504 -18.224 1.00 0.00 H new ATOM 0 HB2 LYS A 113 14.271 -4.986 -16.458 1.00 0.00 H new ATOM 0 HB3 LYS A 113 15.539 -4.673 -17.627 1.00 0.00 H new ATOM 0 HG2 LYS A 113 16.186 -2.604 -16.399 1.00 0.00 H new ATOM 0 HG3 LYS A 113 14.887 -2.862 -15.251 1.00 0.00 H new ATOM 0 HD2 LYS A 113 15.949 -4.961 -14.462 1.00 0.00 H new ATOM 0 HD3 LYS A 113 17.202 -4.819 -15.678 1.00 0.00 H new ATOM 0 HE2 LYS A 113 17.844 -2.571 -14.710 1.00 0.00 H new ATOM 0 HE3 LYS A 113 16.635 -2.787 -13.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 19.007 -3.382 -12.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 17.822 -4.532 -12.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 18.801 -4.759 -13.871 1.00 0.00 H new ATOM 1789 N ASP A 114 12.226 -4.914 -18.510 1.00 0.00 N ATOM 1790 CA ASP A 114 11.092 -5.406 -19.282 1.00 0.00 C ATOM 1791 C ASP A 114 10.183 -4.191 -19.613 1.00 0.00 C ATOM 1792 O ASP A 114 9.770 -3.510 -18.668 1.00 0.00 O ATOM 1793 CB ASP A 114 10.305 -6.494 -18.495 1.00 0.00 C ATOM 1794 CG ASP A 114 11.053 -7.397 -17.480 1.00 0.00 C ATOM 1795 OD1 ASP A 114 12.091 -6.967 -16.922 1.00 0.00 O ATOM 1796 OD2 ASP A 114 10.319 -8.132 -16.797 1.00 0.00 O1- ATOM 0 H ASP A 114 12.216 -5.285 -17.560 1.00 0.00 H new ATOM 0 HA ASP A 114 11.442 -5.876 -20.201 1.00 0.00 H new ATOM 0 HB2 ASP A 114 9.504 -5.990 -17.954 1.00 0.00 H new ATOM 0 HB3 ASP A 114 9.833 -7.149 -19.227 1.00 0.00 H new ATOM 1801 N PRO A 115 9.931 -3.839 -20.893 1.00 0.00 N ATOM 1802 CA PRO A 115 9.466 -2.494 -21.251 1.00 0.00 C ATOM 1803 C PRO A 115 8.170 -2.031 -20.571 1.00 0.00 C ATOM 1804 O PRO A 115 7.123 -2.686 -20.650 1.00 0.00 O ATOM 1805 CB PRO A 115 9.332 -2.489 -22.772 1.00 0.00 C ATOM 1806 CG PRO A 115 10.429 -3.455 -23.202 1.00 0.00 C ATOM 1807 CD PRO A 115 10.405 -4.515 -22.100 1.00 0.00 C ATOM 0 HA PRO A 115 10.194 -1.770 -20.885 1.00 0.00 H new ATOM 0 HB2 PRO A 115 8.346 -2.825 -23.094 1.00 0.00 H new ATOM 0 HB3 PRO A 115 9.481 -1.493 -23.189 1.00 0.00 H new ATOM 0 HG2 PRO A 115 10.225 -3.887 -24.182 1.00 0.00 H new ATOM 0 HG3 PRO A 115 11.399 -2.962 -23.266 1.00 0.00 H new ATOM 0 HD2 PRO A 115 9.745 -5.340 -22.368 1.00 0.00 H new ATOM 0 HD3 PRO A 115 11.398 -4.938 -21.945 1.00 0.00 H new ATOM 1815 N ASN A 116 8.188 -0.785 -20.090 1.00 0.00 N ATOM 1816 CA ASN A 116 6.994 -0.094 -19.592 1.00 0.00 C ATOM 1817 C ASN A 116 5.996 0.223 -20.719 1.00 0.00 C ATOM 1818 O ASN A 116 4.838 -0.144 -20.575 1.00 0.00 O ATOM 1819 CB ASN A 116 7.379 1.152 -18.778 1.00 0.00 C ATOM 1820 CG ASN A 116 8.372 2.064 -19.468 1.00 0.00 C ATOM 1821 OD1 ASN A 116 8.032 2.827 -20.349 1.00 0.00 O ATOM 1822 ND2 ASN A 116 9.644 1.945 -19.166 1.00 0.00 N ATOM 0 H ASN A 116 9.037 -0.223 -20.035 1.00 0.00 H new ATOM 0 HA ASN A 116 6.476 -0.774 -18.916 1.00 0.00 H new ATOM 0 HB2 ASN A 116 6.476 1.720 -18.555 1.00 0.00 H new ATOM 0 HB3 ASN A 116 7.798 0.833 -17.824 1.00 0.00 H new ATOM 0 HD21 ASN A 116 10.341 2.492 -19.671 1.00 0.00 H new ATOM 0 HD22 ASN A 116 9.935 1.305 -18.427 1.00 0.00 H new ATOM 1829 N ASP A 117 6.479 0.491 -21.933 1.00 0.00 N ATOM 1830 CA ASP A 117 5.665 0.703 -23.142 1.00 0.00 C ATOM 1831 C ASP A 117 4.761 -0.489 -23.506 1.00 0.00 C ATOM 1832 O ASP A 117 3.656 -0.297 -24.012 1.00 0.00 O ATOM 1833 CB ASP A 117 6.591 1.008 -24.337 1.00 0.00 C ATOM 1834 CG ASP A 117 7.762 1.924 -23.977 1.00 0.00 C ATOM 1835 OD1 ASP A 117 8.708 1.364 -23.379 1.00 0.00 O ATOM 1836 OD2 ASP A 117 7.488 3.141 -23.874 1.00 0.00 O1- ATOM 0 H ASP A 117 7.480 0.570 -22.113 1.00 0.00 H new ATOM 0 HA ASP A 117 5.006 1.542 -22.920 1.00 0.00 H new ATOM 0 HB2 ASP A 117 6.981 0.071 -24.734 1.00 0.00 H new ATOM 0 HB3 ASP A 117 6.007 1.472 -25.131 1.00 0.00 H new ATOM 1841 N GLY A 118 5.202 -1.717 -23.209 1.00 0.00 N ATOM 1842 CA GLY A 118 4.388 -2.930 -23.344 1.00 0.00 C ATOM 1843 C GLY A 118 3.560 -3.252 -22.096 1.00 0.00 C ATOM 1844 O GLY A 118 2.408 -3.667 -22.210 1.00 0.00 O ATOM 0 H GLY A 118 6.145 -1.898 -22.864 1.00 0.00 H new ATOM 0 HA2 GLY A 118 3.717 -2.815 -24.196 1.00 0.00 H new ATOM 0 HA3 GLY A 118 5.042 -3.774 -23.565 1.00 0.00 H new ATOM 1848 N THR A 119 4.097 -2.965 -20.908 1.00 0.00 N ATOM 1849 CA THR A 119 3.421 -3.177 -19.615 1.00 0.00 C ATOM 1850 C THR A 119 2.180 -2.289 -19.460 1.00 0.00 C ATOM 1851 O THR A 119 1.114 -2.771 -19.084 1.00 0.00 O ATOM 1852 CB THR A 119 4.398 -2.908 -18.456 1.00 0.00 C ATOM 1853 OG1 THR A 119 5.552 -3.713 -18.572 1.00 0.00 O ATOM 1854 CG2 THR A 119 3.804 -3.218 -17.082 1.00 0.00 C ATOM 0 H THR A 119 5.033 -2.571 -20.810 1.00 0.00 H new ATOM 0 HA THR A 119 3.092 -4.216 -19.588 1.00 0.00 H new ATOM 0 HB THR A 119 4.629 -1.845 -18.528 1.00 0.00 H new ATOM 0 HG1 THR A 119 6.125 -3.363 -19.286 1.00 0.00 H new ATOM 0 HG21 THR A 119 4.544 -3.007 -16.310 1.00 0.00 H new ATOM 0 HG22 THR A 119 2.922 -2.599 -16.919 1.00 0.00 H new ATOM 0 HG23 THR A 119 3.522 -4.270 -17.036 1.00 0.00 H new ATOM 1862 N GLU A 120 2.263 -1.031 -19.893 1.00 0.00 N ATOM 1863 CA GLU A 120 1.205 -0.013 -19.821 1.00 0.00 C ATOM 1864 C GLU A 120 -0.078 -0.405 -20.565 1.00 0.00 C ATOM 1865 O GLU A 120 -1.172 -0.102 -20.090 1.00 0.00 O ATOM 1866 CB GLU A 120 1.752 1.297 -20.406 1.00 0.00 C ATOM 1867 CG GLU A 120 2.768 1.959 -19.462 1.00 0.00 C ATOM 1868 CD GLU A 120 3.708 2.928 -20.191 1.00 0.00 C ATOM 1869 OE1 GLU A 120 3.348 3.488 -21.255 1.00 0.00 O ATOM 1870 OE2 GLU A 120 4.847 3.112 -19.715 1.00 0.00 O1- ATOM 0 H GLU A 120 3.113 -0.672 -20.327 1.00 0.00 H new ATOM 0 HA GLU A 120 0.930 0.096 -18.772 1.00 0.00 H new ATOM 0 HB2 GLU A 120 2.225 1.097 -21.367 1.00 0.00 H new ATOM 0 HB3 GLU A 120 0.927 1.985 -20.593 1.00 0.00 H new ATOM 0 HG2 GLU A 120 2.234 2.497 -18.679 1.00 0.00 H new ATOM 0 HG3 GLU A 120 3.359 1.186 -18.971 1.00 0.00 H new ATOM 1877 N GLN A 121 0.043 -1.243 -21.599 1.00 0.00 N ATOM 1878 CA GLN A 121 -1.091 -1.788 -22.354 1.00 0.00 C ATOM 1879 C GLN A 121 -1.930 -2.789 -21.536 1.00 0.00 C ATOM 1880 O GLN A 121 -3.083 -3.037 -21.874 1.00 0.00 O ATOM 1881 CB GLN A 121 -0.593 -2.443 -23.657 1.00 0.00 C ATOM 1882 CG GLN A 121 0.468 -1.640 -24.434 1.00 0.00 C ATOM 1883 CD GLN A 121 0.111 -0.172 -24.660 1.00 0.00 C ATOM 1884 OE1 GLN A 121 -1.023 0.197 -24.918 1.00 0.00 O ATOM 1885 NE2 GLN A 121 1.074 0.719 -24.604 1.00 0.00 N ATOM 0 H GLN A 121 0.947 -1.568 -21.941 1.00 0.00 H new ATOM 0 HA GLN A 121 -1.748 -0.951 -22.592 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -0.180 -3.423 -23.417 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -1.449 -2.610 -24.311 1.00 0.00 H new ATOM 0 HG2 GLN A 121 1.413 -1.692 -23.893 1.00 0.00 H new ATOM 0 HG3 GLN A 121 0.628 -2.115 -25.402 1.00 0.00 H new ATOM 0 HE21 GLN A 121 2.027 0.427 -24.389 1.00 0.00 H new ATOM 0 HE22 GLN A 121 0.869 1.703 -24.775 1.00 0.00 H new ATOM 1894 N ALA A 122 -1.385 -3.338 -20.443 1.00 0.00 N ATOM 1895 CA ALA A 122 -2.152 -4.045 -19.417 1.00 0.00 C ATOM 1896 C ALA A 122 -2.599 -3.119 -18.271 1.00 0.00 C ATOM 1897 O ALA A 122 -3.716 -3.267 -17.774 1.00 0.00 O ATOM 1898 CB ALA A 122 -1.304 -5.208 -18.889 1.00 0.00 C ATOM 0 H ALA A 122 -0.385 -3.301 -20.247 1.00 0.00 H new ATOM 0 HA ALA A 122 -3.069 -4.425 -19.868 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -1.862 -5.746 -18.122 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -1.066 -5.886 -19.708 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -0.380 -4.819 -18.460 1.00 0.00 H new ATOM 1904 N LEU A 123 -1.778 -2.133 -17.881 1.00 0.00 N ATOM 1905 CA LEU A 123 -2.084 -1.232 -16.759 1.00 0.00 C ATOM 1906 C LEU A 123 -3.294 -0.328 -17.024 1.00 0.00 C ATOM 1907 O LEU A 123 -4.081 -0.094 -16.111 1.00 0.00 O ATOM 1908 CB LEU A 123 -0.874 -0.358 -16.388 1.00 0.00 C ATOM 1909 CG LEU A 123 0.436 -1.107 -16.103 1.00 0.00 C ATOM 1910 CD1 LEU A 123 1.467 -0.128 -15.558 1.00 0.00 C ATOM 1911 CD2 LEU A 123 0.296 -2.252 -15.105 1.00 0.00 C ATOM 0 H LEU A 123 -0.885 -1.938 -18.333 1.00 0.00 H new ATOM 0 HA LEU A 123 -2.331 -1.888 -15.924 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -0.697 0.346 -17.201 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -1.132 0.230 -15.507 1.00 0.00 H new ATOM 0 HG LEU A 123 0.744 -1.544 -17.053 1.00 0.00 H new ATOM 0 HD11 LEU A 123 2.398 -0.656 -15.354 1.00 0.00 H new ATOM 0 HD12 LEU A 123 1.648 0.656 -16.293 1.00 0.00 H new ATOM 0 HD13 LEU A 123 1.094 0.318 -14.636 1.00 0.00 H new ATOM 0 HD21 LEU A 123 1.266 -2.728 -14.960 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -0.064 -1.863 -14.153 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -0.414 -2.984 -15.489 1.00 0.00 H new ATOM 1923 N LEU A 124 -3.506 0.113 -18.268 1.00 0.00 N ATOM 1924 CA LEU A 124 -4.709 0.866 -18.644 1.00 0.00 C ATOM 1925 C LEU A 124 -5.990 0.037 -18.461 1.00 0.00 C ATOM 1926 O LEU A 124 -6.983 0.560 -17.956 1.00 0.00 O ATOM 1927 CB LEU A 124 -4.580 1.356 -20.098 1.00 0.00 C ATOM 1928 CG LEU A 124 -3.517 2.449 -20.307 1.00 0.00 C ATOM 1929 CD1 LEU A 124 -3.294 2.686 -21.800 1.00 0.00 C ATOM 1930 CD2 LEU A 124 -3.921 3.782 -19.667 1.00 0.00 C ATOM 0 H LEU A 124 -2.855 -0.040 -19.038 1.00 0.00 H new ATOM 0 HA LEU A 124 -4.790 1.725 -17.978 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -4.339 0.505 -20.736 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -5.546 1.738 -20.427 1.00 0.00 H new ATOM 0 HG LEU A 124 -2.604 2.094 -19.829 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -2.540 3.461 -21.937 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -2.954 1.762 -22.268 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -4.229 3.004 -22.262 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -3.139 4.521 -19.841 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -4.854 4.130 -20.109 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -4.057 3.644 -18.594 1.00 0.00 H new ATOM 1942 N GLU A 125 -5.944 -1.268 -18.732 1.00 0.00 N ATOM 1943 CA GLU A 125 -7.097 -2.163 -18.578 1.00 0.00 C ATOM 1944 C GLU A 125 -7.290 -2.627 -17.123 1.00 0.00 C ATOM 1945 O GLU A 125 -8.426 -2.684 -16.653 1.00 0.00 O ATOM 1946 CB GLU A 125 -6.995 -3.353 -19.548 1.00 0.00 C ATOM 1947 CG GLU A 125 -6.644 -3.006 -21.010 1.00 0.00 C ATOM 1948 CD GLU A 125 -7.297 -1.725 -21.554 1.00 0.00 C ATOM 1949 OE1 GLU A 125 -8.533 -1.682 -21.764 1.00 0.00 O ATOM 1950 OE2 GLU A 125 -6.617 -0.677 -21.640 1.00 0.00 O1- ATOM 0 H GLU A 125 -5.103 -1.738 -19.066 1.00 0.00 H new ATOM 0 HA GLU A 125 -7.989 -1.592 -18.836 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -6.241 -4.042 -19.168 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -7.946 -3.885 -19.540 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -5.562 -2.906 -21.093 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -6.937 -3.842 -21.645 1.00 0.00 H new ATOM 1957 N GLU A 126 -6.205 -2.750 -16.346 1.00 0.00 N ATOM 1958 CA GLU A 126 -6.250 -2.899 -14.881 1.00 0.00 C ATOM 1959 C GLU A 126 -6.905 -1.686 -14.206 1.00 0.00 C ATOM 1960 O GLU A 126 -7.858 -1.843 -13.439 1.00 0.00 O ATOM 1961 CB GLU A 126 -4.831 -3.104 -14.307 1.00 0.00 C ATOM 1962 CG GLU A 126 -4.248 -4.488 -14.618 1.00 0.00 C ATOM 1963 CD GLU A 126 -2.723 -4.591 -14.412 1.00 0.00 C ATOM 1964 OE1 GLU A 126 -2.230 -4.221 -13.326 1.00 0.00 O ATOM 1965 OE2 GLU A 126 -2.168 -5.467 -15.122 1.00 0.00 O1- ATOM 0 H GLU A 126 -5.256 -2.749 -16.721 1.00 0.00 H new ATOM 0 HA GLU A 126 -6.857 -3.779 -14.669 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -4.168 -2.339 -14.711 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -4.859 -2.963 -13.227 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -4.740 -5.228 -13.986 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -4.482 -4.745 -15.651 1.00 0.00 H new ATOM 1972 N LEU A 127 -6.507 -0.470 -14.597 1.00 0.00 N ATOM 1973 CA LEU A 127 -7.121 0.759 -14.102 1.00 0.00 C ATOM 1974 C LEU A 127 -8.584 0.890 -14.539 1.00 0.00 C ATOM 1975 O LEU A 127 -9.409 1.198 -13.687 1.00 0.00 O ATOM 1976 CB LEU A 127 -6.305 1.988 -14.536 1.00 0.00 C ATOM 1977 CG LEU A 127 -4.938 2.156 -13.844 1.00 0.00 C ATOM 1978 CD1 LEU A 127 -4.225 3.356 -14.470 1.00 0.00 C ATOM 1979 CD2 LEU A 127 -5.065 2.414 -12.339 1.00 0.00 C ATOM 0 H LEU A 127 -5.751 -0.314 -15.264 1.00 0.00 H new ATOM 0 HA LEU A 127 -7.117 0.707 -13.013 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -6.143 1.933 -15.613 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -6.900 2.882 -14.348 1.00 0.00 H new ATOM 0 HG LEU A 127 -4.384 1.227 -13.981 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -3.254 3.492 -13.993 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -4.084 3.180 -15.536 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -4.828 4.253 -14.327 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -4.072 2.524 -11.904 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -5.637 3.327 -12.173 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -5.576 1.575 -11.868 1.00 0.00 H new ATOM 1991 N LYS A 128 -8.953 0.542 -15.781 1.00 0.00 N ATOM 1992 CA LYS A 128 -10.360 0.556 -16.240 1.00 0.00 C ATOM 1993 C LYS A 128 -11.240 -0.423 -15.464 1.00 0.00 C ATOM 1994 O LYS A 128 -12.368 -0.070 -15.127 1.00 0.00 O ATOM 1995 CB LYS A 128 -10.446 0.209 -17.731 1.00 0.00 C ATOM 1996 CG LYS A 128 -10.019 1.343 -18.675 1.00 0.00 C ATOM 1997 CD LYS A 128 -9.699 0.729 -20.039 1.00 0.00 C ATOM 1998 CE LYS A 128 -9.206 1.739 -21.072 1.00 0.00 C ATOM 1999 NZ LYS A 128 -8.569 1.011 -22.191 1.00 0.00 N1+ ATOM 0 H LYS A 128 -8.291 0.243 -16.497 1.00 0.00 H new ATOM 0 HA LYS A 128 -10.727 1.567 -16.062 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -9.821 -0.663 -17.925 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -11.472 -0.076 -17.966 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -10.815 2.082 -18.767 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -9.147 1.862 -18.277 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -8.941 -0.043 -19.910 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -10.592 0.237 -20.424 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -10.039 2.339 -21.439 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -8.494 2.427 -20.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -8.613 1.592 -23.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -7.575 0.814 -21.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -9.071 0.114 -22.352 1.00 0.00 H new ATOM 2013 N ALA A 129 -10.749 -1.633 -15.191 1.00 0.00 N ATOM 2014 CA ALA A 129 -11.494 -2.652 -14.452 1.00 0.00 C ATOM 2015 C ALA A 129 -11.776 -2.229 -12.999 1.00 0.00 C ATOM 2016 O ALA A 129 -12.879 -2.443 -12.500 1.00 0.00 O ATOM 2017 CB ALA A 129 -10.704 -3.965 -14.514 1.00 0.00 C ATOM 0 H ALA A 129 -9.818 -1.935 -15.478 1.00 0.00 H new ATOM 0 HA ALA A 129 -12.472 -2.786 -14.915 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -11.243 -4.740 -13.968 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -10.585 -4.269 -15.554 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -9.722 -3.820 -14.064 1.00 0.00 H new ATOM 2023 N LEU A 130 -10.835 -1.518 -12.370 1.00 0.00 N ATOM 2024 CA LEU A 130 -11.023 -0.909 -11.054 1.00 0.00 C ATOM 2025 C LEU A 130 -11.959 0.321 -11.126 1.00 0.00 C ATOM 2026 O LEU A 130 -13.020 0.358 -10.505 1.00 0.00 O ATOM 2027 CB LEU A 130 -9.622 -0.562 -10.505 1.00 0.00 C ATOM 2028 CG LEU A 130 -9.595 -0.368 -8.981 1.00 0.00 C ATOM 2029 CD1 LEU A 130 -9.440 -1.703 -8.250 1.00 0.00 C ATOM 2030 CD2 LEU A 130 -8.422 0.528 -8.581 1.00 0.00 C ATOM 0 H LEU A 130 -9.911 -1.348 -12.767 1.00 0.00 H new ATOM 0 HA LEU A 130 -11.518 -1.602 -10.374 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -8.927 -1.357 -10.775 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -9.267 0.349 -10.986 1.00 0.00 H new ATOM 0 HG LEU A 130 -10.542 0.092 -8.700 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -9.425 -1.529 -7.174 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -10.277 -2.354 -8.500 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -8.507 -2.178 -8.554 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -8.415 0.657 -7.499 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -7.487 0.066 -8.897 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -8.527 1.501 -9.062 1.00 0.00 H new ATOM 2042 N ASP A 131 -11.627 1.279 -11.992 1.00 0.00 N ATOM 2043 CA ASP A 131 -12.284 2.583 -12.146 1.00 0.00 C ATOM 2044 C ASP A 131 -13.752 2.492 -12.593 1.00 0.00 C ATOM 2045 O ASP A 131 -14.597 3.221 -12.074 1.00 0.00 O ATOM 2046 CB ASP A 131 -11.464 3.399 -13.152 1.00 0.00 C ATOM 2047 CG ASP A 131 -12.024 4.800 -13.365 1.00 0.00 C ATOM 2048 OD1 ASP A 131 -11.522 5.747 -12.723 1.00 0.00 O ATOM 2049 OD2 ASP A 131 -12.759 4.978 -14.359 1.00 0.00 O1- ATOM 0 H ASP A 131 -10.850 1.162 -12.642 1.00 0.00 H new ATOM 0 HA ASP A 131 -12.316 3.065 -11.169 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -10.435 3.473 -12.801 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -11.439 2.873 -14.106 1.00 0.00 H new ATOM 2054 N GLY A 132 -14.091 1.518 -13.443 1.00 0.00 N ATOM 2055 CA GLY A 132 -15.457 1.286 -13.917 1.00 0.00 C ATOM 2056 C GLY A 132 -16.454 0.973 -12.796 1.00 0.00 C ATOM 2057 O GLY A 132 -17.566 1.496 -12.818 1.00 0.00 O ATOM 0 H GLY A 132 -13.413 0.859 -13.826 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -15.799 2.168 -14.459 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -15.450 0.459 -14.626 1.00 0.00 H new ATOM 2061 N HIS A 133 -16.003 0.289 -11.741 1.00 0.00 N ATOM 2062 CA HIS A 133 -16.799 0.031 -10.538 1.00 0.00 C ATOM 2063 C HIS A 133 -16.558 1.060 -9.417 1.00 0.00 C ATOM 2064 O HIS A 133 -17.506 1.417 -8.714 1.00 0.00 O ATOM 2065 CB HIS A 133 -16.552 -1.416 -10.088 1.00 0.00 C ATOM 2066 CG HIS A 133 -17.113 -2.431 -11.052 1.00 0.00 C ATOM 2067 ND1 HIS A 133 -18.440 -2.769 -11.187 1.00 0.00 N ATOM 2068 CD2 HIS A 133 -16.424 -3.104 -12.026 1.00 0.00 C ATOM 2069 CE1 HIS A 133 -18.545 -3.642 -12.202 1.00 0.00 C ATOM 2070 NE2 HIS A 133 -17.344 -3.871 -12.752 1.00 0.00 N ATOM 0 H HIS A 133 -15.064 -0.106 -11.698 1.00 0.00 H new ATOM 0 HA HIS A 133 -17.854 0.152 -10.783 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -15.480 -1.580 -9.978 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -17.000 -1.568 -9.106 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -15.360 -3.052 -12.203 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -19.468 -4.096 -12.530 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -17.141 -4.483 -13.543 1.00 0.00 H new ATOM 2078 N LEU A 134 -15.371 1.674 -9.324 1.00 0.00 N ATOM 2079 CA LEU A 134 -15.114 2.748 -8.351 1.00 0.00 C ATOM 2080 C LEU A 134 -15.925 4.019 -8.624 1.00 0.00 C ATOM 2081 O LEU A 134 -16.451 4.605 -7.681 1.00 0.00 O ATOM 2082 CB LEU A 134 -13.620 3.100 -8.310 1.00 0.00 C ATOM 2083 CG LEU A 134 -12.719 2.068 -7.619 1.00 0.00 C ATOM 2084 CD1 LEU A 134 -11.276 2.565 -7.673 1.00 0.00 C ATOM 2085 CD2 LEU A 134 -13.110 1.884 -6.157 1.00 0.00 C ATOM 0 H LEU A 134 -14.570 1.445 -9.912 1.00 0.00 H new ATOM 0 HA LEU A 134 -15.434 2.357 -7.385 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -13.268 3.237 -9.333 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -13.503 4.057 -7.802 1.00 0.00 H new ATOM 0 HG LEU A 134 -12.829 1.114 -8.134 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -10.623 1.841 -7.185 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -10.971 2.685 -8.713 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -11.202 3.524 -7.160 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -12.453 1.147 -5.695 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -13.014 2.835 -5.632 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -14.142 1.539 -6.097 1.00 0.00 H new ATOM 2097 N LYS A 135 -16.219 4.337 -9.890 1.00 0.00 N ATOM 2098 CA LYS A 135 -17.115 5.449 -10.265 1.00 0.00 C ATOM 2099 C LYS A 135 -18.581 5.253 -9.853 1.00 0.00 C ATOM 2100 O LYS A 135 -19.339 6.214 -9.906 1.00 0.00 O ATOM 2101 CB LYS A 135 -17.006 5.720 -11.772 1.00 0.00 C ATOM 2102 CG LYS A 135 -15.650 6.358 -12.109 1.00 0.00 C ATOM 2103 CD LYS A 135 -15.468 6.672 -13.595 1.00 0.00 C ATOM 2104 CE LYS A 135 -15.706 5.465 -14.504 1.00 0.00 C ATOM 2105 NZ LYS A 135 -14.931 5.612 -15.756 1.00 0.00 N1+ ATOM 0 H LYS A 135 -15.842 3.830 -10.691 1.00 0.00 H new ATOM 0 HA LYS A 135 -16.774 6.316 -9.699 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -17.123 4.787 -12.324 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -17.813 6.381 -12.088 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -15.540 7.279 -11.536 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -14.853 5.686 -11.789 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -16.154 7.471 -13.877 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -14.458 7.047 -13.759 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -15.412 4.549 -13.991 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -16.768 5.376 -14.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -15.249 4.902 -16.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -15.079 6.565 -16.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -13.920 5.472 -15.557 1.00 0.00 H new ATOM 2119 N VAL A 136 -18.972 4.052 -9.414 1.00 0.00 N ATOM 2120 CA VAL A 136 -20.282 3.796 -8.785 1.00 0.00 C ATOM 2121 C VAL A 136 -20.268 4.112 -7.280 1.00 0.00 C ATOM 2122 O VAL A 136 -21.283 4.540 -6.745 1.00 0.00 O ATOM 2123 CB VAL A 136 -20.739 2.341 -9.038 1.00 0.00 C ATOM 2124 CG1 VAL A 136 -22.174 2.091 -8.561 1.00 0.00 C ATOM 2125 CG2 VAL A 136 -20.683 1.978 -10.531 1.00 0.00 C ATOM 0 H VAL A 136 -18.386 3.220 -9.484 1.00 0.00 H new ATOM 0 HA VAL A 136 -21.002 4.469 -9.250 1.00 0.00 H new ATOM 0 HB VAL A 136 -20.047 1.720 -8.469 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -22.449 1.055 -8.761 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -22.240 2.284 -7.490 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -22.855 2.756 -9.092 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -21.012 0.948 -10.668 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -21.337 2.645 -11.092 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -19.660 2.084 -10.893 1.00 0.00 H new ATOM 2135 N HIS A 137 -19.112 3.976 -6.619 1.00 0.00 N ATOM 2136 CA HIS A 137 -18.950 4.173 -5.172 1.00 0.00 C ATOM 2137 C HIS A 137 -18.487 5.592 -4.799 1.00 0.00 C ATOM 2138 O HIS A 137 -18.976 6.158 -3.825 1.00 0.00 O ATOM 2139 CB HIS A 137 -17.968 3.124 -4.629 1.00 0.00 C ATOM 2140 CG HIS A 137 -18.419 1.697 -4.834 1.00 0.00 C ATOM 2141 ND1 HIS A 137 -18.377 0.976 -6.009 1.00 0.00 N ATOM 2142 CD2 HIS A 137 -19.049 0.910 -3.907 1.00 0.00 C ATOM 2143 CE1 HIS A 137 -18.938 -0.223 -5.782 1.00 0.00 C ATOM 2144 NE2 HIS A 137 -19.360 -0.309 -4.516 1.00 0.00 N ATOM 0 H HIS A 137 -18.242 3.720 -7.086 1.00 0.00 H new ATOM 0 HA HIS A 137 -19.931 4.049 -4.713 1.00 0.00 H new ATOM 0 HB2 HIS A 137 -17.001 3.262 -5.113 1.00 0.00 H new ATOM 0 HB3 HIS A 137 -17.819 3.298 -3.563 1.00 0.00 H new ATOM 0 HD1 HIS A 137 -17.988 1.297 -6.895 1.00 0.00 H new ATOM 0 HD2 HIS A 137 -19.267 1.183 -2.885 1.00 0.00 H new ATOM 0 HE1 HIS A 137 -19.035 -1.007 -6.518 1.00 0.00 H new ATOM 2152 N GLY A 138 -17.605 6.202 -5.602 1.00 0.00 N ATOM 2153 CA GLY A 138 -17.273 7.631 -5.549 1.00 0.00 C ATOM 2154 C GLY A 138 -15.840 7.989 -5.107 1.00 0.00 C ATOM 2155 O GLY A 138 -15.169 8.655 -5.897 1.00 0.00 O ATOM 0 H GLY A 138 -17.089 5.701 -6.326 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -17.441 8.057 -6.538 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -17.971 8.118 -4.869 1.00 0.00 H new ATOM 2159 N PRO A 139 -15.450 7.798 -3.825 1.00 0.00 N ATOM 2160 CA PRO A 139 -14.341 8.558 -3.227 1.00 0.00 C ATOM 2161 C PRO A 139 -12.975 7.852 -3.090 1.00 0.00 C ATOM 2162 O PRO A 139 -11.964 8.557 -3.061 1.00 0.00 O ATOM 2163 CB PRO A 139 -14.870 8.957 -1.847 1.00 0.00 C ATOM 2164 CG PRO A 139 -15.722 7.754 -1.451 1.00 0.00 C ATOM 2165 CD PRO A 139 -16.333 7.308 -2.772 1.00 0.00 C ATOM 0 HA PRO A 139 -14.094 9.380 -3.899 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -14.060 9.130 -1.138 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -15.459 9.873 -1.889 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -15.120 6.966 -1.000 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -16.488 8.025 -0.725 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -16.419 6.222 -2.812 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -17.338 7.712 -2.890 1.00 0.00 H new ATOM 2173 N PHE A 140 -12.913 6.536 -2.842 1.00 0.00 N ATOM 2174 CA PHE A 140 -11.675 5.841 -2.445 1.00 0.00 C ATOM 2175 C PHE A 140 -11.450 4.536 -3.215 1.00 0.00 C ATOM 2176 O PHE A 140 -12.395 3.922 -3.695 1.00 0.00 O ATOM 2177 CB PHE A 140 -11.657 5.597 -0.929 1.00 0.00 C ATOM 2178 CG PHE A 140 -11.769 6.848 -0.082 1.00 0.00 C ATOM 2179 CD1 PHE A 140 -10.700 7.758 -0.004 1.00 0.00 C ATOM 2180 CD2 PHE A 140 -12.953 7.108 0.623 1.00 0.00 C ATOM 2181 CE1 PHE A 140 -10.823 8.923 0.774 1.00 0.00 C ATOM 2182 CE2 PHE A 140 -13.078 8.263 1.412 1.00 0.00 C ATOM 2183 CZ PHE A 140 -12.011 9.175 1.483 1.00 0.00 C ATOM 0 H PHE A 140 -13.722 5.919 -2.911 1.00 0.00 H new ATOM 0 HA PHE A 140 -10.846 6.498 -2.707 1.00 0.00 H new ATOM 0 HB2 PHE A 140 -12.478 4.928 -0.673 1.00 0.00 H new ATOM 0 HB3 PHE A 140 -10.733 5.081 -0.669 1.00 0.00 H new ATOM 0 HD1 PHE A 140 -9.784 7.562 -0.542 1.00 0.00 H new ATOM 0 HD2 PHE A 140 -13.777 6.413 0.559 1.00 0.00 H new ATOM 0 HE1 PHE A 140 -10.004 9.625 0.827 1.00 0.00 H new ATOM 0 HE2 PHE A 140 -13.989 8.449 1.961 1.00 0.00 H new ATOM 0 HZ PHE A 140 -12.103 10.069 2.082 1.00 0.00 H new ATOM 2193 N ILE A 141 -10.200 4.071 -3.311 1.00 0.00 N ATOM 2194 CA ILE A 141 -9.812 2.904 -4.125 1.00 0.00 C ATOM 2195 C ILE A 141 -10.309 1.551 -3.572 1.00 0.00 C ATOM 2196 O ILE A 141 -10.369 0.578 -4.324 1.00 0.00 O ATOM 2197 CB ILE A 141 -8.287 2.978 -4.424 1.00 0.00 C ATOM 2198 CG1 ILE A 141 -8.105 3.753 -5.750 1.00 0.00 C ATOM 2199 CG2 ILE A 141 -7.556 1.627 -4.451 1.00 0.00 C ATOM 2200 CD1 ILE A 141 -6.665 3.843 -6.262 1.00 0.00 C ATOM 0 H ILE A 141 -9.415 4.498 -2.820 1.00 0.00 H new ATOM 0 HA ILE A 141 -10.337 2.954 -5.079 1.00 0.00 H new ATOM 0 HB ILE A 141 -7.815 3.498 -3.590 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -8.717 3.278 -6.517 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -8.490 4.764 -5.617 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -6.500 1.789 -4.667 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -7.657 1.139 -3.482 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -7.992 0.993 -5.223 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -6.645 4.405 -7.196 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -6.046 4.349 -5.521 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -6.277 2.839 -6.435 1.00 0.00 H new ATOM 2212 N ALA A 142 -10.791 1.501 -2.328 1.00 0.00 N ATOM 2213 CA ALA A 142 -11.565 0.383 -1.787 1.00 0.00 C ATOM 2214 C ALA A 142 -13.101 0.573 -1.837 1.00 0.00 C ATOM 2215 O ALA A 142 -13.820 -0.338 -1.434 1.00 0.00 O ATOM 2216 CB ALA A 142 -11.067 0.108 -0.366 1.00 0.00 C ATOM 0 H ALA A 142 -10.650 2.254 -1.654 1.00 0.00 H new ATOM 0 HA ALA A 142 -11.397 -0.481 -2.430 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -11.628 -0.723 0.062 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -10.008 -0.146 -0.395 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -11.210 0.997 0.248 1.00 0.00 H new ATOM 2222 N GLY A 143 -13.624 1.711 -2.318 1.00 0.00 N ATOM 2223 CA GLY A 143 -15.064 2.001 -2.404 1.00 0.00 C ATOM 2224 C GLY A 143 -15.486 3.266 -1.644 1.00 0.00 C ATOM 2225 O GLY A 143 -14.860 4.316 -1.757 1.00 0.00 O ATOM 0 H GLY A 143 -13.043 2.474 -2.666 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -15.342 2.108 -3.453 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -15.621 1.150 -2.012 1.00 0.00 H new ATOM 2229 N GLU A 144 -16.588 3.186 -0.889 1.00 0.00 N ATOM 2230 CA GLU A 144 -17.183 4.326 -0.161 1.00 0.00 C ATOM 2231 C GLU A 144 -16.262 4.932 0.919 1.00 0.00 C ATOM 2232 O GLU A 144 -16.389 6.105 1.274 1.00 0.00 O ATOM 2233 CB GLU A 144 -18.466 3.879 0.552 1.00 0.00 C ATOM 2234 CG GLU A 144 -19.549 3.306 -0.372 1.00 0.00 C ATOM 2235 CD GLU A 144 -20.848 3.018 0.400 1.00 0.00 C ATOM 2236 OE1 GLU A 144 -20.754 2.693 1.608 1.00 0.00 O ATOM 2237 OE2 GLU A 144 -21.925 3.116 -0.226 1.00 0.00 O1- ATOM 0 H GLU A 144 -17.104 2.315 -0.761 1.00 0.00 H new ATOM 0 HA GLU A 144 -17.368 5.085 -0.922 1.00 0.00 H new ATOM 0 HB2 GLU A 144 -18.208 3.126 1.297 1.00 0.00 H new ATOM 0 HB3 GLU A 144 -18.881 4.731 1.091 1.00 0.00 H new ATOM 0 HG2 GLU A 144 -19.752 4.010 -1.179 1.00 0.00 H new ATOM 0 HG3 GLU A 144 -19.187 2.388 -0.834 1.00 0.00 H new ATOM 2244 N LYS A 145 -15.328 4.137 1.452 1.00 0.00 N ATOM 2245 CA LYS A 145 -14.370 4.537 2.488 1.00 0.00 C ATOM 2246 C LYS A 145 -13.020 3.855 2.258 1.00 0.00 C ATOM 2247 O LYS A 145 -12.980 2.744 1.745 1.00 0.00 O ATOM 2248 CB LYS A 145 -14.948 4.259 3.887 1.00 0.00 C ATOM 2249 CG LYS A 145 -14.956 2.770 4.273 1.00 0.00 C ATOM 2250 CD LYS A 145 -15.436 2.564 5.718 1.00 0.00 C ATOM 2251 CE LYS A 145 -14.702 1.393 6.384 1.00 0.00 C ATOM 2252 NZ LYS A 145 -13.275 1.725 6.637 1.00 0.00 N1+ ATOM 0 H LYS A 145 -15.214 3.165 1.164 1.00 0.00 H new ATOM 0 HA LYS A 145 -14.195 5.611 2.426 1.00 0.00 H new ATOM 0 HB2 LYS A 145 -14.368 4.813 4.626 1.00 0.00 H new ATOM 0 HB3 LYS A 145 -15.968 4.641 3.931 1.00 0.00 H new ATOM 0 HG2 LYS A 145 -15.605 2.220 3.591 1.00 0.00 H new ATOM 0 HG3 LYS A 145 -13.953 2.359 4.160 1.00 0.00 H new ATOM 0 HD2 LYS A 145 -15.270 3.475 6.293 1.00 0.00 H new ATOM 0 HD3 LYS A 145 -16.509 2.375 5.724 1.00 0.00 H new ATOM 0 HE2 LYS A 145 -15.192 1.142 7.325 1.00 0.00 H new ATOM 0 HE3 LYS A 145 -14.765 0.511 5.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 -12.839 0.972 7.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 -12.772 1.808 5.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 -13.214 2.627 7.151 1.00 0.00 H new ATOM 2266 N ILE A 146 -11.985 4.372 2.915 1.00 0.00 N ATOM 2267 CA ILE A 146 -10.668 3.724 2.990 1.00 0.00 C ATOM 2268 C ILE A 146 -10.782 2.345 3.684 1.00 0.00 C ATOM 2269 O ILE A 146 -11.217 2.254 4.835 1.00 0.00 O ATOM 2270 CB ILE A 146 -9.669 4.693 3.679 1.00 0.00 C ATOM 2271 CG1 ILE A 146 -9.393 5.893 2.733 1.00 0.00 C ATOM 2272 CG2 ILE A 146 -8.349 4.009 4.075 1.00 0.00 C ATOM 2273 CD1 ILE A 146 -8.577 7.038 3.342 1.00 0.00 C ATOM 0 H ILE A 146 -12.032 5.259 3.416 1.00 0.00 H new ATOM 0 HA ILE A 146 -10.281 3.518 1.992 1.00 0.00 H new ATOM 0 HB ILE A 146 -10.126 5.038 4.606 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -8.868 5.525 1.851 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -10.348 6.292 2.392 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -7.691 4.736 4.552 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -8.555 3.195 4.770 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -7.864 3.611 3.184 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -8.442 7.824 2.599 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -9.105 7.442 4.205 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -7.603 6.664 3.656 1.00 0.00 H new ATOM 2285 N THR A 147 -10.372 1.277 3.002 1.00 0.00 N ATOM 2286 CA THR A 147 -10.012 -0.030 3.591 1.00 0.00 C ATOM 2287 C THR A 147 -8.780 -0.584 2.858 1.00 0.00 C ATOM 2288 O THR A 147 -8.017 0.184 2.268 1.00 0.00 O ATOM 2289 CB THR A 147 -11.174 -1.068 3.628 1.00 0.00 C ATOM 2290 OG1 THR A 147 -11.422 -1.586 2.357 1.00 0.00 O ATOM 2291 CG2 THR A 147 -12.514 -0.585 4.182 1.00 0.00 C ATOM 0 H THR A 147 -10.275 1.289 1.987 1.00 0.00 H new ATOM 0 HA THR A 147 -9.781 0.145 4.642 1.00 0.00 H new ATOM 0 HB THR A 147 -10.797 -1.814 4.327 1.00 0.00 H new ATOM 0 HG1 THR A 147 -11.705 -2.521 2.434 1.00 0.00 H new ATOM 0 HG21 THR A 147 -13.235 -1.402 4.153 1.00 0.00 H new ATOM 0 HG22 THR A 147 -12.383 -0.253 5.212 1.00 0.00 H new ATOM 0 HG23 THR A 147 -12.880 0.245 3.577 1.00 0.00 H new ATOM 2299 N ALA A 148 -8.525 -1.891 2.947 1.00 0.00 N ATOM 2300 CA ALA A 148 -7.270 -2.513 2.555 1.00 0.00 C ATOM 2301 C ALA A 148 -6.752 -2.124 1.154 1.00 0.00 C ATOM 2302 O ALA A 148 -5.550 -1.970 1.012 1.00 0.00 O ATOM 2303 CB ALA A 148 -7.487 -4.021 2.661 1.00 0.00 C ATOM 0 H ALA A 148 -9.208 -2.559 3.304 1.00 0.00 H new ATOM 0 HA ALA A 148 -6.486 -2.153 3.221 1.00 0.00 H new ATOM 0 HB1 ALA A 148 -6.572 -4.541 2.377 1.00 0.00 H new ATOM 0 HB2 ALA A 148 -7.748 -4.280 3.687 1.00 0.00 H new ATOM 0 HB3 ALA A 148 -8.296 -4.320 1.995 1.00 0.00 H new ATOM 2309 N VAL A 149 -7.607 -1.857 0.158 1.00 0.00 N ATOM 2310 CA VAL A 149 -7.142 -1.570 -1.220 1.00 0.00 C ATOM 2311 C VAL A 149 -6.470 -0.193 -1.353 1.00 0.00 C ATOM 2312 O VAL A 149 -5.400 -0.101 -1.953 1.00 0.00 O ATOM 2313 CB VAL A 149 -8.257 -1.727 -2.271 1.00 0.00 C ATOM 2314 CG1 VAL A 149 -7.656 -1.956 -3.665 1.00 0.00 C ATOM 2315 CG2 VAL A 149 -9.186 -2.912 -1.971 1.00 0.00 C ATOM 0 H VAL A 149 -8.620 -1.832 0.272 1.00 0.00 H new ATOM 0 HA VAL A 149 -6.384 -2.327 -1.423 1.00 0.00 H new ATOM 0 HB VAL A 149 -8.833 -0.802 -2.237 1.00 0.00 H new ATOM 0 HG11 VAL A 149 -8.459 -2.065 -4.394 1.00 0.00 H new ATOM 0 HG12 VAL A 149 -7.032 -1.105 -3.937 1.00 0.00 H new ATOM 0 HG13 VAL A 149 -7.050 -2.862 -3.655 1.00 0.00 H new ATOM 0 HG21 VAL A 149 -9.953 -2.977 -2.742 1.00 0.00 H new ATOM 0 HG22 VAL A 149 -8.606 -3.835 -1.958 1.00 0.00 H new ATOM 0 HG23 VAL A 149 -9.659 -2.767 -1.000 1.00 0.00 H new ATOM 2325 N ASP A 150 -6.967 0.835 -0.654 1.00 0.00 N ATOM 2326 CA ASP A 150 -6.259 2.116 -0.492 1.00 0.00 C ATOM 2327 C ASP A 150 -4.942 1.939 0.263 1.00 0.00 C ATOM 2328 O ASP A 150 -3.895 2.389 -0.199 1.00 0.00 O ATOM 2329 CB ASP A 150 -7.119 3.120 0.284 1.00 0.00 C ATOM 2330 CG ASP A 150 -8.373 3.530 -0.470 1.00 0.00 C ATOM 2331 OD1 ASP A 150 -8.282 4.503 -1.254 1.00 0.00 O ATOM 2332 OD2 ASP A 150 -9.423 2.888 -0.257 1.00 0.00 O1- ATOM 0 H ASP A 150 -7.872 0.804 -0.184 1.00 0.00 H new ATOM 0 HA ASP A 150 -6.056 2.489 -1.496 1.00 0.00 H new ATOM 0 HB2 ASP A 150 -7.403 2.684 1.242 1.00 0.00 H new ATOM 0 HB3 ASP A 150 -6.525 4.008 0.502 1.00 0.00 H new ATOM 2337 N LEU A 151 -4.958 1.157 1.346 1.00 0.00 N ATOM 2338 CA LEU A 151 -3.756 0.843 2.121 1.00 0.00 C ATOM 2339 C LEU A 151 -2.741 0.019 1.303 1.00 0.00 C ATOM 2340 O LEU A 151 -1.537 0.231 1.426 1.00 0.00 O ATOM 2341 CB LEU A 151 -4.150 0.148 3.441 1.00 0.00 C ATOM 2342 CG LEU A 151 -5.217 0.887 4.278 1.00 0.00 C ATOM 2343 CD1 LEU A 151 -5.531 0.126 5.562 1.00 0.00 C ATOM 2344 CD2 LEU A 151 -4.791 2.299 4.666 1.00 0.00 C ATOM 0 H LEU A 151 -5.806 0.723 1.710 1.00 0.00 H new ATOM 0 HA LEU A 151 -3.250 1.776 2.368 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -4.519 -0.851 3.211 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -3.254 0.025 4.050 1.00 0.00 H new ATOM 0 HG LEU A 151 -6.098 0.946 3.639 1.00 0.00 H new ATOM 0 HD11 LEU A 151 -6.285 0.669 6.132 1.00 0.00 H new ATOM 0 HD12 LEU A 151 -5.908 -0.866 5.314 1.00 0.00 H new ATOM 0 HD13 LEU A 151 -4.624 0.030 6.159 1.00 0.00 H new ATOM 0 HD21 LEU A 151 -5.580 2.769 5.253 1.00 0.00 H new ATOM 0 HD22 LEU A 151 -3.877 2.254 5.258 1.00 0.00 H new ATOM 0 HD23 LEU A 151 -4.611 2.885 3.765 1.00 0.00 H new ATOM 2356 N SER A 152 -3.188 -0.764 0.318 1.00 0.00 N ATOM 2357 CA SER A 152 -2.311 -1.469 -0.611 1.00 0.00 C ATOM 2358 C SER A 152 -1.695 -0.562 -1.685 1.00 0.00 C ATOM 2359 O SER A 152 -0.566 -0.851 -2.100 1.00 0.00 O ATOM 2360 CB SER A 152 -3.024 -2.646 -1.289 1.00 0.00 C ATOM 2361 OG SER A 152 -3.383 -3.647 -0.357 1.00 0.00 O ATOM 0 H SER A 152 -4.180 -0.926 0.144 1.00 0.00 H new ATOM 0 HA SER A 152 -1.497 -1.845 0.008 1.00 0.00 H new ATOM 0 HB2 SER A 152 -3.918 -2.286 -1.798 1.00 0.00 H new ATOM 0 HB3 SER A 152 -2.374 -3.075 -2.051 1.00 0.00 H new ATOM 0 HG SER A 152 -4.111 -3.319 0.211 1.00 0.00 H new ATOM 2367 N LEU A 153 -2.386 0.498 -2.135 1.00 0.00 N ATOM 2368 CA LEU A 153 -2.074 1.206 -3.391 1.00 0.00 C ATOM 2369 C LEU A 153 -1.832 2.721 -3.292 1.00 0.00 C ATOM 2370 O LEU A 153 -0.995 3.226 -4.039 1.00 0.00 O ATOM 2371 CB LEU A 153 -3.207 0.967 -4.406 1.00 0.00 C ATOM 2372 CG LEU A 153 -3.423 -0.490 -4.848 1.00 0.00 C ATOM 2373 CD1 LEU A 153 -4.505 -0.525 -5.926 1.00 0.00 C ATOM 2374 CD2 LEU A 153 -2.151 -1.103 -5.436 1.00 0.00 C ATOM 0 H LEU A 153 -3.183 0.892 -1.635 1.00 0.00 H new ATOM 0 HA LEU A 153 -1.119 0.782 -3.701 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -4.137 1.336 -3.975 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -3.006 1.568 -5.293 1.00 0.00 H new ATOM 0 HG LEU A 153 -3.712 -1.064 -3.968 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -4.666 -1.554 -6.247 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -5.434 -0.121 -5.523 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -4.188 0.075 -6.779 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -2.348 -2.132 -5.735 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -1.838 -0.526 -6.306 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -1.360 -1.088 -4.686 1.00 0.00 H new ATOM 2386 N ALA A 154 -2.503 3.449 -2.400 1.00 0.00 N ATOM 2387 CA ALA A 154 -2.516 4.918 -2.375 1.00 0.00 C ATOM 2388 C ALA A 154 -1.119 5.584 -2.396 1.00 0.00 C ATOM 2389 O ALA A 154 -0.844 6.337 -3.336 1.00 0.00 O ATOM 2390 CB ALA A 154 -3.340 5.379 -1.168 1.00 0.00 C ATOM 0 H ALA A 154 -3.065 3.030 -1.659 1.00 0.00 H new ATOM 0 HA ALA A 154 -2.976 5.249 -3.306 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -3.359 6.468 -1.135 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -4.358 5.001 -1.257 1.00 0.00 H new ATOM 0 HB3 ALA A 154 -2.889 4.996 -0.252 1.00 0.00 H new ATOM 2396 N PRO A 155 -0.152 5.195 -1.534 1.00 0.00 N ATOM 2397 CA PRO A 155 1.199 5.761 -1.593 1.00 0.00 C ATOM 2398 C PRO A 155 1.985 5.340 -2.841 1.00 0.00 C ATOM 2399 O PRO A 155 2.872 6.060 -3.288 1.00 0.00 O ATOM 2400 CB PRO A 155 1.886 5.254 -0.327 1.00 0.00 C ATOM 2401 CG PRO A 155 1.183 3.940 -0.011 1.00 0.00 C ATOM 2402 CD PRO A 155 -0.251 4.262 -0.411 1.00 0.00 C ATOM 0 HA PRO A 155 1.154 6.848 -1.654 1.00 0.00 H new ATOM 0 HB2 PRO A 155 2.954 5.104 -0.488 1.00 0.00 H new ATOM 0 HB3 PRO A 155 1.784 5.966 0.492 1.00 0.00 H new ATOM 0 HG2 PRO A 155 1.592 3.107 -0.584 1.00 0.00 H new ATOM 0 HG3 PRO A 155 1.265 3.673 1.043 1.00 0.00 H new ATOM 0 HD2 PRO A 155 -0.789 3.359 -0.699 1.00 0.00 H new ATOM 0 HD3 PRO A 155 -0.798 4.707 0.420 1.00 0.00 H new ATOM 2410 N LYS A 156 1.662 4.185 -3.437 1.00 0.00 N ATOM 2411 CA LYS A 156 2.313 3.687 -4.658 1.00 0.00 C ATOM 2412 C LYS A 156 1.897 4.481 -5.901 1.00 0.00 C ATOM 2413 O LYS A 156 2.713 4.640 -6.800 1.00 0.00 O ATOM 2414 CB LYS A 156 2.002 2.190 -4.807 1.00 0.00 C ATOM 2415 CG LYS A 156 2.962 1.482 -5.776 1.00 0.00 C ATOM 2416 CD LYS A 156 2.589 0.005 -5.976 1.00 0.00 C ATOM 2417 CE LYS A 156 2.544 -0.826 -4.683 1.00 0.00 C ATOM 2418 NZ LYS A 156 3.859 -0.893 -3.998 1.00 0.00 N1+ ATOM 0 H LYS A 156 0.935 3.563 -3.083 1.00 0.00 H new ATOM 0 HA LYS A 156 3.390 3.825 -4.567 1.00 0.00 H new ATOM 0 HB2 LYS A 156 2.060 1.711 -3.829 1.00 0.00 H new ATOM 0 HB3 LYS A 156 0.978 2.069 -5.161 1.00 0.00 H new ATOM 0 HG2 LYS A 156 2.948 1.993 -6.739 1.00 0.00 H new ATOM 0 HG3 LYS A 156 3.980 1.551 -5.393 1.00 0.00 H new ATOM 0 HD2 LYS A 156 1.614 -0.047 -6.460 1.00 0.00 H new ATOM 0 HD3 LYS A 156 3.308 -0.448 -6.658 1.00 0.00 H new ATOM 0 HE2 LYS A 156 1.807 -0.395 -4.005 1.00 0.00 H new ATOM 0 HE3 LYS A 156 2.209 -1.837 -4.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 4.093 -1.885 -3.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 4.592 -0.486 -4.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 3.815 -0.355 -3.109 1.00 0.00 H new ATOM 2432 N LEU A 157 0.682 5.033 -5.918 1.00 0.00 N ATOM 2433 CA LEU A 157 0.201 5.914 -6.988 1.00 0.00 C ATOM 2434 C LEU A 157 0.881 7.288 -6.952 1.00 0.00 C ATOM 2435 O LEU A 157 1.496 7.662 -7.946 1.00 0.00 O ATOM 2436 CB LEU A 157 -1.330 6.036 -6.897 1.00 0.00 C ATOM 2437 CG LEU A 157 -2.045 4.729 -7.284 1.00 0.00 C ATOM 2438 CD1 LEU A 157 -3.467 4.721 -6.737 1.00 0.00 C ATOM 2439 CD2 LEU A 157 -2.112 4.557 -8.803 1.00 0.00 C ATOM 0 H LEU A 157 -0.005 4.880 -5.180 1.00 0.00 H new ATOM 0 HA LEU A 157 0.466 5.471 -7.948 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -1.610 6.313 -5.881 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -1.668 6.840 -7.551 1.00 0.00 H new ATOM 0 HG LEU A 157 -1.470 3.908 -6.855 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -3.960 3.791 -7.019 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -3.439 4.802 -5.650 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -4.020 5.564 -7.150 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -2.623 3.624 -9.041 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -2.659 5.392 -9.240 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -1.102 4.532 -9.211 1.00 0.00 H new ATOM 2451 N TYR A 158 1.018 7.885 -5.764 1.00 0.00 N ATOM 2452 CA TYR A 158 1.820 9.102 -5.575 1.00 0.00 C ATOM 2453 C TYR A 158 3.318 8.883 -5.867 1.00 0.00 C ATOM 2454 O TYR A 158 3.953 9.667 -6.569 1.00 0.00 O ATOM 2455 CB TYR A 158 1.617 9.607 -4.142 1.00 0.00 C ATOM 2456 CG TYR A 158 2.483 10.801 -3.817 1.00 0.00 C ATOM 2457 CD1 TYR A 158 2.244 12.016 -4.488 1.00 0.00 C ATOM 2458 CD2 TYR A 158 3.567 10.676 -2.925 1.00 0.00 C ATOM 2459 CE1 TYR A 158 3.098 13.112 -4.283 1.00 0.00 C ATOM 2460 CE2 TYR A 158 4.411 11.780 -2.703 1.00 0.00 C ATOM 2461 CZ TYR A 158 4.181 12.986 -3.394 1.00 0.00 C ATOM 2462 OH TYR A 158 4.987 14.042 -3.154 1.00 0.00 O ATOM 0 H TYR A 158 0.579 7.542 -4.909 1.00 0.00 H new ATOM 0 HA TYR A 158 1.478 9.848 -6.293 1.00 0.00 H new ATOM 0 HB2 TYR A 158 0.570 9.873 -4.000 1.00 0.00 H new ATOM 0 HB3 TYR A 158 1.839 8.801 -3.442 1.00 0.00 H new ATOM 0 HD1 TYR A 158 1.404 12.105 -5.161 1.00 0.00 H new ATOM 0 HD2 TYR A 158 3.748 9.741 -2.416 1.00 0.00 H new ATOM 0 HE1 TYR A 158 2.925 14.043 -4.803 1.00 0.00 H new ATOM 0 HE2 TYR A 158 5.232 11.703 -2.006 1.00 0.00 H new ATOM 0 HH TYR A 158 5.060 14.588 -3.964 1.00 0.00 H new ATOM 2472 N HIS A 159 3.862 7.726 -5.483 1.00 0.00 N ATOM 2473 CA HIS A 159 5.232 7.358 -5.839 1.00 0.00 C ATOM 2474 C HIS A 159 5.423 7.188 -7.359 1.00 0.00 C ATOM 2475 O HIS A 159 6.503 7.479 -7.872 1.00 0.00 O ATOM 2476 CB HIS A 159 5.614 6.081 -5.082 1.00 0.00 C ATOM 2477 CG HIS A 159 7.085 5.768 -5.126 1.00 0.00 C ATOM 2478 ND1 HIS A 159 7.869 5.654 -6.253 1.00 0.00 N ATOM 2479 CD2 HIS A 159 7.920 5.691 -4.048 1.00 0.00 C ATOM 2480 CE1 HIS A 159 9.141 5.501 -5.864 1.00 0.00 C ATOM 2481 NE2 HIS A 159 9.215 5.507 -4.526 1.00 0.00 N ATOM 0 H HIS A 159 3.372 7.027 -4.924 1.00 0.00 H new ATOM 0 HA HIS A 159 5.895 8.172 -5.546 1.00 0.00 H new ATOM 0 HB2 HIS A 159 5.304 6.179 -4.042 1.00 0.00 H new ATOM 0 HB3 HIS A 159 5.060 5.241 -5.502 1.00 0.00 H new ATOM 0 HD1 HIS A 159 7.538 5.681 -7.217 1.00 0.00 H new ATOM 0 HD2 HIS A 159 7.628 5.760 -3.010 1.00 0.00 H new ATOM 0 HE1 HIS A 159 9.983 5.389 -6.530 1.00 0.00 H new ATOM 2489 N LEU A 160 4.419 6.690 -8.090 1.00 0.00 N ATOM 2490 CA LEU A 160 4.471 6.616 -9.552 1.00 0.00 C ATOM 2491 C LEU A 160 4.418 8.017 -10.181 1.00 0.00 C ATOM 2492 O LEU A 160 5.301 8.350 -10.963 1.00 0.00 O ATOM 2493 CB LEU A 160 3.334 5.718 -10.071 1.00 0.00 C ATOM 2494 CG LEU A 160 3.480 5.409 -11.574 1.00 0.00 C ATOM 2495 CD1 LEU A 160 4.462 4.255 -11.788 1.00 0.00 C ATOM 2496 CD2 LEU A 160 2.137 5.024 -12.185 1.00 0.00 C ATOM 0 H LEU A 160 3.554 6.330 -7.687 1.00 0.00 H new ATOM 0 HA LEU A 160 5.421 6.171 -9.847 1.00 0.00 H new ATOM 0 HB2 LEU A 160 3.324 4.784 -9.509 1.00 0.00 H new ATOM 0 HB3 LEU A 160 2.376 6.207 -9.893 1.00 0.00 H new ATOM 0 HG LEU A 160 3.853 6.310 -12.060 1.00 0.00 H new ATOM 0 HD11 LEU A 160 4.554 4.049 -12.854 1.00 0.00 H new ATOM 0 HD12 LEU A 160 5.437 4.528 -11.385 1.00 0.00 H new ATOM 0 HD13 LEU A 160 4.095 3.365 -11.277 1.00 0.00 H new ATOM 0 HD21 LEU A 160 2.268 4.811 -13.246 1.00 0.00 H new ATOM 0 HD22 LEU A 160 1.749 4.138 -11.682 1.00 0.00 H new ATOM 0 HD23 LEU A 160 1.433 5.847 -12.064 1.00 0.00 H new ATOM 2508 N GLU A 161 3.491 8.863 -9.727 1.00 0.00 N ATOM 2509 CA GLU A 161 3.336 10.264 -10.147 1.00 0.00 C ATOM 2510 C GLU A 161 4.652 11.056 -10.031 1.00 0.00 C ATOM 2511 O GLU A 161 5.131 11.594 -11.029 1.00 0.00 O ATOM 2512 CB GLU A 161 2.194 10.865 -9.301 1.00 0.00 C ATOM 2513 CG GLU A 161 1.919 12.366 -9.477 1.00 0.00 C ATOM 2514 CD GLU A 161 0.738 12.843 -8.605 1.00 0.00 C ATOM 2515 OE1 GLU A 161 0.518 12.262 -7.515 1.00 0.00 O ATOM 2516 OE2 GLU A 161 0.041 13.792 -9.032 1.00 0.00 O1- ATOM 0 H GLU A 161 2.800 8.584 -9.030 1.00 0.00 H new ATOM 0 HA GLU A 161 3.080 10.321 -11.205 1.00 0.00 H new ATOM 0 HB2 GLU A 161 1.278 10.322 -9.532 1.00 0.00 H new ATOM 0 HB3 GLU A 161 2.417 10.681 -8.250 1.00 0.00 H new ATOM 0 HG2 GLU A 161 2.814 12.932 -9.217 1.00 0.00 H new ATOM 0 HG3 GLU A 161 1.704 12.575 -10.525 1.00 0.00 H new ATOM 2523 N VAL A 162 5.363 10.899 -8.910 1.00 0.00 N ATOM 2524 CA VAL A 162 6.674 11.524 -8.675 1.00 0.00 C ATOM 2525 C VAL A 162 7.814 10.844 -9.449 1.00 0.00 C ATOM 2526 O VAL A 162 8.552 11.507 -10.178 1.00 0.00 O ATOM 2527 CB VAL A 162 6.964 11.575 -7.160 1.00 0.00 C ATOM 2528 CG1 VAL A 162 8.363 12.112 -6.839 1.00 0.00 C ATOM 2529 CG2 VAL A 162 5.951 12.468 -6.433 1.00 0.00 C ATOM 0 H VAL A 162 5.042 10.327 -8.128 1.00 0.00 H new ATOM 0 HA VAL A 162 6.627 12.541 -9.063 1.00 0.00 H new ATOM 0 HB VAL A 162 6.890 10.543 -6.818 1.00 0.00 H new ATOM 0 HG11 VAL A 162 8.509 12.124 -5.759 1.00 0.00 H new ATOM 0 HG12 VAL A 162 9.114 11.470 -7.299 1.00 0.00 H new ATOM 0 HG13 VAL A 162 8.463 13.124 -7.230 1.00 0.00 H new ATOM 0 HG21 VAL A 162 6.180 12.485 -5.367 1.00 0.00 H new ATOM 0 HG22 VAL A 162 6.006 13.481 -6.832 1.00 0.00 H new ATOM 0 HG23 VAL A 162 4.946 12.074 -6.582 1.00 0.00 H new ATOM 2539 N ALA A 163 8.048 9.545 -9.230 1.00 0.00 N ATOM 2540 CA ALA A 163 9.269 8.879 -9.698 1.00 0.00 C ATOM 2541 C ALA A 163 9.228 8.502 -11.188 1.00 0.00 C ATOM 2542 O ALA A 163 10.223 8.671 -11.890 1.00 0.00 O ATOM 2543 CB ALA A 163 9.548 7.657 -8.818 1.00 0.00 C ATOM 0 H ALA A 163 7.405 8.932 -8.729 1.00 0.00 H new ATOM 0 HA ALA A 163 10.088 9.592 -9.606 1.00 0.00 H new ATOM 0 HB1 ALA A 163 10.455 7.160 -9.163 1.00 0.00 H new ATOM 0 HB2 ALA A 163 9.680 7.976 -7.784 1.00 0.00 H new ATOM 0 HB3 ALA A 163 8.708 6.965 -8.880 1.00 0.00 H new ATOM 2549 N LEU A 164 8.063 8.100 -11.709 1.00 0.00 N ATOM 2550 CA LEU A 164 7.876 7.905 -13.149 1.00 0.00 C ATOM 2551 C LEU A 164 7.812 9.251 -13.891 1.00 0.00 C ATOM 2552 O LEU A 164 8.424 9.386 -14.950 1.00 0.00 O ATOM 2553 CB LEU A 164 6.612 7.066 -13.396 1.00 0.00 C ATOM 2554 CG LEU A 164 6.645 6.347 -14.754 1.00 0.00 C ATOM 2555 CD1 LEU A 164 7.250 4.949 -14.615 1.00 0.00 C ATOM 2556 CD2 LEU A 164 5.232 6.211 -15.310 1.00 0.00 C ATOM 0 H LEU A 164 7.233 7.903 -11.151 1.00 0.00 H new ATOM 0 HA LEU A 164 8.736 7.365 -13.546 1.00 0.00 H new ATOM 0 HB2 LEU A 164 6.506 6.329 -12.600 1.00 0.00 H new ATOM 0 HB3 LEU A 164 5.735 7.712 -13.351 1.00 0.00 H new ATOM 0 HG LEU A 164 7.259 6.941 -15.431 1.00 0.00 H new ATOM 0 HD11 LEU A 164 7.263 4.460 -15.589 1.00 0.00 H new ATOM 0 HD12 LEU A 164 8.269 5.029 -14.236 1.00 0.00 H new ATOM 0 HD13 LEU A 164 6.650 4.360 -13.921 1.00 0.00 H new ATOM 0 HD21 LEU A 164 5.267 5.700 -16.272 1.00 0.00 H new ATOM 0 HD22 LEU A 164 4.622 5.634 -14.615 1.00 0.00 H new ATOM 0 HD23 LEU A 164 4.796 7.201 -15.441 1.00 0.00 H new ATOM 2568 N GLY A 165 7.287 10.297 -13.237 1.00 0.00 N ATOM 2569 CA GLY A 165 7.319 11.686 -13.713 1.00 0.00 C ATOM 2570 C GLY A 165 8.716 12.211 -14.064 1.00 0.00 C ATOM 2571 O GLY A 165 8.861 12.921 -15.058 1.00 0.00 O ATOM 0 H GLY A 165 6.816 10.197 -12.338 1.00 0.00 H new ATOM 0 HA2 GLY A 165 6.683 11.768 -14.594 1.00 0.00 H new ATOM 0 HA3 GLY A 165 6.886 12.329 -12.946 1.00 0.00 H new ATOM 2575 N HIS A 166 9.764 11.680 -13.423 1.00 0.00 N ATOM 2576 CA HIS A 166 11.161 12.034 -13.694 1.00 0.00 C ATOM 2577 C HIS A 166 11.693 11.598 -15.077 1.00 0.00 C ATOM 2578 O HIS A 166 12.680 12.166 -15.542 1.00 0.00 O ATOM 2579 CB HIS A 166 12.027 11.460 -12.561 1.00 0.00 C ATOM 2580 CG HIS A 166 13.433 12.005 -12.539 1.00 0.00 C ATOM 2581 ND1 HIS A 166 13.789 13.311 -12.296 1.00 0.00 N ATOM 2582 CD2 HIS A 166 14.583 11.326 -12.842 1.00 0.00 C ATOM 2583 CE1 HIS A 166 15.122 13.411 -12.428 1.00 0.00 C ATOM 2584 NE2 HIS A 166 15.653 12.223 -12.749 1.00 0.00 N ATOM 0 H HIS A 166 9.662 10.980 -12.688 1.00 0.00 H new ATOM 0 HA HIS A 166 11.215 13.122 -13.726 1.00 0.00 H new ATOM 0 HB2 HIS A 166 11.548 11.674 -11.605 1.00 0.00 H new ATOM 0 HB3 HIS A 166 12.068 10.375 -12.661 1.00 0.00 H new ATOM 0 HD2 HIS A 166 14.652 10.281 -13.106 1.00 0.00 H new ATOM 0 HE1 HIS A 166 15.687 14.322 -12.294 1.00 0.00 H new ATOM 0 HE2 HIS A 166 16.641 12.014 -12.896 1.00 0.00 H new ATOM 2592 N PHE A 167 11.060 10.633 -15.760 1.00 0.00 N ATOM 2593 CA PHE A 167 11.534 10.138 -17.069 1.00 0.00 C ATOM 2594 C PHE A 167 10.430 9.820 -18.090 1.00 0.00 C ATOM 2595 O PHE A 167 10.659 9.938 -19.293 1.00 0.00 O ATOM 2596 CB PHE A 167 12.445 8.918 -16.854 1.00 0.00 C ATOM 2597 CG PHE A 167 11.728 7.617 -16.535 1.00 0.00 C ATOM 2598 CD1 PHE A 167 11.360 7.314 -15.211 1.00 0.00 C ATOM 2599 CD2 PHE A 167 11.438 6.701 -17.565 1.00 0.00 C ATOM 2600 CE1 PHE A 167 10.741 6.086 -14.916 1.00 0.00 C ATOM 2601 CE2 PHE A 167 10.799 5.483 -17.273 1.00 0.00 C ATOM 2602 CZ PHE A 167 10.462 5.169 -15.945 1.00 0.00 C ATOM 0 H PHE A 167 10.212 10.174 -15.428 1.00 0.00 H new ATOM 0 HA PHE A 167 12.088 10.963 -17.517 1.00 0.00 H new ATOM 0 HB2 PHE A 167 13.045 8.771 -17.752 1.00 0.00 H new ATOM 0 HB3 PHE A 167 13.136 9.141 -16.041 1.00 0.00 H new ATOM 0 HD1 PHE A 167 11.553 8.025 -14.421 1.00 0.00 H new ATOM 0 HD2 PHE A 167 11.708 6.935 -18.584 1.00 0.00 H new ATOM 0 HE1 PHE A 167 10.479 5.847 -13.896 1.00 0.00 H new ATOM 0 HE2 PHE A 167 10.567 4.790 -18.068 1.00 0.00 H new ATOM 0 HZ PHE A 167 9.990 4.225 -15.715 1.00 0.00 H new ATOM 2612 N LYS A 168 9.223 9.469 -17.637 1.00 0.00 N ATOM 2613 CA LYS A 168 8.054 9.167 -18.471 1.00 0.00 C ATOM 2614 C LYS A 168 6.778 9.541 -17.711 1.00 0.00 C ATOM 2615 O LYS A 168 6.130 8.698 -17.101 1.00 0.00 O ATOM 2616 CB LYS A 168 8.105 7.686 -18.900 1.00 0.00 C ATOM 2617 CG LYS A 168 7.042 7.361 -19.962 1.00 0.00 C ATOM 2618 CD LYS A 168 7.142 5.904 -20.427 1.00 0.00 C ATOM 2619 CE LYS A 168 6.050 5.609 -21.459 1.00 0.00 C ATOM 2620 NZ LYS A 168 6.039 4.183 -21.831 1.00 0.00 N1+ ATOM 0 H LYS A 168 9.025 9.384 -16.640 1.00 0.00 H new ATOM 0 HA LYS A 168 8.058 9.760 -19.386 1.00 0.00 H new ATOM 0 HB2 LYS A 168 9.095 7.456 -19.294 1.00 0.00 H new ATOM 0 HB3 LYS A 168 7.954 7.050 -18.028 1.00 0.00 H new ATOM 0 HG2 LYS A 168 6.049 7.546 -19.553 1.00 0.00 H new ATOM 0 HG3 LYS A 168 7.164 8.026 -20.817 1.00 0.00 H new ATOM 0 HD2 LYS A 168 8.124 5.719 -20.861 1.00 0.00 H new ATOM 0 HD3 LYS A 168 7.039 5.233 -19.574 1.00 0.00 H new ATOM 0 HE2 LYS A 168 5.078 5.889 -21.054 1.00 0.00 H new ATOM 0 HE3 LYS A 168 6.212 6.218 -22.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 5.057 3.864 -21.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 6.561 4.052 -22.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 6.491 3.625 -21.079 1.00 0.00 H new ATOM 2634 N ASN A 169 6.435 10.830 -17.727 1.00 0.00 N ATOM 2635 CA ASN A 169 5.267 11.408 -17.049 1.00 0.00 C ATOM 2636 C ASN A 169 3.929 10.905 -17.646 1.00 0.00 C ATOM 2637 O ASN A 169 3.294 11.582 -18.456 1.00 0.00 O ATOM 2638 CB ASN A 169 5.429 12.942 -17.078 1.00 0.00 C ATOM 2639 CG ASN A 169 4.437 13.668 -16.185 1.00 0.00 C ATOM 2640 OD1 ASN A 169 4.785 14.231 -15.169 1.00 0.00 O ATOM 2641 ND2 ASN A 169 3.167 13.653 -16.510 1.00 0.00 N ATOM 0 H ASN A 169 6.982 11.529 -18.231 1.00 0.00 H new ATOM 0 HA ASN A 169 5.223 11.077 -16.011 1.00 0.00 H new ATOM 0 HB2 ASN A 169 6.442 13.199 -16.768 1.00 0.00 H new ATOM 0 HB3 ASN A 169 5.310 13.294 -18.103 1.00 0.00 H new ATOM 0 HD21 ASN A 169 2.482 14.112 -15.910 1.00 0.00 H new ATOM 0 HD22 ASN A 169 2.864 13.182 -17.363 1.00 0.00 H new ATOM 2648 N TRP A 170 3.565 9.667 -17.316 1.00 0.00 N ATOM 2649 CA TRP A 170 2.483 8.894 -17.927 1.00 0.00 C ATOM 2650 C TRP A 170 1.088 9.426 -17.534 1.00 0.00 C ATOM 2651 O TRP A 170 0.742 9.403 -16.351 1.00 0.00 O ATOM 2652 CB TRP A 170 2.691 7.437 -17.507 1.00 0.00 C ATOM 2653 CG TRP A 170 1.839 6.407 -18.171 1.00 0.00 C ATOM 2654 CD1 TRP A 170 2.056 5.916 -19.410 1.00 0.00 C ATOM 2655 CD2 TRP A 170 0.755 5.605 -17.609 1.00 0.00 C ATOM 2656 NE1 TRP A 170 1.190 4.875 -19.660 1.00 0.00 N ATOM 2657 CE2 TRP A 170 0.405 4.598 -18.558 1.00 0.00 C ATOM 2658 CE3 TRP A 170 0.099 5.561 -16.357 1.00 0.00 C ATOM 2659 CZ2 TRP A 170 -0.511 3.578 -18.268 1.00 0.00 C ATOM 2660 CZ3 TRP A 170 -0.838 4.551 -16.063 1.00 0.00 C ATOM 2661 CH2 TRP A 170 -1.140 3.556 -17.010 1.00 0.00 C ATOM 0 H TRP A 170 4.041 9.149 -16.577 1.00 0.00 H new ATOM 0 HA TRP A 170 2.515 8.985 -19.013 1.00 0.00 H new ATOM 0 HB2 TRP A 170 3.735 7.179 -17.687 1.00 0.00 H new ATOM 0 HB3 TRP A 170 2.527 7.369 -16.432 1.00 0.00 H new ATOM 0 HD1 TRP A 170 2.798 6.285 -20.102 1.00 0.00 H new ATOM 0 HE1 TRP A 170 1.135 4.373 -20.546 1.00 0.00 H new ATOM 0 HE3 TRP A 170 0.320 6.314 -15.615 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 -0.732 2.817 -19.002 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 -1.329 4.541 -15.101 1.00 0.00 H new ATOM 0 HH2 TRP A 170 -1.851 2.779 -16.773 1.00 0.00 H new ATOM 2672 N PRO A 171 0.303 9.989 -18.474 1.00 0.00 N ATOM 2673 CA PRO A 171 -0.963 10.643 -18.152 1.00 0.00 C ATOM 2674 C PRO A 171 -2.075 9.625 -17.866 1.00 0.00 C ATOM 2675 O PRO A 171 -2.348 8.752 -18.686 1.00 0.00 O ATOM 2676 CB PRO A 171 -1.287 11.513 -19.370 1.00 0.00 C ATOM 2677 CG PRO A 171 -0.658 10.740 -20.529 1.00 0.00 C ATOM 2678 CD PRO A 171 0.586 10.114 -19.898 1.00 0.00 C ATOM 0 HA PRO A 171 -0.887 11.239 -17.242 1.00 0.00 H new ATOM 0 HB2 PRO A 171 -2.362 11.635 -19.503 1.00 0.00 H new ATOM 0 HB3 PRO A 171 -0.863 12.512 -19.275 1.00 0.00 H new ATOM 0 HG2 PRO A 171 -1.335 9.982 -20.922 1.00 0.00 H new ATOM 0 HG3 PRO A 171 -0.401 11.398 -21.359 1.00 0.00 H new ATOM 0 HD2 PRO A 171 0.798 9.140 -20.339 1.00 0.00 H new ATOM 0 HD3 PRO A 171 1.464 10.738 -20.067 1.00 0.00 H new ATOM 2686 N ILE A 172 -2.871 9.895 -16.829 1.00 0.00 N ATOM 2687 CA ILE A 172 -4.163 9.239 -16.583 1.00 0.00 C ATOM 2688 C ILE A 172 -5.270 10.010 -17.334 1.00 0.00 C ATOM 2689 O ILE A 172 -5.537 11.153 -16.962 1.00 0.00 O ATOM 2690 CB ILE A 172 -4.442 9.181 -15.062 1.00 0.00 C ATOM 2691 CG1 ILE A 172 -3.311 8.506 -14.250 1.00 0.00 C ATOM 2692 CG2 ILE A 172 -5.785 8.493 -14.765 1.00 0.00 C ATOM 2693 CD1 ILE A 172 -2.949 7.072 -14.662 1.00 0.00 C ATOM 0 H ILE A 172 -2.633 10.589 -16.121 1.00 0.00 H new ATOM 0 HA ILE A 172 -4.142 8.214 -16.954 1.00 0.00 H new ATOM 0 HB ILE A 172 -4.489 10.220 -14.737 1.00 0.00 H new ATOM 0 HG12 ILE A 172 -2.416 9.123 -14.330 1.00 0.00 H new ATOM 0 HG13 ILE A 172 -3.600 8.499 -13.199 1.00 0.00 H new ATOM 0 HG21 ILE A 172 -5.951 8.469 -13.688 1.00 0.00 H new ATOM 0 HG22 ILE A 172 -6.592 9.048 -15.244 1.00 0.00 H new ATOM 0 HG23 ILE A 172 -5.765 7.474 -15.152 1.00 0.00 H new ATOM 0 HD11 ILE A 172 -2.146 6.702 -14.025 1.00 0.00 H new ATOM 0 HD12 ILE A 172 -3.823 6.430 -14.553 1.00 0.00 H new ATOM 0 HD13 ILE A 172 -2.621 7.064 -15.701 1.00 0.00 H new ATOM 2705 N PRO A 173 -5.940 9.444 -18.359 1.00 0.00 N ATOM 2706 CA PRO A 173 -7.010 10.145 -19.077 1.00 0.00 C ATOM 2707 C PRO A 173 -8.271 10.290 -18.218 1.00 0.00 C ATOM 2708 O PRO A 173 -8.642 9.335 -17.541 1.00 0.00 O ATOM 2709 CB PRO A 173 -7.292 9.309 -20.335 1.00 0.00 C ATOM 2710 CG PRO A 173 -6.040 8.448 -20.492 1.00 0.00 C ATOM 2711 CD PRO A 173 -5.633 8.199 -19.045 1.00 0.00 C ATOM 0 HA PRO A 173 -6.707 11.161 -19.330 1.00 0.00 H new ATOM 0 HB2 PRO A 173 -8.186 8.697 -20.216 1.00 0.00 H new ATOM 0 HB3 PRO A 173 -7.454 9.942 -21.207 1.00 0.00 H new ATOM 0 HG2 PRO A 173 -6.250 7.518 -21.021 1.00 0.00 H new ATOM 0 HG3 PRO A 173 -5.259 8.964 -21.051 1.00 0.00 H new ATOM 0 HD2 PRO A 173 -6.185 7.363 -18.616 1.00 0.00 H new ATOM 0 HD3 PRO A 173 -4.574 7.954 -18.967 1.00 0.00 H new ATOM 2719 N ASP A 174 -9.111 11.285 -18.511 1.00 0.00 N ATOM 2720 CA ASP A 174 -10.375 11.559 -17.798 1.00 0.00 C ATOM 2721 C ASP A 174 -11.450 10.463 -17.918 1.00 0.00 C ATOM 2722 O ASP A 174 -12.387 10.416 -17.121 1.00 0.00 O ATOM 2723 CB ASP A 174 -10.970 12.896 -18.272 1.00 0.00 C ATOM 2724 CG ASP A 174 -9.958 14.045 -18.311 1.00 0.00 C ATOM 2725 OD1 ASP A 174 -9.043 13.963 -19.164 1.00 0.00 O ATOM 2726 OD2 ASP A 174 -10.050 14.920 -17.421 1.00 0.00 O1- ATOM 0 H ASP A 174 -8.933 11.943 -19.269 1.00 0.00 H new ATOM 0 HA ASP A 174 -10.097 11.593 -16.745 1.00 0.00 H new ATOM 0 HB2 ASP A 174 -11.392 12.762 -19.268 1.00 0.00 H new ATOM 0 HB3 ASP A 174 -11.792 13.171 -17.612 1.00 0.00 H new ATOM 2731 N ASN A 175 -11.268 9.506 -18.832 1.00 0.00 N ATOM 2732 CA ASN A 175 -12.035 8.257 -18.882 1.00 0.00 C ATOM 2733 C ASN A 175 -11.847 7.388 -17.621 1.00 0.00 C ATOM 2734 O ASN A 175 -12.795 6.731 -17.189 1.00 0.00 O ATOM 2735 CB ASN A 175 -11.633 7.474 -20.142 1.00 0.00 C ATOM 2736 CG ASN A 175 -12.017 8.203 -21.415 1.00 0.00 C ATOM 2737 OD1 ASN A 175 -13.169 8.243 -21.800 1.00 0.00 O ATOM 2738 ND2 ASN A 175 -11.069 8.752 -22.140 1.00 0.00 N ATOM 0 H ASN A 175 -10.570 9.578 -19.572 1.00 0.00 H new ATOM 0 HA ASN A 175 -13.093 8.515 -18.919 1.00 0.00 H new ATOM 0 HB2 ASN A 175 -10.557 7.303 -20.134 1.00 0.00 H new ATOM 0 HB3 ASN A 175 -12.111 6.495 -20.127 1.00 0.00 H new ATOM 0 HD21 ASN A 175 -11.301 9.209 -23.022 1.00 0.00 H new ATOM 0 HD22 ASN A 175 -10.101 8.721 -21.821 1.00 0.00 H new ATOM 2745 N LEU A 176 -10.668 7.447 -16.994 1.00 0.00 N ATOM 2746 CA LEU A 176 -10.361 6.913 -15.664 1.00 0.00 C ATOM 2747 C LEU A 176 -10.759 7.916 -14.566 1.00 0.00 C ATOM 2748 O LEU A 176 -9.916 8.529 -13.905 1.00 0.00 O ATOM 2749 CB LEU A 176 -8.877 6.508 -15.601 1.00 0.00 C ATOM 2750 CG LEU A 176 -8.488 5.346 -16.528 1.00 0.00 C ATOM 2751 CD1 LEU A 176 -6.975 5.137 -16.480 1.00 0.00 C ATOM 2752 CD2 LEU A 176 -9.161 4.047 -16.088 1.00 0.00 C ATOM 0 H LEU A 176 -9.858 7.893 -17.425 1.00 0.00 H new ATOM 0 HA LEU A 176 -10.952 6.016 -15.481 1.00 0.00 H new ATOM 0 HB2 LEU A 176 -8.267 7.375 -15.853 1.00 0.00 H new ATOM 0 HB3 LEU A 176 -8.633 6.233 -14.575 1.00 0.00 H new ATOM 0 HG LEU A 176 -8.812 5.599 -17.538 1.00 0.00 H new ATOM 0 HD11 LEU A 176 -6.701 4.312 -17.138 1.00 0.00 H new ATOM 0 HD12 LEU A 176 -6.471 6.046 -16.808 1.00 0.00 H new ATOM 0 HD13 LEU A 176 -6.672 4.903 -15.459 1.00 0.00 H new ATOM 0 HD21 LEU A 176 -8.869 3.240 -16.760 1.00 0.00 H new ATOM 0 HD22 LEU A 176 -8.851 3.803 -15.072 1.00 0.00 H new ATOM 0 HD23 LEU A 176 -10.244 4.170 -16.117 1.00 0.00 H new ATOM 2764 N THR A 177 -12.041 8.284 -14.576 1.00 0.00 N ATOM 2765 CA THR A 177 -12.570 9.488 -13.917 1.00 0.00 C ATOM 2766 C THR A 177 -12.518 9.414 -12.387 1.00 0.00 C ATOM 2767 O THR A 177 -12.474 10.461 -11.742 1.00 0.00 O ATOM 2768 CB THR A 177 -14.025 9.761 -14.338 1.00 0.00 C ATOM 2769 OG1 THR A 177 -14.302 9.252 -15.623 1.00 0.00 O ATOM 2770 CG2 THR A 177 -14.352 11.252 -14.353 1.00 0.00 C ATOM 0 H THR A 177 -12.761 7.742 -15.053 1.00 0.00 H new ATOM 0 HA THR A 177 -11.920 10.300 -14.243 1.00 0.00 H new ATOM 0 HB THR A 177 -14.640 9.257 -13.593 1.00 0.00 H new ATOM 0 HG1 THR A 177 -13.610 9.551 -16.249 1.00 0.00 H new ATOM 0 HG21 THR A 177 -15.389 11.394 -14.656 1.00 0.00 H new ATOM 0 HG22 THR A 177 -14.205 11.667 -13.356 1.00 0.00 H new ATOM 0 HG23 THR A 177 -13.695 11.761 -15.058 1.00 0.00 H new ATOM 2778 N HIS A 178 -12.473 8.216 -11.791 1.00 0.00 N ATOM 2779 CA HIS A 178 -12.116 8.065 -10.380 1.00 0.00 C ATOM 2780 C HIS A 178 -10.606 8.241 -10.192 1.00 0.00 C ATOM 2781 O HIS A 178 -10.200 9.142 -9.466 1.00 0.00 O ATOM 2782 CB HIS A 178 -12.609 6.721 -9.816 1.00 0.00 C ATOM 2783 CG HIS A 178 -12.298 6.532 -8.351 1.00 0.00 C ATOM 2784 ND1 HIS A 178 -11.073 6.224 -7.797 1.00 0.00 N ATOM 2785 CD2 HIS A 178 -13.177 6.686 -7.315 1.00 0.00 C ATOM 2786 CE1 HIS A 178 -11.221 6.177 -6.461 1.00 0.00 C ATOM 2787 NE2 HIS A 178 -12.486 6.448 -6.125 1.00 0.00 N ATOM 0 H HIS A 178 -12.680 7.338 -12.267 1.00 0.00 H new ATOM 0 HA HIS A 178 -12.619 8.848 -9.813 1.00 0.00 H new ATOM 0 HB2 HIS A 178 -13.687 6.648 -9.963 1.00 0.00 H new ATOM 0 HB3 HIS A 178 -12.154 5.909 -10.383 1.00 0.00 H new ATOM 0 HD1 HIS A 178 -10.207 6.061 -8.310 1.00 0.00 H new ATOM 0 HD2 HIS A 178 -14.222 6.946 -7.402 1.00 0.00 H new ATOM 0 HE1 HIS A 178 -10.431 5.952 -5.760 1.00 0.00 H new ATOM 2795 N VAL A 179 -9.764 7.514 -10.940 1.00 0.00 N ATOM 2796 CA VAL A 179 -8.292 7.521 -10.754 1.00 0.00 C ATOM 2797 C VAL A 179 -7.685 8.925 -10.883 1.00 0.00 C ATOM 2798 O VAL A 179 -6.988 9.375 -9.972 1.00 0.00 O ATOM 2799 CB VAL A 179 -7.580 6.565 -11.734 1.00 0.00 C ATOM 2800 CG1 VAL A 179 -6.074 6.459 -11.451 1.00 0.00 C ATOM 2801 CG2 VAL A 179 -8.147 5.142 -11.680 1.00 0.00 C ATOM 0 H VAL A 179 -10.077 6.902 -11.693 1.00 0.00 H new ATOM 0 HA VAL A 179 -8.129 7.171 -9.735 1.00 0.00 H new ATOM 0 HB VAL A 179 -7.752 7.000 -12.718 1.00 0.00 H new ATOM 0 HG11 VAL A 179 -5.617 5.775 -12.166 1.00 0.00 H new ATOM 0 HG12 VAL A 179 -5.616 7.443 -11.546 1.00 0.00 H new ATOM 0 HG13 VAL A 179 -5.919 6.083 -10.440 1.00 0.00 H new ATOM 0 HG21 VAL A 179 -7.611 4.510 -12.388 1.00 0.00 H new ATOM 0 HG22 VAL A 179 -8.028 4.741 -10.674 1.00 0.00 H new ATOM 0 HG23 VAL A 179 -9.205 5.162 -11.940 1.00 0.00 H new ATOM 2811 N LEU A 180 -8.069 9.680 -11.920 1.00 0.00 N ATOM 2812 CA LEU A 180 -7.565 11.037 -12.165 1.00 0.00 C ATOM 2813 C LEU A 180 -7.958 12.038 -11.064 1.00 0.00 C ATOM 2814 O LEU A 180 -7.261 13.028 -10.852 1.00 0.00 O ATOM 2815 CB LEU A 180 -8.061 11.497 -13.552 1.00 0.00 C ATOM 2816 CG LEU A 180 -7.632 12.920 -13.964 1.00 0.00 C ATOM 2817 CD1 LEU A 180 -6.114 13.105 -14.004 1.00 0.00 C ATOM 2818 CD2 LEU A 180 -8.188 13.240 -15.344 1.00 0.00 C ATOM 0 H LEU A 180 -8.743 9.364 -12.617 1.00 0.00 H new ATOM 0 HA LEU A 180 -6.476 11.008 -12.145 1.00 0.00 H new ATOM 0 HB2 LEU A 180 -7.698 10.794 -14.302 1.00 0.00 H new ATOM 0 HB3 LEU A 180 -9.150 11.444 -13.567 1.00 0.00 H new ATOM 0 HG LEU A 180 -8.030 13.594 -13.205 1.00 0.00 H new ATOM 0 HD11 LEU A 180 -5.880 14.127 -14.301 1.00 0.00 H new ATOM 0 HD12 LEU A 180 -5.697 12.909 -13.016 1.00 0.00 H new ATOM 0 HD13 LEU A 180 -5.682 12.410 -14.724 1.00 0.00 H new ATOM 0 HD21 LEU A 180 -7.884 14.246 -15.634 1.00 0.00 H new ATOM 0 HD22 LEU A 180 -7.802 12.522 -16.067 1.00 0.00 H new ATOM 0 HD23 LEU A 180 -9.276 13.182 -15.320 1.00 0.00 H new ATOM 2830 N ASN A 181 -9.081 11.824 -10.375 1.00 0.00 N ATOM 2831 CA ASN A 181 -9.512 12.680 -9.266 1.00 0.00 C ATOM 2832 C ASN A 181 -9.053 12.170 -7.892 1.00 0.00 C ATOM 2833 O ASN A 181 -8.633 12.977 -7.068 1.00 0.00 O ATOM 2834 CB ASN A 181 -11.027 12.898 -9.371 1.00 0.00 C ATOM 2835 CG ASN A 181 -11.366 13.754 -10.580 1.00 0.00 C ATOM 2836 OD1 ASN A 181 -10.852 14.854 -10.752 1.00 0.00 O ATOM 2837 ND2 ASN A 181 -12.078 13.226 -11.543 1.00 0.00 N ATOM 0 H ASN A 181 -9.718 11.052 -10.570 1.00 0.00 H new ATOM 0 HA ASN A 181 -9.019 13.648 -9.353 1.00 0.00 H new ATOM 0 HB2 ASN A 181 -11.533 11.936 -9.448 1.00 0.00 H new ATOM 0 HB3 ASN A 181 -11.393 13.380 -8.464 1.00 0.00 H new ATOM 0 HD21 ASN A 181 -12.199 13.729 -12.422 1.00 0.00 H new ATOM 0 HD22 ASN A 181 -12.512 12.312 -11.414 1.00 0.00 H new ATOM 2844 N TYR A 182 -8.894 10.859 -7.732 1.00 0.00 N ATOM 2845 CA TYR A 182 -8.336 10.216 -6.546 1.00 0.00 C ATOM 2846 C TYR A 182 -6.868 10.587 -6.300 1.00 0.00 C ATOM 2847 O TYR A 182 -6.523 10.954 -5.181 1.00 0.00 O ATOM 2848 CB TYR A 182 -8.500 8.704 -6.710 1.00 0.00 C ATOM 2849 CG TYR A 182 -7.906 7.906 -5.573 1.00 0.00 C ATOM 2850 CD1 TYR A 182 -8.676 7.653 -4.422 1.00 0.00 C ATOM 2851 CD2 TYR A 182 -6.574 7.453 -5.654 1.00 0.00 C ATOM 2852 CE1 TYR A 182 -8.121 6.912 -3.364 1.00 0.00 C ATOM 2853 CE2 TYR A 182 -6.016 6.725 -4.588 1.00 0.00 C ATOM 2854 CZ TYR A 182 -6.800 6.433 -3.454 1.00 0.00 C ATOM 2855 OH TYR A 182 -6.306 5.649 -2.469 1.00 0.00 O ATOM 0 H TYR A 182 -9.161 10.189 -8.453 1.00 0.00 H new ATOM 0 HA TYR A 182 -8.877 10.570 -5.668 1.00 0.00 H new ATOM 0 HB2 TYR A 182 -9.561 8.469 -6.793 1.00 0.00 H new ATOM 0 HB3 TYR A 182 -8.031 8.395 -7.644 1.00 0.00 H new ATOM 0 HD1 TYR A 182 -9.687 8.026 -4.352 1.00 0.00 H new ATOM 0 HD2 TYR A 182 -5.983 7.664 -6.533 1.00 0.00 H new ATOM 0 HE1 TYR A 182 -8.709 6.710 -2.481 1.00 0.00 H new ATOM 0 HE2 TYR A 182 -4.990 6.391 -4.638 1.00 0.00 H new ATOM 0 HH TYR A 182 -7.025 5.414 -1.846 1.00 0.00 H new ATOM 2865 N ILE A 183 -6.065 10.737 -7.360 1.00 0.00 N ATOM 2866 CA ILE A 183 -4.685 11.245 -7.252 1.00 0.00 C ATOM 2867 C ILE A 183 -4.647 12.666 -6.651 1.00 0.00 C ATOM 2868 O ILE A 183 -3.934 12.902 -5.679 1.00 0.00 O ATOM 2869 CB ILE A 183 -3.986 11.151 -8.628 1.00 0.00 C ATOM 2870 CG1 ILE A 183 -3.720 9.665 -8.974 1.00 0.00 C ATOM 2871 CG2 ILE A 183 -2.664 11.935 -8.652 1.00 0.00 C ATOM 2872 CD1 ILE A 183 -3.409 9.421 -10.456 1.00 0.00 C ATOM 0 H ILE A 183 -6.348 10.512 -8.314 1.00 0.00 H new ATOM 0 HA ILE A 183 -4.127 10.619 -6.555 1.00 0.00 H new ATOM 0 HB ILE A 183 -4.648 11.595 -9.371 1.00 0.00 H new ATOM 0 HG12 ILE A 183 -2.885 9.306 -8.373 1.00 0.00 H new ATOM 0 HG13 ILE A 183 -4.592 9.074 -8.693 1.00 0.00 H new ATOM 0 HG21 ILE A 183 -2.205 11.843 -9.636 1.00 0.00 H new ATOM 0 HG22 ILE A 183 -2.860 12.986 -8.439 1.00 0.00 H new ATOM 0 HG23 ILE A 183 -1.988 11.532 -7.897 1.00 0.00 H new ATOM 0 HD11 ILE A 183 -3.234 8.358 -10.621 1.00 0.00 H new ATOM 0 HD12 ILE A 183 -4.253 9.748 -11.064 1.00 0.00 H new ATOM 0 HD13 ILE A 183 -2.519 9.983 -10.738 1.00 0.00 H new ATOM 2884 N LYS A 184 -5.620 13.523 -6.994 1.00 0.00 N ATOM 2885 CA LYS A 184 -5.782 14.865 -6.397 1.00 0.00 C ATOM 2886 C LYS A 184 -6.175 14.804 -4.910 1.00 0.00 C ATOM 2887 O LYS A 184 -5.777 15.680 -4.143 1.00 0.00 O ATOM 2888 CB LYS A 184 -6.808 15.700 -7.191 1.00 0.00 C ATOM 2889 CG LYS A 184 -6.533 15.747 -8.706 1.00 0.00 C ATOM 2890 CD LYS A 184 -7.705 16.354 -9.491 1.00 0.00 C ATOM 2891 CE LYS A 184 -7.462 16.165 -10.996 1.00 0.00 C ATOM 2892 NZ LYS A 184 -8.712 16.288 -11.786 1.00 0.00 N1+ ATOM 0 H LYS A 184 -6.324 13.306 -7.699 1.00 0.00 H new ATOM 0 HA LYS A 184 -4.809 15.353 -6.454 1.00 0.00 H new ATOM 0 HB2 LYS A 184 -7.804 15.289 -7.025 1.00 0.00 H new ATOM 0 HB3 LYS A 184 -6.814 16.718 -6.801 1.00 0.00 H new ATOM 0 HG2 LYS A 184 -5.632 16.332 -8.892 1.00 0.00 H new ATOM 0 HG3 LYS A 184 -6.339 14.738 -9.069 1.00 0.00 H new ATOM 0 HD2 LYS A 184 -8.640 15.875 -9.199 1.00 0.00 H new ATOM 0 HD3 LYS A 184 -7.804 17.414 -9.257 1.00 0.00 H new ATOM 0 HE2 LYS A 184 -6.741 16.906 -11.342 1.00 0.00 H new ATOM 0 HE3 LYS A 184 -7.019 15.184 -11.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 184 -8.578 15.849 -12.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 184 -9.487 15.808 -11.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 184 -8.948 17.293 -11.908 1.00 0.00 H new ATOM 2906 N LEU A 185 -6.863 13.744 -4.469 1.00 0.00 N ATOM 2907 CA LEU A 185 -7.164 13.494 -3.052 1.00 0.00 C ATOM 2908 C LEU A 185 -5.934 13.076 -2.229 1.00 0.00 C ATOM 2909 O LEU A 185 -5.921 13.352 -1.030 1.00 0.00 O ATOM 2910 CB LEU A 185 -8.281 12.443 -2.873 1.00 0.00 C ATOM 2911 CG LEU A 185 -9.607 12.735 -3.598 1.00 0.00 C ATOM 2912 CD1 LEU A 185 -10.597 11.603 -3.330 1.00 0.00 C ATOM 2913 CD2 LEU A 185 -10.246 14.048 -3.137 1.00 0.00 C ATOM 0 H LEU A 185 -7.231 13.026 -5.093 1.00 0.00 H new ATOM 0 HA LEU A 185 -7.509 14.454 -2.668 1.00 0.00 H new ATOM 0 HB2 LEU A 185 -7.905 11.480 -3.219 1.00 0.00 H new ATOM 0 HB3 LEU A 185 -8.488 12.340 -1.808 1.00 0.00 H new ATOM 0 HG LEU A 185 -9.378 12.817 -4.661 1.00 0.00 H new ATOM 0 HD11 LEU A 185 -11.535 11.811 -3.844 1.00 0.00 H new ATOM 0 HD12 LEU A 185 -10.183 10.663 -3.696 1.00 0.00 H new ATOM 0 HD13 LEU A 185 -10.780 11.526 -2.258 1.00 0.00 H new ATOM 0 HD21 LEU A 185 -11.179 14.208 -3.678 1.00 0.00 H new ATOM 0 HD22 LEU A 185 -10.451 13.997 -2.068 1.00 0.00 H new ATOM 0 HD23 LEU A 185 -9.564 14.874 -3.337 1.00 0.00 H new ATOM 2925 N LEU A 186 -4.855 12.576 -2.840 1.00 0.00 N ATOM 2926 CA LEU A 186 -3.606 12.246 -2.133 1.00 0.00 C ATOM 2927 C LEU A 186 -2.902 13.491 -1.552 1.00 0.00 C ATOM 2928 O LEU A 186 -2.297 13.433 -0.483 1.00 0.00 O ATOM 2929 CB LEU A 186 -2.665 11.425 -3.043 1.00 0.00 C ATOM 2930 CG LEU A 186 -3.293 10.147 -3.638 1.00 0.00 C ATOM 2931 CD1 LEU A 186 -2.313 9.444 -4.577 1.00 0.00 C ATOM 2932 CD2 LEU A 186 -3.701 9.138 -2.561 1.00 0.00 C ATOM 0 H LEU A 186 -4.820 12.387 -3.842 1.00 0.00 H new ATOM 0 HA LEU A 186 -3.874 11.628 -1.276 1.00 0.00 H new ATOM 0 HB2 LEU A 186 -2.327 12.061 -3.861 1.00 0.00 H new ATOM 0 HB3 LEU A 186 -1.781 11.146 -2.470 1.00 0.00 H new ATOM 0 HG LEU A 186 -4.181 10.477 -4.177 1.00 0.00 H new ATOM 0 HD11 LEU A 186 -2.779 8.546 -4.983 1.00 0.00 H new ATOM 0 HD12 LEU A 186 -2.046 10.115 -5.393 1.00 0.00 H new ATOM 0 HD13 LEU A 186 -1.414 9.168 -4.025 1.00 0.00 H new ATOM 0 HD21 LEU A 186 -4.137 8.258 -3.034 1.00 0.00 H new ATOM 0 HD22 LEU A 186 -2.823 8.844 -1.987 1.00 0.00 H new ATOM 0 HD23 LEU A 186 -4.434 9.593 -1.895 1.00 0.00 H new ATOM 2944 N PHE A 187 -3.204 14.673 -2.095 1.00 0.00 N ATOM 2945 CA PHE A 187 -2.801 15.980 -1.566 1.00 0.00 C ATOM 2946 C PHE A 187 -3.770 16.531 -0.489 1.00 0.00 C ATOM 2947 O PHE A 187 -3.770 17.734 -0.193 1.00 0.00 O ATOM 2948 CB PHE A 187 -2.583 16.942 -2.747 1.00 0.00 C ATOM 2949 CG PHE A 187 -1.590 16.439 -3.787 1.00 0.00 C ATOM 2950 CD1 PHE A 187 -2.020 15.576 -4.816 1.00 0.00 C ATOM 2951 CD2 PHE A 187 -0.230 16.806 -3.716 1.00 0.00 C ATOM 2952 CE1 PHE A 187 -1.099 15.067 -5.748 1.00 0.00 C ATOM 2953 CE2 PHE A 187 0.687 16.310 -4.662 1.00 0.00 C ATOM 2954 CZ PHE A 187 0.252 15.435 -5.673 1.00 0.00 C ATOM 0 H PHE A 187 -3.757 14.750 -2.948 1.00 0.00 H new ATOM 0 HA PHE A 187 -1.860 15.869 -1.028 1.00 0.00 H new ATOM 0 HB2 PHE A 187 -3.541 17.124 -3.234 1.00 0.00 H new ATOM 0 HB3 PHE A 187 -2.234 17.900 -2.361 1.00 0.00 H new ATOM 0 HD1 PHE A 187 -3.063 15.305 -4.888 1.00 0.00 H new ATOM 0 HD2 PHE A 187 0.109 17.469 -2.934 1.00 0.00 H new ATOM 0 HE1 PHE A 187 -1.432 14.392 -6.522 1.00 0.00 H new ATOM 0 HE2 PHE A 187 1.726 16.602 -4.611 1.00 0.00 H new ATOM 0 HZ PHE A 187 0.958 15.046 -6.392 1.00 0.00 H new ATOM 2964 N SER A 188 -4.594 15.671 0.123 1.00 0.00 N ATOM 2965 CA SER A 188 -5.657 16.002 1.087 1.00 0.00 C ATOM 2966 C SER A 188 -5.789 14.960 2.219 1.00 0.00 C ATOM 2967 O SER A 188 -5.032 13.990 2.263 1.00 0.00 O ATOM 2968 CB SER A 188 -6.978 16.200 0.331 1.00 0.00 C ATOM 2969 OG SER A 188 -7.657 14.983 0.152 1.00 0.00 O ATOM 0 H SER A 188 -4.535 14.667 -0.050 1.00 0.00 H new ATOM 0 HA SER A 188 -5.386 16.932 1.587 1.00 0.00 H new ATOM 0 HB2 SER A 188 -7.613 16.894 0.882 1.00 0.00 H new ATOM 0 HB3 SER A 188 -6.778 16.652 -0.640 1.00 0.00 H new ATOM 0 HG SER A 188 -7.164 14.424 -0.485 1.00 0.00 H new ATOM 2975 N ARG A 189 -6.719 15.200 3.160 1.00 0.00 N ATOM 2976 CA ARG A 189 -6.894 14.469 4.435 1.00 0.00 C ATOM 2977 C ARG A 189 -5.661 14.525 5.349 1.00 0.00 C ATOM 2978 O ARG A 189 -4.581 14.959 4.958 1.00 0.00 O ATOM 2979 CB ARG A 189 -7.329 13.005 4.187 1.00 0.00 C ATOM 2980 CG ARG A 189 -8.556 12.849 3.274 1.00 0.00 C ATOM 2981 CD ARG A 189 -8.925 11.373 3.053 1.00 0.00 C ATOM 2982 NE ARG A 189 -9.394 10.697 4.278 1.00 0.00 N ATOM 2983 CZ ARG A 189 -10.598 10.733 4.814 1.00 0.00 C ATOM 2984 NH1 ARG A 189 -11.546 11.495 4.342 1.00 0.00 N1+ ATOM 2985 NH2 ARG A 189 -10.889 10.011 5.846 1.00 0.00 N ATOM 0 H ARG A 189 -7.406 15.946 3.050 1.00 0.00 H new ATOM 0 HA ARG A 189 -7.692 14.987 4.967 1.00 0.00 H new ATOM 0 HB2 ARG A 189 -6.493 12.461 3.747 1.00 0.00 H new ATOM 0 HB3 ARG A 189 -7.545 12.536 5.147 1.00 0.00 H new ATOM 0 HG2 ARG A 189 -9.404 13.373 3.714 1.00 0.00 H new ATOM 0 HG3 ARG A 189 -8.355 13.320 2.312 1.00 0.00 H new ATOM 0 HD2 ARG A 189 -9.703 11.311 2.292 1.00 0.00 H new ATOM 0 HD3 ARG A 189 -8.055 10.843 2.664 1.00 0.00 H new ATOM 0 HE ARG A 189 -8.702 10.133 4.771 1.00 0.00 H new ATOM 0 HH11 ARG A 189 -11.367 12.089 3.532 1.00 0.00 H new ATOM 0 HH12 ARG A 189 -12.466 11.497 4.783 1.00 0.00 H new ATOM 0 HH21 ARG A 189 -10.182 9.402 6.258 1.00 0.00 H new ATOM 0 HH22 ARG A 189 -11.825 10.051 6.249 1.00 0.00 H new ATOM 2999 N GLU A 190 -5.817 14.033 6.568 1.00 0.00 N ATOM 3000 CA GLU A 190 -4.721 13.601 7.430 1.00 0.00 C ATOM 3001 C GLU A 190 -4.002 12.392 6.812 1.00 0.00 C ATOM 3002 O GLU A 190 -2.795 12.439 6.580 1.00 0.00 O ATOM 3003 CB GLU A 190 -5.273 13.220 8.820 1.00 0.00 C ATOM 3004 CG GLU A 190 -5.896 14.379 9.619 1.00 0.00 C ATOM 3005 CD GLU A 190 -7.276 14.873 9.138 1.00 0.00 C ATOM 3006 OE1 GLU A 190 -7.904 14.208 8.279 1.00 0.00 O ATOM 3007 OE2 GLU A 190 -7.589 16.030 9.488 1.00 0.00 O1- ATOM 0 H GLU A 190 -6.734 13.919 7.000 1.00 0.00 H new ATOM 0 HA GLU A 190 -4.010 14.420 7.532 1.00 0.00 H new ATOM 0 HB2 GLU A 190 -6.025 12.442 8.693 1.00 0.00 H new ATOM 0 HB3 GLU A 190 -4.464 12.788 9.409 1.00 0.00 H new ATOM 0 HG2 GLU A 190 -5.987 14.068 10.660 1.00 0.00 H new ATOM 0 HG3 GLU A 190 -5.204 15.221 9.597 1.00 0.00 H new ATOM 3014 N SER A 191 -4.791 11.404 6.381 1.00 0.00 N ATOM 3015 CA SER A 191 -4.365 10.073 5.938 1.00 0.00 C ATOM 3016 C SER A 191 -3.440 10.044 4.729 1.00 0.00 C ATOM 3017 O SER A 191 -2.505 9.251 4.713 1.00 0.00 O ATOM 3018 CB SER A 191 -5.591 9.192 5.658 1.00 0.00 C ATOM 3019 OG SER A 191 -6.810 9.910 5.560 1.00 0.00 O ATOM 0 H SER A 191 -5.803 11.518 6.329 1.00 0.00 H new ATOM 0 HA SER A 191 -3.773 9.686 6.767 1.00 0.00 H new ATOM 0 HB2 SER A 191 -5.428 8.646 4.729 1.00 0.00 H new ATOM 0 HB3 SER A 191 -5.681 8.451 6.452 1.00 0.00 H new ATOM 0 HG SER A 191 -7.442 9.575 6.230 1.00 0.00 H new ATOM 3025 N PHE A 192 -3.652 10.891 3.719 1.00 0.00 N ATOM 3026 CA PHE A 192 -2.727 10.966 2.585 1.00 0.00 C ATOM 3027 C PHE A 192 -1.715 12.105 2.752 1.00 0.00 C ATOM 3028 O PHE A 192 -0.512 11.842 2.827 1.00 0.00 O ATOM 3029 CB PHE A 192 -3.487 11.039 1.258 1.00 0.00 C ATOM 3030 CG PHE A 192 -4.553 9.980 1.024 1.00 0.00 C ATOM 3031 CD1 PHE A 192 -4.230 8.612 1.107 1.00 0.00 C ATOM 3032 CD2 PHE A 192 -5.857 10.361 0.650 1.00 0.00 C ATOM 3033 CE1 PHE A 192 -5.206 7.635 0.836 1.00 0.00 C ATOM 3034 CE2 PHE A 192 -6.823 9.383 0.347 1.00 0.00 C ATOM 3035 CZ PHE A 192 -6.499 8.019 0.444 1.00 0.00 C ATOM 0 H PHE A 192 -4.447 11.528 3.662 1.00 0.00 H new ATOM 0 HA PHE A 192 -2.145 10.045 2.565 1.00 0.00 H new ATOM 0 HB2 PHE A 192 -3.960 12.019 1.190 1.00 0.00 H new ATOM 0 HB3 PHE A 192 -2.762 10.978 0.446 1.00 0.00 H new ATOM 0 HD1 PHE A 192 -3.229 8.311 1.380 1.00 0.00 H new ATOM 0 HD2 PHE A 192 -6.116 11.408 0.596 1.00 0.00 H new ATOM 0 HE1 PHE A 192 -4.960 6.588 0.930 1.00 0.00 H new ATOM 0 HE2 PHE A 192 -7.814 9.681 0.040 1.00 0.00 H new ATOM 0 HZ PHE A 192 -7.242 7.268 0.218 1.00 0.00 H new ATOM 3045 N LYS A 193 -2.175 13.340 2.997 1.00 0.00 N ATOM 3046 CA LYS A 193 -1.314 14.534 2.921 1.00 0.00 C ATOM 3047 C LYS A 193 -0.152 14.555 3.914 1.00 0.00 C ATOM 3048 O LYS A 193 0.931 15.001 3.541 1.00 0.00 O ATOM 3049 CB LYS A 193 -2.172 15.788 3.102 1.00 0.00 C ATOM 3050 CG LYS A 193 -1.486 17.037 2.541 1.00 0.00 C ATOM 3051 CD LYS A 193 -2.421 18.242 2.677 1.00 0.00 C ATOM 3052 CE LYS A 193 -1.951 19.371 1.755 1.00 0.00 C ATOM 3053 NZ LYS A 193 -3.110 20.102 1.192 1.00 0.00 N1+ ATOM 0 H LYS A 193 -3.142 13.541 3.251 1.00 0.00 H new ATOM 0 HA LYS A 193 -0.851 14.506 1.935 1.00 0.00 H new ATOM 0 HB2 LYS A 193 -3.131 15.646 2.604 1.00 0.00 H new ATOM 0 HB3 LYS A 193 -2.382 15.934 4.162 1.00 0.00 H new ATOM 0 HG2 LYS A 193 -0.555 17.224 3.076 1.00 0.00 H new ATOM 0 HG3 LYS A 193 -1.226 16.882 1.494 1.00 0.00 H new ATOM 0 HD2 LYS A 193 -3.441 17.953 2.422 1.00 0.00 H new ATOM 0 HD3 LYS A 193 -2.436 18.587 3.711 1.00 0.00 H new ATOM 0 HE2 LYS A 193 -1.315 20.060 2.310 1.00 0.00 H new ATOM 0 HE3 LYS A 193 -1.346 18.960 0.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 193 -2.774 20.934 0.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 193 -3.636 19.476 0.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 193 -3.735 20.410 1.964 1.00 0.00 H new ATOM 3067 N LYS A 194 -0.339 14.067 5.148 1.00 0.00 N ATOM 3068 CA LYS A 194 0.738 14.011 6.161 1.00 0.00 C ATOM 3069 C LYS A 194 1.868 13.052 5.781 1.00 0.00 C ATOM 3070 O LYS A 194 2.974 13.170 6.293 1.00 0.00 O ATOM 3071 CB LYS A 194 0.172 13.574 7.517 1.00 0.00 C ATOM 3072 CG LYS A 194 -0.798 14.587 8.142 1.00 0.00 C ATOM 3073 CD LYS A 194 -1.291 13.996 9.464 1.00 0.00 C ATOM 3074 CE LYS A 194 -2.284 14.890 10.205 1.00 0.00 C ATOM 3075 NZ LYS A 194 -2.678 14.248 11.479 1.00 0.00 N1+ ATOM 0 H LYS A 194 -1.233 13.701 5.476 1.00 0.00 H new ATOM 0 HA LYS A 194 1.151 15.018 6.217 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -0.342 12.621 7.395 1.00 0.00 H new ATOM 0 HB3 LYS A 194 0.999 13.404 8.207 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -0.299 15.541 8.311 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -1.636 14.779 7.472 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -1.760 13.032 9.268 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -0.433 13.808 10.110 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -1.835 15.864 10.401 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -3.164 15.063 9.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -3.694 14.028 11.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -2.137 13.369 11.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -2.480 14.895 12.269 1.00 0.00 H new ATOM 3089 N THR A 195 1.575 12.083 4.917 1.00 0.00 N ATOM 3090 CA THR A 195 2.490 10.996 4.538 1.00 0.00 C ATOM 3091 C THR A 195 3.358 11.334 3.318 1.00 0.00 C ATOM 3092 O THR A 195 4.234 10.550 2.957 1.00 0.00 O ATOM 3093 CB THR A 195 1.703 9.695 4.308 1.00 0.00 C ATOM 3094 OG1 THR A 195 1.081 9.688 3.040 1.00 0.00 O ATOM 3095 CG2 THR A 195 0.621 9.446 5.355 1.00 0.00 C ATOM 0 H THR A 195 0.672 12.026 4.446 1.00 0.00 H new ATOM 0 HA THR A 195 3.180 10.858 5.371 1.00 0.00 H new ATOM 0 HB THR A 195 2.448 8.903 4.381 1.00 0.00 H new ATOM 0 HG1 THR A 195 0.723 10.579 2.847 1.00 0.00 H new ATOM 0 HG21 THR A 195 0.106 8.512 5.131 1.00 0.00 H new ATOM 0 HG22 THR A 195 1.078 9.381 6.342 1.00 0.00 H new ATOM 0 HG23 THR A 195 -0.095 10.268 5.341 1.00 0.00 H new ATOM 3103 N ARG A 196 3.099 12.474 2.660 1.00 0.00 N ATOM 3104 CA ARG A 196 3.781 12.928 1.442 1.00 0.00 C ATOM 3105 C ARG A 196 5.287 13.115 1.689 1.00 0.00 C ATOM 3106 O ARG A 196 5.688 13.999 2.441 1.00 0.00 O ATOM 3107 CB ARG A 196 3.108 14.233 0.975 1.00 0.00 C ATOM 3108 CG ARG A 196 3.567 14.647 -0.429 1.00 0.00 C ATOM 3109 CD ARG A 196 3.067 16.045 -0.812 1.00 0.00 C ATOM 3110 NE ARG A 196 3.566 16.460 -2.142 1.00 0.00 N ATOM 3111 CZ ARG A 196 3.671 17.691 -2.615 1.00 0.00 C ATOM 3112 NH1 ARG A 196 3.370 18.732 -1.893 1.00 0.00 N1+ ATOM 3113 NH2 ARG A 196 4.062 17.930 -3.825 1.00 0.00 N ATOM 0 H ARG A 196 2.382 13.128 2.974 1.00 0.00 H new ATOM 0 HA ARG A 196 3.692 12.176 0.658 1.00 0.00 H new ATOM 0 HB2 ARG A 196 2.026 14.104 0.979 1.00 0.00 H new ATOM 0 HB3 ARG A 196 3.337 15.031 1.681 1.00 0.00 H new ATOM 0 HG2 ARG A 196 4.656 14.627 -0.474 1.00 0.00 H new ATOM 0 HG3 ARG A 196 3.205 13.921 -1.157 1.00 0.00 H new ATOM 0 HD2 ARG A 196 1.977 16.054 -0.813 1.00 0.00 H new ATOM 0 HD3 ARG A 196 3.391 16.766 -0.061 1.00 0.00 H new ATOM 0 HE ARG A 196 3.863 15.710 -2.766 1.00 0.00 H new ATOM 0 HH11 ARG A 196 3.043 18.611 -0.935 1.00 0.00 H new ATOM 0 HH12 ARG A 196 3.461 19.669 -2.286 1.00 0.00 H new ATOM 0 HH21 ARG A 196 4.300 17.157 -4.446 1.00 0.00 H new ATOM 0 HH22 ARG A 196 4.132 18.892 -4.158 1.00 0.00 H new ATOM 3127 N ALA A 197 6.110 12.302 1.028 1.00 0.00 N ATOM 3128 CA ALA A 197 7.569 12.424 1.042 1.00 0.00 C ATOM 3129 C ALA A 197 8.068 13.669 0.273 1.00 0.00 C ATOM 3130 O ALA A 197 7.349 14.218 -0.560 1.00 0.00 O ATOM 3131 CB ALA A 197 8.154 11.127 0.470 1.00 0.00 C ATOM 0 H ALA A 197 5.776 11.526 0.457 1.00 0.00 H new ATOM 0 HA ALA A 197 7.910 12.568 2.067 1.00 0.00 H new ATOM 0 HB1 ALA A 197 9.242 11.189 0.468 1.00 0.00 H new ATOM 0 HB2 ALA A 197 7.840 10.284 1.085 1.00 0.00 H new ATOM 0 HB3 ALA A 197 7.797 10.985 -0.550 1.00 0.00 H new ATOM 3137 N ALA A 198 9.318 14.083 0.509 1.00 0.00 N ATOM 3138 CA ALA A 198 9.981 15.114 -0.295 1.00 0.00 C ATOM 3139 C ALA A 198 10.418 14.543 -1.661 1.00 0.00 C ATOM 3140 O ALA A 198 10.996 13.461 -1.729 1.00 0.00 O ATOM 3141 CB ALA A 198 11.152 15.685 0.510 1.00 0.00 C ATOM 0 H ALA A 198 9.897 13.713 1.262 1.00 0.00 H new ATOM 0 HA ALA A 198 9.289 15.927 -0.515 1.00 0.00 H new ATOM 0 HB1 ALA A 198 11.656 16.454 -0.076 1.00 0.00 H new ATOM 0 HB2 ALA A 198 10.778 16.121 1.436 1.00 0.00 H new ATOM 0 HB3 ALA A 198 11.857 14.887 0.743 1.00 0.00 H new ATOM 3147 N GLU A 199 10.009 15.180 -2.755 1.00 0.00 N ATOM 3148 CA GLU A 199 9.866 14.537 -4.073 1.00 0.00 C ATOM 3149 C GLU A 199 11.191 14.233 -4.790 1.00 0.00 C ATOM 3150 O GLU A 199 11.374 13.136 -5.322 1.00 0.00 O ATOM 3151 CB GLU A 199 8.942 15.426 -4.926 1.00 0.00 C ATOM 3152 CG GLU A 199 7.523 15.308 -4.356 1.00 0.00 C ATOM 3153 CD GLU A 199 6.491 16.246 -4.985 1.00 0.00 C ATOM 3154 OE1 GLU A 199 6.671 17.469 -4.807 1.00 0.00 O ATOM 3155 OE2 GLU A 199 5.315 15.807 -4.982 1.00 0.00 O1- ATOM 0 H GLU A 199 9.763 16.170 -2.759 1.00 0.00 H new ATOM 0 HA GLU A 199 9.431 13.549 -3.921 1.00 0.00 H new ATOM 0 HB2 GLU A 199 9.279 16.462 -4.901 1.00 0.00 H new ATOM 0 HB3 GLU A 199 8.963 15.109 -5.969 1.00 0.00 H new ATOM 0 HG2 GLU A 199 7.182 14.281 -4.482 1.00 0.00 H new ATOM 0 HG3 GLU A 199 7.561 15.502 -3.284 1.00 0.00 H new ATOM 3162 N GLU A 200 12.202 15.069 -4.575 1.00 0.00 N ATOM 3163 CA GLU A 200 13.597 14.811 -4.951 1.00 0.00 C ATOM 3164 C GLU A 200 14.160 13.601 -4.194 1.00 0.00 C ATOM 3165 O GLU A 200 14.874 12.774 -4.757 1.00 0.00 O ATOM 3166 CB GLU A 200 14.496 16.037 -4.658 1.00 0.00 C ATOM 3167 CG GLU A 200 13.830 17.424 -4.554 1.00 0.00 C ATOM 3168 CD GLU A 200 13.268 17.721 -3.146 1.00 0.00 C ATOM 3169 OE1 GLU A 200 12.718 16.785 -2.511 1.00 0.00 O ATOM 3170 OE2 GLU A 200 13.490 18.843 -2.649 1.00 0.00 O1- ATOM 0 H GLU A 200 12.074 15.973 -4.121 1.00 0.00 H new ATOM 0 HA GLU A 200 13.600 14.607 -6.022 1.00 0.00 H new ATOM 0 HB2 GLU A 200 15.020 15.849 -3.721 1.00 0.00 H new ATOM 0 HB3 GLU A 200 15.252 16.089 -5.441 1.00 0.00 H new ATOM 0 HG2 GLU A 200 14.558 18.191 -4.817 1.00 0.00 H new ATOM 0 HG3 GLU A 200 13.022 17.488 -5.283 1.00 0.00 H new ATOM 3177 N HIS A 201 13.754 13.450 -2.934 1.00 0.00 N ATOM 3178 CA HIS A 201 14.174 12.391 -2.016 1.00 0.00 C ATOM 3179 C HIS A 201 13.371 11.081 -2.185 1.00 0.00 C ATOM 3180 O HIS A 201 13.775 10.030 -1.672 1.00 0.00 O ATOM 3181 CB HIS A 201 14.106 12.938 -0.581 1.00 0.00 C ATOM 3182 CG HIS A 201 14.831 14.254 -0.372 1.00 0.00 C ATOM 3183 ND1 HIS A 201 14.405 15.516 -0.742 1.00 0.00 N ATOM 3184 CD2 HIS A 201 16.091 14.408 0.143 1.00 0.00 C ATOM 3185 CE1 HIS A 201 15.371 16.395 -0.444 1.00 0.00 C ATOM 3186 NE2 HIS A 201 16.421 15.768 0.112 1.00 0.00 N ATOM 0 H HIS A 201 13.090 14.095 -2.504 1.00 0.00 H new ATOM 0 HA HIS A 201 15.200 12.111 -2.253 1.00 0.00 H new ATOM 0 HB2 HIS A 201 13.060 13.067 -0.304 1.00 0.00 H new ATOM 0 HB3 HIS A 201 14.526 12.195 0.097 1.00 0.00 H new ATOM 0 HD1 HIS A 201 13.507 15.740 -1.170 1.00 0.00 H new ATOM 0 HD2 HIS A 201 16.723 13.614 0.511 1.00 0.00 H new ATOM 0 HE1 HIS A 201 15.314 17.458 -0.625 1.00 0.00 H new ATOM 3194 N VAL A 202 12.302 11.105 -2.993 1.00 0.00 N ATOM 3195 CA VAL A 202 11.710 9.914 -3.622 1.00 0.00 C ATOM 3196 C VAL A 202 12.545 9.495 -4.833 1.00 0.00 C ATOM 3197 O VAL A 202 13.064 8.383 -4.848 1.00 0.00 O ATOM 3198 CB VAL A 202 10.240 10.144 -4.035 1.00 0.00 C ATOM 3199 CG1 VAL A 202 9.619 8.886 -4.648 1.00 0.00 C ATOM 3200 CG2 VAL A 202 9.358 10.531 -2.843 1.00 0.00 C ATOM 0 H VAL A 202 11.815 11.968 -3.233 1.00 0.00 H new ATOM 0 HA VAL A 202 11.714 9.113 -2.883 1.00 0.00 H new ATOM 0 HB VAL A 202 10.273 10.955 -4.763 1.00 0.00 H new ATOM 0 HG11 VAL A 202 8.585 9.089 -4.925 1.00 0.00 H new ATOM 0 HG12 VAL A 202 10.183 8.597 -5.535 1.00 0.00 H new ATOM 0 HG13 VAL A 202 9.647 8.075 -3.920 1.00 0.00 H new ATOM 0 HG21 VAL A 202 8.333 10.682 -3.183 1.00 0.00 H new ATOM 0 HG22 VAL A 202 9.380 9.734 -2.100 1.00 0.00 H new ATOM 0 HG23 VAL A 202 9.732 11.453 -2.397 1.00 0.00 H new ATOM 3210 N ILE A 203 12.830 10.420 -5.758 1.00 0.00 N ATOM 3211 CA ILE A 203 13.555 10.137 -7.014 1.00 0.00 C ATOM 3212 C ILE A 203 14.985 9.629 -6.752 1.00 0.00 C ATOM 3213 O ILE A 203 15.334 8.528 -7.178 1.00 0.00 O ATOM 3214 CB ILE A 203 13.537 11.394 -7.920 1.00 0.00 C ATOM 3215 CG1 ILE A 203 12.096 11.715 -8.384 1.00 0.00 C ATOM 3216 CG2 ILE A 203 14.446 11.226 -9.153 1.00 0.00 C ATOM 3217 CD1 ILE A 203 11.904 13.164 -8.851 1.00 0.00 C ATOM 0 H ILE A 203 12.563 11.399 -5.659 1.00 0.00 H new ATOM 0 HA ILE A 203 13.043 9.329 -7.537 1.00 0.00 H new ATOM 0 HB ILE A 203 13.920 12.221 -7.322 1.00 0.00 H new ATOM 0 HG12 ILE A 203 11.828 11.042 -9.199 1.00 0.00 H new ATOM 0 HG13 ILE A 203 11.407 11.513 -7.564 1.00 0.00 H new ATOM 0 HG21 ILE A 203 14.404 12.129 -9.761 1.00 0.00 H new ATOM 0 HG22 ILE A 203 15.472 11.054 -8.828 1.00 0.00 H new ATOM 0 HG23 ILE A 203 14.105 10.375 -9.743 1.00 0.00 H new ATOM 0 HD11 ILE A 203 10.869 13.312 -9.161 1.00 0.00 H new ATOM 0 HD12 ILE A 203 12.139 13.844 -8.032 1.00 0.00 H new ATOM 0 HD13 ILE A 203 12.567 13.366 -9.692 1.00 0.00 H new ATOM 3229 N ALA A 204 15.735 10.311 -5.882 1.00 0.00 N ATOM 3230 CA ALA A 204 17.073 9.910 -5.433 1.00 0.00 C ATOM 3231 C ALA A 204 17.078 8.727 -4.437 1.00 0.00 C ATOM 3232 O ALA A 204 18.140 8.242 -4.050 1.00 0.00 O ATOM 3233 CB ALA A 204 17.760 11.148 -4.843 1.00 0.00 C ATOM 0 H ALA A 204 15.419 11.183 -5.458 1.00 0.00 H new ATOM 0 HA ALA A 204 17.623 9.534 -6.295 1.00 0.00 H new ATOM 0 HB1 ALA A 204 18.759 10.881 -4.500 1.00 0.00 H new ATOM 0 HB2 ALA A 204 17.834 11.922 -5.607 1.00 0.00 H new ATOM 0 HB3 ALA A 204 17.176 11.522 -4.002 1.00 0.00 H new ATOM 3239 N GLY A 205 15.905 8.261 -3.998 1.00 0.00 N ATOM 3240 CA GLY A 205 15.749 6.967 -3.330 1.00 0.00 C ATOM 3241 C GLY A 205 15.455 5.818 -4.303 1.00 0.00 C ATOM 3242 O GLY A 205 15.920 4.702 -4.075 1.00 0.00 O ATOM 0 H GLY A 205 15.030 8.776 -4.097 1.00 0.00 H new ATOM 0 HA2 GLY A 205 16.659 6.740 -2.774 1.00 0.00 H new ATOM 0 HA3 GLY A 205 14.940 7.035 -2.603 1.00 0.00 H new ATOM 3246 N TRP A 206 14.741 6.116 -5.392 1.00 0.00 N ATOM 3247 CA TRP A 206 14.250 5.164 -6.389 1.00 0.00 C ATOM 3248 C TRP A 206 15.271 4.777 -7.467 1.00 0.00 C ATOM 3249 O TRP A 206 15.280 3.612 -7.852 1.00 0.00 O ATOM 3250 CB TRP A 206 12.964 5.731 -7.012 1.00 0.00 C ATOM 3251 CG TRP A 206 12.601 5.190 -8.364 1.00 0.00 C ATOM 3252 CD1 TRP A 206 12.105 3.958 -8.623 1.00 0.00 C ATOM 3253 CD2 TRP A 206 12.886 5.786 -9.666 1.00 0.00 C ATOM 3254 NE1 TRP A 206 12.043 3.759 -9.991 1.00 0.00 N ATOM 3255 CE2 TRP A 206 12.497 4.864 -10.683 1.00 0.00 C ATOM 3256 CE3 TRP A 206 13.464 7.004 -10.086 1.00 0.00 C ATOM 3257 CZ2 TRP A 206 12.663 5.140 -12.048 1.00 0.00 C ATOM 3258 CZ3 TRP A 206 13.638 7.290 -11.453 1.00 0.00 C ATOM 3259 CH2 TRP A 206 13.244 6.361 -12.432 1.00 0.00 C ATOM 0 H TRP A 206 14.477 7.076 -5.612 1.00 0.00 H new ATOM 0 HA TRP A 206 14.049 4.228 -5.868 1.00 0.00 H new ATOM 0 HB2 TRP A 206 12.136 5.538 -6.330 1.00 0.00 H new ATOM 0 HB3 TRP A 206 13.067 6.813 -7.090 1.00 0.00 H new ATOM 0 HD1 TRP A 206 11.803 3.239 -7.876 1.00 0.00 H new ATOM 0 HE1 TRP A 206 11.705 2.904 -10.432 1.00 0.00 H new ATOM 0 HE3 TRP A 206 13.777 7.727 -9.347 1.00 0.00 H new ATOM 0 HZ2 TRP A 206 12.349 4.425 -12.794 1.00 0.00 H new ATOM 0 HZ3 TRP A 206 14.077 8.230 -11.752 1.00 0.00 H new ATOM 0 HH2 TRP A 206 13.388 6.585 -13.479 1.00 0.00 H new ATOM 3270 N GLU A 207 16.185 5.665 -7.881 1.00 0.00 N ATOM 3271 CA GLU A 207 17.159 5.383 -8.961 1.00 0.00 C ATOM 3272 C GLU A 207 17.908 4.039 -8.809 1.00 0.00 C ATOM 3273 O GLU A 207 17.674 3.143 -9.631 1.00 0.00 O ATOM 3274 CB GLU A 207 18.123 6.574 -9.147 1.00 0.00 C ATOM 3275 CG GLU A 207 19.202 6.366 -10.233 1.00 0.00 C ATOM 3276 CD GLU A 207 20.375 5.454 -9.814 1.00 0.00 C ATOM 3277 OE1 GLU A 207 20.966 5.717 -8.744 1.00 0.00 O ATOM 3278 OE2 GLU A 207 20.576 4.412 -10.482 1.00 0.00 O1- ATOM 0 H GLU A 207 16.276 6.599 -7.482 1.00 0.00 H new ATOM 0 HA GLU A 207 16.576 5.263 -9.874 1.00 0.00 H new ATOM 0 HB2 GLU A 207 17.540 7.460 -9.398 1.00 0.00 H new ATOM 0 HB3 GLU A 207 18.617 6.776 -8.197 1.00 0.00 H new ATOM 0 HG2 GLU A 207 18.729 5.942 -11.119 1.00 0.00 H new ATOM 0 HG3 GLU A 207 19.601 7.339 -10.520 1.00 0.00 H new ATOM 3285 N PRO A 208 18.592 3.752 -7.680 1.00 0.00 N ATOM 3286 CA PRO A 208 19.294 2.479 -7.530 1.00 0.00 C ATOM 3287 C PRO A 208 18.321 1.300 -7.382 1.00 0.00 C ATOM 3288 O PRO A 208 18.655 0.170 -7.739 1.00 0.00 O ATOM 3289 CB PRO A 208 20.183 2.657 -6.297 1.00 0.00 C ATOM 3290 CG PRO A 208 19.421 3.677 -5.453 1.00 0.00 C ATOM 3291 CD PRO A 208 18.814 4.595 -6.510 1.00 0.00 C ATOM 0 HA PRO A 208 19.883 2.236 -8.414 1.00 0.00 H new ATOM 0 HB2 PRO A 208 20.321 1.717 -5.763 1.00 0.00 H new ATOM 0 HB3 PRO A 208 21.175 3.020 -6.566 1.00 0.00 H new ATOM 0 HG2 PRO A 208 18.655 3.204 -4.839 1.00 0.00 H new ATOM 0 HG3 PRO A 208 20.082 4.219 -4.777 1.00 0.00 H new ATOM 0 HD2 PRO A 208 17.879 5.033 -6.159 1.00 0.00 H new ATOM 0 HD3 PRO A 208 19.485 5.421 -6.744 1.00 0.00 H new ATOM 3299 N LYS A 209 17.071 1.566 -6.984 1.00 0.00 N ATOM 3300 CA LYS A 209 15.965 0.603 -6.900 1.00 0.00 C ATOM 3301 C LYS A 209 15.215 0.387 -8.221 1.00 0.00 C ATOM 3302 O LYS A 209 14.424 -0.551 -8.289 1.00 0.00 O ATOM 3303 CB LYS A 209 14.999 1.011 -5.781 1.00 0.00 C ATOM 3304 CG LYS A 209 15.657 0.966 -4.390 1.00 0.00 C ATOM 3305 CD LYS A 209 14.754 1.597 -3.325 1.00 0.00 C ATOM 3306 CE LYS A 209 13.439 0.835 -3.143 1.00 0.00 C ATOM 3307 NZ LYS A 209 12.453 1.655 -2.411 1.00 0.00 N1+ ATOM 0 H LYS A 209 16.789 2.504 -6.698 1.00 0.00 H new ATOM 0 HA LYS A 209 16.417 -0.361 -6.667 1.00 0.00 H new ATOM 0 HB2 LYS A 209 14.630 2.019 -5.973 1.00 0.00 H new ATOM 0 HB3 LYS A 209 14.134 0.348 -5.792 1.00 0.00 H new ATOM 0 HG2 LYS A 209 15.872 -0.068 -4.121 1.00 0.00 H new ATOM 0 HG3 LYS A 209 16.611 1.493 -4.420 1.00 0.00 H new ATOM 0 HD2 LYS A 209 15.286 1.628 -2.374 1.00 0.00 H new ATOM 0 HD3 LYS A 209 14.537 2.628 -3.603 1.00 0.00 H new ATOM 0 HE2 LYS A 209 13.036 0.558 -4.117 1.00 0.00 H new ATOM 0 HE3 LYS A 209 13.623 -0.092 -2.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 209 11.668 1.052 -2.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 209 12.910 2.093 -1.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 209 12.085 2.398 -3.039 1.00 0.00 H new ATOM 3321 N VAL A 210 15.631 1.016 -9.326 1.00 0.00 N ATOM 3322 CA VAL A 210 15.414 0.479 -10.688 1.00 0.00 C ATOM 3323 C VAL A 210 16.223 -0.810 -10.885 1.00 0.00 C ATOM 3324 O VAL A 210 15.789 -1.731 -11.585 1.00 0.00 O ATOM 3325 CB VAL A 210 15.802 1.513 -11.769 1.00 0.00 C ATOM 3326 CG1 VAL A 210 15.588 0.980 -13.195 1.00 0.00 C ATOM 3327 CG2 VAL A 210 14.967 2.787 -11.642 1.00 0.00 C ATOM 0 H VAL A 210 16.126 1.908 -9.309 1.00 0.00 H new ATOM 0 HA VAL A 210 14.352 0.259 -10.794 1.00 0.00 H new ATOM 0 HB VAL A 210 16.860 1.719 -11.605 1.00 0.00 H new ATOM 0 HG11 VAL A 210 15.876 1.745 -13.916 1.00 0.00 H new ATOM 0 HG12 VAL A 210 16.199 0.090 -13.346 1.00 0.00 H new ATOM 0 HG13 VAL A 210 14.537 0.726 -13.335 1.00 0.00 H new ATOM 0 HG21 VAL A 210 15.263 3.495 -12.416 1.00 0.00 H new ATOM 0 HG22 VAL A 210 13.911 2.543 -11.758 1.00 0.00 H new ATOM 0 HG23 VAL A 210 15.130 3.233 -10.661 1.00 0.00 H new ATOM 3337 N ASN A 211 17.368 -0.929 -10.202 1.00 0.00 N ATOM 3338 CA ASN A 211 18.240 -2.097 -10.251 1.00 0.00 C ATOM 3339 C ASN A 211 18.018 -3.097 -9.111 1.00 0.00 C ATOM 3340 O ASN A 211 17.855 -4.278 -9.422 1.00 0.00 O ATOM 3341 CB ASN A 211 19.702 -1.637 -10.379 1.00 0.00 C ATOM 3342 CG ASN A 211 19.967 -1.081 -11.761 1.00 0.00 C ATOM 3343 OD1 ASN A 211 19.867 -1.817 -12.736 1.00 0.00 O ATOM 3344 ND2 ASN A 211 20.128 0.212 -11.910 1.00 0.00 N ATOM 0 H ASN A 211 17.718 -0.195 -9.586 1.00 0.00 H new ATOM 0 HA ASN A 211 17.974 -2.670 -11.139 1.00 0.00 H new ATOM 0 HB2 ASN A 211 19.917 -0.877 -9.628 1.00 0.00 H new ATOM 0 HB3 ASN A 211 20.371 -2.475 -10.184 1.00 0.00 H new ATOM 0 HD21 ASN A 211 20.171 0.616 -12.846 1.00 0.00 H new ATOM 0 HD22 ASN A 211 20.210 0.814 -11.090 1.00 0.00 H new ATOM 3351 N ALA A 212 18.041 -2.630 -7.859 1.00 0.00 N ATOM 3352 CA ALA A 212 17.909 -3.414 -6.623 1.00 0.00 C ATOM 3353 C ALA A 212 16.447 -3.659 -6.218 1.00 0.00 C ATOM 3354 O ALA A 212 15.930 -4.720 -6.635 1.00 0.00 O ATOM 3355 CB ALA A 212 18.699 -2.684 -5.524 1.00 0.00 C ATOM 0 H ALA A 212 18.159 -1.635 -7.668 1.00 0.00 H new ATOM 0 HA ALA A 212 18.318 -4.411 -6.784 1.00 0.00 H new ATOM 0 HB1 ALA A 212 18.622 -3.241 -4.590 1.00 0.00 H new ATOM 0 HB2 ALA A 212 19.746 -2.610 -5.817 1.00 0.00 H new ATOM 0 HB3 ALA A 212 18.289 -1.684 -5.385 1.00 0.00 H new TER 3361 ALA A 212 HETATM 3362 N1 GSH A 301 6.713 -6.663 1.861 1.00 22.60 N HETATM 3363 CA1 GSH A 301 7.452 -5.454 2.437 1.00 22.33 C HETATM 3364 C1 GSH A 301 6.530 -4.357 2.956 1.00 21.95 C HETATM 3365 O11 GSH A 301 5.510 -4.141 2.344 1.00 20.30 O HETATM 3366 O12 GSH A 301 6.773 -3.867 4.036 1.00 17.97 O HETATM 3367 CB1 GSH A 301 8.529 -4.849 1.507 1.00 24.41 C HETATM 3368 CG1 GSH A 301 9.356 -3.772 2.257 1.00 24.79 C HETATM 3369 CD1 GSH A 301 10.518 -3.230 1.473 1.00 22.98 C HETATM 3370 OE1 GSH A 301 10.672 -3.389 0.283 1.00 24.40 O HETATM 3371 N2 GSH A 301 11.425 -2.565 2.194 1.00 26.71 N HETATM 3372 CA2 GSH A 301 12.719 -2.060 1.693 1.00 25.68 C HETATM 3373 C2 GSH A 301 13.811 -2.197 2.740 1.00 28.43 C HETATM 3374 O2 GSH A 301 13.595 -2.070 3.929 1.00 27.94 O HETATM 3375 CB2 GSH A 301 12.602 -0.588 1.255 1.00 29.25 C HETATM 3376 SG2 GSH A 301 10.889 -0.129 0.828 1.00 35.47 S HETATM 3377 N3 GSH A 301 15.053 -2.364 2.269 1.00 35.75 N HETATM 3378 CA3 GSH A 301 16.274 -2.479 3.099 1.00 36.79 C HETATM 3379 C3 GSH A 301 17.472 -1.718 2.561 1.00 41.12 C HETATM 3380 O31 GSH A 301 17.272 -0.833 1.753 1.00 43.80 O HETATM 3381 O32 GSH A 301 18.545 -1.944 3.082 1.00 45.58 O HETATM 0 HN12 GSH A 301 7.240 -7.452 1.487 1.00 22.60 H new HETATM 0 HN11 GSH A 301 5.693 -6.680 1.851 1.00 22.60 H new HETATM 0 HG13 GSH A 301 8.697 -2.946 2.526 1.00 24.79 H new HETATM 0 HG12 GSH A 301 9.728 -4.199 3.188 1.00 24.79 H new HETATM 0 HB23 GSH A 301 12.960 0.057 2.057 1.00 29.25 H new HETATM 0 HB22 GSH A 301 13.248 -0.415 0.394 1.00 29.25 H new HETATM 0 HB13 GSH A 301 9.190 -5.637 1.147 1.00 24.41 H new HETATM 0 HB12 GSH A 301 8.054 -4.406 0.632 1.00 24.41 H new HETATM 0 HA32 GSH A 301 16.051 -2.119 4.103 1.00 36.79 H new HETATM 0 HA31 GSH A 301 16.539 -3.532 3.190 1.00 36.79 H new HETATM 0 HN3 GSH A 301 15.168 -2.416 1.257 1.00 35.75 H new HETATM 0 HN2 GSH A 301 11.205 -2.391 3.175 1.00 26.71 H new HETATM 0 HA2 GSH A 301 12.990 -2.667 0.829 1.00 25.68 H new HETATM 0 HA1 GSH A 301 7.976 -5.883 3.291 1.00 22.33 H new