USER MOD reduce.3.24.130724 H: found=0, std=0, add=1150, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1152 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 30 GLN : amide:sc= -9.07! C(o=-10!,f=-13!) USER MOD Set 1.2: A 136 GLN :FLIP amide:sc= -1.35 F(o=-11!,f=-10) USER MOD Set 2.1: A 135 LYS NZ :NH3+ 143:sc= 1.94 (180deg=0) USER MOD Set 2.2: A 141 CYS SG : rot 87:sc= -0.0152 USER MOD Set 2.3: A 148 SER OG : rot 27:sc= 0.929 USER MOD Set 3.1: A 115 THR OG1 : rot 65:sc= 0.773 USER MOD Set 3.2: A 120 ASN :FLIP amide:sc= 0.524 F(o=-2,f=1.3) USER MOD Set 4.1: A 119 LYS NZ :NH3+ -123:sc= 1.22 (180deg=-1.04) USER MOD Set 4.2: A 121 TYR OH : rot 180:sc= 0.248 USER MOD Set 5.1: A 118 THR OG1 : rot 112:sc= 0.561 USER MOD Set 5.2: A 153 GLN : amide:sc= 0.291 K(o=0.85,f=-2.5!) USER MOD Set 6.1: A 100 LYS NZ :NH3+ 171:sc=-0.00749 (180deg=-0.0934) USER MOD Set 6.2: A 101 THR OG1 : rot 180:sc= 0 USER MOD Set 7.1: A 80 TYR OH : rot -130:sc= 0.795 USER MOD Set 7.2: A 82 THR OG1 : rot 180:sc= -3.79! USER MOD Set 7.3: A 108 ASN : amide:sc= 0.672 K(o=-2.3,f=-3.3) USER MOD Set 8.1: A 77 THR OG1 : rot 180:sc= -0.159 USER MOD Set 8.2: A 78 GLN :FLIP amide:sc= -1.17! C(o=-3.8!,f=-1.3!) USER MOD Set 9.1: A 13 ASN : amide:sc= 0.726 K(o=1.6,f=0.24) USER MOD Set 9.2: A 61 SER OG : rot 98:sc= 0.828 USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= -6.45! C(o=-6.5!,f=-12!) USER MOD Single : A 29 ASN : amide:sc=-0.00564 X(o=-0.0056,f=-0.11) USER MOD Single : A 31 SER OG : rot 5:sc= 1.07 USER MOD Single : A 36 ASN : amide:sc= 0.272 K(o=0.27,f=-5.6!) USER MOD Single : A 38 GLN :FLIP amide:sc= 0 F(o=-0.72,f=0) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot -67:sc= 0.932 USER MOD Single : A 46 HIS : no HD1:sc=-0.00641 X(o=-0.0064,f=0) USER MOD Single : A 47 ASN : amide:sc= -0.0868 X(o=-0.087,f=0) USER MOD Single : A 53 LYS NZ :NH3+ -140:sc= 1.27 (180deg=0.664) USER MOD Single : A 56 MET CE :methyl 160:sc= 0 (180deg=-0.193) USER MOD Single : A 59 TYR OH : rot 150:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ -141:sc= 1.24 (180deg=-0.108) USER MOD Single : A 69 THR OG1 : rot -150:sc= -1.65! USER MOD Single : A 75 SER OG : rot 180:sc= 0.0599 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= -0.753 K(o=-0.75,f=-2.8!) USER MOD Single : A 88 GLN : amide:sc= -1.75! C(o=-1.8!,f=-3.5!) USER MOD Single : A 93 LYS NZ :NH3+ 169:sc=-0.00718 (180deg=-0.153) USER MOD Single : A 95 MET CE :methyl 163:sc= -0.0954 (180deg=-0.524) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot -93:sc= 1.26 USER MOD Single : A 116 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 123 THR OG1 : rot -54:sc= 0.846 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 127 HIS :FLIP no HD1:sc= -0.475 F(o=-2.6!,f=-0.48) USER MOD Single : A 129 ASN :FLIP amide:sc= -4.15! C(o=-5.2!,f=-4.2!) USER MOD Single : A 134 THR OG1 : rot 7:sc= -2.68! USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 154:sc= 0.0484 USER MOD Single : A 157 ASN : amide:sc= -0.287 K(o=-0.29,f=-1.5!) USER MOD Single : A 158 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 76 N ASN A 13 16.472 -5.835 0.276 1.00 1.23 N ATOM 77 CA ASN A 13 15.756 -5.984 1.507 1.00 1.00 C ATOM 78 C ASN A 13 15.013 -7.299 1.571 1.00 0.86 C ATOM 79 O ASN A 13 13.958 -7.424 0.986 1.00 1.29 O ATOM 80 CB ASN A 13 14.798 -4.809 1.742 1.00 1.76 C ATOM 81 CG ASN A 13 15.480 -3.508 2.150 1.00 2.67 C ATOM 82 OD1 ASN A 13 16.594 -3.206 1.730 1.00 3.27 O ATOM 83 ND2 ASN A 13 14.804 -2.727 2.983 1.00 3.42 N ATOM 0 HA ASN A 13 16.497 -5.984 2.306 1.00 1.00 H new ATOM 0 HB2 ASN A 13 14.227 -4.634 0.830 1.00 1.76 H new ATOM 0 HB3 ASN A 13 14.084 -5.088 2.517 1.00 1.76 H new ATOM 0 HD21 ASN A 13 15.208 -1.844 3.295 1.00 3.42 H new ATOM 0 HD22 ASN A 13 13.881 -3.010 3.311 1.00 3.42 H new ATOM 90 N PHE A 14 15.547 -8.276 2.277 1.00 0.97 N ATOM 91 CA PHE A 14 14.759 -9.380 2.828 1.00 1.06 C ATOM 92 C PHE A 14 14.239 -9.073 4.239 1.00 0.93 C ATOM 93 O PHE A 14 15.042 -8.787 5.127 1.00 1.27 O ATOM 94 CB PHE A 14 15.584 -10.676 2.828 1.00 1.64 C ATOM 95 CG PHE A 14 16.916 -10.575 3.531 1.00 2.26 C ATOM 96 CD1 PHE A 14 18.012 -10.017 2.891 1.00 3.13 C ATOM 97 CD2 PHE A 14 17.068 -11.031 4.833 1.00 2.47 C ATOM 98 CE1 PHE A 14 19.230 -9.917 3.534 1.00 4.16 C ATOM 99 CE2 PHE A 14 18.284 -10.933 5.480 1.00 3.36 C ATOM 100 CZ PHE A 14 19.374 -10.402 4.820 1.00 4.21 C ATOM 0 H PHE A 14 16.543 -8.334 2.490 1.00 0.97 H new ATOM 0 HA PHE A 14 13.888 -9.511 2.186 1.00 1.06 H new ATOM 0 HB2 PHE A 14 14.998 -11.464 3.301 1.00 1.64 H new ATOM 0 HB3 PHE A 14 15.755 -10.982 1.796 1.00 1.64 H new ATOM 0 HD1 PHE A 14 17.912 -9.656 1.878 1.00 3.13 H new ATOM 0 HD2 PHE A 14 16.224 -11.468 5.347 1.00 2.47 H new ATOM 0 HE1 PHE A 14 20.070 -9.460 3.032 1.00 4.16 H new ATOM 0 HE2 PHE A 14 18.382 -11.271 6.501 1.00 3.36 H new ATOM 0 HZ PHE A 14 20.337 -10.366 5.308 1.00 4.21 H new ATOM 110 N MET A 15 12.929 -9.087 4.477 1.00 0.73 N ATOM 111 CA MET A 15 12.446 -9.238 5.851 1.00 0.74 C ATOM 112 C MET A 15 11.704 -10.556 6.026 1.00 0.70 C ATOM 113 O MET A 15 12.215 -11.508 6.614 1.00 0.79 O ATOM 114 CB MET A 15 11.556 -8.080 6.273 1.00 0.84 C ATOM 115 CG MET A 15 11.078 -8.161 7.719 1.00 1.48 C ATOM 116 SD MET A 15 12.417 -8.481 8.879 1.00 2.32 S ATOM 117 CE MET A 15 11.507 -8.575 10.418 1.00 2.91 C ATOM 0 H MET A 15 12.204 -8.999 3.765 1.00 0.73 H new ATOM 0 HA MET A 15 13.324 -9.237 6.496 1.00 0.74 H new ATOM 0 HB2 MET A 15 12.101 -7.146 6.133 1.00 0.84 H new ATOM 0 HB3 MET A 15 10.688 -8.044 5.615 1.00 0.84 H new ATOM 0 HG2 MET A 15 10.587 -7.226 7.987 1.00 1.48 H new ATOM 0 HG3 MET A 15 10.331 -8.950 7.806 1.00 1.48 H new ATOM 0 HE1 MET A 15 12.198 -8.770 11.238 1.00 2.91 H new ATOM 0 HE2 MET A 15 10.992 -7.631 10.594 1.00 2.91 H new ATOM 0 HE3 MET A 15 10.776 -9.382 10.360 1.00 2.91 H new ATOM 127 N ARG A 16 10.490 -10.583 5.479 1.00 0.61 N ATOM 128 CA ARG A 16 9.593 -11.725 5.580 1.00 0.61 C ATOM 129 C ARG A 16 8.392 -11.543 4.668 1.00 0.56 C ATOM 130 O ARG A 16 7.955 -10.420 4.411 1.00 0.52 O ATOM 131 CB ARG A 16 9.115 -11.918 7.027 1.00 0.63 C ATOM 132 CG ARG A 16 8.609 -10.655 7.723 1.00 0.72 C ATOM 133 CD ARG A 16 7.168 -10.341 7.371 1.00 1.06 C ATOM 134 NE ARG A 16 6.524 -9.505 8.386 1.00 1.64 N ATOM 135 CZ ARG A 16 5.377 -9.824 8.991 1.00 2.09 C ATOM 136 NH1 ARG A 16 4.792 -10.990 8.741 1.00 2.43 N ATOM 137 NH2 ARG A 16 4.826 -8.986 9.865 1.00 2.73 N ATOM 0 H ARG A 16 10.101 -9.803 4.949 1.00 0.61 H new ATOM 0 HA ARG A 16 10.146 -12.612 5.270 1.00 0.61 H new ATOM 0 HB2 ARG A 16 8.317 -12.660 7.032 1.00 0.63 H new ATOM 0 HB3 ARG A 16 9.937 -12.330 7.612 1.00 0.63 H new ATOM 0 HG2 ARG A 16 8.698 -10.777 8.802 1.00 0.72 H new ATOM 0 HG3 ARG A 16 9.241 -9.812 7.444 1.00 0.72 H new ATOM 0 HD2 ARG A 16 7.133 -9.833 6.407 1.00 1.06 H new ATOM 0 HD3 ARG A 16 6.611 -11.271 7.261 1.00 1.06 H new ATOM 0 HE ARG A 16 6.977 -8.629 8.646 1.00 1.64 H new ATOM 0 HH11 ARG A 16 5.219 -11.645 8.085 1.00 2.43 H new ATOM 0 HH12 ARG A 16 3.916 -11.231 9.205 1.00 2.43 H new ATOM 0 HH21 ARG A 16 5.280 -8.097 10.075 1.00 2.73 H new ATOM 0 HH22 ARG A 16 3.950 -9.233 10.325 1.00 2.73 H new ATOM 151 N ILE A 17 7.866 -12.646 4.181 1.00 0.62 N ATOM 152 CA ILE A 17 6.626 -12.625 3.430 1.00 0.61 C ATOM 153 C ILE A 17 5.425 -12.547 4.381 1.00 0.57 C ATOM 154 O ILE A 17 5.196 -13.434 5.206 1.00 0.64 O ATOM 155 CB ILE A 17 6.504 -13.849 2.488 1.00 0.73 C ATOM 156 CG1 ILE A 17 5.164 -13.818 1.743 1.00 1.68 C ATOM 157 CG2 ILE A 17 6.671 -15.153 3.257 1.00 1.41 C ATOM 158 CD1 ILE A 17 5.021 -14.905 0.701 1.00 2.26 C ATOM 0 H ILE A 17 8.278 -13.572 4.291 1.00 0.62 H new ATOM 0 HA ILE A 17 6.634 -11.733 2.803 1.00 0.61 H new ATOM 0 HB ILE A 17 7.307 -13.795 1.753 1.00 0.73 H new ATOM 0 HG12 ILE A 17 4.354 -13.912 2.466 1.00 1.68 H new ATOM 0 HG13 ILE A 17 5.049 -12.847 1.260 1.00 1.68 H new ATOM 0 HG21 ILE A 17 6.581 -15.995 2.570 1.00 1.41 H new ATOM 0 HG22 ILE A 17 7.653 -15.174 3.729 1.00 1.41 H new ATOM 0 HG23 ILE A 17 5.899 -15.225 4.023 1.00 1.41 H new ATOM 0 HD11 ILE A 17 4.048 -14.819 0.216 1.00 2.26 H new ATOM 0 HD12 ILE A 17 5.809 -14.800 -0.045 1.00 2.26 H new ATOM 0 HD13 ILE A 17 5.103 -15.881 1.180 1.00 2.26 H new ATOM 170 N ILE A 18 4.692 -11.447 4.285 1.00 0.49 N ATOM 171 CA ILE A 18 3.502 -11.224 5.105 1.00 0.48 C ATOM 172 C ILE A 18 2.256 -11.827 4.436 1.00 0.48 C ATOM 173 O ILE A 18 2.286 -12.965 3.968 1.00 0.52 O ATOM 174 CB ILE A 18 3.252 -9.715 5.379 1.00 0.44 C ATOM 175 CG1 ILE A 18 4.567 -8.973 5.611 1.00 0.44 C ATOM 176 CG2 ILE A 18 2.345 -9.535 6.596 1.00 0.50 C ATOM 177 CD1 ILE A 18 4.380 -7.504 5.921 1.00 0.94 C ATOM 0 H ILE A 18 4.901 -10.685 3.640 1.00 0.49 H new ATOM 0 HA ILE A 18 3.685 -11.720 6.058 1.00 0.48 H new ATOM 0 HB ILE A 18 2.764 -9.296 4.499 1.00 0.44 H new ATOM 0 HG12 ILE A 18 5.102 -9.446 6.435 1.00 0.44 H new ATOM 0 HG13 ILE A 18 5.194 -9.073 4.725 1.00 0.44 H new ATOM 0 HG21 ILE A 18 2.181 -8.472 6.773 1.00 0.50 H new ATOM 0 HG22 ILE A 18 1.389 -10.024 6.413 1.00 0.50 H new ATOM 0 HG23 ILE A 18 2.818 -9.980 7.471 1.00 0.50 H new ATOM 0 HD11 ILE A 18 5.353 -7.038 6.075 1.00 0.94 H new ATOM 0 HD12 ILE A 18 3.872 -7.018 5.088 1.00 0.94 H new ATOM 0 HD13 ILE A 18 3.779 -7.396 6.824 1.00 0.94 H new ATOM 189 N LYS A 19 1.172 -11.063 4.391 1.00 0.45 N ATOM 190 CA LYS A 19 -0.125 -11.592 3.996 1.00 0.46 C ATOM 191 C LYS A 19 -0.505 -11.137 2.593 1.00 0.42 C ATOM 192 O LYS A 19 0.015 -10.140 2.093 1.00 0.49 O ATOM 193 CB LYS A 19 -1.191 -11.169 5.008 1.00 0.54 C ATOM 194 CG LYS A 19 -0.941 -11.722 6.401 1.00 1.13 C ATOM 195 CD LYS A 19 -2.027 -11.314 7.382 1.00 1.85 C ATOM 196 CE LYS A 19 -1.783 -11.941 8.745 1.00 2.57 C ATOM 197 NZ LYS A 19 -2.822 -11.564 9.739 1.00 2.68 N ATOM 0 H LYS A 19 1.167 -10.070 4.625 1.00 0.45 H new ATOM 0 HA LYS A 19 -0.061 -12.680 3.982 1.00 0.46 H new ATOM 0 HB2 LYS A 19 -1.226 -10.081 5.056 1.00 0.54 H new ATOM 0 HB3 LYS A 19 -2.168 -11.505 4.660 1.00 0.54 H new ATOM 0 HG2 LYS A 19 -0.886 -12.810 6.354 1.00 1.13 H new ATOM 0 HG3 LYS A 19 0.025 -11.369 6.763 1.00 1.13 H new ATOM 0 HD2 LYS A 19 -2.051 -10.228 7.475 1.00 1.85 H new ATOM 0 HD3 LYS A 19 -3.001 -11.623 7.003 1.00 1.85 H new ATOM 0 HE2 LYS A 19 -1.759 -13.026 8.643 1.00 2.57 H new ATOM 0 HE3 LYS A 19 -0.804 -11.633 9.113 1.00 2.57 H new ATOM 0 HZ1 LYS A 19 -2.610 -12.017 10.651 1.00 2.68 H new ATOM 0 HZ2 LYS A 19 -2.829 -10.531 9.859 1.00 2.68 H new ATOM 0 HZ3 LYS A 19 -3.754 -11.880 9.404 1.00 2.68 H new ATOM 211 N TYR A 20 -1.425 -11.870 1.980 1.00 0.37 N ATOM 212 CA TYR A 20 -1.763 -11.687 0.573 1.00 0.41 C ATOM 213 C TYR A 20 -3.195 -12.115 0.297 1.00 0.31 C ATOM 214 O TYR A 20 -3.781 -12.870 1.076 1.00 0.33 O ATOM 215 CB TYR A 20 -0.776 -12.489 -0.292 1.00 0.67 C ATOM 216 CG TYR A 20 -0.557 -13.923 0.157 1.00 1.13 C ATOM 217 CD1 TYR A 20 -1.349 -14.957 -0.326 1.00 1.34 C ATOM 218 CD2 TYR A 20 0.455 -14.239 1.055 1.00 1.45 C ATOM 219 CE1 TYR A 20 -1.139 -16.264 0.076 1.00 1.82 C ATOM 220 CE2 TYR A 20 0.671 -15.541 1.462 1.00 1.93 C ATOM 221 CZ TYR A 20 -0.128 -16.551 0.970 1.00 2.10 C ATOM 222 OH TYR A 20 0.084 -17.851 1.378 1.00 2.59 O ATOM 0 H TYR A 20 -1.958 -12.607 2.442 1.00 0.37 H new ATOM 0 HA TYR A 20 -1.685 -10.629 0.322 1.00 0.41 H new ATOM 0 HB2 TYR A 20 -1.138 -12.496 -1.320 1.00 0.67 H new ATOM 0 HB3 TYR A 20 0.184 -11.973 -0.296 1.00 0.67 H new ATOM 0 HD1 TYR A 20 -2.141 -14.737 -1.026 1.00 1.34 H new ATOM 0 HD2 TYR A 20 1.085 -13.452 1.442 1.00 1.45 H new ATOM 0 HE1 TYR A 20 -1.764 -17.057 -0.308 1.00 1.82 H new ATOM 0 HE2 TYR A 20 1.462 -15.767 2.162 1.00 1.93 H new ATOM 0 HH TYR A 20 0.835 -17.878 2.007 1.00 2.59 H new ATOM 232 N GLU A 21 -3.742 -11.621 -0.818 1.00 0.33 N ATOM 233 CA GLU A 21 -5.126 -11.902 -1.211 1.00 0.32 C ATOM 234 C GLU A 21 -6.108 -11.457 -0.147 1.00 0.28 C ATOM 235 O GLU A 21 -7.127 -12.108 0.100 1.00 0.30 O ATOM 236 CB GLU A 21 -5.311 -13.397 -1.480 1.00 0.35 C ATOM 237 CG GLU A 21 -4.816 -13.875 -2.838 1.00 0.98 C ATOM 238 CD GLU A 21 -5.847 -13.685 -3.934 1.00 1.16 C ATOM 239 OE1 GLU A 21 -6.946 -14.278 -3.835 1.00 1.73 O ATOM 240 OE2 GLU A 21 -5.562 -12.968 -4.913 1.00 1.53 O ATOM 0 H GLU A 21 -3.241 -11.018 -1.470 1.00 0.33 H new ATOM 0 HA GLU A 21 -5.327 -11.338 -2.122 1.00 0.32 H new ATOM 0 HB2 GLU A 21 -4.791 -13.957 -0.703 1.00 0.35 H new ATOM 0 HB3 GLU A 21 -6.370 -13.638 -1.391 1.00 0.35 H new ATOM 0 HG2 GLU A 21 -3.908 -13.333 -3.101 1.00 0.98 H new ATOM 0 HG3 GLU A 21 -4.550 -14.930 -2.773 1.00 0.98 H new ATOM 247 N PHE A 22 -5.805 -10.342 0.467 1.00 0.26 N ATOM 248 CA PHE A 22 -6.692 -9.745 1.423 1.00 0.26 C ATOM 249 C PHE A 22 -7.345 -8.577 0.754 1.00 0.24 C ATOM 250 O PHE A 22 -6.808 -8.020 -0.206 1.00 0.27 O ATOM 251 CB PHE A 22 -5.944 -9.306 2.681 1.00 0.32 C ATOM 252 CG PHE A 22 -5.734 -10.422 3.662 1.00 1.08 C ATOM 253 CD1 PHE A 22 -6.702 -10.707 4.611 1.00 1.98 C ATOM 254 CD2 PHE A 22 -4.584 -11.190 3.631 1.00 1.15 C ATOM 255 CE1 PHE A 22 -6.524 -11.736 5.513 1.00 2.89 C ATOM 256 CE2 PHE A 22 -4.402 -12.224 4.530 1.00 2.05 C ATOM 257 CZ PHE A 22 -5.373 -12.496 5.473 1.00 2.92 C ATOM 0 H PHE A 22 -4.938 -9.826 0.317 1.00 0.26 H new ATOM 0 HA PHE A 22 -7.439 -10.470 1.746 1.00 0.26 H new ATOM 0 HB2 PHE A 22 -4.976 -8.895 2.396 1.00 0.32 H new ATOM 0 HB3 PHE A 22 -6.501 -8.504 3.166 1.00 0.32 H new ATOM 0 HD1 PHE A 22 -7.606 -10.117 4.645 1.00 1.98 H new ATOM 0 HD2 PHE A 22 -3.820 -10.980 2.897 1.00 1.15 H new ATOM 0 HE1 PHE A 22 -7.285 -11.946 6.250 1.00 2.89 H new ATOM 0 HE2 PHE A 22 -3.501 -12.819 4.495 1.00 2.05 H new ATOM 0 HZ PHE A 22 -5.232 -13.302 6.178 1.00 2.92 H new ATOM 267 N ILE A 23 -8.476 -8.188 1.254 1.00 0.22 N ATOM 268 CA ILE A 23 -9.205 -7.126 0.640 1.00 0.21 C ATOM 269 C ILE A 23 -8.944 -5.872 1.398 1.00 0.19 C ATOM 270 O ILE A 23 -8.988 -5.842 2.622 1.00 0.22 O ATOM 271 CB ILE A 23 -10.708 -7.388 0.622 1.00 0.28 C ATOM 272 CG1 ILE A 23 -10.987 -8.770 0.031 1.00 0.36 C ATOM 273 CG2 ILE A 23 -11.412 -6.298 -0.172 1.00 0.36 C ATOM 274 CD1 ILE A 23 -10.472 -8.942 -1.382 1.00 0.84 C ATOM 0 H ILE A 23 -8.913 -8.589 2.084 1.00 0.22 H new ATOM 0 HA ILE A 23 -8.872 -7.044 -0.395 1.00 0.21 H new ATOM 0 HB ILE A 23 -11.094 -7.370 1.641 1.00 0.28 H new ATOM 0 HG12 ILE A 23 -10.531 -9.527 0.669 1.00 0.36 H new ATOM 0 HG13 ILE A 23 -12.062 -8.950 0.041 1.00 0.36 H new ATOM 0 HG21 ILE A 23 -12.485 -6.490 -0.182 1.00 0.36 H new ATOM 0 HG22 ILE A 23 -11.221 -5.330 0.291 1.00 0.36 H new ATOM 0 HG23 ILE A 23 -11.035 -6.292 -1.195 1.00 0.36 H new ATOM 0 HD11 ILE A 23 -10.706 -9.946 -1.735 1.00 0.84 H new ATOM 0 HD12 ILE A 23 -10.946 -8.209 -2.034 1.00 0.84 H new ATOM 0 HD13 ILE A 23 -9.392 -8.795 -1.396 1.00 0.84 H new ATOM 286 N LEU A 24 -8.647 -4.847 0.672 1.00 0.18 N ATOM 287 CA LEU A 24 -8.239 -3.618 1.306 1.00 0.19 C ATOM 288 C LEU A 24 -9.381 -2.630 1.404 1.00 0.20 C ATOM 289 O LEU A 24 -9.945 -2.219 0.401 1.00 0.23 O ATOM 290 CB LEU A 24 -7.072 -2.995 0.550 1.00 0.23 C ATOM 291 CG LEU A 24 -5.845 -2.764 1.414 1.00 0.53 C ATOM 292 CD1 LEU A 24 -5.244 -4.093 1.842 1.00 1.32 C ATOM 293 CD2 LEU A 24 -4.816 -1.913 0.693 1.00 1.41 C ATOM 0 H LEU A 24 -8.675 -4.824 -0.347 1.00 0.18 H new ATOM 0 HA LEU A 24 -7.923 -3.862 2.320 1.00 0.19 H new ATOM 0 HB2 LEU A 24 -6.802 -3.643 -0.284 1.00 0.23 H new ATOM 0 HB3 LEU A 24 -7.391 -2.044 0.125 1.00 0.23 H new ATOM 0 HG LEU A 24 -6.155 -2.219 2.306 1.00 0.53 H new ATOM 0 HD11 LEU A 24 -4.365 -3.912 2.461 1.00 1.32 H new ATOM 0 HD12 LEU A 24 -5.980 -4.658 2.414 1.00 1.32 H new ATOM 0 HD13 LEU A 24 -4.955 -4.663 0.959 1.00 1.32 H new ATOM 0 HD21 LEU A 24 -3.950 -1.766 1.338 1.00 1.41 H new ATOM 0 HD22 LEU A 24 -4.505 -2.416 -0.223 1.00 1.41 H new ATOM 0 HD23 LEU A 24 -5.253 -0.946 0.446 1.00 1.41 H new ATOM 305 N ASN A 25 -9.683 -2.255 2.638 1.00 0.19 N ATOM 306 CA ASN A 25 -10.657 -1.216 2.950 1.00 0.19 C ATOM 307 C ASN A 25 -10.047 -0.303 3.968 1.00 0.18 C ATOM 308 O ASN A 25 -9.316 -0.747 4.819 1.00 0.22 O ATOM 309 CB ASN A 25 -11.954 -1.775 3.557 1.00 0.29 C ATOM 310 CG ASN A 25 -12.747 -2.683 2.643 1.00 0.92 C ATOM 311 OD1 ASN A 25 -12.199 -3.471 1.882 1.00 1.74 O ATOM 312 ND2 ASN A 25 -14.063 -2.571 2.711 1.00 1.72 N ATOM 0 H ASN A 25 -9.252 -2.670 3.465 1.00 0.19 H new ATOM 0 HA ASN A 25 -10.908 -0.711 2.017 1.00 0.19 H new ATOM 0 HB2 ASN A 25 -11.705 -2.325 4.465 1.00 0.29 H new ATOM 0 HB3 ASN A 25 -12.588 -0.940 3.854 1.00 0.29 H new ATOM 0 HD21 ASN A 25 -14.656 -3.152 2.118 1.00 1.72 H new ATOM 0 HD22 ASN A 25 -14.485 -1.904 3.357 1.00 1.72 H new ATOM 319 N ASP A 26 -10.370 0.954 3.901 1.00 0.16 N ATOM 320 CA ASP A 26 -9.940 1.894 4.897 1.00 0.17 C ATOM 321 C ASP A 26 -10.958 1.998 6.016 1.00 0.18 C ATOM 322 O ASP A 26 -11.933 1.252 6.072 1.00 0.20 O ATOM 323 CB ASP A 26 -9.870 3.269 4.247 1.00 0.19 C ATOM 324 CG ASP A 26 -10.841 3.421 3.096 1.00 0.40 C ATOM 325 OD1 ASP A 26 -12.058 3.339 3.293 1.00 0.66 O ATOM 326 OD2 ASP A 26 -10.365 3.647 1.982 1.00 1.04 O ATOM 0 H ASP A 26 -10.938 1.358 3.156 1.00 0.16 H new ATOM 0 HA ASP A 26 -8.980 1.565 5.294 1.00 0.17 H new ATOM 0 HB2 ASP A 26 -10.079 4.032 4.997 1.00 0.19 H new ATOM 0 HB3 ASP A 26 -8.856 3.445 3.887 1.00 0.19 H new ATOM 331 N ALA A 27 -10.663 2.882 6.950 1.00 0.21 N ATOM 332 CA ALA A 27 -11.573 3.228 8.027 1.00 0.25 C ATOM 333 C ALA A 27 -12.743 4.004 7.471 1.00 0.24 C ATOM 334 O ALA A 27 -13.775 4.146 8.124 1.00 0.28 O ATOM 335 CB ALA A 27 -10.873 4.042 9.097 1.00 0.32 C ATOM 0 H ALA A 27 -9.777 3.385 6.983 1.00 0.21 H new ATOM 0 HA ALA A 27 -11.929 2.306 8.486 1.00 0.25 H new ATOM 0 HB1 ALA A 27 -11.580 4.286 9.890 1.00 0.32 H new ATOM 0 HB2 ALA A 27 -10.048 3.464 9.512 1.00 0.32 H new ATOM 0 HB3 ALA A 27 -10.487 4.963 8.659 1.00 0.32 H new ATOM 341 N LEU A 28 -12.567 4.520 6.260 1.00 0.21 N ATOM 342 CA LEU A 28 -13.694 5.113 5.534 1.00 0.24 C ATOM 343 C LEU A 28 -14.580 3.989 5.043 1.00 0.23 C ATOM 344 O LEU A 28 -15.757 4.163 4.723 1.00 0.29 O ATOM 345 CB LEU A 28 -13.228 5.978 4.355 1.00 0.25 C ATOM 346 CG LEU A 28 -12.462 7.220 4.742 1.00 0.31 C ATOM 347 CD1 LEU A 28 -12.057 7.995 3.500 1.00 0.48 C ATOM 348 CD2 LEU A 28 -13.305 8.086 5.671 1.00 0.48 C ATOM 0 H LEU A 28 -11.676 4.543 5.765 1.00 0.21 H new ATOM 0 HA LEU A 28 -14.243 5.771 6.208 1.00 0.24 H new ATOM 0 HB2 LEU A 28 -12.601 5.370 3.703 1.00 0.25 H new ATOM 0 HB3 LEU A 28 -14.101 6.274 3.773 1.00 0.25 H new ATOM 0 HG LEU A 28 -11.556 6.928 5.272 1.00 0.31 H new ATOM 0 HD11 LEU A 28 -11.505 8.888 3.792 1.00 0.48 H new ATOM 0 HD12 LEU A 28 -11.426 7.369 2.870 1.00 0.48 H new ATOM 0 HD13 LEU A 28 -12.949 8.285 2.945 1.00 0.48 H new ATOM 0 HD21 LEU A 28 -12.744 8.979 5.945 1.00 0.48 H new ATOM 0 HD22 LEU A 28 -14.224 8.377 5.163 1.00 0.48 H new ATOM 0 HD23 LEU A 28 -13.550 7.522 6.571 1.00 0.48 H new ATOM 360 N ASN A 29 -13.948 2.829 5.053 1.00 0.20 N ATOM 361 CA ASN A 29 -14.471 1.573 4.565 1.00 0.23 C ATOM 362 C ASN A 29 -14.866 1.713 3.128 1.00 0.24 C ATOM 363 O ASN A 29 -16.045 1.645 2.780 1.00 0.28 O ATOM 364 CB ASN A 29 -15.699 1.107 5.330 1.00 0.29 C ATOM 365 CG ASN A 29 -15.640 1.383 6.824 1.00 0.60 C ATOM 366 OD1 ASN A 29 -16.118 2.413 7.301 1.00 1.32 O ATOM 367 ND2 ASN A 29 -15.065 0.454 7.576 1.00 1.30 N ATOM 0 H ASN A 29 -13.002 2.737 5.424 1.00 0.20 H new ATOM 0 HA ASN A 29 -13.676 0.839 4.698 1.00 0.23 H new ATOM 0 HB2 ASN A 29 -16.580 1.597 4.915 1.00 0.29 H new ATOM 0 HB3 ASN A 29 -15.827 0.036 5.174 1.00 0.29 H new ATOM 0 HD21 ASN A 29 -15.007 0.580 8.587 1.00 1.30 H new ATOM 0 HD22 ASN A 29 -14.680 -0.386 7.144 1.00 1.30 H new ATOM 374 N GLN A 30 -13.885 1.846 2.285 1.00 0.23 N ATOM 375 CA GLN A 30 -14.093 1.653 0.894 1.00 0.24 C ATOM 376 C GLN A 30 -13.002 0.766 0.417 1.00 0.22 C ATOM 377 O GLN A 30 -11.828 1.105 0.511 1.00 0.28 O ATOM 378 CB GLN A 30 -14.094 2.968 0.119 1.00 0.36 C ATOM 379 CG GLN A 30 -13.637 4.157 0.924 1.00 0.98 C ATOM 380 CD GLN A 30 -14.784 4.912 1.544 1.00 1.41 C ATOM 381 OE1 GLN A 30 -14.672 6.084 1.790 1.00 2.21 O ATOM 382 NE2 GLN A 30 -15.903 4.255 1.788 1.00 1.84 N ATOM 0 H GLN A 30 -12.929 2.089 2.546 1.00 0.23 H new ATOM 0 HA GLN A 30 -15.074 1.208 0.726 1.00 0.24 H new ATOM 0 HB2 GLN A 30 -13.449 2.864 -0.753 1.00 0.36 H new ATOM 0 HB3 GLN A 30 -15.101 3.159 -0.251 1.00 0.36 H new ATOM 0 HG2 GLN A 30 -12.961 3.821 1.710 1.00 0.98 H new ATOM 0 HG3 GLN A 30 -13.069 4.830 0.281 1.00 0.98 H new ATOM 0 HE21 GLN A 30 -15.969 3.261 1.569 1.00 1.84 H new ATOM 0 HE22 GLN A 30 -16.702 4.741 2.196 1.00 1.84 H new ATOM 391 N SER A 31 -13.373 -0.390 -0.052 1.00 0.23 N ATOM 392 CA SER A 31 -12.394 -1.284 -0.539 1.00 0.26 C ATOM 393 C SER A 31 -11.781 -0.649 -1.774 1.00 0.21 C ATOM 394 O SER A 31 -12.478 -0.329 -2.739 1.00 0.21 O ATOM 395 CB SER A 31 -13.053 -2.623 -0.825 1.00 0.36 C ATOM 396 OG SER A 31 -14.178 -2.482 -1.673 1.00 1.23 O ATOM 0 H SER A 31 -14.336 -0.722 -0.103 1.00 0.23 H new ATOM 0 HA SER A 31 -11.599 -1.471 0.183 1.00 0.26 H new ATOM 0 HB2 SER A 31 -12.329 -3.293 -1.289 1.00 0.36 H new ATOM 0 HB3 SER A 31 -13.360 -3.085 0.113 1.00 0.36 H new ATOM 0 HG SER A 31 -14.254 -1.549 -1.963 1.00 1.23 H new ATOM 402 N ILE A 32 -10.485 -0.432 -1.720 1.00 0.21 N ATOM 403 CA ILE A 32 -9.821 0.330 -2.744 1.00 0.20 C ATOM 404 C ILE A 32 -9.579 -0.525 -3.994 1.00 0.21 C ATOM 405 O ILE A 32 -8.697 -1.378 -4.024 1.00 0.24 O ATOM 406 CB ILE A 32 -8.506 0.971 -2.237 1.00 0.24 C ATOM 407 CG1 ILE A 32 -7.503 -0.082 -1.767 1.00 1.11 C ATOM 408 CG2 ILE A 32 -8.810 1.932 -1.102 1.00 1.23 C ATOM 409 CD1 ILE A 32 -6.167 0.502 -1.362 1.00 1.72 C ATOM 0 H ILE A 32 -9.875 -0.774 -0.978 1.00 0.21 H new ATOM 0 HA ILE A 32 -10.486 1.150 -3.017 1.00 0.20 H new ATOM 0 HB ILE A 32 -8.055 1.509 -3.071 1.00 0.24 H new ATOM 0 HG12 ILE A 32 -7.926 -0.624 -0.921 1.00 1.11 H new ATOM 0 HG13 ILE A 32 -7.347 -0.807 -2.566 1.00 1.11 H new ATOM 0 HG21 ILE A 32 -7.882 2.381 -0.747 1.00 1.23 H new ATOM 0 HG22 ILE A 32 -9.480 2.715 -1.458 1.00 1.23 H new ATOM 0 HG23 ILE A 32 -9.286 1.391 -0.285 1.00 1.23 H new ATOM 0 HD11 ILE A 32 -5.502 -0.299 -1.039 1.00 1.72 H new ATOM 0 HD12 ILE A 32 -5.724 1.020 -2.212 1.00 1.72 H new ATOM 0 HD13 ILE A 32 -6.311 1.206 -0.543 1.00 1.72 H new ATOM 421 N ILE A 33 -10.404 -0.324 -5.005 1.00 0.21 N ATOM 422 CA ILE A 33 -10.346 -1.134 -6.219 1.00 0.24 C ATOM 423 C ILE A 33 -9.587 -0.382 -7.312 1.00 0.24 C ATOM 424 O ILE A 33 -9.526 0.850 -7.306 1.00 0.24 O ATOM 425 CB ILE A 33 -11.770 -1.455 -6.737 1.00 0.28 C ATOM 426 CG1 ILE A 33 -12.689 -1.840 -5.574 1.00 0.80 C ATOM 427 CG2 ILE A 33 -11.725 -2.579 -7.766 1.00 0.77 C ATOM 428 CD1 ILE A 33 -14.125 -2.088 -5.984 1.00 0.91 C ATOM 0 H ILE A 33 -11.127 0.395 -5.014 1.00 0.21 H new ATOM 0 HA ILE A 33 -9.833 -2.065 -5.977 1.00 0.24 H new ATOM 0 HB ILE A 33 -12.169 -0.561 -7.216 1.00 0.28 H new ATOM 0 HG12 ILE A 33 -12.297 -2.738 -5.096 1.00 0.80 H new ATOM 0 HG13 ILE A 33 -12.666 -1.046 -4.828 1.00 0.80 H new ATOM 0 HG21 ILE A 33 -12.735 -2.790 -8.118 1.00 0.77 H new ATOM 0 HG22 ILE A 33 -11.103 -2.277 -8.608 1.00 0.77 H new ATOM 0 HG23 ILE A 33 -11.305 -3.475 -7.308 1.00 0.77 H new ATOM 0 HD11 ILE A 33 -14.713 -2.356 -5.106 1.00 0.91 H new ATOM 0 HD12 ILE A 33 -14.536 -1.185 -6.434 1.00 0.91 H new ATOM 0 HD13 ILE A 33 -14.161 -2.903 -6.707 1.00 0.91 H new ATOM 440 N ARG A 34 -9.008 -1.121 -8.244 1.00 0.31 N ATOM 441 CA ARG A 34 -8.301 -0.523 -9.362 1.00 0.35 C ATOM 442 C ARG A 34 -9.307 -0.003 -10.376 1.00 0.36 C ATOM 443 O ARG A 34 -10.043 -0.774 -10.989 1.00 0.42 O ATOM 444 CB ARG A 34 -7.355 -1.561 -9.994 1.00 0.48 C ATOM 445 CG ARG A 34 -6.582 -1.067 -11.212 1.00 1.04 C ATOM 446 CD ARG A 34 -7.342 -1.330 -12.506 1.00 1.16 C ATOM 447 NE ARG A 34 -7.594 -2.755 -12.708 1.00 1.48 N ATOM 448 CZ ARG A 34 -8.529 -3.246 -13.520 1.00 1.79 C ATOM 449 NH1 ARG A 34 -9.340 -2.435 -14.190 1.00 2.09 N ATOM 450 NH2 ARG A 34 -8.662 -4.559 -13.651 1.00 2.47 N ATOM 0 H ARG A 34 -9.015 -2.141 -8.247 1.00 0.31 H new ATOM 0 HA ARG A 34 -7.698 0.316 -9.015 1.00 0.35 H new ATOM 0 HB2 ARG A 34 -6.642 -1.889 -9.238 1.00 0.48 H new ATOM 0 HB3 ARG A 34 -7.939 -2.435 -10.282 1.00 0.48 H new ATOM 0 HG2 ARG A 34 -6.391 0.002 -11.113 1.00 1.04 H new ATOM 0 HG3 ARG A 34 -5.612 -1.562 -11.253 1.00 1.04 H new ATOM 0 HD2 ARG A 34 -8.290 -0.793 -12.486 1.00 1.16 H new ATOM 0 HD3 ARG A 34 -6.771 -0.939 -13.348 1.00 1.16 H new ATOM 0 HE ARG A 34 -7.015 -3.418 -12.193 1.00 1.48 H new ATOM 0 HH11 ARG A 34 -9.251 -1.424 -14.086 1.00 2.09 H new ATOM 0 HH12 ARG A 34 -10.052 -2.823 -14.809 1.00 2.09 H new ATOM 0 HH21 ARG A 34 -8.050 -5.188 -13.131 1.00 2.47 H new ATOM 0 HH22 ARG A 34 -9.376 -4.940 -14.271 1.00 2.47 H new ATOM 464 N ALA A 35 -9.346 1.310 -10.528 1.00 0.37 N ATOM 465 CA ALA A 35 -10.246 1.937 -11.476 1.00 0.46 C ATOM 466 C ALA A 35 -9.526 2.111 -12.792 1.00 0.53 C ATOM 467 O ALA A 35 -10.099 1.979 -13.870 1.00 0.63 O ATOM 468 CB ALA A 35 -10.731 3.275 -10.943 1.00 0.54 C ATOM 0 H ALA A 35 -8.762 1.962 -10.005 1.00 0.37 H new ATOM 0 HA ALA A 35 -11.121 1.304 -11.626 1.00 0.46 H new ATOM 0 HB1 ALA A 35 -11.406 3.732 -11.667 1.00 0.54 H new ATOM 0 HB2 ALA A 35 -11.259 3.122 -10.002 1.00 0.54 H new ATOM 0 HB3 ALA A 35 -9.877 3.932 -10.778 1.00 0.54 H new ATOM 474 N ASN A 36 -8.244 2.386 -12.673 1.00 0.53 N ATOM 475 CA ASN A 36 -7.374 2.548 -13.814 1.00 0.66 C ATOM 476 C ASN A 36 -6.031 1.934 -13.461 1.00 0.65 C ATOM 477 O ASN A 36 -5.732 1.741 -12.285 1.00 0.55 O ATOM 478 CB ASN A 36 -7.223 4.040 -14.125 1.00 0.76 C ATOM 479 CG ASN A 36 -6.382 4.314 -15.354 1.00 1.43 C ATOM 480 OD1 ASN A 36 -5.162 4.410 -15.272 1.00 2.25 O ATOM 481 ND2 ASN A 36 -7.029 4.472 -16.493 1.00 1.93 N ATOM 0 H ASN A 36 -7.775 2.504 -11.775 1.00 0.53 H new ATOM 0 HA ASN A 36 -7.784 2.056 -14.696 1.00 0.66 H new ATOM 0 HB2 ASN A 36 -8.212 4.477 -14.265 1.00 0.76 H new ATOM 0 HB3 ASN A 36 -6.773 4.539 -13.267 1.00 0.76 H new ATOM 0 HD21 ASN A 36 -6.513 4.682 -17.348 1.00 1.93 H new ATOM 0 HD22 ASN A 36 -8.045 4.384 -16.519 1.00 1.93 H new ATOM 488 N ASP A 37 -5.228 1.625 -14.463 1.00 0.81 N ATOM 489 CA ASP A 37 -3.944 0.975 -14.232 1.00 0.88 C ATOM 490 C ASP A 37 -2.919 1.951 -13.661 1.00 0.79 C ATOM 491 O ASP A 37 -1.783 1.569 -13.391 1.00 0.88 O ATOM 492 CB ASP A 37 -3.413 0.322 -15.515 1.00 1.10 C ATOM 493 CG ASP A 37 -3.046 1.325 -16.592 1.00 1.76 C ATOM 494 OD1 ASP A 37 -3.966 1.908 -17.202 1.00 2.10 O ATOM 495 OD2 ASP A 37 -1.841 1.510 -16.854 1.00 2.51 O ATOM 0 H ASP A 37 -5.439 1.812 -15.443 1.00 0.81 H new ATOM 0 HA ASP A 37 -4.107 0.190 -13.494 1.00 0.88 H new ATOM 0 HB2 ASP A 37 -2.536 -0.278 -15.273 1.00 1.10 H new ATOM 0 HB3 ASP A 37 -4.168 -0.361 -15.906 1.00 1.10 H new ATOM 500 N GLN A 38 -3.308 3.211 -13.493 1.00 0.68 N ATOM 501 CA GLN A 38 -2.397 4.198 -12.924 1.00 0.60 C ATOM 502 C GLN A 38 -2.961 4.838 -11.649 1.00 0.44 C ATOM 503 O GLN A 38 -2.197 5.288 -10.792 1.00 0.39 O ATOM 504 CB GLN A 38 -2.051 5.275 -13.955 1.00 0.71 C ATOM 505 CG GLN A 38 -1.023 6.282 -13.455 1.00 1.53 C ATOM 506 CD GLN A 38 -0.582 7.268 -14.517 1.00 2.01 C ATOM 507 OE1 GLN A 38 -1.463 7.576 -15.454 1.00 2.57 O flip ATOM 508 NE2 GLN A 38 0.548 7.757 -14.492 1.00 2.58 N flip ATOM 0 H GLN A 38 -4.231 3.569 -13.738 1.00 0.68 H new ATOM 0 HA GLN A 38 -1.485 3.669 -12.647 1.00 0.60 H new ATOM 0 HB2 GLN A 38 -1.670 4.795 -14.857 1.00 0.71 H new ATOM 0 HB3 GLN A 38 -2.961 5.805 -14.236 1.00 0.71 H new ATOM 0 HG2 GLN A 38 -1.443 6.831 -12.612 1.00 1.53 H new ATOM 0 HG3 GLN A 38 -0.150 5.745 -13.083 1.00 1.53 H new ATOM 0 HE21 GLN A 38 1.201 7.495 -13.753 1.00 2.58 H new ATOM 0 HE22 GLN A 38 0.831 8.424 -15.210 1.00 2.58 H new ATOM 517 N TYR A 39 -4.285 4.899 -11.515 1.00 0.43 N ATOM 518 CA TYR A 39 -4.880 5.427 -10.291 1.00 0.41 C ATOM 519 C TYR A 39 -5.918 4.479 -9.697 1.00 0.34 C ATOM 520 O TYR A 39 -6.542 3.685 -10.403 1.00 0.36 O ATOM 521 CB TYR A 39 -5.456 6.840 -10.471 1.00 0.64 C ATOM 522 CG TYR A 39 -6.095 7.134 -11.810 1.00 0.92 C ATOM 523 CD1 TYR A 39 -5.341 7.655 -12.852 1.00 1.50 C ATOM 524 CD2 TYR A 39 -7.453 6.931 -12.023 1.00 1.31 C ATOM 525 CE1 TYR A 39 -5.918 7.965 -14.066 1.00 2.23 C ATOM 526 CE2 TYR A 39 -8.037 7.231 -13.239 1.00 1.97 C ATOM 527 CZ TYR A 39 -7.264 7.751 -14.257 1.00 2.39 C ATOM 528 OH TYR A 39 -7.840 8.067 -15.468 1.00 3.17 O ATOM 0 H TYR A 39 -4.953 4.596 -12.223 1.00 0.43 H new ATOM 0 HA TYR A 39 -4.062 5.507 -9.575 1.00 0.41 H new ATOM 0 HB2 TYR A 39 -6.199 7.009 -9.692 1.00 0.64 H new ATOM 0 HB3 TYR A 39 -4.654 7.560 -10.308 1.00 0.64 H new ATOM 0 HD1 TYR A 39 -4.283 7.821 -12.710 1.00 1.50 H new ATOM 0 HD2 TYR A 39 -8.062 6.532 -11.225 1.00 1.31 H new ATOM 0 HE1 TYR A 39 -5.316 8.374 -14.864 1.00 2.23 H new ATOM 0 HE2 TYR A 39 -9.092 7.059 -13.392 1.00 1.97 H new ATOM 0 HH TYR A 39 -8.796 7.855 -15.441 1.00 3.17 H new ATOM 538 N LEU A 40 -6.109 4.600 -8.392 1.00 0.31 N ATOM 539 CA LEU A 40 -6.995 3.723 -7.642 1.00 0.28 C ATOM 540 C LEU A 40 -8.075 4.524 -6.933 1.00 0.25 C ATOM 541 O LEU A 40 -7.798 5.564 -6.340 1.00 0.29 O ATOM 542 CB LEU A 40 -6.190 2.940 -6.606 1.00 0.30 C ATOM 543 CG LEU A 40 -6.432 1.436 -6.593 1.00 0.51 C ATOM 544 CD1 LEU A 40 -5.697 0.775 -7.746 1.00 1.21 C ATOM 545 CD2 LEU A 40 -6.000 0.840 -5.265 1.00 1.31 C ATOM 0 H LEU A 40 -5.652 5.312 -7.822 1.00 0.31 H new ATOM 0 HA LEU A 40 -7.469 3.035 -8.343 1.00 0.28 H new ATOM 0 HB2 LEU A 40 -5.130 3.119 -6.783 1.00 0.30 H new ATOM 0 HB3 LEU A 40 -6.419 3.337 -5.617 1.00 0.30 H new ATOM 0 HG LEU A 40 -7.499 1.252 -6.716 1.00 0.51 H new ATOM 0 HD11 LEU A 40 -5.878 -0.300 -7.725 1.00 1.21 H new ATOM 0 HD12 LEU A 40 -6.057 1.185 -8.690 1.00 1.21 H new ATOM 0 HD13 LEU A 40 -4.628 0.964 -7.652 1.00 1.21 H new ATOM 0 HD21 LEU A 40 -6.180 -0.235 -5.273 1.00 1.31 H new ATOM 0 HD22 LEU A 40 -4.938 1.029 -5.110 1.00 1.31 H new ATOM 0 HD23 LEU A 40 -6.572 1.298 -4.458 1.00 1.31 H new ATOM 557 N THR A 41 -9.296 4.022 -6.988 1.00 0.24 N ATOM 558 CA THR A 41 -10.422 4.653 -6.324 1.00 0.22 C ATOM 559 C THR A 41 -10.984 3.699 -5.282 1.00 0.19 C ATOM 560 O THR A 41 -11.130 2.500 -5.534 1.00 0.21 O ATOM 561 CB THR A 41 -11.535 5.001 -7.334 1.00 0.27 C ATOM 562 OG1 THR A 41 -10.965 5.607 -8.500 1.00 1.36 O ATOM 563 CG2 THR A 41 -12.552 5.948 -6.717 1.00 1.28 C ATOM 0 H THR A 41 -9.534 3.168 -7.493 1.00 0.24 H new ATOM 0 HA THR A 41 -10.075 5.573 -5.854 1.00 0.22 H new ATOM 0 HB THR A 41 -12.042 4.077 -7.612 1.00 0.27 H new ATOM 0 HG1 THR A 41 -10.595 6.483 -8.265 1.00 1.36 H new ATOM 0 HG21 THR A 41 -13.326 6.178 -7.449 1.00 1.28 H new ATOM 0 HG22 THR A 41 -13.006 5.477 -5.845 1.00 1.28 H new ATOM 0 HG23 THR A 41 -12.054 6.869 -6.414 1.00 1.28 H new ATOM 571 N ALA A 42 -11.298 4.229 -4.122 1.00 0.19 N ATOM 572 CA ALA A 42 -11.849 3.432 -3.050 1.00 0.20 C ATOM 573 C ALA A 42 -13.364 3.395 -3.145 1.00 0.20 C ATOM 574 O ALA A 42 -14.002 4.404 -3.448 1.00 0.27 O ATOM 575 CB ALA A 42 -11.409 3.996 -1.712 1.00 0.26 C ATOM 0 H ALA A 42 -11.180 5.217 -3.896 1.00 0.19 H new ATOM 0 HA ALA A 42 -11.478 2.411 -3.138 1.00 0.20 H new ATOM 0 HB1 ALA A 42 -11.827 3.392 -0.907 1.00 0.26 H new ATOM 0 HB2 ALA A 42 -10.321 3.980 -1.650 1.00 0.26 H new ATOM 0 HB3 ALA A 42 -11.762 5.023 -1.616 1.00 0.26 H new ATOM 581 N ALA A 43 -13.930 2.221 -2.914 1.00 0.20 N ATOM 582 CA ALA A 43 -15.385 2.056 -2.931 1.00 0.29 C ATOM 583 C ALA A 43 -15.808 0.968 -1.954 1.00 0.35 C ATOM 584 O ALA A 43 -15.217 -0.103 -1.938 1.00 0.40 O ATOM 585 CB ALA A 43 -15.856 1.710 -4.336 1.00 0.38 C ATOM 0 H ALA A 43 -13.410 1.367 -2.712 1.00 0.20 H new ATOM 0 HA ALA A 43 -15.845 2.996 -2.625 1.00 0.29 H new ATOM 0 HB1 ALA A 43 -16.939 1.590 -4.337 1.00 0.38 H new ATOM 0 HB2 ALA A 43 -15.579 2.512 -5.020 1.00 0.38 H new ATOM 0 HB3 ALA A 43 -15.387 0.780 -4.658 1.00 0.38 H new ATOM 591 N ALA A 44 -16.846 1.237 -1.159 1.00 0.63 N ATOM 592 CA ALA A 44 -17.282 0.325 -0.114 1.00 0.65 C ATOM 593 C ALA A 44 -17.579 -1.079 -0.633 1.00 0.46 C ATOM 594 O ALA A 44 -18.358 -1.285 -1.567 1.00 0.79 O ATOM 595 CB ALA A 44 -18.503 0.894 0.588 1.00 1.13 C ATOM 0 H ALA A 44 -17.401 2.090 -1.225 1.00 0.63 H new ATOM 0 HA ALA A 44 -16.456 0.228 0.591 1.00 0.65 H new ATOM 0 HB1 ALA A 44 -18.826 0.207 1.370 1.00 1.13 H new ATOM 0 HB2 ALA A 44 -18.252 1.857 1.032 1.00 1.13 H new ATOM 0 HB3 ALA A 44 -19.309 1.027 -0.134 1.00 1.13 H new ATOM 601 N LEU A 45 -16.908 -2.020 0.009 1.00 0.47 N ATOM 602 CA LEU A 45 -17.011 -3.432 -0.236 1.00 0.66 C ATOM 603 C LEU A 45 -18.369 -4.000 0.170 1.00 0.62 C ATOM 604 O LEU A 45 -18.997 -3.516 1.110 1.00 0.88 O ATOM 605 CB LEU A 45 -15.937 -4.044 0.636 1.00 1.23 C ATOM 606 CG LEU A 45 -15.545 -5.461 0.339 1.00 2.25 C ATOM 607 CD1 LEU A 45 -14.995 -5.551 -1.070 1.00 2.87 C ATOM 608 CD2 LEU A 45 -14.522 -5.906 1.370 1.00 2.93 C ATOM 0 H LEU A 45 -16.245 -1.799 0.752 1.00 0.47 H new ATOM 0 HA LEU A 45 -16.898 -3.648 -1.298 1.00 0.66 H new ATOM 0 HB2 LEU A 45 -15.045 -3.423 0.561 1.00 1.23 H new ATOM 0 HB3 LEU A 45 -16.273 -3.995 1.672 1.00 1.23 H new ATOM 0 HG LEU A 45 -16.410 -6.122 0.398 1.00 2.25 H new ATOM 0 HD11 LEU A 45 -14.711 -6.581 -1.284 1.00 2.87 H new ATOM 0 HD12 LEU A 45 -15.758 -5.230 -1.779 1.00 2.87 H new ATOM 0 HD13 LEU A 45 -14.121 -4.907 -1.161 1.00 2.87 H new ATOM 0 HD21 LEU A 45 -14.226 -6.935 1.168 1.00 2.93 H new ATOM 0 HD22 LEU A 45 -13.646 -5.259 1.316 1.00 2.93 H new ATOM 0 HD23 LEU A 45 -14.959 -5.843 2.367 1.00 2.93 H new ATOM 620 N HIS A 46 -18.810 -5.033 -0.542 1.00 0.61 N ATOM 621 CA HIS A 46 -20.042 -5.729 -0.191 1.00 0.80 C ATOM 622 C HIS A 46 -19.923 -7.230 -0.484 1.00 0.76 C ATOM 623 O HIS A 46 -20.608 -8.043 0.130 1.00 0.94 O ATOM 624 CB HIS A 46 -21.224 -5.127 -0.958 1.00 1.06 C ATOM 625 CG HIS A 46 -22.570 -5.550 -0.444 1.00 1.87 C ATOM 626 ND1 HIS A 46 -23.603 -5.933 -1.270 1.00 2.69 N ATOM 627 CD2 HIS A 46 -23.058 -5.621 0.819 1.00 2.79 C ATOM 628 CE1 HIS A 46 -24.666 -6.218 -0.542 1.00 3.63 C ATOM 629 NE2 HIS A 46 -24.362 -6.038 0.729 1.00 3.71 N ATOM 0 H HIS A 46 -18.333 -5.405 -1.363 1.00 0.61 H new ATOM 0 HA HIS A 46 -20.215 -5.605 0.878 1.00 0.80 H new ATOM 0 HB2 HIS A 46 -21.156 -4.040 -0.914 1.00 1.06 H new ATOM 0 HB3 HIS A 46 -21.143 -5.409 -2.008 1.00 1.06 H new ATOM 0 HD2 HIS A 46 -22.520 -5.392 1.727 1.00 2.79 H new ATOM 0 HE1 HIS A 46 -25.623 -6.544 -0.922 1.00 3.63 H new ATOM 0 HE2 HIS A 46 -24.993 -6.185 1.516 1.00 3.71 H new ATOM 638 N ASN A 47 -19.043 -7.595 -1.418 1.00 0.66 N ATOM 639 CA ASN A 47 -18.763 -9.009 -1.701 1.00 0.71 C ATOM 640 C ASN A 47 -17.588 -9.485 -0.856 1.00 0.76 C ATOM 641 O ASN A 47 -17.214 -10.658 -0.883 1.00 0.88 O ATOM 642 CB ASN A 47 -18.405 -9.188 -3.176 1.00 0.74 C ATOM 643 CG ASN A 47 -18.585 -10.615 -3.668 1.00 1.42 C ATOM 644 OD1 ASN A 47 -19.672 -11.001 -4.098 1.00 2.21 O ATOM 645 ND2 ASN A 47 -17.521 -11.404 -3.627 1.00 1.94 N ATOM 0 H ASN A 47 -18.513 -6.937 -1.990 1.00 0.66 H new ATOM 0 HA ASN A 47 -19.653 -9.591 -1.463 1.00 0.71 H new ATOM 0 HB2 ASN A 47 -19.025 -8.523 -3.777 1.00 0.74 H new ATOM 0 HB3 ASN A 47 -17.369 -8.885 -3.331 1.00 0.74 H new ATOM 0 HD21 ASN A 47 -17.587 -12.366 -3.959 1.00 1.94 H new ATOM 0 HD22 ASN A 47 -16.636 -11.049 -3.264 1.00 1.94 H new ATOM 652 N LEU A 48 -17.038 -8.558 -0.083 1.00 0.77 N ATOM 653 CA LEU A 48 -15.805 -8.768 0.661 1.00 0.89 C ATOM 654 C LEU A 48 -14.620 -8.937 -0.293 1.00 0.81 C ATOM 655 O LEU A 48 -13.775 -8.067 -0.372 1.00 0.78 O ATOM 656 CB LEU A 48 -15.945 -9.918 1.654 1.00 1.15 C ATOM 657 CG LEU A 48 -16.812 -9.582 2.873 1.00 1.37 C ATOM 658 CD1 LEU A 48 -17.043 -10.807 3.741 1.00 1.71 C ATOM 659 CD2 LEU A 48 -16.177 -8.466 3.690 1.00 1.66 C ATOM 0 H LEU A 48 -17.440 -7.630 0.046 1.00 0.77 H new ATOM 0 HA LEU A 48 -15.601 -7.879 1.258 1.00 0.89 H new ATOM 0 HB2 LEU A 48 -16.374 -10.778 1.141 1.00 1.15 H new ATOM 0 HB3 LEU A 48 -14.953 -10.213 1.996 1.00 1.15 H new ATOM 0 HG LEU A 48 -17.781 -9.241 2.508 1.00 1.37 H new ATOM 0 HD11 LEU A 48 -17.661 -10.535 4.597 1.00 1.71 H new ATOM 0 HD12 LEU A 48 -17.549 -11.576 3.158 1.00 1.71 H new ATOM 0 HD13 LEU A 48 -16.085 -11.190 4.092 1.00 1.71 H new ATOM 0 HD21 LEU A 48 -16.807 -8.242 4.551 1.00 1.66 H new ATOM 0 HD22 LEU A 48 -15.192 -8.782 4.034 1.00 1.66 H new ATOM 0 HD23 LEU A 48 -16.077 -7.574 3.071 1.00 1.66 H new ATOM 671 N ASP A 49 -14.547 -10.003 -1.048 1.00 0.83 N ATOM 672 CA ASP A 49 -13.530 -10.056 -2.101 1.00 0.83 C ATOM 673 C ASP A 49 -14.088 -9.386 -3.360 1.00 0.75 C ATOM 674 O ASP A 49 -14.644 -10.026 -4.250 1.00 0.83 O ATOM 675 CB ASP A 49 -13.019 -11.486 -2.375 1.00 1.00 C ATOM 676 CG ASP A 49 -14.029 -12.410 -3.033 1.00 1.20 C ATOM 677 OD1 ASP A 49 -15.069 -12.693 -2.399 1.00 1.87 O ATOM 678 OD2 ASP A 49 -13.804 -12.823 -4.187 1.00 1.53 O ATOM 0 H ASP A 49 -15.148 -10.824 -0.971 1.00 0.83 H new ATOM 0 HA ASP A 49 -12.651 -9.508 -1.762 1.00 0.83 H new ATOM 0 HB2 ASP A 49 -12.136 -11.425 -3.011 1.00 1.00 H new ATOM 0 HB3 ASP A 49 -12.702 -11.930 -1.431 1.00 1.00 H new ATOM 683 N GLU A 50 -13.949 -8.074 -3.411 1.00 0.66 N ATOM 684 CA GLU A 50 -14.580 -7.271 -4.450 1.00 0.72 C ATOM 685 C GLU A 50 -13.674 -6.107 -4.816 1.00 0.62 C ATOM 686 O GLU A 50 -13.631 -5.669 -5.966 1.00 0.68 O ATOM 687 CB GLU A 50 -15.941 -6.794 -3.945 1.00 0.94 C ATOM 688 CG GLU A 50 -16.728 -5.939 -4.914 1.00 1.25 C ATOM 689 CD GLU A 50 -18.158 -5.767 -4.456 1.00 1.93 C ATOM 690 OE1 GLU A 50 -18.369 -5.467 -3.257 1.00 2.66 O ATOM 691 OE2 GLU A 50 -19.077 -5.956 -5.281 1.00 2.35 O ATOM 0 H GLU A 50 -13.401 -7.535 -2.740 1.00 0.66 H new ATOM 0 HA GLU A 50 -14.736 -7.863 -5.352 1.00 0.72 H new ATOM 0 HB2 GLU A 50 -16.541 -7.667 -3.687 1.00 0.94 H new ATOM 0 HB3 GLU A 50 -15.791 -6.228 -3.026 1.00 0.94 H new ATOM 0 HG2 GLU A 50 -16.254 -4.962 -5.009 1.00 1.25 H new ATOM 0 HG3 GLU A 50 -16.713 -6.398 -5.903 1.00 1.25 H new ATOM 698 N ALA A 51 -12.921 -5.630 -3.837 1.00 0.52 N ATOM 699 CA ALA A 51 -11.798 -4.755 -4.125 1.00 0.43 C ATOM 700 C ALA A 51 -10.615 -5.558 -4.614 1.00 0.32 C ATOM 701 O ALA A 51 -10.561 -6.780 -4.449 1.00 0.33 O ATOM 702 CB ALA A 51 -11.366 -3.995 -2.904 1.00 0.50 C ATOM 0 H ALA A 51 -13.065 -5.831 -2.848 1.00 0.52 H new ATOM 0 HA ALA A 51 -12.130 -4.055 -4.892 1.00 0.43 H new ATOM 0 HB1 ALA A 51 -10.524 -3.350 -3.156 1.00 0.50 H new ATOM 0 HB2 ALA A 51 -12.194 -3.386 -2.543 1.00 0.50 H new ATOM 0 HB3 ALA A 51 -11.066 -4.697 -2.126 1.00 0.50 H new ATOM 708 N VAL A 52 -9.676 -4.862 -5.220 1.00 0.28 N ATOM 709 CA VAL A 52 -8.452 -5.481 -5.681 1.00 0.26 C ATOM 710 C VAL A 52 -7.600 -5.871 -4.484 1.00 0.22 C ATOM 711 O VAL A 52 -7.468 -5.118 -3.518 1.00 0.23 O ATOM 712 CB VAL A 52 -7.640 -4.588 -6.650 1.00 0.29 C ATOM 713 CG1 VAL A 52 -8.372 -4.442 -7.975 1.00 0.38 C ATOM 714 CG2 VAL A 52 -7.357 -3.224 -6.041 1.00 0.31 C ATOM 0 H VAL A 52 -9.738 -3.861 -5.405 1.00 0.28 H new ATOM 0 HA VAL A 52 -8.735 -6.367 -6.249 1.00 0.26 H new ATOM 0 HB VAL A 52 -6.682 -5.075 -6.832 1.00 0.29 H new ATOM 0 HG11 VAL A 52 -7.788 -3.811 -8.646 1.00 0.38 H new ATOM 0 HG12 VAL A 52 -8.506 -5.425 -8.427 1.00 0.38 H new ATOM 0 HG13 VAL A 52 -9.347 -3.985 -7.804 1.00 0.38 H new ATOM 0 HG21 VAL A 52 -6.785 -2.622 -6.747 1.00 0.31 H new ATOM 0 HG22 VAL A 52 -8.299 -2.723 -5.816 1.00 0.31 H new ATOM 0 HG23 VAL A 52 -6.784 -3.348 -5.122 1.00 0.31 H new ATOM 724 N LYS A 53 -7.056 -7.065 -4.553 1.00 0.22 N ATOM 725 CA LYS A 53 -6.388 -7.690 -3.416 1.00 0.22 C ATOM 726 C LYS A 53 -4.929 -7.376 -3.470 1.00 0.18 C ATOM 727 O LYS A 53 -4.278 -7.506 -4.503 1.00 0.24 O ATOM 728 CB LYS A 53 -6.554 -9.210 -3.445 1.00 0.35 C ATOM 729 CG LYS A 53 -7.980 -9.692 -3.631 1.00 0.78 C ATOM 730 CD LYS A 53 -8.050 -11.197 -3.469 1.00 1.12 C ATOM 731 CE LYS A 53 -9.389 -11.762 -3.897 1.00 1.37 C ATOM 732 NZ LYS A 53 -9.437 -13.237 -3.720 1.00 1.59 N ATOM 0 H LYS A 53 -7.060 -7.637 -5.397 1.00 0.22 H new ATOM 0 HA LYS A 53 -6.838 -7.301 -2.503 1.00 0.22 H new ATOM 0 HB2 LYS A 53 -5.941 -9.613 -4.252 1.00 0.35 H new ATOM 0 HB3 LYS A 53 -6.165 -9.621 -2.514 1.00 0.35 H new ATOM 0 HG2 LYS A 53 -8.632 -9.210 -2.903 1.00 0.78 H new ATOM 0 HG3 LYS A 53 -8.341 -9.408 -4.619 1.00 0.78 H new ATOM 0 HD2 LYS A 53 -7.258 -11.660 -4.058 1.00 1.12 H new ATOM 0 HD3 LYS A 53 -7.866 -11.457 -2.427 1.00 1.12 H new ATOM 0 HE2 LYS A 53 -10.184 -11.298 -3.314 1.00 1.37 H new ATOM 0 HE3 LYS A 53 -9.573 -11.513 -4.942 1.00 1.37 H new ATOM 0 HZ1 LYS A 53 -9.932 -13.668 -4.527 1.00 1.59 H new ATOM 0 HZ2 LYS A 53 -8.468 -13.612 -3.667 1.00 1.59 H new ATOM 0 HZ3 LYS A 53 -9.945 -13.465 -2.841 1.00 1.59 H new ATOM 746 N PHE A 54 -4.446 -6.904 -2.350 1.00 0.18 N ATOM 747 CA PHE A 54 -3.088 -6.521 -2.222 1.00 0.19 C ATOM 748 C PHE A 54 -2.344 -7.602 -1.495 1.00 0.20 C ATOM 749 O PHE A 54 -2.937 -8.431 -0.799 1.00 0.23 O ATOM 750 CB PHE A 54 -2.967 -5.198 -1.463 1.00 0.25 C ATOM 751 CG PHE A 54 -3.469 -4.007 -2.227 1.00 1.22 C ATOM 752 CD1 PHE A 54 -4.827 -3.759 -2.326 1.00 1.57 C ATOM 753 CD2 PHE A 54 -2.587 -3.142 -2.852 1.00 1.95 C ATOM 754 CE1 PHE A 54 -5.298 -2.673 -3.037 1.00 2.60 C ATOM 755 CE2 PHE A 54 -3.051 -2.053 -3.562 1.00 2.98 C ATOM 756 CZ PHE A 54 -4.386 -1.791 -3.626 1.00 3.31 C ATOM 0 H PHE A 54 -4.999 -6.779 -1.502 1.00 0.18 H new ATOM 0 HA PHE A 54 -2.660 -6.380 -3.215 1.00 0.19 H new ATOM 0 HB2 PHE A 54 -3.520 -5.276 -0.527 1.00 0.25 H new ATOM 0 HB3 PHE A 54 -1.921 -5.035 -1.202 1.00 0.25 H new ATOM 0 HD1 PHE A 54 -5.527 -4.423 -1.841 1.00 1.57 H new ATOM 0 HD2 PHE A 54 -1.524 -3.321 -2.783 1.00 1.95 H new ATOM 0 HE1 PHE A 54 -6.360 -2.506 -3.137 1.00 2.60 H new ATOM 0 HE2 PHE A 54 -2.352 -1.405 -4.070 1.00 2.98 H new ATOM 0 HZ PHE A 54 -4.740 -0.904 -4.131 1.00 3.31 H new ATOM 766 N ASP A 55 -1.054 -7.565 -1.636 1.00 0.21 N ATOM 767 CA ASP A 55 -0.202 -8.464 -0.894 1.00 0.22 C ATOM 768 C ASP A 55 0.987 -7.681 -0.389 1.00 0.23 C ATOM 769 O ASP A 55 1.649 -6.976 -1.150 1.00 0.27 O ATOM 770 CB ASP A 55 0.296 -9.611 -1.789 1.00 0.24 C ATOM 771 CG ASP A 55 -0.732 -10.093 -2.803 1.00 1.33 C ATOM 772 OD1 ASP A 55 -1.672 -10.802 -2.404 1.00 1.89 O ATOM 773 OD2 ASP A 55 -0.623 -9.750 -3.992 1.00 1.93 O ATOM 0 H ASP A 55 -0.561 -6.924 -2.257 1.00 0.21 H new ATOM 0 HA ASP A 55 -0.768 -8.893 -0.067 1.00 0.22 H new ATOM 0 HB2 ASP A 55 1.189 -9.283 -2.320 1.00 0.24 H new ATOM 0 HB3 ASP A 55 0.590 -10.450 -1.158 1.00 0.24 H new ATOM 778 N MET A 56 1.221 -7.785 0.907 1.00 0.24 N ATOM 779 CA MET A 56 2.305 -7.081 1.556 1.00 0.25 C ATOM 780 C MET A 56 3.366 -8.048 2.030 1.00 0.25 C ATOM 781 O MET A 56 3.078 -9.133 2.533 1.00 0.30 O ATOM 782 CB MET A 56 1.788 -6.232 2.724 1.00 0.33 C ATOM 783 CG MET A 56 0.976 -7.010 3.748 1.00 0.97 C ATOM 784 SD MET A 56 0.473 -5.988 5.148 1.00 1.19 S ATOM 785 CE MET A 56 -0.547 -7.138 6.064 1.00 1.85 C ATOM 0 H MET A 56 0.663 -8.361 1.537 1.00 0.24 H new ATOM 0 HA MET A 56 2.755 -6.411 0.823 1.00 0.25 H new ATOM 0 HB2 MET A 56 2.638 -5.769 3.226 1.00 0.33 H new ATOM 0 HB3 MET A 56 1.173 -5.424 2.327 1.00 0.33 H new ATOM 0 HG2 MET A 56 0.090 -7.423 3.267 1.00 0.97 H new ATOM 0 HG3 MET A 56 1.565 -7.853 4.110 1.00 0.97 H new ATOM 0 HE1 MET A 56 -0.639 -6.801 7.096 1.00 1.85 H new ATOM 0 HE2 MET A 56 -1.536 -7.188 5.610 1.00 1.85 H new ATOM 0 HE3 MET A 56 -0.088 -8.126 6.045 1.00 1.85 H new ATOM 795 N GLY A 57 4.586 -7.643 1.831 1.00 0.26 N ATOM 796 CA GLY A 57 5.725 -8.365 2.301 1.00 0.32 C ATOM 797 C GLY A 57 6.703 -7.395 2.882 1.00 0.31 C ATOM 798 O GLY A 57 7.018 -6.395 2.245 1.00 0.35 O ATOM 0 H GLY A 57 4.818 -6.786 1.328 1.00 0.26 H new ATOM 0 HA2 GLY A 57 5.425 -9.095 3.053 1.00 0.32 H new ATOM 0 HA3 GLY A 57 6.184 -8.920 1.483 1.00 0.32 H new ATOM 802 N ALA A 58 7.173 -7.632 4.077 1.00 0.37 N ATOM 803 CA ALA A 58 8.056 -6.677 4.684 1.00 0.38 C ATOM 804 C ALA A 58 9.448 -6.977 4.209 1.00 0.42 C ATOM 805 O ALA A 58 9.814 -8.141 4.033 1.00 0.61 O ATOM 806 CB ALA A 58 7.974 -6.743 6.200 1.00 0.51 C ATOM 0 H ALA A 58 6.965 -8.458 4.638 1.00 0.37 H new ATOM 0 HA ALA A 58 7.769 -5.666 4.397 1.00 0.38 H new ATOM 0 HB1 ALA A 58 8.653 -6.009 6.633 1.00 0.51 H new ATOM 0 HB2 ALA A 58 6.954 -6.527 6.519 1.00 0.51 H new ATOM 0 HB3 ALA A 58 8.255 -7.741 6.537 1.00 0.51 H new ATOM 812 N TYR A 59 10.211 -5.951 3.931 1.00 0.45 N ATOM 813 CA TYR A 59 11.569 -6.169 3.491 1.00 0.61 C ATOM 814 C TYR A 59 12.524 -5.290 4.264 1.00 0.72 C ATOM 815 O TYR A 59 12.165 -4.190 4.676 1.00 0.81 O ATOM 816 CB TYR A 59 11.651 -5.983 1.983 1.00 0.93 C ATOM 817 CG TYR A 59 10.915 -7.092 1.262 1.00 1.64 C ATOM 818 CD1 TYR A 59 11.372 -8.403 1.335 1.00 2.54 C ATOM 819 CD2 TYR A 59 9.754 -6.845 0.551 1.00 2.01 C ATOM 820 CE1 TYR A 59 10.700 -9.431 0.714 1.00 3.70 C ATOM 821 CE2 TYR A 59 9.071 -7.873 -0.066 1.00 3.08 C ATOM 822 CZ TYR A 59 9.550 -9.164 0.016 1.00 3.92 C ATOM 823 OH TYR A 59 8.872 -10.194 -0.599 1.00 5.11 O ATOM 0 H TYR A 59 9.925 -4.974 3.999 1.00 0.45 H new ATOM 0 HA TYR A 59 11.874 -7.194 3.700 1.00 0.61 H new ATOM 0 HB2 TYR A 59 11.224 -5.019 1.708 1.00 0.93 H new ATOM 0 HB3 TYR A 59 12.695 -5.970 1.670 1.00 0.93 H new ATOM 0 HD1 TYR A 59 12.273 -8.619 1.890 1.00 2.54 H new ATOM 0 HD2 TYR A 59 9.378 -5.835 0.478 1.00 2.01 H new ATOM 0 HE1 TYR A 59 11.076 -10.442 0.776 1.00 3.70 H new ATOM 0 HE2 TYR A 59 8.162 -7.667 -0.612 1.00 3.08 H new ATOM 0 HH TYR A 59 7.915 -9.986 -0.626 1.00 5.11 H new ATOM 833 N LYS A 60 13.748 -5.769 4.454 1.00 0.92 N ATOM 834 CA LYS A 60 14.560 -5.239 5.538 1.00 1.13 C ATOM 835 C LYS A 60 16.029 -5.042 5.207 1.00 1.50 C ATOM 836 O LYS A 60 16.709 -5.931 4.685 1.00 1.77 O ATOM 837 CB LYS A 60 14.436 -6.128 6.778 1.00 1.30 C ATOM 838 CG LYS A 60 15.200 -5.603 7.987 1.00 1.66 C ATOM 839 CD LYS A 60 14.992 -6.490 9.199 1.00 2.14 C ATOM 840 CE LYS A 60 15.821 -6.032 10.387 1.00 2.79 C ATOM 841 NZ LYS A 60 15.623 -6.915 11.566 1.00 3.47 N ATOM 0 H LYS A 60 14.187 -6.498 3.892 1.00 0.92 H new ATOM 0 HA LYS A 60 14.159 -4.243 5.725 1.00 1.13 H new ATOM 0 HB2 LYS A 60 13.382 -6.226 7.040 1.00 1.30 H new ATOM 0 HB3 LYS A 60 14.799 -7.127 6.536 1.00 1.30 H new ATOM 0 HG2 LYS A 60 16.263 -5.548 7.752 1.00 1.66 H new ATOM 0 HG3 LYS A 60 14.871 -4.589 8.215 1.00 1.66 H new ATOM 0 HD2 LYS A 60 13.937 -6.490 9.472 1.00 2.14 H new ATOM 0 HD3 LYS A 60 15.256 -7.517 8.947 1.00 2.14 H new ATOM 0 HE2 LYS A 60 16.876 -6.022 10.113 1.00 2.79 H new ATOM 0 HE3 LYS A 60 15.549 -5.009 10.648 1.00 2.79 H new ATOM 0 HZ1 LYS A 60 16.204 -6.572 12.358 1.00 3.47 H new ATOM 0 HZ2 LYS A 60 14.620 -6.905 11.843 1.00 3.47 H new ATOM 0 HZ3 LYS A 60 15.906 -7.886 11.324 1.00 3.47 H new ATOM 855 N SER A 61 16.470 -3.838 5.491 1.00 1.67 N ATOM 856 CA SER A 61 17.847 -3.551 5.811 1.00 2.15 C ATOM 857 C SER A 61 17.788 -2.620 7.003 1.00 2.02 C ATOM 858 O SER A 61 16.800 -1.906 7.154 1.00 1.72 O ATOM 859 CB SER A 61 18.564 -2.879 4.636 1.00 2.67 C ATOM 860 OG SER A 61 18.735 -3.779 3.557 1.00 3.06 O ATOM 0 H SER A 61 15.868 -3.015 5.506 1.00 1.67 H new ATOM 0 HA SER A 61 18.407 -4.461 6.026 1.00 2.15 H new ATOM 0 HB2 SER A 61 17.990 -2.014 4.304 1.00 2.67 H new ATOM 0 HB3 SER A 61 19.536 -2.510 4.963 1.00 2.67 H new ATOM 0 HG SER A 61 18.028 -3.633 2.894 1.00 3.06 H new ATOM 866 N SER A 62 18.799 -2.584 7.848 1.00 2.37 N ATOM 867 CA SER A 62 18.699 -1.731 9.018 1.00 2.25 C ATOM 868 C SER A 62 19.241 -0.344 8.707 1.00 2.37 C ATOM 869 O SER A 62 19.991 0.236 9.494 1.00 2.59 O ATOM 870 CB SER A 62 19.455 -2.360 10.188 1.00 2.65 C ATOM 871 OG SER A 62 18.935 -3.647 10.496 1.00 2.99 O ATOM 0 H SER A 62 19.667 -3.112 7.756 1.00 2.37 H new ATOM 0 HA SER A 62 17.650 -1.631 9.297 1.00 2.25 H new ATOM 0 HB2 SER A 62 20.513 -2.441 9.941 1.00 2.65 H new ATOM 0 HB3 SER A 62 19.381 -1.715 11.063 1.00 2.65 H new ATOM 0 HG SER A 62 19.435 -4.031 11.246 1.00 2.99 H new ATOM 877 N LYS A 63 18.852 0.179 7.549 1.00 2.37 N ATOM 878 CA LYS A 63 19.187 1.540 7.175 1.00 2.64 C ATOM 879 C LYS A 63 17.946 2.353 6.828 1.00 2.48 C ATOM 880 O LYS A 63 17.999 3.214 5.946 1.00 2.87 O ATOM 881 CB LYS A 63 20.187 1.562 6.013 1.00 3.20 C ATOM 882 CG LYS A 63 21.581 1.072 6.394 1.00 3.62 C ATOM 883 CD LYS A 63 22.106 1.790 7.631 1.00 4.18 C ATOM 884 CE LYS A 63 22.124 3.302 7.452 1.00 4.77 C ATOM 885 NZ LYS A 63 23.199 3.749 6.533 1.00 5.27 N ATOM 0 H LYS A 63 18.302 -0.325 6.853 1.00 2.37 H new ATOM 0 HA LYS A 63 19.656 2.005 8.042 1.00 2.64 H new ATOM 0 HB2 LYS A 63 19.803 0.942 5.203 1.00 3.20 H new ATOM 0 HB3 LYS A 63 20.262 2.579 5.629 1.00 3.20 H new ATOM 0 HG2 LYS A 63 21.552 -0.002 6.580 1.00 3.62 H new ATOM 0 HG3 LYS A 63 22.265 1.233 5.561 1.00 3.62 H new ATOM 0 HD2 LYS A 63 21.484 1.534 8.489 1.00 4.18 H new ATOM 0 HD3 LYS A 63 23.114 1.440 7.852 1.00 4.18 H new ATOM 0 HE2 LYS A 63 21.159 3.631 7.066 1.00 4.77 H new ATOM 0 HE3 LYS A 63 22.258 3.779 8.423 1.00 4.77 H new ATOM 0 HZ1 LYS A 63 23.171 4.785 6.443 1.00 5.27 H new ATOM 0 HZ2 LYS A 63 24.123 3.460 6.913 1.00 5.27 H new ATOM 0 HZ3 LYS A 63 23.058 3.317 5.598 1.00 5.27 H new ATOM 899 N ASP A 64 16.827 2.080 7.492 1.00 2.02 N ATOM 900 CA ASP A 64 15.639 2.911 7.313 1.00 2.02 C ATOM 901 C ASP A 64 15.816 4.189 8.130 1.00 2.36 C ATOM 902 O ASP A 64 16.815 4.892 7.974 1.00 2.81 O ATOM 903 CB ASP A 64 14.395 2.149 7.777 1.00 1.53 C ATOM 904 CG ASP A 64 14.152 0.882 6.979 1.00 1.63 C ATOM 905 OD1 ASP A 64 13.701 0.990 5.822 1.00 1.88 O ATOM 906 OD2 ASP A 64 14.404 -0.221 7.504 1.00 1.89 O ATOM 0 H ASP A 64 16.717 1.306 8.147 1.00 2.02 H new ATOM 0 HA ASP A 64 15.511 3.163 6.260 1.00 2.02 H new ATOM 0 HB2 ASP A 64 14.502 1.894 8.831 1.00 1.53 H new ATOM 0 HB3 ASP A 64 13.524 2.799 7.693 1.00 1.53 H new ATOM 911 N ASP A 65 14.874 4.498 9.013 1.00 2.27 N ATOM 912 CA ASP A 65 15.146 5.452 10.083 1.00 2.65 C ATOM 913 C ASP A 65 14.802 4.820 11.423 1.00 2.35 C ATOM 914 O ASP A 65 15.658 4.288 12.130 1.00 2.28 O ATOM 915 CB ASP A 65 14.342 6.747 9.907 1.00 3.22 C ATOM 916 CG ASP A 65 14.564 7.416 8.566 1.00 3.59 C ATOM 917 OD1 ASP A 65 15.499 8.235 8.442 1.00 3.75 O ATOM 918 OD2 ASP A 65 13.784 7.140 7.636 1.00 4.06 O ATOM 0 H ASP A 65 13.931 4.110 9.012 1.00 2.27 H new ATOM 0 HA ASP A 65 16.205 5.707 10.046 1.00 2.65 H new ATOM 0 HB2 ASP A 65 13.281 6.526 10.023 1.00 3.22 H new ATOM 0 HB3 ASP A 65 14.611 7.444 10.701 1.00 3.22 H new ATOM 923 N ALA A 66 13.515 4.883 11.742 1.00 2.40 N ATOM 924 CA ALA A 66 12.931 4.173 12.866 1.00 2.34 C ATOM 925 C ALA A 66 11.685 3.430 12.401 1.00 2.24 C ATOM 926 O ALA A 66 10.814 3.080 13.200 1.00 2.63 O ATOM 927 CB ALA A 66 12.603 5.134 13.997 1.00 2.98 C ATOM 0 H ALA A 66 12.840 5.438 11.217 1.00 2.40 H new ATOM 0 HA ALA A 66 13.652 3.450 13.248 1.00 2.34 H new ATOM 0 HB1 ALA A 66 12.167 4.581 14.829 1.00 2.98 H new ATOM 0 HB2 ALA A 66 13.515 5.630 14.329 1.00 2.98 H new ATOM 0 HB3 ALA A 66 11.892 5.881 13.645 1.00 2.98 H new ATOM 933 N LYS A 67 11.597 3.206 11.097 1.00 1.96 N ATOM 934 CA LYS A 67 10.366 2.734 10.480 1.00 1.89 C ATOM 935 C LYS A 67 10.671 1.781 9.337 1.00 1.44 C ATOM 936 O LYS A 67 11.618 1.980 8.592 1.00 1.95 O ATOM 937 CB LYS A 67 9.522 3.925 9.997 1.00 2.82 C ATOM 938 CG LYS A 67 10.240 4.883 9.053 1.00 3.45 C ATOM 939 CD LYS A 67 9.346 6.065 8.703 1.00 4.32 C ATOM 940 CE LYS A 67 9.999 7.017 7.710 1.00 5.01 C ATOM 941 NZ LYS A 67 11.190 7.708 8.270 1.00 5.31 N ATOM 0 H LYS A 67 12.368 3.345 10.444 1.00 1.96 H new ATOM 0 HA LYS A 67 9.789 2.187 11.226 1.00 1.89 H new ATOM 0 HB2 LYS A 67 8.634 3.542 9.495 1.00 2.82 H new ATOM 0 HB3 LYS A 67 9.179 4.485 10.867 1.00 2.82 H new ATOM 0 HG2 LYS A 67 11.158 5.241 9.519 1.00 3.45 H new ATOM 0 HG3 LYS A 67 10.528 4.357 8.143 1.00 3.45 H new ATOM 0 HD2 LYS A 67 8.409 5.696 8.285 1.00 4.32 H new ATOM 0 HD3 LYS A 67 9.097 6.610 9.614 1.00 4.32 H new ATOM 0 HE2 LYS A 67 10.293 6.460 6.820 1.00 5.01 H new ATOM 0 HE3 LYS A 67 9.268 7.761 7.394 1.00 5.01 H new ATOM 0 HZ1 LYS A 67 11.205 8.695 7.943 1.00 5.31 H new ATOM 0 HZ2 LYS A 67 11.146 7.688 9.309 1.00 5.31 H new ATOM 0 HZ3 LYS A 67 12.054 7.225 7.951 1.00 5.31 H new ATOM 955 N ILE A 68 9.841 0.757 9.213 1.00 0.88 N ATOM 956 CA ILE A 68 10.139 -0.409 8.400 1.00 0.76 C ATOM 957 C ILE A 68 9.220 -0.487 7.209 1.00 0.43 C ATOM 958 O ILE A 68 8.079 -0.025 7.263 1.00 0.37 O ATOM 959 CB ILE A 68 10.069 -1.723 9.218 1.00 0.97 C ATOM 960 CG1 ILE A 68 8.875 -1.732 10.189 1.00 1.07 C ATOM 961 CG2 ILE A 68 11.371 -1.945 9.972 1.00 1.51 C ATOM 962 CD1 ILE A 68 7.541 -2.049 9.542 1.00 1.66 C ATOM 0 H ILE A 68 8.934 0.713 9.678 1.00 0.88 H new ATOM 0 HA ILE A 68 11.164 -0.293 8.046 1.00 0.76 H new ATOM 0 HB ILE A 68 9.921 -2.542 8.514 1.00 0.97 H new ATOM 0 HG12 ILE A 68 9.067 -2.464 10.974 1.00 1.07 H new ATOM 0 HG13 ILE A 68 8.808 -0.757 10.672 1.00 1.07 H new ATOM 0 HG21 ILE A 68 11.308 -2.872 10.542 1.00 1.51 H new ATOM 0 HG22 ILE A 68 12.196 -2.011 9.262 1.00 1.51 H new ATOM 0 HG23 ILE A 68 11.544 -1.111 10.652 1.00 1.51 H new ATOM 0 HD11 ILE A 68 6.757 -2.034 10.299 1.00 1.66 H new ATOM 0 HD12 ILE A 68 7.321 -1.304 8.777 1.00 1.66 H new ATOM 0 HD13 ILE A 68 7.584 -3.037 9.084 1.00 1.66 H new ATOM 974 N THR A 69 9.720 -1.071 6.141 1.00 0.47 N ATOM 975 CA THR A 69 9.028 -1.036 4.883 1.00 0.38 C ATOM 976 C THR A 69 8.430 -2.390 4.518 1.00 0.34 C ATOM 977 O THR A 69 9.057 -3.442 4.665 1.00 0.46 O ATOM 978 CB THR A 69 9.967 -0.569 3.752 1.00 0.55 C ATOM 979 OG1 THR A 69 9.356 -0.808 2.483 1.00 1.50 O ATOM 980 CG2 THR A 69 11.313 -1.277 3.815 1.00 1.23 C ATOM 0 H THR A 69 10.606 -1.576 6.125 1.00 0.47 H new ATOM 0 HA THR A 69 8.211 -0.323 4.996 1.00 0.38 H new ATOM 0 HB THR A 69 10.141 0.499 3.882 1.00 0.55 H new ATOM 0 HG1 THR A 69 10.050 -0.975 1.812 1.00 1.50 H new ATOM 0 HG21 THR A 69 11.949 -0.923 3.003 1.00 1.23 H new ATOM 0 HG22 THR A 69 11.792 -1.063 4.770 1.00 1.23 H new ATOM 0 HG23 THR A 69 11.164 -2.352 3.716 1.00 1.23 H new ATOM 988 N VAL A 70 7.200 -2.327 4.052 1.00 0.27 N ATOM 989 CA VAL A 70 6.483 -3.469 3.530 1.00 0.28 C ATOM 990 C VAL A 70 6.085 -3.125 2.105 1.00 0.26 C ATOM 991 O VAL A 70 6.126 -1.948 1.732 1.00 0.29 O ATOM 992 CB VAL A 70 5.217 -3.792 4.361 1.00 0.33 C ATOM 993 CG1 VAL A 70 5.578 -4.067 5.812 1.00 0.98 C ATOM 994 CG2 VAL A 70 4.198 -2.666 4.271 1.00 1.06 C ATOM 0 H VAL A 70 6.661 -1.462 4.026 1.00 0.27 H new ATOM 0 HA VAL A 70 7.121 -4.352 3.574 1.00 0.28 H new ATOM 0 HB VAL A 70 4.766 -4.691 3.941 1.00 0.33 H new ATOM 0 HG11 VAL A 70 4.673 -4.291 6.376 1.00 0.98 H new ATOM 0 HG12 VAL A 70 6.257 -4.918 5.863 1.00 0.98 H new ATOM 0 HG13 VAL A 70 6.063 -3.189 6.239 1.00 0.98 H new ATOM 0 HG21 VAL A 70 3.320 -2.921 4.864 1.00 1.06 H new ATOM 0 HG22 VAL A 70 4.639 -1.745 4.653 1.00 1.06 H new ATOM 0 HG23 VAL A 70 3.904 -2.524 3.231 1.00 1.06 H new ATOM 1004 N ILE A 71 5.726 -4.120 1.312 1.00 0.25 N ATOM 1005 CA ILE A 71 5.371 -3.882 -0.076 1.00 0.28 C ATOM 1006 C ILE A 71 3.872 -3.967 -0.282 1.00 0.28 C ATOM 1007 O ILE A 71 3.238 -4.891 0.192 1.00 0.33 O ATOM 1008 CB ILE A 71 6.063 -4.877 -1.029 1.00 0.39 C ATOM 1009 CG1 ILE A 71 5.902 -6.328 -0.577 1.00 1.29 C ATOM 1010 CG2 ILE A 71 7.540 -4.540 -1.178 1.00 1.34 C ATOM 1011 CD1 ILE A 71 4.782 -7.068 -1.281 1.00 2.12 C ATOM 0 H ILE A 71 5.673 -5.096 1.604 1.00 0.25 H new ATOM 0 HA ILE A 71 5.715 -2.875 -0.311 1.00 0.28 H new ATOM 0 HB ILE A 71 5.570 -4.779 -1.996 1.00 0.39 H new ATOM 0 HG12 ILE A 71 6.839 -6.858 -0.748 1.00 1.29 H new ATOM 0 HG13 ILE A 71 5.718 -6.346 0.497 1.00 1.29 H new ATOM 0 HG21 ILE A 71 8.010 -5.254 -1.854 1.00 1.34 H new ATOM 0 HG22 ILE A 71 7.644 -3.534 -1.583 1.00 1.34 H new ATOM 0 HG23 ILE A 71 8.025 -4.591 -0.203 1.00 1.34 H new ATOM 0 HD11 ILE A 71 4.730 -8.091 -0.907 1.00 2.12 H new ATOM 0 HD12 ILE A 71 3.835 -6.563 -1.089 1.00 2.12 H new ATOM 0 HD13 ILE A 71 4.974 -7.083 -2.354 1.00 2.12 H new ATOM 1023 N LEU A 72 3.296 -2.985 -0.947 1.00 0.28 N ATOM 1024 CA LEU A 72 1.891 -3.089 -1.320 1.00 0.29 C ATOM 1025 C LEU A 72 1.751 -3.345 -2.824 1.00 0.27 C ATOM 1026 O LEU A 72 2.131 -2.510 -3.641 1.00 0.30 O ATOM 1027 CB LEU A 72 1.127 -1.828 -0.912 1.00 0.33 C ATOM 1028 CG LEU A 72 -0.366 -2.034 -0.642 1.00 0.37 C ATOM 1029 CD1 LEU A 72 -0.569 -2.970 0.542 1.00 0.79 C ATOM 1030 CD2 LEU A 72 -1.051 -0.699 -0.390 1.00 0.88 C ATOM 0 H LEU A 72 3.761 -2.125 -1.236 1.00 0.28 H new ATOM 0 HA LEU A 72 1.457 -3.935 -0.787 1.00 0.29 H new ATOM 0 HB2 LEU A 72 1.589 -1.416 -0.015 1.00 0.33 H new ATOM 0 HB3 LEU A 72 1.239 -1.083 -1.700 1.00 0.33 H new ATOM 0 HG LEU A 72 -0.816 -2.491 -1.523 1.00 0.37 H new ATOM 0 HD11 LEU A 72 -1.636 -3.105 0.720 1.00 0.79 H new ATOM 0 HD12 LEU A 72 -0.112 -3.935 0.325 1.00 0.79 H new ATOM 0 HD13 LEU A 72 -0.105 -2.540 1.430 1.00 0.79 H new ATOM 0 HD21 LEU A 72 -2.111 -0.864 -0.200 1.00 0.88 H new ATOM 0 HD22 LEU A 72 -0.598 -0.215 0.476 1.00 0.88 H new ATOM 0 HD23 LEU A 72 -0.935 -0.059 -1.265 1.00 0.88 H new ATOM 1042 N ARG A 73 1.201 -4.495 -3.184 1.00 0.24 N ATOM 1043 CA ARG A 73 0.982 -4.840 -4.590 1.00 0.24 C ATOM 1044 C ARG A 73 -0.410 -5.411 -4.765 1.00 0.21 C ATOM 1045 O ARG A 73 -0.914 -6.044 -3.856 1.00 0.24 O ATOM 1046 CB ARG A 73 1.979 -5.902 -5.052 1.00 0.28 C ATOM 1047 CG ARG A 73 1.689 -7.285 -4.477 1.00 0.43 C ATOM 1048 CD ARG A 73 2.276 -8.387 -5.351 1.00 0.58 C ATOM 1049 NE ARG A 73 1.805 -9.706 -4.937 1.00 0.91 N ATOM 1050 CZ ARG A 73 2.533 -10.823 -4.968 1.00 1.04 C ATOM 1051 NH1 ARG A 73 3.777 -10.807 -5.437 1.00 1.27 N ATOM 1052 NH2 ARG A 73 2.001 -11.961 -4.539 1.00 1.67 N ATOM 0 H ARG A 73 0.896 -5.210 -2.524 1.00 0.24 H new ATOM 0 HA ARG A 73 1.109 -3.932 -5.179 1.00 0.24 H new ATOM 0 HB2 ARG A 73 1.964 -5.957 -6.141 1.00 0.28 H new ATOM 0 HB3 ARG A 73 2.985 -5.598 -4.762 1.00 0.28 H new ATOM 0 HG2 ARG A 73 2.104 -7.357 -3.472 1.00 0.43 H new ATOM 0 HG3 ARG A 73 0.612 -7.425 -4.388 1.00 0.43 H new ATOM 0 HD2 ARG A 73 2.003 -8.212 -6.392 1.00 0.58 H new ATOM 0 HD3 ARG A 73 3.364 -8.355 -5.297 1.00 0.58 H new ATOM 0 HE ARG A 73 0.846 -9.778 -4.598 1.00 0.91 H new ATOM 0 HH11 ARG A 73 4.183 -9.935 -5.777 1.00 1.27 H new ATOM 0 HH12 ARG A 73 4.326 -11.667 -5.457 1.00 1.27 H new ATOM 0 HH21 ARG A 73 1.043 -11.976 -4.189 1.00 1.67 H new ATOM 0 HH22 ARG A 73 2.550 -12.820 -4.559 1.00 1.67 H new ATOM 1066 N ILE A 74 -1.046 -5.189 -5.904 1.00 0.22 N ATOM 1067 CA ILE A 74 -2.254 -5.920 -6.211 1.00 0.24 C ATOM 1068 C ILE A 74 -1.911 -7.250 -6.873 1.00 0.27 C ATOM 1069 O ILE A 74 -1.143 -7.300 -7.829 1.00 0.30 O ATOM 1070 CB ILE A 74 -3.238 -5.125 -7.080 1.00 0.31 C ATOM 1071 CG1 ILE A 74 -2.603 -4.690 -8.403 1.00 1.14 C ATOM 1072 CG2 ILE A 74 -3.754 -3.920 -6.315 1.00 1.30 C ATOM 1073 CD1 ILE A 74 -3.532 -3.872 -9.276 1.00 1.81 C ATOM 0 H ILE A 74 -0.750 -4.521 -6.616 1.00 0.22 H new ATOM 0 HA ILE A 74 -2.759 -6.102 -5.263 1.00 0.24 H new ATOM 0 HB ILE A 74 -4.075 -5.780 -7.321 1.00 0.31 H new ATOM 0 HG12 ILE A 74 -1.707 -4.107 -8.193 1.00 1.14 H new ATOM 0 HG13 ILE A 74 -2.285 -5.576 -8.953 1.00 1.14 H new ATOM 0 HG21 ILE A 74 -4.451 -3.363 -6.941 1.00 1.30 H new ATOM 0 HG22 ILE A 74 -4.264 -4.254 -5.412 1.00 1.30 H new ATOM 0 HG23 ILE A 74 -2.917 -3.277 -6.043 1.00 1.30 H new ATOM 0 HD11 ILE A 74 -3.018 -3.597 -10.197 1.00 1.81 H new ATOM 0 HD12 ILE A 74 -4.418 -4.460 -9.516 1.00 1.81 H new ATOM 0 HD13 ILE A 74 -3.830 -2.969 -8.744 1.00 1.81 H new ATOM 1085 N SER A 75 -2.455 -8.320 -6.316 1.00 0.30 N ATOM 1086 CA SER A 75 -2.209 -9.690 -6.768 1.00 0.38 C ATOM 1087 C SER A 75 -2.375 -9.873 -8.286 1.00 0.44 C ATOM 1088 O SER A 75 -1.800 -10.795 -8.870 1.00 0.50 O ATOM 1089 CB SER A 75 -3.166 -10.633 -6.038 1.00 0.47 C ATOM 1090 OG SER A 75 -3.272 -10.290 -4.666 1.00 1.16 O ATOM 0 H SER A 75 -3.093 -8.265 -5.522 1.00 0.30 H new ATOM 0 HA SER A 75 -1.169 -9.921 -6.537 1.00 0.38 H new ATOM 0 HB2 SER A 75 -4.150 -10.590 -6.504 1.00 0.47 H new ATOM 0 HB3 SER A 75 -2.813 -11.660 -6.133 1.00 0.47 H new ATOM 0 HG SER A 75 -3.890 -10.907 -4.221 1.00 1.16 H new ATOM 1096 N LYS A 76 -3.165 -9.011 -8.919 1.00 0.45 N ATOM 1097 CA LYS A 76 -3.593 -9.244 -10.295 1.00 0.54 C ATOM 1098 C LYS A 76 -2.551 -8.829 -11.335 1.00 0.55 C ATOM 1099 O LYS A 76 -2.074 -9.660 -12.111 1.00 0.61 O ATOM 1100 CB LYS A 76 -4.875 -8.444 -10.526 1.00 0.60 C ATOM 1101 CG LYS A 76 -6.103 -9.066 -9.881 1.00 1.21 C ATOM 1102 CD LYS A 76 -6.441 -10.392 -10.533 1.00 1.70 C ATOM 1103 CE LYS A 76 -7.593 -11.091 -9.835 1.00 2.16 C ATOM 1104 NZ LYS A 76 -7.925 -12.380 -10.491 1.00 2.51 N ATOM 0 H LYS A 76 -3.520 -8.149 -8.504 1.00 0.45 H new ATOM 0 HA LYS A 76 -3.746 -10.316 -10.420 1.00 0.54 H new ATOM 0 HB2 LYS A 76 -4.740 -7.436 -10.134 1.00 0.60 H new ATOM 0 HB3 LYS A 76 -5.046 -8.349 -11.598 1.00 0.60 H new ATOM 0 HG2 LYS A 76 -5.924 -9.215 -8.816 1.00 1.21 H new ATOM 0 HG3 LYS A 76 -6.950 -8.386 -9.970 1.00 1.21 H new ATOM 0 HD2 LYS A 76 -6.698 -10.227 -11.579 1.00 1.70 H new ATOM 0 HD3 LYS A 76 -5.563 -11.038 -10.518 1.00 1.70 H new ATOM 0 HE2 LYS A 76 -7.333 -11.269 -8.791 1.00 2.16 H new ATOM 0 HE3 LYS A 76 -8.469 -10.443 -9.839 1.00 2.16 H new ATOM 0 HZ1 LYS A 76 -8.716 -12.831 -9.989 1.00 2.51 H new ATOM 0 HZ2 LYS A 76 -8.196 -12.207 -11.480 1.00 2.51 H new ATOM 0 HZ3 LYS A 76 -7.096 -13.007 -10.464 1.00 2.51 H new ATOM 1118 N THR A 77 -2.195 -7.561 -11.347 1.00 0.51 N ATOM 1119 CA THR A 77 -1.156 -7.052 -12.231 1.00 0.53 C ATOM 1120 C THR A 77 0.000 -6.546 -11.385 1.00 0.47 C ATOM 1121 O THR A 77 -0.145 -6.430 -10.172 1.00 0.46 O ATOM 1122 CB THR A 77 -1.706 -5.946 -13.164 1.00 0.62 C ATOM 1123 OG1 THR A 77 -0.666 -5.425 -14.000 1.00 1.45 O ATOM 1124 CG2 THR A 77 -2.339 -4.819 -12.370 1.00 1.29 C ATOM 0 H THR A 77 -2.615 -6.851 -10.746 1.00 0.51 H new ATOM 0 HA THR A 77 -0.802 -7.855 -12.877 1.00 0.53 H new ATOM 0 HB THR A 77 -2.474 -6.399 -13.791 1.00 0.62 H new ATOM 0 HG1 THR A 77 -1.033 -4.729 -14.583 1.00 1.45 H new ATOM 0 HG21 THR A 77 -2.715 -4.059 -13.054 1.00 1.29 H new ATOM 0 HG22 THR A 77 -3.163 -5.212 -11.775 1.00 1.29 H new ATOM 0 HG23 THR A 77 -1.594 -4.376 -11.710 1.00 1.29 H new ATOM 1132 N GLN A 78 1.129 -6.205 -11.983 1.00 0.50 N ATOM 1133 CA GLN A 78 2.238 -5.753 -11.169 1.00 0.49 C ATOM 1134 C GLN A 78 2.313 -4.233 -11.195 1.00 0.46 C ATOM 1135 O GLN A 78 3.222 -3.613 -11.754 1.00 0.48 O ATOM 1136 CB GLN A 78 3.563 -6.393 -11.633 1.00 0.59 C ATOM 1137 CG GLN A 78 4.004 -6.073 -13.067 1.00 1.49 C ATOM 1138 CD GLN A 78 3.110 -6.667 -14.141 1.00 2.14 C ATOM 1139 OE1 GLN A 78 2.173 -5.877 -14.642 1.00 2.69 O flip ATOM 1140 NE2 GLN A 78 3.289 -7.815 -14.549 1.00 2.90 N flip ATOM 0 H GLN A 78 1.297 -6.231 -12.989 1.00 0.50 H new ATOM 0 HA GLN A 78 2.072 -6.071 -10.140 1.00 0.49 H new ATOM 0 HB2 GLN A 78 4.353 -6.076 -10.953 1.00 0.59 H new ATOM 0 HB3 GLN A 78 3.474 -7.475 -11.535 1.00 0.59 H new ATOM 0 HG2 GLN A 78 4.034 -4.991 -13.193 1.00 1.49 H new ATOM 0 HG3 GLN A 78 5.020 -6.439 -13.213 1.00 1.49 H new ATOM 0 HE21 GLN A 78 4.021 -8.394 -14.138 1.00 2.90 H new ATOM 0 HE22 GLN A 78 2.705 -8.187 -15.298 1.00 2.90 H new ATOM 1149 N LEU A 79 1.329 -3.653 -10.530 1.00 0.46 N ATOM 1150 CA LEU A 79 1.314 -2.247 -10.201 1.00 0.45 C ATOM 1151 C LEU A 79 1.724 -2.102 -8.752 1.00 0.42 C ATOM 1152 O LEU A 79 1.009 -2.581 -7.865 1.00 0.54 O ATOM 1153 CB LEU A 79 -0.086 -1.662 -10.413 1.00 0.59 C ATOM 1154 CG LEU A 79 -0.668 -1.845 -11.816 1.00 0.95 C ATOM 1155 CD1 LEU A 79 -2.101 -1.343 -11.871 1.00 1.95 C ATOM 1156 CD2 LEU A 79 0.184 -1.125 -12.849 1.00 1.61 C ATOM 0 H LEU A 79 0.507 -4.158 -10.200 1.00 0.46 H new ATOM 0 HA LEU A 79 2.005 -1.705 -10.847 1.00 0.45 H new ATOM 0 HB2 LEU A 79 -0.765 -2.120 -9.694 1.00 0.59 H new ATOM 0 HB3 LEU A 79 -0.054 -0.596 -10.188 1.00 0.59 H new ATOM 0 HG LEU A 79 -0.665 -2.910 -12.048 1.00 0.95 H new ATOM 0 HD11 LEU A 79 -2.497 -1.482 -12.877 1.00 1.95 H new ATOM 0 HD12 LEU A 79 -2.710 -1.902 -11.161 1.00 1.95 H new ATOM 0 HD13 LEU A 79 -2.126 -0.284 -11.615 1.00 1.95 H new ATOM 0 HD21 LEU A 79 -0.247 -1.268 -13.840 1.00 1.61 H new ATOM 0 HD22 LEU A 79 0.215 -0.060 -12.617 1.00 1.61 H new ATOM 0 HD23 LEU A 79 1.196 -1.530 -12.832 1.00 1.61 H new ATOM 1168 N TYR A 80 2.853 -1.484 -8.482 1.00 0.34 N ATOM 1169 CA TYR A 80 3.244 -1.311 -7.106 1.00 0.38 C ATOM 1170 C TYR A 80 3.046 0.135 -6.716 1.00 0.34 C ATOM 1171 O TYR A 80 3.010 1.020 -7.563 1.00 0.45 O ATOM 1172 CB TYR A 80 4.655 -1.897 -6.813 1.00 0.60 C ATOM 1173 CG TYR A 80 5.906 -1.020 -6.938 1.00 1.27 C ATOM 1174 CD1 TYR A 80 5.876 0.364 -7.035 1.00 2.27 C ATOM 1175 CD2 TYR A 80 7.157 -1.630 -6.902 1.00 1.56 C ATOM 1176 CE1 TYR A 80 7.039 1.105 -7.095 1.00 3.30 C ATOM 1177 CE2 TYR A 80 8.322 -0.897 -6.968 1.00 2.49 C ATOM 1178 CZ TYR A 80 8.258 0.469 -7.062 1.00 3.33 C ATOM 1179 OH TYR A 80 9.417 1.204 -7.120 1.00 4.39 O ATOM 0 H TYR A 80 3.497 -1.104 -9.175 1.00 0.34 H new ATOM 0 HA TYR A 80 2.598 -1.900 -6.455 1.00 0.38 H new ATOM 0 HB2 TYR A 80 4.636 -2.286 -5.795 1.00 0.60 H new ATOM 0 HB3 TYR A 80 4.793 -2.750 -7.478 1.00 0.60 H new ATOM 0 HD1 TYR A 80 4.923 0.872 -7.064 1.00 2.27 H new ATOM 0 HD2 TYR A 80 7.216 -2.705 -6.820 1.00 1.56 H new ATOM 0 HE1 TYR A 80 6.992 2.182 -7.168 1.00 3.30 H new ATOM 0 HE2 TYR A 80 9.280 -1.396 -6.946 1.00 2.49 H new ATOM 0 HH TYR A 80 10.007 0.831 -7.808 1.00 4.39 H new ATOM 1189 N VAL A 81 2.879 0.364 -5.445 1.00 0.32 N ATOM 1190 CA VAL A 81 2.464 1.667 -4.958 1.00 0.32 C ATOM 1191 C VAL A 81 3.652 2.603 -4.841 1.00 0.32 C ATOM 1192 O VAL A 81 4.597 2.319 -4.117 1.00 0.36 O ATOM 1193 CB VAL A 81 1.760 1.573 -3.593 1.00 0.36 C ATOM 1194 CG1 VAL A 81 1.146 2.913 -3.211 1.00 0.46 C ATOM 1195 CG2 VAL A 81 0.700 0.481 -3.607 1.00 0.38 C ATOM 0 H VAL A 81 3.023 -0.334 -4.715 1.00 0.32 H new ATOM 0 HA VAL A 81 1.756 2.063 -5.686 1.00 0.32 H new ATOM 0 HB VAL A 81 2.507 1.313 -2.843 1.00 0.36 H new ATOM 0 HG11 VAL A 81 0.653 2.825 -2.243 1.00 0.46 H new ATOM 0 HG12 VAL A 81 1.929 3.669 -3.152 1.00 0.46 H new ATOM 0 HG13 VAL A 81 0.415 3.206 -3.965 1.00 0.46 H new ATOM 0 HG21 VAL A 81 0.215 0.432 -2.632 1.00 0.38 H new ATOM 0 HG22 VAL A 81 -0.044 0.706 -4.371 1.00 0.38 H new ATOM 0 HG23 VAL A 81 1.169 -0.478 -3.828 1.00 0.38 H new ATOM 1205 N THR A 82 3.608 3.696 -5.580 1.00 0.32 N ATOM 1206 CA THR A 82 4.667 4.684 -5.541 1.00 0.32 C ATOM 1207 C THR A 82 4.253 5.825 -4.634 1.00 0.31 C ATOM 1208 O THR A 82 3.072 6.166 -4.527 1.00 0.32 O ATOM 1209 CB THR A 82 4.992 5.249 -6.948 1.00 0.32 C ATOM 1210 OG1 THR A 82 6.342 5.687 -7.017 1.00 1.22 O ATOM 1211 CG2 THR A 82 4.117 6.430 -7.304 1.00 1.37 C ATOM 0 H THR A 82 2.845 3.922 -6.218 1.00 0.32 H new ATOM 0 HA THR A 82 5.563 4.193 -5.162 1.00 0.32 H new ATOM 0 HB THR A 82 4.810 4.434 -7.649 1.00 0.32 H new ATOM 0 HG1 THR A 82 6.527 6.038 -7.913 1.00 1.22 H new ATOM 0 HG21 THR A 82 4.381 6.792 -8.298 1.00 1.37 H new ATOM 0 HG22 THR A 82 3.071 6.124 -7.295 1.00 1.37 H new ATOM 0 HG23 THR A 82 4.268 7.227 -6.576 1.00 1.37 H new ATOM 1219 N ALA A 83 5.219 6.371 -3.949 1.00 0.33 N ATOM 1220 CA ALA A 83 4.976 7.519 -3.099 1.00 0.32 C ATOM 1221 C ALA A 83 5.456 8.805 -3.768 1.00 0.27 C ATOM 1222 O ALA A 83 6.636 8.943 -4.095 1.00 0.31 O ATOM 1223 CB ALA A 83 5.644 7.317 -1.752 1.00 0.41 C ATOM 0 H ALA A 83 6.185 6.044 -3.958 1.00 0.33 H new ATOM 0 HA ALA A 83 3.902 7.616 -2.940 1.00 0.32 H new ATOM 0 HB1 ALA A 83 5.456 8.184 -1.119 1.00 0.41 H new ATOM 0 HB2 ALA A 83 5.238 6.425 -1.275 1.00 0.41 H new ATOM 0 HB3 ALA A 83 6.718 7.196 -1.893 1.00 0.41 H new ATOM 1229 N GLN A 84 4.528 9.737 -3.981 1.00 0.25 N ATOM 1230 CA GLN A 84 4.834 11.004 -4.644 1.00 0.26 C ATOM 1231 C GLN A 84 5.135 12.102 -3.616 1.00 0.25 C ATOM 1232 O GLN A 84 6.143 12.032 -2.924 1.00 0.28 O ATOM 1233 CB GLN A 84 3.713 11.422 -5.601 1.00 0.33 C ATOM 1234 CG GLN A 84 4.145 12.476 -6.615 1.00 0.77 C ATOM 1235 CD GLN A 84 5.364 12.046 -7.416 1.00 1.32 C ATOM 1236 OE1 GLN A 84 5.241 11.405 -8.459 1.00 2.05 O ATOM 1237 NE2 GLN A 84 6.548 12.412 -6.952 1.00 2.02 N ATOM 0 H GLN A 84 3.552 9.637 -3.702 1.00 0.25 H new ATOM 0 HA GLN A 84 5.731 10.857 -5.245 1.00 0.26 H new ATOM 0 HB2 GLN A 84 3.353 10.542 -6.134 1.00 0.33 H new ATOM 0 HB3 GLN A 84 2.875 11.808 -5.021 1.00 0.33 H new ATOM 0 HG2 GLN A 84 3.319 12.680 -7.297 1.00 0.77 H new ATOM 0 HG3 GLN A 84 4.366 13.408 -6.094 1.00 0.77 H new ATOM 0 HE21 GLN A 84 6.614 12.943 -6.084 1.00 2.02 H new ATOM 0 HE22 GLN A 84 7.395 12.163 -7.463 1.00 2.02 H new ATOM 1246 N ASP A 85 4.295 13.132 -3.529 1.00 0.24 N ATOM 1247 CA ASP A 85 4.554 14.212 -2.568 1.00 0.28 C ATOM 1248 C ASP A 85 3.268 14.763 -1.958 1.00 0.26 C ATOM 1249 O ASP A 85 2.509 15.469 -2.622 1.00 0.27 O ATOM 1250 CB ASP A 85 5.323 15.349 -3.239 1.00 0.34 C ATOM 1251 CG ASP A 85 5.831 16.374 -2.247 1.00 0.44 C ATOM 1252 OD1 ASP A 85 6.957 16.213 -1.730 1.00 0.53 O ATOM 1253 OD2 ASP A 85 5.093 17.342 -1.970 1.00 0.56 O ATOM 0 H ASP A 85 3.452 13.245 -4.092 1.00 0.24 H new ATOM 0 HA ASP A 85 5.152 13.783 -1.764 1.00 0.28 H new ATOM 0 HB2 ASP A 85 6.166 14.935 -3.792 1.00 0.34 H new ATOM 0 HB3 ASP A 85 4.676 15.841 -3.965 1.00 0.34 H new ATOM 1258 N GLU A 86 3.050 14.430 -0.684 1.00 0.27 N ATOM 1259 CA GLU A 86 1.908 14.910 0.096 1.00 0.29 C ATOM 1260 C GLU A 86 0.614 14.695 -0.689 1.00 0.22 C ATOM 1261 O GLU A 86 0.486 13.654 -1.299 1.00 0.19 O ATOM 1262 CB GLU A 86 2.136 16.361 0.517 1.00 0.40 C ATOM 1263 CG GLU A 86 1.070 16.917 1.452 1.00 0.51 C ATOM 1264 CD GLU A 86 1.507 18.172 2.174 1.00 0.78 C ATOM 1265 OE1 GLU A 86 1.984 19.105 1.495 1.00 1.62 O ATOM 1266 OE2 GLU A 86 1.373 18.234 3.411 1.00 1.04 O ATOM 0 H GLU A 86 3.669 13.812 -0.159 1.00 0.27 H new ATOM 0 HA GLU A 86 1.809 14.335 1.017 1.00 0.29 H new ATOM 0 HB2 GLU A 86 3.107 16.437 1.006 1.00 0.40 H new ATOM 0 HB3 GLU A 86 2.180 16.984 -0.377 1.00 0.40 H new ATOM 0 HG2 GLU A 86 0.168 17.131 0.878 1.00 0.51 H new ATOM 0 HG3 GLU A 86 0.807 16.156 2.187 1.00 0.51 H new ATOM 1273 N ASP A 87 -0.313 15.657 -0.742 1.00 0.22 N ATOM 1274 CA ASP A 87 -1.573 15.434 -1.438 1.00 0.20 C ATOM 1275 C ASP A 87 -1.339 15.389 -2.938 1.00 0.23 C ATOM 1276 O ASP A 87 -1.592 16.344 -3.675 1.00 0.30 O ATOM 1277 CB ASP A 87 -2.617 16.497 -1.092 1.00 0.28 C ATOM 1278 CG ASP A 87 -4.023 16.057 -1.479 1.00 0.33 C ATOM 1279 OD1 ASP A 87 -4.335 16.004 -2.687 1.00 0.61 O ATOM 1280 OD2 ASP A 87 -4.823 15.746 -0.572 1.00 0.56 O ATOM 0 H ASP A 87 -0.213 16.579 -0.318 1.00 0.22 H new ATOM 0 HA ASP A 87 -1.968 14.474 -1.105 1.00 0.20 H new ATOM 0 HB2 ASP A 87 -2.583 16.705 -0.023 1.00 0.28 H new ATOM 0 HB3 ASP A 87 -2.373 17.427 -1.606 1.00 0.28 H new ATOM 1285 N GLN A 88 -0.838 14.251 -3.352 1.00 0.19 N ATOM 1286 CA GLN A 88 -0.704 13.868 -4.738 1.00 0.24 C ATOM 1287 C GLN A 88 -0.876 12.377 -4.743 1.00 0.21 C ATOM 1288 O GLN A 88 -0.132 11.677 -4.063 1.00 0.19 O ATOM 1289 CB GLN A 88 0.674 14.240 -5.309 1.00 0.32 C ATOM 1290 CG GLN A 88 0.887 15.730 -5.523 1.00 1.03 C ATOM 1291 CD GLN A 88 2.237 16.041 -6.142 1.00 1.28 C ATOM 1292 OE1 GLN A 88 3.224 16.256 -5.440 1.00 1.89 O ATOM 1293 NE2 GLN A 88 2.292 16.063 -7.464 1.00 1.93 N ATOM 0 H GLN A 88 -0.499 13.537 -2.707 1.00 0.19 H new ATOM 0 HA GLN A 88 -1.436 14.384 -5.359 1.00 0.24 H new ATOM 0 HB2 GLN A 88 1.445 13.869 -4.634 1.00 0.32 H new ATOM 0 HB3 GLN A 88 0.810 13.726 -6.261 1.00 0.32 H new ATOM 0 HG2 GLN A 88 0.098 16.118 -6.167 1.00 1.03 H new ATOM 0 HG3 GLN A 88 0.801 16.247 -4.567 1.00 1.03 H new ATOM 0 HE21 GLN A 88 1.452 15.880 -8.013 1.00 1.93 H new ATOM 0 HE22 GLN A 88 3.175 16.263 -7.934 1.00 1.93 H new ATOM 1302 N PRO A 89 -1.857 11.862 -5.478 1.00 0.24 N ATOM 1303 CA PRO A 89 -2.294 10.489 -5.293 1.00 0.24 C ATOM 1304 C PRO A 89 -1.173 9.505 -5.536 1.00 0.21 C ATOM 1305 O PRO A 89 -0.278 9.752 -6.344 1.00 0.22 O ATOM 1306 CB PRO A 89 -3.399 10.313 -6.344 1.00 0.33 C ATOM 1307 CG PRO A 89 -3.204 11.428 -7.317 1.00 0.58 C ATOM 1308 CD PRO A 89 -2.604 12.558 -6.534 1.00 0.33 C ATOM 0 HA PRO A 89 -2.632 10.301 -4.274 1.00 0.24 H new ATOM 0 HB2 PRO A 89 -3.321 9.344 -6.837 1.00 0.33 H new ATOM 0 HB3 PRO A 89 -4.387 10.360 -5.886 1.00 0.33 H new ATOM 0 HG2 PRO A 89 -2.546 11.125 -8.131 1.00 0.58 H new ATOM 0 HG3 PRO A 89 -4.152 11.724 -7.766 1.00 0.58 H new ATOM 0 HD2 PRO A 89 -1.951 13.176 -7.151 1.00 0.33 H new ATOM 0 HD3 PRO A 89 -3.369 13.216 -6.122 1.00 0.33 H new ATOM 1316 N VAL A 90 -1.219 8.398 -4.814 1.00 0.23 N ATOM 1317 CA VAL A 90 -0.244 7.349 -4.994 1.00 0.24 C ATOM 1318 C VAL A 90 -0.331 6.830 -6.425 1.00 0.24 C ATOM 1319 O VAL A 90 -1.410 6.511 -6.929 1.00 0.28 O ATOM 1320 CB VAL A 90 -0.449 6.207 -3.966 1.00 0.36 C ATOM 1321 CG1 VAL A 90 -0.442 6.769 -2.557 1.00 1.31 C ATOM 1322 CG2 VAL A 90 -1.736 5.439 -4.221 1.00 1.10 C ATOM 0 H VAL A 90 -1.922 8.208 -4.100 1.00 0.23 H new ATOM 0 HA VAL A 90 0.753 7.753 -4.820 1.00 0.24 H new ATOM 0 HB VAL A 90 0.378 5.506 -4.080 1.00 0.36 H new ATOM 0 HG11 VAL A 90 -0.587 5.959 -1.842 1.00 1.31 H new ATOM 0 HG12 VAL A 90 0.514 7.257 -2.365 1.00 1.31 H new ATOM 0 HG13 VAL A 90 -1.248 7.495 -2.451 1.00 1.31 H new ATOM 0 HG21 VAL A 90 -1.841 4.648 -3.478 1.00 1.10 H new ATOM 0 HG22 VAL A 90 -2.585 6.118 -4.150 1.00 1.10 H new ATOM 0 HG23 VAL A 90 -1.706 4.999 -5.218 1.00 1.10 H new ATOM 1332 N LEU A 91 0.806 6.799 -7.093 1.00 0.22 N ATOM 1333 CA LEU A 91 0.843 6.530 -8.506 1.00 0.24 C ATOM 1334 C LEU A 91 1.202 5.079 -8.689 1.00 0.26 C ATOM 1335 O LEU A 91 1.939 4.522 -7.884 1.00 0.33 O ATOM 1336 CB LEU A 91 1.843 7.446 -9.221 1.00 0.30 C ATOM 1337 CG LEU A 91 1.681 8.945 -8.936 1.00 0.31 C ATOM 1338 CD1 LEU A 91 2.771 9.733 -9.641 1.00 0.42 C ATOM 1339 CD2 LEU A 91 0.309 9.432 -9.379 1.00 0.34 C ATOM 0 H LEU A 91 1.720 6.959 -6.670 1.00 0.22 H new ATOM 0 HA LEU A 91 -0.132 6.732 -8.950 1.00 0.24 H new ATOM 0 HB2 LEU A 91 2.852 7.146 -8.937 1.00 0.30 H new ATOM 0 HB3 LEU A 91 1.753 7.286 -10.295 1.00 0.30 H new ATOM 0 HG LEU A 91 1.770 9.103 -7.861 1.00 0.31 H new ATOM 0 HD11 LEU A 91 2.646 10.795 -9.431 1.00 0.42 H new ATOM 0 HD12 LEU A 91 3.747 9.405 -9.283 1.00 0.42 H new ATOM 0 HD13 LEU A 91 2.704 9.565 -10.716 1.00 0.42 H new ATOM 0 HD21 LEU A 91 0.215 10.497 -9.168 1.00 0.34 H new ATOM 0 HD22 LEU A 91 0.191 9.263 -10.449 1.00 0.34 H new ATOM 0 HD23 LEU A 91 -0.463 8.886 -8.838 1.00 0.34 H new ATOM 1351 N LEU A 92 0.681 4.438 -9.699 1.00 0.27 N ATOM 1352 CA LEU A 92 0.892 3.022 -9.811 1.00 0.28 C ATOM 1353 C LEU A 92 2.105 2.797 -10.675 1.00 0.29 C ATOM 1354 O LEU A 92 2.085 2.899 -11.900 1.00 0.31 O ATOM 1355 CB LEU A 92 -0.346 2.317 -10.368 1.00 0.32 C ATOM 1356 CG LEU A 92 -1.562 2.334 -9.434 1.00 0.76 C ATOM 1357 CD1 LEU A 92 -2.746 1.630 -10.071 1.00 1.15 C ATOM 1358 CD2 LEU A 92 -1.218 1.685 -8.102 1.00 1.30 C ATOM 0 H LEU A 92 0.121 4.861 -10.439 1.00 0.27 H new ATOM 0 HA LEU A 92 1.065 2.591 -8.825 1.00 0.28 H new ATOM 0 HB2 LEU A 92 -0.622 2.787 -11.312 1.00 0.32 H new ATOM 0 HB3 LEU A 92 -0.089 1.281 -10.591 1.00 0.32 H new ATOM 0 HG LEU A 92 -1.838 3.374 -9.257 1.00 0.76 H new ATOM 0 HD11 LEU A 92 -3.595 1.656 -9.388 1.00 1.15 H new ATOM 0 HD12 LEU A 92 -3.012 2.134 -11.000 1.00 1.15 H new ATOM 0 HD13 LEU A 92 -2.482 0.594 -10.283 1.00 1.15 H new ATOM 0 HD21 LEU A 92 -2.092 1.705 -7.451 1.00 1.30 H new ATOM 0 HD22 LEU A 92 -0.914 0.652 -8.269 1.00 1.30 H new ATOM 0 HD23 LEU A 92 -0.402 2.232 -7.631 1.00 1.30 H new ATOM 1370 N LYS A 93 3.179 2.517 -9.959 1.00 0.31 N ATOM 1371 CA LYS A 93 4.505 2.412 -10.493 1.00 0.37 C ATOM 1372 C LYS A 93 4.718 0.966 -10.867 1.00 0.38 C ATOM 1373 O LYS A 93 4.634 0.081 -10.015 1.00 0.39 O ATOM 1374 CB LYS A 93 5.531 2.826 -9.420 1.00 0.46 C ATOM 1375 CG LYS A 93 6.894 3.152 -9.969 1.00 1.29 C ATOM 1376 CD LYS A 93 6.882 4.480 -10.711 1.00 2.11 C ATOM 1377 CE LYS A 93 8.242 4.818 -11.297 1.00 2.85 C ATOM 1378 NZ LYS A 93 8.669 3.829 -12.320 1.00 3.26 N ATOM 0 H LYS A 93 3.139 2.352 -8.953 1.00 0.31 H new ATOM 0 HA LYS A 93 4.630 3.062 -11.359 1.00 0.37 H new ATOM 0 HB2 LYS A 93 5.150 3.695 -8.883 1.00 0.46 H new ATOM 0 HB3 LYS A 93 5.627 2.019 -8.693 1.00 0.46 H new ATOM 0 HG2 LYS A 93 7.617 3.193 -9.155 1.00 1.29 H new ATOM 0 HG3 LYS A 93 7.218 2.358 -10.643 1.00 1.29 H new ATOM 0 HD2 LYS A 93 6.142 4.442 -11.511 1.00 2.11 H new ATOM 0 HD3 LYS A 93 6.574 5.273 -10.030 1.00 2.11 H new ATOM 0 HE2 LYS A 93 8.207 5.811 -11.745 1.00 2.85 H new ATOM 0 HE3 LYS A 93 8.982 4.855 -10.498 1.00 2.85 H new ATOM 0 HZ1 LYS A 93 9.504 4.190 -12.825 1.00 3.26 H new ATOM 0 HZ2 LYS A 93 8.908 2.930 -11.855 1.00 3.26 H new ATOM 0 HZ3 LYS A 93 7.895 3.674 -12.997 1.00 3.26 H new ATOM 1392 N GLU A 94 4.985 0.707 -12.129 1.00 0.43 N ATOM 1393 CA GLU A 94 4.859 -0.642 -12.618 1.00 0.47 C ATOM 1394 C GLU A 94 6.198 -1.335 -12.546 1.00 0.52 C ATOM 1395 O GLU A 94 7.034 -1.248 -13.444 1.00 0.62 O ATOM 1396 CB GLU A 94 4.349 -0.618 -14.059 1.00 0.56 C ATOM 1397 CG GLU A 94 3.075 0.195 -14.230 1.00 1.38 C ATOM 1398 CD GLU A 94 2.651 0.330 -15.676 1.00 1.76 C ATOM 1399 OE1 GLU A 94 2.044 -0.625 -16.214 1.00 2.33 O ATOM 1400 OE2 GLU A 94 2.923 1.387 -16.284 1.00 2.05 O ATOM 0 H GLU A 94 5.284 1.397 -12.818 1.00 0.43 H new ATOM 0 HA GLU A 94 4.147 -1.190 -12.001 1.00 0.47 H new ATOM 0 HB2 GLU A 94 5.124 -0.207 -14.705 1.00 0.56 H new ATOM 0 HB3 GLU A 94 4.167 -1.640 -14.390 1.00 0.56 H new ATOM 0 HG2 GLU A 94 2.271 -0.275 -13.664 1.00 1.38 H new ATOM 0 HG3 GLU A 94 3.224 1.188 -13.806 1.00 1.38 H new ATOM 1407 N MET A 95 6.373 -2.015 -11.428 1.00 0.50 N ATOM 1408 CA MET A 95 7.546 -2.819 -11.166 1.00 0.59 C ATOM 1409 C MET A 95 7.143 -4.277 -11.048 1.00 0.66 C ATOM 1410 O MET A 95 6.380 -4.646 -10.155 1.00 0.65 O ATOM 1411 CB MET A 95 8.241 -2.344 -9.887 1.00 0.60 C ATOM 1412 CG MET A 95 9.386 -3.242 -9.436 1.00 1.21 C ATOM 1413 SD MET A 95 10.650 -3.456 -10.706 1.00 1.67 S ATOM 1414 CE MET A 95 11.072 -1.752 -11.059 1.00 2.39 C ATOM 0 H MET A 95 5.693 -2.023 -10.668 1.00 0.50 H new ATOM 0 HA MET A 95 8.249 -2.712 -11.992 1.00 0.59 H new ATOM 0 HB2 MET A 95 8.624 -1.336 -10.046 1.00 0.60 H new ATOM 0 HB3 MET A 95 7.504 -2.282 -9.086 1.00 0.60 H new ATOM 0 HG2 MET A 95 9.844 -2.818 -8.542 1.00 1.21 H new ATOM 0 HG3 MET A 95 8.988 -4.218 -9.158 1.00 1.21 H new ATOM 0 HE1 MET A 95 12.026 -1.715 -11.585 1.00 2.39 H new ATOM 0 HE2 MET A 95 10.296 -1.307 -11.682 1.00 2.39 H new ATOM 0 HE3 MET A 95 11.151 -1.196 -10.125 1.00 2.39 H new ATOM 1424 N PRO A 96 7.630 -5.120 -11.957 1.00 0.82 N ATOM 1425 CA PRO A 96 7.270 -6.532 -11.976 1.00 0.95 C ATOM 1426 C PRO A 96 7.931 -7.332 -10.859 1.00 0.93 C ATOM 1427 O PRO A 96 9.154 -7.323 -10.703 1.00 0.98 O ATOM 1428 CB PRO A 96 7.754 -6.991 -13.346 1.00 1.19 C ATOM 1429 CG PRO A 96 8.898 -6.094 -13.663 1.00 1.26 C ATOM 1430 CD PRO A 96 8.558 -4.766 -13.047 1.00 0.99 C ATOM 0 HA PRO A 96 6.203 -6.685 -11.812 1.00 0.95 H new ATOM 0 HB2 PRO A 96 8.064 -8.036 -13.327 1.00 1.19 H new ATOM 0 HB3 PRO A 96 6.965 -6.906 -14.093 1.00 1.19 H new ATOM 0 HG2 PRO A 96 9.829 -6.488 -13.255 1.00 1.26 H new ATOM 0 HG3 PRO A 96 9.036 -6.002 -14.740 1.00 1.26 H new ATOM 0 HD2 PRO A 96 9.446 -4.259 -12.669 1.00 0.99 H new ATOM 0 HD3 PRO A 96 8.092 -4.096 -13.769 1.00 0.99 H new ATOM 1438 N GLU A 97 7.087 -8.020 -10.101 1.00 0.98 N ATOM 1439 CA GLU A 97 7.493 -8.925 -9.028 1.00 1.06 C ATOM 1440 C GLU A 97 8.108 -8.191 -7.834 1.00 0.90 C ATOM 1441 O GLU A 97 8.818 -7.193 -7.964 1.00 0.88 O ATOM 1442 CB GLU A 97 8.444 -10.008 -9.535 1.00 1.32 C ATOM 1443 CG GLU A 97 8.478 -11.236 -8.638 1.00 1.84 C ATOM 1444 CD GLU A 97 7.090 -11.666 -8.203 1.00 2.42 C ATOM 1445 OE1 GLU A 97 6.449 -12.436 -8.950 1.00 2.74 O ATOM 1446 OE2 GLU A 97 6.640 -11.251 -7.112 1.00 3.15 O ATOM 0 H GLU A 97 6.075 -7.964 -10.217 1.00 0.98 H new ATOM 0 HA GLU A 97 6.578 -9.403 -8.677 1.00 1.06 H new ATOM 0 HB2 GLU A 97 8.144 -10.307 -10.539 1.00 1.32 H new ATOM 0 HB3 GLU A 97 9.449 -9.594 -9.613 1.00 1.32 H new ATOM 0 HG2 GLU A 97 8.962 -12.057 -9.167 1.00 1.84 H new ATOM 0 HG3 GLU A 97 9.084 -11.024 -7.757 1.00 1.84 H new ATOM 1453 N ILE A 98 7.792 -8.716 -6.666 1.00 1.08 N ATOM 1454 CA ILE A 98 8.212 -8.160 -5.391 1.00 1.17 C ATOM 1455 C ILE A 98 9.680 -8.483 -5.087 1.00 1.10 C ATOM 1456 O ILE A 98 10.094 -9.643 -5.165 1.00 1.29 O ATOM 1457 CB ILE A 98 7.302 -8.680 -4.265 1.00 1.61 C ATOM 1458 CG1 ILE A 98 5.847 -8.299 -4.549 1.00 2.25 C ATOM 1459 CG2 ILE A 98 7.739 -8.139 -2.922 1.00 2.35 C ATOM 1460 CD1 ILE A 98 5.633 -6.812 -4.769 1.00 3.20 C ATOM 0 H ILE A 98 7.224 -9.558 -6.573 1.00 1.08 H new ATOM 0 HA ILE A 98 8.123 -7.075 -5.452 1.00 1.17 H new ATOM 0 HB ILE A 98 7.383 -9.766 -4.231 1.00 1.61 H new ATOM 0 HG12 ILE A 98 5.506 -8.840 -5.432 1.00 2.25 H new ATOM 0 HG13 ILE A 98 5.226 -8.626 -3.715 1.00 2.25 H new ATOM 0 HG21 ILE A 98 7.079 -8.522 -2.143 1.00 2.35 H new ATOM 0 HG22 ILE A 98 8.762 -8.455 -2.718 1.00 2.35 H new ATOM 0 HG23 ILE A 98 7.691 -7.050 -2.935 1.00 2.35 H new ATOM 0 HD11 ILE A 98 4.578 -6.621 -4.964 1.00 3.20 H new ATOM 0 HD12 ILE A 98 5.942 -6.264 -3.879 1.00 3.20 H new ATOM 0 HD13 ILE A 98 6.225 -6.481 -5.622 1.00 3.20 H new ATOM 1472 N PRO A 99 10.484 -7.456 -4.759 1.00 1.08 N ATOM 1473 CA PRO A 99 11.928 -7.604 -4.534 1.00 1.14 C ATOM 1474 C PRO A 99 12.317 -8.220 -3.178 1.00 1.08 C ATOM 1475 O PRO A 99 11.623 -8.074 -2.175 1.00 1.15 O ATOM 1476 CB PRO A 99 12.434 -6.165 -4.618 1.00 1.38 C ATOM 1477 CG PRO A 99 11.289 -5.334 -4.160 1.00 1.61 C ATOM 1478 CD PRO A 99 10.044 -6.055 -4.598 1.00 1.28 C ATOM 0 HA PRO A 99 12.358 -8.296 -5.258 1.00 1.14 H new ATOM 0 HB2 PRO A 99 13.309 -6.016 -3.986 1.00 1.38 H new ATOM 0 HB3 PRO A 99 12.728 -5.908 -5.636 1.00 1.38 H new ATOM 0 HG2 PRO A 99 11.306 -5.211 -3.077 1.00 1.61 H new ATOM 0 HG3 PRO A 99 11.334 -4.336 -4.595 1.00 1.61 H new ATOM 0 HD2 PRO A 99 9.250 -5.968 -3.856 1.00 1.28 H new ATOM 0 HD3 PRO A 99 9.654 -5.649 -5.531 1.00 1.28 H new ATOM 1486 N LYS A 100 13.461 -8.898 -3.202 1.00 1.10 N ATOM 1487 CA LYS A 100 14.133 -9.478 -2.028 1.00 1.07 C ATOM 1488 C LYS A 100 15.236 -8.527 -1.578 1.00 1.03 C ATOM 1489 O LYS A 100 15.913 -8.711 -0.561 1.00 0.99 O ATOM 1490 CB LYS A 100 14.713 -10.857 -2.371 1.00 1.15 C ATOM 1491 CG LYS A 100 15.612 -10.856 -3.603 1.00 1.99 C ATOM 1492 CD LYS A 100 16.133 -12.248 -3.919 1.00 2.34 C ATOM 1493 CE LYS A 100 16.959 -12.262 -5.200 1.00 3.09 C ATOM 1494 NZ LYS A 100 18.169 -11.400 -5.105 1.00 3.70 N ATOM 0 H LYS A 100 13.970 -9.069 -4.069 1.00 1.10 H new ATOM 0 HA LYS A 100 13.414 -9.611 -1.219 1.00 1.07 H new ATOM 0 HB2 LYS A 100 15.282 -11.224 -1.517 1.00 1.15 H new ATOM 0 HB3 LYS A 100 13.893 -11.556 -2.532 1.00 1.15 H new ATOM 0 HG2 LYS A 100 15.056 -10.472 -4.459 1.00 1.99 H new ATOM 0 HG3 LYS A 100 16.452 -10.181 -3.440 1.00 1.99 H new ATOM 0 HD2 LYS A 100 16.742 -12.606 -3.089 1.00 2.34 H new ATOM 0 HD3 LYS A 100 15.294 -12.937 -4.019 1.00 2.34 H new ATOM 0 HE2 LYS A 100 17.262 -13.285 -5.423 1.00 3.09 H new ATOM 0 HE3 LYS A 100 16.340 -11.925 -6.032 1.00 3.09 H new ATOM 0 HZ1 LYS A 100 18.775 -11.559 -5.935 1.00 3.70 H new ATOM 0 HZ2 LYS A 100 17.882 -10.401 -5.072 1.00 3.70 H new ATOM 0 HZ3 LYS A 100 18.697 -11.637 -4.241 1.00 3.70 H new ATOM 1508 N THR A 101 15.460 -7.597 -2.464 1.00 1.10 N ATOM 1509 CA THR A 101 16.539 -6.698 -2.502 1.00 1.11 C ATOM 1510 C THR A 101 15.983 -5.306 -2.839 1.00 1.16 C ATOM 1511 O THR A 101 15.489 -5.121 -3.950 1.00 1.30 O ATOM 1512 CB THR A 101 17.436 -7.157 -3.643 1.00 1.30 C ATOM 1513 OG1 THR A 101 16.651 -7.884 -4.602 1.00 1.73 O ATOM 1514 CG2 THR A 101 18.587 -8.026 -3.175 1.00 1.92 C ATOM 0 H THR A 101 14.820 -7.450 -3.245 1.00 1.10 H new ATOM 0 HA THR A 101 17.081 -6.663 -1.557 1.00 1.11 H new ATOM 0 HB THR A 101 17.869 -6.263 -4.092 1.00 1.30 H new ATOM 0 HG1 THR A 101 17.226 -8.179 -5.339 1.00 1.73 H new ATOM 0 HG21 THR A 101 19.191 -8.322 -4.032 1.00 1.92 H new ATOM 0 HG22 THR A 101 19.204 -7.465 -2.473 1.00 1.92 H new ATOM 0 HG23 THR A 101 18.194 -8.916 -2.683 1.00 1.92 H new ATOM 1522 N ILE A 102 16.017 -4.320 -1.934 1.00 1.14 N ATOM 1523 CA ILE A 102 15.401 -3.049 -2.305 1.00 1.18 C ATOM 1524 C ILE A 102 16.488 -2.084 -2.631 1.00 1.22 C ATOM 1525 O ILE A 102 17.168 -1.590 -1.737 1.00 1.37 O ATOM 1526 CB ILE A 102 14.457 -2.435 -1.251 1.00 1.31 C ATOM 1527 CG1 ILE A 102 13.335 -3.416 -0.896 1.00 2.08 C ATOM 1528 CG2 ILE A 102 13.868 -1.128 -1.772 1.00 1.98 C ATOM 1529 CD1 ILE A 102 12.326 -2.863 0.090 1.00 2.69 C ATOM 0 H ILE A 102 16.434 -4.370 -1.004 1.00 1.14 H new ATOM 0 HA ILE A 102 14.759 -3.258 -3.160 1.00 1.18 H new ATOM 0 HB ILE A 102 15.033 -2.229 -0.349 1.00 1.31 H new ATOM 0 HG12 ILE A 102 12.815 -3.705 -1.810 1.00 2.08 H new ATOM 0 HG13 ILE A 102 13.776 -4.322 -0.480 1.00 2.08 H new ATOM 0 HG21 ILE A 102 13.203 -0.703 -1.020 1.00 1.98 H new ATOM 0 HG22 ILE A 102 14.673 -0.425 -1.983 1.00 1.98 H new ATOM 0 HG23 ILE A 102 13.306 -1.321 -2.686 1.00 1.98 H new ATOM 0 HD11 ILE A 102 11.564 -3.616 0.291 1.00 2.69 H new ATOM 0 HD12 ILE A 102 12.831 -2.601 1.019 1.00 2.69 H new ATOM 0 HD13 ILE A 102 11.856 -1.974 -0.330 1.00 2.69 H new ATOM 1541 N THR A 103 16.616 -1.774 -3.894 1.00 1.15 N ATOM 1542 CA THR A 103 17.803 -1.135 -4.374 1.00 1.20 C ATOM 1543 C THR A 103 17.453 0.146 -5.079 1.00 1.08 C ATOM 1544 O THR A 103 16.785 0.139 -6.106 1.00 1.05 O ATOM 1545 CB THR A 103 18.596 -2.084 -5.308 1.00 1.39 C ATOM 1546 OG1 THR A 103 19.743 -1.423 -5.854 1.00 1.58 O ATOM 1547 CG2 THR A 103 17.726 -2.636 -6.433 1.00 1.57 C ATOM 0 H THR A 103 15.909 -1.956 -4.607 1.00 1.15 H new ATOM 0 HA THR A 103 18.440 -0.896 -3.522 1.00 1.20 H new ATOM 0 HB THR A 103 18.928 -2.925 -4.699 1.00 1.39 H new ATOM 0 HG1 THR A 103 20.229 -2.041 -6.439 1.00 1.58 H new ATOM 0 HG21 THR A 103 18.322 -3.296 -7.063 1.00 1.57 H new ATOM 0 HG22 THR A 103 16.893 -3.195 -6.008 1.00 1.57 H new ATOM 0 HG23 THR A 103 17.341 -1.812 -7.033 1.00 1.57 H new ATOM 1555 N GLY A 104 18.014 1.216 -4.530 1.00 1.08 N ATOM 1556 CA GLY A 104 17.647 2.592 -4.863 1.00 1.03 C ATOM 1557 C GLY A 104 16.228 2.787 -5.383 1.00 0.92 C ATOM 1558 O GLY A 104 15.356 3.183 -4.630 1.00 0.84 O ATOM 0 H GLY A 104 18.751 1.154 -3.827 1.00 1.08 H new ATOM 0 HA2 GLY A 104 17.777 3.209 -3.974 1.00 1.03 H new ATOM 0 HA3 GLY A 104 18.344 2.964 -5.614 1.00 1.03 H new ATOM 1562 N SER A 105 15.989 2.502 -6.649 1.00 0.96 N ATOM 1563 CA SER A 105 14.767 2.912 -7.338 1.00 0.92 C ATOM 1564 C SER A 105 13.472 2.269 -6.800 1.00 0.81 C ATOM 1565 O SER A 105 12.388 2.755 -7.105 1.00 0.77 O ATOM 1566 CB SER A 105 14.918 2.637 -8.835 1.00 1.05 C ATOM 1567 OG SER A 105 16.095 3.253 -9.338 1.00 1.47 O ATOM 0 H SER A 105 16.637 1.977 -7.237 1.00 0.96 H new ATOM 0 HA SER A 105 14.651 3.979 -7.145 1.00 0.92 H new ATOM 0 HB2 SER A 105 14.960 1.562 -9.011 1.00 1.05 H new ATOM 0 HB3 SER A 105 14.046 3.014 -9.370 1.00 1.05 H new ATOM 0 HG SER A 105 16.178 3.066 -10.296 1.00 1.47 H new ATOM 1573 N GLU A 106 13.554 1.193 -6.017 1.00 0.79 N ATOM 1574 CA GLU A 106 12.355 0.465 -5.596 1.00 0.72 C ATOM 1575 C GLU A 106 11.691 1.191 -4.424 1.00 0.56 C ATOM 1576 O GLU A 106 10.717 0.717 -3.841 1.00 0.51 O ATOM 1577 CB GLU A 106 12.711 -0.973 -5.205 1.00 0.82 C ATOM 1578 CG GLU A 106 13.672 -1.653 -6.174 1.00 1.28 C ATOM 1579 CD GLU A 106 13.158 -1.692 -7.602 1.00 1.74 C ATOM 1580 OE1 GLU A 106 13.368 -0.705 -8.346 1.00 2.11 O ATOM 1581 OE2 GLU A 106 12.570 -2.716 -7.998 1.00 2.39 O ATOM 0 H GLU A 106 14.430 0.808 -5.663 1.00 0.79 H new ATOM 0 HA GLU A 106 11.654 0.428 -6.430 1.00 0.72 H new ATOM 0 HB2 GLU A 106 13.155 -0.970 -4.210 1.00 0.82 H new ATOM 0 HB3 GLU A 106 11.795 -1.561 -5.144 1.00 0.82 H new ATOM 0 HG2 GLU A 106 14.628 -1.130 -6.154 1.00 1.28 H new ATOM 0 HG3 GLU A 106 13.859 -2.672 -5.835 1.00 1.28 H new ATOM 1588 N THR A 107 12.244 2.353 -4.110 1.00 0.55 N ATOM 1589 CA THR A 107 11.874 3.143 -2.959 1.00 0.49 C ATOM 1590 C THR A 107 10.458 3.676 -3.043 1.00 0.37 C ATOM 1591 O THR A 107 9.961 4.248 -2.078 1.00 0.38 O ATOM 1592 CB THR A 107 12.833 4.336 -2.815 1.00 0.62 C ATOM 1593 OG1 THR A 107 13.231 4.795 -4.116 1.00 1.41 O ATOM 1594 CG2 THR A 107 14.054 3.960 -1.990 1.00 1.27 C ATOM 0 H THR A 107 12.983 2.779 -4.669 1.00 0.55 H new ATOM 0 HA THR A 107 11.936 2.482 -2.095 1.00 0.49 H new ATOM 0 HB THR A 107 12.312 5.139 -2.293 1.00 0.62 H new ATOM 0 HG1 THR A 107 14.072 4.361 -4.373 1.00 1.41 H new ATOM 0 HG21 THR A 107 14.715 4.823 -1.904 1.00 1.27 H new ATOM 0 HG22 THR A 107 13.738 3.645 -0.996 1.00 1.27 H new ATOM 0 HG23 THR A 107 14.585 3.143 -2.478 1.00 1.27 H new ATOM 1602 N ASN A 108 9.805 3.542 -4.186 1.00 0.34 N ATOM 1603 CA ASN A 108 8.472 4.005 -4.295 1.00 0.29 C ATOM 1604 C ASN A 108 7.558 3.124 -3.460 1.00 0.25 C ATOM 1605 O ASN A 108 6.632 3.604 -2.811 1.00 0.27 O ATOM 1606 CB ASN A 108 8.084 3.950 -5.758 1.00 0.40 C ATOM 1607 CG ASN A 108 9.078 4.665 -6.656 1.00 0.58 C ATOM 1608 OD1 ASN A 108 9.114 5.895 -6.719 1.00 1.39 O ATOM 1609 ND2 ASN A 108 9.871 3.897 -7.379 1.00 1.22 N ATOM 0 H ASN A 108 10.189 3.118 -5.031 1.00 0.34 H new ATOM 0 HA ASN A 108 8.381 5.027 -3.927 1.00 0.29 H new ATOM 0 HB2 ASN A 108 8.003 2.908 -6.069 1.00 0.40 H new ATOM 0 HB3 ASN A 108 7.098 4.398 -5.885 1.00 0.40 H new ATOM 0 HD21 ASN A 108 10.545 4.318 -8.019 1.00 1.22 H new ATOM 0 HD22 ASN A 108 9.810 2.882 -7.298 1.00 1.22 H new ATOM 1616 N LEU A 109 7.883 1.836 -3.443 1.00 0.25 N ATOM 1617 CA LEU A 109 7.071 0.837 -2.769 1.00 0.26 C ATOM 1618 C LEU A 109 7.502 0.575 -1.321 1.00 0.21 C ATOM 1619 O LEU A 109 7.401 -0.562 -0.850 1.00 0.23 O ATOM 1620 CB LEU A 109 7.149 -0.474 -3.560 1.00 0.41 C ATOM 1621 CG LEU A 109 6.197 -1.580 -3.111 1.00 0.54 C ATOM 1622 CD1 LEU A 109 4.765 -1.160 -3.358 1.00 0.83 C ATOM 1623 CD2 LEU A 109 6.502 -2.878 -3.843 1.00 0.95 C ATOM 0 H LEU A 109 8.715 1.459 -3.896 1.00 0.25 H new ATOM 0 HA LEU A 109 6.053 1.224 -2.729 1.00 0.26 H new ATOM 0 HB2 LEU A 109 6.952 -0.255 -4.609 1.00 0.41 H new ATOM 0 HB3 LEU A 109 8.169 -0.852 -3.499 1.00 0.41 H new ATOM 0 HG LEU A 109 6.337 -1.749 -2.043 1.00 0.54 H new ATOM 0 HD11 LEU A 109 4.092 -1.954 -3.035 1.00 0.83 H new ATOM 0 HD12 LEU A 109 4.550 -0.251 -2.796 1.00 0.83 H new ATOM 0 HD13 LEU A 109 4.619 -0.971 -4.422 1.00 0.83 H new ATOM 0 HD21 LEU A 109 5.813 -3.654 -3.510 1.00 0.95 H new ATOM 0 HD22 LEU A 109 6.386 -2.726 -4.916 1.00 0.95 H new ATOM 0 HD23 LEU A 109 7.526 -3.185 -3.629 1.00 0.95 H new ATOM 1635 N LEU A 110 7.942 1.583 -0.582 1.00 0.20 N ATOM 1636 CA LEU A 110 8.207 1.349 0.825 1.00 0.21 C ATOM 1637 C LEU A 110 7.074 1.895 1.676 1.00 0.23 C ATOM 1638 O LEU A 110 6.565 2.989 1.428 1.00 0.31 O ATOM 1639 CB LEU A 110 9.572 1.913 1.261 1.00 0.28 C ATOM 1640 CG LEU A 110 10.048 3.193 0.573 1.00 0.81 C ATOM 1641 CD1 LEU A 110 9.177 4.378 0.944 1.00 1.71 C ATOM 1642 CD2 LEU A 110 11.499 3.467 0.933 1.00 1.64 C ATOM 0 H LEU A 110 8.116 2.531 -0.916 1.00 0.20 H new ATOM 0 HA LEU A 110 8.258 0.271 0.978 1.00 0.21 H new ATOM 0 HB2 LEU A 110 9.534 2.100 2.334 1.00 0.28 H new ATOM 0 HB3 LEU A 110 10.325 1.141 1.098 1.00 0.28 H new ATOM 0 HG LEU A 110 9.968 3.049 -0.504 1.00 0.81 H new ATOM 0 HD11 LEU A 110 9.543 5.271 0.438 1.00 1.71 H new ATOM 0 HD12 LEU A 110 8.149 4.184 0.639 1.00 1.71 H new ATOM 0 HD13 LEU A 110 9.212 4.532 2.022 1.00 1.71 H new ATOM 0 HD21 LEU A 110 11.830 4.380 0.439 1.00 1.64 H new ATOM 0 HD22 LEU A 110 11.590 3.585 2.013 1.00 1.64 H new ATOM 0 HD23 LEU A 110 12.119 2.632 0.606 1.00 1.64 H new ATOM 1654 N PHE A 111 6.699 1.144 2.701 1.00 0.22 N ATOM 1655 CA PHE A 111 5.540 1.499 3.512 1.00 0.25 C ATOM 1656 C PHE A 111 5.755 1.195 4.975 1.00 0.23 C ATOM 1657 O PHE A 111 6.052 0.062 5.348 1.00 0.27 O ATOM 1658 CB PHE A 111 4.292 0.770 3.020 1.00 0.42 C ATOM 1659 CG PHE A 111 3.991 1.052 1.588 1.00 0.91 C ATOM 1660 CD1 PHE A 111 3.648 2.327 1.183 1.00 1.64 C ATOM 1661 CD2 PHE A 111 4.080 0.052 0.644 1.00 1.18 C ATOM 1662 CE1 PHE A 111 3.403 2.597 -0.143 1.00 2.38 C ATOM 1663 CE2 PHE A 111 3.829 0.316 -0.679 1.00 1.90 C ATOM 1664 CZ PHE A 111 3.493 1.590 -1.072 1.00 2.46 C ATOM 0 H PHE A 111 7.176 0.290 2.991 1.00 0.22 H new ATOM 0 HA PHE A 111 5.400 2.575 3.406 1.00 0.25 H new ATOM 0 HB2 PHE A 111 4.426 -0.303 3.155 1.00 0.42 H new ATOM 0 HB3 PHE A 111 3.439 1.064 3.632 1.00 0.42 H new ATOM 0 HD1 PHE A 111 3.572 3.119 1.914 1.00 1.64 H new ATOM 0 HD2 PHE A 111 4.350 -0.949 0.948 1.00 1.18 H new ATOM 0 HE1 PHE A 111 3.141 3.598 -0.453 1.00 2.38 H new ATOM 0 HE2 PHE A 111 3.895 -0.476 -1.410 1.00 1.90 H new ATOM 0 HZ PHE A 111 3.299 1.799 -2.114 1.00 2.46 H new ATOM 1674 N PHE A 112 5.608 2.221 5.790 1.00 0.21 N ATOM 1675 CA PHE A 112 5.716 2.074 7.233 1.00 0.25 C ATOM 1676 C PHE A 112 4.376 1.639 7.766 1.00 0.25 C ATOM 1677 O PHE A 112 3.429 2.425 7.818 1.00 0.26 O ATOM 1678 CB PHE A 112 6.167 3.367 7.922 1.00 0.30 C ATOM 1679 CG PHE A 112 6.052 3.322 9.423 1.00 0.57 C ATOM 1680 CD1 PHE A 112 6.632 2.294 10.152 1.00 0.79 C ATOM 1681 CD2 PHE A 112 5.348 4.304 10.103 1.00 0.95 C ATOM 1682 CE1 PHE A 112 6.516 2.251 11.528 1.00 1.21 C ATOM 1683 CE2 PHE A 112 5.228 4.264 11.480 1.00 1.43 C ATOM 1684 CZ PHE A 112 5.814 3.236 12.193 1.00 1.50 C ATOM 0 H PHE A 112 5.412 3.172 5.478 1.00 0.21 H new ATOM 0 HA PHE A 112 6.479 1.326 7.448 1.00 0.25 H new ATOM 0 HB2 PHE A 112 7.203 3.571 7.651 1.00 0.30 H new ATOM 0 HB3 PHE A 112 5.570 4.197 7.545 1.00 0.30 H new ATOM 0 HD1 PHE A 112 7.180 1.518 9.638 1.00 0.79 H new ATOM 0 HD2 PHE A 112 4.888 5.110 9.551 1.00 0.95 H new ATOM 0 HE1 PHE A 112 6.975 1.446 12.084 1.00 1.21 H new ATOM 0 HE2 PHE A 112 4.677 5.035 11.997 1.00 1.43 H new ATOM 0 HZ PHE A 112 5.723 3.203 13.269 1.00 1.50 H new ATOM 1694 N TRP A 113 4.298 0.386 8.145 1.00 0.31 N ATOM 1695 CA TRP A 113 3.021 -0.209 8.481 1.00 0.35 C ATOM 1696 C TRP A 113 2.758 -0.079 9.970 1.00 0.33 C ATOM 1697 O TRP A 113 3.362 -0.761 10.800 1.00 0.37 O ATOM 1698 CB TRP A 113 3.015 -1.682 8.053 1.00 0.48 C ATOM 1699 CG TRP A 113 1.765 -2.429 8.414 1.00 1.08 C ATOM 1700 CD1 TRP A 113 0.487 -2.113 8.060 1.00 2.30 C ATOM 1701 CD2 TRP A 113 1.681 -3.633 9.186 1.00 1.17 C ATOM 1702 NE1 TRP A 113 -0.388 -3.043 8.569 1.00 3.02 N ATOM 1703 CE2 TRP A 113 0.319 -3.987 9.260 1.00 2.29 C ATOM 1704 CE3 TRP A 113 2.624 -4.446 9.818 1.00 1.12 C ATOM 1705 CZ2 TRP A 113 -0.119 -5.118 9.947 1.00 2.67 C ATOM 1706 CZ3 TRP A 113 2.187 -5.567 10.498 1.00 1.47 C ATOM 1707 CH2 TRP A 113 0.827 -5.896 10.555 1.00 2.02 C ATOM 0 H TRP A 113 5.098 -0.241 8.229 1.00 0.31 H new ATOM 0 HA TRP A 113 2.226 0.315 7.950 1.00 0.35 H new ATOM 0 HB2 TRP A 113 3.156 -1.734 6.973 1.00 0.48 H new ATOM 0 HB3 TRP A 113 3.868 -2.184 8.510 1.00 0.48 H new ATOM 0 HD1 TRP A 113 0.203 -1.257 7.466 1.00 2.30 H new ATOM 0 HE1 TRP A 113 -1.401 -3.031 8.450 1.00 3.02 H new ATOM 0 HE3 TRP A 113 3.676 -4.203 9.776 1.00 1.12 H new ATOM 0 HZ2 TRP A 113 -1.168 -5.371 9.997 1.00 2.67 H new ATOM 0 HZ3 TRP A 113 2.907 -6.201 10.994 1.00 1.47 H new ATOM 0 HH2 TRP A 113 0.519 -6.782 11.090 1.00 2.02 H new ATOM 1718 N GLU A 114 1.848 0.829 10.286 1.00 0.32 N ATOM 1719 CA GLU A 114 1.434 1.074 11.651 1.00 0.37 C ATOM 1720 C GLU A 114 0.068 0.438 11.877 1.00 0.39 C ATOM 1721 O GLU A 114 -0.942 0.924 11.371 1.00 0.42 O ATOM 1722 CB GLU A 114 1.389 2.583 11.920 1.00 0.43 C ATOM 1723 CG GLU A 114 1.276 2.948 13.392 1.00 0.96 C ATOM 1724 CD GLU A 114 1.233 4.448 13.621 1.00 1.50 C ATOM 1725 OE1 GLU A 114 2.309 5.083 13.616 1.00 1.90 O ATOM 1726 OE2 GLU A 114 0.127 5.000 13.799 1.00 2.32 O ATOM 0 H GLU A 114 1.377 1.416 9.598 1.00 0.32 H new ATOM 0 HA GLU A 114 2.149 0.630 12.343 1.00 0.37 H new ATOM 0 HB2 GLU A 114 2.290 3.041 11.511 1.00 0.43 H new ATOM 0 HB3 GLU A 114 0.542 3.012 11.384 1.00 0.43 H new ATOM 0 HG2 GLU A 114 0.375 2.495 13.806 1.00 0.96 H new ATOM 0 HG3 GLU A 114 2.123 2.526 13.933 1.00 0.96 H new ATOM 1733 N THR A 115 0.041 -0.652 12.623 1.00 0.47 N ATOM 1734 CA THR A 115 -1.184 -1.412 12.803 1.00 0.49 C ATOM 1735 C THR A 115 -1.857 -1.071 14.128 1.00 0.52 C ATOM 1736 O THR A 115 -1.250 -1.174 15.196 1.00 0.64 O ATOM 1737 CB THR A 115 -0.908 -2.935 12.720 1.00 0.67 C ATOM 1738 OG1 THR A 115 -2.096 -3.680 13.010 1.00 1.38 O ATOM 1739 CG2 THR A 115 0.205 -3.353 13.672 1.00 1.39 C ATOM 0 H THR A 115 0.851 -1.031 13.113 1.00 0.47 H new ATOM 0 HA THR A 115 -1.862 -1.136 11.995 1.00 0.49 H new ATOM 0 HB THR A 115 -0.588 -3.152 11.701 1.00 0.67 H new ATOM 0 HG1 THR A 115 -2.769 -3.503 12.320 1.00 1.38 H new ATOM 0 HG21 THR A 115 0.372 -4.427 13.587 1.00 1.39 H new ATOM 0 HG22 THR A 115 1.122 -2.822 13.416 1.00 1.39 H new ATOM 0 HG23 THR A 115 -0.081 -3.110 14.695 1.00 1.39 H new ATOM 1747 N HIS A 116 -3.105 -0.620 14.051 1.00 0.47 N ATOM 1748 CA HIS A 116 -3.883 -0.346 15.244 1.00 0.56 C ATOM 1749 C HIS A 116 -5.276 -0.963 15.117 1.00 0.56 C ATOM 1750 O HIS A 116 -6.182 -0.371 14.530 1.00 0.55 O ATOM 1751 CB HIS A 116 -3.974 1.167 15.471 1.00 0.66 C ATOM 1752 CG HIS A 116 -4.565 1.550 16.792 1.00 1.29 C ATOM 1753 ND1 HIS A 116 -5.681 2.345 16.911 1.00 1.88 N ATOM 1754 CD2 HIS A 116 -4.181 1.256 18.058 1.00 2.27 C ATOM 1755 CE1 HIS A 116 -5.961 2.523 18.186 1.00 2.63 C ATOM 1756 NE2 HIS A 116 -5.068 1.872 18.904 1.00 2.89 N ATOM 0 H HIS A 116 -3.594 -0.438 13.175 1.00 0.47 H new ATOM 0 HA HIS A 116 -3.389 -0.795 16.106 1.00 0.56 H new ATOM 0 HB2 HIS A 116 -2.975 1.596 15.393 1.00 0.66 H new ATOM 0 HB3 HIS A 116 -4.574 1.608 14.675 1.00 0.66 H new ATOM 0 HD2 HIS A 116 -3.335 0.650 18.347 1.00 2.27 H new ATOM 0 HE1 HIS A 116 -6.783 3.104 18.577 1.00 2.63 H new ATOM 0 HE2 HIS A 116 -5.041 1.833 19.923 1.00 2.89 H new ATOM 1765 N GLY A 117 -5.437 -2.144 15.696 1.00 0.64 N ATOM 1766 CA GLY A 117 -6.712 -2.837 15.676 1.00 0.71 C ATOM 1767 C GLY A 117 -6.993 -3.529 14.351 1.00 0.69 C ATOM 1768 O GLY A 117 -6.382 -4.550 14.042 1.00 0.74 O ATOM 0 H GLY A 117 -4.695 -2.642 16.187 1.00 0.64 H new ATOM 0 HA2 GLY A 117 -6.730 -3.577 16.476 1.00 0.71 H new ATOM 0 HA3 GLY A 117 -7.510 -2.124 15.883 1.00 0.71 H new ATOM 1772 N THR A 118 -7.909 -2.974 13.566 1.00 0.66 N ATOM 1773 CA THR A 118 -8.255 -3.551 12.273 1.00 0.69 C ATOM 1774 C THR A 118 -7.667 -2.732 11.130 1.00 0.56 C ATOM 1775 O THR A 118 -7.063 -3.278 10.208 1.00 0.57 O ATOM 1776 CB THR A 118 -9.783 -3.664 12.097 1.00 0.81 C ATOM 1777 OG1 THR A 118 -10.407 -2.407 12.393 1.00 1.60 O ATOM 1778 CG2 THR A 118 -10.354 -4.749 12.997 1.00 1.39 C ATOM 0 H THR A 118 -8.425 -2.126 13.802 1.00 0.66 H new ATOM 0 HA THR A 118 -7.827 -4.553 12.246 1.00 0.69 H new ATOM 0 HB THR A 118 -9.988 -3.932 11.061 1.00 0.81 H new ATOM 0 HG1 THR A 118 -10.786 -2.028 11.572 1.00 1.60 H new ATOM 0 HG21 THR A 118 -11.433 -4.809 12.855 1.00 1.39 H new ATOM 0 HG22 THR A 118 -9.901 -5.707 12.744 1.00 1.39 H new ATOM 0 HG23 THR A 118 -10.138 -4.509 14.038 1.00 1.39 H new ATOM 1786 N LYS A 119 -7.857 -1.420 11.201 1.00 0.50 N ATOM 1787 CA LYS A 119 -7.295 -0.506 10.218 1.00 0.41 C ATOM 1788 C LYS A 119 -5.813 -0.266 10.545 1.00 0.35 C ATOM 1789 O LYS A 119 -5.384 -0.434 11.691 1.00 0.40 O ATOM 1790 CB LYS A 119 -8.072 0.813 10.245 1.00 0.46 C ATOM 1791 CG LYS A 119 -7.994 1.575 11.559 1.00 0.98 C ATOM 1792 CD LYS A 119 -9.016 2.697 11.582 1.00 1.36 C ATOM 1793 CE LYS A 119 -8.618 3.821 12.524 1.00 1.79 C ATOM 1794 NZ LYS A 119 -7.338 4.463 12.123 1.00 2.49 N ATOM 0 H LYS A 119 -8.400 -0.964 11.935 1.00 0.50 H new ATOM 0 HA LYS A 119 -7.373 -0.935 9.219 1.00 0.41 H new ATOM 0 HB2 LYS A 119 -7.698 1.455 9.447 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -9.119 0.606 10.023 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -8.172 0.895 12.392 1.00 0.98 H new ATOM 0 HG3 LYS A 119 -6.992 1.984 11.690 1.00 0.98 H new ATOM 0 HD2 LYS A 119 -9.137 3.096 10.575 1.00 1.36 H new ATOM 0 HD3 LYS A 119 -9.984 2.298 11.885 1.00 1.36 H new ATOM 0 HE2 LYS A 119 -9.408 4.572 12.545 1.00 1.79 H new ATOM 0 HE3 LYS A 119 -8.524 3.428 13.536 1.00 1.79 H new ATOM 0 HZ1 LYS A 119 -6.661 4.409 12.910 1.00 2.49 H new ATOM 0 HZ2 LYS A 119 -6.947 3.970 11.295 1.00 2.49 H new ATOM 0 HZ3 LYS A 119 -7.510 5.460 11.882 1.00 2.49 H new ATOM 1808 N ASN A 120 -5.043 0.129 9.546 1.00 0.30 N ATOM 1809 CA ASN A 120 -3.610 0.355 9.693 1.00 0.28 C ATOM 1810 C ASN A 120 -3.169 1.404 8.671 1.00 0.28 C ATOM 1811 O ASN A 120 -3.841 1.600 7.660 1.00 0.32 O ATOM 1812 CB ASN A 120 -2.816 -0.945 9.456 1.00 0.36 C ATOM 1813 CG ASN A 120 -3.646 -2.216 9.602 1.00 1.26 C ATOM 1814 OD1 ASN A 120 -3.674 -2.787 10.793 1.00 2.08 O flip ATOM 1815 ND2 ASN A 120 -4.245 -2.693 8.642 1.00 2.07 N flip ATOM 0 H ASN A 120 -5.393 0.304 8.604 1.00 0.30 H new ATOM 0 HA ASN A 120 -3.413 0.699 10.708 1.00 0.28 H new ATOM 0 HB2 ASN A 120 -2.385 -0.918 8.455 1.00 0.36 H new ATOM 0 HB3 ASN A 120 -1.985 -0.984 10.160 1.00 0.36 H new ATOM 0 HD21 ASN A 120 -4.205 -2.229 7.734 1.00 2.07 H new ATOM 0 HD22 ASN A 120 -4.783 -3.553 8.752 1.00 2.07 H new ATOM 1822 N TYR A 121 -2.049 2.076 8.936 1.00 0.31 N ATOM 1823 CA TYR A 121 -1.569 3.159 8.067 1.00 0.37 C ATOM 1824 C TYR A 121 -0.288 2.748 7.337 1.00 0.30 C ATOM 1825 O TYR A 121 0.374 1.794 7.749 1.00 0.34 O ATOM 1826 CB TYR A 121 -1.264 4.412 8.893 1.00 0.66 C ATOM 1827 CG TYR A 121 -2.250 4.700 10.004 1.00 1.06 C ATOM 1828 CD1 TYR A 121 -3.395 5.451 9.774 1.00 1.41 C ATOM 1829 CD2 TYR A 121 -2.020 4.232 11.291 1.00 1.46 C ATOM 1830 CE1 TYR A 121 -4.283 5.725 10.799 1.00 2.01 C ATOM 1831 CE2 TYR A 121 -2.902 4.497 12.317 1.00 1.98 C ATOM 1832 CZ TYR A 121 -4.030 5.244 12.068 1.00 2.23 C ATOM 1833 OH TYR A 121 -4.904 5.520 13.096 1.00 2.84 O ATOM 0 H TYR A 121 -1.455 1.892 9.744 1.00 0.31 H new ATOM 0 HA TYR A 121 -2.356 3.367 7.342 1.00 0.37 H new ATOM 0 HB2 TYR A 121 -0.270 4.310 9.327 1.00 0.66 H new ATOM 0 HB3 TYR A 121 -1.232 5.272 8.224 1.00 0.66 H new ATOM 0 HD1 TYR A 121 -3.595 5.826 8.781 1.00 1.41 H new ATOM 0 HD2 TYR A 121 -1.133 3.649 11.492 1.00 1.46 H new ATOM 0 HE1 TYR A 121 -5.169 6.312 10.607 1.00 2.01 H new ATOM 0 HE2 TYR A 121 -2.708 4.120 13.310 1.00 1.98 H new ATOM 0 HH TYR A 121 -4.578 5.106 13.922 1.00 2.84 H new ATOM 1843 N PHE A 122 0.072 3.472 6.264 1.00 0.30 N ATOM 1844 CA PHE A 122 1.364 3.277 5.617 1.00 0.29 C ATOM 1845 C PHE A 122 2.082 4.612 5.450 1.00 0.26 C ATOM 1846 O PHE A 122 1.793 5.356 4.526 1.00 0.32 O ATOM 1847 CB PHE A 122 1.219 2.632 4.236 1.00 0.34 C ATOM 1848 CG PHE A 122 0.745 1.207 4.238 1.00 1.05 C ATOM 1849 CD1 PHE A 122 1.447 0.235 4.932 1.00 1.45 C ATOM 1850 CD2 PHE A 122 -0.416 0.847 3.579 1.00 1.56 C ATOM 1851 CE1 PHE A 122 1.000 -1.070 4.962 1.00 2.18 C ATOM 1852 CE2 PHE A 122 -0.870 -0.456 3.607 1.00 2.27 C ATOM 1853 CZ PHE A 122 -0.099 -1.438 4.183 1.00 2.54 C ATOM 0 H PHE A 122 -0.513 4.189 5.835 1.00 0.30 H new ATOM 0 HA PHE A 122 1.941 2.612 6.259 1.00 0.29 H new ATOM 0 HB2 PHE A 122 0.522 3.228 3.646 1.00 0.34 H new ATOM 0 HB3 PHE A 122 2.183 2.676 3.730 1.00 0.34 H new ATOM 0 HD1 PHE A 122 2.354 0.501 5.455 1.00 1.45 H new ATOM 0 HD2 PHE A 122 -0.975 1.595 3.036 1.00 1.56 H new ATOM 0 HE1 PHE A 122 1.496 -1.801 5.583 1.00 2.18 H new ATOM 0 HE2 PHE A 122 -1.829 -0.704 3.177 1.00 2.27 H new ATOM 0 HZ PHE A 122 -0.340 -2.480 4.035 1.00 2.54 H new ATOM 1863 N THR A 123 3.029 4.908 6.316 1.00 0.22 N ATOM 1864 CA THR A 123 3.806 6.119 6.191 1.00 0.22 C ATOM 1865 C THR A 123 5.010 5.806 5.325 1.00 0.20 C ATOM 1866 O THR A 123 5.604 4.753 5.468 1.00 0.19 O ATOM 1867 CB THR A 123 4.284 6.584 7.577 1.00 0.24 C ATOM 1868 OG1 THR A 123 3.186 6.567 8.496 1.00 0.32 O ATOM 1869 CG2 THR A 123 4.876 7.984 7.519 1.00 0.33 C ATOM 0 H THR A 123 3.278 4.324 7.115 1.00 0.22 H new ATOM 0 HA THR A 123 3.202 6.910 5.747 1.00 0.22 H new ATOM 0 HB THR A 123 5.062 5.899 7.913 1.00 0.24 H new ATOM 0 HG1 THR A 123 2.443 7.088 8.127 1.00 0.32 H new ATOM 0 HG21 THR A 123 5.204 8.282 8.515 1.00 0.33 H new ATOM 0 HG22 THR A 123 5.728 7.991 6.839 1.00 0.33 H new ATOM 0 HG23 THR A 123 4.121 8.684 7.161 1.00 0.33 H new ATOM 1877 N SER A 124 5.368 6.675 4.408 1.00 0.21 N ATOM 1878 CA SER A 124 6.438 6.333 3.499 1.00 0.23 C ATOM 1879 C SER A 124 7.745 6.333 4.268 1.00 0.29 C ATOM 1880 O SER A 124 8.098 7.313 4.924 1.00 0.34 O ATOM 1881 CB SER A 124 6.487 7.310 2.326 1.00 0.26 C ATOM 1882 OG SER A 124 7.507 6.964 1.405 1.00 1.17 O ATOM 0 H SER A 124 4.950 7.596 4.273 1.00 0.21 H new ATOM 0 HA SER A 124 6.264 5.341 3.082 1.00 0.23 H new ATOM 0 HB2 SER A 124 5.523 7.318 1.817 1.00 0.26 H new ATOM 0 HB3 SER A 124 6.659 8.320 2.699 1.00 0.26 H new ATOM 0 HG SER A 124 7.512 7.607 0.665 1.00 1.17 H new ATOM 1888 N VAL A 125 8.447 5.211 4.197 1.00 0.33 N ATOM 1889 CA VAL A 125 9.635 5.005 4.993 1.00 0.43 C ATOM 1890 C VAL A 125 10.781 5.846 4.455 1.00 0.53 C ATOM 1891 O VAL A 125 11.697 6.211 5.190 1.00 0.65 O ATOM 1892 CB VAL A 125 10.009 3.503 5.012 1.00 0.48 C ATOM 1893 CG1 VAL A 125 11.437 3.275 5.494 1.00 0.81 C ATOM 1894 CG2 VAL A 125 9.035 2.739 5.890 1.00 0.47 C ATOM 0 H VAL A 125 8.207 4.428 3.590 1.00 0.33 H new ATOM 0 HA VAL A 125 9.436 5.320 6.017 1.00 0.43 H new ATOM 0 HB VAL A 125 9.947 3.135 3.988 1.00 0.48 H new ATOM 0 HG11 VAL A 125 11.656 2.207 5.491 1.00 0.81 H new ATOM 0 HG12 VAL A 125 12.132 3.790 4.830 1.00 0.81 H new ATOM 0 HG13 VAL A 125 11.546 3.665 6.506 1.00 0.81 H new ATOM 0 HG21 VAL A 125 9.304 1.683 5.899 1.00 0.47 H new ATOM 0 HG22 VAL A 125 9.075 3.132 6.906 1.00 0.47 H new ATOM 0 HG23 VAL A 125 8.025 2.853 5.497 1.00 0.47 H new ATOM 1904 N ALA A 126 10.708 6.190 3.180 1.00 0.53 N ATOM 1905 CA ALA A 126 11.665 7.123 2.615 1.00 0.63 C ATOM 1906 C ALA A 126 11.376 8.538 3.105 1.00 0.63 C ATOM 1907 O ALA A 126 12.272 9.247 3.557 1.00 0.72 O ATOM 1908 CB ALA A 126 11.632 7.071 1.094 1.00 0.68 C ATOM 0 H ALA A 126 10.007 5.843 2.526 1.00 0.53 H new ATOM 0 HA ALA A 126 12.663 6.836 2.946 1.00 0.63 H new ATOM 0 HB1 ALA A 126 12.357 7.778 0.690 1.00 0.68 H new ATOM 0 HB2 ALA A 126 11.881 6.064 0.759 1.00 0.68 H new ATOM 0 HB3 ALA A 126 10.634 7.334 0.743 1.00 0.68 H new ATOM 1914 N HIS A 127 10.109 8.935 3.042 1.00 0.56 N ATOM 1915 CA HIS A 127 9.709 10.269 3.453 1.00 0.58 C ATOM 1916 C HIS A 127 8.295 10.236 4.033 1.00 0.47 C ATOM 1917 O HIS A 127 7.340 9.982 3.315 1.00 0.44 O ATOM 1918 CB HIS A 127 9.785 11.225 2.258 1.00 0.72 C ATOM 1919 CG HIS A 127 10.001 12.658 2.638 1.00 1.15 C ATOM 1920 ND1 HIS A 127 9.125 13.674 2.808 1.00 1.70 N flip ATOM 1921 CD2 HIS A 127 11.249 13.191 2.878 1.00 1.99 C flip ATOM 1922 CE1 HIS A 127 9.854 14.786 3.144 1.00 2.29 C flip ATOM 1923 NE2 HIS A 127 11.132 14.469 3.181 1.00 2.47 N flip ATOM 0 H HIS A 127 9.344 8.349 2.709 1.00 0.56 H new ATOM 0 HA HIS A 127 10.388 10.627 4.227 1.00 0.58 H new ATOM 0 HB2 HIS A 127 10.596 10.907 1.602 1.00 0.72 H new ATOM 0 HB3 HIS A 127 8.862 11.147 1.684 1.00 0.72 H new ATOM 0 HD2 HIS A 127 12.180 12.646 2.826 1.00 1.99 H new ATOM 0 HE1 HIS A 127 9.446 15.765 3.346 1.00 2.29 H new ATOM 0 HE2 HIS A 127 11.899 15.103 3.405 1.00 2.47 H new ATOM 1932 N PRO A 128 8.149 10.528 5.332 1.00 0.47 N ATOM 1933 CA PRO A 128 6.852 10.513 6.048 1.00 0.43 C ATOM 1934 C PRO A 128 5.801 11.423 5.415 1.00 0.40 C ATOM 1935 O PRO A 128 4.610 11.142 5.486 1.00 0.39 O ATOM 1936 CB PRO A 128 7.192 10.995 7.448 1.00 0.53 C ATOM 1937 CG PRO A 128 8.506 11.686 7.310 1.00 0.79 C ATOM 1938 CD PRO A 128 9.238 10.942 6.230 1.00 0.60 C ATOM 0 HA PRO A 128 6.409 9.518 6.022 1.00 0.43 H new ATOM 0 HB2 PRO A 128 6.428 11.673 7.828 1.00 0.53 H new ATOM 0 HB3 PRO A 128 7.256 10.162 8.148 1.00 0.53 H new ATOM 0 HG2 PRO A 128 8.372 12.734 7.043 1.00 0.79 H new ATOM 0 HG3 PRO A 128 9.061 11.664 8.248 1.00 0.79 H new ATOM 0 HD2 PRO A 128 9.964 11.576 5.721 1.00 0.60 H new ATOM 0 HD3 PRO A 128 9.785 10.086 6.626 1.00 0.60 H new ATOM 1946 N ASN A 129 6.241 12.564 4.871 1.00 0.44 N ATOM 1947 CA ASN A 129 5.330 13.541 4.282 1.00 0.47 C ATOM 1948 C ASN A 129 4.662 12.945 3.041 1.00 0.39 C ATOM 1949 O ASN A 129 3.826 13.558 2.385 1.00 0.44 O ATOM 1950 CB ASN A 129 6.102 14.812 3.920 1.00 0.57 C ATOM 1951 CG ASN A 129 5.215 15.958 3.443 1.00 1.07 C ATOM 1952 OD1 ASN A 129 5.053 16.085 2.138 1.00 1.84 O flip ATOM 1953 ND2 ASN A 129 4.696 16.737 4.245 1.00 1.44 N flip ATOM 0 H ASN A 129 7.225 12.830 4.829 1.00 0.44 H new ATOM 0 HA ASN A 129 4.554 13.797 5.004 1.00 0.47 H new ATOM 0 HB2 ASN A 129 6.668 15.142 4.791 1.00 0.57 H new ATOM 0 HB3 ASN A 129 6.826 14.576 3.140 1.00 0.57 H new ATOM 0 HD21 ASN A 129 4.842 16.610 5.247 1.00 1.44 H new ATOM 0 HD22 ASN A 129 4.121 17.509 3.907 1.00 1.44 H new ATOM 1960 N LEU A 130 5.099 11.765 2.694 1.00 0.32 N ATOM 1961 CA LEU A 130 4.349 10.901 1.829 1.00 0.26 C ATOM 1962 C LEU A 130 3.611 9.933 2.748 1.00 0.24 C ATOM 1963 O LEU A 130 4.229 9.301 3.607 1.00 0.26 O ATOM 1964 CB LEU A 130 5.309 10.130 0.903 1.00 0.30 C ATOM 1965 CG LEU A 130 6.070 10.938 -0.173 1.00 0.58 C ATOM 1966 CD1 LEU A 130 6.691 12.216 0.370 1.00 1.38 C ATOM 1967 CD2 LEU A 130 7.164 10.078 -0.781 1.00 1.28 C ATOM 0 H LEU A 130 5.989 11.376 3.005 1.00 0.32 H new ATOM 0 HA LEU A 130 3.657 11.458 1.197 1.00 0.26 H new ATOM 0 HB2 LEU A 130 6.046 9.626 1.528 1.00 0.30 H new ATOM 0 HB3 LEU A 130 4.736 9.353 0.397 1.00 0.30 H new ATOM 0 HG LEU A 130 5.336 11.225 -0.926 1.00 0.58 H new ATOM 0 HD11 LEU A 130 7.211 12.738 -0.433 1.00 1.38 H new ATOM 0 HD12 LEU A 130 5.908 12.858 0.773 1.00 1.38 H new ATOM 0 HD13 LEU A 130 7.400 11.969 1.160 1.00 1.38 H new ATOM 0 HD21 LEU A 130 7.698 10.651 -1.539 1.00 1.28 H new ATOM 0 HD22 LEU A 130 7.860 9.770 -0.001 1.00 1.28 H new ATOM 0 HD23 LEU A 130 6.720 9.195 -1.240 1.00 1.28 H new ATOM 1979 N PHE A 131 2.335 9.755 2.541 1.00 0.23 N ATOM 1980 CA PHE A 131 1.552 8.895 3.411 1.00 0.27 C ATOM 1981 C PHE A 131 0.416 8.294 2.600 1.00 0.26 C ATOM 1982 O PHE A 131 -0.229 8.987 1.816 1.00 0.26 O ATOM 1983 CB PHE A 131 1.039 9.718 4.608 1.00 0.42 C ATOM 1984 CG PHE A 131 0.738 8.945 5.867 1.00 0.36 C ATOM 1985 CD1 PHE A 131 0.203 7.671 5.825 1.00 0.63 C ATOM 1986 CD2 PHE A 131 0.988 9.520 7.103 1.00 0.65 C ATOM 1987 CE1 PHE A 131 -0.076 6.984 6.991 1.00 0.97 C ATOM 1988 CE2 PHE A 131 0.713 8.838 8.271 1.00 0.96 C ATOM 1989 CZ PHE A 131 0.179 7.568 8.216 1.00 1.05 C ATOM 0 H PHE A 131 1.809 10.189 1.782 1.00 0.23 H new ATOM 0 HA PHE A 131 2.156 8.079 3.808 1.00 0.27 H new ATOM 0 HB2 PHE A 131 1.782 10.480 4.843 1.00 0.42 H new ATOM 0 HB3 PHE A 131 0.133 10.240 4.302 1.00 0.42 H new ATOM 0 HD1 PHE A 131 0.001 7.208 4.871 1.00 0.63 H new ATOM 0 HD2 PHE A 131 1.404 10.516 7.153 1.00 0.65 H new ATOM 0 HE1 PHE A 131 -0.494 5.989 6.944 1.00 0.97 H new ATOM 0 HE2 PHE A 131 0.916 9.298 9.227 1.00 0.96 H new ATOM 0 HZ PHE A 131 -0.039 7.032 9.128 1.00 1.05 H new ATOM 1999 N ILE A 132 0.149 7.027 2.825 1.00 0.28 N ATOM 2000 CA ILE A 132 -0.703 6.257 1.955 1.00 0.27 C ATOM 2001 C ILE A 132 -2.145 6.394 2.398 1.00 0.25 C ATOM 2002 O ILE A 132 -2.602 5.755 3.343 1.00 0.32 O ATOM 2003 CB ILE A 132 -0.248 4.779 1.968 1.00 0.34 C ATOM 2004 CG1 ILE A 132 1.136 4.657 1.324 1.00 0.87 C ATOM 2005 CG2 ILE A 132 -1.254 3.883 1.253 1.00 0.80 C ATOM 2006 CD1 ILE A 132 1.205 5.178 -0.094 1.00 1.39 C ATOM 0 H ILE A 132 0.518 6.503 3.618 1.00 0.28 H new ATOM 0 HA ILE A 132 -0.628 6.630 0.934 1.00 0.27 H new ATOM 0 HB ILE A 132 -0.190 4.446 3.004 1.00 0.34 H new ATOM 0 HG12 ILE A 132 1.858 5.199 1.934 1.00 0.87 H new ATOM 0 HG13 ILE A 132 1.437 3.609 1.330 1.00 0.87 H new ATOM 0 HG21 ILE A 132 -0.905 2.851 1.280 1.00 0.80 H new ATOM 0 HG22 ILE A 132 -2.221 3.952 1.751 1.00 0.80 H new ATOM 0 HG23 ILE A 132 -1.356 4.205 0.217 1.00 0.80 H new ATOM 0 HD11 ILE A 132 2.218 5.055 -0.478 1.00 1.39 H new ATOM 0 HD12 ILE A 132 0.509 4.620 -0.721 1.00 1.39 H new ATOM 0 HD13 ILE A 132 0.938 6.235 -0.107 1.00 1.39 H new ATOM 2018 N ALA A 133 -2.831 7.261 1.690 1.00 0.22 N ATOM 2019 CA ALA A 133 -4.205 7.630 1.987 1.00 0.23 C ATOM 2020 C ALA A 133 -5.212 6.838 1.178 1.00 0.23 C ATOM 2021 O ALA A 133 -4.916 6.359 0.085 1.00 0.26 O ATOM 2022 CB ALA A 133 -4.401 9.112 1.743 1.00 0.25 C ATOM 0 H ALA A 133 -2.447 7.741 0.876 1.00 0.22 H new ATOM 0 HA ALA A 133 -4.382 7.394 3.036 1.00 0.23 H new ATOM 0 HB1 ALA A 133 -5.432 9.384 1.967 1.00 0.25 H new ATOM 0 HB2 ALA A 133 -3.728 9.679 2.387 1.00 0.25 H new ATOM 0 HB3 ALA A 133 -4.184 9.341 0.700 1.00 0.25 H new ATOM 2028 N THR A 134 -6.406 6.730 1.726 1.00 0.23 N ATOM 2029 CA THR A 134 -7.535 6.159 1.031 1.00 0.25 C ATOM 2030 C THR A 134 -8.681 7.148 1.149 1.00 0.26 C ATOM 2031 O THR A 134 -9.013 7.592 2.251 1.00 0.31 O ATOM 2032 CB THR A 134 -7.906 4.789 1.601 1.00 0.31 C ATOM 2033 OG1 THR A 134 -8.009 4.896 3.004 1.00 0.96 O ATOM 2034 CG2 THR A 134 -6.865 3.738 1.241 1.00 1.01 C ATOM 0 H THR A 134 -6.618 7.040 2.674 1.00 0.23 H new ATOM 0 HA THR A 134 -7.293 5.989 -0.018 1.00 0.25 H new ATOM 0 HB THR A 134 -8.857 4.475 1.171 1.00 0.31 H new ATOM 0 HG1 THR A 134 -7.934 5.837 3.267 1.00 0.96 H new ATOM 0 HG21 THR A 134 -7.159 2.776 1.661 1.00 1.01 H new ATOM 0 HG22 THR A 134 -6.793 3.654 0.157 1.00 1.01 H new ATOM 0 HG23 THR A 134 -5.897 4.031 1.647 1.00 1.01 H new ATOM 2042 N LYS A 135 -9.239 7.553 0.032 1.00 0.28 N ATOM 2043 CA LYS A 135 -10.228 8.620 0.048 1.00 0.31 C ATOM 2044 C LYS A 135 -11.628 8.059 -0.183 1.00 0.40 C ATOM 2045 O LYS A 135 -11.811 7.089 -0.913 1.00 0.47 O ATOM 2046 CB LYS A 135 -9.881 9.705 -0.990 1.00 0.35 C ATOM 2047 CG LYS A 135 -8.448 10.241 -0.882 1.00 0.69 C ATOM 2048 CD LYS A 135 -8.128 10.801 0.503 1.00 0.76 C ATOM 2049 CE LYS A 135 -8.479 12.280 0.642 1.00 0.89 C ATOM 2050 NZ LYS A 135 -7.403 13.191 0.133 1.00 0.63 N ATOM 0 H LYS A 135 -9.033 7.170 -0.891 1.00 0.28 H new ATOM 0 HA LYS A 135 -10.213 9.088 1.033 1.00 0.31 H new ATOM 0 HB2 LYS A 135 -10.030 9.297 -1.990 1.00 0.35 H new ATOM 0 HB3 LYS A 135 -10.577 10.536 -0.878 1.00 0.35 H new ATOM 0 HG2 LYS A 135 -7.747 9.440 -1.116 1.00 0.69 H new ATOM 0 HG3 LYS A 135 -8.300 11.022 -1.628 1.00 0.69 H new ATOM 0 HD2 LYS A 135 -8.674 10.231 1.255 1.00 0.76 H new ATOM 0 HD3 LYS A 135 -7.066 10.664 0.708 1.00 0.76 H new ATOM 0 HE2 LYS A 135 -9.403 12.480 0.099 1.00 0.89 H new ATOM 0 HE3 LYS A 135 -8.670 12.505 1.691 1.00 0.89 H new ATOM 0 HZ1 LYS A 135 -7.836 14.015 -0.330 1.00 0.63 H new ATOM 0 HZ2 LYS A 135 -6.814 13.510 0.928 1.00 0.63 H new ATOM 0 HZ3 LYS A 135 -6.812 12.680 -0.553 1.00 0.63 H new ATOM 2064 N GLN A 136 -12.604 8.718 0.432 1.00 0.49 N ATOM 2065 CA GLN A 136 -13.998 8.275 0.428 1.00 0.63 C ATOM 2066 C GLN A 136 -14.665 8.505 -0.916 1.00 0.58 C ATOM 2067 O GLN A 136 -15.605 7.807 -1.295 1.00 0.69 O ATOM 2068 CB GLN A 136 -14.766 9.013 1.543 1.00 0.82 C ATOM 2069 CG GLN A 136 -16.280 8.822 1.525 1.00 1.05 C ATOM 2070 CD GLN A 136 -16.836 8.275 2.834 1.00 1.14 C ATOM 2071 OE1 GLN A 136 -16.135 7.332 3.447 1.00 1.75 O flip ATOM 2072 NE2 GLN A 136 -17.925 8.661 3.264 1.00 1.20 N flip ATOM 0 H GLN A 136 -12.451 9.582 0.952 1.00 0.49 H new ATOM 0 HA GLN A 136 -14.016 7.201 0.612 1.00 0.63 H new ATOM 0 HB2 GLN A 136 -14.385 8.678 2.508 1.00 0.82 H new ATOM 0 HB3 GLN A 136 -14.549 10.079 1.467 1.00 0.82 H new ATOM 0 HG2 GLN A 136 -16.757 9.778 1.307 1.00 1.05 H new ATOM 0 HG3 GLN A 136 -16.544 8.142 0.715 1.00 1.05 H new ATOM 0 HE21 GLN A 136 -18.440 9.389 2.769 1.00 1.20 H new ATOM 0 HE22 GLN A 136 -18.311 8.252 4.115 1.00 1.20 H new ATOM 2081 N ASP A 137 -14.163 9.478 -1.630 1.00 0.48 N ATOM 2082 CA ASP A 137 -14.800 9.917 -2.873 1.00 0.52 C ATOM 2083 C ASP A 137 -13.801 9.942 -4.018 1.00 0.47 C ATOM 2084 O ASP A 137 -14.134 9.643 -5.166 1.00 0.56 O ATOM 2085 CB ASP A 137 -15.375 11.332 -2.719 1.00 0.63 C ATOM 2086 CG ASP A 137 -16.184 11.528 -1.453 1.00 1.34 C ATOM 2087 OD1 ASP A 137 -15.584 11.736 -0.377 1.00 2.21 O ATOM 2088 OD2 ASP A 137 -17.430 11.452 -1.525 1.00 1.43 O ATOM 0 H ASP A 137 -13.316 9.990 -1.384 1.00 0.48 H new ATOM 0 HA ASP A 137 -15.598 9.207 -3.091 1.00 0.52 H new ATOM 0 HB2 ASP A 137 -14.555 12.051 -2.730 1.00 0.63 H new ATOM 0 HB3 ASP A 137 -16.005 11.554 -3.580 1.00 0.63 H new ATOM 2093 N TYR A 138 -12.579 10.317 -3.689 1.00 0.39 N ATOM 2094 CA TYR A 138 -11.547 10.558 -4.679 1.00 0.38 C ATOM 2095 C TYR A 138 -10.639 9.351 -4.804 1.00 0.32 C ATOM 2096 O TYR A 138 -10.866 8.328 -4.163 1.00 0.31 O ATOM 2097 CB TYR A 138 -10.736 11.800 -4.310 1.00 0.44 C ATOM 2098 CG TYR A 138 -11.595 13.017 -4.046 1.00 0.82 C ATOM 2099 CD1 TYR A 138 -12.203 13.705 -5.088 1.00 0.99 C ATOM 2100 CD2 TYR A 138 -11.802 13.472 -2.751 1.00 1.41 C ATOM 2101 CE1 TYR A 138 -12.993 14.814 -4.846 1.00 1.45 C ATOM 2102 CE2 TYR A 138 -12.589 14.580 -2.502 1.00 1.98 C ATOM 2103 CZ TYR A 138 -13.183 15.246 -3.551 1.00 1.94 C ATOM 2104 OH TYR A 138 -13.971 16.347 -3.305 1.00 2.50 O ATOM 0 H TYR A 138 -12.274 10.463 -2.727 1.00 0.39 H new ATOM 0 HA TYR A 138 -12.026 10.730 -5.643 1.00 0.38 H new ATOM 0 HB2 TYR A 138 -10.139 11.586 -3.424 1.00 0.44 H new ATOM 0 HB3 TYR A 138 -10.039 12.024 -5.118 1.00 0.44 H new ATOM 0 HD1 TYR A 138 -12.056 13.369 -6.104 1.00 0.99 H new ATOM 0 HD2 TYR A 138 -11.340 12.952 -1.925 1.00 1.41 H new ATOM 0 HE1 TYR A 138 -13.459 15.339 -5.667 1.00 1.45 H new ATOM 0 HE2 TYR A 138 -12.738 14.923 -1.489 1.00 1.98 H new ATOM 0 HH TYR A 138 -14.003 16.518 -2.341 1.00 2.50 H new ATOM 2114 N TRP A 139 -9.615 9.474 -5.625 1.00 0.34 N ATOM 2115 CA TRP A 139 -8.609 8.435 -5.731 1.00 0.33 C ATOM 2116 C TRP A 139 -7.769 8.423 -4.458 1.00 0.30 C ATOM 2117 O TRP A 139 -7.680 9.432 -3.756 1.00 0.32 O ATOM 2118 CB TRP A 139 -7.716 8.694 -6.949 1.00 0.40 C ATOM 2119 CG TRP A 139 -8.490 8.853 -8.222 1.00 1.19 C ATOM 2120 CD1 TRP A 139 -9.046 7.860 -8.969 1.00 2.40 C ATOM 2121 CD2 TRP A 139 -8.789 10.080 -8.899 1.00 1.47 C ATOM 2122 NE1 TRP A 139 -9.682 8.390 -10.065 1.00 3.09 N ATOM 2123 CE2 TRP A 139 -9.533 9.753 -10.048 1.00 2.48 C ATOM 2124 CE3 TRP A 139 -8.498 11.423 -8.645 1.00 1.75 C ATOM 2125 CZ2 TRP A 139 -9.995 10.721 -10.937 1.00 2.99 C ATOM 2126 CZ3 TRP A 139 -8.954 12.382 -9.528 1.00 2.37 C ATOM 2127 CH2 TRP A 139 -9.694 12.028 -10.663 1.00 2.74 C ATOM 0 H TRP A 139 -9.457 10.282 -6.228 1.00 0.34 H new ATOM 0 HA TRP A 139 -9.094 7.467 -5.856 1.00 0.33 H new ATOM 0 HB2 TRP A 139 -7.126 9.594 -6.775 1.00 0.40 H new ATOM 0 HB3 TRP A 139 -7.013 7.868 -7.059 1.00 0.40 H new ATOM 0 HD1 TRP A 139 -8.994 6.807 -8.734 1.00 2.40 H new ATOM 0 HE1 TRP A 139 -10.183 7.857 -10.776 1.00 3.09 H new ATOM 0 HE3 TRP A 139 -7.926 11.706 -7.773 1.00 1.75 H new ATOM 0 HZ2 TRP A 139 -10.570 10.450 -11.810 1.00 2.99 H new ATOM 0 HZ3 TRP A 139 -8.736 13.423 -9.340 1.00 2.37 H new ATOM 0 HH2 TRP A 139 -10.034 12.802 -11.336 1.00 2.74 H new ATOM 2138 N VAL A 140 -7.163 7.285 -4.163 1.00 0.30 N ATOM 2139 CA VAL A 140 -6.356 7.140 -2.963 1.00 0.33 C ATOM 2140 C VAL A 140 -5.064 7.934 -3.101 1.00 0.30 C ATOM 2141 O VAL A 140 -4.184 7.597 -3.893 1.00 0.32 O ATOM 2142 CB VAL A 140 -6.063 5.652 -2.658 1.00 0.44 C ATOM 2143 CG1 VAL A 140 -7.350 4.934 -2.290 1.00 1.58 C ATOM 2144 CG2 VAL A 140 -5.403 4.953 -3.840 1.00 1.28 C ATOM 0 H VAL A 140 -7.215 6.446 -4.740 1.00 0.30 H new ATOM 0 HA VAL A 140 -6.921 7.539 -2.121 1.00 0.33 H new ATOM 0 HB VAL A 140 -5.369 5.617 -1.818 1.00 0.44 H new ATOM 0 HG11 VAL A 140 -7.134 3.887 -2.077 1.00 1.58 H new ATOM 0 HG12 VAL A 140 -7.788 5.401 -1.408 1.00 1.58 H new ATOM 0 HG13 VAL A 140 -8.053 4.998 -3.121 1.00 1.58 H new ATOM 0 HG21 VAL A 140 -5.213 3.910 -3.586 1.00 1.28 H new ATOM 0 HG22 VAL A 140 -6.063 5.002 -4.706 1.00 1.28 H new ATOM 0 HG23 VAL A 140 -4.460 5.447 -4.074 1.00 1.28 H new ATOM 2154 N CYS A 141 -4.975 9.029 -2.368 1.00 0.30 N ATOM 2155 CA CYS A 141 -3.863 9.936 -2.540 1.00 0.26 C ATOM 2156 C CYS A 141 -2.837 9.809 -1.421 1.00 0.25 C ATOM 2157 O CYS A 141 -2.692 8.762 -0.790 1.00 0.29 O ATOM 2158 CB CYS A 141 -4.369 11.378 -2.644 1.00 0.33 C ATOM 2159 SG CYS A 141 -5.033 12.052 -1.108 1.00 1.21 S ATOM 0 H CYS A 141 -5.652 9.307 -1.657 1.00 0.30 H new ATOM 0 HA CYS A 141 -3.360 9.664 -3.468 1.00 0.26 H new ATOM 0 HB2 CYS A 141 -3.550 12.013 -2.980 1.00 0.33 H new ATOM 0 HB3 CYS A 141 -5.143 11.423 -3.410 1.00 0.33 H new ATOM 0 HG CYS A 141 -4.066 12.563 -0.405 1.00 1.21 H new ATOM 2165 N LEU A 142 -2.125 10.894 -1.213 1.00 0.21 N ATOM 2166 CA LEU A 142 -1.003 10.963 -0.322 1.00 0.23 C ATOM 2167 C LEU A 142 -1.150 12.238 0.487 1.00 0.24 C ATOM 2168 O LEU A 142 -1.937 13.108 0.119 1.00 0.23 O ATOM 2169 CB LEU A 142 0.239 10.944 -1.224 1.00 0.21 C ATOM 2170 CG LEU A 142 1.566 10.579 -0.598 1.00 0.22 C ATOM 2171 CD1 LEU A 142 1.692 9.071 -0.449 1.00 0.23 C ATOM 2172 CD2 LEU A 142 2.704 11.125 -1.435 1.00 0.25 C ATOM 0 H LEU A 142 -2.323 11.780 -1.679 1.00 0.21 H new ATOM 0 HA LEU A 142 -0.929 10.141 0.390 1.00 0.23 H new ATOM 0 HB2 LEU A 142 0.050 10.244 -2.038 1.00 0.21 H new ATOM 0 HB3 LEU A 142 0.342 11.933 -1.672 1.00 0.21 H new ATOM 0 HG LEU A 142 1.616 11.025 0.395 1.00 0.22 H new ATOM 0 HD11 LEU A 142 2.654 8.829 0.003 1.00 0.23 H new ATOM 0 HD12 LEU A 142 0.888 8.700 0.187 1.00 0.23 H new ATOM 0 HD13 LEU A 142 1.624 8.602 -1.430 1.00 0.23 H new ATOM 0 HD21 LEU A 142 3.655 10.857 -0.975 1.00 0.25 H new ATOM 0 HD22 LEU A 142 2.654 10.702 -2.438 1.00 0.25 H new ATOM 0 HD23 LEU A 142 2.624 12.210 -1.495 1.00 0.25 H new ATOM 2184 N ALA A 143 -0.477 12.316 1.613 1.00 0.34 N ATOM 2185 CA ALA A 143 -0.335 13.571 2.332 1.00 0.33 C ATOM 2186 C ALA A 143 0.843 13.461 3.275 1.00 0.60 C ATOM 2187 O ALA A 143 1.326 12.368 3.523 1.00 0.91 O ATOM 2188 CB ALA A 143 -1.606 13.884 3.105 1.00 0.38 C ATOM 0 H ALA A 143 -0.015 11.522 2.056 1.00 0.34 H new ATOM 0 HA ALA A 143 -0.163 14.382 1.625 1.00 0.33 H new ATOM 0 HB1 ALA A 143 -1.485 14.827 3.638 1.00 0.38 H new ATOM 0 HB2 ALA A 143 -2.443 13.965 2.412 1.00 0.38 H new ATOM 0 HB3 ALA A 143 -1.803 13.085 3.820 1.00 0.38 H new ATOM 2194 N GLY A 144 1.322 14.584 3.786 1.00 0.63 N ATOM 2195 CA GLY A 144 2.440 14.523 4.712 1.00 0.93 C ATOM 2196 C GLY A 144 1.967 14.460 6.130 1.00 0.93 C ATOM 2197 O GLY A 144 2.617 14.914 7.069 1.00 1.13 O ATOM 0 H GLY A 144 0.968 15.519 3.584 1.00 0.63 H new ATOM 0 HA2 GLY A 144 3.051 13.648 4.491 1.00 0.93 H new ATOM 0 HA3 GLY A 144 3.076 15.398 4.577 1.00 0.93 H new ATOM 2236 N SER A 148 -6.283 12.900 5.081 1.00 0.49 N ATOM 2237 CA SER A 148 -6.718 11.834 4.235 1.00 0.43 C ATOM 2238 C SER A 148 -6.782 10.578 5.070 1.00 0.37 C ATOM 2239 O SER A 148 -5.948 10.388 5.956 1.00 0.37 O ATOM 2240 CB SER A 148 -5.768 11.691 3.052 1.00 0.57 C ATOM 2241 OG SER A 148 -5.768 12.871 2.257 1.00 0.64 O ATOM 0 HA SER A 148 -7.707 12.035 3.823 1.00 0.43 H new ATOM 0 HB2 SER A 148 -4.759 11.490 3.413 1.00 0.57 H new ATOM 0 HB3 SER A 148 -6.065 10.837 2.443 1.00 0.57 H new ATOM 0 HG SER A 148 -6.014 13.640 2.813 1.00 0.64 H new ATOM 2247 N ILE A 149 -7.741 9.732 4.818 1.00 0.37 N ATOM 2248 CA ILE A 149 -7.889 8.542 5.621 1.00 0.32 C ATOM 2249 C ILE A 149 -6.921 7.502 5.150 1.00 0.26 C ATOM 2250 O ILE A 149 -7.157 6.838 4.181 1.00 0.29 O ATOM 2251 CB ILE A 149 -9.323 8.011 5.603 1.00 0.35 C ATOM 2252 CG1 ILE A 149 -10.258 9.090 6.156 1.00 0.57 C ATOM 2253 CG2 ILE A 149 -9.440 6.729 6.420 1.00 0.56 C ATOM 2254 CD1 ILE A 149 -9.962 9.484 7.591 1.00 1.21 C ATOM 0 H ILE A 149 -8.428 9.838 4.071 1.00 0.37 H new ATOM 0 HA ILE A 149 -7.668 8.797 6.657 1.00 0.32 H new ATOM 0 HB ILE A 149 -9.605 7.773 4.578 1.00 0.35 H new ATOM 0 HG12 ILE A 149 -10.188 9.976 5.525 1.00 0.57 H new ATOM 0 HG13 ILE A 149 -11.286 8.733 6.092 1.00 0.57 H new ATOM 0 HG21 ILE A 149 -10.469 6.372 6.391 1.00 0.56 H new ATOM 0 HG22 ILE A 149 -8.780 5.969 6.001 1.00 0.56 H new ATOM 0 HG23 ILE A 149 -9.154 6.928 7.453 1.00 0.56 H new ATOM 0 HD11 ILE A 149 -10.666 10.252 7.910 1.00 1.21 H new ATOM 0 HD12 ILE A 149 -10.061 8.611 8.236 1.00 1.21 H new ATOM 0 HD13 ILE A 149 -8.946 9.872 7.659 1.00 1.21 H new ATOM 2266 N THR A 150 -5.802 7.412 5.822 1.00 0.24 N ATOM 2267 CA THR A 150 -4.709 6.582 5.381 1.00 0.25 C ATOM 2268 C THR A 150 -4.898 5.218 5.983 1.00 0.26 C ATOM 2269 O THR A 150 -3.962 4.550 6.378 1.00 0.34 O ATOM 2270 CB THR A 150 -3.357 7.188 5.846 1.00 0.28 C ATOM 2271 OG1 THR A 150 -3.434 7.536 7.236 1.00 0.53 O ATOM 2272 CG2 THR A 150 -3.022 8.441 5.052 1.00 0.69 C ATOM 0 H THR A 150 -5.622 7.913 6.692 1.00 0.24 H new ATOM 0 HA THR A 150 -4.695 6.519 4.293 1.00 0.25 H new ATOM 0 HB THR A 150 -2.580 6.441 5.684 1.00 0.28 H new ATOM 0 HG1 THR A 150 -2.537 7.513 7.629 1.00 0.53 H new ATOM 0 HG21 THR A 150 -2.071 8.847 5.396 1.00 0.69 H new ATOM 0 HG22 THR A 150 -2.948 8.192 3.993 1.00 0.69 H new ATOM 0 HG23 THR A 150 -3.807 9.184 5.196 1.00 0.69 H new ATOM 2280 N ASP A 151 -6.140 4.814 6.042 1.00 0.25 N ATOM 2281 CA ASP A 151 -6.490 3.582 6.637 1.00 0.25 C ATOM 2282 C ASP A 151 -6.624 2.493 5.614 1.00 0.26 C ATOM 2283 O ASP A 151 -7.005 2.706 4.474 1.00 0.27 O ATOM 2284 CB ASP A 151 -7.751 3.739 7.441 1.00 0.29 C ATOM 2285 CG ASP A 151 -7.506 4.404 8.779 1.00 0.79 C ATOM 2286 OD1 ASP A 151 -6.799 3.818 9.622 1.00 1.25 O ATOM 2287 OD2 ASP A 151 -7.995 5.529 8.988 1.00 1.07 O ATOM 0 H ASP A 151 -6.930 5.344 5.673 1.00 0.25 H new ATOM 0 HA ASP A 151 -5.685 3.285 7.310 1.00 0.25 H new ATOM 0 HB2 ASP A 151 -8.470 4.329 6.872 1.00 0.29 H new ATOM 0 HB3 ASP A 151 -8.200 2.759 7.603 1.00 0.29 H new ATOM 2292 N PHE A 152 -6.247 1.347 6.034 1.00 0.27 N ATOM 2293 CA PHE A 152 -6.611 0.124 5.395 1.00 0.27 C ATOM 2294 C PHE A 152 -6.919 -0.895 6.473 1.00 0.28 C ATOM 2295 O PHE A 152 -6.611 -0.680 7.623 1.00 0.30 O ATOM 2296 CB PHE A 152 -5.491 -0.342 4.469 1.00 0.30 C ATOM 2297 CG PHE A 152 -4.538 -1.363 5.041 1.00 1.46 C ATOM 2298 CD1 PHE A 152 -3.436 -0.965 5.784 1.00 2.11 C ATOM 2299 CD2 PHE A 152 -4.761 -2.715 4.863 1.00 2.12 C ATOM 2300 CE1 PHE A 152 -2.578 -1.895 6.334 1.00 3.33 C ATOM 2301 CE2 PHE A 152 -3.903 -3.651 5.408 1.00 3.35 C ATOM 2302 CZ PHE A 152 -2.753 -3.244 6.042 1.00 3.93 C ATOM 0 H PHE A 152 -5.658 1.220 6.857 1.00 0.27 H new ATOM 0 HA PHE A 152 -7.496 0.260 4.773 1.00 0.27 H new ATOM 0 HB2 PHE A 152 -5.942 -0.760 3.569 1.00 0.30 H new ATOM 0 HB3 PHE A 152 -4.915 0.531 4.161 1.00 0.30 H new ATOM 0 HD1 PHE A 152 -3.247 0.088 5.934 1.00 2.11 H new ATOM 0 HD2 PHE A 152 -5.616 -3.044 4.291 1.00 2.12 H new ATOM 0 HE1 PHE A 152 -1.777 -1.578 6.986 1.00 3.33 H new ATOM 0 HE2 PHE A 152 -4.136 -4.703 5.336 1.00 3.35 H new ATOM 0 HZ PHE A 152 -1.994 -3.964 6.310 1.00 3.93 H new ATOM 2312 N GLN A 153 -7.495 -1.992 6.073 1.00 0.30 N ATOM 2313 CA GLN A 153 -7.966 -3.038 6.958 1.00 0.33 C ATOM 2314 C GLN A 153 -7.964 -4.306 6.140 1.00 0.38 C ATOM 2315 O GLN A 153 -8.242 -4.247 4.941 1.00 0.44 O ATOM 2316 CB GLN A 153 -9.402 -2.797 7.472 1.00 0.44 C ATOM 2317 CG GLN A 153 -9.764 -1.356 7.815 1.00 0.70 C ATOM 2318 CD GLN A 153 -10.952 -1.265 8.758 1.00 0.63 C ATOM 2319 OE1 GLN A 153 -11.150 -2.122 9.619 1.00 1.27 O ATOM 2320 NE2 GLN A 153 -11.769 -0.240 8.584 1.00 1.20 N ATOM 0 H GLN A 153 -7.659 -2.198 5.087 1.00 0.30 H new ATOM 0 HA GLN A 153 -7.320 -3.078 7.835 1.00 0.33 H new ATOM 0 HB2 GLN A 153 -10.101 -3.154 6.716 1.00 0.44 H new ATOM 0 HB3 GLN A 153 -9.554 -3.409 8.361 1.00 0.44 H new ATOM 0 HG2 GLN A 153 -8.903 -0.867 8.271 1.00 0.70 H new ATOM 0 HG3 GLN A 153 -9.990 -0.813 6.897 1.00 0.70 H new ATOM 0 HE21 GLN A 153 -11.573 0.451 7.860 1.00 1.20 H new ATOM 0 HE22 GLN A 153 -12.595 -0.141 9.174 1.00 1.20 H new ATOM 2329 N ILE A 154 -7.643 -5.442 6.730 1.00 0.43 N ATOM 2330 CA ILE A 154 -7.626 -6.657 5.944 1.00 0.45 C ATOM 2331 C ILE A 154 -8.969 -7.356 6.062 1.00 0.44 C ATOM 2332 O ILE A 154 -9.386 -7.813 7.131 1.00 0.49 O ATOM 2333 CB ILE A 154 -6.480 -7.613 6.353 1.00 0.56 C ATOM 2334 CG1 ILE A 154 -6.479 -7.866 7.865 1.00 1.14 C ATOM 2335 CG2 ILE A 154 -5.143 -7.044 5.904 1.00 1.53 C ATOM 2336 CD1 ILE A 154 -5.462 -8.896 8.303 1.00 1.63 C ATOM 0 H ILE A 154 -7.399 -5.548 7.715 1.00 0.43 H new ATOM 0 HA ILE A 154 -7.444 -6.377 4.906 1.00 0.45 H new ATOM 0 HB ILE A 154 -6.641 -8.571 5.859 1.00 0.56 H new ATOM 0 HG12 ILE A 154 -6.280 -6.927 8.382 1.00 1.14 H new ATOM 0 HG13 ILE A 154 -7.472 -8.194 8.171 1.00 1.14 H new ATOM 0 HG21 ILE A 154 -4.342 -7.723 6.196 1.00 1.53 H new ATOM 0 HG22 ILE A 154 -5.143 -6.927 4.820 1.00 1.53 H new ATOM 0 HG23 ILE A 154 -4.985 -6.073 6.374 1.00 1.53 H new ATOM 0 HD11 ILE A 154 -5.517 -9.025 9.384 1.00 1.63 H new ATOM 0 HD12 ILE A 154 -5.673 -9.847 7.813 1.00 1.63 H new ATOM 0 HD13 ILE A 154 -4.462 -8.560 8.028 1.00 1.63 H new ATOM 2348 N LEU A 155 -9.636 -7.395 4.922 1.00 0.43 N ATOM 2349 CA LEU A 155 -11.008 -7.851 4.800 1.00 0.44 C ATOM 2350 C LEU A 155 -11.045 -9.209 4.112 1.00 0.57 C ATOM 2351 O LEU A 155 -10.514 -9.371 3.016 1.00 0.67 O ATOM 2352 CB LEU A 155 -11.863 -6.840 4.004 1.00 0.53 C ATOM 2353 CG LEU A 155 -12.208 -5.494 4.691 1.00 0.46 C ATOM 2354 CD1 LEU A 155 -13.716 -5.313 4.744 1.00 0.82 C ATOM 2355 CD2 LEU A 155 -11.635 -5.404 6.097 1.00 0.73 C ATOM 0 H LEU A 155 -9.228 -7.103 4.034 1.00 0.43 H new ATOM 0 HA LEU A 155 -11.426 -7.938 5.803 1.00 0.44 H new ATOM 0 HB2 LEU A 155 -11.341 -6.618 3.073 1.00 0.53 H new ATOM 0 HB3 LEU A 155 -12.799 -7.330 3.735 1.00 0.53 H new ATOM 0 HG LEU A 155 -11.756 -4.700 4.097 1.00 0.46 H new ATOM 0 HD11 LEU A 155 -13.952 -4.365 5.228 1.00 0.82 H new ATOM 0 HD12 LEU A 155 -14.118 -5.313 3.731 1.00 0.82 H new ATOM 0 HD13 LEU A 155 -14.161 -6.131 5.311 1.00 0.82 H new ATOM 0 HD21 LEU A 155 -11.903 -4.444 6.538 1.00 0.73 H new ATOM 0 HD22 LEU A 155 -12.042 -6.210 6.708 1.00 0.73 H new ATOM 0 HD23 LEU A 155 -10.550 -5.494 6.054 1.00 0.73 H new ATOM 2367 N GLU A 156 -11.625 -10.184 4.778 1.00 0.67 N ATOM 2368 CA GLU A 156 -11.745 -11.514 4.256 1.00 0.89 C ATOM 2369 C GLU A 156 -13.009 -11.593 3.417 1.00 0.99 C ATOM 2370 O GLU A 156 -13.912 -10.788 3.598 1.00 0.90 O ATOM 2371 CB GLU A 156 -11.814 -12.485 5.424 1.00 1.04 C ATOM 2372 CG GLU A 156 -12.837 -12.104 6.479 1.00 1.58 C ATOM 2373 CD GLU A 156 -12.932 -13.127 7.585 1.00 2.05 C ATOM 2374 OE1 GLU A 156 -12.161 -13.020 8.560 1.00 2.57 O ATOM 2375 OE2 GLU A 156 -13.776 -14.045 7.483 1.00 2.53 O ATOM 0 H GLU A 156 -12.029 -10.067 5.707 1.00 0.67 H new ATOM 0 HA GLU A 156 -10.889 -11.769 3.631 1.00 0.89 H new ATOM 0 HB2 GLU A 156 -12.051 -13.479 5.044 1.00 1.04 H new ATOM 0 HB3 GLU A 156 -10.831 -12.548 5.891 1.00 1.04 H new ATOM 0 HG2 GLU A 156 -12.572 -11.136 6.905 1.00 1.58 H new ATOM 0 HG3 GLU A 156 -13.814 -11.989 6.009 1.00 1.58 H new ATOM 2382 N ASN A 157 -13.078 -12.557 2.514 1.00 1.23 N ATOM 2383 CA ASN A 157 -14.190 -12.637 1.573 1.00 1.41 C ATOM 2384 C ASN A 157 -15.374 -13.385 2.180 1.00 1.66 C ATOM 2385 O ASN A 157 -15.244 -14.017 3.232 1.00 1.82 O ATOM 2386 CB ASN A 157 -13.757 -13.293 0.258 1.00 1.68 C ATOM 2387 CG ASN A 157 -14.087 -14.773 0.164 1.00 2.14 C ATOM 2388 OD1 ASN A 157 -13.986 -15.514 1.135 1.00 2.67 O ATOM 2389 ND2 ASN A 157 -14.518 -15.200 -1.013 1.00 2.44 N ATOM 0 H ASN A 157 -12.381 -13.294 2.410 1.00 1.23 H new ATOM 0 HA ASN A 157 -14.508 -11.617 1.355 1.00 1.41 H new ATOM 0 HB2 ASN A 157 -14.236 -12.772 -0.571 1.00 1.68 H new ATOM 0 HB3 ASN A 157 -12.682 -13.163 0.137 1.00 1.68 H new ATOM 0 HD21 ASN A 157 -14.780 -16.178 -1.136 1.00 2.44 H new ATOM 0 HD22 ASN A 157 -14.588 -14.551 -1.797 1.00 2.44 H new ATOM 2396 N GLN A 158 -16.521 -13.300 1.529 1.00 1.77 N ATOM 2397 CA GLN A 158 -17.759 -13.803 2.106 1.00 2.06 C ATOM 2398 C GLN A 158 -17.796 -15.323 2.065 1.00 2.49 C ATOM 2399 O GLN A 158 -17.932 -15.983 3.100 1.00 2.73 O ATOM 2400 CB GLN A 158 -18.962 -13.230 1.356 1.00 2.08 C ATOM 2401 CG GLN A 158 -20.297 -13.584 1.990 1.00 2.54 C ATOM 2402 CD GLN A 158 -21.480 -13.103 1.176 1.00 2.68 C ATOM 2403 OE1 GLN A 158 -21.960 -11.983 1.353 1.00 3.15 O ATOM 2404 NE2 GLN A 158 -21.957 -13.946 0.275 1.00 2.98 N ATOM 0 H GLN A 158 -16.623 -12.888 0.601 1.00 1.77 H new ATOM 0 HA GLN A 158 -17.804 -13.485 3.148 1.00 2.06 H new ATOM 0 HB2 GLN A 158 -18.868 -12.145 1.309 1.00 2.08 H new ATOM 0 HB3 GLN A 158 -18.948 -13.596 0.329 1.00 2.08 H new ATOM 0 HG2 GLN A 158 -20.361 -14.665 2.111 1.00 2.54 H new ATOM 0 HG3 GLN A 158 -20.347 -13.148 2.988 1.00 2.54 H new ATOM 0 HE21 GLN A 158 -21.530 -14.865 0.160 1.00 2.98 H new ATOM 0 HE22 GLN A 158 -22.752 -13.677 -0.305 1.00 2.98 H new ATOM 2413 N ALA A 159 -17.634 -15.866 0.868 1.00 2.67 N ATOM 2414 CA ALA A 159 -17.629 -17.304 0.668 1.00 3.14 C ATOM 2415 C ALA A 159 -16.863 -17.648 -0.599 1.00 3.38 C ATOM 2416 O ALA A 159 -15.728 -18.158 -0.491 1.00 3.55 O ATOM 2417 CB ALA A 159 -19.053 -17.840 0.595 1.00 3.37 C ATOM 2418 OXT ALA A 159 -17.381 -17.376 -1.697 1.00 3.78 O ATOM 0 H ALA A 159 -17.503 -15.325 0.014 1.00 2.67 H new ATOM 0 HA ALA A 159 -17.133 -17.775 1.517 1.00 3.14 H new ATOM 0 HB1 ALA A 159 -19.028 -18.919 0.445 1.00 3.37 H new ATOM 0 HB2 ALA A 159 -19.575 -17.615 1.525 1.00 3.37 H new ATOM 0 HB3 ALA A 159 -19.577 -17.370 -0.237 1.00 3.37 H new