USER MOD reduce.3.24.130724 H: found=0, std=0, add=821, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 823 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 35 GLN : amide:sc= -0.171 X(o=0.1,f=-0.24) USER MOD Set 1.2: A 38 GLN : amide:sc= 0.271 X(o=0.1,f=-0.24) USER MOD Single : A 4 TYR OH : rot 130:sc= 0.042 USER MOD Single : A 8 LYS NZ :NH3+ 151:sc= -0.0111 (180deg=-0.442) USER MOD Single : A 9 SER OG : rot -35:sc= 0.448 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.0168 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl -164:sc= -0.388 (180deg=-0.503) USER MOD Single : A 28 GLN : amide:sc= -0.308 X(o=-0.31,f=-0.14) USER MOD Single : A 36 LYS NZ :NH3+ -147:sc= 0.576 (180deg=-2.22!) USER MOD Single : A 37 TYR OH : rot 150:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ -144:sc= 0.0946 (180deg=0) USER MOD Single : A 42 GLN : amide:sc= -0.22 X(o=-0.22,f=-0.15) USER MOD Single : B 104 TYR OH : rot 180:sc= 0 USER MOD Single : B 108 LYS NZ :NH3+ 180:sc= -0.143 (180deg=-0.143) USER MOD Single : B 109 SER OG : rot -41:sc= 0.514 USER MOD Single : B 111 THR OG1 : rot -86:sc= 1.54 USER MOD Single : B 116 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 125 MET CE :methyl -169:sc= 0 (180deg=-0.143) USER MOD Single : B 126 MET CE :methyl 179:sc= 0 (180deg=-0.000579) USER MOD Single : B 128 GLN : amide:sc= -0.46 X(o=-0.46,f=-0.46) USER MOD Single : B 135 GLN : amide:sc= -0.0356 X(o=-0.036,f=-0.036) USER MOD Single : B 136 LYS NZ :NH3+ 149:sc= 1.1 (180deg=0.094) USER MOD Single : B 137 TYR OH : rot 145:sc= 1.27 USER MOD Single : B 138 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : B 139 SER OG : rot 180:sc= 0 USER MOD Single : B 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 142 GLN :FLIP amide:sc= -0.103 F(o=-1.4!,f=-0.1) USER MOD Single : B 151 LYS NZ :NH3+ 164:sc= -0.0332 (180deg=-0.982!) USER MOD ----------------------------------------------------------------- ATOM 31 N TYR A 4 -20.225 -3.940 7.102 1.00 0.00 N ATOM 32 CA TYR A 4 -21.124 -3.068 6.355 1.00 0.00 C ATOM 33 C TYR A 4 -22.096 -3.877 5.483 1.00 0.00 C ATOM 34 O TYR A 4 -22.731 -3.308 4.612 1.00 0.00 O ATOM 35 CB TYR A 4 -20.310 -2.077 5.492 1.00 0.00 C ATOM 36 CG TYR A 4 -19.349 -1.097 6.155 1.00 0.00 C ATOM 37 CD1 TYR A 4 -19.361 -0.857 7.541 1.00 0.00 C ATOM 38 CD2 TYR A 4 -18.488 -0.336 5.340 1.00 0.00 C ATOM 39 CE1 TYR A 4 -18.529 0.113 8.115 1.00 0.00 C ATOM 40 CE2 TYR A 4 -17.650 0.644 5.903 1.00 0.00 C ATOM 41 CZ TYR A 4 -17.688 0.888 7.291 1.00 0.00 C ATOM 42 OH TYR A 4 -16.965 1.908 7.819 1.00 0.00 O ATOM 0 HA TYR A 4 -21.720 -2.503 7.072 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -19.732 -2.667 4.781 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -21.023 -1.490 4.914 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -20.023 -1.430 8.173 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -18.471 -0.506 4.274 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -18.532 0.266 9.184 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -16.979 1.208 5.273 1.00 0.00 H new ATOM 0 HH TYR A 4 -16.030 1.826 7.538 1.00 0.00 H new ATOM 52 N GLU A 5 -22.252 -5.183 5.698 1.00 0.00 N ATOM 53 CA GLU A 5 -23.138 -6.081 4.937 1.00 0.00 C ATOM 54 C GLU A 5 -24.533 -5.507 4.653 1.00 0.00 C ATOM 55 O GLU A 5 -25.062 -5.672 3.560 1.00 0.00 O ATOM 56 CB GLU A 5 -23.220 -7.409 5.709 1.00 0.00 C ATOM 57 CG GLU A 5 -23.914 -7.262 7.078 1.00 0.00 C ATOM 58 CD GLU A 5 -23.306 -8.176 8.128 1.00 0.00 C ATOM 59 OE1 GLU A 5 -23.688 -9.362 8.220 1.00 0.00 O ATOM 60 OE2 GLU A 5 -22.394 -7.736 8.865 1.00 0.00 O ATOM 0 H GLU A 5 -21.746 -5.670 6.437 1.00 0.00 H new ATOM 0 HA GLU A 5 -22.709 -6.224 3.945 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -23.762 -8.140 5.109 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -22.214 -7.801 5.857 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -23.840 -6.227 7.412 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -24.975 -7.488 6.972 1.00 0.00 H new ATOM 67 N PHE A 6 -25.083 -4.765 5.611 1.00 0.00 N ATOM 68 CA PHE A 6 -26.373 -4.099 5.623 1.00 0.00 C ATOM 69 C PHE A 6 -26.481 -2.991 4.563 1.00 0.00 C ATOM 70 O PHE A 6 -27.535 -2.377 4.411 1.00 0.00 O ATOM 71 CB PHE A 6 -26.607 -3.571 7.044 1.00 0.00 C ATOM 72 CG PHE A 6 -26.346 -4.584 8.150 1.00 0.00 C ATOM 73 CD1 PHE A 6 -27.194 -5.696 8.304 1.00 0.00 C ATOM 74 CD2 PHE A 6 -25.229 -4.439 9.001 1.00 0.00 C ATOM 75 CE1 PHE A 6 -26.929 -6.657 9.297 1.00 0.00 C ATOM 76 CE2 PHE A 6 -24.963 -5.403 9.992 1.00 0.00 C ATOM 77 CZ PHE A 6 -25.814 -6.512 10.140 1.00 0.00 C ATOM 0 H PHE A 6 -24.581 -4.602 6.484 1.00 0.00 H new ATOM 0 HA PHE A 6 -27.154 -4.810 5.355 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -25.966 -2.704 7.205 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -27.637 -3.224 7.123 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -28.051 -5.812 7.658 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -24.576 -3.586 8.891 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -27.584 -7.508 9.412 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -24.105 -5.290 10.638 1.00 0.00 H new ATOM 0 HZ PHE A 6 -25.611 -7.252 10.900 1.00 0.00 H new ATOM 87 N LEU A 7 -25.403 -2.738 3.810 1.00 0.00 N ATOM 88 CA LEU A 7 -25.299 -1.756 2.732 1.00 0.00 C ATOM 89 C LEU A 7 -26.398 -2.016 1.716 1.00 0.00 C ATOM 90 O LEU A 7 -26.798 -1.096 1.007 1.00 0.00 O ATOM 91 CB LEU A 7 -23.946 -1.894 2.011 1.00 0.00 C ATOM 92 CG LEU A 7 -22.833 -1.022 2.610 1.00 0.00 C ATOM 93 CD1 LEU A 7 -21.477 -1.642 2.256 1.00 0.00 C ATOM 94 CD2 LEU A 7 -22.871 0.400 2.040 1.00 0.00 C ATOM 0 H LEU A 7 -24.529 -3.246 3.948 1.00 0.00 H new ATOM 0 HA LEU A 7 -25.389 -0.758 3.160 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -23.633 -2.938 2.042 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -24.076 -1.631 0.961 1.00 0.00 H new ATOM 0 HG LEU A 7 -22.980 -0.974 3.689 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -20.677 -1.032 2.676 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -21.419 -2.650 2.668 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -21.369 -1.686 1.172 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -22.071 0.992 2.484 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -22.737 0.362 0.959 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -23.832 0.859 2.271 1.00 0.00 H new ATOM 106 N LYS A 8 -26.869 -3.266 1.636 1.00 0.00 N ATOM 107 CA LYS A 8 -27.941 -3.628 0.709 1.00 0.00 C ATOM 108 C LYS A 8 -29.210 -2.799 0.956 1.00 0.00 C ATOM 109 O LYS A 8 -30.011 -2.630 0.040 1.00 0.00 O ATOM 110 CB LYS A 8 -28.313 -5.107 0.878 1.00 0.00 C ATOM 111 CG LYS A 8 -27.184 -6.134 0.797 1.00 0.00 C ATOM 112 CD LYS A 8 -26.278 -6.065 -0.437 1.00 0.00 C ATOM 113 CE LYS A 8 -25.281 -7.210 -0.246 1.00 0.00 C ATOM 114 NZ LYS A 8 -24.153 -7.198 -1.194 1.00 0.00 N ATOM 0 H LYS A 8 -26.524 -4.041 2.202 1.00 0.00 H new ATOM 0 HA LYS A 8 -27.568 -3.432 -0.296 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -28.803 -5.222 1.845 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -29.050 -5.357 0.115 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -26.560 -6.024 1.684 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -27.626 -7.130 0.839 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -26.850 -6.187 -1.357 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -25.770 -5.103 -0.503 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -24.887 -7.167 0.769 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -25.811 -8.157 -0.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -23.321 -7.634 -0.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -24.410 -7.735 -2.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -23.931 -6.217 -1.457 1.00 0.00 H new ATOM 128 N SER A 9 -29.414 -2.303 2.177 1.00 0.00 N ATOM 129 CA SER A 9 -30.575 -1.523 2.571 1.00 0.00 C ATOM 130 C SER A 9 -30.260 -0.029 2.641 1.00 0.00 C ATOM 131 O SER A 9 -31.151 0.743 3.006 1.00 0.00 O ATOM 132 CB SER A 9 -31.040 -2.053 3.933 1.00 0.00 C ATOM 133 OG SER A 9 -32.287 -1.504 4.305 1.00 0.00 O ATOM 0 H SER A 9 -28.751 -2.441 2.940 1.00 0.00 H new ATOM 0 HA SER A 9 -31.364 -1.630 1.826 1.00 0.00 H new ATOM 0 HB2 SER A 9 -31.117 -3.140 3.895 1.00 0.00 H new ATOM 0 HB3 SER A 9 -30.295 -1.813 4.691 1.00 0.00 H new ATOM 0 HG SER A 9 -32.344 -0.578 3.990 1.00 0.00 H new ATOM 139 N TRP A 10 -29.014 0.392 2.403 1.00 0.00 N ATOM 140 CA TRP A 10 -28.660 1.802 2.439 1.00 0.00 C ATOM 141 C TRP A 10 -29.098 2.463 1.133 1.00 0.00 C ATOM 142 O TRP A 10 -29.413 1.809 0.134 1.00 0.00 O ATOM 143 CB TRP A 10 -27.144 1.964 2.620 1.00 0.00 C ATOM 144 CG TRP A 10 -26.528 1.620 3.949 1.00 0.00 C ATOM 145 CD1 TRP A 10 -25.222 1.838 4.227 1.00 0.00 C ATOM 146 CD2 TRP A 10 -27.083 0.963 5.142 1.00 0.00 C ATOM 147 NE1 TRP A 10 -24.906 1.272 5.441 1.00 0.00 N ATOM 148 CE2 TRP A 10 -26.003 0.697 6.036 1.00 0.00 C ATOM 149 CE3 TRP A 10 -28.364 0.549 5.578 1.00 0.00 C ATOM 150 CZ2 TRP A 10 -26.161 -0.019 7.229 1.00 0.00 C ATOM 151 CZ3 TRP A 10 -28.541 -0.181 6.770 1.00 0.00 C ATOM 152 CH2 TRP A 10 -27.435 -0.488 7.578 1.00 0.00 C ATOM 0 H TRP A 10 -28.236 -0.231 2.183 1.00 0.00 H new ATOM 0 HA TRP A 10 -29.165 2.278 3.280 1.00 0.00 H new ATOM 0 HB2 TRP A 10 -26.655 1.352 1.862 1.00 0.00 H new ATOM 0 HB3 TRP A 10 -26.895 3.002 2.401 1.00 0.00 H new ATOM 0 HD1 TRP A 10 -24.532 2.375 3.593 1.00 0.00 H new ATOM 0 HE1 TRP A 10 -23.971 1.279 5.849 1.00 0.00 H new ATOM 0 HE3 TRP A 10 -29.229 0.799 4.981 1.00 0.00 H new ATOM 0 HZ2 TRP A 10 -25.313 -0.207 7.871 1.00 0.00 H new ATOM 0 HZ3 TRP A 10 -29.529 -0.505 7.062 1.00 0.00 H new ATOM 0 HH2 TRP A 10 -27.566 -1.085 8.468 1.00 0.00 H new ATOM 163 N THR A 11 -29.140 3.790 1.144 1.00 0.00 N ATOM 164 CA THR A 11 -29.500 4.553 -0.033 1.00 0.00 C ATOM 165 C THR A 11 -28.321 4.507 -1.012 1.00 0.00 C ATOM 166 O THR A 11 -27.178 4.215 -0.633 1.00 0.00 O ATOM 167 CB THR A 11 -29.832 6.006 0.345 1.00 0.00 C ATOM 168 OG1 THR A 11 -28.872 6.564 1.225 1.00 0.00 O ATOM 169 CG2 THR A 11 -31.210 6.122 0.995 1.00 0.00 C ATOM 0 H THR A 11 -28.927 4.358 1.964 1.00 0.00 H new ATOM 0 HA THR A 11 -30.387 4.123 -0.498 1.00 0.00 H new ATOM 0 HB THR A 11 -29.822 6.562 -0.592 1.00 0.00 H new ATOM 0 HG1 THR A 11 -29.121 7.488 1.437 1.00 0.00 H new ATOM 0 HG21 THR A 11 -31.407 7.164 1.247 1.00 0.00 H new ATOM 0 HG22 THR A 11 -31.971 5.767 0.300 1.00 0.00 H new ATOM 0 HG23 THR A 11 -31.236 5.518 1.902 1.00 0.00 H new ATOM 177 N VAL A 12 -28.600 4.805 -2.283 1.00 0.00 N ATOM 178 CA VAL A 12 -27.567 4.827 -3.306 1.00 0.00 C ATOM 179 C VAL A 12 -26.523 5.888 -2.937 1.00 0.00 C ATOM 180 O VAL A 12 -25.336 5.672 -3.159 1.00 0.00 O ATOM 181 CB VAL A 12 -28.192 5.017 -4.705 1.00 0.00 C ATOM 182 CG1 VAL A 12 -29.016 6.308 -4.852 1.00 0.00 C ATOM 183 CG2 VAL A 12 -27.115 4.953 -5.792 1.00 0.00 C ATOM 0 H VAL A 12 -29.534 5.034 -2.623 1.00 0.00 H new ATOM 0 HA VAL A 12 -27.047 3.870 -3.352 1.00 0.00 H new ATOM 0 HB VAL A 12 -28.893 4.191 -4.828 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -29.421 6.368 -5.862 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -29.835 6.301 -4.132 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -28.377 7.171 -4.666 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -27.577 5.089 -6.770 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -26.381 5.741 -5.624 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -26.620 3.983 -5.757 1.00 0.00 H new ATOM 193 N GLU A 13 -26.933 6.996 -2.310 1.00 0.00 N ATOM 194 CA GLU A 13 -25.995 8.033 -1.927 1.00 0.00 C ATOM 195 C GLU A 13 -25.110 7.546 -0.783 1.00 0.00 C ATOM 196 O GLU A 13 -23.892 7.583 -0.909 1.00 0.00 O ATOM 197 CB GLU A 13 -26.729 9.306 -1.511 1.00 0.00 C ATOM 198 CG GLU A 13 -27.516 9.947 -2.661 1.00 0.00 C ATOM 199 CD GLU A 13 -28.108 11.266 -2.185 1.00 0.00 C ATOM 200 OE1 GLU A 13 -28.950 11.238 -1.260 1.00 0.00 O ATOM 201 OE2 GLU A 13 -27.624 12.332 -2.623 1.00 0.00 O ATOM 0 H GLU A 13 -27.904 7.188 -2.062 1.00 0.00 H new ATOM 0 HA GLU A 13 -25.371 8.262 -2.791 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -27.413 9.074 -0.695 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -26.007 10.026 -1.127 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -26.862 10.115 -3.516 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -28.309 9.277 -2.993 1.00 0.00 H new ATOM 208 N ASP A 14 -25.684 7.038 0.310 1.00 0.00 N ATOM 209 CA ASP A 14 -24.894 6.580 1.456 1.00 0.00 C ATOM 210 C ASP A 14 -23.848 5.552 1.050 1.00 0.00 C ATOM 211 O ASP A 14 -22.691 5.641 1.481 1.00 0.00 O ATOM 212 CB ASP A 14 -25.781 5.988 2.558 1.00 0.00 C ATOM 213 CG ASP A 14 -26.368 7.012 3.522 1.00 0.00 C ATOM 214 OD1 ASP A 14 -26.174 8.238 3.344 1.00 0.00 O ATOM 215 OD2 ASP A 14 -27.004 6.559 4.501 1.00 0.00 O ATOM 0 H ASP A 14 -26.692 6.933 0.426 1.00 0.00 H new ATOM 0 HA ASP A 14 -24.387 7.463 1.845 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -26.598 5.438 2.091 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -25.196 5.266 3.128 1.00 0.00 H new ATOM 220 N LEU A 15 -24.246 4.564 0.243 1.00 0.00 N ATOM 221 CA LEU A 15 -23.321 3.536 -0.211 1.00 0.00 C ATOM 222 C LEU A 15 -22.286 4.169 -1.153 1.00 0.00 C ATOM 223 O LEU A 15 -21.095 3.889 -1.008 1.00 0.00 O ATOM 224 CB LEU A 15 -24.086 2.322 -0.794 1.00 0.00 C ATOM 225 CG LEU A 15 -24.469 2.441 -2.275 1.00 0.00 C ATOM 226 CD1 LEU A 15 -23.292 2.099 -3.195 1.00 0.00 C ATOM 227 CD2 LEU A 15 -25.646 1.548 -2.658 1.00 0.00 C ATOM 0 H LEU A 15 -25.199 4.459 -0.105 1.00 0.00 H new ATOM 0 HA LEU A 15 -22.758 3.123 0.626 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -23.473 1.430 -0.664 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -24.995 2.172 -0.211 1.00 0.00 H new ATOM 0 HG LEU A 15 -24.759 3.483 -2.409 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -23.603 2.195 -4.235 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -22.466 2.783 -2.999 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -22.968 1.075 -3.006 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -25.870 1.676 -3.717 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -25.390 0.506 -2.464 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -26.519 1.823 -2.067 1.00 0.00 H new ATOM 239 N GLN A 16 -22.692 5.030 -2.097 1.00 0.00 N ATOM 240 CA GLN A 16 -21.770 5.663 -3.036 1.00 0.00 C ATOM 241 C GLN A 16 -20.735 6.486 -2.274 1.00 0.00 C ATOM 242 O GLN A 16 -19.553 6.444 -2.594 1.00 0.00 O ATOM 243 CB GLN A 16 -22.529 6.517 -4.050 1.00 0.00 C ATOM 244 CG GLN A 16 -21.595 7.159 -5.085 1.00 0.00 C ATOM 245 CD GLN A 16 -22.430 7.762 -6.201 1.00 0.00 C ATOM 246 OE1 GLN A 16 -22.686 8.964 -6.205 1.00 0.00 O ATOM 247 NE2 GLN A 16 -22.936 6.931 -7.093 1.00 0.00 N ATOM 0 H GLN A 16 -23.666 5.303 -2.227 1.00 0.00 H new ATOM 0 HA GLN A 16 -21.245 4.888 -3.594 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -23.266 5.899 -4.563 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -23.078 7.299 -3.525 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -20.984 7.929 -4.614 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -20.911 6.412 -5.488 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -22.700 5.939 -7.058 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -23.563 7.281 -7.818 1.00 0.00 H new ATOM 256 N LYS A 17 -21.137 7.208 -1.227 1.00 0.00 N ATOM 257 CA LYS A 17 -20.219 8.010 -0.424 1.00 0.00 C ATOM 258 C LYS A 17 -19.182 7.083 0.216 1.00 0.00 C ATOM 259 O LYS A 17 -18.040 7.505 0.405 1.00 0.00 O ATOM 260 CB LYS A 17 -21.003 8.872 0.583 1.00 0.00 C ATOM 261 CG LYS A 17 -21.449 10.253 0.047 1.00 0.00 C ATOM 262 CD LYS A 17 -21.998 10.270 -1.388 1.00 0.00 C ATOM 263 CE LYS A 17 -22.935 11.441 -1.685 1.00 0.00 C ATOM 264 NZ LYS A 17 -22.250 12.688 -2.078 1.00 0.00 N ATOM 0 H LYS A 17 -22.107 7.252 -0.914 1.00 0.00 H new ATOM 0 HA LYS A 17 -19.671 8.718 -1.045 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -21.887 8.319 0.902 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -20.385 9.024 1.468 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -22.215 10.650 0.713 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -20.599 10.933 0.098 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -21.161 10.303 -2.085 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -22.530 9.337 -1.573 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -23.618 11.150 -2.483 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -23.542 11.638 -0.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -22.956 13.429 -2.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -21.618 12.994 -1.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -21.692 12.521 -2.940 1.00 0.00 H new ATOM 278 N ARG A 18 -19.526 5.837 0.577 1.00 0.00 N ATOM 279 CA ARG A 18 -18.553 4.902 1.146 1.00 0.00 C ATOM 280 C ARG A 18 -17.566 4.510 0.054 1.00 0.00 C ATOM 281 O ARG A 18 -16.370 4.481 0.322 1.00 0.00 O ATOM 282 CB ARG A 18 -19.225 3.645 1.732 1.00 0.00 C ATOM 283 CG ARG A 18 -19.886 3.824 3.105 1.00 0.00 C ATOM 284 CD ARG A 18 -18.858 3.743 4.241 1.00 0.00 C ATOM 285 NE ARG A 18 -18.005 4.935 4.331 1.00 0.00 N ATOM 286 CZ ARG A 18 -16.896 5.069 5.062 1.00 0.00 C ATOM 287 NH1 ARG A 18 -16.500 4.106 5.885 1.00 0.00 N ATOM 288 NH2 ARG A 18 -16.182 6.177 4.926 1.00 0.00 N ATOM 0 H ARG A 18 -20.468 5.458 0.484 1.00 0.00 H new ATOM 0 HA ARG A 18 -18.039 5.396 1.970 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -19.981 3.298 1.028 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -18.476 2.857 1.810 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -20.395 4.787 3.142 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -20.647 3.056 3.246 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -19.381 3.605 5.187 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -18.230 2.864 4.093 1.00 0.00 H new ATOM 0 HE ARG A 18 -18.289 5.744 3.778 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -17.045 3.248 5.966 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -15.650 4.224 6.437 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -16.484 6.902 4.275 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -15.330 6.305 5.472 1.00 0.00 H new ATOM 302 N LEU A 19 -18.059 4.197 -1.148 1.00 0.00 N ATOM 303 CA LEU A 19 -17.253 3.809 -2.308 1.00 0.00 C ATOM 304 C LEU A 19 -16.264 4.917 -2.646 1.00 0.00 C ATOM 305 O LEU A 19 -15.076 4.672 -2.842 1.00 0.00 O ATOM 306 CB LEU A 19 -18.183 3.517 -3.511 1.00 0.00 C ATOM 307 CG LEU A 19 -17.537 3.642 -4.903 1.00 0.00 C ATOM 308 CD1 LEU A 19 -16.421 2.621 -5.108 1.00 0.00 C ATOM 309 CD2 LEU A 19 -18.597 3.448 -5.982 1.00 0.00 C ATOM 0 H LEU A 19 -19.060 4.207 -1.346 1.00 0.00 H new ATOM 0 HA LEU A 19 -16.689 2.906 -2.075 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -18.578 2.507 -3.404 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -19.033 4.198 -3.463 1.00 0.00 H new ATOM 0 HG LEU A 19 -17.101 4.639 -4.974 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -15.993 2.745 -6.103 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -15.645 2.774 -4.358 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -16.827 1.614 -5.010 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -18.136 3.537 -6.966 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -19.044 2.459 -5.879 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -19.370 4.209 -5.874 1.00 0.00 H new ATOM 321 N LEU A 20 -16.769 6.141 -2.694 1.00 0.00 N ATOM 322 CA LEU A 20 -16.003 7.320 -3.005 1.00 0.00 C ATOM 323 C LEU A 20 -14.909 7.506 -1.962 1.00 0.00 C ATOM 324 O LEU A 20 -13.758 7.704 -2.320 1.00 0.00 O ATOM 325 CB LEU A 20 -16.969 8.515 -3.044 1.00 0.00 C ATOM 326 CG LEU A 20 -16.265 9.875 -2.985 1.00 0.00 C ATOM 327 CD1 LEU A 20 -15.341 10.108 -4.179 1.00 0.00 C ATOM 328 CD2 LEU A 20 -17.323 10.979 -2.895 1.00 0.00 C ATOM 0 H LEU A 20 -17.753 6.338 -2.511 1.00 0.00 H new ATOM 0 HA LEU A 20 -15.513 7.231 -3.975 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -17.563 8.462 -3.957 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -17.663 8.438 -2.207 1.00 0.00 H new ATOM 0 HG LEU A 20 -15.630 9.891 -2.099 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -14.868 11.086 -4.087 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -14.574 9.334 -4.202 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -15.921 10.071 -5.101 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -16.832 11.951 -2.852 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -17.969 10.937 -3.772 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -17.923 10.836 -1.996 1.00 0.00 H new ATOM 340 N ALA A 21 -15.245 7.446 -0.670 1.00 0.00 N ATOM 341 CA ALA A 21 -14.256 7.622 0.396 1.00 0.00 C ATOM 342 C ALA A 21 -13.190 6.520 0.385 1.00 0.00 C ATOM 343 O ALA A 21 -12.083 6.729 0.888 1.00 0.00 O ATOM 344 CB ALA A 21 -14.951 7.668 1.758 1.00 0.00 C ATOM 0 H ALA A 21 -16.194 7.277 -0.338 1.00 0.00 H new ATOM 0 HA ALA A 21 -13.748 8.569 0.214 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -14.206 7.799 2.543 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -15.652 8.502 1.781 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -15.491 6.736 1.923 1.00 0.00 H new ATOM 350 N LEU A 22 -13.531 5.359 -0.176 1.00 0.00 N ATOM 351 CA LEU A 22 -12.685 4.176 -0.310 1.00 0.00 C ATOM 352 C LEU A 22 -11.488 4.482 -1.214 1.00 0.00 C ATOM 353 O LEU A 22 -10.403 3.941 -0.991 1.00 0.00 O ATOM 354 CB LEU A 22 -13.524 3.011 -0.896 1.00 0.00 C ATOM 355 CG LEU A 22 -13.455 1.642 -0.213 1.00 0.00 C ATOM 356 CD1 LEU A 22 -12.087 0.996 -0.291 1.00 0.00 C ATOM 357 CD2 LEU A 22 -13.922 1.722 1.236 1.00 0.00 C ATOM 0 H LEU A 22 -14.460 5.212 -0.572 1.00 0.00 H new ATOM 0 HA LEU A 22 -12.307 3.887 0.670 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -14.568 3.325 -0.903 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -13.225 2.878 -1.936 1.00 0.00 H new ATOM 0 HG LEU A 22 -14.136 1.000 -0.772 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -12.112 0.030 0.213 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -11.811 0.853 -1.336 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -11.353 1.639 0.194 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -13.861 0.734 1.693 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -13.286 2.416 1.786 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -14.953 2.073 1.267 1.00 0.00 H new ATOM 369 N ASP A 23 -11.674 5.351 -2.215 1.00 0.00 N ATOM 370 CA ASP A 23 -10.631 5.733 -3.165 1.00 0.00 C ATOM 371 C ASP A 23 -9.443 6.377 -2.446 1.00 0.00 C ATOM 372 O ASP A 23 -8.375 5.757 -2.452 1.00 0.00 O ATOM 373 CB ASP A 23 -11.181 6.638 -4.295 1.00 0.00 C ATOM 374 CG ASP A 23 -11.808 5.875 -5.459 1.00 0.00 C ATOM 375 OD1 ASP A 23 -11.623 4.643 -5.569 1.00 0.00 O ATOM 376 OD2 ASP A 23 -12.556 6.471 -6.268 1.00 0.00 O ATOM 0 H ASP A 23 -12.567 5.813 -2.387 1.00 0.00 H new ATOM 0 HA ASP A 23 -10.272 4.821 -3.643 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -11.926 7.313 -3.874 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -10.369 7.257 -4.677 1.00 0.00 H new ATOM 381 N PRO A 24 -9.576 7.534 -1.764 1.00 0.00 N ATOM 382 CA PRO A 24 -8.452 8.142 -1.077 1.00 0.00 C ATOM 383 C PRO A 24 -7.973 7.310 0.118 1.00 0.00 C ATOM 384 O PRO A 24 -6.851 7.539 0.564 1.00 0.00 O ATOM 385 CB PRO A 24 -8.900 9.549 -0.673 1.00 0.00 C ATOM 386 CG PRO A 24 -10.415 9.429 -0.578 1.00 0.00 C ATOM 387 CD PRO A 24 -10.742 8.395 -1.650 1.00 0.00 C ATOM 0 HA PRO A 24 -7.583 8.191 -1.733 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -8.461 9.852 0.278 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -8.602 10.292 -1.413 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -10.733 9.100 0.411 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -10.909 10.381 -0.771 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -11.625 7.818 -1.375 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -10.961 8.879 -2.602 1.00 0.00 H new ATOM 395 N MET A 25 -8.770 6.371 0.656 1.00 0.00 N ATOM 396 CA MET A 25 -8.340 5.549 1.790 1.00 0.00 C ATOM 397 C MET A 25 -7.159 4.682 1.370 1.00 0.00 C ATOM 398 O MET A 25 -6.100 4.724 1.988 1.00 0.00 O ATOM 399 CB MET A 25 -9.442 4.599 2.296 1.00 0.00 C ATOM 400 CG MET A 25 -10.615 5.257 3.013 1.00 0.00 C ATOM 401 SD MET A 25 -10.810 4.803 4.753 1.00 0.00 S ATOM 402 CE MET A 25 -12.277 5.798 5.102 1.00 0.00 C ATOM 0 H MET A 25 -9.712 6.166 0.322 1.00 0.00 H new ATOM 0 HA MET A 25 -8.080 6.242 2.590 1.00 0.00 H new ATOM 0 HB2 MET A 25 -9.830 4.039 1.445 1.00 0.00 H new ATOM 0 HB3 MET A 25 -8.988 3.876 2.973 1.00 0.00 H new ATOM 0 HG2 MET A 25 -10.499 6.339 2.948 1.00 0.00 H new ATOM 0 HG3 MET A 25 -11.533 5.002 2.483 1.00 0.00 H new ATOM 0 HE1 MET A 25 -12.570 5.661 6.143 1.00 0.00 H new ATOM 0 HE2 MET A 25 -12.054 6.850 4.923 1.00 0.00 H new ATOM 0 HE3 MET A 25 -13.093 5.484 4.451 1.00 0.00 H new ATOM 412 N MET A 26 -7.333 3.875 0.321 1.00 0.00 N ATOM 413 CA MET A 26 -6.259 3.003 -0.128 1.00 0.00 C ATOM 414 C MET A 26 -5.132 3.797 -0.772 1.00 0.00 C ATOM 415 O MET A 26 -3.971 3.450 -0.626 1.00 0.00 O ATOM 416 CB MET A 26 -6.806 1.920 -1.069 1.00 0.00 C ATOM 417 CG MET A 26 -7.135 2.371 -2.495 1.00 0.00 C ATOM 418 SD MET A 26 -8.013 1.098 -3.436 1.00 0.00 S ATOM 419 CE MET A 26 -9.688 1.451 -2.861 1.00 0.00 C ATOM 0 H MET A 26 -8.194 3.811 -0.222 1.00 0.00 H new ATOM 0 HA MET A 26 -5.835 2.505 0.744 1.00 0.00 H new ATOM 0 HB2 MET A 26 -6.076 1.113 -1.124 1.00 0.00 H new ATOM 0 HB3 MET A 26 -7.709 1.503 -0.624 1.00 0.00 H new ATOM 0 HG2 MET A 26 -7.743 3.275 -2.456 1.00 0.00 H new ATOM 0 HG3 MET A 26 -6.212 2.630 -3.013 1.00 0.00 H new ATOM 0 HE1 MET A 26 -10.339 0.609 -3.097 1.00 0.00 H new ATOM 0 HE2 MET A 26 -9.677 1.610 -1.783 1.00 0.00 H new ATOM 0 HE3 MET A 26 -10.061 2.348 -3.356 1.00 0.00 H new ATOM 429 N GLU A 27 -5.471 4.868 -1.474 1.00 0.00 N ATOM 430 CA GLU A 27 -4.521 5.711 -2.177 1.00 0.00 C ATOM 431 C GLU A 27 -3.515 6.352 -1.240 1.00 0.00 C ATOM 432 O GLU A 27 -2.315 6.312 -1.523 1.00 0.00 O ATOM 433 CB GLU A 27 -5.325 6.751 -2.935 1.00 0.00 C ATOM 434 CG GLU A 27 -4.507 7.558 -3.935 1.00 0.00 C ATOM 435 CD GLU A 27 -5.478 8.323 -4.849 1.00 0.00 C ATOM 436 OE1 GLU A 27 -6.344 7.667 -5.485 1.00 0.00 O ATOM 437 OE2 GLU A 27 -5.393 9.569 -4.940 1.00 0.00 O ATOM 0 H GLU A 27 -6.437 5.181 -1.572 1.00 0.00 H new ATOM 0 HA GLU A 27 -3.926 5.109 -2.864 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -6.138 6.253 -3.464 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -5.782 7.434 -2.219 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -3.849 8.253 -3.414 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -3.871 6.898 -4.525 1.00 0.00 H new ATOM 444 N GLN A 28 -4.016 6.940 -0.150 1.00 0.00 N ATOM 445 CA GLN A 28 -3.205 7.599 0.851 1.00 0.00 C ATOM 446 C GLN A 28 -2.276 6.586 1.516 1.00 0.00 C ATOM 447 O GLN A 28 -1.104 6.883 1.752 1.00 0.00 O ATOM 448 CB GLN A 28 -4.134 8.287 1.865 1.00 0.00 C ATOM 449 CG GLN A 28 -3.384 9.015 2.984 1.00 0.00 C ATOM 450 CD GLN A 28 -3.245 8.175 4.251 1.00 0.00 C ATOM 451 OE1 GLN A 28 -4.131 8.164 5.105 1.00 0.00 O ATOM 452 NE2 GLN A 28 -2.137 7.473 4.404 1.00 0.00 N ATOM 0 H GLN A 28 -5.015 6.966 0.056 1.00 0.00 H new ATOM 0 HA GLN A 28 -2.574 8.361 0.393 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -4.768 9.001 1.339 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -4.794 7.540 2.307 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -2.392 9.293 2.628 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -3.908 9.940 3.223 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -1.415 7.496 3.684 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -2.003 6.908 5.242 1.00 0.00 H new ATOM 461 N GLU A 29 -2.789 5.406 1.861 1.00 0.00 N ATOM 462 CA GLU A 29 -1.964 4.388 2.490 1.00 0.00 C ATOM 463 C GLU A 29 -0.899 3.888 1.510 1.00 0.00 C ATOM 464 O GLU A 29 0.223 3.606 1.932 1.00 0.00 O ATOM 465 CB GLU A 29 -2.809 3.222 3.011 1.00 0.00 C ATOM 466 CG GLU A 29 -3.688 3.624 4.203 1.00 0.00 C ATOM 467 CD GLU A 29 -4.256 2.409 4.946 1.00 0.00 C ATOM 468 OE1 GLU A 29 -3.510 1.439 5.205 1.00 0.00 O ATOM 469 OE2 GLU A 29 -5.456 2.398 5.312 1.00 0.00 O ATOM 0 H GLU A 29 -3.762 5.137 1.716 1.00 0.00 H new ATOM 0 HA GLU A 29 -1.468 4.842 3.348 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -3.442 2.847 2.206 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.152 2.404 3.307 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -3.102 4.229 4.895 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -4.509 4.248 3.851 1.00 0.00 H new ATOM 476 N ILE A 30 -1.219 3.788 0.212 1.00 0.00 N ATOM 477 CA ILE A 30 -0.260 3.322 -0.764 1.00 0.00 C ATOM 478 C ILE A 30 0.843 4.361 -0.915 1.00 0.00 C ATOM 479 O ILE A 30 2.000 3.981 -0.739 1.00 0.00 O ATOM 480 CB ILE A 30 -0.931 2.894 -2.102 1.00 0.00 C ATOM 481 CG1 ILE A 30 -1.187 1.361 -2.101 1.00 0.00 C ATOM 482 CG2 ILE A 30 -0.130 3.266 -3.370 1.00 0.00 C ATOM 483 CD1 ILE A 30 -2.572 0.987 -1.591 1.00 0.00 C ATOM 0 H ILE A 30 -2.134 4.026 -0.172 1.00 0.00 H new ATOM 0 HA ILE A 30 0.206 2.403 -0.407 1.00 0.00 H new ATOM 0 HB ILE A 30 -1.865 3.454 -2.149 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -1.064 0.977 -3.114 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -0.434 0.873 -1.481 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -0.672 2.930 -4.254 1.00 0.00 H new ATOM 0 HG22 ILE A 30 0.001 4.347 -3.414 1.00 0.00 H new ATOM 0 HG23 ILE A 30 0.847 2.784 -3.338 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -2.688 -0.097 -1.615 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -2.691 1.342 -0.567 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -3.330 1.447 -2.225 1.00 0.00 H new ATOM 495 N GLU A 31 0.549 5.632 -1.204 1.00 0.00 N ATOM 496 CA GLU A 31 1.624 6.621 -1.368 1.00 0.00 C ATOM 497 C GLU A 31 2.532 6.666 -0.140 1.00 0.00 C ATOM 498 O GLU A 31 3.756 6.666 -0.286 1.00 0.00 O ATOM 499 CB GLU A 31 1.095 8.007 -1.746 1.00 0.00 C ATOM 500 CG GLU A 31 0.215 8.632 -0.666 1.00 0.00 C ATOM 501 CD GLU A 31 -0.481 9.880 -1.174 1.00 0.00 C ATOM 502 OE1 GLU A 31 -1.506 9.725 -1.877 1.00 0.00 O ATOM 503 OE2 GLU A 31 -0.063 11.005 -0.832 1.00 0.00 O ATOM 0 H GLU A 31 -0.396 5.996 -1.327 1.00 0.00 H new ATOM 0 HA GLU A 31 2.232 6.291 -2.210 1.00 0.00 H new ATOM 0 HB2 GLU A 31 1.938 8.668 -1.946 1.00 0.00 H new ATOM 0 HB3 GLU A 31 0.524 7.931 -2.671 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -0.529 7.907 -0.336 1.00 0.00 H new ATOM 0 HG3 GLU A 31 0.824 8.881 0.203 1.00 0.00 H new ATOM 510 N GLU A 32 1.946 6.575 1.056 1.00 0.00 N ATOM 511 CA GLU A 32 2.672 6.604 2.311 1.00 0.00 C ATOM 512 C GLU A 32 3.653 5.427 2.388 1.00 0.00 C ATOM 513 O GLU A 32 4.699 5.543 3.020 1.00 0.00 O ATOM 514 CB GLU A 32 1.658 6.653 3.471 1.00 0.00 C ATOM 515 CG GLU A 32 2.262 6.798 4.874 1.00 0.00 C ATOM 516 CD GLU A 32 3.084 8.076 5.053 1.00 0.00 C ATOM 517 OE1 GLU A 32 4.266 8.101 4.650 1.00 0.00 O ATOM 518 OE2 GLU A 32 2.586 9.076 5.618 1.00 0.00 O ATOM 0 H GLU A 32 0.937 6.478 1.173 1.00 0.00 H new ATOM 0 HA GLU A 32 3.288 7.500 2.385 1.00 0.00 H new ATOM 0 HB2 GLU A 32 0.978 7.487 3.300 1.00 0.00 H new ATOM 0 HB3 GLU A 32 1.059 5.743 3.445 1.00 0.00 H new ATOM 0 HG2 GLU A 32 1.458 6.786 5.610 1.00 0.00 H new ATOM 0 HG3 GLU A 32 2.896 5.935 5.079 1.00 0.00 H new ATOM 525 N ILE A 33 3.347 4.273 1.792 1.00 0.00 N ATOM 526 CA ILE A 33 4.209 3.105 1.772 1.00 0.00 C ATOM 527 C ILE A 33 5.243 3.261 0.653 1.00 0.00 C ATOM 528 O ILE A 33 6.424 2.988 0.876 1.00 0.00 O ATOM 529 CB ILE A 33 3.348 1.837 1.627 1.00 0.00 C ATOM 530 CG1 ILE A 33 2.605 1.583 2.949 1.00 0.00 C ATOM 531 CG2 ILE A 33 4.221 0.615 1.330 1.00 0.00 C ATOM 532 CD1 ILE A 33 1.519 0.526 2.803 1.00 0.00 C ATOM 0 H ILE A 33 2.466 4.128 1.298 1.00 0.00 H new ATOM 0 HA ILE A 33 4.760 3.010 2.707 1.00 0.00 H new ATOM 0 HB ILE A 33 2.649 1.988 0.805 1.00 0.00 H new ATOM 0 HG12 ILE A 33 3.318 1.266 3.710 1.00 0.00 H new ATOM 0 HG13 ILE A 33 2.159 2.514 3.298 1.00 0.00 H new ATOM 0 HG21 ILE A 33 3.590 -0.268 1.232 1.00 0.00 H new ATOM 0 HG22 ILE A 33 4.767 0.775 0.401 1.00 0.00 H new ATOM 0 HG23 ILE A 33 4.929 0.466 2.146 1.00 0.00 H new ATOM 0 HD11 ILE A 33 1.022 0.380 3.762 1.00 0.00 H new ATOM 0 HD12 ILE A 33 0.790 0.854 2.062 1.00 0.00 H new ATOM 0 HD13 ILE A 33 1.967 -0.414 2.480 1.00 0.00 H new ATOM 544 N ARG A 34 4.833 3.685 -0.549 1.00 0.00 N ATOM 545 CA ARG A 34 5.747 3.849 -1.681 1.00 0.00 C ATOM 546 C ARG A 34 6.846 4.802 -1.294 1.00 0.00 C ATOM 547 O ARG A 34 8.007 4.515 -1.570 1.00 0.00 O ATOM 548 CB ARG A 34 5.047 4.338 -2.959 1.00 0.00 C ATOM 549 CG ARG A 34 3.897 3.411 -3.351 1.00 0.00 C ATOM 550 CD ARG A 34 3.671 3.288 -4.853 1.00 0.00 C ATOM 551 NE ARG A 34 4.651 2.384 -5.481 1.00 0.00 N ATOM 552 CZ ARG A 34 4.446 1.663 -6.590 1.00 0.00 C ATOM 553 NH1 ARG A 34 3.347 1.824 -7.320 1.00 0.00 N ATOM 554 NH2 ARG A 34 5.360 0.784 -6.982 1.00 0.00 N ATOM 0 H ARG A 34 3.864 3.922 -0.761 1.00 0.00 H new ATOM 0 HA ARG A 34 6.156 2.866 -1.914 1.00 0.00 H new ATOM 0 HB2 ARG A 34 4.667 5.348 -2.804 1.00 0.00 H new ATOM 0 HB3 ARG A 34 5.769 4.391 -3.774 1.00 0.00 H new ATOM 0 HG2 ARG A 34 4.091 2.419 -2.943 1.00 0.00 H new ATOM 0 HG3 ARG A 34 2.980 3.773 -2.886 1.00 0.00 H new ATOM 0 HD2 ARG A 34 2.663 2.918 -5.040 1.00 0.00 H new ATOM 0 HD3 ARG A 34 3.739 4.274 -5.313 1.00 0.00 H new ATOM 0 HE ARG A 34 5.563 2.301 -5.032 1.00 0.00 H new ATOM 0 HH11 ARG A 34 2.643 2.506 -7.038 1.00 0.00 H new ATOM 0 HH12 ARG A 34 3.208 1.266 -8.162 1.00 0.00 H new ATOM 0 HH21 ARG A 34 6.214 0.660 -6.439 1.00 0.00 H new ATOM 0 HH22 ARG A 34 5.208 0.232 -7.826 1.00 0.00 H new ATOM 568 N GLN A 35 6.496 5.907 -0.642 1.00 0.00 N ATOM 569 CA GLN A 35 7.481 6.880 -0.211 1.00 0.00 C ATOM 570 C GLN A 35 8.403 6.291 0.842 1.00 0.00 C ATOM 571 O GLN A 35 9.620 6.305 0.663 1.00 0.00 O ATOM 572 CB GLN A 35 6.810 8.136 0.326 1.00 0.00 C ATOM 573 CG GLN A 35 6.255 8.950 -0.834 1.00 0.00 C ATOM 574 CD GLN A 35 7.349 9.395 -1.800 1.00 0.00 C ATOM 575 OE1 GLN A 35 8.224 10.197 -1.480 1.00 0.00 O ATOM 576 NE2 GLN A 35 7.387 8.837 -2.994 1.00 0.00 N ATOM 0 H GLN A 35 5.534 6.147 -0.403 1.00 0.00 H new ATOM 0 HA GLN A 35 8.077 7.152 -1.082 1.00 0.00 H new ATOM 0 HB2 GLN A 35 6.007 7.867 1.013 1.00 0.00 H new ATOM 0 HB3 GLN A 35 7.527 8.731 0.892 1.00 0.00 H new ATOM 0 HG2 GLN A 35 5.517 8.356 -1.372 1.00 0.00 H new ATOM 0 HG3 GLN A 35 5.737 9.827 -0.446 1.00 0.00 H new ATOM 0 HE21 GLN A 35 6.665 8.170 -3.269 1.00 0.00 H new ATOM 0 HE22 GLN A 35 8.138 9.072 -3.643 1.00 0.00 H new ATOM 585 N LYS A 36 7.846 5.710 1.906 1.00 0.00 N ATOM 586 CA LYS A 36 8.647 5.126 2.979 1.00 0.00 C ATOM 587 C LYS A 36 9.647 4.110 2.432 1.00 0.00 C ATOM 588 O LYS A 36 10.830 4.153 2.774 1.00 0.00 O ATOM 589 CB LYS A 36 7.714 4.602 4.082 1.00 0.00 C ATOM 590 CG LYS A 36 7.445 3.100 4.146 1.00 0.00 C ATOM 591 CD LYS A 36 6.704 2.677 5.418 1.00 0.00 C ATOM 592 CE LYS A 36 5.219 3.042 5.544 1.00 0.00 C ATOM 593 NZ LYS A 36 4.940 4.487 5.686 1.00 0.00 N ATOM 0 H LYS A 36 6.839 5.632 2.046 1.00 0.00 H new ATOM 0 HA LYS A 36 9.273 5.885 3.448 1.00 0.00 H new ATOM 0 HB2 LYS A 36 8.130 4.907 5.042 1.00 0.00 H new ATOM 0 HB3 LYS A 36 6.754 5.108 3.975 1.00 0.00 H new ATOM 0 HG2 LYS A 36 6.859 2.804 3.276 1.00 0.00 H new ATOM 0 HG3 LYS A 36 8.393 2.564 4.089 1.00 0.00 H new ATOM 0 HD2 LYS A 36 6.790 1.594 5.510 1.00 0.00 H new ATOM 0 HD3 LYS A 36 7.228 3.112 6.269 1.00 0.00 H new ATOM 0 HE2 LYS A 36 4.693 2.671 4.664 1.00 0.00 H new ATOM 0 HE3 LYS A 36 4.804 2.521 6.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 4.103 4.621 6.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 5.759 4.957 6.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 4.762 4.900 4.748 1.00 0.00 H new ATOM 607 N TYR A 37 9.203 3.204 1.560 1.00 0.00 N ATOM 608 CA TYR A 37 10.095 2.213 0.986 1.00 0.00 C ATOM 609 C TYR A 37 11.038 2.865 -0.024 1.00 0.00 C ATOM 610 O TYR A 37 12.195 2.450 -0.073 1.00 0.00 O ATOM 611 CB TYR A 37 9.319 1.004 0.470 1.00 0.00 C ATOM 612 CG TYR A 37 8.855 0.090 1.593 1.00 0.00 C ATOM 613 CD1 TYR A 37 9.782 -0.519 2.458 1.00 0.00 C ATOM 614 CD2 TYR A 37 7.491 -0.183 1.759 1.00 0.00 C ATOM 615 CE1 TYR A 37 9.351 -1.423 3.440 1.00 0.00 C ATOM 616 CE2 TYR A 37 7.042 -1.072 2.754 1.00 0.00 C ATOM 617 CZ TYR A 37 7.976 -1.706 3.596 1.00 0.00 C ATOM 618 OH TYR A 37 7.579 -2.565 4.574 1.00 0.00 O ATOM 0 H TYR A 37 8.236 3.141 1.241 1.00 0.00 H new ATOM 0 HA TYR A 37 10.744 1.806 1.761 1.00 0.00 H new ATOM 0 HB2 TYR A 37 8.453 1.346 -0.097 1.00 0.00 H new ATOM 0 HB3 TYR A 37 9.948 0.439 -0.218 1.00 0.00 H new ATOM 0 HD1 TYR A 37 10.833 -0.289 2.365 1.00 0.00 H new ATOM 0 HD2 TYR A 37 6.771 0.297 1.112 1.00 0.00 H new ATOM 0 HE1 TYR A 37 10.075 -1.905 4.080 1.00 0.00 H new ATOM 0 HE2 TYR A 37 5.986 -1.267 2.871 1.00 0.00 H new ATOM 0 HH TYR A 37 6.682 -2.317 4.883 1.00 0.00 H new ATOM 628 N GLN A 38 10.622 3.898 -0.768 1.00 0.00 N ATOM 629 CA GLN A 38 11.484 4.608 -1.713 1.00 0.00 C ATOM 630 C GLN A 38 12.636 5.186 -0.888 1.00 0.00 C ATOM 631 O GLN A 38 13.786 5.024 -1.282 1.00 0.00 O ATOM 632 CB GLN A 38 10.713 5.679 -2.518 1.00 0.00 C ATOM 633 CG GLN A 38 11.563 6.856 -3.025 1.00 0.00 C ATOM 634 CD GLN A 38 10.937 7.577 -4.214 1.00 0.00 C ATOM 635 OE1 GLN A 38 9.770 7.957 -4.202 1.00 0.00 O ATOM 636 NE2 GLN A 38 11.696 7.792 -5.273 1.00 0.00 N ATOM 0 H GLN A 38 9.671 4.265 -0.729 1.00 0.00 H new ATOM 0 HA GLN A 38 11.870 3.934 -2.478 1.00 0.00 H new ATOM 0 HB2 GLN A 38 10.241 5.197 -3.374 1.00 0.00 H new ATOM 0 HB3 GLN A 38 9.912 6.073 -1.893 1.00 0.00 H new ATOM 0 HG2 GLN A 38 11.709 7.567 -2.212 1.00 0.00 H new ATOM 0 HG3 GLN A 38 12.549 6.489 -3.309 1.00 0.00 H new ATOM 0 HE21 GLN A 38 12.665 7.475 -5.279 1.00 0.00 H new ATOM 0 HE22 GLN A 38 11.313 8.276 -6.085 1.00 0.00 H new ATOM 645 N SER A 39 12.374 5.770 0.288 1.00 0.00 N ATOM 646 CA SER A 39 13.408 6.322 1.153 1.00 0.00 C ATOM 647 C SER A 39 14.396 5.218 1.545 1.00 0.00 C ATOM 648 O SER A 39 15.584 5.490 1.718 1.00 0.00 O ATOM 649 CB SER A 39 12.753 6.954 2.385 1.00 0.00 C ATOM 650 OG SER A 39 13.716 7.599 3.200 1.00 0.00 O ATOM 0 H SER A 39 11.431 5.870 0.663 1.00 0.00 H new ATOM 0 HA SER A 39 13.964 7.097 0.626 1.00 0.00 H new ATOM 0 HB2 SER A 39 11.998 7.674 2.070 1.00 0.00 H new ATOM 0 HB3 SER A 39 12.240 6.185 2.962 1.00 0.00 H new ATOM 0 HG SER A 39 13.273 7.996 3.979 1.00 0.00 H new ATOM 656 N LYS A 40 13.936 3.975 1.747 1.00 0.00 N ATOM 657 CA LYS A 40 14.824 2.865 2.083 1.00 0.00 C ATOM 658 C LYS A 40 15.592 2.410 0.837 1.00 0.00 C ATOM 659 O LYS A 40 16.747 2.006 0.966 1.00 0.00 O ATOM 660 CB LYS A 40 14.062 1.714 2.769 1.00 0.00 C ATOM 661 CG LYS A 40 13.534 2.137 4.154 1.00 0.00 C ATOM 662 CD LYS A 40 13.514 1.005 5.191 1.00 0.00 C ATOM 663 CE LYS A 40 12.526 -0.114 4.840 1.00 0.00 C ATOM 664 NZ LYS A 40 12.380 -1.069 5.957 1.00 0.00 N ATOM 0 H LYS A 40 12.951 3.718 1.682 1.00 0.00 H new ATOM 0 HA LYS A 40 15.557 3.211 2.812 1.00 0.00 H new ATOM 0 HB2 LYS A 40 13.229 1.401 2.140 1.00 0.00 H new ATOM 0 HB3 LYS A 40 14.721 0.852 2.877 1.00 0.00 H new ATOM 0 HG2 LYS A 40 14.152 2.951 4.533 1.00 0.00 H new ATOM 0 HG3 LYS A 40 12.523 2.529 4.041 1.00 0.00 H new ATOM 0 HD2 LYS A 40 14.515 0.583 5.279 1.00 0.00 H new ATOM 0 HD3 LYS A 40 13.255 1.418 6.166 1.00 0.00 H new ATOM 0 HE2 LYS A 40 11.555 0.318 4.598 1.00 0.00 H new ATOM 0 HE3 LYS A 40 12.871 -0.641 3.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 12.261 -2.030 5.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 13.230 -1.036 6.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 11.546 -0.815 6.525 1.00 0.00 H new ATOM 678 N ARG A 41 14.987 2.470 -0.356 1.00 0.00 N ATOM 679 CA ARG A 41 15.580 2.082 -1.642 1.00 0.00 C ATOM 680 C ARG A 41 16.645 3.078 -2.093 1.00 0.00 C ATOM 681 O ARG A 41 17.695 2.672 -2.569 1.00 0.00 O ATOM 682 CB ARG A 41 14.493 1.957 -2.735 1.00 0.00 C ATOM 683 CG ARG A 41 15.017 1.186 -3.964 1.00 0.00 C ATOM 684 CD ARG A 41 14.203 1.423 -5.241 1.00 0.00 C ATOM 685 NE ARG A 41 12.848 0.848 -5.189 1.00 0.00 N ATOM 686 CZ ARG A 41 11.683 1.495 -5.356 1.00 0.00 C ATOM 687 NH1 ARG A 41 11.593 2.817 -5.427 1.00 0.00 N ATOM 688 NH2 ARG A 41 10.570 0.791 -5.480 1.00 0.00 N ATOM 0 H ARG A 41 14.029 2.805 -0.456 1.00 0.00 H new ATOM 0 HA ARG A 41 16.055 1.112 -1.495 1.00 0.00 H new ATOM 0 HB2 ARG A 41 13.622 1.445 -2.327 1.00 0.00 H new ATOM 0 HB3 ARG A 41 14.165 2.951 -3.040 1.00 0.00 H new ATOM 0 HG2 ARG A 41 16.052 1.474 -4.147 1.00 0.00 H new ATOM 0 HG3 ARG A 41 15.018 0.120 -3.738 1.00 0.00 H new ATOM 0 HD2 ARG A 41 14.127 2.495 -5.420 1.00 0.00 H new ATOM 0 HD3 ARG A 41 14.738 0.995 -6.088 1.00 0.00 H new ATOM 0 HE ARG A 41 12.788 -0.154 -5.006 1.00 0.00 H new ATOM 0 HH11 ARG A 41 12.434 3.390 -5.354 1.00 0.00 H new ATOM 0 HH12 ARG A 41 10.683 3.260 -5.555 1.00 0.00 H new ATOM 0 HH21 ARG A 41 10.605 -0.228 -5.448 1.00 0.00 H new ATOM 0 HH22 ARG A 41 9.677 1.267 -5.607 1.00 0.00 H new ATOM 702 N GLN A 42 16.390 4.367 -1.928 1.00 0.00 N ATOM 703 CA GLN A 42 17.245 5.477 -2.308 1.00 0.00 C ATOM 704 C GLN A 42 18.717 5.286 -1.910 1.00 0.00 C ATOM 705 O GLN A 42 19.535 5.271 -2.820 1.00 0.00 O ATOM 706 CB GLN A 42 16.618 6.807 -1.848 1.00 0.00 C ATOM 707 CG GLN A 42 17.317 8.025 -2.463 1.00 0.00 C ATOM 708 CD GLN A 42 17.035 8.159 -3.958 1.00 0.00 C ATOM 709 OE1 GLN A 42 16.048 8.766 -4.368 1.00 0.00 O ATOM 710 NE2 GLN A 42 17.823 7.546 -4.819 1.00 0.00 N ATOM 0 H GLN A 42 15.522 4.684 -1.496 1.00 0.00 H new ATOM 0 HA GLN A 42 17.296 5.511 -3.396 1.00 0.00 H new ATOM 0 HB2 GLN A 42 15.563 6.821 -2.120 1.00 0.00 H new ATOM 0 HB3 GLN A 42 16.668 6.873 -0.761 1.00 0.00 H new ATOM 0 HG2 GLN A 42 16.987 8.928 -1.950 1.00 0.00 H new ATOM 0 HG3 GLN A 42 18.392 7.943 -2.304 1.00 0.00 H new ATOM 0 HE21 GLN A 42 18.644 7.040 -4.488 1.00 0.00 H new ATOM 0 HE22 GLN A 42 17.611 7.578 -5.816 1.00 0.00 H new ATOM 719 N PRO A 43 19.102 5.092 -0.634 1.00 0.00 N ATOM 720 CA PRO A 43 20.506 4.912 -0.269 1.00 0.00 C ATOM 721 C PRO A 43 21.108 3.644 -0.884 1.00 0.00 C ATOM 722 O PRO A 43 22.317 3.569 -1.062 1.00 0.00 O ATOM 723 CB PRO A 43 20.531 4.865 1.264 1.00 0.00 C ATOM 724 CG PRO A 43 19.140 4.348 1.604 1.00 0.00 C ATOM 725 CD PRO A 43 18.288 5.067 0.563 1.00 0.00 C ATOM 0 HA PRO A 43 21.118 5.727 -0.655 1.00 0.00 H new ATOM 0 HB2 PRO A 43 21.312 4.202 1.636 1.00 0.00 H new ATOM 0 HB3 PRO A 43 20.715 5.848 1.697 1.00 0.00 H new ATOM 0 HG2 PRO A 43 19.071 3.264 1.513 1.00 0.00 H new ATOM 0 HG3 PRO A 43 18.845 4.602 2.622 1.00 0.00 H new ATOM 0 HD2 PRO A 43 17.349 4.542 0.391 1.00 0.00 H new ATOM 0 HD3 PRO A 43 18.034 6.076 0.889 1.00 0.00 H new ATOM 733 N ILE A 44 20.287 2.631 -1.174 1.00 0.00 N ATOM 734 CA ILE A 44 20.722 1.378 -1.772 1.00 0.00 C ATOM 735 C ILE A 44 21.093 1.663 -3.233 1.00 0.00 C ATOM 736 O ILE A 44 22.177 1.291 -3.688 1.00 0.00 O ATOM 737 CB ILE A 44 19.628 0.281 -1.614 1.00 0.00 C ATOM 738 CG1 ILE A 44 19.153 0.042 -0.162 1.00 0.00 C ATOM 739 CG2 ILE A 44 20.220 -1.042 -2.103 1.00 0.00 C ATOM 740 CD1 ILE A 44 17.858 -0.768 -0.044 1.00 0.00 C ATOM 0 H ILE A 44 19.284 2.665 -0.994 1.00 0.00 H new ATOM 0 HA ILE A 44 21.601 0.982 -1.263 1.00 0.00 H new ATOM 0 HB ILE A 44 18.766 0.628 -2.184 1.00 0.00 H new ATOM 0 HG12 ILE A 44 19.942 -0.475 0.385 1.00 0.00 H new ATOM 0 HG13 ILE A 44 19.009 1.007 0.324 1.00 0.00 H new ATOM 0 HG21 ILE A 44 19.476 -1.832 -2.005 1.00 0.00 H new ATOM 0 HG22 ILE A 44 20.511 -0.946 -3.149 1.00 0.00 H new ATOM 0 HG23 ILE A 44 21.096 -1.292 -1.504 1.00 0.00 H new ATOM 0 HD11 ILE A 44 17.598 -0.888 1.008 1.00 0.00 H new ATOM 0 HD12 ILE A 44 17.053 -0.244 -0.559 1.00 0.00 H new ATOM 0 HD13 ILE A 44 18.000 -1.749 -0.497 1.00 0.00 H new ATOM 752 N LEU A 45 20.200 2.324 -3.972 1.00 0.00 N ATOM 753 CA LEU A 45 20.429 2.661 -5.371 1.00 0.00 C ATOM 754 C LEU A 45 21.587 3.651 -5.491 1.00 0.00 C ATOM 755 O LEU A 45 22.470 3.466 -6.323 1.00 0.00 O ATOM 756 CB LEU A 45 19.109 3.034 -6.075 1.00 0.00 C ATOM 757 CG LEU A 45 18.778 4.518 -6.267 1.00 0.00 C ATOM 758 CD1 LEU A 45 19.505 5.117 -7.480 1.00 0.00 C ATOM 759 CD2 LEU A 45 17.261 4.650 -6.480 1.00 0.00 C ATOM 0 H LEU A 45 19.299 2.639 -3.614 1.00 0.00 H new ATOM 0 HA LEU A 45 20.767 1.790 -5.933 1.00 0.00 H new ATOM 0 HB2 LEU A 45 19.114 2.565 -7.059 1.00 0.00 H new ATOM 0 HB3 LEU A 45 18.293 2.582 -5.511 1.00 0.00 H new ATOM 0 HG LEU A 45 19.106 5.061 -5.381 1.00 0.00 H new ATOM 0 HD11 LEU A 45 19.242 6.170 -7.579 1.00 0.00 H new ATOM 0 HD12 LEU A 45 20.582 5.024 -7.341 1.00 0.00 H new ATOM 0 HD13 LEU A 45 19.208 4.583 -8.382 1.00 0.00 H new ATOM 0 HD21 LEU A 45 17.003 5.700 -6.619 1.00 0.00 H new ATOM 0 HD22 LEU A 45 16.967 4.084 -7.364 1.00 0.00 H new ATOM 0 HD23 LEU A 45 16.736 4.260 -5.608 1.00 0.00 H new ATOM 771 N ASP A 46 21.639 4.639 -4.600 1.00 0.00 N ATOM 772 CA ASP A 46 22.684 5.659 -4.586 1.00 0.00 C ATOM 773 C ASP A 46 24.043 5.015 -4.275 1.00 0.00 C ATOM 774 O ASP A 46 25.077 5.576 -4.625 1.00 0.00 O ATOM 775 CB ASP A 46 22.425 6.754 -3.521 1.00 0.00 C ATOM 776 CG ASP A 46 21.220 7.693 -3.679 1.00 0.00 C ATOM 777 OD1 ASP A 46 20.531 7.695 -4.721 1.00 0.00 O ATOM 778 OD2 ASP A 46 20.947 8.470 -2.729 1.00 0.00 O ATOM 0 H ASP A 46 20.948 4.755 -3.859 1.00 0.00 H new ATOM 0 HA ASP A 46 22.682 6.120 -5.574 1.00 0.00 H new ATOM 0 HB2 ASP A 46 22.326 6.255 -2.557 1.00 0.00 H new ATOM 0 HB3 ASP A 46 23.319 7.376 -3.468 1.00 0.00 H new ATOM 783 N ALA A 47 24.079 3.886 -3.556 1.00 0.00 N ATOM 784 CA ALA A 47 25.311 3.191 -3.199 1.00 0.00 C ATOM 785 C ALA A 47 25.853 2.338 -4.349 1.00 0.00 C ATOM 786 O ALA A 47 27.026 2.462 -4.678 1.00 0.00 O ATOM 787 CB ALA A 47 25.092 2.339 -1.944 1.00 0.00 C ATOM 0 H ALA A 47 23.239 3.428 -3.204 1.00 0.00 H new ATOM 0 HA ALA A 47 26.065 3.949 -2.988 1.00 0.00 H new ATOM 0 HB1 ALA A 47 26.018 1.825 -1.687 1.00 0.00 H new ATOM 0 HB2 ALA A 47 24.792 2.981 -1.116 1.00 0.00 H new ATOM 0 HB3 ALA A 47 24.310 1.604 -2.135 1.00 0.00 H new ATOM 793 N ILE A 48 25.042 1.472 -4.971 1.00 0.00 N ATOM 794 CA ILE A 48 25.513 0.614 -6.076 1.00 0.00 C ATOM 795 C ILE A 48 26.038 1.441 -7.244 1.00 0.00 C ATOM 796 O ILE A 48 26.954 1.024 -7.953 1.00 0.00 O ATOM 797 CB ILE A 48 24.436 -0.396 -6.528 1.00 0.00 C ATOM 798 CG1 ILE A 48 24.922 -1.466 -7.528 1.00 0.00 C ATOM 799 CG2 ILE A 48 23.198 0.301 -7.071 1.00 0.00 C ATOM 800 CD1 ILE A 48 24.030 -2.723 -7.539 1.00 0.00 C ATOM 0 H ILE A 48 24.059 1.344 -4.732 1.00 0.00 H new ATOM 0 HA ILE A 48 26.349 0.030 -5.690 1.00 0.00 H new ATOM 0 HB ILE A 48 24.181 -0.933 -5.614 1.00 0.00 H new ATOM 0 HG12 ILE A 48 24.948 -1.036 -8.529 1.00 0.00 H new ATOM 0 HG13 ILE A 48 25.943 -1.753 -7.278 1.00 0.00 H new ATOM 0 HG21 ILE A 48 22.465 -0.445 -7.378 1.00 0.00 H new ATOM 0 HG22 ILE A 48 22.768 0.935 -6.296 1.00 0.00 H new ATOM 0 HG23 ILE A 48 23.473 0.914 -7.929 1.00 0.00 H new ATOM 0 HD11 ILE A 48 24.421 -3.440 -8.261 1.00 0.00 H new ATOM 0 HD12 ILE A 48 24.024 -3.174 -6.547 1.00 0.00 H new ATOM 0 HD13 ILE A 48 23.013 -2.445 -7.817 1.00 0.00 H new ATOM 812 N GLU A 49 25.440 2.604 -7.470 1.00 0.00 N ATOM 813 CA GLU A 49 25.811 3.495 -8.549 1.00 0.00 C ATOM 814 C GLU A 49 27.051 4.328 -8.221 1.00 0.00 C ATOM 815 O GLU A 49 27.563 5.025 -9.101 1.00 0.00 O ATOM 816 CB GLU A 49 24.591 4.300 -8.984 1.00 0.00 C ATOM 817 CG GLU A 49 23.566 3.295 -9.552 1.00 0.00 C ATOM 818 CD GLU A 49 22.556 3.843 -10.545 1.00 0.00 C ATOM 819 OE1 GLU A 49 22.919 4.676 -11.404 1.00 0.00 O ATOM 820 OE2 GLU A 49 21.426 3.298 -10.588 1.00 0.00 O ATOM 0 H GLU A 49 24.673 2.955 -6.897 1.00 0.00 H new ATOM 0 HA GLU A 49 26.125 2.910 -9.413 1.00 0.00 H new ATOM 0 HB2 GLU A 49 24.169 4.846 -8.141 1.00 0.00 H new ATOM 0 HB3 GLU A 49 24.865 5.039 -9.737 1.00 0.00 H new ATOM 0 HG2 GLU A 49 24.114 2.486 -10.035 1.00 0.00 H new ATOM 0 HG3 GLU A 49 23.020 2.857 -8.717 1.00 0.00 H new ATOM 827 N ALA A 50 27.480 4.328 -6.958 1.00 0.00 N ATOM 828 CA ALA A 50 28.640 5.053 -6.465 1.00 0.00 C ATOM 829 C ALA A 50 29.641 4.138 -5.744 1.00 0.00 C ATOM 830 O ALA A 50 30.304 4.607 -4.815 1.00 0.00 O ATOM 831 CB ALA A 50 28.158 6.199 -5.582 1.00 0.00 C ATOM 0 H ALA A 50 27.006 3.800 -6.225 1.00 0.00 H new ATOM 0 HA ALA A 50 29.191 5.462 -7.312 1.00 0.00 H new ATOM 0 HB1 ALA A 50 29.017 6.753 -5.204 1.00 0.00 H new ATOM 0 HB2 ALA A 50 27.524 6.866 -6.166 1.00 0.00 H new ATOM 0 HB3 ALA A 50 27.588 5.798 -4.744 1.00 0.00 H new ATOM 890 N TYR B 104 20.240 3.555 6.758 1.00 0.00 N ATOM 891 CA TYR B 104 21.030 2.678 5.908 1.00 0.00 C ATOM 892 C TYR B 104 21.996 3.527 5.072 1.00 0.00 C ATOM 893 O TYR B 104 22.403 3.154 3.980 1.00 0.00 O ATOM 894 CB TYR B 104 20.105 1.817 5.041 1.00 0.00 C ATOM 895 CG TYR B 104 19.397 0.705 5.785 1.00 0.00 C ATOM 896 CD1 TYR B 104 20.019 -0.553 5.904 1.00 0.00 C ATOM 897 CD2 TYR B 104 18.140 0.932 6.374 1.00 0.00 C ATOM 898 CE1 TYR B 104 19.386 -1.592 6.608 1.00 0.00 C ATOM 899 CE2 TYR B 104 17.509 -0.096 7.095 1.00 0.00 C ATOM 900 CZ TYR B 104 18.131 -1.361 7.217 1.00 0.00 C ATOM 901 OH TYR B 104 17.503 -2.356 7.904 1.00 0.00 O ATOM 0 HA TYR B 104 21.625 1.994 6.514 1.00 0.00 H new ATOM 0 HB2 TYR B 104 19.357 2.462 4.580 1.00 0.00 H new ATOM 0 HB3 TYR B 104 20.690 1.380 4.232 1.00 0.00 H new ATOM 0 HD1 TYR B 104 20.986 -0.720 5.453 1.00 0.00 H new ATOM 0 HD2 TYR B 104 17.661 1.894 6.272 1.00 0.00 H new ATOM 0 HE1 TYR B 104 19.856 -2.562 6.683 1.00 0.00 H new ATOM 0 HE2 TYR B 104 16.548 0.080 7.556 1.00 0.00 H new ATOM 0 HH TYR B 104 16.652 -2.023 8.258 1.00 0.00 H new ATOM 911 N GLU B 105 22.321 4.729 5.543 1.00 0.00 N ATOM 912 CA GLU B 105 23.226 5.641 4.852 1.00 0.00 C ATOM 913 C GLU B 105 24.636 5.061 4.699 1.00 0.00 C ATOM 914 O GLU B 105 25.351 5.423 3.772 1.00 0.00 O ATOM 915 CB GLU B 105 23.249 6.963 5.610 1.00 0.00 C ATOM 916 CG GLU B 105 23.785 6.849 7.043 1.00 0.00 C ATOM 917 CD GLU B 105 23.570 8.149 7.807 1.00 0.00 C ATOM 918 OE1 GLU B 105 24.076 9.214 7.366 1.00 0.00 O ATOM 919 OE2 GLU B 105 22.862 8.129 8.841 1.00 0.00 O ATOM 0 H GLU B 105 21.960 5.099 6.422 1.00 0.00 H new ATOM 0 HA GLU B 105 22.859 5.800 3.838 1.00 0.00 H new ATOM 0 HB2 GLU B 105 23.862 7.676 5.059 1.00 0.00 H new ATOM 0 HB3 GLU B 105 22.238 7.370 5.642 1.00 0.00 H new ATOM 0 HG2 GLU B 105 23.283 6.031 7.560 1.00 0.00 H new ATOM 0 HG3 GLU B 105 24.848 6.607 7.020 1.00 0.00 H new ATOM 926 N PHE B 106 25.003 4.126 5.571 1.00 0.00 N ATOM 927 CA PHE B 106 26.288 3.442 5.612 1.00 0.00 C ATOM 928 C PHE B 106 26.433 2.442 4.463 1.00 0.00 C ATOM 929 O PHE B 106 27.500 1.853 4.303 1.00 0.00 O ATOM 930 CB PHE B 106 26.452 2.780 6.989 1.00 0.00 C ATOM 931 CG PHE B 106 26.090 3.719 8.126 1.00 0.00 C ATOM 932 CD1 PHE B 106 26.947 4.790 8.441 1.00 0.00 C ATOM 933 CD2 PHE B 106 24.838 3.615 8.766 1.00 0.00 C ATOM 934 CE1 PHE B 106 26.553 5.756 9.381 1.00 0.00 C ATOM 935 CE2 PHE B 106 24.447 4.583 9.708 1.00 0.00 C ATOM 936 CZ PHE B 106 25.306 5.651 10.019 1.00 0.00 C ATOM 0 H PHE B 106 24.374 3.809 6.309 1.00 0.00 H new ATOM 0 HA PHE B 106 27.091 4.167 5.474 1.00 0.00 H new ATOM 0 HB2 PHE B 106 25.823 1.892 7.040 1.00 0.00 H new ATOM 0 HB3 PHE B 106 27.483 2.447 7.109 1.00 0.00 H new ATOM 0 HD1 PHE B 106 27.910 4.869 7.959 1.00 0.00 H new ATOM 0 HD2 PHE B 106 24.179 2.792 8.533 1.00 0.00 H new ATOM 0 HE1 PHE B 106 27.210 6.581 9.614 1.00 0.00 H new ATOM 0 HE2 PHE B 106 23.485 4.506 10.193 1.00 0.00 H new ATOM 0 HZ PHE B 106 25.008 6.390 10.748 1.00 0.00 H new ATOM 946 N LEU B 107 25.391 2.265 3.633 1.00 0.00 N ATOM 947 CA LEU B 107 25.404 1.358 2.487 1.00 0.00 C ATOM 948 C LEU B 107 26.532 1.722 1.525 1.00 0.00 C ATOM 949 O LEU B 107 26.918 0.886 0.714 1.00 0.00 O ATOM 950 CB LEU B 107 24.057 1.377 1.750 1.00 0.00 C ATOM 951 CG LEU B 107 22.973 0.538 2.449 1.00 0.00 C ATOM 952 CD1 LEU B 107 21.609 0.914 1.871 1.00 0.00 C ATOM 953 CD2 LEU B 107 23.138 -0.966 2.212 1.00 0.00 C ATOM 0 H LEU B 107 24.506 2.758 3.747 1.00 0.00 H new ATOM 0 HA LEU B 107 25.574 0.350 2.864 1.00 0.00 H new ATOM 0 HB2 LEU B 107 23.711 2.407 1.664 1.00 0.00 H new ATOM 0 HB3 LEU B 107 24.199 1.003 0.736 1.00 0.00 H new ATOM 0 HG LEU B 107 23.060 0.744 3.516 1.00 0.00 H new ATOM 0 HD11 LEU B 107 20.832 0.325 2.359 1.00 0.00 H new ATOM 0 HD12 LEU B 107 21.422 1.974 2.041 1.00 0.00 H new ATOM 0 HD13 LEU B 107 21.599 0.711 0.800 1.00 0.00 H new ATOM 0 HD21 LEU B 107 22.345 -1.505 2.730 1.00 0.00 H new ATOM 0 HD22 LEU B 107 23.081 -1.174 1.144 1.00 0.00 H new ATOM 0 HD23 LEU B 107 24.106 -1.290 2.594 1.00 0.00 H new ATOM 965 N LYS B 108 27.054 2.954 1.603 1.00 0.00 N ATOM 966 CA LYS B 108 28.162 3.414 0.770 1.00 0.00 C ATOM 967 C LYS B 108 29.402 2.545 1.005 1.00 0.00 C ATOM 968 O LYS B 108 30.249 2.459 0.124 1.00 0.00 O ATOM 969 CB LYS B 108 28.528 4.859 1.140 1.00 0.00 C ATOM 970 CG LYS B 108 27.407 5.891 1.005 1.00 0.00 C ATOM 971 CD LYS B 108 26.861 6.033 -0.414 1.00 0.00 C ATOM 972 CE LYS B 108 25.827 7.154 -0.368 1.00 0.00 C ATOM 973 NZ LYS B 108 25.197 7.398 -1.672 1.00 0.00 N ATOM 0 H LYS B 108 26.712 3.662 2.253 1.00 0.00 H new ATOM 0 HA LYS B 108 27.850 3.350 -0.272 1.00 0.00 H new ATOM 0 HB2 LYS B 108 28.883 4.870 2.171 1.00 0.00 H new ATOM 0 HB3 LYS B 108 29.362 5.174 0.512 1.00 0.00 H new ATOM 0 HG2 LYS B 108 26.590 5.614 1.672 1.00 0.00 H new ATOM 0 HG3 LYS B 108 27.777 6.860 1.340 1.00 0.00 H new ATOM 0 HD2 LYS B 108 27.661 6.271 -1.116 1.00 0.00 H new ATOM 0 HD3 LYS B 108 26.408 5.101 -0.751 1.00 0.00 H new ATOM 0 HE2 LYS B 108 25.057 6.903 0.362 1.00 0.00 H new ATOM 0 HE3 LYS B 108 26.306 8.070 -0.023 1.00 0.00 H new ATOM 0 HZ1 LYS B 108 24.504 8.168 -1.584 1.00 0.00 H new ATOM 0 HZ2 LYS B 108 25.925 7.665 -2.365 1.00 0.00 H new ATOM 0 HZ3 LYS B 108 24.715 6.534 -1.992 1.00 0.00 H new ATOM 987 N SER B 109 29.518 1.936 2.188 1.00 0.00 N ATOM 988 CA SER B 109 30.621 1.079 2.585 1.00 0.00 C ATOM 989 C SER B 109 30.197 -0.396 2.619 1.00 0.00 C ATOM 990 O SER B 109 31.001 -1.225 3.056 1.00 0.00 O ATOM 991 CB SER B 109 31.111 1.562 3.959 1.00 0.00 C ATOM 992 OG SER B 109 32.304 0.906 4.338 1.00 0.00 O ATOM 0 H SER B 109 28.814 2.035 2.919 1.00 0.00 H new ATOM 0 HA SER B 109 31.431 1.143 1.859 1.00 0.00 H new ATOM 0 HB2 SER B 109 31.279 2.639 3.930 1.00 0.00 H new ATOM 0 HB3 SER B 109 30.340 1.380 4.707 1.00 0.00 H new ATOM 0 HG SER B 109 32.247 -0.042 4.097 1.00 0.00 H new ATOM 998 N TRP B 110 28.938 -0.731 2.301 1.00 0.00 N ATOM 999 CA TRP B 110 28.495 -2.118 2.296 1.00 0.00 C ATOM 1000 C TRP B 110 28.903 -2.734 0.960 1.00 0.00 C ATOM 1001 O TRP B 110 29.062 -2.030 -0.039 1.00 0.00 O ATOM 1002 CB TRP B 110 26.972 -2.244 2.459 1.00 0.00 C ATOM 1003 CG TRP B 110 26.376 -2.233 3.847 1.00 0.00 C ATOM 1004 CD1 TRP B 110 25.216 -2.862 4.144 1.00 0.00 C ATOM 1005 CD2 TRP B 110 26.828 -1.639 5.117 1.00 0.00 C ATOM 1006 NE1 TRP B 110 24.886 -2.646 5.460 1.00 0.00 N ATOM 1007 CE2 TRP B 110 25.836 -1.903 6.112 1.00 0.00 C ATOM 1008 CE3 TRP B 110 27.956 -0.917 5.564 1.00 0.00 C ATOM 1009 CZ2 TRP B 110 25.928 -1.451 7.439 1.00 0.00 C ATOM 1010 CZ3 TRP B 110 28.066 -0.451 6.889 1.00 0.00 C ATOM 1011 CH2 TRP B 110 27.051 -0.702 7.826 1.00 0.00 C ATOM 0 H TRP B 110 28.216 -0.057 2.046 1.00 0.00 H new ATOM 0 HA TRP B 110 28.957 -2.632 3.139 1.00 0.00 H new ATOM 0 HB2 TRP B 110 26.514 -1.429 1.899 1.00 0.00 H new ATOM 0 HB3 TRP B 110 26.666 -3.173 1.978 1.00 0.00 H new ATOM 0 HD1 TRP B 110 24.634 -3.448 3.448 1.00 0.00 H new ATOM 0 HE1 TRP B 110 24.035 -2.997 5.900 1.00 0.00 H new ATOM 0 HE3 TRP B 110 28.758 -0.716 4.870 1.00 0.00 H new ATOM 0 HZ2 TRP B 110 25.147 -1.676 8.150 1.00 0.00 H new ATOM 0 HZ3 TRP B 110 28.942 0.106 7.188 1.00 0.00 H new ATOM 0 HH2 TRP B 110 27.133 -0.323 8.834 1.00 0.00 H new ATOM 1022 N THR B 111 29.053 -4.059 0.911 1.00 0.00 N ATOM 1023 CA THR B 111 29.417 -4.691 -0.351 1.00 0.00 C ATOM 1024 C THR B 111 28.258 -4.553 -1.334 1.00 0.00 C ATOM 1025 O THR B 111 27.096 -4.399 -0.936 1.00 0.00 O ATOM 1026 CB THR B 111 29.777 -6.179 -0.184 1.00 0.00 C ATOM 1027 OG1 THR B 111 28.680 -6.970 0.242 1.00 0.00 O ATOM 1028 CG2 THR B 111 30.989 -6.360 0.722 1.00 0.00 C ATOM 0 H THR B 111 28.933 -4.693 1.701 1.00 0.00 H new ATOM 0 HA THR B 111 30.305 -4.185 -0.729 1.00 0.00 H new ATOM 0 HB THR B 111 30.044 -6.544 -1.176 1.00 0.00 H new ATOM 0 HG1 THR B 111 28.620 -6.946 1.220 1.00 0.00 H new ATOM 0 HG21 THR B 111 31.216 -7.422 0.818 1.00 0.00 H new ATOM 0 HG22 THR B 111 31.846 -5.844 0.290 1.00 0.00 H new ATOM 0 HG23 THR B 111 30.773 -5.944 1.706 1.00 0.00 H new ATOM 1036 N VAL B 112 28.559 -4.686 -2.630 1.00 0.00 N ATOM 1037 CA VAL B 112 27.503 -4.607 -3.632 1.00 0.00 C ATOM 1038 C VAL B 112 26.495 -5.748 -3.414 1.00 0.00 C ATOM 1039 O VAL B 112 25.340 -5.644 -3.823 1.00 0.00 O ATOM 1040 CB VAL B 112 28.086 -4.538 -5.051 1.00 0.00 C ATOM 1041 CG1 VAL B 112 28.827 -5.808 -5.493 1.00 0.00 C ATOM 1042 CG2 VAL B 112 26.983 -4.182 -6.055 1.00 0.00 C ATOM 0 H VAL B 112 29.497 -4.844 -2.998 1.00 0.00 H new ATOM 0 HA VAL B 112 26.947 -3.677 -3.514 1.00 0.00 H new ATOM 0 HB VAL B 112 28.842 -3.753 -5.028 1.00 0.00 H new ATOM 0 HG11 VAL B 112 29.206 -5.674 -6.506 1.00 0.00 H new ATOM 0 HG12 VAL B 112 29.660 -5.998 -4.816 1.00 0.00 H new ATOM 0 HG13 VAL B 112 28.142 -6.655 -5.471 1.00 0.00 H new ATOM 0 HG21 VAL B 112 27.406 -4.135 -7.059 1.00 0.00 H new ATOM 0 HG22 VAL B 112 26.204 -4.944 -6.025 1.00 0.00 H new ATOM 0 HG23 VAL B 112 26.554 -3.214 -5.796 1.00 0.00 H new ATOM 1052 N GLU B 113 26.914 -6.865 -2.813 1.00 0.00 N ATOM 1053 CA GLU B 113 26.020 -7.972 -2.540 1.00 0.00 C ATOM 1054 C GLU B 113 25.094 -7.580 -1.397 1.00 0.00 C ATOM 1055 O GLU B 113 23.881 -7.647 -1.549 1.00 0.00 O ATOM 1056 CB GLU B 113 26.791 -9.253 -2.220 1.00 0.00 C ATOM 1057 CG GLU B 113 27.725 -9.658 -3.370 1.00 0.00 C ATOM 1058 CD GLU B 113 27.952 -11.169 -3.419 1.00 0.00 C ATOM 1059 OE1 GLU B 113 28.078 -11.796 -2.339 1.00 0.00 O ATOM 1060 OE2 GLU B 113 27.980 -11.716 -4.545 1.00 0.00 O ATOM 0 H GLU B 113 27.875 -7.018 -2.508 1.00 0.00 H new ATOM 0 HA GLU B 113 25.428 -8.184 -3.430 1.00 0.00 H new ATOM 0 HB2 GLU B 113 27.375 -9.108 -1.311 1.00 0.00 H new ATOM 0 HB3 GLU B 113 26.087 -10.061 -2.022 1.00 0.00 H new ATOM 0 HG2 GLU B 113 27.300 -9.324 -4.317 1.00 0.00 H new ATOM 0 HG3 GLU B 113 28.683 -9.151 -3.255 1.00 0.00 H new ATOM 1067 N ASP B 114 25.654 -7.127 -0.277 1.00 0.00 N ATOM 1068 CA ASP B 114 24.893 -6.738 0.911 1.00 0.00 C ATOM 1069 C ASP B 114 23.857 -5.674 0.583 1.00 0.00 C ATOM 1070 O ASP B 114 22.706 -5.755 1.028 1.00 0.00 O ATOM 1071 CB ASP B 114 25.815 -6.183 2.002 1.00 0.00 C ATOM 1072 CG ASP B 114 26.564 -7.262 2.765 1.00 0.00 C ATOM 1073 OD1 ASP B 114 25.914 -8.105 3.423 1.00 0.00 O ATOM 1074 OD2 ASP B 114 27.814 -7.196 2.781 1.00 0.00 O ATOM 0 H ASP B 114 26.662 -7.018 -0.167 1.00 0.00 H new ATOM 0 HA ASP B 114 24.394 -7.639 1.268 1.00 0.00 H new ATOM 0 HB2 ASP B 114 26.536 -5.503 1.547 1.00 0.00 H new ATOM 0 HB3 ASP B 114 25.223 -5.596 2.704 1.00 0.00 H new ATOM 1079 N LEU B 115 24.260 -4.656 -0.181 1.00 0.00 N ATOM 1080 CA LEU B 115 23.350 -3.589 -0.558 1.00 0.00 C ATOM 1081 C LEU B 115 22.294 -4.146 -1.517 1.00 0.00 C ATOM 1082 O LEU B 115 21.105 -3.907 -1.307 1.00 0.00 O ATOM 1083 CB LEU B 115 24.114 -2.338 -1.062 1.00 0.00 C ATOM 1084 CG LEU B 115 24.545 -2.372 -2.535 1.00 0.00 C ATOM 1085 CD1 LEU B 115 23.395 -1.988 -3.466 1.00 0.00 C ATOM 1086 CD2 LEU B 115 25.697 -1.412 -2.838 1.00 0.00 C ATOM 0 H LEU B 115 25.207 -4.554 -0.546 1.00 0.00 H new ATOM 0 HA LEU B 115 22.808 -3.222 0.314 1.00 0.00 H new ATOM 0 HB2 LEU B 115 23.483 -1.463 -0.907 1.00 0.00 H new ATOM 0 HB3 LEU B 115 25.003 -2.204 -0.445 1.00 0.00 H new ATOM 0 HG LEU B 115 24.864 -3.400 -2.709 1.00 0.00 H new ATOM 0 HD11 LEU B 115 23.737 -2.023 -4.500 1.00 0.00 H new ATOM 0 HD12 LEU B 115 22.570 -2.688 -3.333 1.00 0.00 H new ATOM 0 HD13 LEU B 115 23.057 -0.979 -3.230 1.00 0.00 H new ATOM 0 HD21 LEU B 115 25.959 -1.479 -3.894 1.00 0.00 H new ATOM 0 HD22 LEU B 115 25.392 -0.392 -2.604 1.00 0.00 H new ATOM 0 HD23 LEU B 115 26.563 -1.680 -2.232 1.00 0.00 H new ATOM 1098 N GLN B 116 22.681 -4.911 -2.547 1.00 0.00 N ATOM 1099 CA GLN B 116 21.723 -5.453 -3.507 1.00 0.00 C ATOM 1100 C GLN B 116 20.705 -6.344 -2.788 1.00 0.00 C ATOM 1101 O GLN B 116 19.513 -6.283 -3.076 1.00 0.00 O ATOM 1102 CB GLN B 116 22.466 -6.140 -4.648 1.00 0.00 C ATOM 1103 CG GLN B 116 21.554 -6.519 -5.812 1.00 0.00 C ATOM 1104 CD GLN B 116 22.422 -6.801 -7.033 1.00 0.00 C ATOM 1105 OE1 GLN B 116 23.074 -7.840 -7.111 1.00 0.00 O ATOM 1106 NE2 GLN B 116 22.581 -5.844 -7.930 1.00 0.00 N ATOM 0 H GLN B 116 23.651 -5.166 -2.733 1.00 0.00 H new ATOM 0 HA GLN B 116 21.143 -4.652 -3.966 1.00 0.00 H new ATOM 0 HB2 GLN B 116 23.253 -5.480 -5.011 1.00 0.00 H new ATOM 0 HB3 GLN B 116 22.953 -7.038 -4.268 1.00 0.00 H new ATOM 0 HG2 GLN B 116 20.960 -7.397 -5.558 1.00 0.00 H new ATOM 0 HG3 GLN B 116 20.854 -5.711 -6.023 1.00 0.00 H new ATOM 0 HE21 GLN B 116 22.037 -4.984 -7.860 1.00 0.00 H new ATOM 0 HE22 GLN B 116 23.248 -5.965 -8.692 1.00 0.00 H new ATOM 1115 N LYS B 117 21.137 -7.116 -1.787 1.00 0.00 N ATOM 1116 CA LYS B 117 20.262 -7.976 -0.987 1.00 0.00 C ATOM 1117 C LYS B 117 19.193 -7.101 -0.331 1.00 0.00 C ATOM 1118 O LYS B 117 18.063 -7.569 -0.159 1.00 0.00 O ATOM 1119 CB LYS B 117 21.076 -8.763 0.065 1.00 0.00 C ATOM 1120 CG LYS B 117 21.493 -10.187 -0.347 1.00 0.00 C ATOM 1121 CD LYS B 117 21.919 -10.332 -1.817 1.00 0.00 C ATOM 1122 CE LYS B 117 22.828 -11.532 -2.083 1.00 0.00 C ATOM 1123 NZ LYS B 117 22.204 -12.833 -1.787 1.00 0.00 N ATOM 0 H LYS B 117 22.117 -7.162 -1.506 1.00 0.00 H new ATOM 0 HA LYS B 117 19.779 -8.714 -1.627 1.00 0.00 H new ATOM 0 HB2 LYS B 117 21.975 -8.195 0.302 1.00 0.00 H new ATOM 0 HB3 LYS B 117 20.488 -8.826 0.981 1.00 0.00 H new ATOM 0 HG2 LYS B 117 22.318 -10.508 0.289 1.00 0.00 H new ATOM 0 HG3 LYS B 117 20.661 -10.864 -0.156 1.00 0.00 H new ATOM 0 HD2 LYS B 117 21.027 -10.420 -2.437 1.00 0.00 H new ATOM 0 HD3 LYS B 117 22.434 -9.423 -2.127 1.00 0.00 H new ATOM 0 HE2 LYS B 117 23.135 -11.517 -3.129 1.00 0.00 H new ATOM 0 HE3 LYS B 117 23.733 -11.430 -1.484 1.00 0.00 H new ATOM 0 HZ1 LYS B 117 22.880 -13.597 -1.992 1.00 0.00 H new ATOM 0 HZ2 LYS B 117 21.935 -12.869 -0.783 1.00 0.00 H new ATOM 0 HZ3 LYS B 117 21.356 -12.954 -2.377 1.00 0.00 H new ATOM 1137 N ARG B 118 19.503 -5.865 0.082 1.00 0.00 N ATOM 1138 CA ARG B 118 18.502 -4.982 0.675 1.00 0.00 C ATOM 1139 C ARG B 118 17.500 -4.614 -0.408 1.00 0.00 C ATOM 1140 O ARG B 118 16.310 -4.762 -0.166 1.00 0.00 O ATOM 1141 CB ARG B 118 19.105 -3.705 1.286 1.00 0.00 C ATOM 1142 CG ARG B 118 19.904 -3.897 2.578 1.00 0.00 C ATOM 1143 CD ARG B 118 18.975 -3.964 3.795 1.00 0.00 C ATOM 1144 NE ARG B 118 18.294 -5.262 3.903 1.00 0.00 N ATOM 1145 CZ ARG B 118 17.195 -5.526 4.612 1.00 0.00 C ATOM 1146 NH1 ARG B 118 16.488 -4.562 5.193 1.00 0.00 N ATOM 1147 NH2 ARG B 118 16.808 -6.785 4.718 1.00 0.00 N ATOM 0 H ARG B 118 20.436 -5.459 0.015 1.00 0.00 H new ATOM 0 HA ARG B 118 18.025 -5.515 1.497 1.00 0.00 H new ATOM 0 HB2 ARG B 118 19.756 -3.242 0.544 1.00 0.00 H new ATOM 0 HB3 ARG B 118 18.296 -3.002 1.483 1.00 0.00 H new ATOM 0 HG2 ARG B 118 20.491 -4.813 2.514 1.00 0.00 H new ATOM 0 HG3 ARG B 118 20.609 -3.074 2.699 1.00 0.00 H new ATOM 0 HD2 ARG B 118 19.553 -3.782 4.701 1.00 0.00 H new ATOM 0 HD3 ARG B 118 18.231 -3.170 3.726 1.00 0.00 H new ATOM 0 HE ARG B 118 18.703 -6.039 3.384 1.00 0.00 H new ATOM 0 HH11 ARG B 118 16.782 -3.589 5.103 1.00 0.00 H new ATOM 0 HH12 ARG B 118 15.652 -4.795 5.729 1.00 0.00 H new ATOM 0 HH21 ARG B 118 17.346 -7.524 4.264 1.00 0.00 H new ATOM 0 HH22 ARG B 118 15.972 -7.018 5.254 1.00 0.00 H new ATOM 1161 N LEU B 119 17.958 -4.155 -1.578 1.00 0.00 N ATOM 1162 CA LEU B 119 17.116 -3.762 -2.714 1.00 0.00 C ATOM 1163 C LEU B 119 16.163 -4.902 -3.072 1.00 0.00 C ATOM 1164 O LEU B 119 14.951 -4.707 -3.180 1.00 0.00 O ATOM 1165 CB LEU B 119 18.002 -3.362 -3.917 1.00 0.00 C ATOM 1166 CG LEU B 119 17.296 -3.429 -5.283 1.00 0.00 C ATOM 1167 CD1 LEU B 119 16.152 -2.417 -5.382 1.00 0.00 C ATOM 1168 CD2 LEU B 119 18.272 -3.208 -6.425 1.00 0.00 C ATOM 0 H LEU B 119 18.954 -4.043 -1.766 1.00 0.00 H new ATOM 0 HA LEU B 119 16.515 -2.895 -2.441 1.00 0.00 H new ATOM 0 HB2 LEU B 119 18.367 -2.347 -3.761 1.00 0.00 H new ATOM 0 HB3 LEU B 119 18.875 -4.014 -3.941 1.00 0.00 H new ATOM 0 HG LEU B 119 16.878 -4.432 -5.366 1.00 0.00 H new ATOM 0 HD11 LEU B 119 15.680 -2.496 -6.361 1.00 0.00 H new ATOM 0 HD12 LEU B 119 15.415 -2.624 -4.606 1.00 0.00 H new ATOM 0 HD13 LEU B 119 16.545 -1.409 -5.250 1.00 0.00 H new ATOM 0 HD21 LEU B 119 17.739 -3.262 -7.374 1.00 0.00 H new ATOM 0 HD22 LEU B 119 18.734 -2.226 -6.324 1.00 0.00 H new ATOM 0 HD23 LEU B 119 19.044 -3.977 -6.398 1.00 0.00 H new ATOM 1180 N LEU B 120 16.703 -6.107 -3.224 1.00 0.00 N ATOM 1181 CA LEU B 120 15.931 -7.280 -3.563 1.00 0.00 C ATOM 1182 C LEU B 120 14.865 -7.547 -2.499 1.00 0.00 C ATOM 1183 O LEU B 120 13.743 -7.889 -2.840 1.00 0.00 O ATOM 1184 CB LEU B 120 16.889 -8.475 -3.732 1.00 0.00 C ATOM 1185 CG LEU B 120 16.190 -9.844 -3.619 1.00 0.00 C ATOM 1186 CD1 LEU B 120 15.224 -10.115 -4.772 1.00 0.00 C ATOM 1187 CD2 LEU B 120 17.220 -10.974 -3.574 1.00 0.00 C ATOM 0 H LEU B 120 17.700 -6.290 -3.112 1.00 0.00 H new ATOM 0 HA LEU B 120 15.404 -7.122 -4.504 1.00 0.00 H new ATOM 0 HB2 LEU B 120 17.377 -8.404 -4.704 1.00 0.00 H new ATOM 0 HB3 LEU B 120 17.672 -8.412 -2.976 1.00 0.00 H new ATOM 0 HG LEU B 120 15.616 -9.812 -2.693 1.00 0.00 H new ATOM 0 HD11 LEU B 120 14.762 -11.093 -4.638 1.00 0.00 H new ATOM 0 HD12 LEU B 120 14.450 -9.347 -4.786 1.00 0.00 H new ATOM 0 HD13 LEU B 120 15.770 -10.098 -5.715 1.00 0.00 H new ATOM 0 HD21 LEU B 120 16.706 -11.932 -3.494 1.00 0.00 H new ATOM 0 HD22 LEU B 120 17.818 -10.958 -4.485 1.00 0.00 H new ATOM 0 HD23 LEU B 120 17.871 -10.839 -2.710 1.00 0.00 H new ATOM 1199 N ALA B 121 15.220 -7.463 -1.211 1.00 0.00 N ATOM 1200 CA ALA B 121 14.281 -7.712 -0.113 1.00 0.00 C ATOM 1201 C ALA B 121 13.218 -6.619 -0.008 1.00 0.00 C ATOM 1202 O ALA B 121 12.112 -6.886 0.460 1.00 0.00 O ATOM 1203 CB ALA B 121 15.029 -7.829 1.220 1.00 0.00 C ATOM 0 H ALA B 121 16.162 -7.222 -0.903 1.00 0.00 H new ATOM 0 HA ALA B 121 13.777 -8.653 -0.333 1.00 0.00 H new ATOM 0 HB1 ALA B 121 14.315 -8.014 2.023 1.00 0.00 H new ATOM 0 HB2 ALA B 121 15.738 -8.655 1.168 1.00 0.00 H new ATOM 0 HB3 ALA B 121 15.566 -6.902 1.418 1.00 0.00 H new ATOM 1209 N LEU B 122 13.571 -5.412 -0.448 1.00 0.00 N ATOM 1210 CA LEU B 122 12.767 -4.192 -0.458 1.00 0.00 C ATOM 1211 C LEU B 122 11.499 -4.388 -1.276 1.00 0.00 C ATOM 1212 O LEU B 122 10.436 -3.904 -0.892 1.00 0.00 O ATOM 1213 CB LEU B 122 13.575 -2.997 -1.017 1.00 0.00 C ATOM 1214 CG LEU B 122 13.608 -1.746 -0.131 1.00 0.00 C ATOM 1215 CD1 LEU B 122 12.210 -1.296 0.285 1.00 0.00 C ATOM 1216 CD2 LEU B 122 14.479 -1.964 1.111 1.00 0.00 C ATOM 0 H LEU B 122 14.500 -5.250 -0.837 1.00 0.00 H new ATOM 0 HA LEU B 122 12.491 -3.971 0.573 1.00 0.00 H new ATOM 0 HB2 LEU B 122 14.600 -3.324 -1.191 1.00 0.00 H new ATOM 0 HB3 LEU B 122 13.159 -2.723 -1.987 1.00 0.00 H new ATOM 0 HG LEU B 122 14.049 -0.953 -0.735 1.00 0.00 H new ATOM 0 HD11 LEU B 122 12.285 -0.407 0.911 1.00 0.00 H new ATOM 0 HD12 LEU B 122 11.623 -1.065 -0.604 1.00 0.00 H new ATOM 0 HD13 LEU B 122 11.723 -2.094 0.845 1.00 0.00 H new ATOM 0 HD21 LEU B 122 14.481 -1.058 1.718 1.00 0.00 H new ATOM 0 HD22 LEU B 122 14.078 -2.792 1.696 1.00 0.00 H new ATOM 0 HD23 LEU B 122 15.499 -2.197 0.804 1.00 0.00 H new ATOM 1228 N ASP B 123 11.616 -5.079 -2.411 1.00 0.00 N ATOM 1229 CA ASP B 123 10.493 -5.363 -3.302 1.00 0.00 C ATOM 1230 C ASP B 123 9.422 -6.143 -2.522 1.00 0.00 C ATOM 1231 O ASP B 123 8.357 -5.572 -2.310 1.00 0.00 O ATOM 1232 CB ASP B 123 10.979 -6.003 -4.615 1.00 0.00 C ATOM 1233 CG ASP B 123 11.350 -4.979 -5.702 1.00 0.00 C ATOM 1234 OD1 ASP B 123 11.023 -3.767 -5.610 1.00 0.00 O ATOM 1235 OD2 ASP B 123 12.086 -5.351 -6.643 1.00 0.00 O ATOM 0 H ASP B 123 12.503 -5.461 -2.740 1.00 0.00 H new ATOM 0 HA ASP B 123 10.006 -4.446 -3.634 1.00 0.00 H new ATOM 0 HB2 ASP B 123 11.847 -6.627 -4.405 1.00 0.00 H new ATOM 0 HB3 ASP B 123 10.199 -6.661 -4.999 1.00 0.00 H new ATOM 1240 N PRO B 124 9.648 -7.360 -1.992 1.00 0.00 N ATOM 1241 CA PRO B 124 8.624 -8.054 -1.224 1.00 0.00 C ATOM 1242 C PRO B 124 8.286 -7.324 0.094 1.00 0.00 C ATOM 1243 O PRO B 124 7.316 -7.713 0.739 1.00 0.00 O ATOM 1244 CB PRO B 124 9.119 -9.488 -1.030 1.00 0.00 C ATOM 1245 CG PRO B 124 10.632 -9.380 -1.177 1.00 0.00 C ATOM 1246 CD PRO B 124 10.816 -8.200 -2.132 1.00 0.00 C ATOM 0 HA PRO B 124 7.673 -8.068 -1.757 1.00 0.00 H new ATOM 0 HB2 PRO B 124 8.840 -9.877 -0.051 1.00 0.00 H new ATOM 0 HB3 PRO B 124 8.693 -10.161 -1.774 1.00 0.00 H new ATOM 0 HG2 PRO B 124 11.116 -9.199 -0.217 1.00 0.00 H new ATOM 0 HG3 PRO B 124 11.062 -10.296 -1.583 1.00 0.00 H new ATOM 0 HD2 PRO B 124 11.722 -7.645 -1.890 1.00 0.00 H new ATOM 0 HD3 PRO B 124 10.921 -8.548 -3.160 1.00 0.00 H new ATOM 1254 N MET B 125 9.061 -6.323 0.559 1.00 0.00 N ATOM 1255 CA MET B 125 8.703 -5.603 1.787 1.00 0.00 C ATOM 1256 C MET B 125 7.472 -4.757 1.457 1.00 0.00 C ATOM 1257 O MET B 125 6.504 -4.736 2.214 1.00 0.00 O ATOM 1258 CB MET B 125 9.771 -4.632 2.336 1.00 0.00 C ATOM 1259 CG MET B 125 11.100 -5.196 2.830 1.00 0.00 C ATOM 1260 SD MET B 125 11.869 -4.222 4.158 1.00 0.00 S ATOM 1261 CE MET B 125 13.066 -5.458 4.726 1.00 0.00 C ATOM 0 H MET B 125 9.920 -6.004 0.111 1.00 0.00 H new ATOM 0 HA MET B 125 8.559 -6.364 2.554 1.00 0.00 H new ATOM 0 HB2 MET B 125 9.992 -3.908 1.551 1.00 0.00 H new ATOM 0 HB3 MET B 125 9.321 -4.080 3.161 1.00 0.00 H new ATOM 0 HG2 MET B 125 10.941 -6.214 3.186 1.00 0.00 H new ATOM 0 HG3 MET B 125 11.792 -5.256 1.990 1.00 0.00 H new ATOM 0 HE1 MET B 125 13.509 -5.130 5.666 1.00 0.00 H new ATOM 0 HE2 MET B 125 12.560 -6.412 4.876 1.00 0.00 H new ATOM 0 HE3 MET B 125 13.849 -5.577 3.978 1.00 0.00 H new ATOM 1271 N MET B 126 7.541 -3.992 0.359 1.00 0.00 N ATOM 1272 CA MET B 126 6.432 -3.152 -0.056 1.00 0.00 C ATOM 1273 C MET B 126 5.311 -3.977 -0.673 1.00 0.00 C ATOM 1274 O MET B 126 4.156 -3.737 -0.363 1.00 0.00 O ATOM 1275 CB MET B 126 6.880 -2.036 -1.021 1.00 0.00 C ATOM 1276 CG MET B 126 7.546 -2.497 -2.322 1.00 0.00 C ATOM 1277 SD MET B 126 7.006 -1.679 -3.843 1.00 0.00 S ATOM 1278 CE MET B 126 5.785 -2.884 -4.437 1.00 0.00 C ATOM 0 H MET B 126 8.357 -3.944 -0.251 1.00 0.00 H new ATOM 0 HA MET B 126 6.048 -2.673 0.844 1.00 0.00 H new ATOM 0 HB2 MET B 126 6.009 -1.433 -1.277 1.00 0.00 H new ATOM 0 HB3 MET B 126 7.575 -1.384 -0.492 1.00 0.00 H new ATOM 0 HG2 MET B 126 8.622 -2.355 -2.223 1.00 0.00 H new ATOM 0 HG3 MET B 126 7.374 -3.568 -2.432 1.00 0.00 H new ATOM 0 HE1 MET B 126 5.339 -2.524 -5.364 1.00 0.00 H new ATOM 0 HE2 MET B 126 6.276 -3.840 -4.618 1.00 0.00 H new ATOM 0 HE3 MET B 126 5.006 -3.013 -3.686 1.00 0.00 H new ATOM 1288 N GLU B 127 5.621 -4.982 -1.491 1.00 0.00 N ATOM 1289 CA GLU B 127 4.612 -5.780 -2.170 1.00 0.00 C ATOM 1290 C GLU B 127 3.573 -6.347 -1.213 1.00 0.00 C ATOM 1291 O GLU B 127 2.382 -6.153 -1.468 1.00 0.00 O ATOM 1292 CB GLU B 127 5.295 -6.874 -2.988 1.00 0.00 C ATOM 1293 CG GLU B 127 4.286 -7.551 -3.911 1.00 0.00 C ATOM 1294 CD GLU B 127 4.985 -8.549 -4.817 1.00 0.00 C ATOM 1295 OE1 GLU B 127 5.523 -8.106 -5.861 1.00 0.00 O ATOM 1296 OE2 GLU B 127 5.025 -9.751 -4.462 1.00 0.00 O ATOM 0 H GLU B 127 6.579 -5.262 -1.699 1.00 0.00 H new ATOM 0 HA GLU B 127 4.059 -5.128 -2.846 1.00 0.00 H new ATOM 0 HB2 GLU B 127 6.106 -6.445 -3.576 1.00 0.00 H new ATOM 0 HB3 GLU B 127 5.741 -7.612 -2.321 1.00 0.00 H new ATOM 0 HG2 GLU B 127 3.525 -8.059 -3.318 1.00 0.00 H new ATOM 0 HG3 GLU B 127 3.773 -6.801 -4.513 1.00 0.00 H new ATOM 1303 N GLN B 128 4.044 -6.956 -0.124 1.00 0.00 N ATOM 1304 CA GLN B 128 3.260 -7.572 0.930 1.00 0.00 C ATOM 1305 C GLN B 128 2.256 -6.574 1.519 1.00 0.00 C ATOM 1306 O GLN B 128 1.061 -6.857 1.612 1.00 0.00 O ATOM 1307 CB GLN B 128 4.272 -8.072 1.980 1.00 0.00 C ATOM 1308 CG GLN B 128 3.732 -8.975 3.090 1.00 0.00 C ATOM 1309 CD GLN B 128 2.879 -8.281 4.152 1.00 0.00 C ATOM 1310 OE1 GLN B 128 3.378 -7.615 5.058 1.00 0.00 O ATOM 1311 NE2 GLN B 128 1.578 -8.488 4.113 1.00 0.00 N ATOM 0 H GLN B 128 5.046 -7.033 0.050 1.00 0.00 H new ATOM 0 HA GLN B 128 2.661 -8.402 0.556 1.00 0.00 H new ATOM 0 HB2 GLN B 128 5.062 -8.612 1.458 1.00 0.00 H new ATOM 0 HB3 GLN B 128 4.734 -7.202 2.446 1.00 0.00 H new ATOM 0 HG2 GLN B 128 3.138 -9.766 2.633 1.00 0.00 H new ATOM 0 HG3 GLN B 128 4.576 -9.456 3.585 1.00 0.00 H new ATOM 0 HE21 GLN B 128 1.172 -9.041 3.358 1.00 0.00 H new ATOM 0 HE22 GLN B 128 0.977 -8.095 4.837 1.00 0.00 H new ATOM 1320 N GLU B 129 2.746 -5.398 1.906 1.00 0.00 N ATOM 1321 CA GLU B 129 1.960 -4.330 2.496 1.00 0.00 C ATOM 1322 C GLU B 129 0.913 -3.803 1.513 1.00 0.00 C ATOM 1323 O GLU B 129 -0.227 -3.564 1.910 1.00 0.00 O ATOM 1324 CB GLU B 129 2.902 -3.197 2.928 1.00 0.00 C ATOM 1325 CG GLU B 129 3.884 -3.580 4.045 1.00 0.00 C ATOM 1326 CD GLU B 129 3.346 -3.220 5.432 1.00 0.00 C ATOM 1327 OE1 GLU B 129 2.209 -3.603 5.787 1.00 0.00 O ATOM 1328 OE2 GLU B 129 4.071 -2.532 6.189 1.00 0.00 O ATOM 0 H GLU B 129 3.733 -5.160 1.812 1.00 0.00 H new ATOM 0 HA GLU B 129 1.428 -4.721 3.363 1.00 0.00 H new ATOM 0 HB2 GLU B 129 3.470 -2.863 2.060 1.00 0.00 H new ATOM 0 HB3 GLU B 129 2.303 -2.350 3.262 1.00 0.00 H new ATOM 0 HG2 GLU B 129 4.083 -4.651 4.001 1.00 0.00 H new ATOM 0 HG3 GLU B 129 4.834 -3.072 3.882 1.00 0.00 H new ATOM 1335 N ILE B 130 1.278 -3.604 0.240 1.00 0.00 N ATOM 1336 CA ILE B 130 0.336 -3.095 -0.744 1.00 0.00 C ATOM 1337 C ILE B 130 -0.776 -4.104 -0.973 1.00 0.00 C ATOM 1338 O ILE B 130 -1.934 -3.701 -0.928 1.00 0.00 O ATOM 1339 CB ILE B 130 1.024 -2.669 -2.067 1.00 0.00 C ATOM 1340 CG1 ILE B 130 1.668 -1.276 -1.914 1.00 0.00 C ATOM 1341 CG2 ILE B 130 0.018 -2.564 -3.233 1.00 0.00 C ATOM 1342 CD1 ILE B 130 3.106 -1.293 -1.411 1.00 0.00 C ATOM 0 H ILE B 130 2.213 -3.788 -0.123 1.00 0.00 H new ATOM 0 HA ILE B 130 -0.107 -2.184 -0.341 1.00 0.00 H new ATOM 0 HB ILE B 130 1.769 -3.435 -2.283 1.00 0.00 H new ATOM 0 HG12 ILE B 130 1.641 -0.770 -2.879 1.00 0.00 H new ATOM 0 HG13 ILE B 130 1.064 -0.684 -1.226 1.00 0.00 H new ATOM 0 HG21 ILE B 130 0.542 -2.263 -4.140 1.00 0.00 H new ATOM 0 HG22 ILE B 130 -0.457 -3.532 -3.392 1.00 0.00 H new ATOM 0 HG23 ILE B 130 -0.743 -1.822 -2.991 1.00 0.00 H new ATOM 0 HD11 ILE B 130 3.477 -0.271 -1.334 1.00 0.00 H new ATOM 0 HD12 ILE B 130 3.143 -1.767 -0.430 1.00 0.00 H new ATOM 0 HD13 ILE B 130 3.729 -1.853 -2.108 1.00 0.00 H new ATOM 1354 N GLU B 131 -0.461 -5.371 -1.263 1.00 0.00 N ATOM 1355 CA GLU B 131 -1.499 -6.364 -1.520 1.00 0.00 C ATOM 1356 C GLU B 131 -2.467 -6.481 -0.350 1.00 0.00 C ATOM 1357 O GLU B 131 -3.664 -6.608 -0.601 1.00 0.00 O ATOM 1358 CB GLU B 131 -0.934 -7.696 -2.016 1.00 0.00 C ATOM 1359 CG GLU B 131 -0.079 -8.411 -0.977 1.00 0.00 C ATOM 1360 CD GLU B 131 0.556 -9.688 -1.506 1.00 0.00 C ATOM 1361 OE1 GLU B 131 1.093 -9.687 -2.640 1.00 0.00 O ATOM 1362 OE2 GLU B 131 0.489 -10.696 -0.770 1.00 0.00 O ATOM 0 H GLU B 131 0.493 -5.726 -1.324 1.00 0.00 H new ATOM 0 HA GLU B 131 -2.099 -6.004 -2.356 1.00 0.00 H new ATOM 0 HB2 GLU B 131 -1.758 -8.346 -2.308 1.00 0.00 H new ATOM 0 HB3 GLU B 131 -0.336 -7.519 -2.910 1.00 0.00 H new ATOM 0 HG2 GLU B 131 0.706 -7.737 -0.634 1.00 0.00 H new ATOM 0 HG3 GLU B 131 -0.695 -8.650 -0.110 1.00 0.00 H new ATOM 1369 N GLU B 132 -1.984 -6.375 0.894 1.00 0.00 N ATOM 1370 CA GLU B 132 -2.842 -6.431 2.067 1.00 0.00 C ATOM 1371 C GLU B 132 -3.834 -5.276 1.942 1.00 0.00 C ATOM 1372 O GLU B 132 -5.035 -5.482 2.074 1.00 0.00 O ATOM 1373 CB GLU B 132 -2.004 -6.335 3.357 1.00 0.00 C ATOM 1374 CG GLU B 132 -2.794 -6.002 4.644 1.00 0.00 C ATOM 1375 CD GLU B 132 -3.804 -7.064 5.096 1.00 0.00 C ATOM 1376 OE1 GLU B 132 -3.480 -8.274 5.033 1.00 0.00 O ATOM 1377 OE2 GLU B 132 -4.882 -6.683 5.624 1.00 0.00 O ATOM 0 H GLU B 132 -0.994 -6.249 1.107 1.00 0.00 H new ATOM 0 HA GLU B 132 -3.378 -7.379 2.124 1.00 0.00 H new ATOM 0 HB2 GLU B 132 -1.487 -7.283 3.505 1.00 0.00 H new ATOM 0 HB3 GLU B 132 -1.238 -5.573 3.215 1.00 0.00 H new ATOM 0 HG2 GLU B 132 -2.082 -5.836 5.453 1.00 0.00 H new ATOM 0 HG3 GLU B 132 -3.326 -5.063 4.490 1.00 0.00 H new ATOM 1384 N ILE B 133 -3.372 -4.059 1.642 1.00 0.00 N ATOM 1385 CA ILE B 133 -4.251 -2.907 1.518 1.00 0.00 C ATOM 1386 C ILE B 133 -5.210 -3.076 0.341 1.00 0.00 C ATOM 1387 O ILE B 133 -6.380 -2.693 0.453 1.00 0.00 O ATOM 1388 CB ILE B 133 -3.404 -1.627 1.420 1.00 0.00 C ATOM 1389 CG1 ILE B 133 -2.639 -1.433 2.745 1.00 0.00 C ATOM 1390 CG2 ILE B 133 -4.274 -0.383 1.188 1.00 0.00 C ATOM 1391 CD1 ILE B 133 -1.466 -0.483 2.585 1.00 0.00 C ATOM 0 H ILE B 133 -2.386 -3.852 1.481 1.00 0.00 H new ATOM 0 HA ILE B 133 -4.877 -2.823 2.407 1.00 0.00 H new ATOM 0 HB ILE B 133 -2.724 -1.740 0.575 1.00 0.00 H new ATOM 0 HG12 ILE B 133 -3.319 -1.046 3.504 1.00 0.00 H new ATOM 0 HG13 ILE B 133 -2.279 -2.398 3.102 1.00 0.00 H new ATOM 0 HG21 ILE B 133 -3.637 0.500 1.125 1.00 0.00 H new ATOM 0 HG22 ILE B 133 -4.830 -0.497 0.258 1.00 0.00 H new ATOM 0 HG23 ILE B 133 -4.973 -0.268 2.017 1.00 0.00 H new ATOM 0 HD11 ILE B 133 -0.954 -0.373 3.541 1.00 0.00 H new ATOM 0 HD12 ILE B 133 -0.772 -0.883 1.845 1.00 0.00 H new ATOM 0 HD13 ILE B 133 -1.829 0.490 2.254 1.00 0.00 H new ATOM 1403 N ARG B 134 -4.752 -3.617 -0.792 1.00 0.00 N ATOM 1404 CA ARG B 134 -5.617 -3.792 -1.946 1.00 0.00 C ATOM 1405 C ARG B 134 -6.721 -4.760 -1.589 1.00 0.00 C ATOM 1406 O ARG B 134 -7.879 -4.448 -1.855 1.00 0.00 O ATOM 1407 CB ARG B 134 -4.865 -4.305 -3.179 1.00 0.00 C ATOM 1408 CG ARG B 134 -3.657 -3.448 -3.565 1.00 0.00 C ATOM 1409 CD ARG B 134 -3.399 -3.485 -5.065 1.00 0.00 C ATOM 1410 NE ARG B 134 -4.305 -2.599 -5.816 1.00 0.00 N ATOM 1411 CZ ARG B 134 -4.532 -2.614 -7.135 1.00 0.00 C ATOM 1412 NH1 ARG B 134 -4.062 -3.581 -7.915 1.00 0.00 N ATOM 1413 NH2 ARG B 134 -5.251 -1.651 -7.696 1.00 0.00 N ATOM 0 H ARG B 134 -3.793 -3.937 -0.927 1.00 0.00 H new ATOM 0 HA ARG B 134 -6.024 -2.814 -2.205 1.00 0.00 H new ATOM 0 HB2 ARG B 134 -4.530 -5.325 -2.991 1.00 0.00 H new ATOM 0 HB3 ARG B 134 -5.554 -4.346 -4.023 1.00 0.00 H new ATOM 0 HG2 ARG B 134 -3.825 -2.418 -3.250 1.00 0.00 H new ATOM 0 HG3 ARG B 134 -2.774 -3.804 -3.035 1.00 0.00 H new ATOM 0 HD2 ARG B 134 -2.367 -3.193 -5.260 1.00 0.00 H new ATOM 0 HD3 ARG B 134 -3.515 -4.507 -5.425 1.00 0.00 H new ATOM 0 HE ARG B 134 -4.813 -1.900 -5.274 1.00 0.00 H new ATOM 0 HH11 ARG B 134 -3.512 -4.339 -7.512 1.00 0.00 H new ATOM 0 HH12 ARG B 134 -4.252 -3.565 -8.917 1.00 0.00 H new ATOM 0 HH21 ARG B 134 -5.631 -0.898 -7.122 1.00 0.00 H new ATOM 0 HH22 ARG B 134 -5.424 -1.663 -8.701 1.00 0.00 H new ATOM 1427 N GLN B 135 -6.383 -5.895 -0.983 1.00 0.00 N ATOM 1428 CA GLN B 135 -7.331 -6.918 -0.593 1.00 0.00 C ATOM 1429 C GLN B 135 -8.274 -6.393 0.485 1.00 0.00 C ATOM 1430 O GLN B 135 -9.483 -6.426 0.275 1.00 0.00 O ATOM 1431 CB GLN B 135 -6.601 -8.180 -0.131 1.00 0.00 C ATOM 1432 CG GLN B 135 -5.890 -8.889 -1.293 1.00 0.00 C ATOM 1433 CD GLN B 135 -6.854 -9.636 -2.208 1.00 0.00 C ATOM 1434 OE1 GLN B 135 -7.295 -10.753 -1.925 1.00 0.00 O ATOM 1435 NE2 GLN B 135 -7.221 -9.045 -3.334 1.00 0.00 N ATOM 0 H GLN B 135 -5.418 -6.128 -0.747 1.00 0.00 H new ATOM 0 HA GLN B 135 -7.934 -7.183 -1.461 1.00 0.00 H new ATOM 0 HB2 GLN B 135 -5.871 -7.917 0.635 1.00 0.00 H new ATOM 0 HB3 GLN B 135 -7.314 -8.864 0.329 1.00 0.00 H new ATOM 0 HG2 GLN B 135 -5.337 -8.154 -1.878 1.00 0.00 H new ATOM 0 HG3 GLN B 135 -5.159 -9.591 -0.892 1.00 0.00 H new ATOM 0 HE21 GLN B 135 -6.856 -8.122 -3.568 1.00 0.00 H new ATOM 0 HE22 GLN B 135 -7.869 -9.513 -3.968 1.00 0.00 H new ATOM 1444 N LYS B 136 -7.759 -5.824 1.581 1.00 0.00 N ATOM 1445 CA LYS B 136 -8.570 -5.300 2.684 1.00 0.00 C ATOM 1446 C LYS B 136 -9.603 -4.308 2.155 1.00 0.00 C ATOM 1447 O LYS B 136 -10.797 -4.435 2.434 1.00 0.00 O ATOM 1448 CB LYS B 136 -7.666 -4.748 3.821 1.00 0.00 C ATOM 1449 CG LYS B 136 -7.432 -3.226 3.865 1.00 0.00 C ATOM 1450 CD LYS B 136 -6.425 -2.791 4.940 1.00 0.00 C ATOM 1451 CE LYS B 136 -6.103 -1.302 4.726 1.00 0.00 C ATOM 1452 NZ LYS B 136 -5.109 -0.770 5.682 1.00 0.00 N ATOM 0 H LYS B 136 -6.756 -5.714 1.728 1.00 0.00 H new ATOM 0 HA LYS B 136 -9.142 -6.107 3.142 1.00 0.00 H new ATOM 0 HB2 LYS B 136 -8.101 -5.050 4.774 1.00 0.00 H new ATOM 0 HB3 LYS B 136 -6.694 -5.236 3.746 1.00 0.00 H new ATOM 0 HG2 LYS B 136 -7.077 -2.893 2.890 1.00 0.00 H new ATOM 0 HG3 LYS B 136 -8.383 -2.725 4.046 1.00 0.00 H new ATOM 0 HD2 LYS B 136 -6.840 -2.951 5.935 1.00 0.00 H new ATOM 0 HD3 LYS B 136 -5.516 -3.389 4.873 1.00 0.00 H new ATOM 0 HE2 LYS B 136 -5.731 -1.161 3.711 1.00 0.00 H new ATOM 0 HE3 LYS B 136 -7.023 -0.724 4.811 1.00 0.00 H new ATOM 0 HZ1 LYS B 136 -4.557 -0.016 5.226 1.00 0.00 H new ATOM 0 HZ2 LYS B 136 -5.599 -0.385 6.514 1.00 0.00 H new ATOM 0 HZ3 LYS B 136 -4.470 -1.535 5.980 1.00 0.00 H new ATOM 1466 N TYR B 137 -9.175 -3.328 1.355 1.00 0.00 N ATOM 1467 CA TYR B 137 -10.099 -2.348 0.816 1.00 0.00 C ATOM 1468 C TYR B 137 -10.989 -2.957 -0.259 1.00 0.00 C ATOM 1469 O TYR B 137 -12.165 -2.612 -0.285 1.00 0.00 O ATOM 1470 CB TYR B 137 -9.367 -1.083 0.371 1.00 0.00 C ATOM 1471 CG TYR B 137 -9.022 -0.174 1.540 1.00 0.00 C ATOM 1472 CD1 TYR B 137 -10.024 0.296 2.417 1.00 0.00 C ATOM 1473 CD2 TYR B 137 -7.687 0.200 1.752 1.00 0.00 C ATOM 1474 CE1 TYR B 137 -9.680 1.101 3.515 1.00 0.00 C ATOM 1475 CE2 TYR B 137 -7.334 1.023 2.834 1.00 0.00 C ATOM 1476 CZ TYR B 137 -8.330 1.451 3.736 1.00 0.00 C ATOM 1477 OH TYR B 137 -8.004 2.163 4.847 1.00 0.00 O ATOM 0 H TYR B 137 -8.203 -3.199 1.073 1.00 0.00 H new ATOM 0 HA TYR B 137 -10.775 -2.033 1.611 1.00 0.00 H new ATOM 0 HB2 TYR B 137 -8.452 -1.361 -0.153 1.00 0.00 H new ATOM 0 HB3 TYR B 137 -9.988 -0.537 -0.339 1.00 0.00 H new ATOM 0 HD1 TYR B 137 -11.058 0.036 2.243 1.00 0.00 H new ATOM 0 HD2 TYR B 137 -6.921 -0.149 1.075 1.00 0.00 H new ATOM 0 HE1 TYR B 137 -10.447 1.452 4.190 1.00 0.00 H new ATOM 0 HE2 TYR B 137 -6.307 1.326 2.974 1.00 0.00 H new ATOM 0 HH TYR B 137 -7.126 1.876 5.173 1.00 0.00 H new ATOM 1487 N GLN B 138 -10.499 -3.860 -1.116 1.00 0.00 N ATOM 1488 CA GLN B 138 -11.335 -4.486 -2.142 1.00 0.00 C ATOM 1489 C GLN B 138 -12.451 -5.253 -1.434 1.00 0.00 C ATOM 1490 O GLN B 138 -13.609 -5.108 -1.808 1.00 0.00 O ATOM 1491 CB GLN B 138 -10.523 -5.395 -3.089 1.00 0.00 C ATOM 1492 CG GLN B 138 -11.445 -6.251 -3.976 1.00 0.00 C ATOM 1493 CD GLN B 138 -10.765 -6.933 -5.161 1.00 0.00 C ATOM 1494 OE1 GLN B 138 -9.541 -7.004 -5.282 1.00 0.00 O ATOM 1495 NE2 GLN B 138 -11.572 -7.467 -6.062 1.00 0.00 N ATOM 0 H GLN B 138 -9.528 -4.172 -1.118 1.00 0.00 H new ATOM 0 HA GLN B 138 -11.762 -3.714 -2.783 1.00 0.00 H new ATOM 0 HB2 GLN B 138 -9.877 -4.782 -3.718 1.00 0.00 H new ATOM 0 HB3 GLN B 138 -9.874 -6.045 -2.503 1.00 0.00 H new ATOM 0 HG2 GLN B 138 -11.909 -7.017 -3.355 1.00 0.00 H new ATOM 0 HG3 GLN B 138 -12.247 -5.618 -4.354 1.00 0.00 H new ATOM 0 HE21 GLN B 138 -12.583 -7.399 -5.945 1.00 0.00 H new ATOM 0 HE22 GLN B 138 -11.184 -7.947 -6.874 1.00 0.00 H new ATOM 1504 N SER B 139 -12.138 -6.007 -0.380 1.00 0.00 N ATOM 1505 CA SER B 139 -13.099 -6.766 0.399 1.00 0.00 C ATOM 1506 C SER B 139 -14.171 -5.812 0.909 1.00 0.00 C ATOM 1507 O SER B 139 -15.348 -6.115 0.766 1.00 0.00 O ATOM 1508 CB SER B 139 -12.357 -7.526 1.506 1.00 0.00 C ATOM 1509 OG SER B 139 -13.200 -8.457 2.146 1.00 0.00 O ATOM 0 H SER B 139 -11.181 -6.105 -0.041 1.00 0.00 H new ATOM 0 HA SER B 139 -13.609 -7.520 -0.200 1.00 0.00 H new ATOM 0 HB2 SER B 139 -11.498 -8.044 1.080 1.00 0.00 H new ATOM 0 HB3 SER B 139 -11.971 -6.818 2.240 1.00 0.00 H new ATOM 0 HG SER B 139 -12.698 -8.926 2.845 1.00 0.00 H new ATOM 1515 N LYS B 140 -13.801 -4.636 1.426 1.00 0.00 N ATOM 1516 CA LYS B 140 -14.772 -3.656 1.913 1.00 0.00 C ATOM 1517 C LYS B 140 -15.491 -2.930 0.762 1.00 0.00 C ATOM 1518 O LYS B 140 -16.584 -2.407 0.978 1.00 0.00 O ATOM 1519 CB LYS B 140 -14.088 -2.699 2.902 1.00 0.00 C ATOM 1520 CG LYS B 140 -13.655 -3.475 4.157 1.00 0.00 C ATOM 1521 CD LYS B 140 -13.112 -2.605 5.294 1.00 0.00 C ATOM 1522 CE LYS B 140 -11.720 -2.053 4.979 1.00 0.00 C ATOM 1523 NZ LYS B 140 -11.128 -1.440 6.183 1.00 0.00 N ATOM 0 H LYS B 140 -12.829 -4.340 1.517 1.00 0.00 H new ATOM 0 HA LYS B 140 -15.562 -4.179 2.452 1.00 0.00 H new ATOM 0 HB2 LYS B 140 -13.221 -2.234 2.433 1.00 0.00 H new ATOM 0 HB3 LYS B 140 -14.771 -1.895 3.177 1.00 0.00 H new ATOM 0 HG2 LYS B 140 -14.508 -4.043 4.528 1.00 0.00 H new ATOM 0 HG3 LYS B 140 -12.890 -4.198 3.874 1.00 0.00 H new ATOM 0 HD2 LYS B 140 -13.797 -1.777 5.476 1.00 0.00 H new ATOM 0 HD3 LYS B 140 -13.070 -3.192 6.211 1.00 0.00 H new ATOM 0 HE2 LYS B 140 -11.077 -2.855 4.617 1.00 0.00 H new ATOM 0 HE3 LYS B 140 -11.787 -1.313 4.181 1.00 0.00 H new ATOM 0 HZ1 LYS B 140 -10.183 -1.069 5.955 1.00 0.00 H new ATOM 0 HZ2 LYS B 140 -11.735 -0.662 6.511 1.00 0.00 H new ATOM 0 HZ3 LYS B 140 -11.047 -2.156 6.933 1.00 0.00 H new ATOM 1537 N ARG B 141 -14.921 -2.890 -0.450 1.00 0.00 N ATOM 1538 CA ARG B 141 -15.477 -2.266 -1.656 1.00 0.00 C ATOM 1539 C ARG B 141 -16.575 -3.166 -2.222 1.00 0.00 C ATOM 1540 O ARG B 141 -17.642 -2.692 -2.588 1.00 0.00 O ATOM 1541 CB ARG B 141 -14.375 -2.081 -2.733 1.00 0.00 C ATOM 1542 CG ARG B 141 -14.802 -1.217 -3.934 1.00 0.00 C ATOM 1543 CD ARG B 141 -14.060 -1.550 -5.232 1.00 0.00 C ATOM 1544 NE ARG B 141 -12.635 -1.185 -5.210 1.00 0.00 N ATOM 1545 CZ ARG B 141 -11.606 -1.951 -5.596 1.00 0.00 C ATOM 1546 NH1 ARG B 141 -11.753 -3.238 -5.882 1.00 0.00 N ATOM 1547 NH2 ARG B 141 -10.409 -1.392 -5.692 1.00 0.00 N ATOM 0 H ARG B 141 -14.010 -3.315 -0.624 1.00 0.00 H new ATOM 0 HA ARG B 141 -15.882 -1.289 -1.391 1.00 0.00 H new ATOM 0 HB2 ARG B 141 -13.500 -1.628 -2.267 1.00 0.00 H new ATOM 0 HB3 ARG B 141 -14.070 -3.062 -3.096 1.00 0.00 H new ATOM 0 HG2 ARG B 141 -15.873 -1.342 -4.097 1.00 0.00 H new ATOM 0 HG3 ARG B 141 -14.637 -0.167 -3.691 1.00 0.00 H new ATOM 0 HD2 ARG B 141 -14.149 -2.619 -5.427 1.00 0.00 H new ATOM 0 HD3 ARG B 141 -14.545 -1.033 -6.060 1.00 0.00 H new ATOM 0 HE ARG B 141 -12.407 -0.252 -4.865 1.00 0.00 H new ATOM 0 HH11 ARG B 141 -12.672 -3.674 -5.811 1.00 0.00 H new ATOM 0 HH12 ARG B 141 -10.947 -3.791 -6.173 1.00 0.00 H new ATOM 0 HH21 ARG B 141 -10.289 -0.403 -5.474 1.00 0.00 H new ATOM 0 HH22 ARG B 141 -9.607 -1.951 -5.984 1.00 0.00 H new ATOM 1561 N GLN B 142 -16.315 -4.465 -2.276 1.00 0.00 N ATOM 1562 CA GLN B 142 -17.163 -5.529 -2.785 1.00 0.00 C ATOM 1563 C GLN B 142 -18.634 -5.428 -2.316 1.00 0.00 C ATOM 1564 O GLN B 142 -19.498 -5.279 -3.171 1.00 0.00 O ATOM 1565 CB GLN B 142 -16.429 -6.873 -2.569 1.00 0.00 C ATOM 1566 CG GLN B 142 -16.700 -7.922 -3.644 1.00 0.00 C ATOM 1567 CD GLN B 142 -18.101 -8.487 -3.583 1.00 0.00 C ATOM 1568 OE1 GLN B 142 -19.011 -7.936 -4.355 1.00 0.00 O flip ATOM 1569 NE2 GLN B 142 -18.359 -9.421 -2.834 1.00 0.00 N flip ATOM 0 H GLN B 142 -15.426 -4.831 -1.934 1.00 0.00 H new ATOM 0 HA GLN B 142 -17.309 -5.432 -3.861 1.00 0.00 H new ATOM 0 HB2 GLN B 142 -15.356 -6.684 -2.526 1.00 0.00 H new ATOM 0 HB3 GLN B 142 -16.720 -7.280 -1.601 1.00 0.00 H new ATOM 0 HG2 GLN B 142 -16.536 -7.478 -4.626 1.00 0.00 H new ATOM 0 HG3 GLN B 142 -15.982 -8.735 -3.539 1.00 0.00 H new ATOM 0 HE21 GLN B 142 -17.626 -9.823 -2.249 1.00 0.00 H new ATOM 0 HE22 GLN B 142 -19.306 -9.797 -2.795 1.00 0.00 H new ATOM 1578 N PRO B 143 -18.986 -5.418 -1.019 1.00 0.00 N ATOM 1579 CA PRO B 143 -20.379 -5.318 -0.585 1.00 0.00 C ATOM 1580 C PRO B 143 -21.045 -4.021 -1.059 1.00 0.00 C ATOM 1581 O PRO B 143 -22.249 -4.021 -1.301 1.00 0.00 O ATOM 1582 CB PRO B 143 -20.361 -5.424 0.944 1.00 0.00 C ATOM 1583 CG PRO B 143 -18.923 -5.054 1.299 1.00 0.00 C ATOM 1584 CD PRO B 143 -18.122 -5.566 0.121 1.00 0.00 C ATOM 0 HA PRO B 143 -20.976 -6.116 -1.026 1.00 0.00 H new ATOM 0 HB2 PRO B 143 -21.078 -4.744 1.404 1.00 0.00 H new ATOM 0 HB3 PRO B 143 -20.614 -6.429 1.282 1.00 0.00 H new ATOM 0 HG2 PRO B 143 -18.806 -3.978 1.426 1.00 0.00 H new ATOM 0 HG3 PRO B 143 -18.607 -5.521 2.232 1.00 0.00 H new ATOM 0 HD2 PRO B 143 -17.202 -4.996 -0.006 1.00 0.00 H new ATOM 0 HD3 PRO B 143 -17.834 -6.608 0.264 1.00 0.00 H new ATOM 1592 N ILE B 144 -20.283 -2.926 -1.173 1.00 0.00 N ATOM 1593 CA ILE B 144 -20.765 -1.626 -1.628 1.00 0.00 C ATOM 1594 C ILE B 144 -21.066 -1.736 -3.129 1.00 0.00 C ATOM 1595 O ILE B 144 -22.115 -1.274 -3.575 1.00 0.00 O ATOM 1596 CB ILE B 144 -19.714 -0.520 -1.345 1.00 0.00 C ATOM 1597 CG1 ILE B 144 -19.313 -0.382 0.138 1.00 0.00 C ATOM 1598 CG2 ILE B 144 -20.234 0.843 -1.827 1.00 0.00 C ATOM 1599 CD1 ILE B 144 -18.022 0.405 0.383 1.00 0.00 C ATOM 0 H ILE B 144 -19.289 -2.925 -0.944 1.00 0.00 H new ATOM 0 HA ILE B 144 -21.670 -1.347 -1.088 1.00 0.00 H new ATOM 0 HB ILE B 144 -18.824 -0.831 -1.893 1.00 0.00 H new ATOM 0 HG12 ILE B 144 -20.126 0.105 0.676 1.00 0.00 H new ATOM 0 HG13 ILE B 144 -19.201 -1.379 0.564 1.00 0.00 H new ATOM 0 HG21 ILE B 144 -19.487 1.610 -1.623 1.00 0.00 H new ATOM 0 HG22 ILE B 144 -20.427 0.801 -2.899 1.00 0.00 H new ATOM 0 HG23 ILE B 144 -21.158 1.087 -1.302 1.00 0.00 H new ATOM 0 HD11 ILE B 144 -17.821 0.450 1.453 1.00 0.00 H new ATOM 0 HD12 ILE B 144 -17.193 -0.090 -0.122 1.00 0.00 H new ATOM 0 HD13 ILE B 144 -18.133 1.416 -0.008 1.00 0.00 H new ATOM 1611 N LEU B 145 -20.150 -2.332 -3.903 1.00 0.00 N ATOM 1612 CA LEU B 145 -20.307 -2.507 -5.343 1.00 0.00 C ATOM 1613 C LEU B 145 -21.545 -3.333 -5.640 1.00 0.00 C ATOM 1614 O LEU B 145 -22.282 -3.000 -6.567 1.00 0.00 O ATOM 1615 CB LEU B 145 -19.013 -3.010 -6.012 1.00 0.00 C ATOM 1616 CG LEU B 145 -18.861 -4.508 -6.319 1.00 0.00 C ATOM 1617 CD1 LEU B 145 -19.567 -4.991 -7.589 1.00 0.00 C ATOM 1618 CD2 LEU B 145 -17.371 -4.853 -6.470 1.00 0.00 C ATOM 0 H LEU B 145 -19.274 -2.707 -3.540 1.00 0.00 H new ATOM 0 HA LEU B 145 -20.477 -1.535 -5.805 1.00 0.00 H new ATOM 0 HB2 LEU B 145 -18.898 -2.469 -6.951 1.00 0.00 H new ATOM 0 HB3 LEU B 145 -18.179 -2.720 -5.373 1.00 0.00 H new ATOM 0 HG LEU B 145 -19.335 -5.011 -5.476 1.00 0.00 H new ATOM 0 HD11 LEU B 145 -19.398 -6.060 -7.715 1.00 0.00 H new ATOM 0 HD12 LEU B 145 -20.637 -4.800 -7.506 1.00 0.00 H new ATOM 0 HD13 LEU B 145 -19.169 -4.457 -8.452 1.00 0.00 H new ATOM 0 HD21 LEU B 145 -17.264 -5.916 -6.688 1.00 0.00 H new ATOM 0 HD22 LEU B 145 -16.944 -4.270 -7.286 1.00 0.00 H new ATOM 0 HD23 LEU B 145 -16.847 -4.618 -5.543 1.00 0.00 H new ATOM 1630 N ASP B 146 -21.789 -4.358 -4.825 1.00 0.00 N ATOM 1631 CA ASP B 146 -22.954 -5.216 -5.002 1.00 0.00 C ATOM 1632 C ASP B 146 -24.206 -4.445 -4.616 1.00 0.00 C ATOM 1633 O ASP B 146 -25.240 -4.594 -5.253 1.00 0.00 O ATOM 1634 CB ASP B 146 -22.895 -6.430 -4.071 1.00 0.00 C ATOM 1635 CG ASP B 146 -22.000 -7.565 -4.533 1.00 0.00 C ATOM 1636 OD1 ASP B 146 -21.509 -7.572 -5.680 1.00 0.00 O ATOM 1637 OD2 ASP B 146 -21.733 -8.451 -3.691 1.00 0.00 O ATOM 0 H ASP B 146 -21.194 -4.613 -4.036 1.00 0.00 H new ATOM 0 HA ASP B 146 -22.969 -5.537 -6.044 1.00 0.00 H new ATOM 0 HB2 ASP B 146 -22.554 -6.098 -3.091 1.00 0.00 H new ATOM 0 HB3 ASP B 146 -23.906 -6.817 -3.943 1.00 0.00 H new ATOM 1642 N ALA B 147 -24.130 -3.636 -3.552 1.00 0.00 N ATOM 1643 CA ALA B 147 -25.260 -2.863 -3.069 1.00 0.00 C ATOM 1644 C ALA B 147 -25.782 -1.916 -4.146 1.00 0.00 C ATOM 1645 O ALA B 147 -26.985 -1.913 -4.381 1.00 0.00 O ATOM 1646 CB ALA B 147 -24.917 -2.138 -1.765 1.00 0.00 C ATOM 0 H ALA B 147 -23.278 -3.505 -3.007 1.00 0.00 H new ATOM 0 HA ALA B 147 -26.072 -3.553 -2.840 1.00 0.00 H new ATOM 0 HB1 ALA B 147 -25.782 -1.567 -1.427 1.00 0.00 H new ATOM 0 HB2 ALA B 147 -24.644 -2.869 -1.003 1.00 0.00 H new ATOM 0 HB3 ALA B 147 -24.080 -1.461 -1.934 1.00 0.00 H new ATOM 1652 N ILE B 148 -24.929 -1.124 -4.814 1.00 0.00 N ATOM 1653 CA ILE B 148 -25.441 -0.221 -5.852 1.00 0.00 C ATOM 1654 C ILE B 148 -26.042 -1.008 -7.008 1.00 0.00 C ATOM 1655 O ILE B 148 -27.007 -0.545 -7.611 1.00 0.00 O ATOM 1656 CB ILE B 148 -24.397 0.801 -6.341 1.00 0.00 C ATOM 1657 CG1 ILE B 148 -25.061 1.886 -7.205 1.00 0.00 C ATOM 1658 CG2 ILE B 148 -23.179 0.153 -7.004 1.00 0.00 C ATOM 1659 CD1 ILE B 148 -24.227 3.170 -7.265 1.00 0.00 C ATOM 0 H ILE B 148 -23.921 -1.090 -4.662 1.00 0.00 H new ATOM 0 HA ILE B 148 -26.233 0.367 -5.388 1.00 0.00 H new ATOM 0 HB ILE B 148 -23.989 1.297 -5.460 1.00 0.00 H new ATOM 0 HG12 ILE B 148 -25.209 1.504 -8.215 1.00 0.00 H new ATOM 0 HG13 ILE B 148 -26.048 2.114 -6.803 1.00 0.00 H new ATOM 0 HG21 ILE B 148 -22.484 0.929 -7.325 1.00 0.00 H new ATOM 0 HG22 ILE B 148 -22.684 -0.506 -6.291 1.00 0.00 H new ATOM 0 HG23 ILE B 148 -23.501 -0.426 -7.869 1.00 0.00 H new ATOM 0 HD11 ILE B 148 -24.737 3.906 -7.886 1.00 0.00 H new ATOM 0 HD12 ILE B 148 -24.101 3.569 -6.259 1.00 0.00 H new ATOM 0 HD13 ILE B 148 -23.249 2.949 -7.693 1.00 0.00 H new ATOM 1671 N GLU B 149 -25.478 -2.172 -7.320 1.00 0.00 N ATOM 1672 CA GLU B 149 -25.965 -3.023 -8.393 1.00 0.00 C ATOM 1673 C GLU B 149 -27.270 -3.731 -7.994 1.00 0.00 C ATOM 1674 O GLU B 149 -27.944 -4.290 -8.861 1.00 0.00 O ATOM 1675 CB GLU B 149 -24.882 -4.020 -8.819 1.00 0.00 C ATOM 1676 CG GLU B 149 -23.817 -3.323 -9.680 1.00 0.00 C ATOM 1677 CD GLU B 149 -22.701 -4.279 -10.097 1.00 0.00 C ATOM 1678 OE1 GLU B 149 -23.001 -5.449 -10.422 1.00 0.00 O ATOM 1679 OE2 GLU B 149 -21.518 -3.872 -10.109 1.00 0.00 O ATOM 0 H GLU B 149 -24.667 -2.550 -6.831 1.00 0.00 H new ATOM 0 HA GLU B 149 -26.196 -2.395 -9.253 1.00 0.00 H new ATOM 0 HB2 GLU B 149 -24.415 -4.458 -7.937 1.00 0.00 H new ATOM 0 HB3 GLU B 149 -25.333 -4.838 -9.380 1.00 0.00 H new ATOM 0 HG2 GLU B 149 -24.287 -2.905 -10.570 1.00 0.00 H new ATOM 0 HG3 GLU B 149 -23.390 -2.489 -9.123 1.00 0.00 H new ATOM 1686 N ALA B 150 -27.622 -3.725 -6.705 1.00 0.00 N ATOM 1687 CA ALA B 150 -28.819 -4.326 -6.137 1.00 0.00 C ATOM 1688 C ALA B 150 -29.867 -3.260 -5.780 1.00 0.00 C ATOM 1689 O ALA B 150 -31.009 -3.623 -5.499 1.00 0.00 O ATOM 1690 CB ALA B 150 -28.433 -5.141 -4.888 1.00 0.00 C ATOM 0 H ALA B 150 -27.044 -3.274 -5.996 1.00 0.00 H new ATOM 0 HA ALA B 150 -29.266 -4.985 -6.882 1.00 0.00 H new ATOM 0 HB1 ALA B 150 -29.327 -5.594 -4.458 1.00 0.00 H new ATOM 0 HB2 ALA B 150 -27.728 -5.924 -5.168 1.00 0.00 H new ATOM 0 HB3 ALA B 150 -27.970 -4.483 -4.153 1.00 0.00 H new ATOM 1696 N LYS B 151 -29.522 -1.963 -5.809 1.00 0.00 N ATOM 1697 CA LYS B 151 -30.416 -0.872 -5.471 1.00 0.00 C ATOM 1698 C LYS B 151 -31.692 -0.831 -6.276 1.00 0.00 C ATOM 1699 O LYS B 151 -32.662 -0.377 -5.631 1.00 0.00 O ATOM 1700 CB LYS B 151 -29.710 0.488 -5.574 1.00 0.00 C ATOM 1701 CG LYS B 151 -28.936 0.868 -4.310 1.00 0.00 C ATOM 1702 CD LYS B 151 -29.801 1.472 -3.198 1.00 0.00 C ATOM 1703 CE LYS B 151 -30.750 0.503 -2.471 1.00 0.00 C ATOM 1704 NZ LYS B 151 -32.097 0.388 -3.093 1.00 0.00 N ATOM 0 H LYS B 151 -28.589 -1.649 -6.076 1.00 0.00 H new ATOM 0 HA LYS B 151 -30.702 -1.071 -4.438 1.00 0.00 H new ATOM 0 HB2 LYS B 151 -29.023 0.469 -6.420 1.00 0.00 H new ATOM 0 HB3 LYS B 151 -30.452 1.259 -5.783 1.00 0.00 H new ATOM 0 HG2 LYS B 151 -28.436 -0.020 -3.923 1.00 0.00 H new ATOM 0 HG3 LYS B 151 -28.157 1.582 -4.576 1.00 0.00 H new ATOM 0 HD2 LYS B 151 -29.141 1.924 -2.458 1.00 0.00 H new ATOM 0 HD3 LYS B 151 -30.397 2.277 -3.627 1.00 0.00 H new ATOM 0 HE2 LYS B 151 -30.290 -0.485 -2.442 1.00 0.00 H new ATOM 0 HE3 LYS B 151 -30.866 0.832 -1.438 1.00 0.00 H new ATOM 0 HZ1 LYS B 151 -32.577 -0.460 -2.728 1.00 0.00 H new ATOM 0 HZ2 LYS B 151 -32.660 1.231 -2.861 1.00 0.00 H new ATOM 0 HZ3 LYS B 151 -31.997 0.312 -4.125 1.00 0.00 H new