USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 968 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 93 HIS : no HD1:sc= -0.322 X(o=-0.4,f=-0.015) USER MOD Set 1.2: A 95 THR OG1 : rot 180:sc= -0.0749 USER MOD Set 2.1: A 14 SER OG : rot -90:sc= -0.723 USER MOD Set 2.2: A 27 ASN : amide:sc= -1.78! X(o=-5.1!,f=-4.8) USER MOD Set 2.3: A 76 THR OG1 : rot 180:sc= -2.61 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot -9:sc= 1.1 USER MOD Single : A 18 ASN : amide:sc= -0.606 K(o=-0.61,f=-13!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 MET CE :methyl -119:sc= -3.09! (180deg=-3.76!) USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 97:sc= -1.99! USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -106:sc= -1.08 (180deg=-2.53) USER MOD Single : A 51 THR OG1 : rot -17:sc= -0.308! USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS : no HD1:sc= -2.45 X(o=-2.5,f=-2.6!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0529) USER MOD Single : A 62 THR OG1 : rot 128:sc= 2.08 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.0036 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 THR OG1 : rot 180:sc= -0.541 USER MOD Single : A 86 GLN : amide:sc= -0.0227 X(o=-0.023,f=-0.012) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 SER OG : rot -100:sc= -1.18 USER MOD Single : A 116 SER OG : rot 68:sc= 0.975 USER MOD Single : A 121 SER OG : rot 48:sc= 0.824 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 MET CE :methyl 171:sc= -2.56 (180deg=-2.79) USER MOD Single : A 127 MET CE :methyl -131:sc= -4.72! (180deg=-7.11!) USER MOD Single : A 128 ASN : amide:sc= -0.463 K(o=-0.46,f=-1.6!) USER MOD Single : A 133 SER OG : rot 180:sc=-0.00222 USER MOD ----------------------------------------------------------------- ATOM 66 N LEU A 8 -14.161 -10.254 3.824 1.00 0.00 N ATOM 67 CA LEU A 8 -14.098 -8.803 3.788 1.00 0.00 C ATOM 68 C LEU A 8 -14.017 -8.336 2.334 1.00 0.00 C ATOM 69 O LEU A 8 -15.041 -8.086 1.700 1.00 0.00 O ATOM 70 CB LEU A 8 -12.949 -8.295 4.662 1.00 0.00 C ATOM 71 CG LEU A 8 -13.164 -8.390 6.174 1.00 0.00 C ATOM 72 CD1 LEU A 8 -14.569 -7.920 6.559 1.00 0.00 C ATOM 73 CD2 LEU A 8 -12.873 -9.803 6.682 1.00 0.00 C ATOM 0 HA LEU A 8 -15.005 -8.372 4.211 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -12.050 -8.855 4.407 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -12.758 -7.253 4.407 1.00 0.00 H new ATOM 0 HG LEU A 8 -12.456 -7.721 6.662 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -14.696 -7.998 7.639 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -14.703 -6.883 6.252 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -15.311 -8.544 6.061 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -13.034 -9.843 7.759 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -13.539 -10.511 6.190 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -11.838 -10.064 6.460 1.00 0.00 H new ATOM 85 N GLY A 9 -12.789 -8.233 1.846 1.00 0.00 N ATOM 86 CA GLY A 9 -12.561 -7.801 0.478 1.00 0.00 C ATOM 87 C GLY A 9 -11.136 -8.130 0.029 1.00 0.00 C ATOM 88 O GLY A 9 -10.393 -8.796 0.749 1.00 0.00 O ATOM 0 H GLY A 9 -11.942 -8.441 2.374 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -13.276 -8.288 -0.185 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.732 -6.727 0.399 1.00 0.00 H new ATOM 92 N THR A 10 -10.796 -7.647 -1.157 1.00 0.00 N ATOM 93 CA THR A 10 -9.473 -7.881 -1.710 1.00 0.00 C ATOM 94 C THR A 10 -8.717 -6.560 -1.862 1.00 0.00 C ATOM 95 O THR A 10 -9.326 -5.491 -1.880 1.00 0.00 O ATOM 96 CB THR A 10 -9.639 -8.641 -3.027 1.00 0.00 C ATOM 97 OG1 THR A 10 -10.176 -9.902 -2.636 1.00 0.00 O ATOM 98 CG2 THR A 10 -8.297 -8.992 -3.673 1.00 0.00 C ATOM 0 H THR A 10 -11.414 -7.094 -1.751 1.00 0.00 H new ATOM 0 HA THR A 10 -8.867 -8.491 -1.040 1.00 0.00 H new ATOM 0 HB THR A 10 -10.230 -8.042 -3.719 1.00 0.00 H new ATOM 0 HG1 THR A 10 -10.317 -10.458 -3.431 1.00 0.00 H new ATOM 0 HG21 THR A 10 -8.471 -9.530 -4.605 1.00 0.00 H new ATOM 0 HG22 THR A 10 -7.743 -8.077 -3.881 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.719 -9.619 -2.994 1.00 0.00 H new ATOM 106 N LEU A 11 -7.402 -6.676 -1.967 1.00 0.00 N ATOM 107 CA LEU A 11 -6.556 -5.504 -2.116 1.00 0.00 C ATOM 108 C LEU A 11 -5.730 -5.637 -3.397 1.00 0.00 C ATOM 109 O LEU A 11 -5.191 -6.705 -3.684 1.00 0.00 O ATOM 110 CB LEU A 11 -5.711 -5.289 -0.859 1.00 0.00 C ATOM 111 CG LEU A 11 -4.434 -4.467 -1.042 1.00 0.00 C ATOM 112 CD1 LEU A 11 -4.744 -3.103 -1.662 1.00 0.00 C ATOM 113 CD2 LEU A 11 -3.673 -4.336 0.279 1.00 0.00 C ATOM 0 H LEU A 11 -6.901 -7.564 -1.952 1.00 0.00 H new ATOM 0 HA LEU A 11 -7.165 -4.606 -2.220 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -6.331 -4.799 -0.108 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.437 -6.265 -0.458 1.00 0.00 H new ATOM 0 HG LEU A 11 -3.783 -4.997 -1.738 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -3.819 -2.539 -1.781 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -5.211 -3.244 -2.637 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -5.423 -2.553 -1.010 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -2.769 -3.747 0.121 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -4.305 -3.840 1.016 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -3.402 -5.327 0.642 1.00 0.00 H new ATOM 125 N PHE A 12 -5.655 -4.537 -4.132 1.00 0.00 N ATOM 126 CA PHE A 12 -4.903 -4.517 -5.375 1.00 0.00 C ATOM 127 C PHE A 12 -3.781 -3.479 -5.320 1.00 0.00 C ATOM 128 O PHE A 12 -3.982 -2.367 -4.835 1.00 0.00 O ATOM 129 CB PHE A 12 -5.884 -4.132 -6.485 1.00 0.00 C ATOM 130 CG PHE A 12 -7.135 -5.011 -6.542 1.00 0.00 C ATOM 131 CD1 PHE A 12 -7.034 -6.353 -6.342 1.00 0.00 C ATOM 132 CD2 PHE A 12 -8.349 -4.451 -6.792 1.00 0.00 C ATOM 133 CE1 PHE A 12 -8.195 -7.168 -6.395 1.00 0.00 C ATOM 134 CE2 PHE A 12 -9.510 -5.267 -6.846 1.00 0.00 C ATOM 135 CZ PHE A 12 -9.408 -6.608 -6.646 1.00 0.00 C ATOM 0 H PHE A 12 -6.103 -3.653 -3.890 1.00 0.00 H new ATOM 0 HA PHE A 12 -4.451 -5.493 -5.552 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -6.187 -3.095 -6.344 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -5.370 -4.186 -7.445 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -6.070 -6.798 -6.143 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -8.430 -3.386 -6.949 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -8.115 -8.233 -6.236 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -10.474 -4.822 -7.046 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.291 -7.229 -6.687 1.00 0.00 H new ATOM 145 N PHE A 13 -2.623 -3.880 -5.825 1.00 0.00 N ATOM 146 CA PHE A 13 -1.468 -2.998 -5.840 1.00 0.00 C ATOM 147 C PHE A 13 -0.345 -3.580 -6.702 1.00 0.00 C ATOM 148 O PHE A 13 -0.400 -4.743 -7.097 1.00 0.00 O ATOM 149 CB PHE A 13 -0.977 -2.880 -4.396 1.00 0.00 C ATOM 150 CG PHE A 13 -0.472 -4.195 -3.800 1.00 0.00 C ATOM 151 CD1 PHE A 13 -1.359 -5.146 -3.402 1.00 0.00 C ATOM 152 CD2 PHE A 13 0.864 -4.414 -3.669 1.00 0.00 C ATOM 153 CE1 PHE A 13 -0.890 -6.368 -2.849 1.00 0.00 C ATOM 154 CE2 PHE A 13 1.333 -5.635 -3.117 1.00 0.00 C ATOM 155 CZ PHE A 13 0.446 -6.586 -2.719 1.00 0.00 C ATOM 0 H PHE A 13 -2.460 -4.803 -6.227 1.00 0.00 H new ATOM 0 HA PHE A 13 -1.745 -2.029 -6.256 1.00 0.00 H new ATOM 0 HB2 PHE A 13 -0.175 -2.143 -4.355 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -1.790 -2.501 -3.777 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -2.420 -4.972 -3.506 1.00 0.00 H new ATOM 0 HD2 PHE A 13 1.568 -3.659 -3.985 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -1.594 -7.123 -2.532 1.00 0.00 H new ATOM 0 HE2 PHE A 13 2.394 -5.809 -3.013 1.00 0.00 H new ATOM 0 HZ PHE A 13 0.803 -7.515 -2.299 1.00 0.00 H new ATOM 165 N SER A 14 0.647 -2.743 -6.967 1.00 0.00 N ATOM 166 CA SER A 14 1.781 -3.160 -7.775 1.00 0.00 C ATOM 167 C SER A 14 3.088 -2.738 -7.099 1.00 0.00 C ATOM 168 O SER A 14 3.089 -1.863 -6.235 1.00 0.00 O ATOM 169 CB SER A 14 1.699 -2.572 -9.185 1.00 0.00 C ATOM 170 OG SER A 14 1.895 -1.160 -9.187 1.00 0.00 O ATOM 0 H SER A 14 0.689 -1.779 -6.637 1.00 0.00 H new ATOM 0 HA SER A 14 1.758 -4.246 -7.862 1.00 0.00 H new ATOM 0 HB2 SER A 14 2.450 -3.043 -9.819 1.00 0.00 H new ATOM 0 HB3 SER A 14 0.726 -2.804 -9.618 1.00 0.00 H new ATOM 0 HG SER A 14 1.031 -0.710 -9.080 1.00 0.00 H new ATOM 176 N LEU A 15 4.168 -3.380 -7.519 1.00 0.00 N ATOM 177 CA LEU A 15 5.478 -3.083 -6.965 1.00 0.00 C ATOM 178 C LEU A 15 6.448 -2.766 -8.105 1.00 0.00 C ATOM 179 O LEU A 15 6.466 -3.459 -9.121 1.00 0.00 O ATOM 180 CB LEU A 15 5.947 -4.221 -6.057 1.00 0.00 C ATOM 181 CG LEU A 15 5.079 -4.498 -4.827 1.00 0.00 C ATOM 182 CD1 LEU A 15 5.131 -5.978 -4.442 1.00 0.00 C ATOM 183 CD2 LEU A 15 5.473 -3.588 -3.662 1.00 0.00 C ATOM 0 H LEU A 15 4.163 -4.105 -8.237 1.00 0.00 H new ATOM 0 HA LEU A 15 5.431 -2.199 -6.329 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.003 -5.133 -6.651 1.00 0.00 H new ATOM 0 HB3 LEU A 15 6.959 -3.997 -5.720 1.00 0.00 H new ATOM 0 HG LEU A 15 4.044 -4.267 -5.080 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.506 -6.148 -3.565 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.765 -6.583 -5.272 1.00 0.00 H new ATOM 0 HD13 LEU A 15 6.159 -6.259 -4.214 1.00 0.00 H new ATOM 0 HD21 LEU A 15 4.841 -3.805 -2.801 1.00 0.00 H new ATOM 0 HD22 LEU A 15 6.516 -3.764 -3.400 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.343 -2.546 -3.954 1.00 0.00 H new ATOM 195 N GLU A 16 7.233 -1.719 -7.898 1.00 0.00 N ATOM 196 CA GLU A 16 8.204 -1.302 -8.895 1.00 0.00 C ATOM 197 C GLU A 16 9.353 -0.540 -8.231 1.00 0.00 C ATOM 198 O GLU A 16 9.124 0.425 -7.504 1.00 0.00 O ATOM 199 CB GLU A 16 7.542 -0.456 -9.985 1.00 0.00 C ATOM 200 CG GLU A 16 8.589 0.306 -10.799 1.00 0.00 C ATOM 201 CD GLU A 16 8.309 0.189 -12.299 1.00 0.00 C ATOM 202 OE1 GLU A 16 8.736 -0.834 -12.878 1.00 0.00 O ATOM 203 OE2 GLU A 16 7.675 1.124 -12.832 1.00 0.00 O ATOM 0 H GLU A 16 7.216 -1.147 -7.054 1.00 0.00 H new ATOM 0 HA GLU A 16 8.613 -2.193 -9.371 1.00 0.00 H new ATOM 0 HB2 GLU A 16 6.960 -1.098 -10.645 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.846 0.249 -9.531 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.589 1.356 -10.506 1.00 0.00 H new ATOM 0 HG3 GLU A 16 9.582 -0.086 -10.579 1.00 0.00 H new ATOM 210 N TYR A 17 10.564 -1.003 -8.506 1.00 0.00 N ATOM 211 CA TYR A 17 11.749 -0.378 -7.945 1.00 0.00 C ATOM 212 C TYR A 17 12.430 0.528 -8.973 1.00 0.00 C ATOM 213 O TYR A 17 12.729 0.095 -10.085 1.00 0.00 O ATOM 214 CB TYR A 17 12.698 -1.522 -7.582 1.00 0.00 C ATOM 215 CG TYR A 17 13.947 -1.076 -6.819 1.00 0.00 C ATOM 216 CD1 TYR A 17 13.876 -0.832 -5.462 1.00 0.00 C ATOM 217 CD2 TYR A 17 15.144 -0.917 -7.487 1.00 0.00 C ATOM 218 CE1 TYR A 17 15.052 -0.413 -4.744 1.00 0.00 C ATOM 219 CE2 TYR A 17 16.319 -0.498 -6.769 1.00 0.00 C ATOM 220 CZ TYR A 17 16.215 -0.266 -5.433 1.00 0.00 C ATOM 221 OH TYR A 17 17.326 0.130 -4.755 1.00 0.00 O ATOM 0 H TYR A 17 10.749 -1.804 -9.110 1.00 0.00 H new ATOM 0 HA TYR A 17 11.487 0.237 -7.084 1.00 0.00 H new ATOM 0 HB2 TYR A 17 12.157 -2.251 -6.979 1.00 0.00 H new ATOM 0 HB3 TYR A 17 13.005 -2.030 -8.496 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.939 -0.955 -4.939 1.00 0.00 H new ATOM 0 HD2 TYR A 17 15.199 -1.107 -8.549 1.00 0.00 H new ATOM 0 HE1 TYR A 17 15.011 -0.220 -3.682 1.00 0.00 H new ATOM 0 HE2 TYR A 17 17.262 -0.371 -7.280 1.00 0.00 H new ATOM 0 HH TYR A 17 17.077 0.396 -3.846 1.00 0.00 H new ATOM 231 N ASN A 18 12.656 1.768 -8.565 1.00 0.00 N ATOM 232 CA ASN A 18 13.297 2.738 -9.437 1.00 0.00 C ATOM 233 C ASN A 18 14.774 2.374 -9.599 1.00 0.00 C ATOM 234 O ASN A 18 15.604 2.750 -8.773 1.00 0.00 O ATOM 235 CB ASN A 18 13.219 4.146 -8.844 1.00 0.00 C ATOM 236 CG ASN A 18 13.736 5.188 -9.838 1.00 0.00 C ATOM 237 OD1 ASN A 18 14.652 4.950 -10.607 1.00 0.00 O ATOM 238 ND2 ASN A 18 13.098 6.354 -9.780 1.00 0.00 N ATOM 0 H ASN A 18 12.407 2.124 -7.642 1.00 0.00 H new ATOM 0 HA ASN A 18 12.781 2.722 -10.397 1.00 0.00 H new ATOM 0 HB2 ASN A 18 12.188 4.375 -8.575 1.00 0.00 H new ATOM 0 HB3 ASN A 18 13.805 4.191 -7.926 1.00 0.00 H new ATOM 0 HD21 ASN A 18 13.368 7.115 -10.404 1.00 0.00 H new ATOM 0 HD22 ASN A 18 12.339 6.487 -9.112 1.00 0.00 H new ATOM 245 N PHE A 19 15.056 1.646 -10.670 1.00 0.00 N ATOM 246 CA PHE A 19 16.419 1.227 -10.951 1.00 0.00 C ATOM 247 C PHE A 19 17.293 2.423 -11.332 1.00 0.00 C ATOM 248 O PHE A 19 18.471 2.472 -10.982 1.00 0.00 O ATOM 249 CB PHE A 19 16.354 0.261 -12.136 1.00 0.00 C ATOM 250 CG PHE A 19 16.484 -1.213 -11.745 1.00 0.00 C ATOM 251 CD1 PHE A 19 15.577 -1.776 -10.902 1.00 0.00 C ATOM 252 CD2 PHE A 19 17.507 -1.960 -12.241 1.00 0.00 C ATOM 253 CE1 PHE A 19 15.698 -3.143 -10.540 1.00 0.00 C ATOM 254 CE2 PHE A 19 17.628 -3.328 -11.879 1.00 0.00 C ATOM 255 CZ PHE A 19 16.721 -3.890 -11.035 1.00 0.00 C ATOM 0 H PHE A 19 14.365 1.336 -11.353 1.00 0.00 H new ATOM 0 HA PHE A 19 16.854 0.760 -10.068 1.00 0.00 H new ATOM 0 HB2 PHE A 19 15.408 0.406 -12.658 1.00 0.00 H new ATOM 0 HB3 PHE A 19 17.148 0.511 -12.840 1.00 0.00 H new ATOM 0 HD1 PHE A 19 14.765 -1.183 -10.508 1.00 0.00 H new ATOM 0 HD2 PHE A 19 18.227 -1.513 -12.910 1.00 0.00 H new ATOM 0 HE1 PHE A 19 14.977 -3.590 -9.871 1.00 0.00 H new ATOM 0 HE2 PHE A 19 18.439 -3.922 -12.273 1.00 0.00 H new ATOM 0 HZ PHE A 19 16.813 -4.930 -10.758 1.00 0.00 H new ATOM 265 N GLU A 20 16.682 3.360 -12.043 1.00 0.00 N ATOM 266 CA GLU A 20 17.390 4.553 -12.474 1.00 0.00 C ATOM 267 C GLU A 20 17.966 5.295 -11.266 1.00 0.00 C ATOM 268 O GLU A 20 19.142 5.654 -11.256 1.00 0.00 O ATOM 269 CB GLU A 20 16.477 5.466 -13.294 1.00 0.00 C ATOM 270 CG GLU A 20 17.249 6.671 -13.836 1.00 0.00 C ATOM 271 CD GLU A 20 17.076 6.797 -15.351 1.00 0.00 C ATOM 272 OE1 GLU A 20 15.974 7.220 -15.763 1.00 0.00 O ATOM 273 OE2 GLU A 20 18.049 6.467 -16.063 1.00 0.00 O ATOM 0 H GLU A 20 15.704 3.317 -12.331 1.00 0.00 H new ATOM 0 HA GLU A 20 18.217 4.249 -13.116 1.00 0.00 H new ATOM 0 HB2 GLU A 20 16.044 4.905 -14.122 1.00 0.00 H new ATOM 0 HB3 GLU A 20 15.649 5.809 -12.674 1.00 0.00 H new ATOM 0 HG2 GLU A 20 16.898 7.581 -13.349 1.00 0.00 H new ATOM 0 HG3 GLU A 20 18.307 6.568 -13.595 1.00 0.00 H new ATOM 280 N ARG A 21 17.109 5.502 -10.276 1.00 0.00 N ATOM 281 CA ARG A 21 17.518 6.195 -9.066 1.00 0.00 C ATOM 282 C ARG A 21 17.573 5.219 -7.889 1.00 0.00 C ATOM 283 O ARG A 21 17.504 5.631 -6.732 1.00 0.00 O ATOM 284 CB ARG A 21 16.552 7.333 -8.731 1.00 0.00 C ATOM 285 CG ARG A 21 16.213 8.150 -9.979 1.00 0.00 C ATOM 286 CD ARG A 21 14.925 8.952 -9.776 1.00 0.00 C ATOM 287 NE ARG A 21 15.250 10.365 -9.481 1.00 0.00 N ATOM 288 CZ ARG A 21 14.382 11.377 -9.607 1.00 0.00 C ATOM 289 NH1 ARG A 21 13.131 11.139 -10.023 1.00 0.00 N ATOM 290 NH2 ARG A 21 14.765 12.628 -9.316 1.00 0.00 N ATOM 0 H ARG A 21 16.134 5.202 -10.287 1.00 0.00 H new ATOM 0 HA ARG A 21 18.509 6.614 -9.242 1.00 0.00 H new ATOM 0 HB2 ARG A 21 15.638 6.924 -8.300 1.00 0.00 H new ATOM 0 HB3 ARG A 21 16.997 7.982 -7.977 1.00 0.00 H new ATOM 0 HG2 ARG A 21 17.035 8.828 -10.209 1.00 0.00 H new ATOM 0 HG3 ARG A 21 16.100 7.484 -10.834 1.00 0.00 H new ATOM 0 HD2 ARG A 21 14.305 8.892 -10.670 1.00 0.00 H new ATOM 0 HD3 ARG A 21 14.346 8.525 -8.957 1.00 0.00 H new ATOM 0 HE ARG A 21 16.194 10.582 -9.162 1.00 0.00 H new ATOM 0 HH11 ARG A 21 12.839 10.187 -10.244 1.00 0.00 H new ATOM 0 HH12 ARG A 21 12.470 11.910 -10.119 1.00 0.00 H new ATOM 0 HH21 ARG A 21 15.717 12.809 -8.999 1.00 0.00 H new ATOM 0 HH22 ARG A 21 14.104 13.399 -9.412 1.00 0.00 H new ATOM 304 N LYS A 22 17.697 3.943 -8.225 1.00 0.00 N ATOM 305 CA LYS A 22 17.763 2.905 -7.210 1.00 0.00 C ATOM 306 C LYS A 22 16.826 3.267 -6.056 1.00 0.00 C ATOM 307 O LYS A 22 17.281 3.591 -4.960 1.00 0.00 O ATOM 308 CB LYS A 22 19.211 2.671 -6.776 1.00 0.00 C ATOM 309 CG LYS A 22 19.822 1.483 -7.523 1.00 0.00 C ATOM 310 CD LYS A 22 20.839 1.955 -8.564 1.00 0.00 C ATOM 311 CE LYS A 22 21.510 0.765 -9.253 1.00 0.00 C ATOM 312 NZ LYS A 22 22.971 0.981 -9.355 1.00 0.00 N ATOM 0 H LYS A 22 17.753 3.605 -9.186 1.00 0.00 H new ATOM 0 HA LYS A 22 17.419 1.953 -7.615 1.00 0.00 H new ATOM 0 HB2 LYS A 22 19.801 3.567 -6.967 1.00 0.00 H new ATOM 0 HB3 LYS A 22 19.248 2.488 -5.702 1.00 0.00 H new ATOM 0 HG2 LYS A 22 20.307 0.813 -6.813 1.00 0.00 H new ATOM 0 HG3 LYS A 22 19.033 0.912 -8.013 1.00 0.00 H new ATOM 0 HD2 LYS A 22 20.341 2.577 -9.308 1.00 0.00 H new ATOM 0 HD3 LYS A 22 21.595 2.576 -8.084 1.00 0.00 H new ATOM 0 HE2 LYS A 22 21.310 -0.148 -8.692 1.00 0.00 H new ATOM 0 HE3 LYS A 22 21.087 0.627 -10.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 23.411 0.164 -9.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 23.157 1.841 -9.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 23.373 1.090 -8.402 1.00 0.00 H new ATOM 326 N ALA A 23 15.534 3.199 -6.341 1.00 0.00 N ATOM 327 CA ALA A 23 14.529 3.515 -5.341 1.00 0.00 C ATOM 328 C ALA A 23 13.414 2.468 -5.395 1.00 0.00 C ATOM 329 O ALA A 23 13.451 1.559 -6.223 1.00 0.00 O ATOM 330 CB ALA A 23 14.007 4.934 -5.572 1.00 0.00 C ATOM 0 H ALA A 23 15.160 2.929 -7.251 1.00 0.00 H new ATOM 0 HA ALA A 23 14.961 3.485 -4.341 1.00 0.00 H new ATOM 0 HB1 ALA A 23 13.253 5.171 -4.822 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.832 5.642 -5.494 1.00 0.00 H new ATOM 0 HB3 ALA A 23 13.564 5.001 -6.566 1.00 0.00 H new ATOM 336 N PHE A 24 12.449 2.631 -4.502 1.00 0.00 N ATOM 337 CA PHE A 24 11.326 1.711 -4.438 1.00 0.00 C ATOM 338 C PHE A 24 10.000 2.450 -4.633 1.00 0.00 C ATOM 339 O PHE A 24 9.786 3.511 -4.050 1.00 0.00 O ATOM 340 CB PHE A 24 11.344 1.079 -3.044 1.00 0.00 C ATOM 341 CG PHE A 24 10.298 -0.020 -2.846 1.00 0.00 C ATOM 342 CD1 PHE A 24 9.807 -0.693 -3.920 1.00 0.00 C ATOM 343 CD2 PHE A 24 9.861 -0.324 -1.594 1.00 0.00 C ATOM 344 CE1 PHE A 24 8.836 -1.713 -3.736 1.00 0.00 C ATOM 345 CE2 PHE A 24 8.890 -1.344 -1.410 1.00 0.00 C ATOM 346 CZ PHE A 24 8.399 -2.017 -2.485 1.00 0.00 C ATOM 0 H PHE A 24 12.421 3.386 -3.817 1.00 0.00 H new ATOM 0 HA PHE A 24 11.413 0.962 -5.225 1.00 0.00 H new ATOM 0 HB2 PHE A 24 12.334 0.662 -2.858 1.00 0.00 H new ATOM 0 HB3 PHE A 24 11.182 1.859 -2.300 1.00 0.00 H new ATOM 0 HD1 PHE A 24 10.155 -0.452 -4.913 1.00 0.00 H new ATOM 0 HD2 PHE A 24 10.252 0.210 -0.741 1.00 0.00 H new ATOM 0 HE1 PHE A 24 8.445 -2.247 -4.589 1.00 0.00 H new ATOM 0 HE2 PHE A 24 8.542 -1.585 -0.417 1.00 0.00 H new ATOM 0 HZ PHE A 24 7.661 -2.793 -2.345 1.00 0.00 H new ATOM 356 N VAL A 25 9.146 1.859 -5.455 1.00 0.00 N ATOM 357 CA VAL A 25 7.847 2.448 -5.734 1.00 0.00 C ATOM 358 C VAL A 25 6.750 1.438 -5.390 1.00 0.00 C ATOM 359 O VAL A 25 6.609 0.416 -6.060 1.00 0.00 O ATOM 360 CB VAL A 25 7.789 2.922 -7.187 1.00 0.00 C ATOM 361 CG1 VAL A 25 6.594 3.850 -7.414 1.00 0.00 C ATOM 362 CG2 VAL A 25 9.097 3.602 -7.595 1.00 0.00 C ATOM 0 H VAL A 25 9.328 0.979 -5.937 1.00 0.00 H new ATOM 0 HA VAL A 25 7.685 3.329 -5.112 1.00 0.00 H new ATOM 0 HB VAL A 25 7.656 2.045 -7.820 1.00 0.00 H new ATOM 0 HG11 VAL A 25 6.576 4.172 -8.455 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.671 3.318 -7.183 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.682 4.722 -6.766 1.00 0.00 H new ATOM 0 HG21 VAL A 25 9.029 3.929 -8.632 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.274 4.465 -6.953 1.00 0.00 H new ATOM 0 HG23 VAL A 25 9.922 2.897 -7.491 1.00 0.00 H new ATOM 372 N VAL A 26 6.000 1.760 -4.345 1.00 0.00 N ATOM 373 CA VAL A 26 4.920 0.894 -3.904 1.00 0.00 C ATOM 374 C VAL A 26 3.579 1.537 -4.262 1.00 0.00 C ATOM 375 O VAL A 26 3.050 2.345 -3.499 1.00 0.00 O ATOM 376 CB VAL A 26 5.062 0.600 -2.410 1.00 0.00 C ATOM 377 CG1 VAL A 26 3.799 -0.065 -1.859 1.00 0.00 C ATOM 378 CG2 VAL A 26 6.298 -0.259 -2.135 1.00 0.00 C ATOM 0 H VAL A 26 6.119 2.608 -3.792 1.00 0.00 H new ATOM 0 HA VAL A 26 4.967 -0.067 -4.416 1.00 0.00 H new ATOM 0 HB VAL A 26 5.193 1.551 -1.893 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.927 -0.263 -0.795 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.946 0.597 -2.005 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.623 -1.004 -2.384 1.00 0.00 H new ATOM 0 HG21 VAL A 26 6.375 -0.453 -1.065 1.00 0.00 H new ATOM 0 HG22 VAL A 26 6.210 -1.205 -2.670 1.00 0.00 H new ATOM 0 HG23 VAL A 26 7.190 0.268 -2.473 1.00 0.00 H new ATOM 388 N ASN A 27 3.066 1.155 -5.422 1.00 0.00 N ATOM 389 CA ASN A 27 1.796 1.684 -5.891 1.00 0.00 C ATOM 390 C ASN A 27 0.652 0.926 -5.214 1.00 0.00 C ATOM 391 O ASN A 27 0.619 -0.303 -5.237 1.00 0.00 O ATOM 392 CB ASN A 27 1.651 1.509 -7.403 1.00 0.00 C ATOM 393 CG ASN A 27 0.192 1.667 -7.836 1.00 0.00 C ATOM 394 OD1 ASN A 27 -0.298 0.985 -8.721 1.00 0.00 O ATOM 395 ND2 ASN A 27 -0.473 2.604 -7.164 1.00 0.00 N ATOM 0 H ASN A 27 3.507 0.485 -6.052 1.00 0.00 H new ATOM 0 HA ASN A 27 1.762 2.746 -5.647 1.00 0.00 H new ATOM 0 HB2 ASN A 27 2.269 2.244 -7.919 1.00 0.00 H new ATOM 0 HB3 ASN A 27 2.016 0.525 -7.695 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -1.453 2.787 -7.379 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -0.002 3.139 -6.434 1.00 0.00 H new ATOM 402 N ILE A 28 -0.257 1.691 -4.629 1.00 0.00 N ATOM 403 CA ILE A 28 -1.400 1.106 -3.948 1.00 0.00 C ATOM 404 C ILE A 28 -2.668 1.387 -4.756 1.00 0.00 C ATOM 405 O ILE A 28 -3.208 2.491 -4.706 1.00 0.00 O ATOM 406 CB ILE A 28 -1.471 1.599 -2.501 1.00 0.00 C ATOM 407 CG1 ILE A 28 -0.277 1.092 -1.690 1.00 0.00 C ATOM 408 CG2 ILE A 28 -2.805 1.219 -1.856 1.00 0.00 C ATOM 409 CD1 ILE A 28 0.050 2.046 -0.539 1.00 0.00 C ATOM 0 H ILE A 28 -0.226 2.710 -4.612 1.00 0.00 H new ATOM 0 HA ILE A 28 -1.294 0.023 -3.887 1.00 0.00 H new ATOM 0 HB ILE A 28 -1.416 2.688 -2.509 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -0.497 0.101 -1.294 1.00 0.00 H new ATOM 0 HG13 ILE A 28 0.592 0.990 -2.340 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.829 1.581 -0.828 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -3.623 1.670 -2.419 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.916 0.135 -1.861 1.00 0.00 H new ATOM 0 HD11 ILE A 28 0.902 1.662 0.021 1.00 0.00 H new ATOM 0 HD12 ILE A 28 0.293 3.030 -0.940 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -0.812 2.127 0.123 1.00 0.00 H new ATOM 421 N LYS A 29 -3.107 0.369 -5.481 1.00 0.00 N ATOM 422 CA LYS A 29 -4.302 0.492 -6.298 1.00 0.00 C ATOM 423 C LYS A 29 -5.503 0.791 -5.397 1.00 0.00 C ATOM 424 O LYS A 29 -5.415 1.623 -4.496 1.00 0.00 O ATOM 425 CB LYS A 29 -4.484 -0.750 -7.173 1.00 0.00 C ATOM 426 CG LYS A 29 -5.301 -0.424 -8.425 1.00 0.00 C ATOM 427 CD LYS A 29 -4.391 0.012 -9.575 1.00 0.00 C ATOM 428 CE LYS A 29 -4.233 -1.109 -10.604 1.00 0.00 C ATOM 429 NZ LYS A 29 -5.196 -0.933 -11.715 1.00 0.00 N ATOM 0 H LYS A 29 -2.656 -0.545 -5.520 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.205 1.329 -6.989 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.509 -1.141 -7.463 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -4.984 -1.532 -6.601 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -5.878 -1.299 -8.725 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -6.015 0.368 -8.201 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -4.807 0.897 -10.057 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -3.413 0.292 -9.184 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -3.215 -1.112 -10.994 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -4.393 -2.075 -10.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -5.075 -1.702 -12.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -6.166 -0.953 -11.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -5.024 -0.020 -12.182 1.00 0.00 H new ATOM 443 N GLU A 30 -6.596 0.095 -5.673 1.00 0.00 N ATOM 444 CA GLU A 30 -7.813 0.275 -4.899 1.00 0.00 C ATOM 445 C GLU A 30 -8.124 -0.991 -4.098 1.00 0.00 C ATOM 446 O GLU A 30 -7.411 -1.988 -4.203 1.00 0.00 O ATOM 447 CB GLU A 30 -8.987 0.655 -5.803 1.00 0.00 C ATOM 448 CG GLU A 30 -9.356 -0.500 -6.736 1.00 0.00 C ATOM 449 CD GLU A 30 -10.846 -0.835 -6.630 1.00 0.00 C ATOM 450 OE1 GLU A 30 -11.337 -0.879 -5.481 1.00 0.00 O ATOM 451 OE2 GLU A 30 -11.459 -1.040 -7.699 1.00 0.00 O ATOM 0 H GLU A 30 -6.665 -0.594 -6.422 1.00 0.00 H new ATOM 0 HA GLU A 30 -7.657 1.096 -4.199 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -9.849 0.924 -5.192 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -8.727 1.535 -6.392 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -9.111 -0.234 -7.764 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -8.763 -1.379 -6.485 1.00 0.00 H new ATOM 458 N ALA A 31 -9.191 -0.911 -3.316 1.00 0.00 N ATOM 459 CA ALA A 31 -9.606 -2.038 -2.498 1.00 0.00 C ATOM 460 C ALA A 31 -11.088 -2.325 -2.748 1.00 0.00 C ATOM 461 O ALA A 31 -11.923 -1.427 -2.653 1.00 0.00 O ATOM 462 CB ALA A 31 -9.310 -1.737 -1.028 1.00 0.00 C ATOM 0 H ALA A 31 -9.781 -0.083 -3.232 1.00 0.00 H new ATOM 0 HA ALA A 31 -9.047 -2.934 -2.766 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -9.621 -2.582 -0.414 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -8.241 -1.569 -0.899 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -9.857 -0.845 -0.722 1.00 0.00 H new ATOM 468 N ARG A 32 -11.369 -3.581 -3.062 1.00 0.00 N ATOM 469 CA ARG A 32 -12.736 -3.998 -3.325 1.00 0.00 C ATOM 470 C ARG A 32 -13.173 -5.057 -2.311 1.00 0.00 C ATOM 471 O ARG A 32 -12.465 -6.038 -2.088 1.00 0.00 O ATOM 472 CB ARG A 32 -12.875 -4.568 -4.739 1.00 0.00 C ATOM 473 CG ARG A 32 -13.321 -3.486 -5.724 1.00 0.00 C ATOM 474 CD ARG A 32 -14.512 -3.962 -6.558 1.00 0.00 C ATOM 475 NE ARG A 32 -14.662 -3.111 -7.759 1.00 0.00 N ATOM 476 CZ ARG A 32 -15.296 -3.492 -8.876 1.00 0.00 C ATOM 477 NH1 ARG A 32 -15.844 -4.712 -8.952 1.00 0.00 N ATOM 478 NH2 ARG A 32 -15.383 -2.653 -9.917 1.00 0.00 N ATOM 0 H ARG A 32 -10.674 -4.323 -3.140 1.00 0.00 H new ATOM 0 HA ARG A 32 -13.374 -3.119 -3.235 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -11.922 -4.988 -5.061 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -13.598 -5.384 -4.737 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -13.592 -2.582 -5.179 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -12.493 -3.225 -6.382 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -14.367 -5.001 -6.854 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -15.423 -3.925 -5.960 1.00 0.00 H new ATOM 0 HE ARG A 32 -14.257 -2.175 -7.735 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -15.779 -5.351 -8.159 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -16.327 -5.002 -9.802 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -14.966 -1.724 -9.859 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -15.866 -2.944 -10.767 1.00 0.00 H new ATOM 492 N GLY A 33 -14.337 -4.822 -1.723 1.00 0.00 N ATOM 493 CA GLY A 33 -14.877 -5.744 -0.738 1.00 0.00 C ATOM 494 C GLY A 33 -14.777 -5.158 0.672 1.00 0.00 C ATOM 495 O GLY A 33 -14.322 -5.831 1.597 1.00 0.00 O ATOM 0 H GLY A 33 -14.921 -4.007 -1.910 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -15.919 -5.963 -0.972 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -14.335 -6.689 -0.783 1.00 0.00 H new ATOM 499 N LEU A 34 -15.210 -3.912 0.793 1.00 0.00 N ATOM 500 CA LEU A 34 -15.175 -3.229 2.075 1.00 0.00 C ATOM 501 C LEU A 34 -16.600 -3.098 2.618 1.00 0.00 C ATOM 502 O LEU A 34 -17.425 -2.391 2.041 1.00 0.00 O ATOM 503 CB LEU A 34 -14.439 -1.893 1.951 1.00 0.00 C ATOM 504 CG LEU A 34 -13.216 -1.884 1.032 1.00 0.00 C ATOM 505 CD1 LEU A 34 -12.253 -0.758 1.412 1.00 0.00 C ATOM 506 CD2 LEU A 34 -12.526 -3.250 1.025 1.00 0.00 C ATOM 0 H LEU A 34 -15.587 -3.357 0.024 1.00 0.00 H new ATOM 0 HA LEU A 34 -14.609 -3.812 2.801 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -15.145 -1.144 1.591 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -14.123 -1.581 2.946 1.00 0.00 H new ATOM 0 HG LEU A 34 -13.555 -1.688 0.015 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -11.392 -0.774 0.743 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -12.763 0.202 1.325 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -11.917 -0.898 2.439 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -11.660 -3.217 0.364 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -12.202 -3.499 2.035 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -13.224 -4.008 0.670 1.00 0.00 H new ATOM 518 N PRO A 35 -16.851 -3.809 3.749 1.00 0.00 N ATOM 519 CA PRO A 35 -18.162 -3.779 4.376 1.00 0.00 C ATOM 520 C PRO A 35 -18.387 -2.458 5.114 1.00 0.00 C ATOM 521 O PRO A 35 -17.544 -2.031 5.902 1.00 0.00 O ATOM 522 CB PRO A 35 -18.184 -4.986 5.299 1.00 0.00 C ATOM 523 CG PRO A 35 -16.731 -5.379 5.506 1.00 0.00 C ATOM 524 CD PRO A 35 -15.899 -4.656 4.460 1.00 0.00 C ATOM 0 HA PRO A 35 -18.976 -3.832 3.653 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -18.662 -4.743 6.248 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -18.751 -5.805 4.857 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -16.402 -5.109 6.509 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -16.610 -6.458 5.411 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -15.110 -4.063 4.922 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -15.414 -5.360 3.784 1.00 0.00 H new ATOM 532 N ALA A 36 -19.528 -1.846 4.833 1.00 0.00 N ATOM 533 CA ALA A 36 -19.874 -0.582 5.461 1.00 0.00 C ATOM 534 C ALA A 36 -19.629 -0.682 6.968 1.00 0.00 C ATOM 535 O ALA A 36 -19.588 -1.779 7.523 1.00 0.00 O ATOM 536 CB ALA A 36 -21.325 -0.228 5.129 1.00 0.00 C ATOM 0 H ALA A 36 -20.225 -2.202 4.179 1.00 0.00 H new ATOM 0 HA ALA A 36 -19.246 0.222 5.077 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -21.585 0.720 5.600 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -21.440 -0.140 4.049 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -21.985 -1.011 5.502 1.00 0.00 H new ATOM 542 N MET A 37 -19.471 0.479 7.587 1.00 0.00 N ATOM 543 CA MET A 37 -19.230 0.536 9.019 1.00 0.00 C ATOM 544 C MET A 37 -20.403 1.196 9.746 1.00 0.00 C ATOM 545 O MET A 37 -20.773 0.778 10.842 1.00 0.00 O ATOM 546 CB MET A 37 -17.950 1.329 9.290 1.00 0.00 C ATOM 547 CG MET A 37 -16.710 0.456 9.083 1.00 0.00 C ATOM 548 SD MET A 37 -16.601 -0.767 10.379 1.00 0.00 S ATOM 549 CE MET A 37 -15.446 -1.905 9.634 1.00 0.00 C ATOM 0 H MET A 37 -19.505 1.387 7.123 1.00 0.00 H new ATOM 0 HA MET A 37 -19.123 -0.483 9.392 1.00 0.00 H new ATOM 0 HB2 MET A 37 -17.906 2.193 8.627 1.00 0.00 H new ATOM 0 HB3 MET A 37 -17.964 1.711 10.311 1.00 0.00 H new ATOM 0 HG2 MET A 37 -16.759 -0.035 8.111 1.00 0.00 H new ATOM 0 HG3 MET A 37 -15.814 1.077 9.081 1.00 0.00 H new ATOM 0 HE1 MET A 37 -15.920 -2.880 9.517 1.00 0.00 H new ATOM 0 HE2 MET A 37 -15.143 -1.529 8.657 1.00 0.00 H new ATOM 0 HE3 MET A 37 -14.568 -2.003 10.273 1.00 0.00 H new ATOM 614 N MET A 42 -25.282 3.643 4.252 1.00 0.00 N ATOM 615 CA MET A 42 -24.610 2.434 3.804 1.00 0.00 C ATOM 616 C MET A 42 -23.291 2.768 3.105 1.00 0.00 C ATOM 617 O MET A 42 -23.202 2.712 1.879 1.00 0.00 O ATOM 618 CB MET A 42 -25.521 1.671 2.840 1.00 0.00 C ATOM 619 CG MET A 42 -25.783 0.250 3.342 1.00 0.00 C ATOM 620 SD MET A 42 -25.624 -0.912 1.997 1.00 0.00 S ATOM 621 CE MET A 42 -23.846 -1.063 1.927 1.00 0.00 C ATOM 0 HA MET A 42 -24.391 1.817 4.676 1.00 0.00 H new ATOM 0 HB2 MET A 42 -26.467 2.202 2.731 1.00 0.00 H new ATOM 0 HB3 MET A 42 -25.061 1.633 1.853 1.00 0.00 H new ATOM 0 HG2 MET A 42 -25.078 -0.000 4.135 1.00 0.00 H new ATOM 0 HG3 MET A 42 -26.782 0.186 3.772 1.00 0.00 H new ATOM 0 HE1 MET A 42 -23.571 -1.758 1.134 1.00 0.00 H new ATOM 0 HE2 MET A 42 -23.406 -0.087 1.723 1.00 0.00 H new ATOM 0 HE3 MET A 42 -23.475 -1.437 2.881 1.00 0.00 H new ATOM 631 N THR A 43 -22.299 3.108 3.914 1.00 0.00 N ATOM 632 CA THR A 43 -20.988 3.451 3.388 1.00 0.00 C ATOM 633 C THR A 43 -20.007 3.714 4.532 1.00 0.00 C ATOM 634 O THR A 43 -20.383 3.660 5.702 1.00 0.00 O ATOM 635 CB THR A 43 -21.155 4.642 2.443 1.00 0.00 C ATOM 636 OG1 THR A 43 -19.829 4.922 2.000 1.00 0.00 O ATOM 637 CG2 THR A 43 -21.579 5.916 3.177 1.00 0.00 C ATOM 0 H THR A 43 -22.376 3.153 4.930 1.00 0.00 H new ATOM 0 HA THR A 43 -20.561 2.625 2.820 1.00 0.00 H new ATOM 0 HB THR A 43 -21.894 4.399 1.680 1.00 0.00 H new ATOM 0 HG1 THR A 43 -19.677 4.494 1.131 1.00 0.00 H new ATOM 0 HG21 THR A 43 -21.683 6.731 2.461 1.00 0.00 H new ATOM 0 HG22 THR A 43 -22.533 5.748 3.677 1.00 0.00 H new ATOM 0 HG23 THR A 43 -20.823 6.178 3.917 1.00 0.00 H new ATOM 645 N SER A 44 -18.768 3.994 4.154 1.00 0.00 N ATOM 646 CA SER A 44 -17.730 4.267 5.134 1.00 0.00 C ATOM 647 C SER A 44 -16.526 4.919 4.452 1.00 0.00 C ATOM 648 O SER A 44 -16.520 5.100 3.236 1.00 0.00 O ATOM 649 CB SER A 44 -17.304 2.987 5.855 1.00 0.00 C ATOM 650 OG SER A 44 -17.112 1.903 4.950 1.00 0.00 O ATOM 0 H SER A 44 -18.460 4.038 3.183 1.00 0.00 H new ATOM 0 HA SER A 44 -18.133 4.954 5.878 1.00 0.00 H new ATOM 0 HB2 SER A 44 -16.380 3.170 6.403 1.00 0.00 H new ATOM 0 HB3 SER A 44 -18.062 2.716 6.590 1.00 0.00 H new ATOM 0 HG SER A 44 -16.839 1.105 5.449 1.00 0.00 H new ATOM 656 N ASP A 45 -15.535 5.252 5.266 1.00 0.00 N ATOM 657 CA ASP A 45 -14.327 5.880 4.756 1.00 0.00 C ATOM 658 C ASP A 45 -13.119 5.009 5.106 1.00 0.00 C ATOM 659 O ASP A 45 -12.285 5.398 5.922 1.00 0.00 O ATOM 660 CB ASP A 45 -14.115 7.258 5.386 1.00 0.00 C ATOM 661 CG ASP A 45 -15.363 8.141 5.444 1.00 0.00 C ATOM 662 OD1 ASP A 45 -16.244 7.937 4.582 1.00 0.00 O ATOM 663 OD2 ASP A 45 -15.408 9.001 6.351 1.00 0.00 O ATOM 0 H ASP A 45 -15.543 5.099 6.274 1.00 0.00 H new ATOM 0 HA ASP A 45 -14.433 5.990 3.677 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -13.736 7.123 6.399 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -13.343 7.783 4.824 1.00 0.00 H new ATOM 668 N PRO A 46 -13.061 3.817 4.454 1.00 0.00 N ATOM 669 CA PRO A 46 -11.969 2.888 4.688 1.00 0.00 C ATOM 670 C PRO A 46 -10.687 3.365 4.001 1.00 0.00 C ATOM 671 O PRO A 46 -10.744 4.085 3.005 1.00 0.00 O ATOM 672 CB PRO A 46 -12.466 1.554 4.156 1.00 0.00 C ATOM 673 CG PRO A 46 -13.626 1.881 3.229 1.00 0.00 C ATOM 674 CD PRO A 46 -14.031 3.324 3.481 1.00 0.00 C ATOM 0 HA PRO A 46 -11.704 2.807 5.742 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -11.675 1.028 3.621 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -12.788 0.904 4.970 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -13.334 1.743 2.188 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -14.465 1.211 3.416 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -14.003 3.909 2.562 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -15.048 3.388 3.868 1.00 0.00 H new ATOM 682 N TYR A 47 -9.562 2.943 4.559 1.00 0.00 N ATOM 683 CA TYR A 47 -8.269 3.318 4.013 1.00 0.00 C ATOM 684 C TYR A 47 -7.187 2.322 4.434 1.00 0.00 C ATOM 685 O TYR A 47 -7.163 1.873 5.579 1.00 0.00 O ATOM 686 CB TYR A 47 -7.942 4.690 4.607 1.00 0.00 C ATOM 687 CG TYR A 47 -7.719 4.676 6.121 1.00 0.00 C ATOM 688 CD1 TYR A 47 -6.516 4.237 6.636 1.00 0.00 C ATOM 689 CD2 TYR A 47 -8.720 5.101 6.970 1.00 0.00 C ATOM 690 CE1 TYR A 47 -6.306 4.224 8.061 1.00 0.00 C ATOM 691 CE2 TYR A 47 -8.510 5.088 8.394 1.00 0.00 C ATOM 692 CZ TYR A 47 -7.313 4.650 8.870 1.00 0.00 C ATOM 693 OH TYR A 47 -7.114 4.637 10.215 1.00 0.00 O ATOM 0 H TYR A 47 -9.519 2.345 5.384 1.00 0.00 H new ATOM 0 HA TYR A 47 -8.301 3.331 2.924 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -7.047 5.081 4.122 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -8.756 5.378 4.376 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -5.733 3.904 5.971 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -9.661 5.443 6.566 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -5.370 3.884 8.478 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -9.285 5.419 9.069 1.00 0.00 H new ATOM 0 HH TYR A 47 -7.917 4.969 10.668 1.00 0.00 H new ATOM 703 N ILE A 48 -6.317 2.006 3.486 1.00 0.00 N ATOM 704 CA ILE A 48 -5.235 1.072 3.744 1.00 0.00 C ATOM 705 C ILE A 48 -4.009 1.842 4.238 1.00 0.00 C ATOM 706 O ILE A 48 -3.744 2.954 3.783 1.00 0.00 O ATOM 707 CB ILE A 48 -4.964 0.212 2.508 1.00 0.00 C ATOM 708 CG1 ILE A 48 -6.080 -0.814 2.298 1.00 0.00 C ATOM 709 CG2 ILE A 48 -3.586 -0.449 2.592 1.00 0.00 C ATOM 710 CD1 ILE A 48 -6.027 -1.400 0.886 1.00 0.00 C ATOM 0 H ILE A 48 -6.340 2.381 2.538 1.00 0.00 H new ATOM 0 HA ILE A 48 -5.514 0.375 4.534 1.00 0.00 H new ATOM 0 HB ILE A 48 -4.957 0.863 1.634 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -5.986 -1.615 3.032 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -7.049 -0.342 2.464 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -3.418 -1.055 1.701 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -2.817 0.320 2.658 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -3.540 -1.084 3.477 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -6.831 -2.126 0.763 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -6.146 -0.600 0.155 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -5.067 -1.892 0.732 1.00 0.00 H new ATOM 722 N LYS A 49 -3.293 1.221 5.164 1.00 0.00 N ATOM 723 CA LYS A 49 -2.101 1.834 5.725 1.00 0.00 C ATOM 724 C LYS A 49 -0.866 1.064 5.252 1.00 0.00 C ATOM 725 O LYS A 49 -0.802 -0.157 5.387 1.00 0.00 O ATOM 726 CB LYS A 49 -2.217 1.936 7.247 1.00 0.00 C ATOM 727 CG LYS A 49 -3.225 3.015 7.649 1.00 0.00 C ATOM 728 CD LYS A 49 -3.124 3.329 9.143 1.00 0.00 C ATOM 729 CE LYS A 49 -2.994 4.835 9.378 1.00 0.00 C ATOM 730 NZ LYS A 49 -2.386 5.103 10.701 1.00 0.00 N ATOM 0 H LYS A 49 -3.516 0.299 5.540 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.995 2.858 5.367 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.525 0.974 7.657 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.242 2.167 7.675 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -3.044 3.921 7.070 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -4.235 2.681 7.411 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -4.007 2.952 9.658 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -2.262 2.815 9.569 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -2.382 5.280 8.593 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -3.976 5.304 9.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -2.305 6.130 10.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.985 4.695 11.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.440 4.672 10.742 1.00 0.00 H new ATOM 744 N MET A 50 0.084 1.810 4.708 1.00 0.00 N ATOM 745 CA MET A 50 1.314 1.213 4.215 1.00 0.00 C ATOM 746 C MET A 50 2.424 1.297 5.264 1.00 0.00 C ATOM 747 O MET A 50 2.488 2.258 6.029 1.00 0.00 O ATOM 748 CB MET A 50 1.758 1.937 2.942 1.00 0.00 C ATOM 749 CG MET A 50 2.618 1.025 2.065 1.00 0.00 C ATOM 750 SD MET A 50 3.353 1.968 0.740 1.00 0.00 S ATOM 751 CE MET A 50 5.030 2.090 1.339 1.00 0.00 C ATOM 0 H MET A 50 0.027 2.822 4.598 1.00 0.00 H new ATOM 0 HA MET A 50 1.124 0.162 3.999 1.00 0.00 H new ATOM 0 HB2 MET A 50 0.883 2.266 2.382 1.00 0.00 H new ATOM 0 HB3 MET A 50 2.322 2.831 3.206 1.00 0.00 H new ATOM 0 HG2 MET A 50 3.398 0.558 2.667 1.00 0.00 H new ATOM 0 HG3 MET A 50 2.008 0.220 1.655 1.00 0.00 H new ATOM 0 HE1 MET A 50 5.215 3.102 1.701 1.00 0.00 H new ATOM 0 HE2 MET A 50 5.178 1.381 2.153 1.00 0.00 H new ATOM 0 HE3 MET A 50 5.723 1.862 0.529 1.00 0.00 H new ATOM 761 N THR A 51 3.271 0.278 5.267 1.00 0.00 N ATOM 762 CA THR A 51 4.375 0.225 6.209 1.00 0.00 C ATOM 763 C THR A 51 5.497 -0.662 5.667 1.00 0.00 C ATOM 764 O THR A 51 5.271 -1.827 5.344 1.00 0.00 O ATOM 765 CB THR A 51 3.824 -0.247 7.556 1.00 0.00 C ATOM 766 OG1 THR A 51 2.814 0.708 7.872 1.00 0.00 O ATOM 767 CG2 THR A 51 4.842 -0.101 8.689 1.00 0.00 C ATOM 0 H THR A 51 3.214 -0.518 4.631 1.00 0.00 H new ATOM 0 HA THR A 51 4.822 1.209 6.351 1.00 0.00 H new ATOM 0 HB THR A 51 3.516 -1.290 7.477 1.00 0.00 H new ATOM 0 HG1 THR A 51 2.940 1.511 7.324 1.00 0.00 H new ATOM 0 HG21 THR A 51 4.400 -0.450 9.622 1.00 0.00 H new ATOM 0 HG22 THR A 51 5.727 -0.695 8.462 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.125 0.947 8.791 1.00 0.00 H new ATOM 775 N ILE A 52 6.683 -0.077 5.584 1.00 0.00 N ATOM 776 CA ILE A 52 7.841 -0.800 5.086 1.00 0.00 C ATOM 777 C ILE A 52 8.437 -1.640 6.218 1.00 0.00 C ATOM 778 O ILE A 52 9.304 -1.170 6.953 1.00 0.00 O ATOM 779 CB ILE A 52 8.840 0.165 4.444 1.00 0.00 C ATOM 780 CG1 ILE A 52 8.189 0.948 3.302 1.00 0.00 C ATOM 781 CG2 ILE A 52 10.100 -0.573 3.989 1.00 0.00 C ATOM 782 CD1 ILE A 52 9.232 1.755 2.527 1.00 0.00 C ATOM 0 H ILE A 52 6.867 0.889 5.853 1.00 0.00 H new ATOM 0 HA ILE A 52 7.548 -1.491 4.295 1.00 0.00 H new ATOM 0 HB ILE A 52 9.147 0.891 5.197 1.00 0.00 H new ATOM 0 HG12 ILE A 52 7.682 0.259 2.627 1.00 0.00 H new ATOM 0 HG13 ILE A 52 7.429 1.619 3.703 1.00 0.00 H new ATOM 0 HG21 ILE A 52 10.793 0.136 3.536 1.00 0.00 H new ATOM 0 HG22 ILE A 52 10.575 -1.046 4.848 1.00 0.00 H new ATOM 0 HG23 ILE A 52 9.831 -1.335 3.258 1.00 0.00 H new ATOM 0 HD11 ILE A 52 8.743 2.302 1.721 1.00 0.00 H new ATOM 0 HD12 ILE A 52 9.720 2.460 3.200 1.00 0.00 H new ATOM 0 HD13 ILE A 52 9.977 1.079 2.107 1.00 0.00 H new ATOM 794 N LEU A 53 7.949 -2.867 6.322 1.00 0.00 N ATOM 795 CA LEU A 53 8.423 -3.776 7.351 1.00 0.00 C ATOM 796 C LEU A 53 9.717 -4.442 6.880 1.00 0.00 C ATOM 797 O LEU A 53 9.976 -4.526 5.681 1.00 0.00 O ATOM 798 CB LEU A 53 7.324 -4.770 7.735 1.00 0.00 C ATOM 799 CG LEU A 53 6.154 -4.198 8.538 1.00 0.00 C ATOM 800 CD1 LEU A 53 6.651 -3.460 9.783 1.00 0.00 C ATOM 801 CD2 LEU A 53 5.269 -3.311 7.661 1.00 0.00 C ATOM 0 H LEU A 53 7.230 -3.253 5.710 1.00 0.00 H new ATOM 0 HA LEU A 53 8.659 -3.229 8.264 1.00 0.00 H new ATOM 0 HB2 LEU A 53 6.929 -5.215 6.822 1.00 0.00 H new ATOM 0 HB3 LEU A 53 7.776 -5.576 8.313 1.00 0.00 H new ATOM 0 HG LEU A 53 5.538 -5.029 8.882 1.00 0.00 H new ATOM 0 HD11 LEU A 53 5.799 -3.064 10.335 1.00 0.00 H new ATOM 0 HD12 LEU A 53 7.206 -4.151 10.418 1.00 0.00 H new ATOM 0 HD13 LEU A 53 7.303 -2.639 9.484 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.445 -2.917 8.256 1.00 0.00 H new ATOM 0 HD22 LEU A 53 5.860 -2.484 7.267 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.871 -3.899 6.834 1.00 0.00 H new ATOM 813 N PRO A 54 10.517 -4.912 7.875 1.00 0.00 N ATOM 814 CA PRO A 54 10.135 -4.773 9.270 1.00 0.00 C ATOM 815 C PRO A 54 10.326 -3.332 9.750 1.00 0.00 C ATOM 816 O PRO A 54 9.685 -2.903 10.707 1.00 0.00 O ATOM 817 CB PRO A 54 11.008 -5.768 10.018 1.00 0.00 C ATOM 818 CG PRO A 54 12.163 -6.092 9.085 1.00 0.00 C ATOM 819 CD PRO A 54 11.800 -5.585 7.699 1.00 0.00 C ATOM 0 HA PRO A 54 9.079 -4.983 9.440 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.370 -5.344 10.955 1.00 0.00 H new ATOM 0 HB3 PRO A 54 10.446 -6.667 10.271 1.00 0.00 H new ATOM 0 HG2 PRO A 54 13.081 -5.620 9.436 1.00 0.00 H new ATOM 0 HG3 PRO A 54 12.346 -7.166 9.063 1.00 0.00 H new ATOM 0 HD2 PRO A 54 12.557 -4.900 7.317 1.00 0.00 H new ATOM 0 HD3 PRO A 54 11.722 -6.405 6.985 1.00 0.00 H new ATOM 827 N GLU A 55 11.211 -2.626 9.061 1.00 0.00 N ATOM 828 CA GLU A 55 11.494 -1.242 9.405 1.00 0.00 C ATOM 829 C GLU A 55 10.291 -0.613 10.109 1.00 0.00 C ATOM 830 O GLU A 55 10.389 -0.196 11.262 1.00 0.00 O ATOM 831 CB GLU A 55 11.886 -0.438 8.163 1.00 0.00 C ATOM 832 CG GLU A 55 13.406 -0.390 7.998 1.00 0.00 C ATOM 833 CD GLU A 55 13.799 0.454 6.784 1.00 0.00 C ATOM 834 OE1 GLU A 55 13.042 1.402 6.483 1.00 0.00 O ATOM 835 OE2 GLU A 55 14.847 0.131 6.184 1.00 0.00 O ATOM 0 H GLU A 55 11.741 -2.986 8.267 1.00 0.00 H new ATOM 0 HA GLU A 55 12.341 -1.224 10.091 1.00 0.00 H new ATOM 0 HB2 GLU A 55 11.435 -0.886 7.278 1.00 0.00 H new ATOM 0 HB3 GLU A 55 11.493 0.576 8.243 1.00 0.00 H new ATOM 0 HG2 GLU A 55 13.860 0.026 8.897 1.00 0.00 H new ATOM 0 HG3 GLU A 55 13.795 -1.402 7.883 1.00 0.00 H new ATOM 842 N LYS A 56 9.182 -0.564 9.385 1.00 0.00 N ATOM 843 CA LYS A 56 7.960 0.008 9.926 1.00 0.00 C ATOM 844 C LYS A 56 8.148 1.514 10.117 1.00 0.00 C ATOM 845 O LYS A 56 7.303 2.178 10.716 1.00 0.00 O ATOM 846 CB LYS A 56 7.544 -0.726 11.202 1.00 0.00 C ATOM 847 CG LYS A 56 6.041 -0.586 11.450 1.00 0.00 C ATOM 848 CD LYS A 56 5.685 -0.962 12.890 1.00 0.00 C ATOM 849 CE LYS A 56 4.761 -2.180 12.926 1.00 0.00 C ATOM 850 NZ LYS A 56 3.510 -1.861 13.650 1.00 0.00 N ATOM 0 H LYS A 56 9.104 -0.911 8.429 1.00 0.00 H new ATOM 0 HA LYS A 56 7.135 -0.125 9.226 1.00 0.00 H new ATOM 0 HB2 LYS A 56 7.806 -1.781 11.121 1.00 0.00 H new ATOM 0 HB3 LYS A 56 8.095 -0.325 12.053 1.00 0.00 H new ATOM 0 HG2 LYS A 56 5.730 0.440 11.251 1.00 0.00 H new ATOM 0 HG3 LYS A 56 5.493 -1.225 10.758 1.00 0.00 H new ATOM 0 HD2 LYS A 56 6.596 -1.175 13.450 1.00 0.00 H new ATOM 0 HD3 LYS A 56 5.200 -0.118 13.381 1.00 0.00 H new ATOM 0 HE2 LYS A 56 4.529 -2.498 11.910 1.00 0.00 H new ATOM 0 HE3 LYS A 56 5.267 -3.014 13.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 2.894 -2.699 13.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 3.736 -1.580 14.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 3.020 -1.080 13.169 1.00 0.00 H new ATOM 864 N LYS A 57 9.261 2.010 9.597 1.00 0.00 N ATOM 865 CA LYS A 57 9.571 3.426 9.702 1.00 0.00 C ATOM 866 C LYS A 57 8.770 4.198 8.652 1.00 0.00 C ATOM 867 O LYS A 57 7.893 4.991 8.994 1.00 0.00 O ATOM 868 CB LYS A 57 11.081 3.652 9.613 1.00 0.00 C ATOM 869 CG LYS A 57 11.397 4.988 8.937 1.00 0.00 C ATOM 870 CD LYS A 57 10.701 6.145 9.658 1.00 0.00 C ATOM 871 CE LYS A 57 11.720 7.175 10.152 1.00 0.00 C ATOM 872 NZ LYS A 57 11.722 8.364 9.272 1.00 0.00 N ATOM 0 H LYS A 57 9.960 1.456 9.101 1.00 0.00 H new ATOM 0 HA LYS A 57 9.272 3.810 10.677 1.00 0.00 H new ATOM 0 HB2 LYS A 57 11.514 3.635 10.613 1.00 0.00 H new ATOM 0 HB3 LYS A 57 11.542 2.839 9.052 1.00 0.00 H new ATOM 0 HG2 LYS A 57 12.475 5.152 8.934 1.00 0.00 H new ATOM 0 HG3 LYS A 57 11.076 4.958 7.896 1.00 0.00 H new ATOM 0 HD2 LYS A 57 9.992 6.624 8.984 1.00 0.00 H new ATOM 0 HD3 LYS A 57 10.129 5.761 10.502 1.00 0.00 H new ATOM 0 HE2 LYS A 57 11.481 7.471 11.173 1.00 0.00 H new ATOM 0 HE3 LYS A 57 12.715 6.730 10.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 12.419 9.053 9.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 11.972 8.079 8.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 10.777 8.797 9.272 1.00 0.00 H new ATOM 886 N HIS A 58 9.101 3.941 7.395 1.00 0.00 N ATOM 887 CA HIS A 58 8.423 4.602 6.293 1.00 0.00 C ATOM 888 C HIS A 58 6.937 4.240 6.312 1.00 0.00 C ATOM 889 O HIS A 58 6.496 3.374 5.559 1.00 0.00 O ATOM 890 CB HIS A 58 9.098 4.267 4.961 1.00 0.00 C ATOM 891 CG HIS A 58 10.582 4.547 4.936 1.00 0.00 C ATOM 892 ND1 HIS A 58 11.153 5.621 5.596 1.00 0.00 N ATOM 893 CD2 HIS A 58 11.604 3.882 4.326 1.00 0.00 C ATOM 894 CE1 HIS A 58 12.461 5.594 5.385 1.00 0.00 C ATOM 895 NE2 HIS A 58 12.738 4.516 4.597 1.00 0.00 N ATOM 0 H HIS A 58 9.830 3.284 7.115 1.00 0.00 H new ATOM 0 HA HIS A 58 8.499 5.683 6.411 1.00 0.00 H new ATOM 0 HB2 HIS A 58 8.934 3.213 4.737 1.00 0.00 H new ATOM 0 HB3 HIS A 58 8.617 4.840 4.168 1.00 0.00 H new ATOM 0 HD2 HIS A 58 11.507 2.990 3.724 1.00 0.00 H new ATOM 0 HE1 HIS A 58 13.181 6.301 5.769 1.00 0.00 H new ATOM 0 HE2 HIS A 58 13.664 4.242 4.270 1.00 0.00 H new ATOM 903 N LYS A 59 6.206 4.922 7.182 1.00 0.00 N ATOM 904 CA LYS A 59 4.779 4.683 7.309 1.00 0.00 C ATOM 905 C LYS A 59 4.018 5.684 6.437 1.00 0.00 C ATOM 906 O LYS A 59 4.217 6.892 6.555 1.00 0.00 O ATOM 907 CB LYS A 59 4.361 4.708 8.781 1.00 0.00 C ATOM 908 CG LYS A 59 4.174 3.289 9.322 1.00 0.00 C ATOM 909 CD LYS A 59 4.104 3.290 10.851 1.00 0.00 C ATOM 910 CE LYS A 59 2.863 2.543 11.343 1.00 0.00 C ATOM 911 NZ LYS A 59 2.431 3.065 12.659 1.00 0.00 N ATOM 0 H LYS A 59 6.576 5.640 7.805 1.00 0.00 H new ATOM 0 HA LYS A 59 4.526 3.687 6.946 1.00 0.00 H new ATOM 0 HB2 LYS A 59 5.117 5.228 9.369 1.00 0.00 H new ATOM 0 HB3 LYS A 59 3.432 5.268 8.890 1.00 0.00 H new ATOM 0 HG2 LYS A 59 3.261 2.857 8.913 1.00 0.00 H new ATOM 0 HG3 LYS A 59 5.000 2.659 8.993 1.00 0.00 H new ATOM 0 HD2 LYS A 59 5.000 2.823 11.260 1.00 0.00 H new ATOM 0 HD3 LYS A 59 4.084 4.316 11.217 1.00 0.00 H new ATOM 0 HE2 LYS A 59 2.055 2.652 10.619 1.00 0.00 H new ATOM 0 HE3 LYS A 59 3.080 1.478 11.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 1.588 2.547 12.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 3.197 2.939 13.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 2.204 4.076 12.574 1.00 0.00 H new ATOM 925 N VAL A 60 3.164 5.144 5.581 1.00 0.00 N ATOM 926 CA VAL A 60 2.373 5.975 4.689 1.00 0.00 C ATOM 927 C VAL A 60 1.006 5.323 4.470 1.00 0.00 C ATOM 928 O VAL A 60 0.908 4.103 4.350 1.00 0.00 O ATOM 929 CB VAL A 60 3.135 6.215 3.384 1.00 0.00 C ATOM 930 CG1 VAL A 60 4.341 7.129 3.615 1.00 0.00 C ATOM 931 CG2 VAL A 60 3.563 4.892 2.747 1.00 0.00 C ATOM 0 H VAL A 60 3.002 4.141 5.486 1.00 0.00 H new ATOM 0 HA VAL A 60 2.199 6.955 5.134 1.00 0.00 H new ATOM 0 HB VAL A 60 2.461 6.717 2.690 1.00 0.00 H new ATOM 0 HG11 VAL A 60 4.866 7.284 2.672 1.00 0.00 H new ATOM 0 HG12 VAL A 60 4.001 8.089 4.003 1.00 0.00 H new ATOM 0 HG13 VAL A 60 5.016 6.666 4.334 1.00 0.00 H new ATOM 0 HG21 VAL A 60 4.102 5.092 1.821 1.00 0.00 H new ATOM 0 HG22 VAL A 60 4.212 4.350 3.435 1.00 0.00 H new ATOM 0 HG23 VAL A 60 2.680 4.290 2.530 1.00 0.00 H new ATOM 941 N LYS A 61 -0.016 6.166 4.426 1.00 0.00 N ATOM 942 CA LYS A 61 -1.373 5.687 4.224 1.00 0.00 C ATOM 943 C LYS A 61 -1.980 6.388 3.007 1.00 0.00 C ATOM 944 O LYS A 61 -1.575 7.495 2.657 1.00 0.00 O ATOM 945 CB LYS A 61 -2.195 5.854 5.503 1.00 0.00 C ATOM 946 CG LYS A 61 -2.470 7.331 5.790 1.00 0.00 C ATOM 947 CD LYS A 61 -2.884 7.539 7.249 1.00 0.00 C ATOM 948 CE LYS A 61 -1.662 7.790 8.135 1.00 0.00 C ATOM 949 NZ LYS A 61 -1.173 9.176 7.962 1.00 0.00 N ATOM 0 H LYS A 61 0.069 7.177 4.527 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.373 4.618 4.010 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -3.139 5.317 5.406 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.661 5.410 6.343 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -1.578 7.919 5.574 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -3.258 7.693 5.130 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -3.569 8.384 7.320 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -3.423 6.662 7.607 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -1.921 7.617 9.180 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -0.871 7.084 7.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -0.481 9.396 8.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -0.720 9.271 7.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -1.973 9.837 8.027 1.00 0.00 H new ATOM 963 N THR A 62 -2.943 5.714 2.396 1.00 0.00 N ATOM 964 CA THR A 62 -3.611 6.257 1.225 1.00 0.00 C ATOM 965 C THR A 62 -4.788 7.139 1.645 1.00 0.00 C ATOM 966 O THR A 62 -5.504 6.816 2.591 1.00 0.00 O ATOM 967 CB THR A 62 -4.017 5.088 0.327 1.00 0.00 C ATOM 968 OG1 THR A 62 -5.193 4.569 0.943 1.00 0.00 O ATOM 969 CG2 THR A 62 -3.021 3.928 0.388 1.00 0.00 C ATOM 0 H THR A 62 -3.277 4.796 2.690 1.00 0.00 H new ATOM 0 HA THR A 62 -2.946 6.906 0.655 1.00 0.00 H new ATOM 0 HB THR A 62 -4.106 5.436 -0.702 1.00 0.00 H new ATOM 0 HG1 THR A 62 -5.908 4.500 0.276 1.00 0.00 H new ATOM 0 HG21 THR A 62 -3.357 3.125 -0.268 1.00 0.00 H new ATOM 0 HG22 THR A 62 -2.039 4.274 0.064 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.956 3.558 1.411 1.00 0.00 H new ATOM 977 N ARG A 63 -4.953 8.236 0.919 1.00 0.00 N ATOM 978 CA ARG A 63 -6.031 9.167 1.204 1.00 0.00 C ATOM 979 C ARG A 63 -7.327 8.406 1.493 1.00 0.00 C ATOM 980 O ARG A 63 -7.904 7.794 0.596 1.00 0.00 O ATOM 981 CB ARG A 63 -6.259 10.122 0.031 1.00 0.00 C ATOM 982 CG ARG A 63 -5.907 9.451 -1.298 1.00 0.00 C ATOM 983 CD ARG A 63 -6.636 10.124 -2.463 1.00 0.00 C ATOM 984 NE ARG A 63 -5.865 9.946 -3.714 1.00 0.00 N ATOM 985 CZ ARG A 63 -6.151 10.567 -4.866 1.00 0.00 C ATOM 986 NH1 ARG A 63 -7.191 11.409 -4.934 1.00 0.00 N ATOM 987 NH2 ARG A 63 -5.396 10.345 -5.951 1.00 0.00 N ATOM 0 H ARG A 63 -4.358 8.500 0.134 1.00 0.00 H new ATOM 0 HA ARG A 63 -5.744 9.748 2.080 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -7.301 10.443 0.016 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -5.651 11.017 0.163 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -4.830 9.501 -1.461 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.175 8.395 -1.258 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.632 9.695 -2.576 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -6.768 11.186 -2.255 1.00 0.00 H new ATOM 0 HE ARG A 63 -5.067 9.311 -3.698 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -7.766 11.578 -4.108 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -7.408 11.881 -5.812 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -4.605 9.704 -5.899 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -5.613 10.817 -6.829 1.00 0.00 H new ATOM 1001 N VAL A 64 -7.746 8.469 2.748 1.00 0.00 N ATOM 1002 CA VAL A 64 -8.962 7.794 3.166 1.00 0.00 C ATOM 1003 C VAL A 64 -10.169 8.487 2.530 1.00 0.00 C ATOM 1004 O VAL A 64 -10.608 9.534 3.001 1.00 0.00 O ATOM 1005 CB VAL A 64 -9.037 7.747 4.694 1.00 0.00 C ATOM 1006 CG1 VAL A 64 -8.721 9.116 5.300 1.00 0.00 C ATOM 1007 CG2 VAL A 64 -10.403 7.242 5.161 1.00 0.00 C ATOM 0 H VAL A 64 -7.264 8.978 3.489 1.00 0.00 H new ATOM 0 HA VAL A 64 -8.961 6.760 2.822 1.00 0.00 H new ATOM 0 HB VAL A 64 -8.283 7.043 5.045 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -8.781 9.056 6.387 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -7.716 9.420 5.009 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -9.441 9.849 4.937 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -10.429 7.218 6.250 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -11.183 7.909 4.794 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -10.572 6.238 4.772 1.00 0.00 H new ATOM 1017 N LEU A 65 -10.672 7.873 1.468 1.00 0.00 N ATOM 1018 CA LEU A 65 -11.819 8.417 0.762 1.00 0.00 C ATOM 1019 C LEU A 65 -13.025 8.446 1.704 1.00 0.00 C ATOM 1020 O LEU A 65 -13.077 7.692 2.674 1.00 0.00 O ATOM 1021 CB LEU A 65 -12.069 7.642 -0.533 1.00 0.00 C ATOM 1022 CG LEU A 65 -10.995 7.780 -1.615 1.00 0.00 C ATOM 1023 CD1 LEU A 65 -10.573 6.409 -2.146 1.00 0.00 C ATOM 1024 CD2 LEU A 65 -11.464 8.710 -2.736 1.00 0.00 C ATOM 0 H LEU A 65 -10.305 7.004 1.080 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.626 9.446 0.458 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -12.175 6.586 -0.286 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -13.021 7.969 -0.951 1.00 0.00 H new ATOM 0 HG LEU A 65 -10.113 8.236 -1.166 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -9.809 6.535 -2.913 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -10.171 5.810 -1.329 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -11.438 5.903 -2.575 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -10.683 8.791 -3.492 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -12.368 8.305 -3.190 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -11.675 9.697 -2.325 1.00 0.00 H new ATOM 1036 N ARG A 66 -13.964 9.324 1.384 1.00 0.00 N ATOM 1037 CA ARG A 66 -15.166 9.461 2.189 1.00 0.00 C ATOM 1038 C ARG A 66 -16.360 8.828 1.472 1.00 0.00 C ATOM 1039 O ARG A 66 -16.528 9.001 0.266 1.00 0.00 O ATOM 1040 CB ARG A 66 -15.473 10.933 2.474 1.00 0.00 C ATOM 1041 CG ARG A 66 -14.281 11.622 3.140 1.00 0.00 C ATOM 1042 CD ARG A 66 -13.595 10.689 4.140 1.00 0.00 C ATOM 1043 NE ARG A 66 -12.652 11.456 4.984 1.00 0.00 N ATOM 1044 CZ ARG A 66 -13.028 12.347 5.911 1.00 0.00 C ATOM 1045 NH1 ARG A 66 -14.329 12.589 6.120 1.00 0.00 N ATOM 1046 NH2 ARG A 66 -12.102 12.996 6.631 1.00 0.00 N ATOM 0 H ARG A 66 -13.917 9.948 0.578 1.00 0.00 H new ATOM 0 HA ARG A 66 -14.992 8.948 3.135 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -15.719 11.444 1.543 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -16.348 11.007 3.120 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -13.566 11.934 2.379 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -14.617 12.524 3.651 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -14.342 10.201 4.766 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -13.062 9.901 3.608 1.00 0.00 H new ATOM 0 HE ARG A 66 -11.653 11.296 4.852 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -15.034 12.095 5.573 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -14.615 13.268 6.826 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -11.111 12.811 6.473 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -12.388 13.674 7.337 1.00 0.00 H new ATOM 1060 N LYS A 67 -17.159 8.106 2.245 1.00 0.00 N ATOM 1061 CA LYS A 67 -18.332 7.446 1.699 1.00 0.00 C ATOM 1062 C LYS A 67 -17.954 6.739 0.396 1.00 0.00 C ATOM 1063 O LYS A 67 -18.098 7.306 -0.686 1.00 0.00 O ATOM 1064 CB LYS A 67 -19.485 8.441 1.547 1.00 0.00 C ATOM 1065 CG LYS A 67 -19.782 9.142 2.874 1.00 0.00 C ATOM 1066 CD LYS A 67 -21.152 9.823 2.839 1.00 0.00 C ATOM 1067 CE LYS A 67 -22.132 9.133 3.790 1.00 0.00 C ATOM 1068 NZ LYS A 67 -23.029 10.126 4.421 1.00 0.00 N ATOM 0 H LYS A 67 -17.016 7.964 3.245 1.00 0.00 H new ATOM 0 HA LYS A 67 -18.692 6.679 2.385 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -19.233 9.182 0.788 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -20.377 7.920 1.199 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -19.753 8.417 3.687 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -19.009 9.882 3.079 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -21.048 10.872 3.117 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -21.548 9.800 1.824 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -22.722 8.398 3.243 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -21.581 8.592 4.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -23.687 9.640 5.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -22.463 10.812 4.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -23.568 10.624 3.684 1.00 0.00 H new ATOM 1082 N THR A 68 -17.479 5.511 0.543 1.00 0.00 N ATOM 1083 CA THR A 68 -17.079 4.721 -0.609 1.00 0.00 C ATOM 1084 C THR A 68 -16.621 3.329 -0.168 1.00 0.00 C ATOM 1085 O THR A 68 -15.528 3.174 0.373 1.00 0.00 O ATOM 1086 CB THR A 68 -16.005 5.501 -1.368 1.00 0.00 C ATOM 1087 OG1 THR A 68 -15.790 4.736 -2.551 1.00 0.00 O ATOM 1088 CG2 THR A 68 -14.650 5.476 -0.657 1.00 0.00 C ATOM 0 H THR A 68 -17.362 5.044 1.442 1.00 0.00 H new ATOM 0 HA THR A 68 -17.918 4.554 -1.284 1.00 0.00 H new ATOM 0 HB THR A 68 -16.329 6.534 -1.495 1.00 0.00 H new ATOM 0 HG1 THR A 68 -15.108 5.172 -3.103 1.00 0.00 H new ATOM 0 HG21 THR A 68 -13.924 6.044 -1.238 1.00 0.00 H new ATOM 0 HG22 THR A 68 -14.750 5.921 0.333 1.00 0.00 H new ATOM 0 HG23 THR A 68 -14.309 4.445 -0.559 1.00 0.00 H new ATOM 1096 N LEU A 69 -17.482 2.352 -0.415 1.00 0.00 N ATOM 1097 CA LEU A 69 -17.179 0.978 -0.050 1.00 0.00 C ATOM 1098 C LEU A 69 -16.008 0.476 -0.897 1.00 0.00 C ATOM 1099 O LEU A 69 -15.272 -0.416 -0.478 1.00 0.00 O ATOM 1100 CB LEU A 69 -18.433 0.108 -0.156 1.00 0.00 C ATOM 1101 CG LEU A 69 -19.453 0.261 0.973 1.00 0.00 C ATOM 1102 CD1 LEU A 69 -18.760 0.309 2.336 1.00 0.00 C ATOM 1103 CD2 LEU A 69 -20.348 1.480 0.742 1.00 0.00 C ATOM 0 H LEU A 69 -18.389 2.485 -0.863 1.00 0.00 H new ATOM 0 HA LEU A 69 -16.866 0.920 0.992 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -18.929 0.334 -1.100 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -18.124 -0.936 -0.200 1.00 0.00 H new ATOM 0 HG LEU A 69 -20.098 -0.617 0.971 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -19.508 0.418 3.121 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -18.201 -0.614 2.493 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -18.076 1.157 2.367 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -21.064 1.566 1.559 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -19.734 2.380 0.702 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -20.884 1.364 -0.200 1.00 0.00 H new ATOM 1115 N ASP A 70 -15.872 1.071 -2.073 1.00 0.00 N ATOM 1116 CA ASP A 70 -14.802 0.695 -2.982 1.00 0.00 C ATOM 1117 C ASP A 70 -13.932 1.920 -3.273 1.00 0.00 C ATOM 1118 O ASP A 70 -14.049 2.530 -4.334 1.00 0.00 O ATOM 1119 CB ASP A 70 -15.363 0.187 -4.312 1.00 0.00 C ATOM 1120 CG ASP A 70 -16.323 1.147 -5.018 1.00 0.00 C ATOM 1121 OD1 ASP A 70 -17.530 1.080 -4.699 1.00 0.00 O ATOM 1122 OD2 ASP A 70 -15.828 1.927 -5.860 1.00 0.00 O ATOM 0 H ASP A 70 -16.484 1.810 -2.417 1.00 0.00 H new ATOM 0 HA ASP A 70 -14.220 -0.097 -2.510 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -14.530 -0.028 -4.982 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -15.881 -0.755 -4.134 1.00 0.00 H new ATOM 1127 N PRO A 71 -13.057 2.251 -2.286 1.00 0.00 N ATOM 1128 CA PRO A 71 -12.168 3.391 -2.426 1.00 0.00 C ATOM 1129 C PRO A 71 -11.019 3.076 -3.386 1.00 0.00 C ATOM 1130 O PRO A 71 -10.447 1.989 -3.339 1.00 0.00 O ATOM 1131 CB PRO A 71 -11.695 3.697 -1.014 1.00 0.00 C ATOM 1132 CG PRO A 71 -11.965 2.440 -0.203 1.00 0.00 C ATOM 1133 CD PRO A 71 -12.892 1.551 -1.015 1.00 0.00 C ATOM 0 HA PRO A 71 -12.662 4.259 -2.863 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -10.634 3.949 -1.003 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -12.230 4.552 -0.600 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -11.033 1.920 0.016 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -12.421 2.694 0.754 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -12.462 0.560 -1.162 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -13.849 1.412 -0.512 1.00 0.00 H new ATOM 1141 N ALA A 72 -10.716 4.048 -4.234 1.00 0.00 N ATOM 1142 CA ALA A 72 -9.646 3.888 -5.204 1.00 0.00 C ATOM 1143 C ALA A 72 -8.604 4.988 -4.993 1.00 0.00 C ATOM 1144 O ALA A 72 -8.737 6.086 -5.531 1.00 0.00 O ATOM 1145 CB ALA A 72 -10.232 3.903 -6.618 1.00 0.00 C ATOM 0 H ALA A 72 -11.193 4.949 -4.269 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.145 2.929 -5.069 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -9.429 3.783 -7.346 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -10.944 3.085 -6.725 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -10.740 4.852 -6.791 1.00 0.00 H new ATOM 1151 N PHE A 73 -7.589 4.654 -4.208 1.00 0.00 N ATOM 1152 CA PHE A 73 -6.525 5.600 -3.919 1.00 0.00 C ATOM 1153 C PHE A 73 -5.501 5.636 -5.056 1.00 0.00 C ATOM 1154 O PHE A 73 -5.051 6.709 -5.457 1.00 0.00 O ATOM 1155 CB PHE A 73 -5.834 5.119 -2.642 1.00 0.00 C ATOM 1156 CG PHE A 73 -6.767 4.404 -1.662 1.00 0.00 C ATOM 1157 CD1 PHE A 73 -7.571 5.127 -0.837 1.00 0.00 C ATOM 1158 CD2 PHE A 73 -6.791 3.045 -1.616 1.00 0.00 C ATOM 1159 CE1 PHE A 73 -8.436 4.463 0.072 1.00 0.00 C ATOM 1160 CE2 PHE A 73 -7.657 2.381 -0.706 1.00 0.00 C ATOM 1161 CZ PHE A 73 -8.461 3.104 0.119 1.00 0.00 C ATOM 0 H PHE A 73 -7.482 3.742 -3.764 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.938 6.602 -3.805 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -5.022 4.444 -2.913 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -5.383 5.975 -2.140 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -7.551 6.206 -0.873 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -6.152 2.471 -2.271 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -9.075 5.037 0.727 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -7.677 1.302 -0.669 1.00 0.00 H new ATOM 0 HZ PHE A 73 -9.119 2.599 0.811 1.00 0.00 H new ATOM 1171 N ASP A 74 -5.161 4.452 -5.542 1.00 0.00 N ATOM 1172 CA ASP A 74 -4.199 4.335 -6.624 1.00 0.00 C ATOM 1173 C ASP A 74 -3.034 5.293 -6.370 1.00 0.00 C ATOM 1174 O ASP A 74 -2.597 5.999 -7.278 1.00 0.00 O ATOM 1175 CB ASP A 74 -4.832 4.705 -7.967 1.00 0.00 C ATOM 1176 CG ASP A 74 -4.399 3.834 -9.148 1.00 0.00 C ATOM 1177 OD1 ASP A 74 -3.222 3.964 -9.548 1.00 0.00 O ATOM 1178 OD2 ASP A 74 -5.255 3.057 -9.623 1.00 0.00 O ATOM 0 H ASP A 74 -5.535 3.564 -5.206 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.856 3.301 -6.660 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -5.916 4.645 -7.869 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -4.589 5.743 -8.192 1.00 0.00 H new ATOM 1183 N GLU A 75 -2.563 5.287 -5.132 1.00 0.00 N ATOM 1184 CA GLU A 75 -1.457 6.148 -4.747 1.00 0.00 C ATOM 1185 C GLU A 75 -0.123 5.441 -4.997 1.00 0.00 C ATOM 1186 O GLU A 75 -0.098 4.269 -5.368 1.00 0.00 O ATOM 1187 CB GLU A 75 -1.583 6.581 -3.285 1.00 0.00 C ATOM 1188 CG GLU A 75 -2.496 7.801 -3.151 1.00 0.00 C ATOM 1189 CD GLU A 75 -1.700 9.100 -3.289 1.00 0.00 C ATOM 1190 OE1 GLU A 75 -0.657 9.201 -2.609 1.00 0.00 O ATOM 1191 OE2 GLU A 75 -2.154 9.963 -4.071 1.00 0.00 O ATOM 0 H GLU A 75 -2.927 4.699 -4.382 1.00 0.00 H new ATOM 0 HA GLU A 75 -1.490 7.047 -5.362 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -1.981 5.758 -2.691 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -0.596 6.815 -2.885 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -3.273 7.764 -3.915 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -2.998 7.779 -2.184 1.00 0.00 H new ATOM 1198 N THR A 76 0.952 6.185 -4.785 1.00 0.00 N ATOM 1199 CA THR A 76 2.286 5.645 -4.983 1.00 0.00 C ATOM 1200 C THR A 76 3.315 6.463 -4.200 1.00 0.00 C ATOM 1201 O THR A 76 3.332 7.690 -4.286 1.00 0.00 O ATOM 1202 CB THR A 76 2.561 5.603 -6.487 1.00 0.00 C ATOM 1203 OG1 THR A 76 1.805 4.486 -6.947 1.00 0.00 O ATOM 1204 CG2 THR A 76 4.010 5.230 -6.808 1.00 0.00 C ATOM 0 H THR A 76 0.927 7.157 -4.478 1.00 0.00 H new ATOM 0 HA THR A 76 2.362 4.629 -4.595 1.00 0.00 H new ATOM 0 HB THR A 76 2.331 6.574 -6.925 1.00 0.00 H new ATOM 0 HG1 THR A 76 1.925 4.386 -7.915 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.151 5.215 -7.889 1.00 0.00 H new ATOM 0 HG22 THR A 76 4.682 5.965 -6.365 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.231 4.244 -6.399 1.00 0.00 H new ATOM 1212 N PHE A 77 4.147 5.751 -3.455 1.00 0.00 N ATOM 1213 CA PHE A 77 5.176 6.396 -2.657 1.00 0.00 C ATOM 1214 C PHE A 77 6.571 5.925 -3.076 1.00 0.00 C ATOM 1215 O PHE A 77 6.821 4.725 -3.175 1.00 0.00 O ATOM 1216 CB PHE A 77 4.932 5.995 -1.201 1.00 0.00 C ATOM 1217 CG PHE A 77 3.509 6.270 -0.711 1.00 0.00 C ATOM 1218 CD1 PHE A 77 3.149 7.527 -0.336 1.00 0.00 C ATOM 1219 CD2 PHE A 77 2.603 5.257 -0.650 1.00 0.00 C ATOM 1220 CE1 PHE A 77 1.829 7.782 0.119 1.00 0.00 C ATOM 1221 CE2 PHE A 77 1.282 5.512 -0.195 1.00 0.00 C ATOM 1222 CZ PHE A 77 0.923 6.769 0.180 1.00 0.00 C ATOM 0 H PHE A 77 4.130 4.733 -3.387 1.00 0.00 H new ATOM 0 HA PHE A 77 5.129 7.476 -2.794 1.00 0.00 H new ATOM 0 HB2 PHE A 77 5.146 4.932 -1.087 1.00 0.00 H new ATOM 0 HB3 PHE A 77 5.635 6.532 -0.564 1.00 0.00 H new ATOM 0 HD1 PHE A 77 3.868 8.331 -0.385 1.00 0.00 H new ATOM 0 HD2 PHE A 77 2.888 4.259 -0.948 1.00 0.00 H new ATOM 0 HE1 PHE A 77 1.544 8.780 0.417 1.00 0.00 H new ATOM 0 HE2 PHE A 77 0.563 4.708 -0.147 1.00 0.00 H new ATOM 0 HZ PHE A 77 -0.081 6.963 0.526 1.00 0.00 H new ATOM 1232 N THR A 78 7.442 6.895 -3.312 1.00 0.00 N ATOM 1233 CA THR A 78 8.804 6.595 -3.718 1.00 0.00 C ATOM 1234 C THR A 78 9.771 6.830 -2.556 1.00 0.00 C ATOM 1235 O THR A 78 9.616 7.786 -1.798 1.00 0.00 O ATOM 1236 CB THR A 78 9.125 7.436 -4.955 1.00 0.00 C ATOM 1237 OG1 THR A 78 8.525 6.717 -6.029 1.00 0.00 O ATOM 1238 CG2 THR A 78 10.617 7.435 -5.293 1.00 0.00 C ATOM 0 H THR A 78 7.231 7.889 -3.230 1.00 0.00 H new ATOM 0 HA THR A 78 8.915 5.544 -3.984 1.00 0.00 H new ATOM 0 HB THR A 78 8.790 8.461 -4.794 1.00 0.00 H new ATOM 0 HG1 THR A 78 8.683 7.194 -6.871 1.00 0.00 H new ATOM 0 HG21 THR A 78 10.790 8.046 -6.179 1.00 0.00 H new ATOM 0 HG22 THR A 78 11.180 7.844 -4.454 1.00 0.00 H new ATOM 0 HG23 THR A 78 10.945 6.414 -5.487 1.00 0.00 H new ATOM 1246 N PHE A 79 10.748 5.941 -2.452 1.00 0.00 N ATOM 1247 CA PHE A 79 11.741 6.040 -1.395 1.00 0.00 C ATOM 1248 C PHE A 79 13.142 5.733 -1.929 1.00 0.00 C ATOM 1249 O PHE A 79 13.355 4.705 -2.569 1.00 0.00 O ATOM 1250 CB PHE A 79 11.371 4.998 -0.337 1.00 0.00 C ATOM 1251 CG PHE A 79 9.871 4.904 -0.054 1.00 0.00 C ATOM 1252 CD1 PHE A 79 9.236 5.917 0.596 1.00 0.00 C ATOM 1253 CD2 PHE A 79 9.171 3.808 -0.451 1.00 0.00 C ATOM 1254 CE1 PHE A 79 7.844 5.829 0.859 1.00 0.00 C ATOM 1255 CE2 PHE A 79 7.779 3.720 -0.188 1.00 0.00 C ATOM 1256 CZ PHE A 79 7.144 4.733 0.462 1.00 0.00 C ATOM 0 H PHE A 79 10.873 5.149 -3.082 1.00 0.00 H new ATOM 0 HA PHE A 79 11.751 7.050 -0.986 1.00 0.00 H new ATOM 0 HB2 PHE A 79 11.731 4.022 -0.662 1.00 0.00 H new ATOM 0 HB3 PHE A 79 11.891 5.237 0.591 1.00 0.00 H new ATOM 0 HD1 PHE A 79 9.791 6.788 0.912 1.00 0.00 H new ATOM 0 HD2 PHE A 79 9.675 3.004 -0.967 1.00 0.00 H new ATOM 0 HE1 PHE A 79 7.340 6.633 1.375 1.00 0.00 H new ATOM 0 HE2 PHE A 79 7.224 2.849 -0.504 1.00 0.00 H new ATOM 0 HZ PHE A 79 6.085 4.666 0.662 1.00 0.00 H new ATOM 1266 N TYR A 80 14.061 6.644 -1.644 1.00 0.00 N ATOM 1267 CA TYR A 80 15.435 6.484 -2.087 1.00 0.00 C ATOM 1268 C TYR A 80 16.315 5.940 -0.959 1.00 0.00 C ATOM 1269 O TYR A 80 15.996 6.107 0.217 1.00 0.00 O ATOM 1270 CB TYR A 80 15.922 7.884 -2.467 1.00 0.00 C ATOM 1271 CG TYR A 80 15.078 8.565 -3.547 1.00 0.00 C ATOM 1272 CD1 TYR A 80 15.305 8.282 -4.879 1.00 0.00 C ATOM 1273 CD2 TYR A 80 14.091 9.460 -3.189 1.00 0.00 C ATOM 1274 CE1 TYR A 80 14.511 8.922 -5.895 1.00 0.00 C ATOM 1275 CE2 TYR A 80 13.297 10.101 -4.206 1.00 0.00 C ATOM 1276 CZ TYR A 80 13.546 9.800 -5.509 1.00 0.00 C ATOM 1277 OH TYR A 80 12.797 10.404 -6.469 1.00 0.00 O ATOM 0 H TYR A 80 13.881 7.495 -1.112 1.00 0.00 H new ATOM 0 HA TYR A 80 15.490 5.782 -2.919 1.00 0.00 H new ATOM 0 HB2 TYR A 80 15.926 8.510 -1.575 1.00 0.00 H new ATOM 0 HB3 TYR A 80 16.953 7.817 -2.815 1.00 0.00 H new ATOM 0 HD1 TYR A 80 16.078 7.581 -5.159 1.00 0.00 H new ATOM 0 HD2 TYR A 80 13.914 9.680 -2.147 1.00 0.00 H new ATOM 0 HE1 TYR A 80 14.678 8.710 -6.941 1.00 0.00 H new ATOM 0 HE2 TYR A 80 12.522 10.804 -3.940 1.00 0.00 H new ATOM 0 HH TYR A 80 12.147 11.004 -6.047 1.00 0.00 H new ATOM 1287 N GLY A 81 17.404 5.301 -1.358 1.00 0.00 N ATOM 1288 CA GLY A 81 18.332 4.731 -0.396 1.00 0.00 C ATOM 1289 C GLY A 81 18.192 3.209 -0.334 1.00 0.00 C ATOM 1290 O GLY A 81 19.135 2.482 -0.642 1.00 0.00 O ATOM 0 H GLY A 81 17.665 5.165 -2.335 1.00 0.00 H new ATOM 0 HA2 GLY A 81 19.353 4.995 -0.670 1.00 0.00 H new ATOM 0 HA3 GLY A 81 18.147 5.157 0.590 1.00 0.00 H new ATOM 1294 N ILE A 82 17.007 2.772 0.067 1.00 0.00 N ATOM 1295 CA ILE A 82 16.731 1.349 0.174 1.00 0.00 C ATOM 1296 C ILE A 82 17.326 0.627 -1.036 1.00 0.00 C ATOM 1297 O ILE A 82 16.881 0.828 -2.165 1.00 0.00 O ATOM 1298 CB ILE A 82 15.231 1.107 0.358 1.00 0.00 C ATOM 1299 CG1 ILE A 82 14.746 1.668 1.696 1.00 0.00 C ATOM 1300 CG2 ILE A 82 14.892 -0.377 0.203 1.00 0.00 C ATOM 1301 CD1 ILE A 82 13.493 2.526 1.509 1.00 0.00 C ATOM 0 H ILE A 82 16.227 3.378 0.322 1.00 0.00 H new ATOM 0 HA ILE A 82 17.209 0.933 1.061 1.00 0.00 H new ATOM 0 HB ILE A 82 14.699 1.643 -0.428 1.00 0.00 H new ATOM 0 HG12 ILE A 82 14.531 0.848 2.382 1.00 0.00 H new ATOM 0 HG13 ILE A 82 15.536 2.266 2.152 1.00 0.00 H new ATOM 0 HG21 ILE A 82 13.820 -0.521 0.338 1.00 0.00 H new ATOM 0 HG22 ILE A 82 15.181 -0.714 -0.793 1.00 0.00 H new ATOM 0 HG23 ILE A 82 15.433 -0.954 0.953 1.00 0.00 H new ATOM 0 HD11 ILE A 82 13.169 2.912 2.475 1.00 0.00 H new ATOM 0 HD12 ILE A 82 13.718 3.358 0.842 1.00 0.00 H new ATOM 0 HD13 ILE A 82 12.698 1.919 1.076 1.00 0.00 H new ATOM 1313 N PRO A 83 18.350 -0.222 -0.752 1.00 0.00 N ATOM 1314 CA PRO A 83 19.011 -0.976 -1.804 1.00 0.00 C ATOM 1315 C PRO A 83 18.135 -2.137 -2.280 1.00 0.00 C ATOM 1316 O PRO A 83 17.524 -2.831 -1.469 1.00 0.00 O ATOM 1317 CB PRO A 83 20.325 -1.435 -1.193 1.00 0.00 C ATOM 1318 CG PRO A 83 20.147 -1.321 0.312 1.00 0.00 C ATOM 1319 CD PRO A 83 18.904 -0.486 0.572 1.00 0.00 C ATOM 0 HA PRO A 83 19.190 -0.381 -2.699 1.00 0.00 H new ATOM 0 HB2 PRO A 83 20.553 -2.461 -1.483 1.00 0.00 H new ATOM 0 HB3 PRO A 83 21.153 -0.815 -1.536 1.00 0.00 H new ATOM 0 HG2 PRO A 83 20.044 -2.309 0.760 1.00 0.00 H new ATOM 0 HG3 PRO A 83 21.022 -0.855 0.766 1.00 0.00 H new ATOM 0 HD2 PRO A 83 18.192 -1.022 1.200 1.00 0.00 H new ATOM 0 HD3 PRO A 83 19.151 0.441 1.090 1.00 0.00 H new ATOM 1327 N TYR A 84 18.101 -2.311 -3.593 1.00 0.00 N ATOM 1328 CA TYR A 84 17.311 -3.376 -4.187 1.00 0.00 C ATOM 1329 C TYR A 84 17.632 -4.724 -3.539 1.00 0.00 C ATOM 1330 O TYR A 84 16.850 -5.668 -3.642 1.00 0.00 O ATOM 1331 CB TYR A 84 17.710 -3.425 -5.663 1.00 0.00 C ATOM 1332 CG TYR A 84 17.154 -4.634 -6.418 1.00 0.00 C ATOM 1333 CD1 TYR A 84 15.790 -4.806 -6.536 1.00 0.00 C ATOM 1334 CD2 TYR A 84 18.017 -5.552 -6.981 1.00 0.00 C ATOM 1335 CE1 TYR A 84 15.267 -5.944 -7.246 1.00 0.00 C ATOM 1336 CE2 TYR A 84 17.494 -6.690 -7.691 1.00 0.00 C ATOM 1337 CZ TYR A 84 16.145 -6.830 -7.789 1.00 0.00 C ATOM 1338 OH TYR A 84 15.651 -7.905 -8.460 1.00 0.00 O ATOM 0 H TYR A 84 18.608 -1.732 -4.262 1.00 0.00 H new ATOM 0 HA TYR A 84 16.247 -3.187 -4.048 1.00 0.00 H new ATOM 0 HB2 TYR A 84 17.365 -2.514 -6.152 1.00 0.00 H new ATOM 0 HB3 TYR A 84 18.798 -3.433 -5.735 1.00 0.00 H new ATOM 0 HD1 TYR A 84 15.115 -4.087 -6.096 1.00 0.00 H new ATOM 0 HD2 TYR A 84 19.085 -5.417 -6.889 1.00 0.00 H new ATOM 0 HE1 TYR A 84 14.202 -6.091 -7.345 1.00 0.00 H new ATOM 0 HE2 TYR A 84 18.158 -7.416 -8.136 1.00 0.00 H new ATOM 0 HH TYR A 84 16.393 -8.451 -8.794 1.00 0.00 H new ATOM 1348 N THR A 85 18.783 -4.771 -2.885 1.00 0.00 N ATOM 1349 CA THR A 85 19.217 -5.988 -2.220 1.00 0.00 C ATOM 1350 C THR A 85 18.525 -6.130 -0.863 1.00 0.00 C ATOM 1351 O THR A 85 18.462 -7.225 -0.306 1.00 0.00 O ATOM 1352 CB THR A 85 20.744 -5.954 -2.123 1.00 0.00 C ATOM 1353 OG1 THR A 85 21.022 -4.728 -1.452 1.00 0.00 O ATOM 1354 CG2 THR A 85 21.414 -5.792 -3.488 1.00 0.00 C ATOM 0 H THR A 85 19.429 -3.986 -2.801 1.00 0.00 H new ATOM 0 HA THR A 85 18.932 -6.873 -2.789 1.00 0.00 H new ATOM 0 HB THR A 85 21.098 -6.871 -1.652 1.00 0.00 H new ATOM 0 HG1 THR A 85 21.991 -4.626 -1.345 1.00 0.00 H new ATOM 0 HG21 THR A 85 22.497 -5.774 -3.362 1.00 0.00 H new ATOM 0 HG22 THR A 85 21.137 -6.628 -4.131 1.00 0.00 H new ATOM 0 HG23 THR A 85 21.086 -4.859 -3.946 1.00 0.00 H new ATOM 1362 N GLN A 86 18.023 -5.007 -0.370 1.00 0.00 N ATOM 1363 CA GLN A 86 17.338 -4.993 0.911 1.00 0.00 C ATOM 1364 C GLN A 86 15.841 -5.243 0.715 1.00 0.00 C ATOM 1365 O GLN A 86 15.126 -5.531 1.674 1.00 0.00 O ATOM 1366 CB GLN A 86 17.582 -3.675 1.649 1.00 0.00 C ATOM 1367 CG GLN A 86 17.221 -3.801 3.131 1.00 0.00 C ATOM 1368 CD GLN A 86 18.314 -3.197 4.015 1.00 0.00 C ATOM 1369 OE1 GLN A 86 19.449 -3.644 4.037 1.00 0.00 O ATOM 1370 NE2 GLN A 86 17.909 -2.158 4.740 1.00 0.00 N ATOM 0 H GLN A 86 18.077 -4.101 -0.835 1.00 0.00 H new ATOM 0 HA GLN A 86 17.743 -5.796 1.527 1.00 0.00 H new ATOM 0 HB2 GLN A 86 18.628 -3.387 1.549 1.00 0.00 H new ATOM 0 HB3 GLN A 86 16.988 -2.883 1.192 1.00 0.00 H new ATOM 0 HG2 GLN A 86 16.274 -3.297 3.322 1.00 0.00 H new ATOM 0 HG3 GLN A 86 17.081 -4.851 3.387 1.00 0.00 H new ATOM 0 HE21 GLN A 86 16.944 -1.835 4.674 1.00 0.00 H new ATOM 0 HE22 GLN A 86 18.564 -1.684 5.362 1.00 0.00 H new ATOM 1379 N ILE A 87 15.412 -5.122 -0.532 1.00 0.00 N ATOM 1380 CA ILE A 87 14.013 -5.331 -0.866 1.00 0.00 C ATOM 1381 C ILE A 87 13.561 -6.689 -0.325 1.00 0.00 C ATOM 1382 O ILE A 87 12.460 -6.813 0.208 1.00 0.00 O ATOM 1383 CB ILE A 87 13.791 -5.164 -2.370 1.00 0.00 C ATOM 1384 CG1 ILE A 87 14.266 -3.789 -2.845 1.00 0.00 C ATOM 1385 CG2 ILE A 87 12.329 -5.425 -2.741 1.00 0.00 C ATOM 1386 CD1 ILE A 87 13.236 -2.708 -2.512 1.00 0.00 C ATOM 0 H ILE A 87 16.008 -4.882 -1.324 1.00 0.00 H new ATOM 0 HA ILE A 87 13.390 -4.574 -0.389 1.00 0.00 H new ATOM 0 HB ILE A 87 14.393 -5.910 -2.889 1.00 0.00 H new ATOM 0 HG12 ILE A 87 15.218 -3.546 -2.374 1.00 0.00 H new ATOM 0 HG13 ILE A 87 14.440 -3.812 -3.921 1.00 0.00 H new ATOM 0 HG21 ILE A 87 12.198 -5.300 -3.816 1.00 0.00 H new ATOM 0 HG22 ILE A 87 12.058 -6.442 -2.459 1.00 0.00 H new ATOM 0 HG23 ILE A 87 11.688 -4.719 -2.213 1.00 0.00 H new ATOM 0 HD11 ILE A 87 13.598 -1.741 -2.860 1.00 0.00 H new ATOM 0 HD12 ILE A 87 12.292 -2.941 -3.005 1.00 0.00 H new ATOM 0 HD13 ILE A 87 13.083 -2.671 -1.433 1.00 0.00 H new ATOM 1398 N GLN A 88 14.435 -7.672 -0.480 1.00 0.00 N ATOM 1399 CA GLN A 88 14.140 -9.016 -0.013 1.00 0.00 C ATOM 1400 C GLN A 88 14.067 -9.044 1.515 1.00 0.00 C ATOM 1401 O GLN A 88 13.699 -10.059 2.104 1.00 0.00 O ATOM 1402 CB GLN A 88 15.176 -10.016 -0.530 1.00 0.00 C ATOM 1403 CG GLN A 88 15.318 -9.923 -2.051 1.00 0.00 C ATOM 1404 CD GLN A 88 16.721 -10.337 -2.498 1.00 0.00 C ATOM 1405 OE1 GLN A 88 17.240 -11.375 -2.120 1.00 0.00 O ATOM 1406 NE2 GLN A 88 17.305 -9.471 -3.322 1.00 0.00 N ATOM 0 H GLN A 88 15.348 -7.565 -0.922 1.00 0.00 H new ATOM 0 HA GLN A 88 13.168 -9.311 -0.409 1.00 0.00 H new ATOM 0 HB2 GLN A 88 16.140 -9.823 -0.059 1.00 0.00 H new ATOM 0 HB3 GLN A 88 14.882 -11.027 -0.250 1.00 0.00 H new ATOM 0 HG2 GLN A 88 14.577 -10.564 -2.529 1.00 0.00 H new ATOM 0 HG3 GLN A 88 15.115 -8.903 -2.377 1.00 0.00 H new ATOM 0 HE21 GLN A 88 16.815 -8.621 -3.599 1.00 0.00 H new ATOM 0 HE22 GLN A 88 18.243 -9.657 -3.677 1.00 0.00 H new ATOM 1415 N GLU A 89 14.422 -7.916 2.113 1.00 0.00 N ATOM 1416 CA GLU A 89 14.401 -7.798 3.561 1.00 0.00 C ATOM 1417 C GLU A 89 13.325 -6.802 3.996 1.00 0.00 C ATOM 1418 O GLU A 89 13.331 -6.334 5.134 1.00 0.00 O ATOM 1419 CB GLU A 89 15.775 -7.391 4.098 1.00 0.00 C ATOM 1420 CG GLU A 89 16.706 -8.601 4.197 1.00 0.00 C ATOM 1421 CD GLU A 89 16.870 -9.047 5.652 1.00 0.00 C ATOM 1422 OE1 GLU A 89 15.865 -9.532 6.214 1.00 0.00 O ATOM 1423 OE2 GLU A 89 17.998 -8.893 6.168 1.00 0.00 O ATOM 0 H GLU A 89 14.726 -7.076 1.621 1.00 0.00 H new ATOM 0 HA GLU A 89 14.157 -8.773 3.982 1.00 0.00 H new ATOM 0 HB2 GLU A 89 16.217 -6.640 3.443 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.664 -6.932 5.080 1.00 0.00 H new ATOM 0 HG2 GLU A 89 16.305 -9.423 3.604 1.00 0.00 H new ATOM 0 HG3 GLU A 89 17.680 -8.350 3.777 1.00 0.00 H new ATOM 1430 N LEU A 90 12.426 -6.508 3.069 1.00 0.00 N ATOM 1431 CA LEU A 90 11.345 -5.576 3.343 1.00 0.00 C ATOM 1432 C LEU A 90 10.014 -6.330 3.338 1.00 0.00 C ATOM 1433 O LEU A 90 9.988 -7.550 3.179 1.00 0.00 O ATOM 1434 CB LEU A 90 11.389 -4.401 2.364 1.00 0.00 C ATOM 1435 CG LEU A 90 12.663 -3.553 2.391 1.00 0.00 C ATOM 1436 CD1 LEU A 90 12.549 -2.362 1.438 1.00 0.00 C ATOM 1437 CD2 LEU A 90 13.000 -3.116 3.818 1.00 0.00 C ATOM 0 H LEU A 90 12.424 -6.899 2.127 1.00 0.00 H new ATOM 0 HA LEU A 90 11.461 -5.139 4.335 1.00 0.00 H new ATOM 0 HB2 LEU A 90 11.256 -4.790 1.354 1.00 0.00 H new ATOM 0 HB3 LEU A 90 10.539 -3.751 2.569 1.00 0.00 H new ATOM 0 HG LEU A 90 13.491 -4.168 2.039 1.00 0.00 H new ATOM 0 HD11 LEU A 90 13.467 -1.776 1.476 1.00 0.00 H new ATOM 0 HD12 LEU A 90 12.391 -2.723 0.422 1.00 0.00 H new ATOM 0 HD13 LEU A 90 11.707 -1.737 1.736 1.00 0.00 H new ATOM 0 HD21 LEU A 90 13.909 -2.515 3.809 1.00 0.00 H new ATOM 0 HD22 LEU A 90 12.178 -2.525 4.221 1.00 0.00 H new ATOM 0 HD23 LEU A 90 13.153 -3.997 4.442 1.00 0.00 H new ATOM 1449 N ALA A 91 8.941 -5.573 3.514 1.00 0.00 N ATOM 1450 CA ALA A 91 7.609 -6.155 3.531 1.00 0.00 C ATOM 1451 C ALA A 91 6.578 -5.050 3.770 1.00 0.00 C ATOM 1452 O ALA A 91 6.662 -4.321 4.757 1.00 0.00 O ATOM 1453 CB ALA A 91 7.545 -7.252 4.596 1.00 0.00 C ATOM 0 H ALA A 91 8.966 -4.562 3.646 1.00 0.00 H new ATOM 0 HA ALA A 91 7.380 -6.618 2.571 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.546 -7.689 4.609 1.00 0.00 H new ATOM 0 HB2 ALA A 91 8.277 -8.026 4.365 1.00 0.00 H new ATOM 0 HB3 ALA A 91 7.766 -6.823 5.573 1.00 0.00 H new ATOM 1459 N LEU A 92 5.629 -4.962 2.850 1.00 0.00 N ATOM 1460 CA LEU A 92 4.583 -3.958 2.948 1.00 0.00 C ATOM 1461 C LEU A 92 3.423 -4.516 3.776 1.00 0.00 C ATOM 1462 O LEU A 92 2.955 -5.626 3.527 1.00 0.00 O ATOM 1463 CB LEU A 92 4.168 -3.479 1.556 1.00 0.00 C ATOM 1464 CG LEU A 92 5.298 -2.970 0.658 1.00 0.00 C ATOM 1465 CD1 LEU A 92 6.452 -2.411 1.492 1.00 0.00 C ATOM 1466 CD2 LEU A 92 5.765 -4.061 -0.307 1.00 0.00 C ATOM 0 H LEU A 92 5.562 -5.569 2.033 1.00 0.00 H new ATOM 0 HA LEU A 92 4.952 -3.074 3.468 1.00 0.00 H new ATOM 0 HB2 LEU A 92 3.667 -4.301 1.045 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.435 -2.681 1.672 1.00 0.00 H new ATOM 0 HG LEU A 92 4.910 -2.150 0.054 1.00 0.00 H new ATOM 0 HD11 LEU A 92 7.241 -2.056 0.829 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.092 -1.583 2.103 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.846 -3.195 2.139 1.00 0.00 H new ATOM 0 HD21 LEU A 92 6.568 -3.673 -0.933 1.00 0.00 H new ATOM 0 HD22 LEU A 92 6.129 -4.917 0.261 1.00 0.00 H new ATOM 0 HD23 LEU A 92 4.931 -4.371 -0.937 1.00 0.00 H new ATOM 1478 N HIS A 93 2.994 -3.720 4.745 1.00 0.00 N ATOM 1479 CA HIS A 93 1.898 -4.121 5.612 1.00 0.00 C ATOM 1480 C HIS A 93 0.676 -3.245 5.331 1.00 0.00 C ATOM 1481 O HIS A 93 0.630 -2.086 5.742 1.00 0.00 O ATOM 1482 CB HIS A 93 2.327 -4.087 7.080 1.00 0.00 C ATOM 1483 CG HIS A 93 1.302 -4.655 8.032 1.00 0.00 C ATOM 1484 ND1 HIS A 93 0.700 -3.900 9.023 1.00 0.00 N ATOM 1485 CD2 HIS A 93 0.779 -5.911 8.133 1.00 0.00 C ATOM 1486 CE1 HIS A 93 -0.145 -4.677 9.686 1.00 0.00 C ATOM 1487 NE2 HIS A 93 -0.094 -5.923 9.133 1.00 0.00 N ATOM 0 H HIS A 93 3.385 -2.800 4.949 1.00 0.00 H new ATOM 0 HA HIS A 93 1.619 -5.153 5.399 1.00 0.00 H new ATOM 0 HB2 HIS A 93 3.257 -4.644 7.189 1.00 0.00 H new ATOM 0 HB3 HIS A 93 2.538 -3.056 7.363 1.00 0.00 H new ATOM 0 HD2 HIS A 93 1.032 -6.753 7.506 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -0.765 -4.376 10.518 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -0.637 -6.731 9.438 1.00 0.00 H new ATOM 1495 N PHE A 94 -0.285 -3.832 4.633 1.00 0.00 N ATOM 1496 CA PHE A 94 -1.505 -3.120 4.292 1.00 0.00 C ATOM 1497 C PHE A 94 -2.620 -3.433 5.292 1.00 0.00 C ATOM 1498 O PHE A 94 -3.155 -4.541 5.303 1.00 0.00 O ATOM 1499 CB PHE A 94 -1.931 -3.601 2.904 1.00 0.00 C ATOM 1500 CG PHE A 94 -0.855 -3.430 1.829 1.00 0.00 C ATOM 1501 CD1 PHE A 94 -0.302 -2.207 1.609 1.00 0.00 C ATOM 1502 CD2 PHE A 94 -0.453 -4.501 1.093 1.00 0.00 C ATOM 1503 CE1 PHE A 94 0.696 -2.049 0.612 1.00 0.00 C ATOM 1504 CE2 PHE A 94 0.545 -4.342 0.096 1.00 0.00 C ATOM 1505 CZ PHE A 94 1.099 -3.119 -0.124 1.00 0.00 C ATOM 0 H PHE A 94 -0.243 -4.793 4.294 1.00 0.00 H new ATOM 0 HA PHE A 94 -1.326 -2.045 4.313 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -2.206 -4.654 2.964 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -2.824 -3.055 2.600 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -0.622 -1.356 2.193 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -0.893 -5.472 1.267 1.00 0.00 H new ATOM 0 HE1 PHE A 94 1.136 -1.078 0.438 1.00 0.00 H new ATOM 0 HE2 PHE A 94 0.865 -5.192 -0.488 1.00 0.00 H new ATOM 0 HZ PHE A 94 1.858 -2.998 -0.883 1.00 0.00 H new ATOM 1515 N THR A 95 -2.937 -2.438 6.107 1.00 0.00 N ATOM 1516 CA THR A 95 -3.979 -2.594 7.108 1.00 0.00 C ATOM 1517 C THR A 95 -5.273 -1.924 6.640 1.00 0.00 C ATOM 1518 O THR A 95 -5.290 -0.726 6.362 1.00 0.00 O ATOM 1519 CB THR A 95 -3.451 -2.036 8.431 1.00 0.00 C ATOM 1520 OG1 THR A 95 -2.254 -2.774 8.665 1.00 0.00 O ATOM 1521 CG2 THR A 95 -4.348 -2.395 9.617 1.00 0.00 C ATOM 0 H THR A 95 -2.491 -1.521 6.095 1.00 0.00 H new ATOM 0 HA THR A 95 -4.229 -3.644 7.258 1.00 0.00 H new ATOM 0 HB THR A 95 -3.362 -0.952 8.359 1.00 0.00 H new ATOM 0 HG1 THR A 95 -1.844 -2.475 9.503 1.00 0.00 H new ATOM 0 HG21 THR A 95 -3.928 -1.975 10.531 1.00 0.00 H new ATOM 0 HG22 THR A 95 -5.346 -1.987 9.455 1.00 0.00 H new ATOM 0 HG23 THR A 95 -4.410 -3.479 9.711 1.00 0.00 H new ATOM 1529 N ILE A 96 -6.324 -2.727 6.566 1.00 0.00 N ATOM 1530 CA ILE A 96 -7.619 -2.228 6.137 1.00 0.00 C ATOM 1531 C ILE A 96 -8.363 -1.649 7.342 1.00 0.00 C ATOM 1532 O ILE A 96 -9.108 -2.360 8.015 1.00 0.00 O ATOM 1533 CB ILE A 96 -8.397 -3.319 5.399 1.00 0.00 C ATOM 1534 CG1 ILE A 96 -7.623 -3.813 4.175 1.00 0.00 C ATOM 1535 CG2 ILE A 96 -9.803 -2.839 5.034 1.00 0.00 C ATOM 1536 CD1 ILE A 96 -6.377 -4.597 4.593 1.00 0.00 C ATOM 0 H ILE A 96 -6.305 -3.721 6.796 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.495 -1.417 5.419 1.00 0.00 H new ATOM 0 HB ILE A 96 -8.512 -4.170 6.071 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -8.267 -4.446 3.564 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.332 -2.963 3.557 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.334 -3.634 4.510 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -10.345 -2.577 5.943 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -9.732 -1.963 4.389 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.845 -4.936 3.704 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.724 -3.954 5.183 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -6.673 -5.459 5.190 1.00 0.00 H new ATOM 1548 N LEU A 97 -8.136 -0.365 7.577 1.00 0.00 N ATOM 1549 CA LEU A 97 -8.776 0.316 8.689 1.00 0.00 C ATOM 1550 C LEU A 97 -10.041 1.018 8.192 1.00 0.00 C ATOM 1551 O LEU A 97 -10.507 0.754 7.085 1.00 0.00 O ATOM 1552 CB LEU A 97 -7.786 1.254 9.384 1.00 0.00 C ATOM 1553 CG LEU A 97 -6.525 0.598 9.951 1.00 0.00 C ATOM 1554 CD1 LEU A 97 -5.355 0.724 8.973 1.00 0.00 C ATOM 1555 CD2 LEU A 97 -6.184 1.165 11.330 1.00 0.00 C ATOM 0 H LEU A 97 -7.518 0.221 7.016 1.00 0.00 H new ATOM 0 HA LEU A 97 -9.086 -0.403 9.448 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -7.483 2.022 8.672 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -8.306 1.760 10.198 1.00 0.00 H new ATOM 0 HG LEU A 97 -6.722 -0.466 10.081 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -4.471 0.250 9.400 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -5.612 0.234 8.034 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -5.148 1.778 8.788 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -5.284 0.682 11.710 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -6.013 2.239 11.250 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -7.012 0.980 12.014 1.00 0.00 H new ATOM 1567 N SER A 98 -10.562 1.897 9.035 1.00 0.00 N ATOM 1568 CA SER A 98 -11.765 2.638 8.695 1.00 0.00 C ATOM 1569 C SER A 98 -11.828 3.934 9.506 1.00 0.00 C ATOM 1570 O SER A 98 -11.511 3.942 10.695 1.00 0.00 O ATOM 1571 CB SER A 98 -13.018 1.796 8.941 1.00 0.00 C ATOM 1572 OG SER A 98 -14.213 2.541 8.720 1.00 0.00 O ATOM 0 H SER A 98 -10.173 2.113 9.953 1.00 0.00 H new ATOM 0 HA SER A 98 -11.728 2.883 7.634 1.00 0.00 H new ATOM 0 HB2 SER A 98 -13.006 0.927 8.283 1.00 0.00 H new ATOM 0 HB3 SER A 98 -13.008 1.422 9.965 1.00 0.00 H new ATOM 0 HG SER A 98 -14.577 2.838 9.580 1.00 0.00 H new ATOM 1701 N ASP A 106 -11.139 1.260 13.023 1.00 0.00 N ATOM 1702 CA ASP A 106 -11.889 0.029 12.839 1.00 0.00 C ATOM 1703 C ASP A 106 -11.156 -0.865 11.836 1.00 0.00 C ATOM 1704 O ASP A 106 -11.447 -0.832 10.642 1.00 0.00 O ATOM 1705 CB ASP A 106 -13.287 0.313 12.284 1.00 0.00 C ATOM 1706 CG ASP A 106 -14.435 0.061 13.264 1.00 0.00 C ATOM 1707 OD1 ASP A 106 -14.137 -0.439 14.370 1.00 0.00 O ATOM 1708 OD2 ASP A 106 -15.584 0.374 12.884 1.00 0.00 O ATOM 0 HA ASP A 106 -11.978 -0.459 13.809 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -13.328 1.353 11.959 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -13.443 -0.304 11.399 1.00 0.00 H new ATOM 1713 N ILE A 107 -10.219 -1.642 12.360 1.00 0.00 N ATOM 1714 CA ILE A 107 -9.442 -2.542 11.526 1.00 0.00 C ATOM 1715 C ILE A 107 -10.361 -3.626 10.959 1.00 0.00 C ATOM 1716 O ILE A 107 -10.796 -4.519 11.685 1.00 0.00 O ATOM 1717 CB ILE A 107 -8.246 -3.095 12.304 1.00 0.00 C ATOM 1718 CG1 ILE A 107 -7.126 -2.057 12.399 1.00 0.00 C ATOM 1719 CG2 ILE A 107 -7.757 -4.411 11.695 1.00 0.00 C ATOM 1720 CD1 ILE A 107 -6.143 -2.412 13.516 1.00 0.00 C ATOM 0 H ILE A 107 -9.981 -1.666 13.352 1.00 0.00 H new ATOM 0 HA ILE A 107 -9.020 -2.005 10.677 1.00 0.00 H new ATOM 0 HB ILE A 107 -8.571 -3.312 13.321 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -6.596 -2.000 11.448 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -7.553 -1.072 12.585 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -6.907 -4.783 12.267 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -8.562 -5.146 11.722 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -7.454 -4.243 10.661 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -5.357 -1.658 13.562 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -6.671 -2.444 14.469 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -5.699 -3.387 13.314 1.00 0.00 H new ATOM 1732 N ILE A 108 -10.630 -3.513 9.667 1.00 0.00 N ATOM 1733 CA ILE A 108 -11.490 -4.472 8.994 1.00 0.00 C ATOM 1734 C ILE A 108 -10.721 -5.778 8.782 1.00 0.00 C ATOM 1735 O ILE A 108 -11.290 -6.863 8.895 1.00 0.00 O ATOM 1736 CB ILE A 108 -12.054 -3.874 7.704 1.00 0.00 C ATOM 1737 CG1 ILE A 108 -12.960 -2.678 8.004 1.00 0.00 C ATOM 1738 CG2 ILE A 108 -12.769 -4.940 6.872 1.00 0.00 C ATOM 1739 CD1 ILE A 108 -12.756 -1.563 6.977 1.00 0.00 C ATOM 0 H ILE A 108 -10.267 -2.772 9.068 1.00 0.00 H new ATOM 0 HA ILE A 108 -12.356 -4.708 9.613 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.221 -3.505 7.106 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -14.002 -2.997 7.998 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -12.749 -2.299 9.004 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -13.160 -4.488 5.961 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -12.065 -5.731 6.612 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -13.591 -5.362 7.450 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -13.412 -0.725 7.214 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -11.718 -1.230 7.003 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -12.992 -1.938 5.981 1.00 0.00 H new ATOM 1751 N GLY A 109 -9.440 -5.631 8.478 1.00 0.00 N ATOM 1752 CA GLY A 109 -8.588 -6.785 8.249 1.00 0.00 C ATOM 1753 C GLY A 109 -7.116 -6.375 8.181 1.00 0.00 C ATOM 1754 O GLY A 109 -6.789 -5.197 8.321 1.00 0.00 O ATOM 0 H GLY A 109 -8.971 -4.730 8.385 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -8.730 -7.511 9.049 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -8.876 -7.275 7.319 1.00 0.00 H new ATOM 1758 N GLU A 110 -6.267 -7.369 7.967 1.00 0.00 N ATOM 1759 CA GLU A 110 -4.837 -7.126 7.879 1.00 0.00 C ATOM 1760 C GLU A 110 -4.252 -7.838 6.657 1.00 0.00 C ATOM 1761 O GLU A 110 -4.611 -8.978 6.367 1.00 0.00 O ATOM 1762 CB GLU A 110 -4.126 -7.564 9.161 1.00 0.00 C ATOM 1763 CG GLU A 110 -4.612 -6.751 10.362 1.00 0.00 C ATOM 1764 CD GLU A 110 -3.435 -6.296 11.228 1.00 0.00 C ATOM 1765 OE1 GLU A 110 -2.392 -6.982 11.174 1.00 0.00 O ATOM 1766 OE2 GLU A 110 -3.606 -5.272 11.925 1.00 0.00 O ATOM 0 H GLU A 110 -6.542 -8.345 7.852 1.00 0.00 H new ATOM 0 HA GLU A 110 -4.677 -6.054 7.762 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.307 -8.624 9.338 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -3.049 -7.440 9.045 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -5.171 -5.882 10.015 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -5.297 -7.352 10.960 1.00 0.00 H new ATOM 1773 N VAL A 111 -3.360 -7.135 5.974 1.00 0.00 N ATOM 1774 CA VAL A 111 -2.722 -7.685 4.790 1.00 0.00 C ATOM 1775 C VAL A 111 -1.210 -7.463 4.881 1.00 0.00 C ATOM 1776 O VAL A 111 -0.757 -6.499 5.495 1.00 0.00 O ATOM 1777 CB VAL A 111 -3.341 -7.076 3.531 1.00 0.00 C ATOM 1778 CG1 VAL A 111 -2.412 -7.244 2.327 1.00 0.00 C ATOM 1779 CG2 VAL A 111 -4.718 -7.680 3.249 1.00 0.00 C ATOM 0 H VAL A 111 -3.064 -6.190 6.218 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.890 -8.760 4.730 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.473 -6.008 3.706 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -2.876 -6.802 1.445 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.464 -6.745 2.527 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -2.233 -8.305 2.150 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -5.136 -7.229 2.349 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -4.621 -8.756 3.105 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -5.380 -7.486 4.093 1.00 0.00 H new ATOM 1789 N LEU A 112 -0.473 -8.372 4.260 1.00 0.00 N ATOM 1790 CA LEU A 112 0.978 -8.288 4.263 1.00 0.00 C ATOM 1791 C LEU A 112 1.521 -8.877 2.960 1.00 0.00 C ATOM 1792 O LEU A 112 0.981 -9.854 2.443 1.00 0.00 O ATOM 1793 CB LEU A 112 1.550 -8.945 5.521 1.00 0.00 C ATOM 1794 CG LEU A 112 3.076 -9.013 5.607 1.00 0.00 C ATOM 1795 CD1 LEU A 112 3.645 -7.756 6.267 1.00 0.00 C ATOM 1796 CD2 LEU A 112 3.529 -10.289 6.319 1.00 0.00 C ATOM 0 H LEU A 112 -0.853 -9.170 3.751 1.00 0.00 H new ATOM 0 HA LEU A 112 1.300 -7.247 4.301 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.181 -8.402 6.391 1.00 0.00 H new ATOM 0 HB3 LEU A 112 1.156 -9.959 5.588 1.00 0.00 H new ATOM 0 HG LEU A 112 3.473 -9.052 4.593 1.00 0.00 H new ATOM 0 HD11 LEU A 112 4.731 -7.830 6.315 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.367 -6.880 5.681 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.243 -7.661 7.275 1.00 0.00 H new ATOM 0 HD21 LEU A 112 4.618 -10.312 6.366 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.121 -10.306 7.330 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.171 -11.159 5.769 1.00 0.00 H new ATOM 1808 N ILE A 113 2.584 -8.259 2.467 1.00 0.00 N ATOM 1809 CA ILE A 113 3.207 -8.710 1.234 1.00 0.00 C ATOM 1810 C ILE A 113 4.728 -8.614 1.371 1.00 0.00 C ATOM 1811 O ILE A 113 5.304 -7.542 1.193 1.00 0.00 O ATOM 1812 CB ILE A 113 2.647 -7.938 0.037 1.00 0.00 C ATOM 1813 CG1 ILE A 113 2.612 -8.818 -1.214 1.00 0.00 C ATOM 1814 CG2 ILE A 113 3.429 -6.643 -0.194 1.00 0.00 C ATOM 1815 CD1 ILE A 113 1.352 -9.686 -1.239 1.00 0.00 C ATOM 0 H ILE A 113 3.030 -7.450 2.899 1.00 0.00 H new ATOM 0 HA ILE A 113 2.969 -9.757 1.048 1.00 0.00 H new ATOM 0 HB ILE A 113 1.618 -7.657 0.262 1.00 0.00 H new ATOM 0 HG12 ILE A 113 2.644 -8.191 -2.105 1.00 0.00 H new ATOM 0 HG13 ILE A 113 3.497 -9.454 -1.240 1.00 0.00 H new ATOM 0 HG21 ILE A 113 3.011 -6.113 -1.050 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.359 -6.013 0.692 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.475 -6.879 -0.389 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.352 -10.302 -2.138 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.336 -10.329 -0.359 1.00 0.00 H new ATOM 0 HD13 ILE A 113 0.469 -9.046 -1.237 1.00 0.00 H new ATOM 1827 N PRO A 114 5.351 -9.779 1.694 1.00 0.00 N ATOM 1828 CA PRO A 114 6.794 -9.836 1.857 1.00 0.00 C ATOM 1829 C PRO A 114 7.501 -9.794 0.501 1.00 0.00 C ATOM 1830 O PRO A 114 7.182 -10.576 -0.394 1.00 0.00 O ATOM 1831 CB PRO A 114 7.053 -11.123 2.622 1.00 0.00 C ATOM 1832 CG PRO A 114 5.800 -11.967 2.454 1.00 0.00 C ATOM 1833 CD PRO A 114 4.701 -11.068 1.913 1.00 0.00 C ATOM 0 HA PRO A 114 7.190 -8.978 2.401 1.00 0.00 H new ATOM 0 HB2 PRO A 114 7.928 -11.641 2.230 1.00 0.00 H new ATOM 0 HB3 PRO A 114 7.248 -10.919 3.675 1.00 0.00 H new ATOM 0 HG2 PRO A 114 5.987 -12.795 1.770 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.502 -12.402 3.408 1.00 0.00 H new ATOM 0 HD2 PRO A 114 4.285 -11.464 0.987 1.00 0.00 H new ATOM 0 HD3 PRO A 114 3.877 -10.981 2.621 1.00 0.00 H new ATOM 1841 N LEU A 115 8.447 -8.873 0.391 1.00 0.00 N ATOM 1842 CA LEU A 115 9.201 -8.719 -0.842 1.00 0.00 C ATOM 1843 C LEU A 115 10.408 -9.660 -0.816 1.00 0.00 C ATOM 1844 O LEU A 115 11.333 -9.510 -1.614 1.00 0.00 O ATOM 1845 CB LEU A 115 9.571 -7.251 -1.064 1.00 0.00 C ATOM 1846 CG LEU A 115 8.437 -6.239 -0.881 1.00 0.00 C ATOM 1847 CD1 LEU A 115 8.945 -4.808 -1.064 1.00 0.00 C ATOM 1848 CD2 LEU A 115 7.265 -6.555 -1.812 1.00 0.00 C ATOM 0 H LEU A 115 8.709 -8.226 1.135 1.00 0.00 H new ATOM 0 HA LEU A 115 8.592 -9.003 -1.700 1.00 0.00 H new ATOM 0 HB2 LEU A 115 10.377 -6.992 -0.377 1.00 0.00 H new ATOM 0 HB3 LEU A 115 9.967 -7.145 -2.074 1.00 0.00 H new ATOM 0 HG LEU A 115 8.067 -6.321 0.141 1.00 0.00 H new ATOM 0 HD11 LEU A 115 8.120 -4.109 -0.929 1.00 0.00 H new ATOM 0 HD12 LEU A 115 9.721 -4.600 -0.327 1.00 0.00 H new ATOM 0 HD13 LEU A 115 9.357 -4.694 -2.067 1.00 0.00 H new ATOM 0 HD21 LEU A 115 6.473 -5.821 -1.662 1.00 0.00 H new ATOM 0 HD22 LEU A 115 7.603 -6.518 -2.848 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.883 -7.552 -1.591 1.00 0.00 H new ATOM 1860 N SER A 116 10.360 -10.608 0.107 1.00 0.00 N ATOM 1861 CA SER A 116 11.437 -11.573 0.247 1.00 0.00 C ATOM 1862 C SER A 116 11.345 -12.624 -0.861 1.00 0.00 C ATOM 1863 O SER A 116 11.304 -13.822 -0.583 1.00 0.00 O ATOM 1864 CB SER A 116 11.401 -12.245 1.621 1.00 0.00 C ATOM 1865 OG SER A 116 12.672 -12.215 2.264 1.00 0.00 O ATOM 0 H SER A 116 9.591 -10.729 0.766 1.00 0.00 H new ATOM 0 HA SER A 116 12.385 -11.042 0.158 1.00 0.00 H new ATOM 0 HB2 SER A 116 10.665 -11.745 2.250 1.00 0.00 H new ATOM 0 HB3 SER A 116 11.075 -13.279 1.510 1.00 0.00 H new ATOM 0 HG SER A 116 12.895 -11.292 2.504 1.00 0.00 H new ATOM 1871 N GLY A 117 11.314 -12.138 -2.093 1.00 0.00 N ATOM 1872 CA GLY A 117 11.227 -13.022 -3.244 1.00 0.00 C ATOM 1873 C GLY A 117 10.801 -12.251 -4.495 1.00 0.00 C ATOM 1874 O GLY A 117 11.132 -12.644 -5.613 1.00 0.00 O ATOM 0 H GLY A 117 11.348 -11.144 -2.320 1.00 0.00 H new ATOM 0 HA2 GLY A 117 12.193 -13.497 -3.416 1.00 0.00 H new ATOM 0 HA3 GLY A 117 10.511 -13.819 -3.042 1.00 0.00 H new ATOM 1878 N ILE A 118 10.073 -11.168 -4.265 1.00 0.00 N ATOM 1879 CA ILE A 118 9.599 -10.339 -5.360 1.00 0.00 C ATOM 1880 C ILE A 118 10.787 -9.917 -6.226 1.00 0.00 C ATOM 1881 O ILE A 118 11.937 -10.030 -5.806 1.00 0.00 O ATOM 1882 CB ILE A 118 8.779 -9.163 -4.825 1.00 0.00 C ATOM 1883 CG1 ILE A 118 7.364 -9.608 -4.449 1.00 0.00 C ATOM 1884 CG2 ILE A 118 8.769 -8.003 -5.823 1.00 0.00 C ATOM 1885 CD1 ILE A 118 6.670 -10.289 -5.630 1.00 0.00 C ATOM 0 H ILE A 118 9.800 -10.846 -3.337 1.00 0.00 H new ATOM 0 HA ILE A 118 8.922 -10.904 -6.001 1.00 0.00 H new ATOM 0 HB ILE A 118 9.255 -8.800 -3.914 1.00 0.00 H new ATOM 0 HG12 ILE A 118 7.408 -10.295 -3.604 1.00 0.00 H new ATOM 0 HG13 ILE A 118 6.781 -8.745 -4.129 1.00 0.00 H new ATOM 0 HG21 ILE A 118 8.179 -7.180 -5.419 1.00 0.00 H new ATOM 0 HG22 ILE A 118 9.790 -7.665 -5.999 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.330 -8.336 -6.763 1.00 0.00 H new ATOM 0 HD11 ILE A 118 5.666 -10.595 -5.335 1.00 0.00 H new ATOM 0 HD12 ILE A 118 6.606 -9.592 -6.466 1.00 0.00 H new ATOM 0 HD13 ILE A 118 7.243 -11.166 -5.932 1.00 0.00 H new ATOM 1897 N GLU A 119 10.468 -9.438 -7.420 1.00 0.00 N ATOM 1898 CA GLU A 119 11.495 -8.998 -8.349 1.00 0.00 C ATOM 1899 C GLU A 119 10.978 -7.837 -9.201 1.00 0.00 C ATOM 1900 O GLU A 119 10.212 -8.045 -10.141 1.00 0.00 O ATOM 1901 CB GLU A 119 11.969 -10.156 -9.230 1.00 0.00 C ATOM 1902 CG GLU A 119 13.215 -10.819 -8.640 1.00 0.00 C ATOM 1903 CD GLU A 119 13.593 -12.075 -9.428 1.00 0.00 C ATOM 1904 OE1 GLU A 119 12.878 -13.086 -9.260 1.00 0.00 O ATOM 1905 OE2 GLU A 119 14.588 -11.995 -10.180 1.00 0.00 O ATOM 0 H GLU A 119 9.513 -9.345 -7.765 1.00 0.00 H new ATOM 0 HA GLU A 119 12.352 -8.647 -7.774 1.00 0.00 H new ATOM 0 HB2 GLU A 119 11.172 -10.893 -9.328 1.00 0.00 H new ATOM 0 HB3 GLU A 119 12.188 -9.789 -10.233 1.00 0.00 H new ATOM 0 HG2 GLU A 119 14.046 -10.114 -8.652 1.00 0.00 H new ATOM 0 HG3 GLU A 119 13.033 -11.080 -7.598 1.00 0.00 H new ATOM 1912 N LEU A 120 11.416 -6.640 -8.841 1.00 0.00 N ATOM 1913 CA LEU A 120 11.008 -5.445 -9.560 1.00 0.00 C ATOM 1914 C LEU A 120 12.160 -4.971 -10.448 1.00 0.00 C ATOM 1915 O LEU A 120 12.430 -3.774 -10.532 1.00 0.00 O ATOM 1916 CB LEU A 120 10.503 -4.380 -8.585 1.00 0.00 C ATOM 1917 CG LEU A 120 9.531 -4.863 -7.507 1.00 0.00 C ATOM 1918 CD1 LEU A 120 8.623 -5.971 -8.044 1.00 0.00 C ATOM 1919 CD2 LEU A 120 10.283 -5.299 -6.247 1.00 0.00 C ATOM 0 H LEU A 120 12.050 -6.472 -8.060 1.00 0.00 H new ATOM 0 HA LEU A 120 10.168 -5.664 -10.219 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.365 -3.929 -8.093 1.00 0.00 H new ATOM 0 HB3 LEU A 120 10.015 -3.592 -9.159 1.00 0.00 H new ATOM 0 HG LEU A 120 8.889 -4.028 -7.227 1.00 0.00 H new ATOM 0 HD11 LEU A 120 7.942 -6.296 -7.258 1.00 0.00 H new ATOM 0 HD12 LEU A 120 8.048 -5.592 -8.889 1.00 0.00 H new ATOM 0 HD13 LEU A 120 9.232 -6.815 -8.369 1.00 0.00 H new ATOM 0 HD21 LEU A 120 9.569 -5.638 -5.496 1.00 0.00 H new ATOM 0 HD22 LEU A 120 10.964 -6.113 -6.493 1.00 0.00 H new ATOM 0 HD23 LEU A 120 10.852 -4.457 -5.853 1.00 0.00 H new ATOM 1931 N SER A 121 12.808 -5.934 -11.087 1.00 0.00 N ATOM 1932 CA SER A 121 13.925 -5.629 -11.965 1.00 0.00 C ATOM 1933 C SER A 121 13.440 -4.812 -13.164 1.00 0.00 C ATOM 1934 O SER A 121 13.414 -5.310 -14.289 1.00 0.00 O ATOM 1935 CB SER A 121 14.618 -6.908 -12.439 1.00 0.00 C ATOM 1936 OG SER A 121 13.761 -7.711 -13.246 1.00 0.00 O ATOM 0 H SER A 121 12.581 -6.926 -11.014 1.00 0.00 H new ATOM 0 HA SER A 121 14.651 -5.042 -11.403 1.00 0.00 H new ATOM 0 HB2 SER A 121 15.511 -6.647 -13.007 1.00 0.00 H new ATOM 0 HB3 SER A 121 14.947 -7.484 -11.574 1.00 0.00 H new ATOM 0 HG SER A 121 13.332 -7.150 -13.926 1.00 0.00 H new ATOM 1942 N GLU A 122 13.067 -3.572 -12.884 1.00 0.00 N ATOM 1943 CA GLU A 122 12.585 -2.682 -13.926 1.00 0.00 C ATOM 1944 C GLU A 122 11.265 -3.202 -14.499 1.00 0.00 C ATOM 1945 O GLU A 122 10.775 -2.688 -15.503 1.00 0.00 O ATOM 1946 CB GLU A 122 13.631 -2.510 -15.028 1.00 0.00 C ATOM 1947 CG GLU A 122 14.502 -1.279 -14.770 1.00 0.00 C ATOM 1948 CD GLU A 122 15.197 -0.819 -16.053 1.00 0.00 C ATOM 1949 OE1 GLU A 122 15.770 -1.698 -16.734 1.00 0.00 O ATOM 1950 OE2 GLU A 122 15.140 0.399 -16.325 1.00 0.00 O ATOM 0 H GLU A 122 13.089 -3.163 -11.950 1.00 0.00 H new ATOM 0 HA GLU A 122 12.406 -1.701 -13.485 1.00 0.00 H new ATOM 0 HB2 GLU A 122 14.259 -3.400 -15.080 1.00 0.00 H new ATOM 0 HB3 GLU A 122 13.135 -2.413 -15.994 1.00 0.00 H new ATOM 0 HG2 GLU A 122 13.887 -0.470 -14.376 1.00 0.00 H new ATOM 0 HG3 GLU A 122 15.249 -1.511 -14.011 1.00 0.00 H new ATOM 1957 N GLY A 123 10.727 -4.215 -13.836 1.00 0.00 N ATOM 1958 CA GLY A 123 9.474 -4.811 -14.267 1.00 0.00 C ATOM 1959 C GLY A 123 8.392 -4.645 -13.198 1.00 0.00 C ATOM 1960 O GLY A 123 8.512 -5.184 -12.099 1.00 0.00 O ATOM 0 H GLY A 123 11.136 -4.638 -13.003 1.00 0.00 H new ATOM 0 HA2 GLY A 123 9.146 -4.345 -15.197 1.00 0.00 H new ATOM 0 HA3 GLY A 123 9.624 -5.870 -14.476 1.00 0.00 H new ATOM 1964 N LYS A 124 7.359 -3.898 -13.558 1.00 0.00 N ATOM 1965 CA LYS A 124 6.256 -3.654 -12.644 1.00 0.00 C ATOM 1966 C LYS A 124 5.279 -4.830 -12.706 1.00 0.00 C ATOM 1967 O LYS A 124 4.729 -5.130 -13.765 1.00 0.00 O ATOM 1968 CB LYS A 124 5.608 -2.299 -12.935 1.00 0.00 C ATOM 1969 CG LYS A 124 4.463 -2.019 -11.959 1.00 0.00 C ATOM 1970 CD LYS A 124 3.377 -1.166 -12.619 1.00 0.00 C ATOM 1971 CE LYS A 124 2.075 -1.956 -12.768 1.00 0.00 C ATOM 1972 NZ LYS A 124 0.953 -1.049 -13.099 1.00 0.00 N ATOM 0 H LYS A 124 7.262 -3.453 -14.471 1.00 0.00 H new ATOM 0 HA LYS A 124 6.618 -3.593 -11.618 1.00 0.00 H new ATOM 0 HB2 LYS A 124 6.356 -1.510 -12.860 1.00 0.00 H new ATOM 0 HB3 LYS A 124 5.231 -2.284 -13.958 1.00 0.00 H new ATOM 0 HG2 LYS A 124 4.033 -2.961 -11.617 1.00 0.00 H new ATOM 0 HG3 LYS A 124 4.848 -1.506 -11.078 1.00 0.00 H new ATOM 0 HD2 LYS A 124 3.198 -0.272 -12.021 1.00 0.00 H new ATOM 0 HD3 LYS A 124 3.718 -0.831 -13.599 1.00 0.00 H new ATOM 0 HE2 LYS A 124 2.186 -2.707 -13.550 1.00 0.00 H new ATOM 0 HE3 LYS A 124 1.858 -2.489 -11.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 0.077 -1.601 -13.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 0.837 -0.348 -12.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 1.155 -0.559 -13.994 1.00 0.00 H new ATOM 1986 N MET A 125 5.092 -5.464 -11.557 1.00 0.00 N ATOM 1987 CA MET A 125 4.190 -6.600 -11.468 1.00 0.00 C ATOM 1988 C MET A 125 2.970 -6.265 -10.608 1.00 0.00 C ATOM 1989 O MET A 125 3.085 -5.553 -9.611 1.00 0.00 O ATOM 1990 CB MET A 125 4.931 -7.793 -10.861 1.00 0.00 C ATOM 1991 CG MET A 125 5.152 -7.595 -9.360 1.00 0.00 C ATOM 1992 SD MET A 125 5.726 -9.116 -8.622 1.00 0.00 S ATOM 1993 CE MET A 125 7.412 -9.128 -9.207 1.00 0.00 C ATOM 0 H MET A 125 5.549 -5.213 -10.681 1.00 0.00 H new ATOM 0 HA MET A 125 3.846 -6.847 -12.472 1.00 0.00 H new ATOM 0 HB2 MET A 125 4.359 -8.705 -11.031 1.00 0.00 H new ATOM 0 HB3 MET A 125 5.892 -7.921 -11.360 1.00 0.00 H new ATOM 0 HG2 MET A 125 5.881 -6.802 -9.193 1.00 0.00 H new ATOM 0 HG3 MET A 125 4.223 -7.279 -8.886 1.00 0.00 H new ATOM 0 HE1 MET A 125 7.964 -9.926 -8.711 1.00 0.00 H new ATOM 0 HE2 MET A 125 7.422 -9.295 -10.284 1.00 0.00 H new ATOM 0 HE3 MET A 125 7.881 -8.170 -8.984 1.00 0.00 H new ATOM 2003 N LEU A 126 1.829 -6.794 -11.024 1.00 0.00 N ATOM 2004 CA LEU A 126 0.589 -6.560 -10.304 1.00 0.00 C ATOM 2005 C LEU A 126 0.380 -7.677 -9.280 1.00 0.00 C ATOM 2006 O LEU A 126 0.657 -8.842 -9.561 1.00 0.00 O ATOM 2007 CB LEU A 126 -0.576 -6.398 -11.283 1.00 0.00 C ATOM 2008 CG LEU A 126 -1.741 -5.531 -10.801 1.00 0.00 C ATOM 2009 CD1 LEU A 126 -2.357 -6.101 -9.522 1.00 0.00 C ATOM 2010 CD2 LEU A 126 -1.305 -4.074 -10.627 1.00 0.00 C ATOM 0 H LEU A 126 1.737 -7.384 -11.851 1.00 0.00 H new ATOM 0 HA LEU A 126 0.642 -5.624 -9.749 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -0.190 -5.971 -12.209 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -0.962 -7.388 -11.525 1.00 0.00 H new ATOM 0 HG LEU A 126 -2.517 -5.546 -11.566 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.183 -5.466 -9.201 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -2.727 -7.108 -9.714 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -1.600 -6.136 -8.738 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -2.152 -3.479 -10.284 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -0.502 -4.020 -9.892 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -0.951 -3.684 -11.581 1.00 0.00 H new ATOM 2022 N MET A 127 -0.106 -7.282 -8.112 1.00 0.00 N ATOM 2023 CA MET A 127 -0.355 -8.235 -7.044 1.00 0.00 C ATOM 2024 C MET A 127 -1.634 -7.884 -6.283 1.00 0.00 C ATOM 2025 O MET A 127 -2.060 -6.730 -6.276 1.00 0.00 O ATOM 2026 CB MET A 127 0.831 -8.239 -6.077 1.00 0.00 C ATOM 2027 CG MET A 127 2.125 -8.626 -6.796 1.00 0.00 C ATOM 2028 SD MET A 127 3.043 -9.799 -5.812 1.00 0.00 S ATOM 2029 CE MET A 127 3.260 -8.847 -4.318 1.00 0.00 C ATOM 0 H MET A 127 -0.334 -6.315 -7.882 1.00 0.00 H new ATOM 0 HA MET A 127 -0.478 -9.224 -7.486 1.00 0.00 H new ATOM 0 HB2 MET A 127 0.942 -7.252 -5.628 1.00 0.00 H new ATOM 0 HB3 MET A 127 0.639 -8.939 -5.264 1.00 0.00 H new ATOM 0 HG2 MET A 127 1.894 -9.058 -7.770 1.00 0.00 H new ATOM 0 HG3 MET A 127 2.730 -7.738 -6.976 1.00 0.00 H new ATOM 0 HE1 MET A 127 4.306 -8.880 -4.014 1.00 0.00 H new ATOM 0 HE2 MET A 127 2.967 -7.813 -4.500 1.00 0.00 H new ATOM 0 HE3 MET A 127 2.639 -9.266 -3.526 1.00 0.00 H new ATOM 2039 N ASN A 128 -2.212 -8.901 -5.660 1.00 0.00 N ATOM 2040 CA ASN A 128 -3.434 -8.714 -4.897 1.00 0.00 C ATOM 2041 C ASN A 128 -3.318 -9.459 -3.565 1.00 0.00 C ATOM 2042 O ASN A 128 -2.424 -10.285 -3.388 1.00 0.00 O ATOM 2043 CB ASN A 128 -4.643 -9.275 -5.648 1.00 0.00 C ATOM 2044 CG ASN A 128 -4.256 -10.508 -6.468 1.00 0.00 C ATOM 2045 OD1 ASN A 128 -3.493 -10.439 -7.417 1.00 0.00 O ATOM 2046 ND2 ASN A 128 -4.824 -11.635 -6.050 1.00 0.00 N ATOM 0 H ASN A 128 -1.856 -9.857 -5.668 1.00 0.00 H new ATOM 0 HA ASN A 128 -3.572 -7.644 -4.738 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.427 -9.538 -4.938 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.053 -8.510 -6.307 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -4.630 -12.513 -6.532 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -5.454 -11.622 -5.248 1.00 0.00 H new ATOM 2053 N ARG A 129 -4.235 -9.140 -2.663 1.00 0.00 N ATOM 2054 CA ARG A 129 -4.247 -9.768 -1.353 1.00 0.00 C ATOM 2055 C ARG A 129 -5.680 -9.878 -0.830 1.00 0.00 C ATOM 2056 O ARG A 129 -6.514 -9.017 -1.107 1.00 0.00 O ATOM 2057 CB ARG A 129 -3.406 -8.972 -0.353 1.00 0.00 C ATOM 2058 CG ARG A 129 -1.978 -9.515 -0.282 1.00 0.00 C ATOM 2059 CD ARG A 129 -1.921 -10.801 0.545 1.00 0.00 C ATOM 2060 NE ARG A 129 -0.663 -11.529 0.263 1.00 0.00 N ATOM 2061 CZ ARG A 129 -0.503 -12.387 -0.754 1.00 0.00 C ATOM 2062 NH1 ARG A 129 -1.520 -12.630 -1.592 1.00 0.00 N ATOM 2063 NH2 ARG A 129 0.674 -13.002 -0.933 1.00 0.00 N ATOM 0 H ARG A 129 -4.975 -8.455 -2.814 1.00 0.00 H new ATOM 0 HA ARG A 129 -3.818 -10.764 -1.459 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -3.385 -7.922 -0.645 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -3.866 -9.020 0.634 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -1.608 -9.709 -1.289 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -1.321 -8.765 0.159 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -1.983 -10.563 1.607 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -2.777 -11.433 0.309 1.00 0.00 H new ATOM 0 HE ARG A 129 0.132 -11.367 0.882 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -2.416 -12.162 -1.456 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -1.398 -13.283 -2.366 1.00 0.00 H new ATOM 0 HH21 ARG A 129 1.448 -12.817 -0.295 1.00 0.00 H new ATOM 0 HH22 ARG A 129 0.796 -13.655 -1.707 1.00 0.00 H new ATOM 2077 N GLU A 130 -5.923 -10.946 -0.084 1.00 0.00 N ATOM 2078 CA GLU A 130 -7.242 -11.180 0.481 1.00 0.00 C ATOM 2079 C GLU A 130 -7.315 -10.627 1.905 1.00 0.00 C ATOM 2080 O GLU A 130 -6.371 -10.770 2.680 1.00 0.00 O ATOM 2081 CB GLU A 130 -7.594 -12.668 0.452 1.00 0.00 C ATOM 2082 CG GLU A 130 -7.114 -13.370 1.723 1.00 0.00 C ATOM 2083 CD GLU A 130 -6.856 -14.856 1.465 1.00 0.00 C ATOM 2084 OE1 GLU A 130 -7.724 -15.478 0.815 1.00 0.00 O ATOM 2085 OE2 GLU A 130 -5.797 -15.337 1.923 1.00 0.00 O ATOM 0 H GLU A 130 -5.229 -11.659 0.142 1.00 0.00 H new ATOM 0 HA GLU A 130 -7.976 -10.655 -0.130 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -8.673 -12.788 0.351 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -7.138 -13.136 -0.420 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -6.201 -12.896 2.082 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.861 -13.258 2.509 1.00 0.00 H new ATOM 2092 N ILE A 131 -8.446 -10.006 2.207 1.00 0.00 N ATOM 2093 CA ILE A 131 -8.655 -9.430 3.525 1.00 0.00 C ATOM 2094 C ILE A 131 -9.523 -10.375 4.357 1.00 0.00 C ATOM 2095 O ILE A 131 -10.665 -10.656 3.996 1.00 0.00 O ATOM 2096 CB ILE A 131 -9.225 -8.015 3.407 1.00 0.00 C ATOM 2097 CG1 ILE A 131 -8.226 -7.076 2.728 1.00 0.00 C ATOM 2098 CG2 ILE A 131 -9.670 -7.488 4.773 1.00 0.00 C ATOM 2099 CD1 ILE A 131 -8.891 -6.295 1.593 1.00 0.00 C ATOM 0 H ILE A 131 -9.227 -9.889 1.562 1.00 0.00 H new ATOM 0 HA ILE A 131 -7.705 -9.323 4.049 1.00 0.00 H new ATOM 0 HB ILE A 131 -10.111 -8.055 2.773 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -7.818 -6.381 3.462 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -7.389 -7.653 2.335 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -10.071 -6.481 4.661 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -10.440 -8.142 5.182 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -8.816 -7.465 5.450 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -8.159 -5.635 1.128 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -9.276 -6.992 0.849 1.00 0.00 H new ATOM 0 HD13 ILE A 131 -9.712 -5.701 1.993 1.00 0.00 H new ATOM 2111 N ILE A 132 -8.949 -10.841 5.457 1.00 0.00 N ATOM 2112 CA ILE A 132 -9.656 -11.749 6.344 1.00 0.00 C ATOM 2113 C ILE A 132 -9.596 -11.208 7.774 1.00 0.00 C ATOM 2114 O ILE A 132 -9.139 -10.089 7.999 1.00 0.00 O ATOM 2115 CB ILE A 132 -9.110 -13.171 6.201 1.00 0.00 C ATOM 2116 CG1 ILE A 132 -7.584 -13.164 6.088 1.00 0.00 C ATOM 2117 CG2 ILE A 132 -9.768 -13.896 5.025 1.00 0.00 C ATOM 2118 CD1 ILE A 132 -6.938 -12.780 7.421 1.00 0.00 C ATOM 0 H ILE A 132 -8.002 -10.606 5.754 1.00 0.00 H new ATOM 0 HA ILE A 132 -10.709 -11.808 6.069 1.00 0.00 H new ATOM 0 HB ILE A 132 -9.364 -13.726 7.104 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -7.234 -14.149 5.780 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -7.276 -12.461 5.314 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -9.362 -14.904 4.946 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -10.844 -13.950 5.187 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -9.567 -13.351 4.103 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -5.853 -12.782 7.314 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -7.271 -11.784 7.713 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -7.228 -13.499 8.187 1.00 0.00 H new ATOM 2130 N SER A 133 -10.064 -12.028 8.703 1.00 0.00 N ATOM 2131 CA SER A 133 -10.070 -11.646 10.105 1.00 0.00 C ATOM 2132 C SER A 133 -8.736 -12.020 10.754 1.00 0.00 C ATOM 2133 O SER A 133 -8.656 -12.997 11.498 1.00 0.00 O ATOM 2134 CB SER A 133 -11.229 -12.310 10.852 1.00 0.00 C ATOM 2135 OG SER A 133 -11.144 -12.104 12.259 1.00 0.00 O ATOM 0 H SER A 133 -10.442 -12.956 8.512 1.00 0.00 H new ATOM 0 HA SER A 133 -10.206 -10.566 10.165 1.00 0.00 H new ATOM 0 HB2 SER A 133 -12.174 -11.911 10.483 1.00 0.00 H new ATOM 0 HB3 SER A 133 -11.231 -13.379 10.641 1.00 0.00 H new ATOM 0 HG SER A 133 -11.902 -12.541 12.700 1.00 0.00 H new