USER MOD reduce.3.24.130724 H: found=0, std=0, add=1090, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1085 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 88 SER OG : rot -65:sc= 0.0771! USER MOD Set 1.2: A 89 HIS : no HE2:sc= -1.03 K(o=-0.01,f=-13!) USER MOD Set 1.3: A 187 SER OG : rot 160:sc= 0.943 USER MOD Set 2.1: A 107 GLN : amide:sc= -2.03! C(o=-3.9!,f=-6.4!) USER MOD Set 2.2: A 125 GLN : amide:sc= -1.83! C(o=-3.9!,f=-5.5!) USER MOD Set 3.1: A 73 GLN : amide:sc= 0 X(o=1.2,f=1.1) USER MOD Set 3.2: A 115 TYR OH : rot 11:sc= 1.15 USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 71 THR OG1 : rot 56:sc= 1.93 USER MOD Single : A 79 MET CE :methyl 176:sc= 0 (180deg=-0.00514) USER MOD Single : A 80 THR OG1 : rot 180:sc= -0.0484 USER MOD Single : A 81 TYR OH : rot 16:sc= 0.0367 USER MOD Single : A 82 LYS NZ :NH3+ -134:sc= -1.85 (180deg=-4.04!) USER MOD Single : A 92 LYS NZ :NH3+ -130:sc= 0.562 (180deg=-0.333) USER MOD Single : A 94 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0654) USER MOD Single : A 102 HIS : no HE2:sc= -2.37 K(o=-2.4,f=-7.4!) USER MOD Single : A 103 SER OG : rot 180:sc= 0.0684! USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 HIS : no HE2:sc= -0.0504 K(o=-0.05,f=-0.94) USER MOD Single : A 117 THR OG1 : rot -126:sc= 0.522 USER MOD Single : A 118 GLN : amide:sc= -11.8! C(o=-12!,f=-19!) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 ASN : amide:sc= -3.78! C(o=-3.8!,f=-2.1!) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot -110:sc= -1.43 USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 180:sc= -0.822! USER MOD Single : A 142 CYS SG : rot 43:sc= 0.302 USER MOD Single : A 143 TYR OH : rot 180:sc= -0.499 USER MOD Single : A 144 LYS NZ :NH3+ -146:sc= -0.251 (180deg=-0.777) USER MOD Single : A 152 LYS NZ :NH3+ 157:sc= -1 (180deg=-1.68) USER MOD Single : A 157 ASN : amide:sc= -0.534 X(o=-0.53,f=-0.038) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 192 HIS : no HD1:sc= -0.778 K(o=-0.78,f=-2.6) USER MOD Single : A 193 HIS : no HD1:sc= -4.17! C(o=-4.2!,f=-6.6!) USER MOD Single : A 194 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 199 HIS : no HD1:sc= -0.665 K(o=-0.66,f=-1.5) USER MOD Single : A 202 TYR OH : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.124) USER MOD Single : A 205 ASN : amide:sc= -0.427 X(o=-0.43,f=-0.47) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 56 8.980 14.238 -3.853 1.00 4.61 N ATOM 2 CA ALA A 56 7.552 14.040 -4.231 1.00 3.98 C ATOM 3 C ALA A 56 7.017 12.772 -3.562 1.00 3.15 C ATOM 4 O ALA A 56 6.215 12.054 -4.126 1.00 3.23 O ATOM 5 CB ALA A 56 7.440 13.904 -5.751 1.00 4.70 C ATOM 0 HA ALA A 56 6.967 14.898 -3.900 1.00 3.98 H new ATOM 0 HB1 ALA A 56 6.396 13.759 -6.027 1.00 4.70 H new ATOM 0 HB2 ALA A 56 7.819 14.809 -6.226 1.00 4.70 H new ATOM 0 HB3 ALA A 56 8.026 13.047 -6.084 1.00 4.70 H new ATOM 11 N TRP A 57 7.449 12.494 -2.364 1.00 2.75 N ATOM 12 CA TRP A 57 6.960 11.276 -1.659 1.00 2.31 C ATOM 13 C TRP A 57 5.488 11.495 -1.279 1.00 1.71 C ATOM 14 O TRP A 57 4.590 11.129 -2.012 1.00 2.05 O ATOM 15 CB TRP A 57 7.846 11.040 -0.412 1.00 2.59 C ATOM 16 CG TRP A 57 7.078 10.417 0.720 1.00 2.15 C ATOM 17 CD1 TRP A 57 7.170 10.808 2.012 1.00 2.38 C ATOM 18 CD2 TRP A 57 6.113 9.317 0.696 1.00 1.56 C ATOM 19 NE1 TRP A 57 6.334 10.022 2.780 1.00 2.03 N ATOM 20 CE2 TRP A 57 5.662 9.089 2.019 1.00 1.45 C ATOM 21 CE3 TRP A 57 5.593 8.504 -0.328 1.00 1.38 C ATOM 22 CZ2 TRP A 57 4.732 8.090 2.316 1.00 1.05 C ATOM 23 CZ3 TRP A 57 4.656 7.498 -0.032 1.00 1.05 C ATOM 24 CH2 TRP A 57 4.227 7.292 1.287 1.00 0.77 C ATOM 0 H TRP A 57 8.120 13.058 -1.842 1.00 2.75 H new ATOM 0 HA TRP A 57 7.023 10.392 -2.294 1.00 2.31 H new ATOM 0 HB2 TRP A 57 8.683 10.395 -0.680 1.00 2.59 H new ATOM 0 HB3 TRP A 57 8.268 11.990 -0.083 1.00 2.59 H new ATOM 0 HD1 TRP A 57 7.796 11.606 2.383 1.00 2.38 H new ATOM 0 HE1 TRP A 57 6.226 10.120 3.790 1.00 2.03 H new ATOM 0 HE3 TRP A 57 5.916 8.654 -1.348 1.00 1.38 H new ATOM 0 HZ2 TRP A 57 4.406 7.936 3.334 1.00 1.05 H new ATOM 0 HZ3 TRP A 57 4.264 6.880 -0.826 1.00 1.05 H new ATOM 0 HH2 TRP A 57 3.507 6.517 1.507 1.00 0.77 H new ATOM 35 N LEU A 58 5.233 12.099 -0.151 1.00 1.60 N ATOM 36 CA LEU A 58 3.822 12.350 0.259 1.00 1.99 C ATOM 37 C LEU A 58 3.336 13.631 -0.430 1.00 2.51 C ATOM 38 O LEU A 58 2.295 13.661 -1.056 1.00 3.09 O ATOM 39 CB LEU A 58 3.761 12.509 1.791 1.00 2.55 C ATOM 40 CG LEU A 58 2.367 12.131 2.312 1.00 2.63 C ATOM 41 CD1 LEU A 58 2.361 12.204 3.843 1.00 2.73 C ATOM 42 CD2 LEU A 58 1.320 13.100 1.748 1.00 3.22 C ATOM 0 H LEU A 58 5.941 12.430 0.505 1.00 1.60 H new ATOM 0 HA LEU A 58 3.183 11.516 -0.033 1.00 1.99 H new ATOM 0 HB2 LEU A 58 4.515 11.877 2.259 1.00 2.55 H new ATOM 0 HB3 LEU A 58 3.993 13.538 2.066 1.00 2.55 H new ATOM 0 HG LEU A 58 2.124 11.118 1.992 1.00 2.63 H new ATOM 0 HD11 LEU A 58 1.373 11.936 4.216 1.00 2.73 H new ATOM 0 HD12 LEU A 58 3.100 11.510 4.243 1.00 2.73 H new ATOM 0 HD13 LEU A 58 2.606 13.218 4.160 1.00 2.73 H new ATOM 0 HD21 LEU A 58 0.333 12.827 2.121 1.00 3.22 H new ATOM 0 HD22 LEU A 58 1.558 14.116 2.062 1.00 3.22 H new ATOM 0 HD23 LEU A 58 1.324 13.047 0.659 1.00 3.22 H new ATOM 54 N GLU A 59 4.095 14.688 -0.319 1.00 2.68 N ATOM 55 CA GLU A 59 3.701 15.974 -0.959 1.00 3.25 C ATOM 56 C GLU A 59 3.988 15.918 -2.462 1.00 3.14 C ATOM 57 O GLU A 59 4.984 16.429 -2.933 1.00 3.52 O ATOM 58 CB GLU A 59 4.504 17.120 -0.335 1.00 3.87 C ATOM 59 CG GLU A 59 4.488 16.998 1.195 1.00 4.68 C ATOM 60 CD GLU A 59 5.523 15.962 1.647 1.00 5.43 C ATOM 61 OE1 GLU A 59 6.138 15.352 0.787 1.00 5.81 O ATOM 62 OE2 GLU A 59 5.682 15.797 2.845 1.00 5.92 O ATOM 0 H GLU A 59 4.978 14.715 0.192 1.00 2.68 H new ATOM 0 HA GLU A 59 2.635 16.140 -0.801 1.00 3.25 H new ATOM 0 HB2 GLU A 59 5.531 17.096 -0.699 1.00 3.87 H new ATOM 0 HB3 GLU A 59 4.081 18.078 -0.636 1.00 3.87 H new ATOM 0 HG2 GLU A 59 4.707 17.965 1.648 1.00 4.68 H new ATOM 0 HG3 GLU A 59 3.495 16.705 1.535 1.00 4.68 H new ATOM 69 N ALA A 60 3.120 15.310 -3.220 1.00 3.25 N ATOM 70 CA ALA A 60 3.343 15.236 -4.694 1.00 3.79 C ATOM 71 C ALA A 60 3.061 16.607 -5.319 1.00 3.93 C ATOM 72 O ALA A 60 2.104 16.778 -6.050 1.00 4.34 O ATOM 73 CB ALA A 60 2.399 14.197 -5.305 1.00 4.57 C ATOM 0 H ALA A 60 2.267 14.861 -2.886 1.00 3.25 H new ATOM 0 HA ALA A 60 4.376 14.948 -4.890 1.00 3.79 H new ATOM 0 HB1 ALA A 60 2.563 14.144 -6.381 1.00 4.57 H new ATOM 0 HB2 ALA A 60 2.595 13.221 -4.860 1.00 4.57 H new ATOM 0 HB3 ALA A 60 1.366 14.484 -5.109 1.00 4.57 H new ATOM 79 N GLN A 61 3.878 17.590 -5.035 1.00 4.11 N ATOM 80 CA GLN A 61 3.643 18.951 -5.612 1.00 4.74 C ATOM 81 C GLN A 61 4.330 19.068 -6.982 1.00 4.98 C ATOM 82 O GLN A 61 3.718 19.451 -7.959 1.00 5.45 O ATOM 83 CB GLN A 61 4.200 20.018 -4.649 1.00 5.31 C ATOM 84 CG GLN A 61 5.415 19.462 -3.899 1.00 5.77 C ATOM 85 CD GLN A 61 6.185 20.612 -3.248 1.00 6.31 C ATOM 86 OE1 GLN A 61 6.713 21.468 -3.930 1.00 6.59 O ATOM 87 NE2 GLN A 61 6.274 20.668 -1.947 1.00 6.81 N ATOM 0 H GLN A 61 4.696 17.510 -4.430 1.00 4.11 H new ATOM 0 HA GLN A 61 2.572 19.107 -5.744 1.00 4.74 H new ATOM 0 HB2 GLN A 61 4.483 20.911 -5.206 1.00 5.31 H new ATOM 0 HB3 GLN A 61 3.429 20.317 -3.939 1.00 5.31 H new ATOM 0 HG2 GLN A 61 5.092 18.751 -3.139 1.00 5.77 H new ATOM 0 HG3 GLN A 61 6.064 18.920 -4.587 1.00 5.77 H new ATOM 0 HE21 GLN A 61 5.831 19.950 -1.374 1.00 6.81 H new ATOM 0 HE22 GLN A 61 6.787 21.430 -1.503 1.00 6.81 H new ATOM 96 N GLU A 62 5.591 18.747 -7.059 1.00 5.00 N ATOM 97 CA GLU A 62 6.309 18.849 -8.362 1.00 5.58 C ATOM 98 C GLU A 62 7.664 18.147 -8.242 1.00 5.55 C ATOM 99 O GLU A 62 7.736 16.969 -7.957 1.00 5.67 O ATOM 100 CB GLU A 62 6.517 20.327 -8.712 1.00 6.14 C ATOM 101 CG GLU A 62 6.940 20.463 -10.182 1.00 6.74 C ATOM 102 CD GLU A 62 5.709 20.361 -11.087 1.00 7.42 C ATOM 103 OE1 GLU A 62 5.218 19.259 -11.266 1.00 7.69 O ATOM 104 OE2 GLU A 62 5.279 21.388 -11.585 1.00 7.91 O ATOM 0 H GLU A 62 6.157 18.418 -6.276 1.00 5.00 H new ATOM 0 HA GLU A 62 5.723 18.374 -9.149 1.00 5.58 H new ATOM 0 HB2 GLU A 62 5.597 20.884 -8.537 1.00 6.14 H new ATOM 0 HB3 GLU A 62 7.279 20.759 -8.064 1.00 6.14 H new ATOM 0 HG2 GLU A 62 7.440 21.419 -10.339 1.00 6.74 H new ATOM 0 HG3 GLU A 62 7.656 19.682 -10.438 1.00 6.74 H new ATOM 111 N GLU A 63 8.743 18.860 -8.455 1.00 5.72 N ATOM 112 CA GLU A 63 10.097 18.232 -8.349 1.00 6.01 C ATOM 113 C GLU A 63 11.066 19.222 -7.699 1.00 5.97 C ATOM 114 O GLU A 63 12.115 19.520 -8.233 1.00 6.17 O ATOM 115 CB GLU A 63 10.603 17.870 -9.748 1.00 6.54 C ATOM 116 CG GLU A 63 9.592 16.950 -10.439 1.00 6.72 C ATOM 117 CD GLU A 63 10.121 16.557 -11.820 1.00 7.22 C ATOM 118 OE1 GLU A 63 10.480 17.449 -12.572 1.00 7.44 O ATOM 119 OE2 GLU A 63 10.157 15.370 -12.104 1.00 7.67 O ATOM 0 H GLU A 63 8.744 19.851 -8.698 1.00 5.72 H new ATOM 0 HA GLU A 63 10.033 17.330 -7.741 1.00 6.01 H new ATOM 0 HB2 GLU A 63 10.749 18.775 -10.338 1.00 6.54 H new ATOM 0 HB3 GLU A 63 11.572 17.375 -9.678 1.00 6.54 H new ATOM 0 HG2 GLU A 63 9.423 16.058 -9.835 1.00 6.72 H new ATOM 0 HG3 GLU A 63 8.631 17.456 -10.536 1.00 6.72 H new ATOM 126 N GLU A 64 10.725 19.731 -6.545 1.00 6.07 N ATOM 127 CA GLU A 64 11.633 20.696 -5.863 1.00 6.34 C ATOM 128 C GLU A 64 12.932 19.969 -5.483 1.00 6.12 C ATOM 129 O GLU A 64 13.105 18.802 -5.775 1.00 6.31 O ATOM 130 CB GLU A 64 10.932 21.250 -4.602 1.00 6.85 C ATOM 131 CG GLU A 64 11.381 22.698 -4.328 1.00 7.36 C ATOM 132 CD GLU A 64 10.579 23.669 -5.200 1.00 8.01 C ATOM 133 OE1 GLU A 64 10.504 23.439 -6.395 1.00 8.39 O ATOM 134 OE2 GLU A 64 10.056 24.627 -4.656 1.00 8.36 O ATOM 0 H GLU A 64 9.860 19.521 -6.047 1.00 6.07 H new ATOM 0 HA GLU A 64 11.871 21.529 -6.525 1.00 6.34 H new ATOM 0 HB2 GLU A 64 9.851 21.217 -4.736 1.00 6.85 H new ATOM 0 HB3 GLU A 64 11.166 20.622 -3.743 1.00 6.85 H new ATOM 0 HG2 GLU A 64 11.238 22.939 -3.275 1.00 7.36 H new ATOM 0 HG3 GLU A 64 12.446 22.803 -4.537 1.00 7.36 H new ATOM 141 N GLU A 65 13.845 20.645 -4.840 1.00 6.04 N ATOM 142 CA GLU A 65 15.124 19.986 -4.452 1.00 6.09 C ATOM 143 C GLU A 65 14.829 18.727 -3.635 1.00 5.38 C ATOM 144 O GLU A 65 14.419 18.798 -2.494 1.00 5.46 O ATOM 145 CB GLU A 65 15.959 20.953 -3.609 1.00 6.80 C ATOM 146 CG GLU A 65 16.332 22.173 -4.452 1.00 7.45 C ATOM 147 CD GLU A 65 16.919 23.260 -3.550 1.00 7.99 C ATOM 148 OE1 GLU A 65 18.108 23.197 -3.280 1.00 8.49 O ATOM 149 OE2 GLU A 65 16.172 24.135 -3.144 1.00 8.13 O ATOM 0 H GLU A 65 13.760 21.624 -4.567 1.00 6.04 H new ATOM 0 HA GLU A 65 15.676 19.712 -5.351 1.00 6.09 H new ATOM 0 HB2 GLU A 65 15.396 21.264 -2.729 1.00 6.80 H new ATOM 0 HB3 GLU A 65 16.860 20.455 -3.251 1.00 6.80 H new ATOM 0 HG2 GLU A 65 17.055 21.891 -5.217 1.00 7.45 H new ATOM 0 HG3 GLU A 65 15.451 22.553 -4.970 1.00 7.45 H new ATOM 156 N VAL A 66 15.040 17.571 -4.208 1.00 4.95 N ATOM 157 CA VAL A 66 14.775 16.302 -3.467 1.00 4.48 C ATOM 158 C VAL A 66 15.620 15.182 -4.072 1.00 4.72 C ATOM 159 O VAL A 66 15.469 14.831 -5.224 1.00 5.03 O ATOM 160 CB VAL A 66 13.293 15.931 -3.586 1.00 4.18 C ATOM 161 CG1 VAL A 66 13.058 14.536 -2.995 1.00 3.90 C ATOM 162 CG2 VAL A 66 12.439 16.952 -2.829 1.00 4.35 C ATOM 0 H VAL A 66 15.385 17.451 -5.160 1.00 4.95 H new ATOM 0 HA VAL A 66 15.031 16.438 -2.416 1.00 4.48 H new ATOM 0 HB VAL A 66 13.011 15.932 -4.639 1.00 4.18 H new ATOM 0 HG11 VAL A 66 12.003 14.277 -3.082 1.00 3.90 H new ATOM 0 HG12 VAL A 66 13.657 13.805 -3.538 1.00 3.90 H new ATOM 0 HG13 VAL A 66 13.347 14.533 -1.944 1.00 3.90 H new ATOM 0 HG21 VAL A 66 11.386 16.683 -2.917 1.00 4.35 H new ATOM 0 HG22 VAL A 66 12.725 16.957 -1.777 1.00 4.35 H new ATOM 0 HG23 VAL A 66 12.597 17.944 -3.253 1.00 4.35 H new ATOM 172 N GLY A 67 16.499 14.614 -3.295 1.00 4.94 N ATOM 173 CA GLY A 67 17.358 13.505 -3.802 1.00 5.45 C ATOM 174 C GLY A 67 17.889 13.841 -5.198 1.00 5.43 C ATOM 175 O GLY A 67 17.227 13.624 -6.194 1.00 5.79 O ATOM 0 H GLY A 67 16.661 14.872 -2.322 1.00 4.94 H new ATOM 0 HA2 GLY A 67 18.191 13.339 -3.119 1.00 5.45 H new ATOM 0 HA3 GLY A 67 16.785 12.578 -3.837 1.00 5.45 H new ATOM 179 N PHE A 68 19.084 14.359 -5.284 1.00 5.26 N ATOM 180 CA PHE A 68 19.656 14.698 -6.623 1.00 5.45 C ATOM 181 C PHE A 68 20.196 13.422 -7.291 1.00 4.79 C ATOM 182 O PHE A 68 20.012 13.211 -8.472 1.00 4.49 O ATOM 183 CB PHE A 68 20.785 15.754 -6.482 1.00 6.13 C ATOM 184 CG PHE A 68 20.713 16.414 -5.120 1.00 6.37 C ATOM 185 CD1 PHE A 68 19.498 16.932 -4.659 1.00 6.71 C ATOM 186 CD2 PHE A 68 21.862 16.509 -4.322 1.00 6.59 C ATOM 187 CE1 PHE A 68 19.428 17.544 -3.402 1.00 7.20 C ATOM 188 CE2 PHE A 68 21.791 17.122 -3.064 1.00 7.13 C ATOM 189 CZ PHE A 68 20.574 17.639 -2.605 1.00 7.40 C ATOM 0 H PHE A 68 19.689 14.563 -4.489 1.00 5.26 H new ATOM 0 HA PHE A 68 18.870 15.123 -7.247 1.00 5.45 H new ATOM 0 HB2 PHE A 68 21.757 15.278 -6.613 1.00 6.13 H new ATOM 0 HB3 PHE A 68 20.690 16.506 -7.265 1.00 6.13 H new ATOM 0 HD1 PHE A 68 18.613 16.860 -5.274 1.00 6.71 H new ATOM 0 HD2 PHE A 68 22.801 16.110 -4.677 1.00 6.59 H new ATOM 0 HE1 PHE A 68 18.489 17.943 -3.047 1.00 7.20 H new ATOM 0 HE2 PHE A 68 22.675 17.196 -2.449 1.00 7.13 H new ATOM 0 HZ PHE A 68 20.520 18.111 -1.635 1.00 7.40 H new ATOM 199 N PRO A 69 20.847 12.577 -6.538 1.00 4.86 N ATOM 200 CA PRO A 69 21.413 11.299 -7.060 1.00 4.45 C ATOM 201 C PRO A 69 20.306 10.355 -7.554 1.00 4.09 C ATOM 202 O PRO A 69 19.484 9.896 -6.787 1.00 4.61 O ATOM 203 CB PRO A 69 22.159 10.697 -5.845 1.00 5.21 C ATOM 204 CG PRO A 69 22.316 11.831 -4.877 1.00 5.88 C ATOM 205 CD PRO A 69 21.120 12.745 -5.111 1.00 5.67 C ATOM 0 HA PRO A 69 22.066 11.454 -7.919 1.00 4.45 H new ATOM 0 HB2 PRO A 69 21.593 9.877 -5.402 1.00 5.21 H new ATOM 0 HB3 PRO A 69 23.128 10.293 -6.139 1.00 5.21 H new ATOM 0 HG2 PRO A 69 22.336 11.468 -3.849 1.00 5.88 H new ATOM 0 HG3 PRO A 69 23.253 12.362 -5.045 1.00 5.88 H new ATOM 0 HD2 PRO A 69 20.265 12.454 -4.500 1.00 5.67 H new ATOM 0 HD3 PRO A 69 21.350 13.781 -4.864 1.00 5.67 H new ATOM 213 N VAL A 70 20.277 10.067 -8.827 1.00 3.53 N ATOM 214 CA VAL A 70 19.220 9.160 -9.360 1.00 3.48 C ATOM 215 C VAL A 70 19.628 7.707 -9.116 1.00 3.20 C ATOM 216 O VAL A 70 20.784 7.353 -9.225 1.00 3.15 O ATOM 217 CB VAL A 70 19.050 9.398 -10.861 1.00 3.52 C ATOM 218 CG1 VAL A 70 18.582 10.836 -11.097 1.00 4.19 C ATOM 219 CG2 VAL A 70 20.388 9.175 -11.572 1.00 3.47 C ATOM 0 H VAL A 70 20.938 10.419 -9.520 1.00 3.53 H new ATOM 0 HA VAL A 70 18.277 9.364 -8.853 1.00 3.48 H new ATOM 0 HB VAL A 70 18.310 8.702 -11.257 1.00 3.52 H new ATOM 0 HG11 VAL A 70 18.460 11.008 -12.166 1.00 4.19 H new ATOM 0 HG12 VAL A 70 17.629 10.996 -10.593 1.00 4.19 H new ATOM 0 HG13 VAL A 70 19.323 11.530 -10.700 1.00 4.19 H new ATOM 0 HG21 VAL A 70 20.264 9.345 -12.642 1.00 3.47 H new ATOM 0 HG22 VAL A 70 21.130 9.869 -11.177 1.00 3.47 H new ATOM 0 HG23 VAL A 70 20.723 8.152 -11.404 1.00 3.47 H new ATOM 229 N THR A 71 18.680 6.864 -8.782 1.00 3.33 N ATOM 230 CA THR A 71 18.993 5.423 -8.523 1.00 3.19 C ATOM 231 C THR A 71 18.024 4.534 -9.321 1.00 2.33 C ATOM 232 O THR A 71 16.915 4.289 -8.888 1.00 2.20 O ATOM 233 CB THR A 71 18.811 5.131 -7.032 1.00 3.92 C ATOM 234 OG1 THR A 71 17.470 5.413 -6.654 1.00 4.10 O ATOM 235 CG2 THR A 71 19.769 5.999 -6.216 1.00 4.65 C ATOM 0 H THR A 71 17.697 7.114 -8.677 1.00 3.33 H new ATOM 0 HA THR A 71 20.019 5.215 -8.826 1.00 3.19 H new ATOM 0 HB THR A 71 19.028 4.080 -6.840 1.00 3.92 H new ATOM 0 HG1 THR A 71 16.856 4.894 -7.214 1.00 4.10 H new ATOM 0 HG21 THR A 71 19.637 5.788 -5.155 1.00 4.65 H new ATOM 0 HG22 THR A 71 20.796 5.777 -6.505 1.00 4.65 H new ATOM 0 HG23 THR A 71 19.558 7.051 -6.406 1.00 4.65 H new ATOM 243 N PRO A 72 18.429 4.040 -10.469 1.00 2.04 N ATOM 244 CA PRO A 72 17.572 3.159 -11.309 1.00 1.36 C ATOM 245 C PRO A 72 17.692 1.691 -10.882 1.00 1.25 C ATOM 246 O PRO A 72 18.057 1.395 -9.766 1.00 1.81 O ATOM 247 CB PRO A 72 18.131 3.377 -12.715 1.00 1.84 C ATOM 248 CG PRO A 72 19.596 3.624 -12.505 1.00 2.59 C ATOM 249 CD PRO A 72 19.740 4.264 -11.109 1.00 2.69 C ATOM 0 HA PRO A 72 16.510 3.391 -11.229 1.00 1.36 H new ATOM 0 HB2 PRO A 72 17.963 2.506 -13.348 1.00 1.84 H new ATOM 0 HB3 PRO A 72 17.652 4.225 -13.205 1.00 1.84 H new ATOM 0 HG2 PRO A 72 20.158 2.692 -12.564 1.00 2.59 H new ATOM 0 HG3 PRO A 72 19.992 4.284 -13.277 1.00 2.59 H new ATOM 0 HD2 PRO A 72 20.545 3.800 -10.540 1.00 2.69 H new ATOM 0 HD3 PRO A 72 19.972 5.327 -11.180 1.00 2.69 H new ATOM 257 N GLN A 73 17.365 0.776 -11.755 1.00 1.10 N ATOM 258 CA GLN A 73 17.441 -0.671 -11.400 1.00 1.44 C ATOM 259 C GLN A 73 18.716 -0.965 -10.606 1.00 1.16 C ATOM 260 O GLN A 73 19.774 -1.203 -11.154 1.00 1.32 O ATOM 261 CB GLN A 73 17.448 -1.513 -12.680 1.00 2.13 C ATOM 262 CG GLN A 73 16.175 -1.246 -13.485 1.00 2.59 C ATOM 263 CD GLN A 73 16.335 -1.817 -14.896 1.00 3.31 C ATOM 264 OE1 GLN A 73 17.078 -1.285 -15.697 1.00 3.76 O ATOM 265 NE2 GLN A 73 15.667 -2.885 -15.237 1.00 3.98 N ATOM 0 H GLN A 73 17.047 0.970 -12.704 1.00 1.10 H new ATOM 0 HA GLN A 73 16.574 -0.923 -10.789 1.00 1.44 H new ATOM 0 HB2 GLN A 73 18.325 -1.272 -13.280 1.00 2.13 H new ATOM 0 HB3 GLN A 73 17.515 -2.572 -12.429 1.00 2.13 H new ATOM 0 HG2 GLN A 73 15.317 -1.703 -12.991 1.00 2.59 H new ATOM 0 HG3 GLN A 73 15.981 -0.175 -13.534 1.00 2.59 H new ATOM 0 HE21 GLN A 73 15.043 -3.332 -14.565 1.00 3.98 H new ATOM 0 HE22 GLN A 73 15.769 -3.272 -16.175 1.00 3.98 H new ATOM 274 N VAL A 74 18.595 -0.984 -9.312 1.00 1.04 N ATOM 275 CA VAL A 74 19.759 -1.299 -8.428 1.00 0.93 C ATOM 276 C VAL A 74 19.768 -2.813 -8.184 1.00 0.86 C ATOM 277 O VAL A 74 18.743 -3.453 -8.299 1.00 0.89 O ATOM 278 CB VAL A 74 19.586 -0.550 -7.095 1.00 1.09 C ATOM 279 CG1 VAL A 74 20.075 0.897 -7.238 1.00 1.17 C ATOM 280 CG2 VAL A 74 18.100 -0.544 -6.718 1.00 1.38 C ATOM 0 H VAL A 74 17.725 -0.792 -8.816 1.00 1.04 H new ATOM 0 HA VAL A 74 20.698 -0.992 -8.889 1.00 0.93 H new ATOM 0 HB VAL A 74 20.169 -1.049 -6.321 1.00 1.09 H new ATOM 0 HG11 VAL A 74 19.949 1.419 -6.290 1.00 1.17 H new ATOM 0 HG12 VAL A 74 21.129 0.899 -7.516 1.00 1.17 H new ATOM 0 HG13 VAL A 74 19.495 1.402 -8.010 1.00 1.17 H new ATOM 0 HG21 VAL A 74 17.966 -0.015 -5.774 1.00 1.38 H new ATOM 0 HG22 VAL A 74 17.529 -0.043 -7.499 1.00 1.38 H new ATOM 0 HG23 VAL A 74 17.747 -1.570 -6.612 1.00 1.38 H new ATOM 290 N PRO A 75 20.903 -3.388 -7.851 1.00 0.93 N ATOM 291 CA PRO A 75 21.010 -4.852 -7.594 1.00 1.00 C ATOM 292 C PRO A 75 19.738 -5.417 -6.953 1.00 0.88 C ATOM 293 O PRO A 75 19.381 -5.083 -5.840 1.00 0.84 O ATOM 294 CB PRO A 75 22.204 -4.936 -6.650 1.00 1.18 C ATOM 295 CG PRO A 75 23.116 -3.834 -7.106 1.00 1.37 C ATOM 296 CD PRO A 75 22.212 -2.725 -7.687 1.00 1.13 C ATOM 0 HA PRO A 75 21.135 -5.439 -8.504 1.00 1.00 H new ATOM 0 HB2 PRO A 75 21.901 -4.798 -5.612 1.00 1.18 H new ATOM 0 HB3 PRO A 75 22.693 -5.908 -6.712 1.00 1.18 H new ATOM 0 HG2 PRO A 75 23.710 -3.454 -6.275 1.00 1.37 H new ATOM 0 HG3 PRO A 75 23.816 -4.197 -7.858 1.00 1.37 H new ATOM 0 HD2 PRO A 75 22.146 -1.870 -7.015 1.00 1.13 H new ATOM 0 HD3 PRO A 75 22.595 -2.354 -8.638 1.00 1.13 H new ATOM 304 N LEU A 76 19.035 -6.248 -7.675 1.00 0.86 N ATOM 305 CA LEU A 76 17.758 -6.821 -7.152 1.00 0.77 C ATOM 306 C LEU A 76 18.010 -7.689 -5.918 1.00 0.77 C ATOM 307 O LEU A 76 18.457 -8.816 -6.014 1.00 0.85 O ATOM 308 CB LEU A 76 17.092 -7.673 -8.239 1.00 0.84 C ATOM 309 CG LEU A 76 16.774 -6.812 -9.471 1.00 0.87 C ATOM 310 CD1 LEU A 76 16.381 -7.727 -10.637 1.00 1.01 C ATOM 311 CD2 LEU A 76 15.610 -5.849 -9.168 1.00 0.76 C ATOM 0 H LEU A 76 19.292 -6.558 -8.612 1.00 0.86 H new ATOM 0 HA LEU A 76 17.105 -5.995 -6.870 1.00 0.77 H new ATOM 0 HB2 LEU A 76 17.751 -8.494 -8.521 1.00 0.84 H new ATOM 0 HB3 LEU A 76 16.176 -8.118 -7.851 1.00 0.84 H new ATOM 0 HG LEU A 76 17.657 -6.228 -9.732 1.00 0.87 H new ATOM 0 HD11 LEU A 76 16.154 -7.121 -11.514 1.00 1.01 H new ATOM 0 HD12 LEU A 76 17.207 -8.401 -10.865 1.00 1.01 H new ATOM 0 HD13 LEU A 76 15.502 -8.310 -10.362 1.00 1.01 H new ATOM 0 HD21 LEU A 76 15.397 -5.246 -10.051 1.00 0.76 H new ATOM 0 HD22 LEU A 76 14.724 -6.423 -8.898 1.00 0.76 H new ATOM 0 HD23 LEU A 76 15.885 -5.195 -8.340 1.00 0.76 H new ATOM 323 N ARG A 77 17.697 -7.176 -4.761 1.00 0.74 N ATOM 324 CA ARG A 77 17.881 -7.964 -3.509 1.00 0.79 C ATOM 325 C ARG A 77 16.677 -8.905 -3.349 1.00 0.71 C ATOM 326 O ARG A 77 15.619 -8.645 -3.884 1.00 0.73 O ATOM 327 CB ARG A 77 17.944 -6.987 -2.321 1.00 0.85 C ATOM 328 CG ARG A 77 19.366 -6.433 -2.170 1.00 1.19 C ATOM 329 CD ARG A 77 19.455 -5.606 -0.887 1.00 1.52 C ATOM 330 NE ARG A 77 18.431 -4.524 -0.918 1.00 2.13 N ATOM 331 CZ ARG A 77 18.120 -3.888 0.179 1.00 2.66 C ATOM 332 NH1 ARG A 77 18.701 -4.207 1.303 1.00 2.73 N ATOM 333 NH2 ARG A 77 17.229 -2.935 0.152 1.00 3.61 N ATOM 0 H ARG A 77 17.319 -6.238 -4.628 1.00 0.74 H new ATOM 0 HA ARG A 77 18.800 -8.549 -3.547 1.00 0.79 H new ATOM 0 HB2 ARG A 77 17.241 -6.169 -2.475 1.00 0.85 H new ATOM 0 HB3 ARG A 77 17.644 -7.496 -1.405 1.00 0.85 H new ATOM 0 HG2 ARG A 77 20.086 -7.251 -2.139 1.00 1.19 H new ATOM 0 HG3 ARG A 77 19.621 -5.816 -3.032 1.00 1.19 H new ATOM 0 HD2 ARG A 77 19.297 -6.245 -0.018 1.00 1.52 H new ATOM 0 HD3 ARG A 77 20.451 -5.175 -0.788 1.00 1.52 H new ATOM 0 HE ARG A 77 17.973 -4.280 -1.796 1.00 2.13 H new ATOM 0 HH11 ARG A 77 19.397 -4.952 1.324 1.00 2.73 H new ATOM 0 HH12 ARG A 77 18.459 -3.711 2.161 1.00 2.73 H new ATOM 0 HH21 ARG A 77 16.775 -2.686 -0.727 1.00 3.61 H new ATOM 0 HH22 ARG A 77 16.987 -2.439 1.010 1.00 3.61 H new ATOM 347 N PRO A 78 16.825 -9.989 -2.623 1.00 0.79 N ATOM 348 CA PRO A 78 15.709 -10.960 -2.403 1.00 0.76 C ATOM 349 C PRO A 78 14.658 -10.407 -1.428 1.00 0.67 C ATOM 350 O PRO A 78 14.946 -10.142 -0.278 1.00 0.69 O ATOM 351 CB PRO A 78 16.417 -12.186 -1.812 1.00 0.86 C ATOM 352 CG PRO A 78 17.613 -11.629 -1.111 1.00 1.18 C ATOM 353 CD PRO A 78 18.060 -10.418 -1.937 1.00 1.06 C ATOM 0 HA PRO A 78 15.160 -11.180 -3.318 1.00 0.76 H new ATOM 0 HB2 PRO A 78 15.768 -12.724 -1.121 1.00 0.86 H new ATOM 0 HB3 PRO A 78 16.707 -12.891 -2.592 1.00 0.86 H new ATOM 0 HG2 PRO A 78 17.366 -11.336 -0.091 1.00 1.18 H new ATOM 0 HG3 PRO A 78 18.408 -12.372 -1.046 1.00 1.18 H new ATOM 0 HD2 PRO A 78 18.462 -9.627 -1.304 1.00 1.06 H new ATOM 0 HD3 PRO A 78 18.842 -10.685 -2.648 1.00 1.06 H new ATOM 361 N MET A 79 13.445 -10.226 -1.880 1.00 0.65 N ATOM 362 CA MET A 79 12.388 -9.683 -0.977 1.00 0.61 C ATOM 363 C MET A 79 12.069 -10.710 0.110 1.00 0.51 C ATOM 364 O MET A 79 11.365 -11.674 -0.116 1.00 0.56 O ATOM 365 CB MET A 79 11.124 -9.367 -1.787 1.00 0.66 C ATOM 366 CG MET A 79 10.156 -8.552 -0.928 1.00 0.74 C ATOM 367 SD MET A 79 10.846 -6.898 -0.642 1.00 1.25 S ATOM 368 CE MET A 79 9.341 -5.938 -0.945 1.00 0.83 C ATOM 0 H MET A 79 13.141 -10.430 -2.832 1.00 0.65 H new ATOM 0 HA MET A 79 12.747 -8.766 -0.510 1.00 0.61 H new ATOM 0 HB2 MET A 79 11.386 -8.810 -2.686 1.00 0.66 H new ATOM 0 HB3 MET A 79 10.647 -10.292 -2.112 1.00 0.66 H new ATOM 0 HG2 MET A 79 9.189 -8.473 -1.426 1.00 0.74 H new ATOM 0 HG3 MET A 79 9.985 -9.056 0.023 1.00 0.74 H new ATOM 0 HE1 MET A 79 9.536 -4.884 -0.749 1.00 0.83 H new ATOM 0 HE2 MET A 79 9.033 -6.063 -1.983 1.00 0.83 H new ATOM 0 HE3 MET A 79 8.547 -6.289 -0.286 1.00 0.83 H new ATOM 378 N THR A 80 12.597 -10.515 1.289 1.00 0.56 N ATOM 379 CA THR A 80 12.346 -11.480 2.399 1.00 0.60 C ATOM 380 C THR A 80 11.078 -11.119 3.149 1.00 0.56 C ATOM 381 O THR A 80 10.685 -9.974 3.207 1.00 0.50 O ATOM 382 CB THR A 80 13.532 -11.458 3.368 1.00 0.77 C ATOM 383 OG1 THR A 80 13.779 -10.125 3.788 1.00 0.94 O ATOM 384 CG2 THR A 80 14.775 -12.015 2.671 1.00 0.73 C ATOM 0 H THR A 80 13.194 -9.725 1.532 1.00 0.56 H new ATOM 0 HA THR A 80 12.228 -12.477 1.974 1.00 0.60 H new ATOM 0 HB THR A 80 13.299 -12.073 4.237 1.00 0.77 H new ATOM 0 HG1 THR A 80 14.537 -10.113 4.409 1.00 0.94 H new ATOM 0 HG21 THR A 80 15.618 -11.998 3.362 1.00 0.73 H new ATOM 0 HG22 THR A 80 14.586 -13.041 2.354 1.00 0.73 H new ATOM 0 HG23 THR A 80 15.008 -11.403 1.800 1.00 0.73 H new ATOM 392 N TYR A 81 10.444 -12.087 3.766 1.00 0.61 N ATOM 393 CA TYR A 81 9.227 -11.772 4.559 1.00 0.60 C ATOM 394 C TYR A 81 9.652 -10.662 5.514 1.00 0.51 C ATOM 395 O TYR A 81 8.966 -9.679 5.709 1.00 0.45 O ATOM 396 CB TYR A 81 8.763 -13.041 5.318 1.00 0.69 C ATOM 397 CG TYR A 81 8.294 -12.705 6.721 1.00 0.60 C ATOM 398 CD1 TYR A 81 6.988 -12.249 6.937 1.00 0.59 C ATOM 399 CD2 TYR A 81 9.174 -12.846 7.801 1.00 0.71 C ATOM 400 CE1 TYR A 81 6.563 -11.934 8.233 1.00 0.66 C ATOM 401 CE2 TYR A 81 8.749 -12.532 9.096 1.00 0.77 C ATOM 402 CZ TYR A 81 7.444 -12.076 9.313 1.00 0.73 C ATOM 403 OH TYR A 81 7.025 -11.765 10.590 1.00 0.90 O ATOM 0 H TYR A 81 10.717 -13.070 3.752 1.00 0.61 H new ATOM 0 HA TYR A 81 8.385 -11.453 3.945 1.00 0.60 H new ATOM 0 HB2 TYR A 81 7.954 -13.521 4.767 1.00 0.69 H new ATOM 0 HB3 TYR A 81 9.583 -13.757 5.368 1.00 0.69 H new ATOM 0 HD1 TYR A 81 6.309 -12.140 6.104 1.00 0.59 H new ATOM 0 HD2 TYR A 81 10.181 -13.197 7.634 1.00 0.71 H new ATOM 0 HE1 TYR A 81 5.556 -11.582 8.400 1.00 0.66 H new ATOM 0 HE2 TYR A 81 9.428 -12.641 9.929 1.00 0.77 H new ATOM 0 HH TYR A 81 6.047 -11.711 10.609 1.00 0.90 H new ATOM 413 N LYS A 82 10.826 -10.811 6.058 1.00 0.52 N ATOM 414 CA LYS A 82 11.376 -9.772 6.952 1.00 0.48 C ATOM 415 C LYS A 82 11.442 -8.467 6.165 1.00 0.40 C ATOM 416 O LYS A 82 11.337 -7.391 6.718 1.00 0.38 O ATOM 417 CB LYS A 82 12.782 -10.182 7.395 1.00 0.55 C ATOM 418 CG LYS A 82 13.311 -9.190 8.431 1.00 0.60 C ATOM 419 CD LYS A 82 14.552 -9.777 9.112 1.00 0.92 C ATOM 420 CE LYS A 82 15.618 -10.123 8.061 1.00 1.49 C ATOM 421 NZ LYS A 82 15.338 -11.474 7.492 1.00 2.32 N ATOM 0 H LYS A 82 11.431 -11.620 5.916 1.00 0.52 H new ATOM 0 HA LYS A 82 10.750 -9.649 7.835 1.00 0.48 H new ATOM 0 HB2 LYS A 82 12.761 -11.186 7.818 1.00 0.55 H new ATOM 0 HB3 LYS A 82 13.450 -10.213 6.534 1.00 0.55 H new ATOM 0 HG2 LYS A 82 13.560 -8.244 7.950 1.00 0.60 H new ATOM 0 HG3 LYS A 82 12.542 -8.978 9.173 1.00 0.60 H new ATOM 0 HD2 LYS A 82 14.956 -9.062 9.829 1.00 0.92 H new ATOM 0 HD3 LYS A 82 14.280 -10.671 9.673 1.00 0.92 H new ATOM 0 HE2 LYS A 82 15.617 -9.376 7.268 1.00 1.49 H new ATOM 0 HE3 LYS A 82 16.609 -10.106 8.514 1.00 1.49 H new ATOM 0 HZ1 LYS A 82 16.219 -12.026 7.459 1.00 2.32 H new ATOM 0 HZ2 LYS A 82 14.643 -11.965 8.090 1.00 2.32 H new ATOM 0 HZ3 LYS A 82 14.957 -11.373 6.530 1.00 2.32 H new ATOM 435 N ALA A 83 11.615 -8.551 4.863 1.00 0.42 N ATOM 436 CA ALA A 83 11.681 -7.293 4.058 1.00 0.41 C ATOM 437 C ALA A 83 10.330 -6.568 4.118 1.00 0.35 C ATOM 438 O ALA A 83 10.268 -5.366 4.283 1.00 0.34 O ATOM 439 CB ALA A 83 12.020 -7.622 2.600 1.00 0.52 C ATOM 0 H ALA A 83 11.711 -9.419 4.336 1.00 0.42 H new ATOM 0 HA ALA A 83 12.457 -6.649 4.471 1.00 0.41 H new ATOM 0 HB1 ALA A 83 12.066 -6.700 2.020 1.00 0.52 H new ATOM 0 HB2 ALA A 83 12.985 -8.127 2.556 1.00 0.52 H new ATOM 0 HB3 ALA A 83 11.250 -8.273 2.185 1.00 0.52 H new ATOM 445 N ALA A 84 9.249 -7.288 3.979 1.00 0.34 N ATOM 446 CA ALA A 84 7.906 -6.640 4.020 1.00 0.31 C ATOM 447 C ALA A 84 7.683 -5.988 5.386 1.00 0.28 C ATOM 448 O ALA A 84 7.303 -4.838 5.478 1.00 0.28 O ATOM 449 CB ALA A 84 6.825 -7.694 3.777 1.00 0.34 C ATOM 0 H ALA A 84 9.238 -8.298 3.839 1.00 0.34 H new ATOM 0 HA ALA A 84 7.854 -5.875 3.245 1.00 0.31 H new ATOM 0 HB1 ALA A 84 5.843 -7.222 3.807 1.00 0.34 H new ATOM 0 HB2 ALA A 84 6.977 -8.153 2.800 1.00 0.34 H new ATOM 0 HB3 ALA A 84 6.883 -8.460 4.551 1.00 0.34 H new ATOM 455 N VAL A 85 7.910 -6.710 6.450 1.00 0.29 N ATOM 456 CA VAL A 85 7.700 -6.117 7.801 1.00 0.29 C ATOM 457 C VAL A 85 8.690 -4.973 8.009 1.00 0.29 C ATOM 458 O VAL A 85 8.336 -3.919 8.498 1.00 0.30 O ATOM 459 CB VAL A 85 7.902 -7.187 8.886 1.00 0.33 C ATOM 460 CG1 VAL A 85 7.232 -6.737 10.187 1.00 0.37 C ATOM 461 CG2 VAL A 85 7.273 -8.503 8.435 1.00 0.38 C ATOM 0 H VAL A 85 8.230 -7.679 6.443 1.00 0.29 H new ATOM 0 HA VAL A 85 6.681 -5.735 7.872 1.00 0.29 H new ATOM 0 HB VAL A 85 8.970 -7.326 9.051 1.00 0.33 H new ATOM 0 HG11 VAL A 85 7.378 -7.498 10.953 1.00 0.37 H new ATOM 0 HG12 VAL A 85 7.676 -5.798 10.519 1.00 0.37 H new ATOM 0 HG13 VAL A 85 6.165 -6.594 10.016 1.00 0.37 H new ATOM 0 HG21 VAL A 85 7.418 -9.259 9.207 1.00 0.38 H new ATOM 0 HG22 VAL A 85 6.206 -8.357 8.266 1.00 0.38 H new ATOM 0 HG23 VAL A 85 7.745 -8.834 7.510 1.00 0.38 H new ATOM 471 N ASP A 86 9.923 -5.161 7.632 1.00 0.30 N ATOM 472 CA ASP A 86 10.912 -4.064 7.803 1.00 0.32 C ATOM 473 C ASP A 86 10.442 -2.870 6.977 1.00 0.30 C ATOM 474 O ASP A 86 10.394 -1.753 7.451 1.00 0.31 O ATOM 475 CB ASP A 86 12.285 -4.525 7.312 1.00 0.36 C ATOM 476 CG ASP A 86 12.883 -5.507 8.321 1.00 0.42 C ATOM 477 OD1 ASP A 86 12.186 -5.864 9.256 1.00 1.05 O ATOM 478 OD2 ASP A 86 14.029 -5.887 8.141 1.00 1.23 O ATOM 0 H ASP A 86 10.286 -6.019 7.217 1.00 0.30 H new ATOM 0 HA ASP A 86 10.993 -3.788 8.854 1.00 0.32 H new ATOM 0 HB2 ASP A 86 12.193 -5.001 6.336 1.00 0.36 H new ATOM 0 HB3 ASP A 86 12.946 -3.667 7.188 1.00 0.36 H new ATOM 483 N LEU A 87 10.075 -3.104 5.745 1.00 0.29 N ATOM 484 CA LEU A 87 9.586 -1.990 4.891 1.00 0.30 C ATOM 485 C LEU A 87 8.323 -1.405 5.517 1.00 0.29 C ATOM 486 O LEU A 87 8.140 -0.205 5.562 1.00 0.30 O ATOM 487 CB LEU A 87 9.266 -2.516 3.485 1.00 0.33 C ATOM 488 CG LEU A 87 8.916 -1.350 2.541 1.00 0.42 C ATOM 489 CD1 LEU A 87 10.184 -0.578 2.141 1.00 0.52 C ATOM 490 CD2 LEU A 87 8.243 -1.908 1.282 1.00 0.44 C ATOM 0 H LEU A 87 10.094 -4.020 5.296 1.00 0.29 H new ATOM 0 HA LEU A 87 10.354 -1.220 4.816 1.00 0.30 H new ATOM 0 HB2 LEU A 87 10.121 -3.066 3.092 1.00 0.33 H new ATOM 0 HB3 LEU A 87 8.432 -3.216 3.533 1.00 0.33 H new ATOM 0 HG LEU A 87 8.241 -0.668 3.058 1.00 0.42 H new ATOM 0 HD11 LEU A 87 9.916 0.241 1.474 1.00 0.52 H new ATOM 0 HD12 LEU A 87 10.663 -0.177 3.034 1.00 0.52 H new ATOM 0 HD13 LEU A 87 10.873 -1.250 1.630 1.00 0.52 H new ATOM 0 HD21 LEU A 87 7.993 -1.088 0.609 1.00 0.44 H new ATOM 0 HD22 LEU A 87 8.924 -2.595 0.779 1.00 0.44 H new ATOM 0 HD23 LEU A 87 7.333 -2.439 1.561 1.00 0.44 H new ATOM 502 N SER A 88 7.442 -2.243 5.998 1.00 0.30 N ATOM 503 CA SER A 88 6.194 -1.724 6.612 1.00 0.34 C ATOM 504 C SER A 88 6.537 -0.629 7.625 1.00 0.33 C ATOM 505 O SER A 88 6.093 0.496 7.510 1.00 0.36 O ATOM 506 CB SER A 88 5.467 -2.867 7.321 1.00 0.40 C ATOM 507 OG SER A 88 6.101 -3.126 8.567 1.00 0.44 O ATOM 0 H SER A 88 7.536 -3.259 5.990 1.00 0.30 H new ATOM 0 HA SER A 88 5.552 -1.308 5.836 1.00 0.34 H new ATOM 0 HB2 SER A 88 4.421 -2.605 7.480 1.00 0.40 H new ATOM 0 HB3 SER A 88 5.481 -3.763 6.700 1.00 0.40 H new ATOM 0 HG SER A 88 7.008 -3.462 8.409 1.00 0.44 H new ATOM 513 N HIS A 89 7.318 -0.948 8.619 1.00 0.34 N ATOM 514 CA HIS A 89 7.673 0.074 9.642 1.00 0.36 C ATOM 515 C HIS A 89 8.603 1.132 9.040 1.00 0.36 C ATOM 516 O HIS A 89 8.597 2.272 9.459 1.00 0.41 O ATOM 517 CB HIS A 89 8.371 -0.608 10.827 1.00 0.41 C ATOM 518 CG HIS A 89 7.349 -1.258 11.719 1.00 0.52 C ATOM 519 ND1 HIS A 89 6.806 -0.605 12.815 1.00 1.43 N ATOM 520 CD2 HIS A 89 6.762 -2.498 11.692 1.00 1.01 C ATOM 521 CE1 HIS A 89 5.936 -1.449 13.398 1.00 1.27 C ATOM 522 NE2 HIS A 89 5.870 -2.617 12.754 1.00 0.82 N ATOM 0 H HIS A 89 7.725 -1.871 8.767 1.00 0.34 H new ATOM 0 HA HIS A 89 6.760 0.562 9.984 1.00 0.36 H new ATOM 0 HB2 HIS A 89 9.077 -1.355 10.464 1.00 0.41 H new ATOM 0 HB3 HIS A 89 8.946 0.125 11.392 1.00 0.41 H new ATOM 0 HD1 HIS A 89 7.026 0.342 13.123 1.00 1.43 H new ATOM 0 HD2 HIS A 89 6.962 -3.265 10.958 1.00 1.01 H new ATOM 0 HE1 HIS A 89 5.360 -1.211 14.280 1.00 1.27 H new ATOM 530 N PHE A 90 9.397 0.785 8.065 1.00 0.34 N ATOM 531 CA PHE A 90 10.296 1.811 7.475 1.00 0.37 C ATOM 532 C PHE A 90 9.438 2.982 6.999 1.00 0.40 C ATOM 533 O PHE A 90 9.579 4.100 7.450 1.00 0.47 O ATOM 534 CB PHE A 90 11.048 1.216 6.283 1.00 0.38 C ATOM 535 CG PHE A 90 12.067 2.208 5.774 1.00 0.47 C ATOM 536 CD1 PHE A 90 11.690 3.170 4.830 1.00 0.59 C ATOM 537 CD2 PHE A 90 13.387 2.164 6.240 1.00 0.57 C ATOM 538 CE1 PHE A 90 12.632 4.089 4.353 1.00 0.70 C ATOM 539 CE2 PHE A 90 14.329 3.083 5.762 1.00 0.69 C ATOM 540 CZ PHE A 90 13.952 4.046 4.818 1.00 0.72 C ATOM 0 H PHE A 90 9.461 -0.148 7.658 1.00 0.34 H new ATOM 0 HA PHE A 90 11.019 2.146 8.218 1.00 0.37 H new ATOM 0 HB2 PHE A 90 11.543 0.291 6.579 1.00 0.38 H new ATOM 0 HB3 PHE A 90 10.346 0.962 5.489 1.00 0.38 H new ATOM 0 HD1 PHE A 90 10.672 3.203 4.470 1.00 0.59 H new ATOM 0 HD2 PHE A 90 13.678 1.421 6.968 1.00 0.57 H new ATOM 0 HE1 PHE A 90 12.340 4.832 3.626 1.00 0.70 H new ATOM 0 HE2 PHE A 90 15.347 3.049 6.122 1.00 0.69 H new ATOM 0 HZ PHE A 90 14.679 4.755 4.449 1.00 0.72 H new ATOM 550 N LEU A 91 8.542 2.719 6.091 1.00 0.37 N ATOM 551 CA LEU A 91 7.653 3.794 5.571 1.00 0.42 C ATOM 552 C LEU A 91 6.765 4.345 6.693 1.00 0.47 C ATOM 553 O LEU A 91 6.375 5.491 6.671 1.00 0.57 O ATOM 554 CB LEU A 91 6.760 3.217 4.466 1.00 0.41 C ATOM 555 CG LEU A 91 7.617 2.765 3.275 1.00 0.41 C ATOM 556 CD1 LEU A 91 6.742 1.977 2.293 1.00 0.42 C ATOM 557 CD2 LEU A 91 8.223 3.987 2.558 1.00 0.54 C ATOM 0 H LEU A 91 8.386 1.797 5.683 1.00 0.37 H new ATOM 0 HA LEU A 91 8.270 4.602 5.177 1.00 0.42 H new ATOM 0 HB2 LEU A 91 6.189 2.373 4.853 1.00 0.41 H new ATOM 0 HB3 LEU A 91 6.040 3.968 4.141 1.00 0.41 H new ATOM 0 HG LEU A 91 8.427 2.133 3.639 1.00 0.41 H new ATOM 0 HD11 LEU A 91 7.347 1.654 1.445 1.00 0.42 H new ATOM 0 HD12 LEU A 91 6.326 1.104 2.796 1.00 0.42 H new ATOM 0 HD13 LEU A 91 5.930 2.612 1.938 1.00 0.42 H new ATOM 0 HD21 LEU A 91 8.828 3.652 1.716 1.00 0.54 H new ATOM 0 HD22 LEU A 91 7.421 4.631 2.195 1.00 0.54 H new ATOM 0 HD23 LEU A 91 8.849 4.544 3.255 1.00 0.54 H new ATOM 569 N LYS A 92 6.414 3.539 7.659 1.00 0.45 N ATOM 570 CA LYS A 92 5.518 4.037 8.747 1.00 0.53 C ATOM 571 C LYS A 92 6.170 5.205 9.493 1.00 0.63 C ATOM 572 O LYS A 92 5.524 6.187 9.801 1.00 0.85 O ATOM 573 CB LYS A 92 5.226 2.887 9.728 1.00 0.54 C ATOM 574 CG LYS A 92 3.958 3.175 10.574 1.00 0.73 C ATOM 575 CD LYS A 92 4.337 3.860 11.893 1.00 1.20 C ATOM 576 CE LYS A 92 3.066 4.180 12.680 1.00 1.61 C ATOM 577 NZ LYS A 92 2.322 5.276 11.999 1.00 2.27 N ATOM 0 H LYS A 92 6.705 2.565 7.743 1.00 0.45 H new ATOM 0 HA LYS A 92 4.587 4.391 8.305 1.00 0.53 H new ATOM 0 HB2 LYS A 92 5.092 1.958 9.173 1.00 0.54 H new ATOM 0 HB3 LYS A 92 6.081 2.744 10.388 1.00 0.54 H new ATOM 0 HG2 LYS A 92 3.274 3.810 10.011 1.00 0.73 H new ATOM 0 HG3 LYS A 92 3.431 2.243 10.779 1.00 0.73 H new ATOM 0 HD2 LYS A 92 4.988 3.211 12.479 1.00 1.20 H new ATOM 0 HD3 LYS A 92 4.895 4.775 11.694 1.00 1.20 H new ATOM 0 HE2 LYS A 92 2.438 3.292 12.754 1.00 1.61 H new ATOM 0 HE3 LYS A 92 3.321 4.477 13.697 1.00 1.61 H new ATOM 0 HZ1 LYS A 92 2.082 6.015 12.691 1.00 2.27 H new ATOM 0 HZ2 LYS A 92 2.915 5.684 11.248 1.00 2.27 H new ATOM 0 HZ3 LYS A 92 1.448 4.896 11.582 1.00 2.27 H new ATOM 591 N GLU A 93 7.431 5.112 9.800 1.00 0.62 N ATOM 592 CA GLU A 93 8.095 6.225 10.537 1.00 0.76 C ATOM 593 C GLU A 93 8.246 7.441 9.615 1.00 0.77 C ATOM 594 O GLU A 93 7.618 8.463 9.811 1.00 1.05 O ATOM 595 CB GLU A 93 9.476 5.762 11.026 1.00 0.94 C ATOM 596 CG GLU A 93 9.329 4.985 12.340 1.00 1.22 C ATOM 597 CD GLU A 93 8.327 3.844 12.152 1.00 2.00 C ATOM 598 OE1 GLU A 93 8.752 2.764 11.775 1.00 2.73 O ATOM 599 OE2 GLU A 93 7.152 4.068 12.392 1.00 2.54 O ATOM 0 H GLU A 93 8.031 4.318 9.575 1.00 0.62 H new ATOM 0 HA GLU A 93 7.485 6.507 11.396 1.00 0.76 H new ATOM 0 HB2 GLU A 93 9.947 5.132 10.271 1.00 0.94 H new ATOM 0 HB3 GLU A 93 10.127 6.624 11.173 1.00 0.94 H new ATOM 0 HG2 GLU A 93 10.295 4.587 12.649 1.00 1.22 H new ATOM 0 HG3 GLU A 93 8.991 5.652 13.133 1.00 1.22 H new ATOM 606 N LYS A 94 9.088 7.346 8.623 1.00 0.80 N ATOM 607 CA LYS A 94 9.297 8.501 7.703 1.00 1.02 C ATOM 608 C LYS A 94 8.128 8.632 6.720 1.00 0.96 C ATOM 609 O LYS A 94 7.645 9.715 6.459 1.00 1.41 O ATOM 610 CB LYS A 94 10.587 8.293 6.908 1.00 1.39 C ATOM 611 CG LYS A 94 11.767 8.118 7.867 1.00 1.63 C ATOM 612 CD LYS A 94 13.057 7.985 7.054 1.00 2.18 C ATOM 613 CE LYS A 94 14.210 7.569 7.973 1.00 2.61 C ATOM 614 NZ LYS A 94 14.115 6.109 8.251 1.00 2.96 N ATOM 0 H LYS A 94 9.642 6.517 8.409 1.00 0.80 H new ATOM 0 HA LYS A 94 9.362 9.409 8.302 1.00 1.02 H new ATOM 0 HB2 LYS A 94 10.493 7.415 6.269 1.00 1.39 H new ATOM 0 HB3 LYS A 94 10.763 9.147 6.253 1.00 1.39 H new ATOM 0 HG2 LYS A 94 11.834 8.972 8.541 1.00 1.63 H new ATOM 0 HG3 LYS A 94 11.620 7.233 8.487 1.00 1.63 H new ATOM 0 HD2 LYS A 94 12.925 7.246 6.264 1.00 2.18 H new ATOM 0 HD3 LYS A 94 13.291 8.932 6.568 1.00 2.18 H new ATOM 0 HE2 LYS A 94 15.166 7.800 7.503 1.00 2.61 H new ATOM 0 HE3 LYS A 94 14.168 8.132 8.905 1.00 2.61 H new ATOM 0 HZ1 LYS A 94 14.981 5.790 8.730 1.00 2.96 H new ATOM 0 HZ2 LYS A 94 13.294 5.925 8.862 1.00 2.96 H new ATOM 0 HZ3 LYS A 94 14.004 5.592 7.356 1.00 2.96 H new ATOM 628 N GLY A 95 7.688 7.544 6.148 1.00 1.12 N ATOM 629 CA GLY A 95 6.574 7.624 5.158 1.00 1.51 C ATOM 630 C GLY A 95 5.252 7.995 5.845 1.00 1.10 C ATOM 631 O GLY A 95 4.850 9.141 5.850 1.00 1.71 O ATOM 0 H GLY A 95 8.050 6.606 6.322 1.00 1.12 H new ATOM 0 HA2 GLY A 95 6.813 8.366 4.396 1.00 1.51 H new ATOM 0 HA3 GLY A 95 6.467 6.667 4.648 1.00 1.51 H new ATOM 635 N GLY A 96 4.567 7.036 6.417 1.00 1.17 N ATOM 636 CA GLY A 96 3.264 7.334 7.091 1.00 0.99 C ATOM 637 C GLY A 96 2.114 7.063 6.114 1.00 0.81 C ATOM 638 O GLY A 96 1.274 7.907 5.877 1.00 0.83 O ATOM 0 H GLY A 96 4.854 6.058 6.447 1.00 1.17 H new ATOM 0 HA2 GLY A 96 3.153 6.716 7.982 1.00 0.99 H new ATOM 0 HA3 GLY A 96 3.240 8.373 7.419 1.00 0.99 H new ATOM 642 N LEU A 97 2.070 5.885 5.547 1.00 0.67 N ATOM 643 CA LEU A 97 0.978 5.545 4.588 1.00 0.55 C ATOM 644 C LEU A 97 -0.238 5.062 5.373 1.00 0.46 C ATOM 645 O LEU A 97 -0.967 4.186 4.961 1.00 0.49 O ATOM 646 CB LEU A 97 1.470 4.448 3.654 1.00 0.54 C ATOM 647 CG LEU A 97 0.506 4.265 2.456 1.00 0.54 C ATOM 648 CD1 LEU A 97 0.865 5.237 1.330 1.00 0.65 C ATOM 649 CD2 LEU A 97 0.608 2.827 1.928 1.00 0.66 C ATOM 0 H LEU A 97 2.748 5.140 5.708 1.00 0.67 H new ATOM 0 HA LEU A 97 0.699 6.420 4.001 1.00 0.55 H new ATOM 0 HB2 LEU A 97 2.467 4.696 3.289 1.00 0.54 H new ATOM 0 HB3 LEU A 97 1.556 3.510 4.203 1.00 0.54 H new ATOM 0 HG LEU A 97 -0.511 4.467 2.793 1.00 0.54 H new ATOM 0 HD11 LEU A 97 0.179 5.096 0.495 1.00 0.65 H new ATOM 0 HD12 LEU A 97 0.787 6.261 1.695 1.00 0.65 H new ATOM 0 HD13 LEU A 97 1.885 5.047 0.997 1.00 0.65 H new ATOM 0 HD21 LEU A 97 -0.071 2.700 1.085 1.00 0.66 H new ATOM 0 HD22 LEU A 97 1.630 2.630 1.604 1.00 0.66 H new ATOM 0 HD23 LEU A 97 0.338 2.129 2.720 1.00 0.66 H new ATOM 661 N GLU A 98 -0.436 5.635 6.513 1.00 0.44 N ATOM 662 CA GLU A 98 -1.597 5.262 7.379 1.00 0.40 C ATOM 663 C GLU A 98 -2.908 5.412 6.593 1.00 0.40 C ATOM 664 O GLU A 98 -2.993 5.099 5.425 1.00 0.58 O ATOM 665 CB GLU A 98 -1.622 6.189 8.609 1.00 0.49 C ATOM 666 CG GLU A 98 -2.389 5.522 9.768 1.00 0.48 C ATOM 667 CD GLU A 98 -1.466 4.576 10.545 1.00 1.26 C ATOM 668 OE1 GLU A 98 -0.279 4.853 10.615 1.00 1.94 O ATOM 669 OE2 GLU A 98 -1.966 3.592 11.063 1.00 2.03 O ATOM 0 H GLU A 98 0.165 6.363 6.899 1.00 0.44 H new ATOM 0 HA GLU A 98 -1.495 4.225 7.698 1.00 0.40 H new ATOM 0 HB2 GLU A 98 -0.603 6.416 8.922 1.00 0.49 H new ATOM 0 HB3 GLU A 98 -2.094 7.136 8.349 1.00 0.49 H new ATOM 0 HG2 GLU A 98 -2.785 6.286 10.438 1.00 0.48 H new ATOM 0 HG3 GLU A 98 -3.242 4.968 9.377 1.00 0.48 H new ATOM 676 N GLY A 99 -3.928 5.883 7.246 1.00 0.39 N ATOM 677 CA GLY A 99 -5.260 6.061 6.592 1.00 0.42 C ATOM 678 C GLY A 99 -5.174 7.067 5.438 1.00 0.42 C ATOM 679 O GLY A 99 -6.089 7.828 5.198 1.00 0.46 O ATOM 0 H GLY A 99 -3.899 6.160 8.227 1.00 0.39 H new ATOM 0 HA2 GLY A 99 -5.617 5.102 6.217 1.00 0.42 H new ATOM 0 HA3 GLY A 99 -5.987 6.406 7.327 1.00 0.42 H new ATOM 683 N LEU A 100 -4.094 7.062 4.716 1.00 0.41 N ATOM 684 CA LEU A 100 -3.959 8.004 3.566 1.00 0.43 C ATOM 685 C LEU A 100 -4.926 7.554 2.460 1.00 0.42 C ATOM 686 O LEU A 100 -4.784 6.489 1.894 1.00 0.44 O ATOM 687 CB LEU A 100 -2.509 7.971 3.050 1.00 0.45 C ATOM 688 CG LEU A 100 -2.167 9.286 2.316 1.00 0.55 C ATOM 689 CD1 LEU A 100 -1.759 10.370 3.324 1.00 1.15 C ATOM 690 CD2 LEU A 100 -1.002 9.046 1.349 1.00 1.17 C ATOM 0 H LEU A 100 -3.295 6.447 4.869 1.00 0.41 H new ATOM 0 HA LEU A 100 -4.198 9.022 3.873 1.00 0.43 H new ATOM 0 HB2 LEU A 100 -1.823 7.824 3.884 1.00 0.45 H new ATOM 0 HB3 LEU A 100 -2.376 7.125 2.375 1.00 0.45 H new ATOM 0 HG LEU A 100 -3.048 9.617 1.767 1.00 0.55 H new ATOM 0 HD11 LEU A 100 -1.521 11.291 2.792 1.00 1.15 H new ATOM 0 HD12 LEU A 100 -2.582 10.553 4.015 1.00 1.15 H new ATOM 0 HD13 LEU A 100 -0.884 10.037 3.882 1.00 1.15 H new ATOM 0 HD21 LEU A 100 -0.761 9.975 0.831 1.00 1.17 H new ATOM 0 HD22 LEU A 100 -0.130 8.705 1.907 1.00 1.17 H new ATOM 0 HD23 LEU A 100 -1.285 8.287 0.620 1.00 1.17 H new ATOM 702 N ILE A 101 -5.928 8.344 2.180 1.00 0.44 N ATOM 703 CA ILE A 101 -6.935 7.956 1.146 1.00 0.45 C ATOM 704 C ILE A 101 -6.297 7.814 -0.241 1.00 0.46 C ATOM 705 O ILE A 101 -5.853 8.770 -0.846 1.00 0.49 O ATOM 706 CB ILE A 101 -8.068 9.000 1.136 1.00 0.50 C ATOM 707 CG1 ILE A 101 -8.961 8.804 2.387 1.00 0.51 C ATOM 708 CG2 ILE A 101 -8.916 8.882 -0.139 1.00 0.54 C ATOM 709 CD1 ILE A 101 -9.996 7.674 2.184 1.00 0.52 C ATOM 0 H ILE A 101 -6.094 9.247 2.625 1.00 0.44 H new ATOM 0 HA ILE A 101 -7.345 6.979 1.400 1.00 0.45 H new ATOM 0 HB ILE A 101 -7.624 9.995 1.154 1.00 0.50 H new ATOM 0 HG12 ILE A 101 -8.334 8.572 3.248 1.00 0.51 H new ATOM 0 HG13 ILE A 101 -9.480 9.736 2.612 1.00 0.51 H new ATOM 0 HG21 ILE A 101 -9.708 9.631 -0.120 1.00 0.54 H new ATOM 0 HG22 ILE A 101 -8.284 9.044 -1.012 1.00 0.54 H new ATOM 0 HG23 ILE A 101 -9.358 7.887 -0.191 1.00 0.54 H new ATOM 0 HD11 ILE A 101 -10.602 7.569 3.084 1.00 0.52 H new ATOM 0 HD12 ILE A 101 -10.640 7.918 1.339 1.00 0.52 H new ATOM 0 HD13 ILE A 101 -9.477 6.736 1.985 1.00 0.52 H new ATOM 721 N HIS A 102 -6.282 6.607 -0.749 1.00 0.47 N ATOM 722 CA HIS A 102 -5.717 6.345 -2.103 1.00 0.51 C ATOM 723 C HIS A 102 -6.634 6.985 -3.153 1.00 0.58 C ATOM 724 O HIS A 102 -7.744 6.538 -3.377 1.00 0.64 O ATOM 725 CB HIS A 102 -5.631 4.822 -2.312 1.00 0.57 C ATOM 726 CG HIS A 102 -5.562 4.475 -3.780 1.00 0.64 C ATOM 727 ND1 HIS A 102 -6.677 4.514 -4.603 1.00 1.41 N ATOM 728 CD2 HIS A 102 -4.527 4.050 -4.572 1.00 0.64 C ATOM 729 CE1 HIS A 102 -6.290 4.116 -5.829 1.00 1.36 C ATOM 730 NE2 HIS A 102 -4.988 3.823 -5.865 1.00 0.70 N ATOM 0 H HIS A 102 -6.644 5.781 -0.273 1.00 0.47 H new ATOM 0 HA HIS A 102 -4.720 6.774 -2.199 1.00 0.51 H new ATOM 0 HB2 HIS A 102 -4.751 4.431 -1.802 1.00 0.57 H new ATOM 0 HB3 HIS A 102 -6.500 4.341 -1.862 1.00 0.57 H new ATOM 0 HD1 HIS A 102 -7.619 4.793 -4.329 1.00 1.41 H new ATOM 0 HD2 HIS A 102 -3.508 3.912 -4.242 1.00 0.64 H new ATOM 0 HE1 HIS A 102 -6.952 4.043 -6.679 1.00 1.36 H new ATOM 738 N SER A 103 -6.174 8.029 -3.792 1.00 0.60 N ATOM 739 CA SER A 103 -7.007 8.708 -4.826 1.00 0.69 C ATOM 740 C SER A 103 -7.107 7.827 -6.079 1.00 0.76 C ATOM 741 O SER A 103 -8.150 7.283 -6.385 1.00 0.85 O ATOM 742 CB SER A 103 -6.369 10.051 -5.189 1.00 0.74 C ATOM 743 OG SER A 103 -5.253 9.833 -6.043 1.00 1.49 O ATOM 0 H SER A 103 -5.253 8.441 -3.641 1.00 0.60 H new ATOM 0 HA SER A 103 -8.009 8.875 -4.430 1.00 0.69 H new ATOM 0 HB2 SER A 103 -7.100 10.690 -5.685 1.00 0.74 H new ATOM 0 HB3 SER A 103 -6.052 10.571 -4.285 1.00 0.74 H new ATOM 0 HG SER A 103 -4.846 10.694 -6.276 1.00 1.49 H new ATOM 749 N GLN A 104 -6.029 7.696 -6.807 1.00 0.81 N ATOM 750 CA GLN A 104 -6.055 6.867 -8.045 1.00 0.92 C ATOM 751 C GLN A 104 -4.625 6.458 -8.412 1.00 0.93 C ATOM 752 O GLN A 104 -4.230 5.322 -8.249 1.00 1.37 O ATOM 753 CB GLN A 104 -6.660 7.684 -9.188 1.00 1.06 C ATOM 754 CG GLN A 104 -6.813 6.799 -10.426 1.00 1.76 C ATOM 755 CD GLN A 104 -7.593 7.558 -11.501 1.00 2.14 C ATOM 756 OE1 GLN A 104 -7.202 8.637 -11.903 1.00 2.64 O ATOM 757 NE2 GLN A 104 -8.689 7.041 -11.984 1.00 2.70 N ATOM 0 H GLN A 104 -5.130 8.129 -6.596 1.00 0.81 H new ATOM 0 HA GLN A 104 -6.657 5.974 -7.876 1.00 0.92 H new ATOM 0 HB2 GLN A 104 -7.630 8.081 -8.890 1.00 1.06 H new ATOM 0 HB3 GLN A 104 -6.022 8.538 -9.416 1.00 1.06 H new ATOM 0 HG2 GLN A 104 -5.832 6.514 -10.806 1.00 1.76 H new ATOM 0 HG3 GLN A 104 -7.334 5.878 -10.166 1.00 1.76 H new ATOM 0 HE21 GLN A 104 -9.018 6.136 -11.647 1.00 2.70 H new ATOM 0 HE22 GLN A 104 -9.217 7.542 -12.698 1.00 2.70 H new ATOM 766 N ARG A 105 -3.848 7.382 -8.907 1.00 0.83 N ATOM 767 CA ARG A 105 -2.444 7.057 -9.287 1.00 0.87 C ATOM 768 C ARG A 105 -1.590 6.903 -8.026 1.00 0.74 C ATOM 769 O ARG A 105 -0.449 6.489 -8.085 1.00 0.70 O ATOM 770 CB ARG A 105 -1.877 8.187 -10.147 1.00 1.06 C ATOM 771 CG ARG A 105 -2.878 8.548 -11.249 1.00 1.71 C ATOM 772 CD ARG A 105 -2.248 9.588 -12.175 1.00 1.99 C ATOM 773 NE ARG A 105 -1.826 10.771 -11.376 1.00 2.86 N ATOM 774 CZ ARG A 105 -0.981 11.628 -11.876 1.00 3.60 C ATOM 775 NH1 ARG A 105 -0.487 11.439 -13.069 1.00 3.73 N ATOM 776 NH2 ARG A 105 -0.621 12.671 -11.179 1.00 4.61 N ATOM 0 H ARG A 105 -4.126 8.351 -9.065 1.00 0.83 H new ATOM 0 HA ARG A 105 -2.429 6.124 -9.850 1.00 0.87 H new ATOM 0 HB2 ARG A 105 -1.672 9.060 -9.528 1.00 1.06 H new ATOM 0 HB3 ARG A 105 -0.929 7.880 -10.589 1.00 1.06 H new ATOM 0 HG2 ARG A 105 -3.152 7.657 -11.815 1.00 1.71 H new ATOM 0 HG3 ARG A 105 -3.795 8.941 -10.810 1.00 1.71 H new ATOM 0 HD2 ARG A 105 -1.389 9.159 -12.691 1.00 1.99 H new ATOM 0 HD3 ARG A 105 -2.962 9.889 -12.941 1.00 1.99 H new ATOM 0 HE ARG A 105 -2.198 10.911 -10.437 1.00 2.86 H new ATOM 0 HH11 ARG A 105 -0.762 10.620 -13.611 1.00 3.73 H new ATOM 0 HH12 ARG A 105 0.174 12.110 -13.459 1.00 3.73 H new ATOM 0 HH21 ARG A 105 -1.001 12.815 -10.243 1.00 4.61 H new ATOM 0 HH22 ARG A 105 0.040 13.342 -11.570 1.00 4.61 H new ATOM 790 N ARG A 106 -2.128 7.242 -6.888 1.00 0.71 N ATOM 791 CA ARG A 106 -1.342 7.120 -5.627 1.00 0.65 C ATOM 792 C ARG A 106 -0.789 5.694 -5.515 1.00 0.54 C ATOM 793 O ARG A 106 0.265 5.466 -4.954 1.00 0.50 O ATOM 794 CB ARG A 106 -2.262 7.437 -4.425 1.00 0.70 C ATOM 795 CG ARG A 106 -1.474 8.157 -3.313 1.00 1.01 C ATOM 796 CD ARG A 106 -1.425 9.662 -3.599 1.00 1.24 C ATOM 797 NE ARG A 106 -0.627 10.340 -2.540 1.00 1.86 N ATOM 798 CZ ARG A 106 -0.207 11.562 -2.721 1.00 2.48 C ATOM 799 NH1 ARG A 106 -0.484 12.190 -3.831 1.00 2.86 N ATOM 800 NH2 ARG A 106 0.490 12.156 -1.792 1.00 3.29 N ATOM 0 H ARG A 106 -3.077 7.598 -6.776 1.00 0.71 H new ATOM 0 HA ARG A 106 -0.509 7.823 -5.632 1.00 0.65 H new ATOM 0 HB2 ARG A 106 -3.094 8.062 -4.751 1.00 0.70 H new ATOM 0 HB3 ARG A 106 -2.691 6.514 -4.035 1.00 0.70 H new ATOM 0 HG2 ARG A 106 -1.945 7.977 -2.347 1.00 1.01 H new ATOM 0 HG3 ARG A 106 -0.462 7.756 -3.254 1.00 1.01 H new ATOM 0 HD2 ARG A 106 -0.980 9.843 -4.577 1.00 1.24 H new ATOM 0 HD3 ARG A 106 -2.435 10.071 -3.627 1.00 1.24 H new ATOM 0 HE ARG A 106 -0.409 9.849 -1.673 1.00 1.86 H new ATOM 0 HH11 ARG A 106 -1.029 11.726 -4.557 1.00 2.86 H new ATOM 0 HH12 ARG A 106 -0.156 13.145 -3.972 1.00 2.86 H new ATOM 0 HH21 ARG A 106 0.707 11.665 -0.924 1.00 3.29 H new ATOM 0 HH22 ARG A 106 0.819 13.111 -1.933 1.00 3.29 H new ATOM 814 N GLN A 107 -1.494 4.736 -6.048 1.00 0.55 N ATOM 815 CA GLN A 107 -1.019 3.322 -5.981 1.00 0.52 C ATOM 816 C GLN A 107 0.282 3.176 -6.782 1.00 0.49 C ATOM 817 O GLN A 107 1.252 2.617 -6.312 1.00 0.44 O ATOM 818 CB GLN A 107 -2.092 2.403 -6.588 1.00 0.63 C ATOM 819 CG GLN A 107 -1.612 0.945 -6.592 1.00 1.11 C ATOM 820 CD GLN A 107 -1.305 0.499 -5.163 1.00 1.53 C ATOM 821 OE1 GLN A 107 -0.160 0.301 -4.809 1.00 2.13 O ATOM 822 NE2 GLN A 107 -2.287 0.333 -4.322 1.00 2.12 N ATOM 0 H GLN A 107 -2.383 4.870 -6.530 1.00 0.55 H new ATOM 0 HA GLN A 107 -0.837 3.047 -4.942 1.00 0.52 H new ATOM 0 HB2 GLN A 107 -3.016 2.486 -6.016 1.00 0.63 H new ATOM 0 HB3 GLN A 107 -2.318 2.721 -7.606 1.00 0.63 H new ATOM 0 HG2 GLN A 107 -2.377 0.302 -7.028 1.00 1.11 H new ATOM 0 HG3 GLN A 107 -0.721 0.847 -7.213 1.00 1.11 H new ATOM 0 HE21 GLN A 107 -3.248 0.500 -4.621 1.00 2.12 H new ATOM 0 HE22 GLN A 107 -2.094 0.036 -3.365 1.00 2.12 H new ATOM 831 N ASP A 108 0.298 3.657 -7.996 1.00 0.56 N ATOM 832 CA ASP A 108 1.521 3.527 -8.841 1.00 0.59 C ATOM 833 C ASP A 108 2.723 4.185 -8.156 1.00 0.54 C ATOM 834 O ASP A 108 3.758 3.572 -7.982 1.00 0.54 O ATOM 835 CB ASP A 108 1.276 4.196 -10.194 1.00 0.72 C ATOM 836 CG ASP A 108 0.154 3.459 -10.930 1.00 0.81 C ATOM 837 OD1 ASP A 108 0.328 2.285 -11.211 1.00 1.33 O ATOM 838 OD2 ASP A 108 -0.860 4.081 -11.199 1.00 1.42 O ATOM 0 H ASP A 108 -0.485 4.136 -8.440 1.00 0.56 H new ATOM 0 HA ASP A 108 1.738 2.468 -8.984 1.00 0.59 H new ATOM 0 HB2 ASP A 108 1.006 5.242 -10.051 1.00 0.72 H new ATOM 0 HB3 ASP A 108 2.188 4.181 -10.790 1.00 0.72 H new ATOM 843 N ILE A 109 2.602 5.428 -7.775 1.00 0.55 N ATOM 844 CA ILE A 109 3.747 6.123 -7.112 1.00 0.54 C ATOM 845 C ILE A 109 4.363 5.214 -6.042 1.00 0.47 C ATOM 846 O ILE A 109 5.548 4.946 -6.048 1.00 0.53 O ATOM 847 CB ILE A 109 3.248 7.415 -6.461 1.00 0.59 C ATOM 848 CG1 ILE A 109 2.579 8.290 -7.525 1.00 0.70 C ATOM 849 CG2 ILE A 109 4.431 8.170 -5.846 1.00 0.63 C ATOM 850 CD1 ILE A 109 1.960 9.524 -6.863 1.00 1.47 C ATOM 0 H ILE A 109 1.761 5.993 -7.893 1.00 0.55 H new ATOM 0 HA ILE A 109 4.506 6.358 -7.859 1.00 0.54 H new ATOM 0 HB ILE A 109 2.528 7.176 -5.678 1.00 0.59 H new ATOM 0 HG12 ILE A 109 3.312 8.595 -8.272 1.00 0.70 H new ATOM 0 HG13 ILE A 109 1.810 7.721 -8.047 1.00 0.70 H new ATOM 0 HG21 ILE A 109 4.074 9.090 -5.383 1.00 0.63 H new ATOM 0 HG22 ILE A 109 4.909 7.545 -5.091 1.00 0.63 H new ATOM 0 HG23 ILE A 109 5.153 8.413 -6.626 1.00 0.63 H new ATOM 0 HD11 ILE A 109 1.485 10.145 -7.623 1.00 1.47 H new ATOM 0 HD12 ILE A 109 1.214 9.210 -6.133 1.00 1.47 H new ATOM 0 HD13 ILE A 109 2.740 10.098 -6.362 1.00 1.47 H new ATOM 862 N LEU A 110 3.568 4.742 -5.123 1.00 0.43 N ATOM 863 CA LEU A 110 4.106 3.855 -4.052 1.00 0.39 C ATOM 864 C LEU A 110 4.971 2.754 -4.678 1.00 0.38 C ATOM 865 O LEU A 110 6.168 2.702 -4.477 1.00 0.38 O ATOM 866 CB LEU A 110 2.929 3.224 -3.293 1.00 0.42 C ATOM 867 CG LEU A 110 3.431 2.191 -2.274 1.00 0.44 C ATOM 868 CD1 LEU A 110 4.475 2.826 -1.346 1.00 0.56 C ATOM 869 CD2 LEU A 110 2.241 1.698 -1.444 1.00 0.66 C ATOM 0 H LEU A 110 2.567 4.932 -5.066 1.00 0.43 H new ATOM 0 HA LEU A 110 4.719 4.436 -3.363 1.00 0.39 H new ATOM 0 HB2 LEU A 110 2.362 4.001 -2.781 1.00 0.42 H new ATOM 0 HB3 LEU A 110 2.250 2.746 -3.998 1.00 0.42 H new ATOM 0 HG LEU A 110 3.893 1.356 -2.801 1.00 0.44 H new ATOM 0 HD11 LEU A 110 4.823 2.083 -0.628 1.00 0.56 H new ATOM 0 HD12 LEU A 110 5.318 3.183 -1.937 1.00 0.56 H new ATOM 0 HD13 LEU A 110 4.026 3.664 -0.813 1.00 0.56 H new ATOM 0 HD21 LEU A 110 2.585 0.963 -0.716 1.00 0.66 H new ATOM 0 HD22 LEU A 110 1.787 2.541 -0.922 1.00 0.66 H new ATOM 0 HD23 LEU A 110 1.503 1.239 -2.102 1.00 0.66 H new ATOM 881 N ASP A 111 4.370 1.870 -5.425 1.00 0.40 N ATOM 882 CA ASP A 111 5.145 0.762 -6.058 1.00 0.42 C ATOM 883 C ASP A 111 6.301 1.322 -6.895 1.00 0.43 C ATOM 884 O ASP A 111 7.417 0.847 -6.819 1.00 0.42 O ATOM 885 CB ASP A 111 4.218 -0.051 -6.964 1.00 0.50 C ATOM 886 CG ASP A 111 2.974 -0.470 -6.178 1.00 0.59 C ATOM 887 OD1 ASP A 111 2.726 0.120 -5.140 1.00 1.30 O ATOM 888 OD2 ASP A 111 2.291 -1.374 -6.629 1.00 1.19 O ATOM 0 H ASP A 111 3.370 1.866 -5.626 1.00 0.40 H new ATOM 0 HA ASP A 111 5.554 0.128 -5.271 1.00 0.42 H new ATOM 0 HB2 ASP A 111 3.930 0.541 -7.833 1.00 0.50 H new ATOM 0 HB3 ASP A 111 4.739 -0.932 -7.338 1.00 0.50 H new ATOM 893 N LEU A 112 6.045 2.312 -7.707 1.00 0.48 N ATOM 894 CA LEU A 112 7.133 2.877 -8.561 1.00 0.52 C ATOM 895 C LEU A 112 8.227 3.483 -7.681 1.00 0.48 C ATOM 896 O LEU A 112 9.398 3.204 -7.856 1.00 0.47 O ATOM 897 CB LEU A 112 6.555 3.960 -9.482 1.00 0.60 C ATOM 898 CG LEU A 112 7.609 4.396 -10.525 1.00 0.70 C ATOM 899 CD1 LEU A 112 7.617 3.428 -11.714 1.00 1.45 C ATOM 900 CD2 LEU A 112 7.279 5.804 -11.034 1.00 1.26 C ATOM 0 H LEU A 112 5.132 2.754 -7.817 1.00 0.48 H new ATOM 0 HA LEU A 112 7.563 2.078 -9.165 1.00 0.52 H new ATOM 0 HB2 LEU A 112 5.668 3.580 -9.989 1.00 0.60 H new ATOM 0 HB3 LEU A 112 6.241 4.820 -8.891 1.00 0.60 H new ATOM 0 HG LEU A 112 8.590 4.391 -10.049 1.00 0.70 H new ATOM 0 HD11 LEU A 112 8.365 3.749 -12.439 1.00 1.45 H new ATOM 0 HD12 LEU A 112 7.858 2.424 -11.364 1.00 1.45 H new ATOM 0 HD13 LEU A 112 6.634 3.422 -12.185 1.00 1.45 H new ATOM 0 HD21 LEU A 112 8.024 6.109 -11.769 1.00 1.26 H new ATOM 0 HD22 LEU A 112 6.292 5.802 -11.497 1.00 1.26 H new ATOM 0 HD23 LEU A 112 7.286 6.504 -10.198 1.00 1.26 H new ATOM 912 N TRP A 113 7.869 4.309 -6.738 1.00 0.48 N ATOM 913 CA TRP A 113 8.905 4.924 -5.861 1.00 0.48 C ATOM 914 C TRP A 113 9.839 3.828 -5.347 1.00 0.43 C ATOM 915 O TRP A 113 11.045 3.976 -5.340 1.00 0.45 O ATOM 916 CB TRP A 113 8.220 5.621 -4.681 1.00 0.52 C ATOM 917 CG TRP A 113 9.244 6.281 -3.815 1.00 0.56 C ATOM 918 CD1 TRP A 113 9.820 7.481 -4.063 1.00 0.66 C ATOM 919 CD2 TRP A 113 9.817 5.805 -2.563 1.00 0.55 C ATOM 920 NE1 TRP A 113 10.710 7.769 -3.044 1.00 0.70 N ATOM 921 CE2 TRP A 113 10.743 6.765 -2.095 1.00 0.65 C ATOM 922 CE3 TRP A 113 9.622 4.642 -1.797 1.00 0.51 C ATOM 923 CZ2 TRP A 113 11.453 6.578 -0.909 1.00 0.70 C ATOM 924 CZ3 TRP A 113 10.334 4.449 -0.602 1.00 0.58 C ATOM 925 CH2 TRP A 113 11.247 5.416 -0.158 1.00 0.67 C ATOM 0 H TRP A 113 6.908 4.584 -6.537 1.00 0.48 H new ATOM 0 HA TRP A 113 9.483 5.657 -6.424 1.00 0.48 H new ATOM 0 HB2 TRP A 113 7.509 6.362 -5.048 1.00 0.52 H new ATOM 0 HB3 TRP A 113 7.652 4.895 -4.099 1.00 0.52 H new ATOM 0 HD1 TRP A 113 9.618 8.110 -4.917 1.00 0.66 H new ATOM 0 HE1 TRP A 113 11.273 8.618 -2.999 1.00 0.70 H new ATOM 0 HE3 TRP A 113 8.920 3.892 -2.130 1.00 0.51 H new ATOM 0 HZ2 TRP A 113 12.157 7.325 -0.573 1.00 0.70 H new ATOM 0 HZ3 TRP A 113 10.178 3.551 -0.022 1.00 0.58 H new ATOM 0 HH2 TRP A 113 11.791 5.264 0.763 1.00 0.67 H new ATOM 936 N ILE A 114 9.291 2.722 -4.930 1.00 0.39 N ATOM 937 CA ILE A 114 10.145 1.609 -4.433 1.00 0.37 C ATOM 938 C ILE A 114 11.090 1.163 -5.556 1.00 0.39 C ATOM 939 O ILE A 114 12.217 0.776 -5.318 1.00 0.44 O ATOM 940 CB ILE A 114 9.251 0.428 -4.019 1.00 0.37 C ATOM 941 CG1 ILE A 114 8.403 0.807 -2.781 1.00 0.37 C ATOM 942 CG2 ILE A 114 10.113 -0.804 -3.717 1.00 0.42 C ATOM 943 CD1 ILE A 114 9.193 0.602 -1.477 1.00 1.00 C ATOM 0 H ILE A 114 8.287 2.541 -4.912 1.00 0.39 H new ATOM 0 HA ILE A 114 10.726 1.944 -3.574 1.00 0.37 H new ATOM 0 HB ILE A 114 8.577 0.191 -4.842 1.00 0.37 H new ATOM 0 HG12 ILE A 114 8.088 1.848 -2.858 1.00 0.37 H new ATOM 0 HG13 ILE A 114 7.497 0.201 -2.759 1.00 0.37 H new ATOM 0 HG21 ILE A 114 9.471 -1.635 -3.425 1.00 0.42 H new ATOM 0 HG22 ILE A 114 10.679 -1.079 -4.607 1.00 0.42 H new ATOM 0 HG23 ILE A 114 10.803 -0.575 -2.904 1.00 0.42 H new ATOM 0 HD11 ILE A 114 8.569 0.877 -0.627 1.00 1.00 H new ATOM 0 HD12 ILE A 114 9.485 -0.444 -1.389 1.00 1.00 H new ATOM 0 HD13 ILE A 114 10.085 1.228 -1.490 1.00 1.00 H new ATOM 955 N TYR A 115 10.626 1.195 -6.777 1.00 0.40 N ATOM 956 CA TYR A 115 11.479 0.755 -7.920 1.00 0.46 C ATOM 957 C TYR A 115 12.671 1.702 -8.122 1.00 0.51 C ATOM 958 O TYR A 115 13.815 1.308 -7.997 1.00 0.54 O ATOM 959 CB TYR A 115 10.629 0.714 -9.201 1.00 0.53 C ATOM 960 CG TYR A 115 11.261 -0.233 -10.199 1.00 0.59 C ATOM 961 CD1 TYR A 115 11.172 -1.615 -9.999 1.00 0.56 C ATOM 962 CD2 TYR A 115 11.937 0.271 -11.320 1.00 0.74 C ATOM 963 CE1 TYR A 115 11.757 -2.495 -10.916 1.00 0.65 C ATOM 964 CE2 TYR A 115 12.522 -0.611 -12.237 1.00 0.82 C ATOM 965 CZ TYR A 115 12.432 -1.993 -12.035 1.00 0.77 C ATOM 966 OH TYR A 115 13.011 -2.862 -12.938 1.00 0.87 O ATOM 0 H TYR A 115 9.690 1.508 -7.033 1.00 0.40 H new ATOM 0 HA TYR A 115 11.870 -0.238 -7.697 1.00 0.46 H new ATOM 0 HB2 TYR A 115 9.615 0.388 -8.967 1.00 0.53 H new ATOM 0 HB3 TYR A 115 10.552 1.713 -9.631 1.00 0.53 H new ATOM 0 HD1 TYR A 115 10.651 -2.003 -9.136 1.00 0.56 H new ATOM 0 HD2 TYR A 115 12.006 1.337 -11.476 1.00 0.74 H new ATOM 0 HE1 TYR A 115 11.688 -3.562 -10.761 1.00 0.65 H new ATOM 0 HE2 TYR A 115 13.043 -0.225 -13.101 1.00 0.82 H new ATOM 0 HH TYR A 115 12.713 -3.776 -12.749 1.00 0.87 H new ATOM 976 N HIS A 116 12.418 2.940 -8.460 1.00 0.58 N ATOM 977 CA HIS A 116 13.541 3.901 -8.699 1.00 0.67 C ATOM 978 C HIS A 116 14.365 4.087 -7.415 1.00 0.67 C ATOM 979 O HIS A 116 15.233 4.936 -7.352 1.00 0.81 O ATOM 980 CB HIS A 116 12.946 5.258 -9.167 1.00 0.79 C ATOM 981 CG HIS A 116 13.413 5.592 -10.565 1.00 1.20 C ATOM 982 ND1 HIS A 116 14.743 5.495 -10.942 1.00 1.99 N ATOM 983 CD2 HIS A 116 12.737 6.020 -11.680 1.00 2.05 C ATOM 984 CE1 HIS A 116 14.826 5.858 -12.234 1.00 2.71 C ATOM 985 NE2 HIS A 116 13.631 6.188 -12.734 1.00 2.74 N ATOM 0 H HIS A 116 11.483 3.329 -8.581 1.00 0.58 H new ATOM 0 HA HIS A 116 14.204 3.509 -9.470 1.00 0.67 H new ATOM 0 HB2 HIS A 116 11.857 5.211 -9.143 1.00 0.79 H new ATOM 0 HB3 HIS A 116 13.246 6.049 -8.479 1.00 0.79 H new ATOM 0 HD1 HIS A 116 15.518 5.202 -10.347 1.00 1.99 H new ATOM 0 HD2 HIS A 116 11.673 6.199 -11.732 1.00 2.05 H new ATOM 0 HE1 HIS A 116 15.746 5.880 -12.799 1.00 2.71 H new ATOM 993 N THR A 117 14.104 3.305 -6.395 1.00 0.63 N ATOM 994 CA THR A 117 14.871 3.435 -5.115 1.00 0.68 C ATOM 995 C THR A 117 15.494 2.088 -4.751 1.00 0.66 C ATOM 996 O THR A 117 16.671 1.864 -4.952 1.00 0.73 O ATOM 997 CB THR A 117 13.922 3.869 -3.998 1.00 0.80 C ATOM 998 OG1 THR A 117 12.787 3.015 -3.985 1.00 0.85 O ATOM 999 CG2 THR A 117 13.475 5.314 -4.234 1.00 0.91 C ATOM 0 H THR A 117 13.389 2.578 -6.394 1.00 0.63 H new ATOM 0 HA THR A 117 15.659 4.178 -5.239 1.00 0.68 H new ATOM 0 HB THR A 117 14.437 3.805 -3.039 1.00 0.80 H new ATOM 0 HG1 THR A 117 11.971 3.554 -4.044 1.00 0.85 H new ATOM 0 HG21 THR A 117 12.799 5.621 -3.436 1.00 0.91 H new ATOM 0 HG22 THR A 117 14.347 5.968 -4.242 1.00 0.91 H new ATOM 0 HG23 THR A 117 12.961 5.384 -5.192 1.00 0.91 H new ATOM 1007 N GLN A 118 14.720 1.190 -4.201 1.00 0.73 N ATOM 1008 CA GLN A 118 15.281 -0.134 -3.809 1.00 0.83 C ATOM 1009 C GLN A 118 15.314 -1.070 -5.024 1.00 0.72 C ATOM 1010 O GLN A 118 16.180 -1.914 -5.140 1.00 0.91 O ATOM 1011 CB GLN A 118 14.411 -0.735 -2.695 1.00 1.06 C ATOM 1012 CG GLN A 118 15.248 -1.686 -1.834 1.00 1.48 C ATOM 1013 CD GLN A 118 15.744 -2.851 -2.693 1.00 2.12 C ATOM 1014 OE1 GLN A 118 16.851 -3.319 -2.519 1.00 2.89 O ATOM 1015 NE2 GLN A 118 14.968 -3.340 -3.619 1.00 2.13 N ATOM 0 H GLN A 118 13.727 1.316 -4.007 1.00 0.73 H new ATOM 0 HA GLN A 118 16.300 -0.009 -3.444 1.00 0.83 H new ATOM 0 HB2 GLN A 118 13.997 0.061 -2.076 1.00 1.06 H new ATOM 0 HB3 GLN A 118 13.568 -1.272 -3.130 1.00 1.06 H new ATOM 0 HG2 GLN A 118 16.095 -1.152 -1.402 1.00 1.48 H new ATOM 0 HG3 GLN A 118 14.651 -2.062 -1.003 1.00 1.48 H new ATOM 0 HE21 GLN A 118 14.038 -2.947 -3.765 1.00 2.13 H new ATOM 0 HE22 GLN A 118 15.291 -4.116 -4.197 1.00 2.13 H new ATOM 1024 N GLY A 119 14.393 -0.919 -5.940 1.00 0.86 N ATOM 1025 CA GLY A 119 14.392 -1.791 -7.157 1.00 0.85 C ATOM 1026 C GLY A 119 13.593 -3.077 -6.911 1.00 0.65 C ATOM 1027 O GLY A 119 13.683 -4.020 -7.674 1.00 0.67 O ATOM 0 H GLY A 119 13.641 -0.231 -5.900 1.00 0.86 H new ATOM 0 HA2 GLY A 119 13.962 -1.247 -7.998 1.00 0.85 H new ATOM 0 HA3 GLY A 119 15.417 -2.042 -7.430 1.00 0.85 H new ATOM 1031 N TYR A 120 12.806 -3.136 -5.870 1.00 0.54 N ATOM 1032 CA TYR A 120 12.014 -4.375 -5.617 1.00 0.44 C ATOM 1033 C TYR A 120 10.853 -4.450 -6.616 1.00 0.49 C ATOM 1034 O TYR A 120 10.115 -3.502 -6.798 1.00 0.70 O ATOM 1035 CB TYR A 120 11.438 -4.343 -4.187 1.00 0.48 C ATOM 1036 CG TYR A 120 12.399 -4.979 -3.202 1.00 0.52 C ATOM 1037 CD1 TYR A 120 12.732 -6.333 -3.327 1.00 0.58 C ATOM 1038 CD2 TYR A 120 12.936 -4.223 -2.152 1.00 0.60 C ATOM 1039 CE1 TYR A 120 13.604 -6.928 -2.409 1.00 0.71 C ATOM 1040 CE2 TYR A 120 13.807 -4.823 -1.232 1.00 0.71 C ATOM 1041 CZ TYR A 120 14.141 -6.173 -1.361 1.00 0.75 C ATOM 1042 OH TYR A 120 14.998 -6.763 -0.454 1.00 0.91 O ATOM 0 H TYR A 120 12.678 -2.387 -5.189 1.00 0.54 H new ATOM 0 HA TYR A 120 12.663 -5.243 -5.732 1.00 0.44 H new ATOM 0 HB2 TYR A 120 11.240 -3.312 -3.894 1.00 0.48 H new ATOM 0 HB3 TYR A 120 10.484 -4.870 -4.163 1.00 0.48 H new ATOM 0 HD1 TYR A 120 12.315 -6.919 -4.133 1.00 0.58 H new ATOM 0 HD2 TYR A 120 12.679 -3.179 -2.051 1.00 0.60 H new ATOM 0 HE1 TYR A 120 13.863 -7.972 -2.510 1.00 0.71 H new ATOM 0 HE2 TYR A 120 14.220 -4.240 -0.422 1.00 0.71 H new ATOM 0 HH TYR A 120 15.280 -6.099 0.209 1.00 0.91 H new ATOM 1052 N PHE A 121 10.667 -5.582 -7.234 1.00 0.48 N ATOM 1053 CA PHE A 121 9.530 -5.731 -8.186 1.00 0.57 C ATOM 1054 C PHE A 121 8.260 -5.945 -7.347 1.00 0.55 C ATOM 1055 O PHE A 121 8.323 -6.530 -6.284 1.00 0.59 O ATOM 1056 CB PHE A 121 9.764 -6.955 -9.091 1.00 0.68 C ATOM 1057 CG PHE A 121 10.611 -6.575 -10.288 1.00 1.42 C ATOM 1058 CD1 PHE A 121 10.031 -5.909 -11.376 1.00 2.33 C ATOM 1059 CD2 PHE A 121 11.974 -6.898 -10.315 1.00 2.32 C ATOM 1060 CE1 PHE A 121 10.811 -5.564 -12.486 1.00 3.43 C ATOM 1061 CE2 PHE A 121 12.753 -6.554 -11.426 1.00 3.44 C ATOM 1062 CZ PHE A 121 12.172 -5.886 -12.510 1.00 3.85 C ATOM 0 H PHE A 121 11.252 -6.410 -7.122 1.00 0.48 H new ATOM 0 HA PHE A 121 9.436 -4.848 -8.818 1.00 0.57 H new ATOM 0 HB2 PHE A 121 10.258 -7.745 -8.524 1.00 0.68 H new ATOM 0 HB3 PHE A 121 8.807 -7.355 -9.427 1.00 0.68 H new ATOM 0 HD1 PHE A 121 8.980 -5.661 -11.358 1.00 2.33 H new ATOM 0 HD2 PHE A 121 12.424 -7.412 -9.479 1.00 2.32 H new ATOM 0 HE1 PHE A 121 10.362 -5.050 -13.323 1.00 3.43 H new ATOM 0 HE2 PHE A 121 13.803 -6.804 -11.447 1.00 3.44 H new ATOM 0 HZ PHE A 121 12.775 -5.619 -13.365 1.00 3.85 H new ATOM 1072 N PRO A 122 7.118 -5.484 -7.794 1.00 0.64 N ATOM 1073 CA PRO A 122 5.850 -5.656 -7.030 1.00 0.67 C ATOM 1074 C PRO A 122 5.288 -7.074 -7.162 1.00 0.73 C ATOM 1075 O PRO A 122 4.094 -7.274 -7.270 1.00 1.19 O ATOM 1076 CB PRO A 122 4.914 -4.627 -7.669 1.00 0.80 C ATOM 1077 CG PRO A 122 5.370 -4.545 -9.090 1.00 1.05 C ATOM 1078 CD PRO A 122 6.889 -4.760 -9.061 1.00 0.87 C ATOM 0 HA PRO A 122 5.985 -5.510 -5.958 1.00 0.67 H new ATOM 0 HB2 PRO A 122 3.873 -4.942 -7.603 1.00 0.80 H new ATOM 0 HB3 PRO A 122 4.987 -3.660 -7.171 1.00 0.80 H new ATOM 0 HG2 PRO A 122 4.880 -5.303 -9.701 1.00 1.05 H new ATOM 0 HG3 PRO A 122 5.121 -3.577 -9.524 1.00 1.05 H new ATOM 0 HD2 PRO A 122 7.227 -5.340 -9.920 1.00 0.87 H new ATOM 0 HD3 PRO A 122 7.428 -3.813 -9.083 1.00 0.87 H new ATOM 1086 N ASP A 123 6.140 -8.059 -7.136 1.00 0.56 N ATOM 1087 CA ASP A 123 5.657 -9.462 -7.240 1.00 0.64 C ATOM 1088 C ASP A 123 5.198 -9.902 -5.854 1.00 0.58 C ATOM 1089 O ASP A 123 5.172 -11.072 -5.529 1.00 0.65 O ATOM 1090 CB ASP A 123 6.795 -10.367 -7.721 1.00 0.74 C ATOM 1091 CG ASP A 123 7.917 -10.371 -6.682 1.00 0.77 C ATOM 1092 OD1 ASP A 123 8.486 -9.318 -6.448 1.00 1.27 O ATOM 1093 OD2 ASP A 123 8.191 -11.429 -6.139 1.00 1.38 O ATOM 0 H ASP A 123 7.151 -7.953 -7.047 1.00 0.56 H new ATOM 0 HA ASP A 123 4.835 -9.530 -7.953 1.00 0.64 H new ATOM 0 HB2 ASP A 123 6.426 -11.381 -7.878 1.00 0.74 H new ATOM 0 HB3 ASP A 123 7.174 -10.014 -8.680 1.00 0.74 H new ATOM 1098 N TRP A 124 4.845 -8.948 -5.031 1.00 0.53 N ATOM 1099 CA TRP A 124 4.390 -9.257 -3.642 1.00 0.52 C ATOM 1100 C TRP A 124 3.160 -8.422 -3.314 1.00 0.51 C ATOM 1101 O TRP A 124 2.287 -8.829 -2.577 1.00 0.55 O ATOM 1102 CB TRP A 124 5.510 -8.905 -2.665 1.00 0.49 C ATOM 1103 CG TRP A 124 5.880 -7.466 -2.850 1.00 0.43 C ATOM 1104 CD1 TRP A 124 6.837 -7.007 -3.693 1.00 0.44 C ATOM 1105 CD2 TRP A 124 5.312 -6.290 -2.201 1.00 0.42 C ATOM 1106 NE1 TRP A 124 6.896 -5.629 -3.596 1.00 0.42 N ATOM 1107 CE2 TRP A 124 5.976 -5.140 -2.691 1.00 0.41 C ATOM 1108 CE3 TRP A 124 4.299 -6.112 -1.244 1.00 0.51 C ATOM 1109 CZ2 TRP A 124 5.645 -3.859 -2.249 1.00 0.46 C ATOM 1110 CZ3 TRP A 124 3.962 -4.824 -0.797 1.00 0.58 C ATOM 1111 CH2 TRP A 124 4.633 -3.701 -1.297 1.00 0.55 C ATOM 0 H TRP A 124 4.853 -7.955 -5.266 1.00 0.53 H new ATOM 0 HA TRP A 124 4.143 -10.316 -3.562 1.00 0.52 H new ATOM 0 HB2 TRP A 124 5.185 -9.082 -1.640 1.00 0.49 H new ATOM 0 HB3 TRP A 124 6.377 -9.543 -2.839 1.00 0.49 H new ATOM 0 HD1 TRP A 124 7.453 -7.618 -4.336 1.00 0.44 H new ATOM 0 HE1 TRP A 124 7.541 -5.045 -4.128 1.00 0.42 H new ATOM 0 HE3 TRP A 124 3.776 -6.971 -0.850 1.00 0.51 H new ATOM 0 HZ2 TRP A 124 6.166 -2.997 -2.639 1.00 0.46 H new ATOM 0 HZ3 TRP A 124 3.180 -4.699 -0.063 1.00 0.58 H new ATOM 0 HH2 TRP A 124 4.369 -2.714 -0.948 1.00 0.55 H new ATOM 1122 N GLN A 125 3.098 -7.256 -3.860 1.00 0.53 N ATOM 1123 CA GLN A 125 1.935 -6.359 -3.600 1.00 0.60 C ATOM 1124 C GLN A 125 0.723 -6.847 -4.397 1.00 0.66 C ATOM 1125 O GLN A 125 0.391 -6.298 -5.430 1.00 0.84 O ATOM 1126 CB GLN A 125 2.287 -4.932 -4.025 1.00 0.69 C ATOM 1127 CG GLN A 125 1.135 -3.992 -3.665 1.00 1.56 C ATOM 1128 CD GLN A 125 1.584 -2.542 -3.849 1.00 2.18 C ATOM 1129 OE1 GLN A 125 0.934 -1.776 -4.532 1.00 2.78 O ATOM 1130 NE2 GLN A 125 2.674 -2.129 -3.265 1.00 2.82 N ATOM 0 H GLN A 125 3.807 -6.872 -4.485 1.00 0.53 H new ATOM 0 HA GLN A 125 1.697 -6.373 -2.536 1.00 0.60 H new ATOM 0 HB2 GLN A 125 3.202 -4.609 -3.529 1.00 0.69 H new ATOM 0 HB3 GLN A 125 2.477 -4.897 -5.098 1.00 0.69 H new ATOM 0 HG2 GLN A 125 0.271 -4.199 -4.297 1.00 1.56 H new ATOM 0 HG3 GLN A 125 0.823 -4.159 -2.634 1.00 1.56 H new ATOM 0 HE21 GLN A 125 3.220 -2.772 -2.691 1.00 2.82 H new ATOM 0 HE22 GLN A 125 2.981 -1.163 -3.382 1.00 2.82 H new ATOM 1139 N ASN A 126 0.064 -7.880 -3.926 1.00 0.64 N ATOM 1140 CA ASN A 126 -1.131 -8.424 -4.652 1.00 0.72 C ATOM 1141 C ASN A 126 -2.321 -8.518 -3.687 1.00 0.69 C ATOM 1142 O ASN A 126 -2.523 -9.519 -3.034 1.00 1.22 O ATOM 1143 CB ASN A 126 -0.798 -9.823 -5.197 1.00 0.84 C ATOM 1144 CG ASN A 126 0.665 -9.870 -5.645 1.00 0.89 C ATOM 1145 OD1 ASN A 126 1.306 -10.898 -5.553 1.00 1.53 O ATOM 1146 ND2 ASN A 126 1.225 -8.797 -6.131 1.00 0.88 N ATOM 0 H ASN A 126 0.303 -8.373 -3.066 1.00 0.64 H new ATOM 0 HA ASN A 126 -1.390 -7.761 -5.478 1.00 0.72 H new ATOM 0 HB2 ASN A 126 -0.977 -10.575 -4.428 1.00 0.84 H new ATOM 0 HB3 ASN A 126 -1.452 -10.062 -6.035 1.00 0.84 H new ATOM 0 HD21 ASN A 126 2.199 -8.822 -6.433 1.00 0.88 H new ATOM 0 HD22 ASN A 126 0.689 -7.933 -6.209 1.00 0.88 H new ATOM 1153 N TYR A 127 -3.112 -7.486 -3.595 1.00 0.69 N ATOM 1154 CA TYR A 127 -4.288 -7.535 -2.680 1.00 0.61 C ATOM 1155 C TYR A 127 -5.330 -8.508 -3.239 1.00 0.63 C ATOM 1156 O TYR A 127 -5.218 -8.981 -4.353 1.00 0.75 O ATOM 1157 CB TYR A 127 -4.900 -6.138 -2.556 1.00 0.65 C ATOM 1158 CG TYR A 127 -3.812 -5.137 -2.247 1.00 0.79 C ATOM 1159 CD1 TYR A 127 -3.301 -5.037 -0.946 1.00 0.98 C ATOM 1160 CD2 TYR A 127 -3.309 -4.311 -3.261 1.00 0.93 C ATOM 1161 CE1 TYR A 127 -2.291 -4.111 -0.660 1.00 1.19 C ATOM 1162 CE2 TYR A 127 -2.299 -3.385 -2.974 1.00 1.14 C ATOM 1163 CZ TYR A 127 -1.790 -3.285 -1.674 1.00 1.23 C ATOM 1164 OH TYR A 127 -0.794 -2.373 -1.392 1.00 1.48 O ATOM 0 H TYR A 127 -2.997 -6.614 -4.111 1.00 0.69 H new ATOM 0 HA TYR A 127 -3.968 -7.876 -1.695 1.00 0.61 H new ATOM 0 HB2 TYR A 127 -5.405 -5.867 -3.483 1.00 0.65 H new ATOM 0 HB3 TYR A 127 -5.653 -6.128 -1.768 1.00 0.65 H new ATOM 0 HD1 TYR A 127 -3.686 -5.674 -0.164 1.00 0.98 H new ATOM 0 HD2 TYR A 127 -3.701 -4.389 -4.264 1.00 0.93 H new ATOM 0 HE1 TYR A 127 -1.898 -4.033 0.343 1.00 1.19 H new ATOM 0 HE2 TYR A 127 -1.913 -2.748 -3.756 1.00 1.14 H new ATOM 0 HH TYR A 127 -0.561 -1.881 -2.207 1.00 1.48 H new ATOM 1174 N THR A 128 -6.348 -8.803 -2.478 1.00 0.62 N ATOM 1175 CA THR A 128 -7.404 -9.738 -2.971 1.00 0.68 C ATOM 1176 C THR A 128 -8.110 -9.086 -4.170 1.00 0.75 C ATOM 1177 O THR A 128 -7.735 -8.011 -4.594 1.00 0.97 O ATOM 1178 CB THR A 128 -8.420 -10.017 -1.841 1.00 0.86 C ATOM 1179 OG1 THR A 128 -9.575 -9.210 -2.027 1.00 1.22 O ATOM 1180 CG2 THR A 128 -7.801 -9.695 -0.480 1.00 0.90 C ATOM 0 H THR A 128 -6.496 -8.439 -1.537 1.00 0.62 H new ATOM 0 HA THR A 128 -6.958 -10.684 -3.277 1.00 0.68 H new ATOM 0 HB THR A 128 -8.695 -11.071 -1.871 1.00 0.86 H new ATOM 0 HG1 THR A 128 -9.610 -8.523 -1.329 1.00 1.22 H new ATOM 0 HG21 THR A 128 -8.528 -9.896 0.307 1.00 0.90 H new ATOM 0 HG22 THR A 128 -6.918 -10.315 -0.326 1.00 0.90 H new ATOM 0 HG23 THR A 128 -7.515 -8.644 -0.450 1.00 0.90 H new ATOM 1188 N PRO A 129 -9.123 -9.719 -4.715 1.00 0.88 N ATOM 1189 CA PRO A 129 -9.881 -9.167 -5.881 1.00 1.15 C ATOM 1190 C PRO A 129 -10.441 -7.769 -5.585 1.00 1.51 C ATOM 1191 O PRO A 129 -9.722 -6.890 -5.154 1.00 2.29 O ATOM 1192 CB PRO A 129 -10.996 -10.206 -6.116 1.00 1.51 C ATOM 1193 CG PRO A 129 -10.466 -11.467 -5.514 1.00 1.27 C ATOM 1194 CD PRO A 129 -9.664 -11.023 -4.296 1.00 1.09 C ATOM 0 HA PRO A 129 -9.256 -9.025 -6.763 1.00 1.15 H new ATOM 0 HB2 PRO A 129 -11.929 -9.901 -5.642 1.00 1.51 H new ATOM 0 HB3 PRO A 129 -11.205 -10.331 -7.179 1.00 1.51 H new ATOM 0 HG2 PRO A 129 -11.276 -12.138 -5.229 1.00 1.27 H new ATOM 0 HG3 PRO A 129 -9.839 -12.008 -6.222 1.00 1.27 H new ATOM 0 HD2 PRO A 129 -10.292 -10.934 -3.410 1.00 1.09 H new ATOM 0 HD3 PRO A 129 -8.871 -11.731 -4.055 1.00 1.09 H new ATOM 1202 N GLY A 130 -11.709 -7.552 -5.822 1.00 1.64 N ATOM 1203 CA GLY A 130 -12.318 -6.200 -5.567 1.00 2.18 C ATOM 1204 C GLY A 130 -13.435 -6.266 -4.509 1.00 1.76 C ATOM 1205 O GLY A 130 -14.473 -5.658 -4.679 1.00 1.92 O ATOM 0 H GLY A 130 -12.356 -8.253 -6.183 1.00 1.64 H new ATOM 0 HA2 GLY A 130 -11.543 -5.509 -5.235 1.00 2.18 H new ATOM 0 HA3 GLY A 130 -12.722 -5.802 -6.498 1.00 2.18 H new ATOM 1209 N PRO A 131 -13.233 -6.963 -3.412 1.00 1.94 N ATOM 1210 CA PRO A 131 -14.254 -7.046 -2.322 1.00 2.04 C ATOM 1211 C PRO A 131 -14.286 -5.753 -1.494 1.00 1.43 C ATOM 1212 O PRO A 131 -13.895 -4.701 -1.959 1.00 1.44 O ATOM 1213 CB PRO A 131 -13.763 -8.223 -1.476 1.00 2.91 C ATOM 1214 CG PRO A 131 -12.281 -8.179 -1.627 1.00 3.25 C ATOM 1215 CD PRO A 131 -12.031 -7.750 -3.075 1.00 2.75 C ATOM 0 HA PRO A 131 -15.269 -7.179 -2.697 1.00 2.04 H new ATOM 0 HB2 PRO A 131 -14.062 -8.117 -0.433 1.00 2.91 H new ATOM 0 HB3 PRO A 131 -14.173 -9.169 -1.831 1.00 2.91 H new ATOM 0 HG2 PRO A 131 -11.836 -7.473 -0.926 1.00 3.25 H new ATOM 0 HG3 PRO A 131 -11.837 -9.153 -1.424 1.00 3.25 H new ATOM 0 HD2 PRO A 131 -11.123 -7.155 -3.166 1.00 2.75 H new ATOM 0 HD3 PRO A 131 -11.916 -8.610 -3.735 1.00 2.75 H new ATOM 1223 N GLY A 132 -14.736 -5.821 -0.268 1.00 1.58 N ATOM 1224 CA GLY A 132 -14.775 -4.595 0.585 1.00 1.44 C ATOM 1225 C GLY A 132 -13.439 -4.450 1.319 1.00 1.21 C ATOM 1226 O GLY A 132 -12.659 -3.562 1.040 1.00 1.21 O ATOM 0 H GLY A 132 -15.078 -6.671 0.179 1.00 1.58 H new ATOM 0 HA2 GLY A 132 -14.963 -3.715 -0.030 1.00 1.44 H new ATOM 0 HA3 GLY A 132 -15.593 -4.663 1.303 1.00 1.44 H new ATOM 1230 N ILE A 133 -13.169 -5.320 2.255 1.00 1.11 N ATOM 1231 CA ILE A 133 -11.885 -5.240 3.009 1.00 0.94 C ATOM 1232 C ILE A 133 -10.774 -5.914 2.192 1.00 0.92 C ATOM 1233 O ILE A 133 -10.658 -7.123 2.167 1.00 1.52 O ATOM 1234 CB ILE A 133 -12.051 -5.964 4.351 1.00 0.99 C ATOM 1235 CG1 ILE A 133 -13.409 -5.595 4.967 1.00 1.14 C ATOM 1236 CG2 ILE A 133 -10.917 -5.572 5.311 1.00 0.98 C ATOM 1237 CD1 ILE A 133 -13.564 -4.074 5.019 1.00 1.56 C ATOM 0 H ILE A 133 -13.785 -6.085 2.531 1.00 1.11 H new ATOM 0 HA ILE A 133 -11.620 -4.198 3.185 1.00 0.94 H new ATOM 0 HB ILE A 133 -12.009 -7.040 4.183 1.00 0.99 H new ATOM 0 HG12 ILE A 133 -14.216 -6.031 4.377 1.00 1.14 H new ATOM 0 HG13 ILE A 133 -13.487 -6.011 5.971 1.00 1.14 H new ATOM 0 HG21 ILE A 133 -11.047 -6.093 6.260 1.00 0.98 H new ATOM 0 HG22 ILE A 133 -9.958 -5.849 4.873 1.00 0.98 H new ATOM 0 HG23 ILE A 133 -10.941 -4.496 5.482 1.00 0.98 H new ATOM 0 HD11 ILE A 133 -14.530 -3.821 5.457 1.00 1.56 H new ATOM 0 HD12 ILE A 133 -12.767 -3.648 5.628 1.00 1.56 H new ATOM 0 HD13 ILE A 133 -13.506 -3.668 4.009 1.00 1.56 H new ATOM 1249 N ARG A 134 -9.962 -5.141 1.521 1.00 0.51 N ATOM 1250 CA ARG A 134 -8.865 -5.736 0.702 1.00 0.49 C ATOM 1251 C ARG A 134 -7.737 -6.229 1.616 1.00 0.40 C ATOM 1252 O ARG A 134 -6.938 -5.452 2.106 1.00 0.38 O ATOM 1253 CB ARG A 134 -8.321 -4.673 -0.263 1.00 0.58 C ATOM 1254 CG ARG A 134 -9.238 -4.558 -1.483 1.00 1.06 C ATOM 1255 CD ARG A 134 -8.672 -3.513 -2.446 1.00 1.37 C ATOM 1256 NE ARG A 134 -9.386 -3.598 -3.750 1.00 1.86 N ATOM 1257 CZ ARG A 134 -9.276 -2.628 -4.618 1.00 2.52 C ATOM 1258 NH1 ARG A 134 -8.556 -1.578 -4.335 1.00 2.83 N ATOM 1259 NH2 ARG A 134 -9.891 -2.707 -5.766 1.00 3.36 N ATOM 0 H ARG A 134 -10.011 -4.122 1.504 1.00 0.51 H new ATOM 0 HA ARG A 134 -9.255 -6.581 0.135 1.00 0.49 H new ATOM 0 HB2 ARG A 134 -8.253 -3.710 0.244 1.00 0.58 H new ATOM 0 HB3 ARG A 134 -7.312 -4.939 -0.579 1.00 0.58 H new ATOM 0 HG2 ARG A 134 -9.320 -5.523 -1.983 1.00 1.06 H new ATOM 0 HG3 ARG A 134 -10.243 -4.275 -1.171 1.00 1.06 H new ATOM 0 HD2 ARG A 134 -8.784 -2.515 -2.023 1.00 1.37 H new ATOM 0 HD3 ARG A 134 -7.605 -3.679 -2.593 1.00 1.37 H new ATOM 0 HE ARG A 134 -9.960 -4.413 -3.965 1.00 1.86 H new ATOM 0 HH11 ARG A 134 -8.079 -1.514 -3.436 1.00 2.83 H new ATOM 0 HH12 ARG A 134 -8.470 -0.821 -5.013 1.00 2.83 H new ATOM 0 HH21 ARG A 134 -10.458 -3.526 -5.986 1.00 3.36 H new ATOM 0 HH22 ARG A 134 -9.805 -1.950 -6.444 1.00 3.36 H new ATOM 1273 N TYR A 135 -7.654 -7.517 1.835 1.00 0.41 N ATOM 1274 CA TYR A 135 -6.565 -8.060 2.700 1.00 0.39 C ATOM 1275 C TYR A 135 -5.318 -8.292 1.833 1.00 0.36 C ATOM 1276 O TYR A 135 -5.433 -8.606 0.664 1.00 0.39 O ATOM 1277 CB TYR A 135 -6.994 -9.405 3.301 1.00 0.46 C ATOM 1278 CG TYR A 135 -8.205 -9.225 4.183 1.00 0.50 C ATOM 1279 CD1 TYR A 135 -8.045 -8.942 5.545 1.00 0.66 C ATOM 1280 CD2 TYR A 135 -9.488 -9.355 3.640 1.00 0.72 C ATOM 1281 CE1 TYR A 135 -9.171 -8.785 6.364 1.00 0.85 C ATOM 1282 CE2 TYR A 135 -10.613 -9.201 4.458 1.00 0.91 C ATOM 1283 CZ TYR A 135 -10.454 -8.914 5.820 1.00 0.92 C ATOM 1284 OH TYR A 135 -11.563 -8.761 6.627 1.00 1.17 O ATOM 0 H TYR A 135 -8.293 -8.214 1.453 1.00 0.41 H new ATOM 0 HA TYR A 135 -6.355 -7.352 3.502 1.00 0.39 H new ATOM 0 HB2 TYR A 135 -7.220 -10.112 2.503 1.00 0.46 H new ATOM 0 HB3 TYR A 135 -6.174 -9.830 3.880 1.00 0.46 H new ATOM 0 HD1 TYR A 135 -7.054 -8.845 5.964 1.00 0.66 H new ATOM 0 HD2 TYR A 135 -9.610 -9.574 2.590 1.00 0.72 H new ATOM 0 HE1 TYR A 135 -9.049 -8.565 7.414 1.00 0.85 H new ATOM 0 HE2 TYR A 135 -11.603 -9.303 4.039 1.00 0.91 H new ATOM 0 HH TYR A 135 -12.376 -8.881 6.092 1.00 1.17 H new ATOM 1294 N PRO A 136 -4.135 -8.169 2.386 1.00 0.37 N ATOM 1295 CA PRO A 136 -2.878 -8.407 1.620 1.00 0.38 C ATOM 1296 C PRO A 136 -2.652 -9.909 1.411 1.00 0.37 C ATOM 1297 O PRO A 136 -2.476 -10.652 2.356 1.00 0.38 O ATOM 1298 CB PRO A 136 -1.794 -7.802 2.519 1.00 0.42 C ATOM 1299 CG PRO A 136 -2.334 -7.944 3.906 1.00 0.51 C ATOM 1300 CD PRO A 136 -3.855 -7.793 3.786 1.00 0.44 C ATOM 0 HA PRO A 136 -2.890 -7.967 0.623 1.00 0.38 H new ATOM 0 HB2 PRO A 136 -0.846 -8.328 2.407 1.00 0.42 H new ATOM 0 HB3 PRO A 136 -1.610 -6.757 2.270 1.00 0.42 H new ATOM 0 HG2 PRO A 136 -2.071 -8.913 4.330 1.00 0.51 H new ATOM 0 HG3 PRO A 136 -1.917 -7.183 4.566 1.00 0.51 H new ATOM 0 HD2 PRO A 136 -4.378 -8.443 4.487 1.00 0.44 H new ATOM 0 HD3 PRO A 136 -4.174 -6.773 3.998 1.00 0.44 H new ATOM 1308 N LEU A 137 -2.679 -10.369 0.190 1.00 0.40 N ATOM 1309 CA LEU A 137 -2.495 -11.830 -0.049 1.00 0.43 C ATOM 1310 C LEU A 137 -1.150 -12.293 0.513 1.00 0.41 C ATOM 1311 O LEU A 137 -1.079 -13.282 1.214 1.00 0.38 O ATOM 1312 CB LEU A 137 -2.555 -12.135 -1.551 1.00 0.51 C ATOM 1313 CG LEU A 137 -3.963 -11.835 -2.106 1.00 0.59 C ATOM 1314 CD1 LEU A 137 -3.988 -12.069 -3.634 1.00 0.64 C ATOM 1315 CD2 LEU A 137 -5.013 -12.733 -1.407 1.00 0.92 C ATOM 0 H LEU A 137 -2.819 -9.803 -0.647 1.00 0.40 H new ATOM 0 HA LEU A 137 -3.298 -12.365 0.457 1.00 0.43 H new ATOM 0 HB2 LEU A 137 -1.814 -11.536 -2.080 1.00 0.51 H new ATOM 0 HB3 LEU A 137 -2.304 -13.181 -1.726 1.00 0.51 H new ATOM 0 HG LEU A 137 -4.209 -10.792 -1.906 1.00 0.59 H new ATOM 0 HD11 LEU A 137 -4.985 -11.855 -4.019 1.00 0.64 H new ATOM 0 HD12 LEU A 137 -3.265 -11.410 -4.115 1.00 0.64 H new ATOM 0 HD13 LEU A 137 -3.732 -13.107 -3.847 1.00 0.64 H new ATOM 0 HD21 LEU A 137 -6.003 -12.513 -1.806 1.00 0.92 H new ATOM 0 HD22 LEU A 137 -4.773 -13.781 -1.587 1.00 0.92 H new ATOM 0 HD23 LEU A 137 -5.003 -12.538 -0.335 1.00 0.92 H new ATOM 1327 N THR A 138 -0.079 -11.608 0.220 1.00 0.50 N ATOM 1328 CA THR A 138 1.232 -12.064 0.761 1.00 0.55 C ATOM 1329 C THR A 138 1.261 -11.904 2.266 1.00 0.47 C ATOM 1330 O THR A 138 0.392 -11.313 2.876 1.00 0.50 O ATOM 1331 CB THR A 138 2.394 -11.264 0.183 1.00 0.73 C ATOM 1332 OG1 THR A 138 3.511 -11.369 1.055 1.00 0.98 O ATOM 1333 CG2 THR A 138 1.995 -9.799 0.052 1.00 1.04 C ATOM 0 H THR A 138 -0.053 -10.769 -0.359 1.00 0.50 H new ATOM 0 HA THR A 138 1.342 -13.111 0.479 1.00 0.55 H new ATOM 0 HB THR A 138 2.652 -11.657 -0.800 1.00 0.73 H new ATOM 0 HG1 THR A 138 4.262 -10.858 0.688 1.00 0.98 H new ATOM 0 HG21 THR A 138 2.828 -9.231 -0.361 1.00 1.04 H new ATOM 0 HG22 THR A 138 1.134 -9.714 -0.611 1.00 1.04 H new ATOM 0 HG23 THR A 138 1.737 -9.403 1.034 1.00 1.04 H new ATOM 1341 N PHE A 139 2.286 -12.430 2.854 1.00 0.51 N ATOM 1342 CA PHE A 139 2.463 -12.343 4.337 1.00 0.49 C ATOM 1343 C PHE A 139 3.530 -11.298 4.675 1.00 0.65 C ATOM 1344 O PHE A 139 4.445 -11.063 3.913 1.00 1.43 O ATOM 1345 CB PHE A 139 2.887 -13.711 4.876 1.00 0.52 C ATOM 1346 CG PHE A 139 2.937 -13.678 6.391 1.00 0.50 C ATOM 1347 CD1 PHE A 139 1.768 -13.436 7.129 1.00 0.67 C ATOM 1348 CD2 PHE A 139 4.150 -13.893 7.060 1.00 0.59 C ATOM 1349 CE1 PHE A 139 1.815 -13.410 8.528 1.00 0.77 C ATOM 1350 CE2 PHE A 139 4.194 -13.867 8.460 1.00 0.62 C ATOM 1351 CZ PHE A 139 3.027 -13.625 9.192 1.00 0.66 C ATOM 0 H PHE A 139 3.030 -12.930 2.367 1.00 0.51 H new ATOM 0 HA PHE A 139 1.521 -12.046 4.798 1.00 0.49 H new ATOM 0 HB2 PHE A 139 2.185 -14.476 4.544 1.00 0.52 H new ATOM 0 HB3 PHE A 139 3.865 -13.981 4.477 1.00 0.52 H new ATOM 0 HD1 PHE A 139 0.832 -13.270 6.617 1.00 0.67 H new ATOM 0 HD2 PHE A 139 5.052 -14.079 6.495 1.00 0.59 H new ATOM 0 HE1 PHE A 139 0.915 -13.224 9.095 1.00 0.77 H new ATOM 0 HE2 PHE A 139 5.129 -14.034 8.974 1.00 0.62 H new ATOM 0 HZ PHE A 139 3.062 -13.604 10.271 1.00 0.66 H new ATOM 1361 N GLY A 140 3.428 -10.679 5.821 1.00 0.46 N ATOM 1362 CA GLY A 140 4.447 -9.661 6.228 1.00 0.43 C ATOM 1363 C GLY A 140 3.949 -8.258 5.883 1.00 0.35 C ATOM 1364 O GLY A 140 4.152 -7.317 6.625 1.00 0.32 O ATOM 0 H GLY A 140 2.680 -10.834 6.497 1.00 0.46 H new ATOM 0 HA2 GLY A 140 4.640 -9.735 7.298 1.00 0.43 H new ATOM 0 HA3 GLY A 140 5.391 -9.856 5.720 1.00 0.43 H new ATOM 1368 N TRP A 141 3.294 -8.109 4.767 1.00 0.34 N ATOM 1369 CA TRP A 141 2.779 -6.761 4.380 1.00 0.29 C ATOM 1370 C TRP A 141 1.552 -6.461 5.234 1.00 0.32 C ATOM 1371 O TRP A 141 0.447 -6.868 4.934 1.00 0.40 O ATOM 1372 CB TRP A 141 2.428 -6.767 2.886 1.00 0.33 C ATOM 1373 CG TRP A 141 2.149 -5.380 2.367 1.00 0.31 C ATOM 1374 CD1 TRP A 141 1.048 -5.052 1.647 1.00 0.35 C ATOM 1375 CD2 TRP A 141 2.945 -4.146 2.473 1.00 0.28 C ATOM 1376 NE1 TRP A 141 1.109 -3.715 1.306 1.00 0.33 N ATOM 1377 CE2 TRP A 141 2.249 -3.112 1.790 1.00 0.30 C ATOM 1378 CE3 TRP A 141 4.179 -3.815 3.082 1.00 0.28 C ATOM 1379 CZ2 TRP A 141 2.753 -1.813 1.713 1.00 0.32 C ATOM 1380 CZ3 TRP A 141 4.683 -2.504 3.002 1.00 0.31 C ATOM 1381 CH2 TRP A 141 3.972 -1.508 2.320 1.00 0.33 C ATOM 0 H TRP A 141 3.092 -8.858 4.105 1.00 0.34 H new ATOM 0 HA TRP A 141 3.529 -5.988 4.548 1.00 0.29 H new ATOM 0 HB2 TRP A 141 3.251 -7.207 2.322 1.00 0.33 H new ATOM 0 HB3 TRP A 141 1.555 -7.398 2.721 1.00 0.33 H new ATOM 0 HD1 TRP A 141 0.249 -5.729 1.382 1.00 0.35 H new ATOM 0 HE1 TRP A 141 0.395 -3.232 0.761 1.00 0.33 H new ATOM 0 HE3 TRP A 141 4.737 -4.573 3.611 1.00 0.28 H new ATOM 0 HZ2 TRP A 141 2.202 -1.048 1.186 1.00 0.32 H new ATOM 0 HZ3 TRP A 141 5.626 -2.263 3.470 1.00 0.31 H new ATOM 0 HH2 TRP A 141 4.367 -0.504 2.264 1.00 0.33 H new ATOM 1392 N CYS A 142 1.760 -5.782 6.326 1.00 0.31 N ATOM 1393 CA CYS A 142 0.637 -5.481 7.255 1.00 0.40 C ATOM 1394 C CYS A 142 -0.155 -4.250 6.804 1.00 0.39 C ATOM 1395 O CYS A 142 -0.535 -3.428 7.614 1.00 0.48 O ATOM 1396 CB CYS A 142 1.217 -5.239 8.640 1.00 0.47 C ATOM 1397 SG CYS A 142 2.548 -6.428 8.946 1.00 1.45 S ATOM 0 H CYS A 142 2.668 -5.420 6.617 1.00 0.31 H new ATOM 0 HA CYS A 142 -0.051 -6.326 7.264 1.00 0.40 H new ATOM 0 HB2 CYS A 142 1.599 -4.221 8.714 1.00 0.47 H new ATOM 0 HB3 CYS A 142 0.439 -5.344 9.396 1.00 0.47 H new ATOM 0 HG CYS A 142 3.289 -6.533 7.883 1.00 1.45 H new ATOM 1403 N TYR A 143 -0.422 -4.123 5.532 1.00 0.38 N ATOM 1404 CA TYR A 143 -1.210 -2.945 5.032 1.00 0.40 C ATOM 1405 C TYR A 143 -2.597 -3.434 4.587 1.00 0.43 C ATOM 1406 O TYR A 143 -2.736 -4.129 3.600 1.00 0.65 O ATOM 1407 CB TYR A 143 -0.465 -2.308 3.841 1.00 0.55 C ATOM 1408 CG TYR A 143 0.384 -1.147 4.318 1.00 1.43 C ATOM 1409 CD1 TYR A 143 -0.223 0.076 4.618 1.00 2.16 C ATOM 1410 CD2 TYR A 143 1.770 -1.295 4.458 1.00 2.17 C ATOM 1411 CE1 TYR A 143 0.551 1.153 5.057 1.00 3.14 C ATOM 1412 CE2 TYR A 143 2.545 -0.216 4.897 1.00 3.14 C ATOM 1413 CZ TYR A 143 1.937 1.007 5.196 1.00 3.52 C ATOM 1414 OH TYR A 143 2.704 2.068 5.631 1.00 4.57 O ATOM 0 H TYR A 143 -0.130 -4.783 4.811 1.00 0.38 H new ATOM 0 HA TYR A 143 -1.323 -2.200 5.820 1.00 0.40 H new ATOM 0 HB2 TYR A 143 0.165 -3.053 3.355 1.00 0.55 H new ATOM 0 HB3 TYR A 143 -1.182 -1.962 3.096 1.00 0.55 H new ATOM 0 HD1 TYR A 143 -1.292 0.188 4.510 1.00 2.16 H new ATOM 0 HD2 TYR A 143 2.239 -2.240 4.228 1.00 2.17 H new ATOM 0 HE1 TYR A 143 0.081 2.097 5.289 1.00 3.14 H new ATOM 0 HE2 TYR A 143 3.614 -0.328 5.005 1.00 3.14 H new ATOM 0 HH TYR A 143 3.645 1.796 5.672 1.00 4.57 H new ATOM 1424 N LYS A 144 -3.619 -3.079 5.323 1.00 0.39 N ATOM 1425 CA LYS A 144 -5.007 -3.518 4.973 1.00 0.51 C ATOM 1426 C LYS A 144 -5.777 -2.359 4.324 1.00 0.43 C ATOM 1427 O LYS A 144 -6.164 -1.418 4.988 1.00 0.45 O ATOM 1428 CB LYS A 144 -5.726 -3.939 6.262 1.00 0.70 C ATOM 1429 CG LYS A 144 -6.961 -4.790 5.927 1.00 1.21 C ATOM 1430 CD LYS A 144 -7.968 -4.730 7.083 1.00 1.24 C ATOM 1431 CE LYS A 144 -7.278 -5.109 8.397 1.00 1.57 C ATOM 1432 NZ LYS A 144 -6.527 -6.383 8.216 1.00 2.32 N ATOM 0 H LYS A 144 -3.552 -2.499 6.159 1.00 0.39 H new ATOM 0 HA LYS A 144 -4.961 -4.351 4.272 1.00 0.51 H new ATOM 0 HB2 LYS A 144 -5.046 -4.506 6.898 1.00 0.70 H new ATOM 0 HB3 LYS A 144 -6.026 -3.055 6.825 1.00 0.70 H new ATOM 0 HG2 LYS A 144 -7.425 -4.427 5.010 1.00 1.21 H new ATOM 0 HG3 LYS A 144 -6.663 -5.823 5.746 1.00 1.21 H new ATOM 0 HD2 LYS A 144 -8.388 -3.727 7.159 1.00 1.24 H new ATOM 0 HD3 LYS A 144 -8.798 -5.409 6.889 1.00 1.24 H new ATOM 0 HE2 LYS A 144 -6.598 -4.315 8.705 1.00 1.57 H new ATOM 0 HE3 LYS A 144 -8.018 -5.220 9.189 1.00 1.57 H new ATOM 0 HZ1 LYS A 144 -6.553 -6.930 9.100 1.00 2.32 H new ATOM 0 HZ2 LYS A 144 -6.964 -6.938 7.452 1.00 2.32 H new ATOM 0 HZ3 LYS A 144 -5.539 -6.172 7.969 1.00 2.32 H new ATOM 1446 N LEU A 145 -6.024 -2.421 3.042 1.00 0.40 N ATOM 1447 CA LEU A 145 -6.793 -1.319 2.388 1.00 0.37 C ATOM 1448 C LEU A 145 -8.279 -1.528 2.704 1.00 0.38 C ATOM 1449 O LEU A 145 -8.731 -2.646 2.826 1.00 0.41 O ATOM 1450 CB LEU A 145 -6.564 -1.351 0.861 1.00 0.42 C ATOM 1451 CG LEU A 145 -5.345 -0.481 0.480 1.00 0.50 C ATOM 1452 CD1 LEU A 145 -4.777 -0.945 -0.867 1.00 0.63 C ATOM 1453 CD2 LEU A 145 -5.766 0.993 0.363 1.00 0.52 C ATOM 0 H LEU A 145 -5.731 -3.178 2.424 1.00 0.40 H new ATOM 0 HA LEU A 145 -6.461 -0.350 2.762 1.00 0.37 H new ATOM 0 HB2 LEU A 145 -6.403 -2.378 0.533 1.00 0.42 H new ATOM 0 HB3 LEU A 145 -7.453 -0.988 0.346 1.00 0.42 H new ATOM 0 HG LEU A 145 -4.586 -0.583 1.256 1.00 0.50 H new ATOM 0 HD11 LEU A 145 -3.918 -0.329 -1.131 1.00 0.63 H new ATOM 0 HD12 LEU A 145 -4.466 -1.987 -0.791 1.00 0.63 H new ATOM 0 HD13 LEU A 145 -5.543 -0.850 -1.637 1.00 0.63 H new ATOM 0 HD21 LEU A 145 -4.900 1.598 0.094 1.00 0.52 H new ATOM 0 HD22 LEU A 145 -6.532 1.093 -0.406 1.00 0.52 H new ATOM 0 HD23 LEU A 145 -6.165 1.334 1.318 1.00 0.52 H new ATOM 1465 N VAL A 146 -9.042 -0.470 2.841 1.00 0.43 N ATOM 1466 CA VAL A 146 -10.496 -0.636 3.160 1.00 0.50 C ATOM 1467 C VAL A 146 -11.262 0.636 2.745 1.00 0.59 C ATOM 1468 O VAL A 146 -10.939 1.713 3.206 1.00 0.63 O ATOM 1469 CB VAL A 146 -10.675 -0.801 4.678 1.00 0.56 C ATOM 1470 CG1 VAL A 146 -12.169 -0.881 5.003 1.00 0.68 C ATOM 1471 CG2 VAL A 146 -9.986 -2.078 5.171 1.00 0.56 C ATOM 0 H VAL A 146 -8.724 0.495 2.747 1.00 0.43 H new ATOM 0 HA VAL A 146 -10.873 -1.509 2.628 1.00 0.50 H new ATOM 0 HB VAL A 146 -10.224 0.056 5.177 1.00 0.56 H new ATOM 0 HG11 VAL A 146 -12.302 -0.998 6.079 1.00 0.68 H new ATOM 0 HG12 VAL A 146 -12.662 0.034 4.674 1.00 0.68 H new ATOM 0 HG13 VAL A 146 -12.608 -1.736 4.488 1.00 0.68 H new ATOM 0 HG21 VAL A 146 -10.126 -2.174 6.248 1.00 0.56 H new ATOM 0 HG22 VAL A 146 -10.421 -2.943 4.670 1.00 0.56 H new ATOM 0 HG23 VAL A 146 -8.921 -2.026 4.946 1.00 0.56 H new ATOM 1481 N PRO A 147 -12.283 0.539 1.909 1.00 0.68 N ATOM 1482 CA PRO A 147 -13.079 1.738 1.502 1.00 0.81 C ATOM 1483 C PRO A 147 -13.507 2.581 2.713 1.00 0.91 C ATOM 1484 O PRO A 147 -13.125 2.314 3.835 1.00 1.12 O ATOM 1485 CB PRO A 147 -14.309 1.146 0.798 1.00 0.87 C ATOM 1486 CG PRO A 147 -13.859 -0.182 0.279 1.00 0.97 C ATOM 1487 CD PRO A 147 -12.786 -0.688 1.254 1.00 0.75 C ATOM 0 HA PRO A 147 -12.502 2.411 0.867 1.00 0.81 H new ATOM 0 HB2 PRO A 147 -15.144 1.037 1.490 1.00 0.87 H new ATOM 0 HB3 PRO A 147 -14.648 1.792 -0.012 1.00 0.87 H new ATOM 0 HG2 PRO A 147 -14.694 -0.881 0.224 1.00 0.97 H new ATOM 0 HG3 PRO A 147 -13.455 -0.088 -0.729 1.00 0.97 H new ATOM 0 HD2 PRO A 147 -13.205 -1.384 1.981 1.00 0.75 H new ATOM 0 HD3 PRO A 147 -11.989 -1.215 0.730 1.00 0.75 H new ATOM 1495 N VAL A 148 -14.309 3.588 2.495 1.00 1.17 N ATOM 1496 CA VAL A 148 -14.770 4.437 3.625 1.00 1.29 C ATOM 1497 C VAL A 148 -15.982 3.784 4.284 1.00 1.32 C ATOM 1498 O VAL A 148 -16.004 2.598 4.549 1.00 1.88 O ATOM 1499 CB VAL A 148 -15.143 5.825 3.088 1.00 1.89 C ATOM 1500 CG1 VAL A 148 -15.129 6.853 4.231 1.00 2.07 C ATOM 1501 CG2 VAL A 148 -14.125 6.234 2.021 1.00 2.31 C ATOM 0 H VAL A 148 -14.665 3.858 1.578 1.00 1.17 H new ATOM 0 HA VAL A 148 -13.977 4.540 4.365 1.00 1.29 H new ATOM 0 HB VAL A 148 -16.143 5.791 2.656 1.00 1.89 H new ATOM 0 HG11 VAL A 148 -15.395 7.835 3.840 1.00 2.07 H new ATOM 0 HG12 VAL A 148 -15.850 6.559 4.994 1.00 2.07 H new ATOM 0 HG13 VAL A 148 -14.132 6.895 4.670 1.00 2.07 H new ATOM 0 HG21 VAL A 148 -14.381 7.220 1.633 1.00 2.31 H new ATOM 0 HG22 VAL A 148 -13.129 6.265 2.462 1.00 2.31 H new ATOM 0 HG23 VAL A 148 -14.139 5.509 1.208 1.00 2.31 H new ATOM 1511 N GLU A 149 -16.982 4.558 4.551 1.00 1.71 N ATOM 1512 CA GLU A 149 -18.207 4.013 5.203 1.00 2.15 C ATOM 1513 C GLU A 149 -18.945 3.087 4.222 1.00 2.52 C ATOM 1514 O GLU A 149 -18.899 3.293 3.027 1.00 2.96 O ATOM 1515 CB GLU A 149 -19.128 5.170 5.597 1.00 3.00 C ATOM 1516 CG GLU A 149 -18.525 5.921 6.786 1.00 3.61 C ATOM 1517 CD GLU A 149 -18.623 5.052 8.040 1.00 4.55 C ATOM 1518 OE1 GLU A 149 -19.694 5.007 8.624 1.00 5.12 O ATOM 1519 OE2 GLU A 149 -17.626 4.447 8.397 1.00 5.02 O ATOM 0 H GLU A 149 -17.011 5.557 4.346 1.00 1.71 H new ATOM 0 HA GLU A 149 -17.924 3.449 6.092 1.00 2.15 H new ATOM 0 HB2 GLU A 149 -19.259 5.848 4.754 1.00 3.00 H new ATOM 0 HB3 GLU A 149 -20.116 4.790 5.857 1.00 3.00 H new ATOM 0 HG2 GLU A 149 -17.483 6.169 6.583 1.00 3.61 H new ATOM 0 HG3 GLU A 149 -19.052 6.862 6.941 1.00 3.61 H new ATOM 1526 N PRO A 150 -19.629 2.076 4.715 1.00 3.13 N ATOM 1527 CA PRO A 150 -20.388 1.123 3.848 1.00 4.08 C ATOM 1528 C PRO A 150 -21.707 1.727 3.350 1.00 4.33 C ATOM 1529 O PRO A 150 -22.699 1.730 4.051 1.00 4.84 O ATOM 1530 CB PRO A 150 -20.653 -0.062 4.780 1.00 4.93 C ATOM 1531 CG PRO A 150 -20.762 0.554 6.135 1.00 4.81 C ATOM 1532 CD PRO A 150 -19.763 1.717 6.144 1.00 3.63 C ATOM 0 HA PRO A 150 -19.839 0.855 2.945 1.00 4.08 H new ATOM 0 HB2 PRO A 150 -21.568 -0.587 4.506 1.00 4.93 H new ATOM 0 HB3 PRO A 150 -19.843 -0.790 4.738 1.00 4.93 H new ATOM 0 HG2 PRO A 150 -21.776 0.907 6.324 1.00 4.81 H new ATOM 0 HG3 PRO A 150 -20.526 -0.171 6.915 1.00 4.81 H new ATOM 0 HD2 PRO A 150 -20.131 2.556 6.735 1.00 3.63 H new ATOM 0 HD3 PRO A 150 -18.806 1.420 6.574 1.00 3.63 H new ATOM 1540 N GLU A 151 -21.723 2.240 2.152 1.00 4.44 N ATOM 1541 CA GLU A 151 -22.973 2.845 1.613 1.00 5.08 C ATOM 1542 C GLU A 151 -24.057 1.771 1.470 1.00 5.48 C ATOM 1543 O GLU A 151 -24.472 1.439 0.378 1.00 5.61 O ATOM 1544 CB GLU A 151 -22.688 3.467 0.245 1.00 5.57 C ATOM 1545 CG GLU A 151 -21.788 4.691 0.424 1.00 5.87 C ATOM 1546 CD GLU A 151 -21.580 5.375 -0.928 1.00 6.47 C ATOM 1547 OE1 GLU A 151 -21.261 4.680 -1.879 1.00 6.96 O ATOM 1548 OE2 GLU A 151 -21.744 6.583 -0.990 1.00 6.74 O ATOM 0 H GLU A 151 -20.922 2.267 1.521 1.00 4.44 H new ATOM 0 HA GLU A 151 -23.323 3.615 2.301 1.00 5.08 H new ATOM 0 HB2 GLU A 151 -22.205 2.738 -0.405 1.00 5.57 H new ATOM 0 HB3 GLU A 151 -23.622 3.755 -0.238 1.00 5.57 H new ATOM 0 HG2 GLU A 151 -22.240 5.388 1.130 1.00 5.87 H new ATOM 0 HG3 GLU A 151 -20.828 4.391 0.843 1.00 5.87 H new ATOM 1555 N LYS A 152 -24.526 1.231 2.564 1.00 6.06 N ATOM 1556 CA LYS A 152 -25.589 0.187 2.483 1.00 6.80 C ATOM 1557 C LYS A 152 -26.944 0.878 2.344 1.00 7.18 C ATOM 1558 O LYS A 152 -27.974 0.246 2.223 1.00 7.59 O ATOM 1559 CB LYS A 152 -25.569 -0.665 3.759 1.00 7.59 C ATOM 1560 CG LYS A 152 -26.698 -1.705 3.715 1.00 7.87 C ATOM 1561 CD LYS A 152 -26.388 -2.850 4.684 1.00 8.73 C ATOM 1562 CE LYS A 152 -26.166 -2.289 6.092 1.00 9.22 C ATOM 1563 NZ LYS A 152 -27.197 -1.255 6.385 1.00 9.63 N ATOM 0 H LYS A 152 -24.220 1.467 3.508 1.00 6.06 H new ATOM 0 HA LYS A 152 -25.414 -0.459 1.623 1.00 6.80 H new ATOM 0 HB2 LYS A 152 -24.606 -1.166 3.856 1.00 7.59 H new ATOM 0 HB3 LYS A 152 -25.686 -0.026 4.634 1.00 7.59 H new ATOM 0 HG2 LYS A 152 -27.646 -1.237 3.982 1.00 7.87 H new ATOM 0 HG3 LYS A 152 -26.808 -2.093 2.702 1.00 7.87 H new ATOM 0 HD2 LYS A 152 -27.211 -3.565 4.692 1.00 8.73 H new ATOM 0 HD3 LYS A 152 -25.501 -3.389 4.353 1.00 8.73 H new ATOM 0 HE2 LYS A 152 -26.222 -3.092 6.827 1.00 9.22 H new ATOM 0 HE3 LYS A 152 -25.169 -1.855 6.169 1.00 9.22 H new ATOM 0 HZ1 LYS A 152 -27.307 -1.156 7.414 1.00 9.63 H new ATOM 0 HZ2 LYS A 152 -26.901 -0.344 5.979 1.00 9.63 H new ATOM 0 HZ3 LYS A 152 -28.105 -1.541 5.966 1.00 9.63 H new ATOM 1577 N LEU A 153 -26.941 2.181 2.354 1.00 7.34 N ATOM 1578 CA LEU A 153 -28.216 2.939 2.218 1.00 7.98 C ATOM 1579 C LEU A 153 -28.598 3.027 0.739 1.00 8.11 C ATOM 1580 O LEU A 153 -28.290 2.151 -0.044 1.00 8.31 O ATOM 1581 CB LEU A 153 -28.027 4.348 2.788 1.00 8.45 C ATOM 1582 CG LEU A 153 -27.311 4.262 4.141 1.00 8.93 C ATOM 1583 CD1 LEU A 153 -27.140 5.670 4.721 1.00 9.23 C ATOM 1584 CD2 LEU A 153 -28.140 3.408 5.108 1.00 9.46 C ATOM 0 H LEU A 153 -26.105 2.757 2.451 1.00 7.34 H new ATOM 0 HA LEU A 153 -29.009 2.430 2.765 1.00 7.98 H new ATOM 0 HB2 LEU A 153 -27.446 4.957 2.095 1.00 8.45 H new ATOM 0 HB3 LEU A 153 -28.994 4.836 2.907 1.00 8.45 H new ATOM 0 HG LEU A 153 -26.331 3.805 4.003 1.00 8.93 H new ATOM 0 HD11 LEU A 153 -26.631 5.608 5.683 1.00 9.23 H new ATOM 0 HD12 LEU A 153 -26.548 6.276 4.036 1.00 9.23 H new ATOM 0 HD13 LEU A 153 -28.119 6.129 4.858 1.00 9.23 H new ATOM 0 HD21 LEU A 153 -27.630 3.348 6.069 1.00 9.46 H new ATOM 0 HD22 LEU A 153 -29.121 3.863 5.246 1.00 9.46 H new ATOM 0 HD23 LEU A 153 -28.259 2.405 4.697 1.00 9.46 H new ATOM 1596 N GLU A 154 -29.268 4.077 0.350 1.00 8.27 N ATOM 1597 CA GLU A 154 -29.669 4.217 -1.079 1.00 8.64 C ATOM 1598 C GLU A 154 -28.446 4.600 -1.916 1.00 8.97 C ATOM 1599 O GLU A 154 -27.360 4.098 -1.709 1.00 9.31 O ATOM 1600 CB GLU A 154 -30.736 5.306 -1.203 1.00 9.08 C ATOM 1601 CG GLU A 154 -31.933 4.949 -0.318 1.00 9.38 C ATOM 1602 CD GLU A 154 -33.116 5.857 -0.663 1.00 9.91 C ATOM 1603 OE1 GLU A 154 -33.082 6.468 -1.717 1.00 10.18 O ATOM 1604 OE2 GLU A 154 -34.037 5.922 0.136 1.00 10.25 O ATOM 0 H GLU A 154 -29.555 4.843 0.959 1.00 8.27 H new ATOM 0 HA GLU A 154 -30.073 3.271 -1.439 1.00 8.64 H new ATOM 0 HB2 GLU A 154 -30.324 6.270 -0.905 1.00 9.08 H new ATOM 0 HB3 GLU A 154 -31.053 5.403 -2.241 1.00 9.08 H new ATOM 0 HG2 GLU A 154 -32.208 3.905 -0.465 1.00 9.38 H new ATOM 0 HG3 GLU A 154 -31.668 5.064 0.733 1.00 9.38 H new ATOM 1611 N GLU A 155 -28.613 5.486 -2.859 1.00 9.09 N ATOM 1612 CA GLU A 155 -27.459 5.900 -3.705 1.00 9.60 C ATOM 1613 C GLU A 155 -27.828 7.172 -4.469 1.00 9.70 C ATOM 1614 O GLU A 155 -28.891 7.274 -5.048 1.00 10.09 O ATOM 1615 CB GLU A 155 -27.123 4.776 -4.693 1.00 10.07 C ATOM 1616 CG GLU A 155 -26.015 5.222 -5.657 1.00 10.61 C ATOM 1617 CD GLU A 155 -24.787 5.679 -4.865 1.00 11.03 C ATOM 1618 OE1 GLU A 155 -24.179 4.843 -4.218 1.00 11.33 O ATOM 1619 OE2 GLU A 155 -24.476 6.858 -4.919 1.00 11.24 O ATOM 0 H GLU A 155 -29.499 5.941 -3.080 1.00 9.09 H new ATOM 0 HA GLU A 155 -26.590 6.095 -3.077 1.00 9.60 H new ATOM 0 HB2 GLU A 155 -26.803 3.888 -4.148 1.00 10.07 H new ATOM 0 HB3 GLU A 155 -28.014 4.500 -5.256 1.00 10.07 H new ATOM 0 HG2 GLU A 155 -25.745 4.400 -6.320 1.00 10.61 H new ATOM 0 HG3 GLU A 155 -26.375 6.035 -6.287 1.00 10.61 H new ATOM 1626 N ALA A 156 -26.957 8.143 -4.477 1.00 9.56 N ATOM 1627 CA ALA A 156 -27.257 9.409 -5.202 1.00 9.82 C ATOM 1628 C ALA A 156 -27.223 9.157 -6.712 1.00 9.59 C ATOM 1629 O ALA A 156 -27.759 8.183 -7.202 1.00 9.64 O ATOM 1630 CB ALA A 156 -26.211 10.462 -4.838 1.00 9.95 C ATOM 0 H ALA A 156 -26.050 8.114 -4.012 1.00 9.56 H new ATOM 0 HA ALA A 156 -28.247 9.764 -4.917 1.00 9.82 H new ATOM 0 HB1 ALA A 156 -26.429 11.389 -5.368 1.00 9.95 H new ATOM 0 HB2 ALA A 156 -26.236 10.643 -3.763 1.00 9.95 H new ATOM 0 HB3 ALA A 156 -25.221 10.105 -5.123 1.00 9.95 H new ATOM 1636 N ASN A 157 -26.599 10.036 -7.453 1.00 9.56 N ATOM 1637 CA ASN A 157 -26.529 9.863 -8.936 1.00 9.52 C ATOM 1638 C ASN A 157 -25.236 9.134 -9.313 1.00 9.04 C ATOM 1639 O ASN A 157 -24.185 9.388 -8.761 1.00 9.05 O ATOM 1640 CB ASN A 157 -26.543 11.239 -9.603 1.00 10.08 C ATOM 1641 CG ASN A 157 -27.752 12.035 -9.105 1.00 10.54 C ATOM 1642 OD1 ASN A 157 -28.760 12.114 -9.779 1.00 10.93 O ATOM 1643 ND2 ASN A 157 -27.694 12.630 -7.944 1.00 10.75 N ATOM 0 H ASN A 157 -26.133 10.869 -7.094 1.00 9.56 H new ATOM 0 HA ASN A 157 -27.385 9.277 -9.272 1.00 9.52 H new ATOM 0 HB2 ASN A 157 -25.622 11.775 -9.374 1.00 10.08 H new ATOM 0 HB3 ASN A 157 -26.588 11.129 -10.687 1.00 10.08 H new ATOM 0 HD21 ASN A 157 -28.495 13.161 -7.603 1.00 10.75 H new ATOM 0 HD22 ASN A 157 -26.848 12.563 -7.379 1.00 10.75 H new ATOM 1650 N LYS A 158 -25.307 8.231 -10.257 1.00 8.83 N ATOM 1651 CA LYS A 158 -24.086 7.481 -10.682 1.00 8.52 C ATOM 1652 C LYS A 158 -23.441 8.184 -11.879 1.00 8.03 C ATOM 1653 O LYS A 158 -23.450 7.679 -12.985 1.00 8.18 O ATOM 1654 CB LYS A 158 -24.479 6.056 -11.090 1.00 8.88 C ATOM 1655 CG LYS A 158 -23.216 5.182 -11.245 1.00 9.31 C ATOM 1656 CD LYS A 158 -22.832 4.549 -9.893 1.00 9.87 C ATOM 1657 CE LYS A 158 -23.610 3.245 -9.683 1.00 10.59 C ATOM 1658 NZ LYS A 158 -23.186 2.614 -8.402 1.00 10.96 N ATOM 0 H LYS A 158 -26.162 7.980 -10.754 1.00 8.83 H new ATOM 0 HA LYS A 158 -23.379 7.447 -9.853 1.00 8.52 H new ATOM 0 HB2 LYS A 158 -25.140 5.624 -10.339 1.00 8.88 H new ATOM 0 HB3 LYS A 158 -25.033 6.078 -12.028 1.00 8.88 H new ATOM 0 HG2 LYS A 158 -23.396 4.400 -11.982 1.00 9.31 H new ATOM 0 HG3 LYS A 158 -22.390 5.788 -11.618 1.00 9.31 H new ATOM 0 HD2 LYS A 158 -21.761 4.351 -9.867 1.00 9.87 H new ATOM 0 HD3 LYS A 158 -23.048 5.245 -9.082 1.00 9.87 H new ATOM 0 HE2 LYS A 158 -24.681 3.447 -9.664 1.00 10.59 H new ATOM 0 HE3 LYS A 158 -23.429 2.563 -10.514 1.00 10.59 H new ATOM 0 HZ1 LYS A 158 -23.714 1.729 -8.259 1.00 10.96 H new ATOM 0 HZ2 LYS A 158 -22.167 2.408 -8.437 1.00 10.96 H new ATOM 0 HZ3 LYS A 158 -23.381 3.264 -7.614 1.00 10.96 H new ATOM 1672 N ASP A 174 -22.876 9.345 -11.671 1.00 7.70 N ATOM 1673 CA ASP A 174 -22.225 10.081 -12.800 1.00 7.46 C ATOM 1674 C ASP A 174 -21.000 10.835 -12.278 1.00 6.93 C ATOM 1675 O ASP A 174 -20.340 11.544 -13.011 1.00 7.21 O ATOM 1676 CB ASP A 174 -23.216 11.080 -13.402 1.00 7.83 C ATOM 1677 CG ASP A 174 -23.763 11.990 -12.301 1.00 8.11 C ATOM 1678 OD1 ASP A 174 -24.093 11.477 -11.245 1.00 8.38 O ATOM 1679 OD2 ASP A 174 -23.843 13.186 -12.533 1.00 8.32 O ATOM 0 H ASP A 174 -22.836 9.817 -10.768 1.00 7.70 H new ATOM 0 HA ASP A 174 -21.918 9.368 -13.565 1.00 7.46 H new ATOM 0 HB2 ASP A 174 -22.724 11.677 -14.170 1.00 7.83 H new ATOM 0 HB3 ASP A 174 -24.034 10.548 -13.887 1.00 7.83 H new ATOM 1684 N ASP A 175 -20.686 10.685 -11.018 1.00 6.43 N ATOM 1685 CA ASP A 175 -19.500 11.389 -10.453 1.00 6.11 C ATOM 1686 C ASP A 175 -18.246 10.534 -10.698 1.00 5.51 C ATOM 1687 O ASP A 175 -18.329 9.322 -10.747 1.00 5.46 O ATOM 1688 CB ASP A 175 -19.704 11.582 -8.947 1.00 6.61 C ATOM 1689 CG ASP A 175 -20.324 10.315 -8.354 1.00 7.27 C ATOM 1690 OD1 ASP A 175 -19.577 9.407 -8.032 1.00 7.70 O ATOM 1691 OD2 ASP A 175 -21.538 10.275 -8.234 1.00 7.57 O ATOM 0 H ASP A 175 -21.201 10.104 -10.356 1.00 6.43 H new ATOM 0 HA ASP A 175 -19.378 12.361 -10.932 1.00 6.11 H new ATOM 0 HB2 ASP A 175 -18.750 11.795 -8.464 1.00 6.61 H new ATOM 0 HB3 ASP A 175 -20.353 12.438 -8.763 1.00 6.61 H new ATOM 1696 N PRO A 176 -17.091 11.144 -10.844 1.00 5.43 N ATOM 1697 CA PRO A 176 -15.825 10.397 -11.075 1.00 5.29 C ATOM 1698 C PRO A 176 -15.755 9.108 -10.245 1.00 4.96 C ATOM 1699 O PRO A 176 -15.781 9.141 -9.031 1.00 4.91 O ATOM 1700 CB PRO A 176 -14.748 11.390 -10.631 1.00 5.76 C ATOM 1701 CG PRO A 176 -15.328 12.742 -10.918 1.00 6.11 C ATOM 1702 CD PRO A 176 -16.857 12.601 -10.806 1.00 5.94 C ATOM 0 HA PRO A 176 -15.718 10.071 -12.110 1.00 5.29 H new ATOM 0 HB2 PRO A 176 -14.518 11.276 -9.572 1.00 5.76 H new ATOM 0 HB3 PRO A 176 -13.818 11.235 -11.178 1.00 5.76 H new ATOM 0 HG2 PRO A 176 -14.955 13.481 -10.209 1.00 6.11 H new ATOM 0 HG3 PRO A 176 -15.043 13.082 -11.914 1.00 6.11 H new ATOM 0 HD2 PRO A 176 -17.231 13.040 -9.881 1.00 5.94 H new ATOM 0 HD3 PRO A 176 -17.365 13.107 -11.627 1.00 5.94 H new ATOM 1710 N GLU A 177 -15.662 7.977 -10.889 1.00 5.10 N ATOM 1711 CA GLU A 177 -15.588 6.697 -10.129 1.00 5.19 C ATOM 1712 C GLU A 177 -14.167 6.512 -9.597 1.00 4.50 C ATOM 1713 O GLU A 177 -13.487 5.559 -9.921 1.00 4.75 O ATOM 1714 CB GLU A 177 -15.947 5.530 -11.050 1.00 6.10 C ATOM 1715 CG GLU A 177 -17.431 5.608 -11.414 1.00 6.79 C ATOM 1716 CD GLU A 177 -17.812 4.396 -12.266 1.00 7.52 C ATOM 1717 OE1 GLU A 177 -17.000 3.992 -13.082 1.00 7.81 O ATOM 1718 OE2 GLU A 177 -18.910 3.893 -12.088 1.00 8.01 O ATOM 0 H GLU A 177 -15.634 7.884 -11.904 1.00 5.10 H new ATOM 0 HA GLU A 177 -16.291 6.725 -9.296 1.00 5.19 H new ATOM 0 HB2 GLU A 177 -15.337 5.564 -11.953 1.00 6.10 H new ATOM 0 HB3 GLU A 177 -15.732 4.583 -10.556 1.00 6.10 H new ATOM 0 HG2 GLU A 177 -18.037 5.635 -10.509 1.00 6.79 H new ATOM 0 HG3 GLU A 177 -17.634 6.529 -11.961 1.00 6.79 H new ATOM 1725 N ARG A 178 -13.713 7.425 -8.782 1.00 3.95 N ATOM 1726 CA ARG A 178 -12.335 7.316 -8.225 1.00 3.61 C ATOM 1727 C ARG A 178 -12.328 6.316 -7.065 1.00 3.28 C ATOM 1728 O ARG A 178 -13.227 6.292 -6.247 1.00 3.07 O ATOM 1729 CB ARG A 178 -11.865 8.693 -7.730 1.00 3.75 C ATOM 1730 CG ARG A 178 -13.009 9.417 -6.997 1.00 4.06 C ATOM 1731 CD ARG A 178 -12.506 10.747 -6.394 1.00 4.58 C ATOM 1732 NE ARG A 178 -13.121 10.958 -5.044 1.00 5.19 N ATOM 1733 CZ ARG A 178 -14.406 10.798 -4.850 1.00 5.87 C ATOM 1734 NH1 ARG A 178 -15.211 10.599 -5.855 1.00 6.06 N ATOM 1735 NH2 ARG A 178 -14.892 10.891 -3.642 1.00 6.66 N ATOM 0 H ARG A 178 -14.239 8.244 -8.477 1.00 3.95 H new ATOM 0 HA ARG A 178 -11.657 6.967 -9.004 1.00 3.61 H new ATOM 0 HB2 ARG A 178 -11.013 8.575 -7.061 1.00 3.75 H new ATOM 0 HB3 ARG A 178 -11.527 9.294 -8.574 1.00 3.75 H new ATOM 0 HG2 ARG A 178 -13.828 9.611 -7.690 1.00 4.06 H new ATOM 0 HG3 ARG A 178 -13.405 8.779 -6.207 1.00 4.06 H new ATOM 0 HD2 ARG A 178 -11.419 10.731 -6.310 1.00 4.58 H new ATOM 0 HD3 ARG A 178 -12.762 11.576 -7.054 1.00 4.58 H new ATOM 0 HE ARG A 178 -12.527 11.232 -4.261 1.00 5.19 H new ATOM 0 HH11 ARG A 178 -14.842 10.566 -6.805 1.00 6.06 H new ATOM 0 HH12 ARG A 178 -16.210 10.476 -5.691 1.00 6.06 H new ATOM 0 HH21 ARG A 178 -14.272 11.087 -2.856 1.00 6.66 H new ATOM 0 HH22 ARG A 178 -15.892 10.767 -3.484 1.00 6.66 H new ATOM 1749 N GLU A 179 -11.320 5.488 -6.989 1.00 3.66 N ATOM 1750 CA GLU A 179 -11.254 4.490 -5.884 1.00 3.59 C ATOM 1751 C GLU A 179 -10.854 5.190 -4.587 1.00 2.48 C ATOM 1752 O GLU A 179 -9.709 5.542 -4.385 1.00 2.75 O ATOM 1753 CB GLU A 179 -10.219 3.418 -6.219 1.00 4.67 C ATOM 1754 CG GLU A 179 -10.446 2.911 -7.645 1.00 5.63 C ATOM 1755 CD GLU A 179 -9.667 1.611 -7.856 1.00 6.37 C ATOM 1756 OE1 GLU A 179 -9.979 0.641 -7.184 1.00 6.71 O ATOM 1757 OE2 GLU A 179 -8.774 1.605 -8.687 1.00 6.87 O ATOM 0 H GLU A 179 -10.540 5.460 -7.645 1.00 3.66 H new ATOM 0 HA GLU A 179 -12.232 4.025 -5.762 1.00 3.59 H new ATOM 0 HB2 GLU A 179 -9.213 3.827 -6.124 1.00 4.67 H new ATOM 0 HB3 GLU A 179 -10.295 2.592 -5.512 1.00 4.67 H new ATOM 0 HG2 GLU A 179 -11.509 2.742 -7.817 1.00 5.63 H new ATOM 0 HG3 GLU A 179 -10.122 3.662 -8.365 1.00 5.63 H new ATOM 1764 N VAL A 180 -11.793 5.395 -3.706 1.00 1.65 N ATOM 1765 CA VAL A 180 -11.488 6.076 -2.412 1.00 0.77 C ATOM 1766 C VAL A 180 -11.154 5.031 -1.352 1.00 0.63 C ATOM 1767 O VAL A 180 -11.999 4.617 -0.582 1.00 0.64 O ATOM 1768 CB VAL A 180 -12.710 6.885 -1.990 1.00 1.22 C ATOM 1769 CG1 VAL A 180 -12.455 7.557 -0.640 1.00 2.08 C ATOM 1770 CG2 VAL A 180 -12.962 7.953 -3.048 1.00 1.28 C ATOM 0 H VAL A 180 -12.767 5.118 -3.826 1.00 1.65 H new ATOM 0 HA VAL A 180 -10.632 6.741 -2.527 1.00 0.77 H new ATOM 0 HB VAL A 180 -13.575 6.228 -1.895 1.00 1.22 H new ATOM 0 HG11 VAL A 180 -13.334 8.132 -0.348 1.00 2.08 H new ATOM 0 HG12 VAL A 180 -12.253 6.795 0.113 1.00 2.08 H new ATOM 0 HG13 VAL A 180 -11.596 8.223 -0.722 1.00 2.08 H new ATOM 0 HG21 VAL A 180 -13.833 8.545 -2.767 1.00 1.28 H new ATOM 0 HG22 VAL A 180 -12.090 8.603 -3.124 1.00 1.28 H new ATOM 0 HG23 VAL A 180 -13.143 7.476 -4.011 1.00 1.28 H new ATOM 1780 N LEU A 181 -9.921 4.593 -1.322 1.00 0.58 N ATOM 1781 CA LEU A 181 -9.496 3.552 -0.319 1.00 0.52 C ATOM 1782 C LEU A 181 -8.428 4.115 0.631 1.00 0.47 C ATOM 1783 O LEU A 181 -7.492 4.761 0.210 1.00 0.51 O ATOM 1784 CB LEU A 181 -8.911 2.340 -1.056 1.00 0.60 C ATOM 1785 CG LEU A 181 -9.782 1.979 -2.263 1.00 0.74 C ATOM 1786 CD1 LEU A 181 -9.150 0.802 -3.007 1.00 0.95 C ATOM 1787 CD2 LEU A 181 -11.182 1.587 -1.784 1.00 0.87 C ATOM 0 H LEU A 181 -9.182 4.909 -1.950 1.00 0.58 H new ATOM 0 HA LEU A 181 -10.370 3.258 0.262 1.00 0.52 H new ATOM 0 HB2 LEU A 181 -7.896 2.562 -1.385 1.00 0.60 H new ATOM 0 HB3 LEU A 181 -8.848 1.489 -0.377 1.00 0.60 H new ATOM 0 HG LEU A 181 -9.855 2.837 -2.931 1.00 0.74 H new ATOM 0 HD11 LEU A 181 -9.767 0.542 -3.867 1.00 0.95 H new ATOM 0 HD12 LEU A 181 -8.152 1.080 -3.347 1.00 0.95 H new ATOM 0 HD13 LEU A 181 -9.080 -0.056 -2.338 1.00 0.95 H new ATOM 0 HD21 LEU A 181 -11.802 1.330 -2.643 1.00 0.87 H new ATOM 0 HD22 LEU A 181 -11.111 0.727 -1.118 1.00 0.87 H new ATOM 0 HD23 LEU A 181 -11.631 2.424 -1.250 1.00 0.87 H new ATOM 1799 N GLU A 182 -8.553 3.852 1.913 1.00 0.45 N ATOM 1800 CA GLU A 182 -7.537 4.347 2.904 1.00 0.45 C ATOM 1801 C GLU A 182 -6.638 3.193 3.368 1.00 0.42 C ATOM 1802 O GLU A 182 -7.104 2.127 3.719 1.00 0.43 O ATOM 1803 CB GLU A 182 -8.254 4.965 4.114 1.00 0.49 C ATOM 1804 CG GLU A 182 -8.902 3.870 4.968 1.00 0.56 C ATOM 1805 CD GLU A 182 -9.842 4.514 5.988 1.00 0.90 C ATOM 1806 OE1 GLU A 182 -10.670 5.311 5.580 1.00 1.49 O ATOM 1807 OE2 GLU A 182 -9.715 4.200 7.161 1.00 1.62 O ATOM 0 H GLU A 182 -9.318 3.313 2.318 1.00 0.45 H new ATOM 0 HA GLU A 182 -6.916 5.104 2.424 1.00 0.45 H new ATOM 0 HB2 GLU A 182 -7.543 5.531 4.716 1.00 0.49 H new ATOM 0 HB3 GLU A 182 -9.015 5.668 3.774 1.00 0.49 H new ATOM 0 HG2 GLU A 182 -9.455 3.177 4.333 1.00 0.56 H new ATOM 0 HG3 GLU A 182 -8.134 3.290 5.480 1.00 0.56 H new ATOM 1814 N TRP A 183 -5.347 3.416 3.379 1.00 0.40 N ATOM 1815 CA TRP A 183 -4.394 2.357 3.828 1.00 0.38 C ATOM 1816 C TRP A 183 -4.445 2.260 5.361 1.00 0.37 C ATOM 1817 O TRP A 183 -4.202 3.224 6.049 1.00 0.43 O ATOM 1818 CB TRP A 183 -2.961 2.746 3.395 1.00 0.41 C ATOM 1819 CG TRP A 183 -2.656 2.243 2.017 1.00 0.42 C ATOM 1820 CD1 TRP A 183 -2.500 0.943 1.674 1.00 0.52 C ATOM 1821 CD2 TRP A 183 -2.439 3.017 0.802 1.00 0.38 C ATOM 1822 NE1 TRP A 183 -2.201 0.870 0.324 1.00 0.53 N ATOM 1823 CE2 TRP A 183 -2.153 2.124 -0.260 1.00 0.44 C ATOM 1824 CE3 TRP A 183 -2.464 4.394 0.522 1.00 0.38 C ATOM 1825 CZ2 TRP A 183 -1.899 2.588 -1.555 1.00 0.44 C ATOM 1826 CZ3 TRP A 183 -2.210 4.862 -0.776 1.00 0.41 C ATOM 1827 CH2 TRP A 183 -1.927 3.961 -1.812 1.00 0.41 C ATOM 0 H TRP A 183 -4.911 4.293 3.094 1.00 0.40 H new ATOM 0 HA TRP A 183 -4.666 1.400 3.383 1.00 0.38 H new ATOM 0 HB2 TRP A 183 -2.852 3.830 3.422 1.00 0.41 H new ATOM 0 HB3 TRP A 183 -2.240 2.336 4.103 1.00 0.41 H new ATOM 0 HD1 TRP A 183 -2.593 0.101 2.344 1.00 0.52 H new ATOM 0 HE1 TRP A 183 -2.036 -0.002 -0.179 1.00 0.53 H new ATOM 0 HE3 TRP A 183 -2.680 5.098 1.312 1.00 0.38 H new ATOM 0 HZ2 TRP A 183 -1.683 1.890 -2.350 1.00 0.44 H new ATOM 0 HZ3 TRP A 183 -2.233 5.923 -0.978 1.00 0.41 H new ATOM 0 HH2 TRP A 183 -1.731 4.328 -2.809 1.00 0.41 H new ATOM 1838 N ARG A 184 -4.747 1.108 5.906 1.00 0.35 N ATOM 1839 CA ARG A 184 -4.790 0.969 7.402 1.00 0.35 C ATOM 1840 C ARG A 184 -3.546 0.211 7.877 1.00 0.31 C ATOM 1841 O ARG A 184 -3.476 -1.000 7.803 1.00 0.31 O ATOM 1842 CB ARG A 184 -6.041 0.189 7.816 1.00 0.40 C ATOM 1843 CG ARG A 184 -7.286 1.053 7.605 1.00 0.98 C ATOM 1844 CD ARG A 184 -8.525 0.268 8.041 1.00 1.51 C ATOM 1845 NE ARG A 184 -8.468 0.029 9.511 1.00 1.57 N ATOM 1846 CZ ARG A 184 -9.532 -0.371 10.152 1.00 2.13 C ATOM 1847 NH1 ARG A 184 -10.647 -0.578 9.505 1.00 2.82 N ATOM 1848 NH2 ARG A 184 -9.480 -0.567 11.441 1.00 2.61 N ATOM 0 H ARG A 184 -4.965 0.258 5.386 1.00 0.35 H new ATOM 0 HA ARG A 184 -4.816 1.961 7.853 1.00 0.35 H new ATOM 0 HB2 ARG A 184 -6.120 -0.727 7.230 1.00 0.40 H new ATOM 0 HB3 ARG A 184 -5.966 -0.107 8.862 1.00 0.40 H new ATOM 0 HG2 ARG A 184 -7.205 1.975 8.180 1.00 0.98 H new ATOM 0 HG3 ARG A 184 -7.372 1.338 6.556 1.00 0.98 H new ATOM 0 HD2 ARG A 184 -9.428 0.822 7.786 1.00 1.51 H new ATOM 0 HD3 ARG A 184 -8.573 -0.682 7.509 1.00 1.51 H new ATOM 0 HE ARG A 184 -7.595 0.178 10.017 1.00 1.57 H new ATOM 0 HH11 ARG A 184 -10.687 -0.427 8.497 1.00 2.82 H new ATOM 0 HH12 ARG A 184 -11.478 -0.891 10.008 1.00 2.82 H new ATOM 0 HH21 ARG A 184 -8.608 -0.408 11.946 1.00 2.61 H new ATOM 0 HH22 ARG A 184 -10.311 -0.880 11.943 1.00 2.61 H new ATOM 1862 N PHE A 185 -2.564 0.917 8.366 1.00 0.31 N ATOM 1863 CA PHE A 185 -1.319 0.251 8.848 1.00 0.31 C ATOM 1864 C PHE A 185 -1.630 -0.577 10.104 1.00 0.31 C ATOM 1865 O PHE A 185 -2.284 -0.113 11.016 1.00 0.37 O ATOM 1866 CB PHE A 185 -0.288 1.334 9.185 1.00 0.40 C ATOM 1867 CG PHE A 185 0.997 0.704 9.667 1.00 0.44 C ATOM 1868 CD1 PHE A 185 1.102 0.241 10.984 1.00 0.65 C ATOM 1869 CD2 PHE A 185 2.088 0.593 8.799 1.00 0.62 C ATOM 1870 CE1 PHE A 185 2.300 -0.332 11.430 1.00 0.75 C ATOM 1871 CE2 PHE A 185 3.281 0.021 9.245 1.00 0.74 C ATOM 1872 CZ PHE A 185 3.390 -0.441 10.558 1.00 0.71 C ATOM 0 H PHE A 185 -2.570 1.933 8.453 1.00 0.31 H new ATOM 0 HA PHE A 185 -0.926 -0.412 8.077 1.00 0.31 H new ATOM 0 HB2 PHE A 185 -0.093 1.946 8.304 1.00 0.40 H new ATOM 0 HB3 PHE A 185 -0.686 1.998 9.953 1.00 0.40 H new ATOM 0 HD1 PHE A 185 0.260 0.325 11.655 1.00 0.65 H new ATOM 0 HD2 PHE A 185 2.008 0.950 7.783 1.00 0.62 H new ATOM 0 HE1 PHE A 185 2.383 -0.689 12.446 1.00 0.75 H new ATOM 0 HE2 PHE A 185 4.122 -0.064 8.573 1.00 0.74 H new ATOM 0 HZ PHE A 185 4.314 -0.882 10.901 1.00 0.71 H new ATOM 1882 N ASP A 186 -1.175 -1.804 10.153 1.00 0.28 N ATOM 1883 CA ASP A 186 -1.453 -2.662 11.339 1.00 0.32 C ATOM 1884 C ASP A 186 -0.353 -3.725 11.476 1.00 0.30 C ATOM 1885 O ASP A 186 -0.605 -4.906 11.345 1.00 0.32 O ATOM 1886 CB ASP A 186 -2.800 -3.346 11.122 1.00 0.37 C ATOM 1887 CG ASP A 186 -3.357 -3.846 12.459 1.00 0.47 C ATOM 1888 OD1 ASP A 186 -3.193 -3.148 13.446 1.00 1.23 O ATOM 1889 OD2 ASP A 186 -3.939 -4.918 12.471 1.00 1.16 O ATOM 0 H ASP A 186 -0.622 -2.247 9.419 1.00 0.28 H new ATOM 0 HA ASP A 186 -1.475 -2.059 12.247 1.00 0.32 H new ATOM 0 HB2 ASP A 186 -3.502 -2.648 10.665 1.00 0.37 H new ATOM 0 HB3 ASP A 186 -2.686 -4.181 10.431 1.00 0.37 H new ATOM 1894 N SER A 187 0.860 -3.303 11.734 1.00 0.33 N ATOM 1895 CA SER A 187 2.002 -4.263 11.874 1.00 0.34 C ATOM 1896 C SER A 187 1.603 -5.481 12.717 1.00 0.35 C ATOM 1897 O SER A 187 2.322 -6.458 12.774 1.00 0.37 O ATOM 1898 CB SER A 187 3.170 -3.556 12.560 1.00 0.40 C ATOM 1899 OG SER A 187 4.169 -4.510 12.891 1.00 1.32 O ATOM 0 H SER A 187 1.112 -2.322 11.855 1.00 0.33 H new ATOM 0 HA SER A 187 2.286 -4.603 10.878 1.00 0.34 H new ATOM 0 HB2 SER A 187 3.584 -2.792 11.902 1.00 0.40 H new ATOM 0 HB3 SER A 187 2.824 -3.048 13.460 1.00 0.40 H new ATOM 0 HG SER A 187 5.027 -4.054 13.019 1.00 1.32 H new ATOM 1905 N ARG A 188 0.476 -5.445 13.374 1.00 0.40 N ATOM 1906 CA ARG A 188 0.076 -6.619 14.199 1.00 0.46 C ATOM 1907 C ARG A 188 -0.028 -7.848 13.293 1.00 0.42 C ATOM 1908 O ARG A 188 0.302 -8.949 13.682 1.00 0.43 O ATOM 1909 CB ARG A 188 -1.281 -6.354 14.855 1.00 0.58 C ATOM 1910 CG ARG A 188 -1.112 -5.356 16.002 1.00 1.40 C ATOM 1911 CD ARG A 188 -2.466 -5.113 16.673 1.00 1.75 C ATOM 1912 NE ARG A 188 -2.827 -6.301 17.499 1.00 2.37 N ATOM 1913 CZ ARG A 188 -3.791 -6.222 18.376 1.00 2.99 C ATOM 1914 NH1 ARG A 188 -4.461 -5.109 18.513 1.00 3.19 N ATOM 1915 NH2 ARG A 188 -4.090 -7.258 19.112 1.00 3.87 N ATOM 0 H ARG A 188 -0.178 -4.663 13.376 1.00 0.40 H new ATOM 0 HA ARG A 188 0.820 -6.791 14.977 1.00 0.46 H new ATOM 0 HB2 ARG A 188 -1.982 -5.961 14.118 1.00 0.58 H new ATOM 0 HB3 ARG A 188 -1.703 -7.286 15.230 1.00 0.58 H new ATOM 0 HG2 ARG A 188 -0.398 -5.740 16.730 1.00 1.40 H new ATOM 0 HG3 ARG A 188 -0.708 -4.417 15.624 1.00 1.40 H new ATOM 0 HD2 ARG A 188 -2.420 -4.221 17.298 1.00 1.75 H new ATOM 0 HD3 ARG A 188 -3.232 -4.934 15.918 1.00 1.75 H new ATOM 0 HE ARG A 188 -2.319 -7.178 17.379 1.00 2.37 H new ATOM 0 HH11 ARG A 188 -4.231 -4.301 17.935 1.00 3.19 H new ATOM 0 HH12 ARG A 188 -5.214 -5.048 19.198 1.00 3.19 H new ATOM 0 HH21 ARG A 188 -3.571 -8.129 19.002 1.00 3.87 H new ATOM 0 HH22 ARG A 188 -4.843 -7.197 19.797 1.00 3.87 H new ATOM 1929 N LEU A 189 -0.475 -7.662 12.082 1.00 0.43 N ATOM 1930 CA LEU A 189 -0.589 -8.811 11.144 1.00 0.46 C ATOM 1931 C LEU A 189 0.805 -9.388 10.892 1.00 0.41 C ATOM 1932 O LEU A 189 0.968 -10.366 10.189 1.00 0.46 O ATOM 1933 CB LEU A 189 -1.213 -8.328 9.823 1.00 0.57 C ATOM 1934 CG LEU A 189 -1.267 -9.487 8.786 1.00 1.05 C ATOM 1935 CD1 LEU A 189 -2.587 -9.430 8.000 1.00 1.46 C ATOM 1936 CD2 LEU A 189 -0.087 -9.375 7.797 1.00 1.78 C ATOM 0 H LEU A 189 -0.767 -6.762 11.702 1.00 0.43 H new ATOM 0 HA LEU A 189 -1.225 -9.585 11.573 1.00 0.46 H new ATOM 0 HB2 LEU A 189 -2.219 -7.950 10.007 1.00 0.57 H new ATOM 0 HB3 LEU A 189 -0.630 -7.500 9.421 1.00 0.57 H new ATOM 0 HG LEU A 189 -1.201 -10.433 9.324 1.00 1.05 H new ATOM 0 HD11 LEU A 189 -2.615 -10.245 7.277 1.00 1.46 H new ATOM 0 HD12 LEU A 189 -3.426 -9.527 8.690 1.00 1.46 H new ATOM 0 HD13 LEU A 189 -2.657 -8.477 7.476 1.00 1.46 H new ATOM 0 HD21 LEU A 189 -0.137 -10.192 7.077 1.00 1.78 H new ATOM 0 HD22 LEU A 189 -0.143 -8.423 7.270 1.00 1.78 H new ATOM 0 HD23 LEU A 189 0.854 -9.431 8.345 1.00 1.78 H new ATOM 1948 N ALA A 190 1.813 -8.801 11.480 1.00 0.37 N ATOM 1949 CA ALA A 190 3.192 -9.327 11.284 1.00 0.42 C ATOM 1950 C ALA A 190 3.307 -10.657 12.024 1.00 0.44 C ATOM 1951 O ALA A 190 4.363 -11.252 12.099 1.00 0.53 O ATOM 1952 CB ALA A 190 4.208 -8.334 11.854 1.00 0.47 C ATOM 0 H ALA A 190 1.740 -7.983 12.085 1.00 0.37 H new ATOM 0 HA ALA A 190 3.393 -9.467 10.222 1.00 0.42 H new ATOM 0 HB1 ALA A 190 5.216 -8.722 11.709 1.00 0.47 H new ATOM 0 HB2 ALA A 190 4.110 -7.378 11.340 1.00 0.47 H new ATOM 0 HB3 ALA A 190 4.022 -8.195 12.919 1.00 0.47 H new ATOM 1958 N PHE A 191 2.210 -11.124 12.571 1.00 0.42 N ATOM 1959 CA PHE A 191 2.216 -12.424 13.316 1.00 0.51 C ATOM 1960 C PHE A 191 1.030 -13.277 12.859 1.00 0.56 C ATOM 1961 O PHE A 191 1.198 -14.319 12.259 1.00 0.96 O ATOM 1962 CB PHE A 191 2.095 -12.151 14.816 1.00 0.58 C ATOM 1963 CG PHE A 191 3.336 -11.440 15.298 1.00 1.14 C ATOM 1964 CD1 PHE A 191 4.465 -12.178 15.671 1.00 1.81 C ATOM 1965 CD2 PHE A 191 3.357 -10.043 15.371 1.00 1.98 C ATOM 1966 CE1 PHE A 191 5.617 -11.518 16.116 1.00 2.75 C ATOM 1967 CE2 PHE A 191 4.508 -9.382 15.814 1.00 2.87 C ATOM 1968 CZ PHE A 191 5.638 -10.120 16.188 1.00 3.15 C ATOM 0 H PHE A 191 1.304 -10.657 12.533 1.00 0.42 H new ATOM 0 HA PHE A 191 3.147 -12.954 13.115 1.00 0.51 H new ATOM 0 HB2 PHE A 191 1.213 -11.542 15.016 1.00 0.58 H new ATOM 0 HB3 PHE A 191 1.966 -13.088 15.358 1.00 0.58 H new ATOM 0 HD1 PHE A 191 4.448 -13.256 15.616 1.00 1.81 H new ATOM 0 HD2 PHE A 191 2.484 -9.474 15.085 1.00 1.98 H new ATOM 0 HE1 PHE A 191 6.489 -12.087 16.403 1.00 2.75 H new ATOM 0 HE2 PHE A 191 4.525 -8.303 15.867 1.00 2.87 H new ATOM 0 HZ PHE A 191 6.526 -9.610 16.532 1.00 3.15 H new ATOM 1978 N HIS A 192 -0.169 -12.845 13.140 1.00 0.64 N ATOM 1979 CA HIS A 192 -1.363 -13.636 12.721 1.00 0.72 C ATOM 1980 C HIS A 192 -1.564 -13.498 11.211 1.00 0.67 C ATOM 1981 O HIS A 192 -1.714 -12.410 10.690 1.00 1.26 O ATOM 1982 CB HIS A 192 -2.604 -13.117 13.451 1.00 1.01 C ATOM 1983 CG HIS A 192 -3.735 -14.096 13.279 1.00 1.62 C ATOM 1984 ND1 HIS A 192 -4.418 -14.232 12.081 1.00 2.46 N ATOM 1985 CD2 HIS A 192 -4.312 -14.993 14.145 1.00 2.48 C ATOM 1986 CE1 HIS A 192 -5.359 -15.179 12.256 1.00 3.29 C ATOM 1987 NE2 HIS A 192 -5.337 -15.675 13.495 1.00 3.35 N ATOM 0 H HIS A 192 -0.374 -11.980 13.641 1.00 0.64 H new ATOM 0 HA HIS A 192 -1.208 -14.685 12.972 1.00 0.72 H new ATOM 0 HB2 HIS A 192 -2.385 -12.980 14.510 1.00 1.01 H new ATOM 0 HB3 HIS A 192 -2.890 -12.142 13.056 1.00 1.01 H new ATOM 0 HD2 HIS A 192 -4.016 -15.146 15.172 1.00 2.48 H new ATOM 0 HE1 HIS A 192 -6.048 -15.498 11.488 1.00 3.29 H new ATOM 0 HE2 HIS A 192 -5.942 -16.399 13.883 1.00 3.35 H new ATOM 1995 N HIS A 193 -1.565 -14.596 10.501 1.00 0.77 N ATOM 1996 CA HIS A 193 -1.755 -14.538 9.019 1.00 0.85 C ATOM 1997 C HIS A 193 -3.239 -14.706 8.685 1.00 0.74 C ATOM 1998 O HIS A 193 -3.745 -15.808 8.604 1.00 0.78 O ATOM 1999 CB HIS A 193 -0.958 -15.667 8.364 1.00 1.28 C ATOM 2000 CG HIS A 193 -1.294 -16.971 9.032 1.00 2.09 C ATOM 2001 ND1 HIS A 193 -2.326 -17.783 8.590 1.00 2.84 N ATOM 2002 CD2 HIS A 193 -0.743 -17.617 10.111 1.00 2.99 C ATOM 2003 CE1 HIS A 193 -2.365 -18.862 9.392 1.00 3.75 C ATOM 2004 NE2 HIS A 193 -1.422 -18.811 10.337 1.00 3.87 N ATOM 0 H HIS A 193 -1.442 -15.533 10.884 1.00 0.77 H new ATOM 0 HA HIS A 193 -1.406 -13.575 8.645 1.00 0.85 H new ATOM 0 HB2 HIS A 193 -1.190 -15.721 7.300 1.00 1.28 H new ATOM 0 HB3 HIS A 193 0.110 -15.468 8.447 1.00 1.28 H new ATOM 0 HD2 HIS A 193 0.090 -17.254 10.695 1.00 2.99 H new ATOM 0 HE1 HIS A 193 -3.072 -19.671 9.285 1.00 3.75 H new ATOM 0 HE2 HIS A 193 -1.239 -19.499 11.067 1.00 3.87 H new ATOM 2012 N MET A 194 -3.940 -13.623 8.485 1.00 0.73 N ATOM 2013 CA MET A 194 -5.389 -13.722 8.151 1.00 0.79 C ATOM 2014 C MET A 194 -5.545 -14.046 6.664 1.00 0.75 C ATOM 2015 O MET A 194 -6.365 -14.854 6.274 1.00 0.90 O ATOM 2016 CB MET A 194 -6.080 -12.389 8.453 1.00 0.91 C ATOM 2017 CG MET A 194 -5.702 -11.920 9.860 1.00 1.47 C ATOM 2018 SD MET A 194 -6.863 -10.642 10.401 1.00 2.35 S ATOM 2019 CE MET A 194 -8.058 -11.740 11.203 1.00 2.94 C ATOM 0 H MET A 194 -3.571 -12.673 8.539 1.00 0.73 H new ATOM 0 HA MET A 194 -5.845 -14.510 8.750 1.00 0.79 H new ATOM 0 HB2 MET A 194 -5.785 -11.640 7.718 1.00 0.91 H new ATOM 0 HB3 MET A 194 -7.161 -12.503 8.375 1.00 0.91 H new ATOM 0 HG2 MET A 194 -5.721 -12.761 10.553 1.00 1.47 H new ATOM 0 HG3 MET A 194 -4.685 -11.528 9.863 1.00 1.47 H new ATOM 0 HE1 MET A 194 -8.876 -11.149 11.615 1.00 2.94 H new ATOM 0 HE2 MET A 194 -8.453 -12.445 10.471 1.00 2.94 H new ATOM 0 HE3 MET A 194 -7.566 -12.289 12.006 1.00 2.94 H new ATOM 2029 N ALA A 195 -4.766 -13.413 5.833 1.00 0.66 N ATOM 2030 CA ALA A 195 -4.861 -13.666 4.369 1.00 0.76 C ATOM 2031 C ALA A 195 -4.693 -15.160 4.078 1.00 0.90 C ATOM 2032 O ALA A 195 -5.414 -15.732 3.284 1.00 1.11 O ATOM 2033 CB ALA A 195 -3.758 -12.884 3.656 1.00 0.82 C ATOM 0 H ALA A 195 -4.063 -12.727 6.107 1.00 0.66 H new ATOM 0 HA ALA A 195 -5.839 -13.345 4.012 1.00 0.76 H new ATOM 0 HB1 ALA A 195 -3.820 -13.064 2.583 1.00 0.82 H new ATOM 0 HB2 ALA A 195 -3.881 -11.819 3.853 1.00 0.82 H new ATOM 0 HB3 ALA A 195 -2.785 -13.211 4.023 1.00 0.82 H new ATOM 2039 N ARG A 196 -3.742 -15.791 4.704 1.00 0.89 N ATOM 2040 CA ARG A 196 -3.513 -17.244 4.456 1.00 1.09 C ATOM 2041 C ARG A 196 -4.643 -18.070 5.077 1.00 1.21 C ATOM 2042 O ARG A 196 -5.133 -19.010 4.484 1.00 1.44 O ATOM 2043 CB ARG A 196 -2.178 -17.647 5.091 1.00 1.11 C ATOM 2044 CG ARG A 196 -1.853 -19.108 4.765 1.00 1.34 C ATOM 2045 CD ARG A 196 -0.575 -19.508 5.503 1.00 1.43 C ATOM 2046 NE ARG A 196 -0.237 -20.927 5.204 1.00 1.90 N ATOM 2047 CZ ARG A 196 0.956 -21.378 5.477 1.00 2.46 C ATOM 2048 NH1 ARG A 196 1.846 -20.582 6.004 1.00 2.75 N ATOM 2049 NH2 ARG A 196 1.261 -22.622 5.226 1.00 3.31 N ATOM 0 H ARG A 196 -3.109 -15.363 5.380 1.00 0.89 H new ATOM 0 HA ARG A 196 -3.491 -17.431 3.382 1.00 1.09 H new ATOM 0 HB2 ARG A 196 -1.382 -17.000 4.723 1.00 1.11 H new ATOM 0 HB3 ARG A 196 -2.226 -17.510 6.171 1.00 1.11 H new ATOM 0 HG2 ARG A 196 -2.679 -19.754 5.064 1.00 1.34 H new ATOM 0 HG3 ARG A 196 -1.723 -19.234 3.690 1.00 1.34 H new ATOM 0 HD2 ARG A 196 0.247 -18.859 5.202 1.00 1.43 H new ATOM 0 HD3 ARG A 196 -0.709 -19.376 6.577 1.00 1.43 H new ATOM 0 HE ARG A 196 -0.935 -21.543 4.788 1.00 1.90 H new ATOM 0 HH11 ARG A 196 1.608 -19.610 6.201 1.00 2.75 H new ATOM 0 HH12 ARG A 196 2.780 -20.932 6.219 1.00 2.75 H new ATOM 0 HH21 ARG A 196 0.565 -23.245 4.815 1.00 3.31 H new ATOM 0 HH22 ARG A 196 2.195 -22.971 5.441 1.00 3.31 H new ATOM 2063 N GLU A 197 -5.052 -17.741 6.268 1.00 1.18 N ATOM 2064 CA GLU A 197 -6.135 -18.526 6.926 1.00 1.45 C ATOM 2065 C GLU A 197 -7.469 -18.302 6.206 1.00 1.53 C ATOM 2066 O GLU A 197 -8.380 -19.098 6.314 1.00 1.76 O ATOM 2067 CB GLU A 197 -6.256 -18.086 8.389 1.00 1.53 C ATOM 2068 CG GLU A 197 -7.267 -18.975 9.128 1.00 1.99 C ATOM 2069 CD GLU A 197 -8.696 -18.506 8.836 1.00 2.56 C ATOM 2070 OE1 GLU A 197 -8.890 -17.310 8.687 1.00 3.13 O ATOM 2071 OE2 GLU A 197 -9.573 -19.351 8.768 1.00 3.04 O ATOM 0 H GLU A 197 -4.685 -16.963 6.816 1.00 1.18 H new ATOM 0 HA GLU A 197 -5.889 -19.587 6.878 1.00 1.45 H new ATOM 0 HB2 GLU A 197 -5.283 -18.147 8.876 1.00 1.53 H new ATOM 0 HB3 GLU A 197 -6.573 -17.044 8.438 1.00 1.53 H new ATOM 0 HG2 GLU A 197 -7.146 -20.012 8.816 1.00 1.99 H new ATOM 0 HG3 GLU A 197 -7.077 -18.940 10.201 1.00 1.99 H new ATOM 2078 N LEU A 198 -7.599 -17.230 5.474 1.00 1.41 N ATOM 2079 CA LEU A 198 -8.885 -16.973 4.762 1.00 1.56 C ATOM 2080 C LEU A 198 -8.992 -17.874 3.525 1.00 1.70 C ATOM 2081 O LEU A 198 -9.894 -18.681 3.417 1.00 1.95 O ATOM 2082 CB LEU A 198 -8.948 -15.498 4.334 1.00 1.47 C ATOM 2083 CG LEU A 198 -9.352 -14.612 5.531 1.00 1.53 C ATOM 2084 CD1 LEU A 198 -8.887 -13.175 5.284 1.00 1.82 C ATOM 2085 CD2 LEU A 198 -10.879 -14.614 5.713 1.00 1.83 C ATOM 0 H LEU A 198 -6.876 -16.524 5.338 1.00 1.41 H new ATOM 0 HA LEU A 198 -9.715 -17.194 5.433 1.00 1.56 H new ATOM 0 HB2 LEU A 198 -7.978 -15.182 3.949 1.00 1.47 H new ATOM 0 HB3 LEU A 198 -9.667 -15.377 3.524 1.00 1.47 H new ATOM 0 HG LEU A 198 -8.883 -15.011 6.430 1.00 1.53 H new ATOM 0 HD11 LEU A 198 -9.173 -12.550 6.130 1.00 1.82 H new ATOM 0 HD12 LEU A 198 -7.803 -13.158 5.170 1.00 1.82 H new ATOM 0 HD13 LEU A 198 -9.354 -12.793 4.376 1.00 1.82 H new ATOM 0 HD21 LEU A 198 -11.145 -13.984 6.562 1.00 1.83 H new ATOM 0 HD22 LEU A 198 -11.353 -14.227 4.811 1.00 1.83 H new ATOM 0 HD23 LEU A 198 -11.222 -15.632 5.895 1.00 1.83 H new ATOM 2097 N HIS A 199 -8.089 -17.738 2.585 1.00 1.61 N ATOM 2098 CA HIS A 199 -8.155 -18.581 1.347 1.00 1.79 C ATOM 2099 C HIS A 199 -6.741 -18.971 0.899 1.00 1.68 C ATOM 2100 O HIS A 199 -6.190 -18.376 -0.005 1.00 1.85 O ATOM 2101 CB HIS A 199 -8.822 -17.781 0.225 1.00 2.06 C ATOM 2102 CG HIS A 199 -10.209 -17.376 0.642 1.00 2.04 C ATOM 2103 ND1 HIS A 199 -11.178 -18.304 0.990 1.00 2.62 N ATOM 2104 CD2 HIS A 199 -10.807 -16.146 0.763 1.00 2.05 C ATOM 2105 CE1 HIS A 199 -12.296 -17.623 1.302 1.00 2.96 C ATOM 2106 NE2 HIS A 199 -12.124 -16.305 1.181 1.00 2.51 N ATOM 0 H HIS A 199 -7.309 -17.081 2.620 1.00 1.61 H new ATOM 0 HA HIS A 199 -8.730 -19.481 1.563 1.00 1.79 H new ATOM 0 HB2 HIS A 199 -8.229 -16.896 -0.005 1.00 2.06 H new ATOM 0 HB3 HIS A 199 -8.866 -18.380 -0.684 1.00 2.06 H new ATOM 0 HD2 HIS A 199 -10.328 -15.199 0.564 1.00 2.05 H new ATOM 0 HE1 HIS A 199 -13.221 -18.087 1.613 1.00 2.96 H new ATOM 0 HE2 HIS A 199 -12.811 -15.572 1.357 1.00 2.51 H new ATOM 2114 N PRO A 200 -6.162 -19.970 1.516 1.00 1.59 N ATOM 2115 CA PRO A 200 -4.796 -20.448 1.163 1.00 1.65 C ATOM 2116 C PRO A 200 -4.817 -21.446 -0.005 1.00 1.89 C ATOM 2117 O PRO A 200 -3.824 -21.657 -0.674 1.00 2.44 O ATOM 2118 CB PRO A 200 -4.328 -21.129 2.452 1.00 1.85 C ATOM 2119 CG PRO A 200 -5.582 -21.664 3.080 1.00 1.95 C ATOM 2120 CD PRO A 200 -6.737 -20.751 2.624 1.00 1.72 C ATOM 0 HA PRO A 200 -4.144 -19.641 0.830 1.00 1.65 H new ATOM 0 HB2 PRO A 200 -3.619 -21.929 2.241 1.00 1.85 H new ATOM 0 HB3 PRO A 200 -3.825 -20.423 3.112 1.00 1.85 H new ATOM 0 HG2 PRO A 200 -5.759 -22.694 2.771 1.00 1.95 H new ATOM 0 HG3 PRO A 200 -5.498 -21.667 4.167 1.00 1.95 H new ATOM 0 HD2 PRO A 200 -7.599 -21.332 2.297 1.00 1.72 H new ATOM 0 HD3 PRO A 200 -7.077 -20.104 3.433 1.00 1.72 H new ATOM 2128 N GLU A 201 -5.941 -22.064 -0.242 1.00 1.95 N ATOM 2129 CA GLU A 201 -6.039 -23.057 -1.350 1.00 2.41 C ATOM 2130 C GLU A 201 -5.417 -22.493 -2.634 1.00 2.20 C ATOM 2131 O GLU A 201 -5.012 -23.232 -3.508 1.00 2.62 O ATOM 2132 CB GLU A 201 -7.513 -23.383 -1.603 1.00 2.93 C ATOM 2133 CG GLU A 201 -7.621 -24.618 -2.500 1.00 3.65 C ATOM 2134 CD GLU A 201 -9.093 -25.005 -2.661 1.00 4.31 C ATOM 2135 OE1 GLU A 201 -9.641 -25.573 -1.731 1.00 4.86 O ATOM 2136 OE2 GLU A 201 -9.648 -24.725 -3.711 1.00 4.64 O ATOM 0 H GLU A 201 -6.801 -21.923 0.287 1.00 1.95 H new ATOM 0 HA GLU A 201 -5.498 -23.959 -1.065 1.00 2.41 H new ATOM 0 HB2 GLU A 201 -8.023 -23.563 -0.657 1.00 2.93 H new ATOM 0 HB3 GLU A 201 -8.007 -22.534 -2.075 1.00 2.93 H new ATOM 0 HG2 GLU A 201 -7.179 -24.412 -3.475 1.00 3.65 H new ATOM 0 HG3 GLU A 201 -7.062 -25.446 -2.065 1.00 3.65 H new ATOM 2143 N TYR A 202 -5.346 -21.195 -2.765 1.00 1.91 N ATOM 2144 CA TYR A 202 -4.759 -20.609 -4.007 1.00 2.02 C ATOM 2145 C TYR A 202 -3.230 -20.702 -3.962 1.00 2.17 C ATOM 2146 O TYR A 202 -2.598 -21.093 -4.923 1.00 2.63 O ATOM 2147 CB TYR A 202 -5.174 -19.141 -4.132 1.00 2.25 C ATOM 2148 CG TYR A 202 -6.633 -19.059 -4.523 1.00 2.62 C ATOM 2149 CD1 TYR A 202 -7.626 -19.362 -3.584 1.00 2.97 C ATOM 2150 CD2 TYR A 202 -6.993 -18.684 -5.825 1.00 3.00 C ATOM 2151 CE1 TYR A 202 -8.977 -19.291 -3.945 1.00 3.63 C ATOM 2152 CE2 TYR A 202 -8.344 -18.612 -6.184 1.00 3.60 C ATOM 2153 CZ TYR A 202 -9.336 -18.916 -5.245 1.00 3.90 C ATOM 2154 OH TYR A 202 -10.668 -18.848 -5.600 1.00 4.66 O ATOM 0 H TYR A 202 -5.666 -20.519 -2.072 1.00 1.91 H new ATOM 0 HA TYR A 202 -5.127 -21.168 -4.867 1.00 2.02 H new ATOM 0 HB2 TYR A 202 -5.011 -18.624 -3.186 1.00 2.25 H new ATOM 0 HB3 TYR A 202 -4.558 -18.641 -4.879 1.00 2.25 H new ATOM 0 HD1 TYR A 202 -7.350 -19.651 -2.581 1.00 2.97 H new ATOM 0 HD2 TYR A 202 -6.228 -18.451 -6.551 1.00 3.00 H new ATOM 0 HE1 TYR A 202 -9.742 -19.526 -3.220 1.00 3.63 H new ATOM 0 HE2 TYR A 202 -8.621 -18.322 -7.187 1.00 3.60 H new ATOM 0 HH TYR A 202 -10.743 -18.571 -6.537 1.00 4.66 H new ATOM 2164 N PHE A 203 -2.627 -20.345 -2.858 1.00 2.24 N ATOM 2165 CA PHE A 203 -1.135 -20.411 -2.760 1.00 2.91 C ATOM 2166 C PHE A 203 -0.717 -21.762 -2.168 1.00 3.51 C ATOM 2167 O PHE A 203 -1.457 -22.383 -1.432 1.00 4.00 O ATOM 2168 CB PHE A 203 -0.637 -19.274 -1.862 1.00 3.09 C ATOM 2169 CG PHE A 203 -1.444 -18.028 -2.139 1.00 2.66 C ATOM 2170 CD1 PHE A 203 -2.660 -17.829 -1.479 1.00 2.55 C ATOM 2171 CD2 PHE A 203 -0.980 -17.074 -3.054 1.00 2.71 C ATOM 2172 CE1 PHE A 203 -3.415 -16.680 -1.729 1.00 2.24 C ATOM 2173 CE2 PHE A 203 -1.736 -15.922 -3.306 1.00 2.44 C ATOM 2174 CZ PHE A 203 -2.954 -15.725 -2.642 1.00 2.05 C ATOM 0 H PHE A 203 -3.101 -20.010 -2.019 1.00 2.24 H new ATOM 0 HA PHE A 203 -0.698 -20.307 -3.753 1.00 2.91 H new ATOM 0 HB2 PHE A 203 -0.731 -19.556 -0.813 1.00 3.09 H new ATOM 0 HB3 PHE A 203 0.420 -19.085 -2.048 1.00 3.09 H new ATOM 0 HD1 PHE A 203 -3.017 -18.565 -0.774 1.00 2.55 H new ATOM 0 HD2 PHE A 203 -0.041 -17.227 -3.564 1.00 2.71 H new ATOM 0 HE1 PHE A 203 -4.354 -16.529 -1.218 1.00 2.24 H new ATOM 0 HE2 PHE A 203 -1.380 -15.186 -4.012 1.00 2.44 H new ATOM 0 HZ PHE A 203 -3.537 -14.836 -2.835 1.00 2.05 H new ATOM 2184 N LYS A 204 0.465 -22.219 -2.484 1.00 3.84 N ATOM 2185 CA LYS A 204 0.928 -23.527 -1.938 1.00 4.59 C ATOM 2186 C LYS A 204 1.335 -23.348 -0.471 1.00 5.09 C ATOM 2187 O LYS A 204 1.365 -22.247 0.043 1.00 5.47 O ATOM 2188 CB LYS A 204 2.128 -24.025 -2.749 1.00 5.01 C ATOM 2189 CG LYS A 204 1.710 -24.224 -4.209 1.00 5.49 C ATOM 2190 CD LYS A 204 2.869 -24.841 -4.997 1.00 6.17 C ATOM 2191 CE LYS A 204 2.407 -25.152 -6.422 1.00 6.89 C ATOM 2192 NZ LYS A 204 2.232 -23.879 -7.177 1.00 7.32 N ATOM 0 H LYS A 204 1.129 -21.744 -3.096 1.00 3.84 H new ATOM 0 HA LYS A 204 0.122 -24.257 -2.005 1.00 4.59 H new ATOM 0 HB2 LYS A 204 2.945 -23.306 -2.688 1.00 5.01 H new ATOM 0 HB3 LYS A 204 2.497 -24.963 -2.334 1.00 5.01 H new ATOM 0 HG2 LYS A 204 0.835 -24.872 -4.262 1.00 5.49 H new ATOM 0 HG3 LYS A 204 1.426 -23.268 -4.650 1.00 5.49 H new ATOM 0 HD2 LYS A 204 3.715 -24.154 -5.019 1.00 6.17 H new ATOM 0 HD3 LYS A 204 3.212 -25.752 -4.507 1.00 6.17 H new ATOM 0 HE2 LYS A 204 3.139 -25.786 -6.922 1.00 6.89 H new ATOM 0 HE3 LYS A 204 1.468 -25.705 -6.399 1.00 6.89 H new ATOM 0 HZ1 LYS A 204 2.101 -24.090 -8.187 1.00 7.32 H new ATOM 0 HZ2 LYS A 204 1.397 -23.374 -6.818 1.00 7.32 H new ATOM 0 HZ3 LYS A 204 3.076 -23.284 -7.054 1.00 7.32 H new ATOM 2206 N ASN A 205 1.640 -24.421 0.209 1.00 5.49 N ATOM 2207 CA ASN A 205 2.036 -24.309 1.643 1.00 6.31 C ATOM 2208 C ASN A 205 3.515 -23.932 1.750 1.00 6.66 C ATOM 2209 O ASN A 205 4.085 -23.920 2.823 1.00 6.90 O ATOM 2210 CB ASN A 205 1.806 -25.651 2.342 1.00 6.97 C ATOM 2211 CG ASN A 205 2.393 -26.778 1.490 1.00 7.47 C ATOM 2212 OD1 ASN A 205 3.586 -27.010 1.506 1.00 7.58 O ATOM 2213 ND2 ASN A 205 1.599 -27.493 0.742 1.00 8.08 N ATOM 0 H ASN A 205 1.632 -25.369 -0.166 1.00 5.49 H new ATOM 0 HA ASN A 205 1.432 -23.536 2.119 1.00 6.31 H new ATOM 0 HB2 ASN A 205 2.273 -25.645 3.327 1.00 6.97 H new ATOM 0 HB3 ASN A 205 0.739 -25.815 2.496 1.00 6.97 H new ATOM 0 HD21 ASN A 205 1.979 -28.247 0.170 1.00 8.08 H new ATOM 0 HD22 ASN A 205 0.598 -27.298 0.729 1.00 8.08 H new ATOM 2220 N ALA A 206 4.145 -23.622 0.650 1.00 7.01 N ATOM 2221 CA ALA A 206 5.588 -23.246 0.700 1.00 7.67 C ATOM 2222 C ALA A 206 5.716 -21.774 1.099 1.00 7.99 C ATOM 2223 O ALA A 206 6.822 -21.358 1.404 1.00 8.32 O ATOM 2224 CB ALA A 206 6.219 -23.457 -0.678 1.00 8.33 C ATOM 2225 OXT ALA A 206 4.707 -21.090 1.096 1.00 8.16 O ATOM 0 H ALA A 206 3.725 -23.613 -0.279 1.00 7.01 H new ATOM 0 HA ALA A 206 6.101 -23.869 1.433 1.00 7.67 H new ATOM 0 HB1 ALA A 206 7.273 -23.182 -0.641 1.00 8.33 H new ATOM 0 HB2 ALA A 206 6.127 -24.505 -0.964 1.00 8.33 H new ATOM 0 HB3 ALA A 206 5.707 -22.834 -1.412 1.00 8.33 H new TER 2231 ALA A 206