USER MOD reduce.3.24.130724 H: found=0, std=0, add=705, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 706 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 152 HIS : no HE2:sc= -13.8! C(o=-19!,f=-24!) USER MOD Set 1.2: A 153 ASN :FLIP amide:sc= -4.27! C(o=-21!,f=-19!) USER MOD Set 1.3: A 157 HIS :FLIP no HE2:sc= -0.954 F(o=-21,f=-19) USER MOD Set 2.1: A 140 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 142 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 100 GLN : amide:sc= 0.102 X(o=-0.52,f=-0.72) USER MOD Set 3.2: A 108 GLN :FLIP amide:sc= -0.62 F(o=-2.1!,f=-0.52) USER MOD Single : A 92 SER OG : rot -45:sc= 0.0256 USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 99 ASN :FLIP amide:sc= -0.691 F(o=-6.1!,f=-0.69) USER MOD Single : A 101 SER OG : rot 180:sc=-0.00901 USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 170:sc= 0 USER MOD Single : A 112 SER OG : rot 85:sc= 1.19 USER MOD Single : A 116 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0755) USER MOD Single : A 119 THR OG1 : rot 180:sc= -0.133 USER MOD Single : A 122 GLN : amide:sc= -0.101 X(o=-0.1,f=-0.4) USER MOD Single : A 124 TYR OH : rot 15:sc=-0.00514 USER MOD Single : A 127 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 130 THR OG1 : rot 86:sc= 1.09 USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ 158:sc= -0.0654 (180deg=-0.555) USER MOD Single : A 137 LYS NZ :NH3+ -159:sc= -0.0641 (180deg=-0.547) USER MOD Single : A 141 ASN : amide:sc= -2.75! C(o=-2.7!,f=-10!) USER MOD Single : A 143 SER OG : rot 180:sc= 0.0384 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 ASN : amide:sc= -0.0786 K(o=-0.079,f=-2.3!) USER MOD Single : A 149 SER OG : rot -58:sc= 0.508 USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : A 158 SER OG : rot 180:sc= 0 USER MOD Single : A 159 LYS NZ :NH3+ 133:sc= -0.145 (180deg=-1.08) USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 HIS : no HD1:sc= -1.17! C(o=-1.2!,f=-4.2!) USER MOD Single : A 165 ASN : amide:sc= -5.05! C(o=-5.1!,f=-18!) USER MOD Single : A 168 THR OG1 : rot 180:sc= 0 USER MOD Single : A 170 LYS NZ :NH3+ 170:sc= 0.00299 (180deg=-0.0552) USER MOD Single : A 171 SER OG : rot 170:sc= -0.034 USER MOD Single : A 172 SER OG : rot -140:sc= 0 USER MOD Single : A 175 MET CE :methyl -128:sc= -0.0783 (180deg=-0.535) USER MOD Single : A 177 ASN : amide:sc= -1.07 X(o=-1.1,f=-1.5) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 92 -17.650 16.471 1.729 1.00 0.00 N ATOM 2 CA SER A 92 -17.208 15.430 0.758 1.00 0.00 C ATOM 3 C SER A 92 -15.748 15.677 0.371 1.00 0.00 C ATOM 4 O SER A 92 -14.942 14.766 0.338 1.00 0.00 O ATOM 5 CB SER A 92 -18.087 15.498 -0.493 1.00 0.00 C ATOM 6 OG SER A 92 -17.985 16.797 -1.066 1.00 0.00 O ATOM 0 HA SER A 92 -17.299 14.444 1.215 1.00 0.00 H new ATOM 0 HB2 SER A 92 -17.773 14.744 -1.214 1.00 0.00 H new ATOM 0 HB3 SER A 92 -19.124 15.281 -0.236 1.00 0.00 H new ATOM 0 HG SER A 92 -18.056 17.473 -0.360 1.00 0.00 H new ATOM 12 N ARG A 93 -15.401 16.902 0.081 1.00 0.00 N ATOM 13 CA ARG A 93 -13.991 17.207 -0.303 1.00 0.00 C ATOM 14 C ARG A 93 -13.049 16.807 0.826 1.00 0.00 C ATOM 15 O ARG A 93 -13.384 16.898 1.989 1.00 0.00 O ATOM 16 CB ARG A 93 -13.826 18.707 -0.559 1.00 0.00 C ATOM 17 CG ARG A 93 -14.554 19.103 -1.846 1.00 0.00 C ATOM 18 CD ARG A 93 -14.246 20.567 -2.172 1.00 0.00 C ATOM 19 NE ARG A 93 -15.302 21.126 -3.075 1.00 0.00 N ATOM 20 CZ ARG A 93 -15.691 20.488 -4.150 1.00 0.00 C ATOM 21 NH1 ARG A 93 -15.086 19.395 -4.529 1.00 0.00 N ATOM 22 NH2 ARG A 93 -16.669 20.970 -4.869 1.00 0.00 N ATOM 0 H ARG A 93 -16.031 17.704 0.093 1.00 0.00 H new ATOM 0 HA ARG A 93 -13.753 16.648 -1.208 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -14.224 19.274 0.283 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -12.768 18.956 -0.639 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -14.238 18.461 -2.668 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -15.628 18.963 -1.727 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -14.197 21.150 -1.252 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -13.270 20.644 -2.650 1.00 0.00 H new ATOM 0 HE ARG A 93 -15.728 22.024 -2.847 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -14.303 19.031 -3.986 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -15.396 18.905 -5.368 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -17.125 21.839 -4.592 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -16.976 20.477 -5.708 1.00 0.00 H new ATOM 36 N ARG A 94 -11.864 16.382 0.487 1.00 0.00 N ATOM 37 CA ARG A 94 -10.875 15.990 1.529 1.00 0.00 C ATOM 38 C ARG A 94 -9.768 17.042 1.573 1.00 0.00 C ATOM 39 O ARG A 94 -9.584 17.801 0.645 1.00 0.00 O ATOM 40 CB ARG A 94 -10.280 14.629 1.176 1.00 0.00 C ATOM 41 CG ARG A 94 -11.399 13.687 0.730 1.00 0.00 C ATOM 42 CD ARG A 94 -12.437 13.550 1.845 1.00 0.00 C ATOM 43 NE ARG A 94 -13.345 12.411 1.545 1.00 0.00 N ATOM 44 CZ ARG A 94 -14.050 11.867 2.497 1.00 0.00 C ATOM 45 NH1 ARG A 94 -13.919 12.284 3.726 1.00 0.00 N ATOM 46 NH2 ARG A 94 -14.874 10.898 2.217 1.00 0.00 N ATOM 0 H ARG A 94 -11.536 16.289 -0.474 1.00 0.00 H new ATOM 0 HA ARG A 94 -11.361 15.925 2.503 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -9.542 14.737 0.381 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -9.760 14.212 2.039 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -11.872 14.071 -0.174 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -10.986 12.709 0.483 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -11.939 13.389 2.801 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -13.011 14.472 1.936 1.00 0.00 H new ATOM 0 HE ARG A 94 -13.416 12.055 0.592 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -13.265 13.036 3.942 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -14.471 11.858 4.471 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -14.966 10.568 1.256 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -15.428 10.469 2.959 1.00 0.00 H new ATOM 60 N ASN A 95 -9.042 17.098 2.651 1.00 0.00 N ATOM 61 CA ASN A 95 -7.951 18.103 2.768 1.00 0.00 C ATOM 62 C ASN A 95 -6.849 17.809 1.749 1.00 0.00 C ATOM 63 O ASN A 95 -6.278 18.707 1.163 1.00 0.00 O ATOM 64 CB ASN A 95 -7.361 18.038 4.175 1.00 0.00 C ATOM 65 CG ASN A 95 -6.249 19.081 4.316 1.00 0.00 C ATOM 66 OD1 ASN A 95 -6.402 20.211 3.897 1.00 0.00 O ATOM 67 ND2 ASN A 95 -5.127 18.744 4.889 1.00 0.00 N ATOM 0 H ASN A 95 -9.157 16.488 3.461 1.00 0.00 H new ATOM 0 HA ASN A 95 -8.358 19.096 2.576 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -8.140 18.220 4.915 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -6.965 17.041 4.368 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -4.378 19.429 4.985 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -4.999 17.795 5.241 1.00 0.00 H new ATOM 74 N ALA A 96 -6.531 16.558 1.547 1.00 0.00 N ATOM 75 CA ALA A 96 -5.448 16.213 0.581 1.00 0.00 C ATOM 76 C ALA A 96 -5.832 14.969 -0.223 1.00 0.00 C ATOM 77 O ALA A 96 -6.941 14.837 -0.700 1.00 0.00 O ATOM 78 CB ALA A 96 -4.157 15.933 1.354 1.00 0.00 C ATOM 0 H ALA A 96 -6.973 15.762 2.008 1.00 0.00 H new ATOM 0 HA ALA A 96 -5.302 17.048 -0.104 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.361 15.680 0.654 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -3.873 16.819 1.921 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -4.316 15.100 2.039 1.00 0.00 H new ATOM 84 N TRP A 97 -4.908 14.057 -0.373 1.00 0.00 N ATOM 85 CA TRP A 97 -5.186 12.813 -1.142 1.00 0.00 C ATOM 86 C TRP A 97 -6.494 12.198 -0.660 1.00 0.00 C ATOM 87 O TRP A 97 -7.236 11.609 -1.422 1.00 0.00 O ATOM 88 CB TRP A 97 -4.051 11.817 -0.913 1.00 0.00 C ATOM 89 CG TRP A 97 -4.033 11.402 0.523 1.00 0.00 C ATOM 90 CD1 TRP A 97 -4.870 10.496 1.083 1.00 0.00 C ATOM 91 CD2 TRP A 97 -3.146 11.853 1.590 1.00 0.00 C ATOM 92 NE1 TRP A 97 -4.552 10.359 2.423 1.00 0.00 N ATOM 93 CE2 TRP A 97 -3.496 11.176 2.784 1.00 0.00 C ATOM 94 CE3 TRP A 97 -2.086 12.771 1.638 1.00 0.00 C ATOM 95 CZ2 TRP A 97 -2.815 11.404 3.981 1.00 0.00 C ATOM 96 CZ3 TRP A 97 -1.398 13.004 2.839 1.00 0.00 C ATOM 97 CH2 TRP A 97 -1.762 12.321 4.010 1.00 0.00 C ATOM 0 H TRP A 97 -3.964 14.123 0.009 1.00 0.00 H new ATOM 0 HA TRP A 97 -5.263 13.051 -2.203 1.00 0.00 H new ATOM 0 HB2 TRP A 97 -4.184 10.945 -1.553 1.00 0.00 H new ATOM 0 HB3 TRP A 97 -3.097 12.269 -1.184 1.00 0.00 H new ATOM 0 HD1 TRP A 97 -5.658 9.967 0.568 1.00 0.00 H new ATOM 0 HE1 TRP A 97 -5.037 9.732 3.065 1.00 0.00 H new ATOM 0 HE3 TRP A 97 -1.797 13.303 0.743 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 -3.100 10.875 4.878 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 -0.584 13.713 2.862 1.00 0.00 H new ATOM 0 HH2 TRP A 97 -1.229 12.504 4.931 1.00 0.00 H new ATOM 108 N GLY A 98 -6.783 12.329 0.600 1.00 0.00 N ATOM 109 CA GLY A 98 -8.040 11.752 1.134 1.00 0.00 C ATOM 110 C GLY A 98 -8.005 11.804 2.655 1.00 0.00 C ATOM 111 O GLY A 98 -7.019 11.460 3.275 1.00 0.00 O ATOM 0 H GLY A 98 -6.201 12.812 1.284 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -8.899 12.309 0.758 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -8.155 10.722 0.795 1.00 0.00 H new ATOM 115 N ASN A 99 -9.072 12.226 3.272 1.00 0.00 N ATOM 116 CA ASN A 99 -9.077 12.281 4.756 1.00 0.00 C ATOM 117 C ASN A 99 -8.989 10.854 5.292 1.00 0.00 C ATOM 118 O ASN A 99 -8.978 10.622 6.481 1.00 0.00 O ATOM 119 CB ASN A 99 -10.363 12.945 5.250 1.00 0.00 C ATOM 120 CG ASN A 99 -10.334 14.432 4.898 1.00 0.00 C ATOM 121 OD1 ASN A 99 -9.183 15.037 4.777 1.00 0.00 O flip ATOM 122 ND2 ASN A 99 -11.365 15.051 4.732 1.00 0.00 N flip ATOM 0 H ASN A 99 -9.932 12.532 2.817 1.00 0.00 H new ATOM 0 HA ASN A 99 -8.228 12.866 5.110 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -11.230 12.469 4.793 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -10.461 12.817 6.328 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -12.264 14.579 4.826 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -11.332 16.043 4.498 1.00 0.00 H new ATOM 129 N GLN A 100 -8.928 9.896 4.407 1.00 0.00 N ATOM 130 CA GLN A 100 -8.842 8.477 4.837 1.00 0.00 C ATOM 131 C GLN A 100 -7.540 8.240 5.603 1.00 0.00 C ATOM 132 O GLN A 100 -6.547 8.913 5.396 1.00 0.00 O ATOM 133 CB GLN A 100 -8.875 7.574 3.605 1.00 0.00 C ATOM 134 CG GLN A 100 -10.113 7.909 2.774 1.00 0.00 C ATOM 135 CD GLN A 100 -10.252 6.902 1.635 1.00 0.00 C ATOM 136 OE1 GLN A 100 -11.083 6.016 1.689 1.00 0.00 O ATOM 137 NE2 GLN A 100 -9.468 7.001 0.599 1.00 0.00 N ATOM 0 H GLN A 100 -8.934 10.040 3.397 1.00 0.00 H new ATOM 0 HA GLN A 100 -9.686 8.248 5.488 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -7.973 7.716 3.010 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -8.896 6.527 3.907 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -11.003 7.887 3.403 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -10.032 8.919 2.372 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -8.772 7.745 0.556 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -9.551 6.335 -0.169 1.00 0.00 H new ATOM 146 N SER A 101 -7.545 7.286 6.492 1.00 0.00 N ATOM 147 CA SER A 101 -6.320 6.987 7.288 1.00 0.00 C ATOM 148 C SER A 101 -5.308 6.233 6.419 1.00 0.00 C ATOM 149 O SER A 101 -5.622 5.775 5.339 1.00 0.00 O ATOM 150 CB SER A 101 -6.703 6.122 8.487 1.00 0.00 C ATOM 151 OG SER A 101 -7.220 4.883 8.021 1.00 0.00 O ATOM 0 H SER A 101 -8.350 6.696 6.703 1.00 0.00 H new ATOM 0 HA SER A 101 -5.872 7.920 7.631 1.00 0.00 H new ATOM 0 HB2 SER A 101 -5.833 5.952 9.121 1.00 0.00 H new ATOM 0 HB3 SER A 101 -7.447 6.634 9.098 1.00 0.00 H new ATOM 0 HG SER A 101 -7.466 4.323 8.786 1.00 0.00 H new ATOM 157 N TYR A 102 -4.094 6.105 6.882 1.00 0.00 N ATOM 158 CA TYR A 102 -3.057 5.383 6.086 1.00 0.00 C ATOM 159 C TYR A 102 -3.453 3.911 5.917 1.00 0.00 C ATOM 160 O TYR A 102 -3.251 3.318 4.875 1.00 0.00 O ATOM 161 CB TYR A 102 -1.716 5.439 6.828 1.00 0.00 C ATOM 162 CG TYR A 102 -1.067 6.790 6.647 1.00 0.00 C ATOM 163 CD1 TYR A 102 -0.612 7.185 5.384 1.00 0.00 C ATOM 164 CD2 TYR A 102 -0.907 7.647 7.747 1.00 0.00 C ATOM 165 CE1 TYR A 102 0.004 8.432 5.218 1.00 0.00 C ATOM 166 CE2 TYR A 102 -0.294 8.896 7.581 1.00 0.00 C ATOM 167 CZ TYR A 102 0.160 9.288 6.316 1.00 0.00 C ATOM 168 OH TYR A 102 0.769 10.517 6.153 1.00 0.00 O ATOM 0 H TYR A 102 -3.774 6.470 7.779 1.00 0.00 H new ATOM 0 HA TYR A 102 -2.973 5.857 5.108 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -1.872 5.243 7.889 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -1.054 4.658 6.454 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -0.736 6.528 4.536 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -1.257 7.343 8.723 1.00 0.00 H new ATOM 0 HE1 TYR A 102 0.359 8.734 4.244 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -0.172 9.555 8.428 1.00 0.00 H new ATOM 0 HH TYR A 102 0.796 10.986 7.013 1.00 0.00 H new ATOM 178 N ALA A 103 -3.981 3.310 6.948 1.00 0.00 N ATOM 179 CA ALA A 103 -4.355 1.865 6.873 1.00 0.00 C ATOM 180 C ALA A 103 -5.341 1.589 5.727 1.00 0.00 C ATOM 181 O ALA A 103 -5.162 0.661 4.967 1.00 0.00 O ATOM 182 CB ALA A 103 -4.988 1.441 8.199 1.00 0.00 C ATOM 0 H ALA A 103 -4.171 3.758 7.844 1.00 0.00 H new ATOM 0 HA ALA A 103 -3.449 1.291 6.680 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -5.263 0.387 8.150 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -4.274 1.593 9.008 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -5.879 2.040 8.385 1.00 0.00 H new ATOM 188 N GLU A 104 -6.387 2.364 5.607 1.00 0.00 N ATOM 189 CA GLU A 104 -7.378 2.101 4.517 1.00 0.00 C ATOM 190 C GLU A 104 -6.731 2.273 3.142 1.00 0.00 C ATOM 191 O GLU A 104 -7.001 1.524 2.226 1.00 0.00 O ATOM 192 CB GLU A 104 -8.551 3.084 4.622 1.00 0.00 C ATOM 193 CG GLU A 104 -9.284 2.890 5.949 1.00 0.00 C ATOM 194 CD GLU A 104 -10.563 3.734 5.950 1.00 0.00 C ATOM 195 OE1 GLU A 104 -10.477 4.908 6.271 1.00 0.00 O ATOM 196 OE2 GLU A 104 -11.606 3.195 5.615 1.00 0.00 O ATOM 0 H GLU A 104 -6.599 3.160 6.209 1.00 0.00 H new ATOM 0 HA GLU A 104 -7.732 1.076 4.630 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -8.185 4.108 4.547 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -9.240 2.930 3.792 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -9.529 1.838 6.092 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -8.641 3.183 6.779 1.00 0.00 H new ATOM 203 N LEU A 105 -5.893 3.259 2.982 1.00 0.00 N ATOM 204 CA LEU A 105 -5.264 3.481 1.650 1.00 0.00 C ATOM 205 C LEU A 105 -4.449 2.252 1.233 1.00 0.00 C ATOM 206 O LEU A 105 -4.465 1.857 0.086 1.00 0.00 O ATOM 207 CB LEU A 105 -4.353 4.707 1.714 1.00 0.00 C ATOM 208 CG LEU A 105 -5.206 5.958 1.971 1.00 0.00 C ATOM 209 CD1 LEU A 105 -4.293 7.141 2.312 1.00 0.00 C ATOM 210 CD2 LEU A 105 -6.045 6.293 0.722 1.00 0.00 C ATOM 0 H LEU A 105 -5.618 3.917 3.711 1.00 0.00 H new ATOM 0 HA LEU A 105 -6.049 3.647 0.912 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -3.616 4.586 2.508 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -3.801 4.814 0.780 1.00 0.00 H new ATOM 0 HG LEU A 105 -5.878 5.765 2.807 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -4.900 8.028 2.494 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -3.714 6.908 3.205 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.615 7.330 1.479 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -6.646 7.182 0.915 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -5.382 6.480 -0.122 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -6.701 5.455 0.489 1.00 0.00 H new ATOM 222 N ILE A 106 -3.747 1.636 2.143 1.00 0.00 N ATOM 223 CA ILE A 106 -2.950 0.438 1.763 1.00 0.00 C ATOM 224 C ILE A 106 -3.885 -0.622 1.187 1.00 0.00 C ATOM 225 O ILE A 106 -3.582 -1.267 0.200 1.00 0.00 O ATOM 226 CB ILE A 106 -2.249 -0.123 3.000 1.00 0.00 C ATOM 227 CG1 ILE A 106 -1.307 0.939 3.574 1.00 0.00 C ATOM 228 CG2 ILE A 106 -1.446 -1.365 2.614 1.00 0.00 C ATOM 229 CD1 ILE A 106 -0.874 0.541 4.986 1.00 0.00 C ATOM 0 H ILE A 106 -3.691 1.907 3.125 1.00 0.00 H new ATOM 0 HA ILE A 106 -2.203 0.716 1.019 1.00 0.00 H new ATOM 0 HB ILE A 106 -2.993 -0.394 3.749 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -0.432 1.047 2.933 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -1.807 1.907 3.597 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -0.947 -1.764 3.497 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -2.118 -2.120 2.205 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -0.700 -1.098 1.865 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -0.204 1.301 5.389 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -1.753 0.456 5.626 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -0.356 -0.418 4.951 1.00 0.00 H new ATOM 241 N SER A 107 -5.016 -0.813 1.803 1.00 0.00 N ATOM 242 CA SER A 107 -5.974 -1.837 1.302 1.00 0.00 C ATOM 243 C SER A 107 -6.393 -1.530 -0.137 1.00 0.00 C ATOM 244 O SER A 107 -6.516 -2.417 -0.955 1.00 0.00 O ATOM 245 CB SER A 107 -7.217 -1.848 2.187 1.00 0.00 C ATOM 246 OG SER A 107 -6.874 -2.340 3.478 1.00 0.00 O ATOM 0 H SER A 107 -5.320 -0.304 2.633 1.00 0.00 H new ATOM 0 HA SER A 107 -5.483 -2.810 1.329 1.00 0.00 H new ATOM 0 HB2 SER A 107 -7.629 -0.842 2.267 1.00 0.00 H new ATOM 0 HB3 SER A 107 -7.989 -2.474 1.740 1.00 0.00 H new ATOM 0 HG SER A 107 -7.625 -2.198 4.092 1.00 0.00 H new ATOM 252 N GLN A 108 -6.636 -0.288 -0.449 1.00 0.00 N ATOM 253 CA GLN A 108 -7.082 0.054 -1.833 1.00 0.00 C ATOM 254 C GLN A 108 -6.046 -0.413 -2.860 1.00 0.00 C ATOM 255 O GLN A 108 -6.388 -0.895 -3.920 1.00 0.00 O ATOM 256 CB GLN A 108 -7.272 1.569 -1.951 1.00 0.00 C ATOM 257 CG GLN A 108 -8.379 2.021 -0.994 1.00 0.00 C ATOM 258 CD GLN A 108 -8.806 3.452 -1.340 1.00 0.00 C ATOM 259 OE1 GLN A 108 -8.459 4.433 -0.554 1.00 0.00 O flip ATOM 260 NE2 GLN A 108 -9.463 3.678 -2.336 1.00 0.00 N flip ATOM 0 H GLN A 108 -6.546 0.503 0.189 1.00 0.00 H new ATOM 0 HA GLN A 108 -8.027 -0.452 -2.032 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -6.340 2.083 -1.715 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -7.531 1.835 -2.976 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -9.233 1.348 -1.067 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -8.024 1.976 0.036 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -9.735 2.912 -2.952 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -9.742 4.634 -2.557 1.00 0.00 H new ATOM 269 N ALA A 109 -4.787 -0.268 -2.560 1.00 0.00 N ATOM 270 CA ALA A 109 -3.735 -0.699 -3.525 1.00 0.00 C ATOM 271 C ALA A 109 -3.877 -2.198 -3.832 1.00 0.00 C ATOM 272 O ALA A 109 -3.931 -2.597 -4.979 1.00 0.00 O ATOM 273 CB ALA A 109 -2.357 -0.424 -2.915 1.00 0.00 C ATOM 0 H ALA A 109 -4.439 0.130 -1.688 1.00 0.00 H new ATOM 0 HA ALA A 109 -3.847 -0.141 -4.455 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -1.581 -0.736 -3.614 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -2.255 0.642 -2.712 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -2.253 -0.982 -1.984 1.00 0.00 H new ATOM 279 N ILE A 110 -3.935 -3.035 -2.824 1.00 0.00 N ATOM 280 CA ILE A 110 -4.061 -4.501 -3.090 1.00 0.00 C ATOM 281 C ILE A 110 -5.367 -4.774 -3.841 1.00 0.00 C ATOM 282 O ILE A 110 -5.399 -5.547 -4.777 1.00 0.00 O ATOM 283 CB ILE A 110 -4.046 -5.282 -1.767 1.00 0.00 C ATOM 284 CG1 ILE A 110 -2.634 -5.219 -1.159 1.00 0.00 C ATOM 285 CG2 ILE A 110 -4.430 -6.739 -2.038 1.00 0.00 C ATOM 286 CD1 ILE A 110 -2.579 -6.001 0.160 1.00 0.00 C ATOM 0 H ILE A 110 -3.901 -2.770 -1.840 1.00 0.00 H new ATOM 0 HA ILE A 110 -3.218 -4.827 -3.699 1.00 0.00 H new ATOM 0 HB ILE A 110 -4.760 -4.845 -1.069 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -1.910 -5.631 -1.863 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -2.353 -4.180 -0.984 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -4.421 -7.298 -1.102 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -5.428 -6.777 -2.474 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -3.714 -7.181 -2.731 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -1.573 -5.945 0.575 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -3.288 -5.571 0.868 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -2.838 -7.044 -0.024 1.00 0.00 H new ATOM 298 N GLU A 111 -6.438 -4.144 -3.444 1.00 0.00 N ATOM 299 CA GLU A 111 -7.739 -4.361 -4.138 1.00 0.00 C ATOM 300 C GLU A 111 -7.604 -3.964 -5.612 1.00 0.00 C ATOM 301 O GLU A 111 -8.351 -4.416 -6.460 1.00 0.00 O ATOM 302 CB GLU A 111 -8.812 -3.490 -3.478 1.00 0.00 C ATOM 303 CG GLU A 111 -9.032 -3.946 -2.036 1.00 0.00 C ATOM 304 CD GLU A 111 -10.013 -2.995 -1.346 1.00 0.00 C ATOM 305 OE1 GLU A 111 -10.480 -2.077 -2.003 1.00 0.00 O ATOM 306 OE2 GLU A 111 -10.281 -3.200 -0.175 1.00 0.00 O ATOM 0 H GLU A 111 -6.468 -3.486 -2.666 1.00 0.00 H new ATOM 0 HA GLU A 111 -8.020 -5.412 -4.068 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -8.506 -2.444 -3.496 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -9.745 -3.559 -4.038 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -9.423 -4.963 -2.020 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -8.084 -3.960 -1.499 1.00 0.00 H new ATOM 313 N SER A 112 -6.667 -3.109 -5.922 1.00 0.00 N ATOM 314 CA SER A 112 -6.493 -2.664 -7.335 1.00 0.00 C ATOM 315 C SER A 112 -5.811 -3.761 -8.163 1.00 0.00 C ATOM 316 O SER A 112 -6.144 -3.974 -9.312 1.00 0.00 O ATOM 317 CB SER A 112 -5.636 -1.397 -7.366 1.00 0.00 C ATOM 318 OG SER A 112 -6.166 -0.449 -6.447 1.00 0.00 O ATOM 0 H SER A 112 -6.013 -2.698 -5.256 1.00 0.00 H new ATOM 0 HA SER A 112 -7.474 -2.459 -7.763 1.00 0.00 H new ATOM 0 HB2 SER A 112 -4.605 -1.635 -7.106 1.00 0.00 H new ATOM 0 HB3 SER A 112 -5.623 -0.978 -8.372 1.00 0.00 H new ATOM 0 HG SER A 112 -5.812 -0.629 -5.551 1.00 0.00 H new ATOM 324 N ALA A 113 -4.862 -4.459 -7.600 1.00 0.00 N ATOM 325 CA ALA A 113 -4.170 -5.531 -8.377 1.00 0.00 C ATOM 326 C ALA A 113 -5.146 -6.690 -8.635 1.00 0.00 C ATOM 327 O ALA A 113 -6.136 -6.837 -7.945 1.00 0.00 O ATOM 328 CB ALA A 113 -2.961 -6.034 -7.578 1.00 0.00 C ATOM 0 H ALA A 113 -4.536 -4.336 -6.641 1.00 0.00 H new ATOM 0 HA ALA A 113 -3.831 -5.132 -9.333 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -2.453 -6.817 -8.141 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -2.272 -5.208 -7.402 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -3.298 -6.435 -6.622 1.00 0.00 H new ATOM 334 N PRO A 114 -4.864 -7.508 -9.620 1.00 0.00 N ATOM 335 CA PRO A 114 -5.726 -8.673 -9.978 1.00 0.00 C ATOM 336 C PRO A 114 -5.550 -9.849 -9.009 1.00 0.00 C ATOM 337 O PRO A 114 -6.478 -10.262 -8.343 1.00 0.00 O ATOM 338 CB PRO A 114 -5.237 -9.056 -11.378 1.00 0.00 C ATOM 339 CG PRO A 114 -3.805 -8.637 -11.414 1.00 0.00 C ATOM 340 CD PRO A 114 -3.690 -7.406 -10.507 1.00 0.00 C ATOM 0 HA PRO A 114 -6.787 -8.425 -9.933 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -5.340 -10.127 -11.553 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -5.816 -8.550 -12.151 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -3.157 -9.440 -11.063 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -3.496 -8.400 -12.432 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -2.759 -7.413 -9.940 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -3.705 -6.482 -11.084 1.00 0.00 H new ATOM 348 N GLU A 115 -4.368 -10.391 -8.932 1.00 0.00 N ATOM 349 CA GLU A 115 -4.131 -11.538 -8.013 1.00 0.00 C ATOM 350 C GLU A 115 -4.424 -11.117 -6.572 1.00 0.00 C ATOM 351 O GLU A 115 -4.732 -11.937 -5.731 1.00 0.00 O ATOM 352 CB GLU A 115 -2.672 -11.976 -8.113 1.00 0.00 C ATOM 353 CG GLU A 115 -2.388 -12.509 -9.518 1.00 0.00 C ATOM 354 CD GLU A 115 -0.888 -12.756 -9.674 1.00 0.00 C ATOM 355 OE1 GLU A 115 -0.183 -12.648 -8.684 1.00 0.00 O ATOM 356 OE2 GLU A 115 -0.469 -13.042 -10.783 1.00 0.00 O ATOM 0 H GLU A 115 -3.554 -10.089 -9.467 1.00 0.00 H new ATOM 0 HA GLU A 115 -4.787 -12.361 -8.294 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -2.014 -11.135 -7.893 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -2.462 -12.747 -7.372 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -2.939 -13.434 -9.686 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -2.730 -11.794 -10.266 1.00 0.00 H new ATOM 363 N LYS A 116 -4.302 -9.850 -6.284 1.00 0.00 N ATOM 364 CA LYS A 116 -4.538 -9.350 -4.898 1.00 0.00 C ATOM 365 C LYS A 116 -3.336 -9.720 -4.030 1.00 0.00 C ATOM 366 O LYS A 116 -3.468 -10.313 -2.979 1.00 0.00 O ATOM 367 CB LYS A 116 -5.818 -9.952 -4.307 1.00 0.00 C ATOM 368 CG LYS A 116 -6.990 -9.683 -5.254 1.00 0.00 C ATOM 369 CD LYS A 116 -8.312 -9.911 -4.522 1.00 0.00 C ATOM 370 CE LYS A 116 -9.463 -9.841 -5.527 1.00 0.00 C ATOM 371 NZ LYS A 116 -9.646 -8.431 -5.974 1.00 0.00 N ATOM 0 H LYS A 116 -4.045 -9.130 -6.959 1.00 0.00 H new ATOM 0 HA LYS A 116 -4.661 -8.267 -4.926 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -5.694 -11.025 -4.159 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -6.020 -9.517 -3.328 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -6.942 -8.659 -5.625 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -6.926 -10.340 -6.121 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -8.304 -10.882 -4.027 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -8.446 -9.158 -3.745 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -9.252 -10.481 -6.384 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -10.381 -10.212 -5.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -10.518 -8.355 -6.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -9.714 -7.809 -5.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -8.834 -8.143 -6.556 1.00 0.00 H new ATOM 385 N ARG A 117 -2.162 -9.356 -4.472 1.00 0.00 N ATOM 386 CA ARG A 117 -0.924 -9.658 -3.699 1.00 0.00 C ATOM 387 C ARG A 117 0.164 -8.666 -4.131 1.00 0.00 C ATOM 388 O ARG A 117 0.437 -8.508 -5.304 1.00 0.00 O ATOM 389 CB ARG A 117 -0.440 -11.087 -4.008 1.00 0.00 C ATOM 390 CG ARG A 117 -1.413 -12.124 -3.434 1.00 0.00 C ATOM 391 CD ARG A 117 -0.853 -13.536 -3.658 1.00 0.00 C ATOM 392 NE ARG A 117 -1.950 -14.534 -3.481 1.00 0.00 N ATOM 393 CZ ARG A 117 -1.803 -15.761 -3.911 1.00 0.00 C ATOM 394 NH1 ARG A 117 -0.682 -16.129 -4.471 1.00 0.00 N ATOM 395 NH2 ARG A 117 -2.778 -16.620 -3.776 1.00 0.00 N ATOM 0 H ARG A 117 -2.007 -8.856 -5.347 1.00 0.00 H new ATOM 0 HA ARG A 117 -1.129 -9.574 -2.632 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -0.352 -11.221 -5.086 1.00 0.00 H new ATOM 0 HB3 ARG A 117 0.553 -11.239 -3.585 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -1.563 -11.946 -2.369 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -2.387 -12.028 -3.914 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -0.429 -13.617 -4.659 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -0.046 -13.736 -2.953 1.00 0.00 H new ATOM 0 HE ARG A 117 -2.818 -14.258 -3.023 1.00 0.00 H new ATOM 0 HH11 ARG A 117 0.081 -15.459 -4.574 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -0.569 -17.086 -4.806 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -3.653 -16.334 -3.336 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -2.665 -17.577 -4.111 1.00 0.00 H new ATOM 409 N LEU A 118 0.789 -8.000 -3.196 1.00 0.00 N ATOM 410 CA LEU A 118 1.864 -7.022 -3.559 1.00 0.00 C ATOM 411 C LEU A 118 2.943 -7.023 -2.472 1.00 0.00 C ATOM 412 O LEU A 118 2.669 -7.275 -1.316 1.00 0.00 O ATOM 413 CB LEU A 118 1.285 -5.603 -3.644 1.00 0.00 C ATOM 414 CG LEU A 118 0.407 -5.415 -4.888 1.00 0.00 C ATOM 415 CD1 LEU A 118 -0.133 -3.983 -4.876 1.00 0.00 C ATOM 416 CD2 LEU A 118 1.223 -5.634 -6.177 1.00 0.00 C ATOM 0 H LEU A 118 0.604 -8.089 -2.197 1.00 0.00 H new ATOM 0 HA LEU A 118 2.283 -7.313 -4.522 1.00 0.00 H new ATOM 0 HB2 LEU A 118 0.696 -5.397 -2.750 1.00 0.00 H new ATOM 0 HB3 LEU A 118 2.100 -4.879 -3.662 1.00 0.00 H new ATOM 0 HG LEU A 118 -0.405 -6.142 -4.869 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -0.762 -3.824 -5.752 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -0.722 -3.824 -3.973 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.700 -3.280 -4.894 1.00 0.00 H new ATOM 0 HD21 LEU A 118 0.578 -5.495 -7.044 1.00 0.00 H new ATOM 0 HD22 LEU A 118 2.042 -4.916 -6.215 1.00 0.00 H new ATOM 0 HD23 LEU A 118 1.627 -6.646 -6.184 1.00 0.00 H new ATOM 428 N THR A 119 4.166 -6.715 -2.826 1.00 0.00 N ATOM 429 CA THR A 119 5.250 -6.669 -1.798 1.00 0.00 C ATOM 430 C THR A 119 5.343 -5.242 -1.249 1.00 0.00 C ATOM 431 O THR A 119 4.642 -4.361 -1.693 1.00 0.00 O ATOM 432 CB THR A 119 6.585 -7.086 -2.421 1.00 0.00 C ATOM 433 OG1 THR A 119 6.855 -6.267 -3.551 1.00 0.00 O ATOM 434 CG2 THR A 119 6.516 -8.559 -2.854 1.00 0.00 C ATOM 0 H THR A 119 4.459 -6.494 -3.778 1.00 0.00 H new ATOM 0 HA THR A 119 5.022 -7.361 -0.987 1.00 0.00 H new ATOM 0 HB THR A 119 7.382 -6.966 -1.687 1.00 0.00 H new ATOM 0 HG1 THR A 119 7.710 -6.532 -3.950 1.00 0.00 H new ATOM 0 HG21 THR A 119 7.468 -8.853 -3.297 1.00 0.00 H new ATOM 0 HG22 THR A 119 6.312 -9.184 -1.985 1.00 0.00 H new ATOM 0 HG23 THR A 119 5.720 -8.686 -3.587 1.00 0.00 H new ATOM 442 N LEU A 120 6.187 -5.006 -0.281 1.00 0.00 N ATOM 443 CA LEU A 120 6.294 -3.633 0.300 1.00 0.00 C ATOM 444 C LEU A 120 6.672 -2.607 -0.777 1.00 0.00 C ATOM 445 O LEU A 120 6.056 -1.569 -0.892 1.00 0.00 O ATOM 446 CB LEU A 120 7.359 -3.641 1.403 1.00 0.00 C ATOM 447 CG LEU A 120 7.506 -2.243 2.022 1.00 0.00 C ATOM 448 CD1 LEU A 120 6.350 -1.968 2.987 1.00 0.00 C ATOM 449 CD2 LEU A 120 8.831 -2.168 2.784 1.00 0.00 C ATOM 0 H LEU A 120 6.807 -5.702 0.133 1.00 0.00 H new ATOM 0 HA LEU A 120 5.326 -3.349 0.713 1.00 0.00 H new ATOM 0 HB2 LEU A 120 7.085 -4.360 2.175 1.00 0.00 H new ATOM 0 HB3 LEU A 120 8.315 -3.965 0.991 1.00 0.00 H new ATOM 0 HG LEU A 120 7.490 -1.497 1.228 1.00 0.00 H new ATOM 0 HD11 LEU A 120 6.466 -0.974 3.419 1.00 0.00 H new ATOM 0 HD12 LEU A 120 5.405 -2.021 2.447 1.00 0.00 H new ATOM 0 HD13 LEU A 120 6.355 -2.713 3.783 1.00 0.00 H new ATOM 0 HD21 LEU A 120 8.941 -1.178 3.226 1.00 0.00 H new ATOM 0 HD22 LEU A 120 8.840 -2.920 3.573 1.00 0.00 H new ATOM 0 HD23 LEU A 120 9.657 -2.353 2.097 1.00 0.00 H new ATOM 461 N ALA A 121 7.687 -2.874 -1.550 1.00 0.00 N ATOM 462 CA ALA A 121 8.108 -1.893 -2.598 1.00 0.00 C ATOM 463 C ALA A 121 6.965 -1.607 -3.584 1.00 0.00 C ATOM 464 O ALA A 121 6.771 -0.485 -4.012 1.00 0.00 O ATOM 465 CB ALA A 121 9.308 -2.454 -3.362 1.00 0.00 C ATOM 0 H ALA A 121 8.245 -3.727 -1.504 1.00 0.00 H new ATOM 0 HA ALA A 121 8.377 -0.959 -2.106 1.00 0.00 H new ATOM 0 HB1 ALA A 121 9.618 -1.742 -4.127 1.00 0.00 H new ATOM 0 HB2 ALA A 121 10.133 -2.625 -2.670 1.00 0.00 H new ATOM 0 HB3 ALA A 121 9.030 -3.396 -3.835 1.00 0.00 H new ATOM 471 N GLN A 122 6.216 -2.608 -3.963 1.00 0.00 N ATOM 472 CA GLN A 122 5.109 -2.390 -4.937 1.00 0.00 C ATOM 473 C GLN A 122 4.064 -1.447 -4.340 1.00 0.00 C ATOM 474 O GLN A 122 3.447 -0.667 -5.042 1.00 0.00 O ATOM 475 CB GLN A 122 4.464 -3.737 -5.251 1.00 0.00 C ATOM 476 CG GLN A 122 5.489 -4.647 -5.927 1.00 0.00 C ATOM 477 CD GLN A 122 5.768 -4.147 -7.348 1.00 0.00 C ATOM 478 OE1 GLN A 122 4.853 -3.886 -8.103 1.00 0.00 O ATOM 479 NE2 GLN A 122 7.003 -4.006 -7.746 1.00 0.00 N ATOM 0 H GLN A 122 6.324 -3.569 -3.639 1.00 0.00 H new ATOM 0 HA GLN A 122 5.504 -1.942 -5.849 1.00 0.00 H new ATOM 0 HB2 GLN A 122 4.099 -4.200 -4.334 1.00 0.00 H new ATOM 0 HB3 GLN A 122 3.601 -3.596 -5.902 1.00 0.00 H new ATOM 0 HG2 GLN A 122 6.413 -4.662 -5.349 1.00 0.00 H new ATOM 0 HG3 GLN A 122 5.116 -5.671 -5.958 1.00 0.00 H new ATOM 0 HE21 GLN A 122 7.771 -4.225 -7.112 1.00 0.00 H new ATOM 0 HE22 GLN A 122 7.200 -3.677 -8.691 1.00 0.00 H new ATOM 488 N ILE A 123 3.863 -1.500 -3.052 1.00 0.00 N ATOM 489 CA ILE A 123 2.863 -0.593 -2.428 1.00 0.00 C ATOM 490 C ILE A 123 3.290 0.853 -2.670 1.00 0.00 C ATOM 491 O ILE A 123 2.518 1.677 -3.119 1.00 0.00 O ATOM 492 CB ILE A 123 2.804 -0.853 -0.921 1.00 0.00 C ATOM 493 CG1 ILE A 123 2.472 -2.326 -0.671 1.00 0.00 C ATOM 494 CG2 ILE A 123 1.719 0.020 -0.286 1.00 0.00 C ATOM 495 CD1 ILE A 123 2.508 -2.623 0.834 1.00 0.00 C ATOM 0 H ILE A 123 4.345 -2.128 -2.409 1.00 0.00 H new ATOM 0 HA ILE A 123 1.881 -0.773 -2.865 1.00 0.00 H new ATOM 0 HB ILE A 123 3.770 -0.611 -0.478 1.00 0.00 H new ATOM 0 HG12 ILE A 123 1.486 -2.558 -1.073 1.00 0.00 H new ATOM 0 HG13 ILE A 123 3.187 -2.962 -1.193 1.00 0.00 H new ATOM 0 HG21 ILE A 123 1.681 -0.169 0.787 1.00 0.00 H new ATOM 0 HG22 ILE A 123 1.949 1.071 -0.461 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.753 -0.219 -0.731 1.00 0.00 H new ATOM 0 HD11 ILE A 123 2.271 -3.673 1.003 1.00 0.00 H new ATOM 0 HD12 ILE A 123 3.503 -2.409 1.223 1.00 0.00 H new ATOM 0 HD13 ILE A 123 1.776 -1.998 1.346 1.00 0.00 H new ATOM 507 N TYR A 124 4.522 1.167 -2.379 1.00 0.00 N ATOM 508 CA TYR A 124 5.007 2.560 -2.587 1.00 0.00 C ATOM 509 C TYR A 124 4.746 2.996 -4.034 1.00 0.00 C ATOM 510 O TYR A 124 4.295 4.095 -4.284 1.00 0.00 O ATOM 511 CB TYR A 124 6.518 2.633 -2.326 1.00 0.00 C ATOM 512 CG TYR A 124 6.859 2.232 -0.901 1.00 0.00 C ATOM 513 CD1 TYR A 124 5.956 2.450 0.154 1.00 0.00 C ATOM 514 CD2 TYR A 124 8.105 1.644 -0.639 1.00 0.00 C ATOM 515 CE1 TYR A 124 6.304 2.080 1.459 1.00 0.00 C ATOM 516 CE2 TYR A 124 8.449 1.275 0.666 1.00 0.00 C ATOM 517 CZ TYR A 124 7.549 1.493 1.716 1.00 0.00 C ATOM 518 OH TYR A 124 7.892 1.135 3.003 1.00 0.00 O ATOM 0 H TYR A 124 5.215 0.518 -2.006 1.00 0.00 H new ATOM 0 HA TYR A 124 4.476 3.216 -1.898 1.00 0.00 H new ATOM 0 HB2 TYR A 124 7.040 1.979 -3.024 1.00 0.00 H new ATOM 0 HB3 TYR A 124 6.872 3.647 -2.514 1.00 0.00 H new ATOM 0 HD1 TYR A 124 4.995 2.902 -0.042 1.00 0.00 H new ATOM 0 HD2 TYR A 124 8.801 1.475 -1.447 1.00 0.00 H new ATOM 0 HE1 TYR A 124 5.610 2.248 2.269 1.00 0.00 H new ATOM 0 HE2 TYR A 124 9.409 0.822 0.863 1.00 0.00 H new ATOM 0 HH TYR A 124 7.090 1.133 3.567 1.00 0.00 H new ATOM 528 N GLU A 125 5.032 2.154 -4.991 1.00 0.00 N ATOM 529 CA GLU A 125 4.804 2.546 -6.412 1.00 0.00 C ATOM 530 C GLU A 125 3.342 2.940 -6.619 1.00 0.00 C ATOM 531 O GLU A 125 3.043 3.956 -7.215 1.00 0.00 O ATOM 532 CB GLU A 125 5.156 1.381 -7.337 1.00 0.00 C ATOM 533 CG GLU A 125 6.672 1.184 -7.338 1.00 0.00 C ATOM 534 CD GLU A 125 7.041 0.040 -8.285 1.00 0.00 C ATOM 535 OE1 GLU A 125 6.140 -0.650 -8.729 1.00 0.00 O ATOM 536 OE2 GLU A 125 8.221 -0.124 -8.549 1.00 0.00 O ATOM 0 H GLU A 125 5.411 1.217 -4.852 1.00 0.00 H new ATOM 0 HA GLU A 125 5.441 3.398 -6.648 1.00 0.00 H new ATOM 0 HB2 GLU A 125 4.659 0.471 -7.002 1.00 0.00 H new ATOM 0 HB3 GLU A 125 4.802 1.583 -8.348 1.00 0.00 H new ATOM 0 HG2 GLU A 125 7.168 2.103 -7.651 1.00 0.00 H new ATOM 0 HG3 GLU A 125 7.020 0.961 -6.329 1.00 0.00 H new ATOM 543 N TRP A 126 2.427 2.153 -6.129 1.00 0.00 N ATOM 544 CA TRP A 126 0.990 2.505 -6.303 1.00 0.00 C ATOM 545 C TRP A 126 0.718 3.845 -5.615 1.00 0.00 C ATOM 546 O TRP A 126 0.174 4.757 -6.203 1.00 0.00 O ATOM 547 CB TRP A 126 0.112 1.418 -5.679 1.00 0.00 C ATOM 548 CG TRP A 126 -1.331 1.754 -5.894 1.00 0.00 C ATOM 549 CD1 TRP A 126 -2.009 1.546 -7.045 1.00 0.00 C ATOM 550 CD2 TRP A 126 -2.282 2.351 -4.962 1.00 0.00 C ATOM 551 NE1 TRP A 126 -3.313 1.974 -6.878 1.00 0.00 N ATOM 552 CE2 TRP A 126 -3.530 2.481 -5.616 1.00 0.00 C ATOM 553 CE3 TRP A 126 -2.186 2.788 -3.629 1.00 0.00 C ATOM 554 CZ2 TRP A 126 -4.641 3.023 -4.975 1.00 0.00 C ATOM 555 CZ3 TRP A 126 -3.306 3.335 -2.977 1.00 0.00 C ATOM 556 CH2 TRP A 126 -4.530 3.453 -3.652 1.00 0.00 C ATOM 0 H TRP A 126 2.608 1.288 -5.620 1.00 0.00 H new ATOM 0 HA TRP A 126 0.758 2.583 -7.365 1.00 0.00 H new ATOM 0 HB2 TRP A 126 0.341 0.450 -6.125 1.00 0.00 H new ATOM 0 HB3 TRP A 126 0.322 1.335 -4.613 1.00 0.00 H new ATOM 0 HD1 TRP A 126 -1.599 1.116 -7.947 1.00 0.00 H new ATOM 0 HE1 TRP A 126 -4.029 1.921 -7.603 1.00 0.00 H new ATOM 0 HE3 TRP A 126 -1.247 2.703 -3.103 1.00 0.00 H new ATOM 0 HZ2 TRP A 126 -5.582 3.110 -5.498 1.00 0.00 H new ATOM 0 HZ3 TRP A 126 -3.223 3.666 -1.952 1.00 0.00 H new ATOM 0 HH2 TRP A 126 -5.386 3.876 -3.148 1.00 0.00 H new ATOM 567 N MET A 127 1.103 3.972 -4.375 1.00 0.00 N ATOM 568 CA MET A 127 0.873 5.255 -3.652 1.00 0.00 C ATOM 569 C MET A 127 1.507 6.403 -4.441 1.00 0.00 C ATOM 570 O MET A 127 0.904 7.437 -4.653 1.00 0.00 O ATOM 571 CB MET A 127 1.500 5.175 -2.258 1.00 0.00 C ATOM 572 CG MET A 127 0.894 3.992 -1.503 1.00 0.00 C ATOM 573 SD MET A 127 1.302 4.110 0.256 1.00 0.00 S ATOM 574 CE MET A 127 -0.380 4.409 0.854 1.00 0.00 C ATOM 0 H MET A 127 1.566 3.244 -3.831 1.00 0.00 H new ATOM 0 HA MET A 127 -0.198 5.433 -3.554 1.00 0.00 H new ATOM 0 HB2 MET A 127 2.581 5.056 -2.338 1.00 0.00 H new ATOM 0 HB3 MET A 127 1.321 6.101 -1.712 1.00 0.00 H new ATOM 0 HG2 MET A 127 -0.188 3.981 -1.634 1.00 0.00 H new ATOM 0 HG3 MET A 127 1.274 3.056 -1.911 1.00 0.00 H new ATOM 0 HE1 MET A 127 -0.367 4.516 1.939 1.00 0.00 H new ATOM 0 HE2 MET A 127 -0.769 5.322 0.404 1.00 0.00 H new ATOM 0 HE3 MET A 127 -1.018 3.569 0.580 1.00 0.00 H new ATOM 584 N VAL A 128 2.721 6.225 -4.884 1.00 0.00 N ATOM 585 CA VAL A 128 3.391 7.301 -5.664 1.00 0.00 C ATOM 586 C VAL A 128 2.661 7.494 -6.998 1.00 0.00 C ATOM 587 O VAL A 128 2.489 8.602 -7.465 1.00 0.00 O ATOM 588 CB VAL A 128 4.851 6.907 -5.925 1.00 0.00 C ATOM 589 CG1 VAL A 128 5.506 7.940 -6.854 1.00 0.00 C ATOM 590 CG2 VAL A 128 5.617 6.857 -4.592 1.00 0.00 C ATOM 0 H VAL A 128 3.277 5.382 -4.739 1.00 0.00 H new ATOM 0 HA VAL A 128 3.364 8.233 -5.100 1.00 0.00 H new ATOM 0 HB VAL A 128 4.881 5.925 -6.398 1.00 0.00 H new ATOM 0 HG11 VAL A 128 6.543 7.658 -7.038 1.00 0.00 H new ATOM 0 HG12 VAL A 128 4.966 7.973 -7.800 1.00 0.00 H new ATOM 0 HG13 VAL A 128 5.475 8.923 -6.384 1.00 0.00 H new ATOM 0 HG21 VAL A 128 6.654 6.577 -4.778 1.00 0.00 H new ATOM 0 HG22 VAL A 128 5.586 7.838 -4.117 1.00 0.00 H new ATOM 0 HG23 VAL A 128 5.155 6.121 -3.934 1.00 0.00 H new ATOM 600 N ARG A 129 2.239 6.422 -7.621 1.00 0.00 N ATOM 601 CA ARG A 129 1.529 6.550 -8.932 1.00 0.00 C ATOM 602 C ARG A 129 0.125 7.128 -8.745 1.00 0.00 C ATOM 603 O ARG A 129 -0.343 7.895 -9.563 1.00 0.00 O ATOM 604 CB ARG A 129 1.406 5.182 -9.604 1.00 0.00 C ATOM 605 CG ARG A 129 0.793 5.366 -10.996 1.00 0.00 C ATOM 606 CD ARG A 129 0.784 4.027 -11.736 1.00 0.00 C ATOM 607 NE ARG A 129 0.734 4.263 -13.216 1.00 0.00 N ATOM 608 CZ ARG A 129 -0.156 5.062 -13.744 1.00 0.00 C ATOM 609 NH1 ARG A 129 -1.121 5.551 -13.015 1.00 0.00 N ATOM 610 NH2 ARG A 129 -0.106 5.335 -15.019 1.00 0.00 N ATOM 0 H ARG A 129 2.354 5.467 -7.281 1.00 0.00 H new ATOM 0 HA ARG A 129 2.115 7.224 -9.557 1.00 0.00 H new ATOM 0 HB2 ARG A 129 2.386 4.711 -9.683 1.00 0.00 H new ATOM 0 HB3 ARG A 129 0.783 4.521 -9.002 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -0.223 5.751 -10.909 1.00 0.00 H new ATOM 0 HG3 ARG A 129 1.365 6.101 -11.562 1.00 0.00 H new ATOM 0 HD2 ARG A 129 1.675 3.454 -11.480 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -0.076 3.435 -11.424 1.00 0.00 H new ATOM 0 HE ARG A 129 1.406 3.792 -13.821 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -1.185 5.311 -12.026 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -1.812 6.174 -13.434 1.00 0.00 H new ATOM 0 HH21 ARG A 129 0.626 4.925 -15.600 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -0.799 5.958 -15.435 1.00 0.00 H new ATOM 624 N THR A 130 -0.569 6.756 -7.703 1.00 0.00 N ATOM 625 CA THR A 130 -1.952 7.281 -7.522 1.00 0.00 C ATOM 626 C THR A 130 -1.893 8.671 -6.895 1.00 0.00 C ATOM 627 O THR A 130 -2.394 9.634 -7.447 1.00 0.00 O ATOM 628 CB THR A 130 -2.746 6.339 -6.613 1.00 0.00 C ATOM 629 OG1 THR A 130 -2.295 5.007 -6.806 1.00 0.00 O ATOM 630 CG2 THR A 130 -4.231 6.429 -6.953 1.00 0.00 C ATOM 0 H THR A 130 -0.242 6.118 -6.977 1.00 0.00 H new ATOM 0 HA THR A 130 -2.444 7.343 -8.492 1.00 0.00 H new ATOM 0 HB THR A 130 -2.597 6.628 -5.573 1.00 0.00 H new ATOM 0 HG1 THR A 130 -1.524 4.836 -6.226 1.00 0.00 H new ATOM 0 HG21 THR A 130 -4.794 5.758 -6.305 1.00 0.00 H new ATOM 0 HG22 THR A 130 -4.577 7.452 -6.804 1.00 0.00 H new ATOM 0 HG23 THR A 130 -4.384 6.142 -7.993 1.00 0.00 H new ATOM 638 N VAL A 131 -1.283 8.785 -5.749 1.00 0.00 N ATOM 639 CA VAL A 131 -1.182 10.112 -5.085 1.00 0.00 C ATOM 640 C VAL A 131 0.081 10.825 -5.585 1.00 0.00 C ATOM 641 O VAL A 131 1.176 10.321 -5.436 1.00 0.00 O ATOM 642 CB VAL A 131 -1.075 9.912 -3.572 1.00 0.00 C ATOM 643 CG1 VAL A 131 -1.285 11.253 -2.868 1.00 0.00 C ATOM 644 CG2 VAL A 131 -2.146 8.920 -3.109 1.00 0.00 C ATOM 0 H VAL A 131 -0.849 8.013 -5.243 1.00 0.00 H new ATOM 0 HA VAL A 131 -2.064 10.709 -5.317 1.00 0.00 H new ATOM 0 HB VAL A 131 -0.088 9.520 -3.326 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -1.209 11.114 -1.790 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -0.523 11.960 -3.197 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -2.272 11.643 -3.115 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -2.069 8.778 -2.031 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -3.134 9.310 -3.354 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -1.999 7.964 -3.612 1.00 0.00 H new ATOM 654 N PRO A 132 -0.057 11.990 -6.177 1.00 0.00 N ATOM 655 CA PRO A 132 1.105 12.766 -6.704 1.00 0.00 C ATOM 656 C PRO A 132 1.821 13.551 -5.596 1.00 0.00 C ATOM 657 O PRO A 132 2.965 13.938 -5.732 1.00 0.00 O ATOM 658 CB PRO A 132 0.457 13.721 -7.709 1.00 0.00 C ATOM 659 CG PRO A 132 -0.910 13.977 -7.163 1.00 0.00 C ATOM 660 CD PRO A 132 -1.328 12.699 -6.421 1.00 0.00 C ATOM 0 HA PRO A 132 1.871 12.124 -7.140 1.00 0.00 H new ATOM 0 HB2 PRO A 132 1.026 14.646 -7.800 1.00 0.00 H new ATOM 0 HB3 PRO A 132 0.409 13.277 -8.703 1.00 0.00 H new ATOM 0 HG2 PRO A 132 -0.905 14.833 -6.489 1.00 0.00 H new ATOM 0 HG3 PRO A 132 -1.611 14.207 -7.965 1.00 0.00 H new ATOM 0 HD2 PRO A 132 -1.841 12.930 -5.487 1.00 0.00 H new ATOM 0 HD3 PRO A 132 -2.012 12.097 -7.019 1.00 0.00 H new ATOM 668 N TYR A 133 1.148 13.788 -4.505 1.00 0.00 N ATOM 669 CA TYR A 133 1.766 14.546 -3.381 1.00 0.00 C ATOM 670 C TYR A 133 3.026 13.820 -2.885 1.00 0.00 C ATOM 671 O TYR A 133 3.921 14.426 -2.326 1.00 0.00 O ATOM 672 CB TYR A 133 0.742 14.651 -2.243 1.00 0.00 C ATOM 673 CG TYR A 133 1.366 15.296 -1.028 1.00 0.00 C ATOM 674 CD1 TYR A 133 1.372 16.688 -0.906 1.00 0.00 C ATOM 675 CD2 TYR A 133 1.924 14.501 -0.019 1.00 0.00 C ATOM 676 CE1 TYR A 133 1.936 17.290 0.223 1.00 0.00 C ATOM 677 CE2 TYR A 133 2.490 15.103 1.111 1.00 0.00 C ATOM 678 CZ TYR A 133 2.497 16.497 1.232 1.00 0.00 C ATOM 679 OH TYR A 133 3.058 17.091 2.344 1.00 0.00 O ATOM 0 H TYR A 133 0.187 13.486 -4.342 1.00 0.00 H new ATOM 0 HA TYR A 133 2.052 15.542 -3.719 1.00 0.00 H new ATOM 0 HB2 TYR A 133 -0.117 15.236 -2.572 1.00 0.00 H new ATOM 0 HB3 TYR A 133 0.372 13.658 -1.986 1.00 0.00 H new ATOM 0 HD1 TYR A 133 0.941 17.300 -1.685 1.00 0.00 H new ATOM 0 HD2 TYR A 133 1.918 13.425 -0.113 1.00 0.00 H new ATOM 0 HE1 TYR A 133 1.939 18.366 0.317 1.00 0.00 H new ATOM 0 HE2 TYR A 133 2.921 14.491 1.890 1.00 0.00 H new ATOM 0 HH TYR A 133 3.401 16.399 2.947 1.00 0.00 H new ATOM 689 N PHE A 134 3.096 12.526 -3.065 1.00 0.00 N ATOM 690 CA PHE A 134 4.286 11.757 -2.580 1.00 0.00 C ATOM 691 C PHE A 134 5.413 11.751 -3.624 1.00 0.00 C ATOM 692 O PHE A 134 6.569 11.579 -3.292 1.00 0.00 O ATOM 693 CB PHE A 134 3.862 10.310 -2.306 1.00 0.00 C ATOM 694 CG PHE A 134 3.077 10.235 -1.014 1.00 0.00 C ATOM 695 CD1 PHE A 134 1.843 10.884 -0.907 1.00 0.00 C ATOM 696 CD2 PHE A 134 3.584 9.513 0.076 1.00 0.00 C ATOM 697 CE1 PHE A 134 1.112 10.812 0.286 1.00 0.00 C ATOM 698 CE2 PHE A 134 2.854 9.441 1.268 1.00 0.00 C ATOM 699 CZ PHE A 134 1.619 10.091 1.374 1.00 0.00 C ATOM 0 H PHE A 134 2.380 11.966 -3.528 1.00 0.00 H new ATOM 0 HA PHE A 134 4.657 12.235 -1.673 1.00 0.00 H new ATOM 0 HB2 PHE A 134 3.255 9.938 -3.132 1.00 0.00 H new ATOM 0 HB3 PHE A 134 4.742 9.670 -2.244 1.00 0.00 H new ATOM 0 HD1 PHE A 134 1.453 11.442 -1.745 1.00 0.00 H new ATOM 0 HD2 PHE A 134 4.538 9.013 -0.004 1.00 0.00 H new ATOM 0 HE1 PHE A 134 0.158 11.312 0.366 1.00 0.00 H new ATOM 0 HE2 PHE A 134 3.244 8.883 2.107 1.00 0.00 H new ATOM 0 HZ PHE A 134 1.057 10.036 2.295 1.00 0.00 H new ATOM 709 N LYS A 135 5.093 11.903 -4.878 1.00 0.00 N ATOM 710 CA LYS A 135 6.160 11.866 -5.923 1.00 0.00 C ATOM 711 C LYS A 135 7.214 12.947 -5.644 1.00 0.00 C ATOM 712 O LYS A 135 8.385 12.770 -5.926 1.00 0.00 O ATOM 713 CB LYS A 135 5.528 12.085 -7.304 1.00 0.00 C ATOM 714 CG LYS A 135 5.516 13.574 -7.651 1.00 0.00 C ATOM 715 CD LYS A 135 4.562 13.810 -8.817 1.00 0.00 C ATOM 716 CE LYS A 135 4.591 15.288 -9.208 1.00 0.00 C ATOM 717 NZ LYS A 135 5.943 15.636 -9.731 1.00 0.00 N ATOM 0 H LYS A 135 4.146 12.051 -5.226 1.00 0.00 H new ATOM 0 HA LYS A 135 6.651 10.893 -5.902 1.00 0.00 H new ATOM 0 HB2 LYS A 135 6.087 11.533 -8.059 1.00 0.00 H new ATOM 0 HB3 LYS A 135 4.510 11.694 -7.312 1.00 0.00 H new ATOM 0 HG2 LYS A 135 5.203 14.159 -6.786 1.00 0.00 H new ATOM 0 HG3 LYS A 135 6.520 13.906 -7.914 1.00 0.00 H new ATOM 0 HD2 LYS A 135 4.850 13.192 -9.667 1.00 0.00 H new ATOM 0 HD3 LYS A 135 3.550 13.516 -8.538 1.00 0.00 H new ATOM 0 HE2 LYS A 135 3.833 15.490 -9.965 1.00 0.00 H new ATOM 0 HE3 LYS A 135 4.352 15.909 -8.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 5.877 16.486 -10.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 6.586 15.820 -8.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 6.310 14.845 -10.297 1.00 0.00 H new ATOM 731 N ASP A 136 6.816 14.067 -5.100 1.00 0.00 N ATOM 732 CA ASP A 136 7.807 15.148 -4.819 1.00 0.00 C ATOM 733 C ASP A 136 8.778 14.685 -3.730 1.00 0.00 C ATOM 734 O ASP A 136 9.968 14.922 -3.803 1.00 0.00 O ATOM 735 CB ASP A 136 7.074 16.404 -4.337 1.00 0.00 C ATOM 736 CG ASP A 136 6.175 16.938 -5.453 1.00 0.00 C ATOM 737 OD1 ASP A 136 6.695 17.575 -6.353 1.00 0.00 O ATOM 738 OD2 ASP A 136 4.979 16.706 -5.385 1.00 0.00 O ATOM 0 H ASP A 136 5.853 14.280 -4.839 1.00 0.00 H new ATOM 0 HA ASP A 136 8.360 15.373 -5.731 1.00 0.00 H new ATOM 0 HB2 ASP A 136 6.476 16.172 -3.455 1.00 0.00 H new ATOM 0 HB3 ASP A 136 7.795 17.166 -4.042 1.00 0.00 H new ATOM 743 N LYS A 137 8.285 14.025 -2.718 1.00 0.00 N ATOM 744 CA LYS A 137 9.184 13.553 -1.627 1.00 0.00 C ATOM 745 C LYS A 137 10.193 12.543 -2.181 1.00 0.00 C ATOM 746 O LYS A 137 11.279 12.390 -1.660 1.00 0.00 O ATOM 747 CB LYS A 137 8.351 12.902 -0.520 1.00 0.00 C ATOM 748 CG LYS A 137 7.466 13.966 0.136 1.00 0.00 C ATOM 749 CD LYS A 137 6.763 13.374 1.360 1.00 0.00 C ATOM 750 CE LYS A 137 5.928 14.462 2.036 1.00 0.00 C ATOM 751 NZ LYS A 137 6.837 15.500 2.597 1.00 0.00 N ATOM 0 H LYS A 137 7.299 13.792 -2.599 1.00 0.00 H new ATOM 0 HA LYS A 137 9.726 14.405 -1.216 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.735 12.104 -0.934 1.00 0.00 H new ATOM 0 HB3 LYS A 137 9.005 12.447 0.224 1.00 0.00 H new ATOM 0 HG2 LYS A 137 8.071 14.823 0.432 1.00 0.00 H new ATOM 0 HG3 LYS A 137 6.727 14.329 -0.579 1.00 0.00 H new ATOM 0 HD2 LYS A 137 6.125 12.542 1.061 1.00 0.00 H new ATOM 0 HD3 LYS A 137 7.498 12.976 2.059 1.00 0.00 H new ATOM 0 HE2 LYS A 137 5.244 14.911 1.317 1.00 0.00 H new ATOM 0 HE3 LYS A 137 5.318 14.029 2.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 6.340 16.032 3.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 7.678 15.042 3.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 7.129 16.151 1.841 1.00 0.00 H new ATOM 765 N GLY A 138 9.846 11.850 -3.230 1.00 0.00 N ATOM 766 CA GLY A 138 10.791 10.852 -3.808 1.00 0.00 C ATOM 767 C GLY A 138 12.115 11.530 -4.171 1.00 0.00 C ATOM 768 O GLY A 138 13.181 11.006 -3.914 1.00 0.00 O ATOM 0 H GLY A 138 8.951 11.931 -3.712 1.00 0.00 H new ATOM 0 HA2 GLY A 138 10.969 10.050 -3.091 1.00 0.00 H new ATOM 0 HA3 GLY A 138 10.352 10.395 -4.695 1.00 0.00 H new ATOM 772 N ASP A 139 12.060 12.692 -4.765 1.00 0.00 N ATOM 773 CA ASP A 139 13.321 13.392 -5.140 1.00 0.00 C ATOM 774 C ASP A 139 13.934 14.032 -3.894 1.00 0.00 C ATOM 775 O ASP A 139 15.003 14.611 -3.944 1.00 0.00 O ATOM 776 CB ASP A 139 13.022 14.478 -6.175 1.00 0.00 C ATOM 777 CG ASP A 139 12.581 13.822 -7.484 1.00 0.00 C ATOM 778 OD1 ASP A 139 12.825 12.637 -7.640 1.00 0.00 O ATOM 779 OD2 ASP A 139 12.006 14.515 -8.305 1.00 0.00 O ATOM 0 H ASP A 139 11.200 13.185 -5.006 1.00 0.00 H new ATOM 0 HA ASP A 139 14.021 12.673 -5.566 1.00 0.00 H new ATOM 0 HB2 ASP A 139 12.240 15.142 -5.806 1.00 0.00 H new ATOM 0 HB3 ASP A 139 13.908 15.091 -6.342 1.00 0.00 H new ATOM 784 N SER A 140 13.261 13.938 -2.777 1.00 0.00 N ATOM 785 CA SER A 140 13.792 14.541 -1.517 1.00 0.00 C ATOM 786 C SER A 140 14.014 13.438 -0.479 1.00 0.00 C ATOM 787 O SER A 140 13.256 12.492 -0.386 1.00 0.00 O ATOM 788 CB SER A 140 12.786 15.560 -0.982 1.00 0.00 C ATOM 789 OG SER A 140 13.355 16.242 0.131 1.00 0.00 O ATOM 0 H SER A 140 12.361 13.467 -2.682 1.00 0.00 H new ATOM 0 HA SER A 140 14.740 15.040 -1.719 1.00 0.00 H new ATOM 0 HB2 SER A 140 12.522 16.272 -1.764 1.00 0.00 H new ATOM 0 HB3 SER A 140 11.866 15.058 -0.684 1.00 0.00 H new ATOM 0 HG SER A 140 12.713 16.898 0.476 1.00 0.00 H new ATOM 795 N ASN A 141 15.056 13.552 0.296 1.00 0.00 N ATOM 796 CA ASN A 141 15.349 12.514 1.325 1.00 0.00 C ATOM 797 C ASN A 141 14.171 12.379 2.296 1.00 0.00 C ATOM 798 O ASN A 141 14.063 11.408 3.018 1.00 0.00 O ATOM 799 CB ASN A 141 16.597 12.927 2.105 1.00 0.00 C ATOM 800 CG ASN A 141 16.356 14.301 2.740 1.00 0.00 C ATOM 801 OD1 ASN A 141 15.284 14.568 3.249 1.00 0.00 O ATOM 802 ND2 ASN A 141 17.309 15.191 2.723 1.00 0.00 N ATOM 0 H ASN A 141 15.722 14.324 0.261 1.00 0.00 H new ATOM 0 HA ASN A 141 15.511 11.556 0.830 1.00 0.00 H new ATOM 0 HB2 ASN A 141 16.820 12.190 2.876 1.00 0.00 H new ATOM 0 HB3 ASN A 141 17.461 12.965 1.441 1.00 0.00 H new ATOM 0 HD21 ASN A 141 17.155 16.111 3.136 1.00 0.00 H new ATOM 0 HD22 ASN A 141 18.208 14.967 2.296 1.00 0.00 H new ATOM 809 N SER A 142 13.293 13.345 2.330 1.00 0.00 N ATOM 810 CA SER A 142 12.132 13.268 3.265 1.00 0.00 C ATOM 811 C SER A 142 11.332 11.989 3.003 1.00 0.00 C ATOM 812 O SER A 142 10.567 11.546 3.836 1.00 0.00 O ATOM 813 CB SER A 142 11.225 14.481 3.051 1.00 0.00 C ATOM 814 OG SER A 142 11.968 15.670 3.278 1.00 0.00 O ATOM 0 H SER A 142 13.329 14.184 1.751 1.00 0.00 H new ATOM 0 HA SER A 142 12.501 13.258 4.290 1.00 0.00 H new ATOM 0 HB2 SER A 142 10.826 14.476 2.037 1.00 0.00 H new ATOM 0 HB3 SER A 142 10.373 14.436 3.729 1.00 0.00 H new ATOM 0 HG SER A 142 11.389 16.449 3.140 1.00 0.00 H new ATOM 820 N SER A 143 11.495 11.398 1.850 1.00 0.00 N ATOM 821 CA SER A 143 10.735 10.153 1.534 1.00 0.00 C ATOM 822 C SER A 143 10.891 9.142 2.675 1.00 0.00 C ATOM 823 O SER A 143 9.973 8.416 2.999 1.00 0.00 O ATOM 824 CB SER A 143 11.275 9.544 0.238 1.00 0.00 C ATOM 825 OG SER A 143 10.382 8.538 -0.215 1.00 0.00 O ATOM 0 H SER A 143 12.121 11.723 1.113 1.00 0.00 H new ATOM 0 HA SER A 143 9.680 10.398 1.414 1.00 0.00 H new ATOM 0 HB2 SER A 143 11.386 10.317 -0.522 1.00 0.00 H new ATOM 0 HB3 SER A 143 12.264 9.119 0.407 1.00 0.00 H new ATOM 0 HG SER A 143 10.724 8.147 -1.046 1.00 0.00 H new ATOM 831 N ALA A 144 12.046 9.081 3.279 1.00 0.00 N ATOM 832 CA ALA A 144 12.260 8.108 4.389 1.00 0.00 C ATOM 833 C ALA A 144 11.281 8.391 5.533 1.00 0.00 C ATOM 834 O ALA A 144 11.071 7.565 6.398 1.00 0.00 O ATOM 835 CB ALA A 144 13.693 8.233 4.905 1.00 0.00 C ATOM 0 H ALA A 144 12.852 9.663 3.052 1.00 0.00 H new ATOM 0 HA ALA A 144 12.089 7.098 4.015 1.00 0.00 H new ATOM 0 HB1 ALA A 144 13.851 7.522 5.716 1.00 0.00 H new ATOM 0 HB2 ALA A 144 14.391 8.020 4.095 1.00 0.00 H new ATOM 0 HB3 ALA A 144 13.861 9.246 5.272 1.00 0.00 H new ATOM 841 N GLY A 145 10.694 9.554 5.556 1.00 0.00 N ATOM 842 CA GLY A 145 9.744 9.887 6.659 1.00 0.00 C ATOM 843 C GLY A 145 8.527 8.952 6.622 1.00 0.00 C ATOM 844 O GLY A 145 8.426 8.023 7.398 1.00 0.00 O ATOM 0 H GLY A 145 10.829 10.289 4.861 1.00 0.00 H new ATOM 0 HA2 GLY A 145 10.249 9.798 7.621 1.00 0.00 H new ATOM 0 HA3 GLY A 145 9.417 10.923 6.565 1.00 0.00 H new ATOM 848 N TRP A 146 7.595 9.202 5.741 1.00 0.00 N ATOM 849 CA TRP A 146 6.371 8.344 5.670 1.00 0.00 C ATOM 850 C TRP A 146 6.749 6.866 5.511 1.00 0.00 C ATOM 851 O TRP A 146 6.007 5.985 5.898 1.00 0.00 O ATOM 852 CB TRP A 146 5.494 8.797 4.495 1.00 0.00 C ATOM 853 CG TRP A 146 6.185 8.528 3.193 1.00 0.00 C ATOM 854 CD1 TRP A 146 7.318 9.135 2.772 1.00 0.00 C ATOM 855 CD2 TRP A 146 5.793 7.611 2.131 1.00 0.00 C ATOM 856 NE1 TRP A 146 7.654 8.636 1.526 1.00 0.00 N ATOM 857 CE2 TRP A 146 6.744 7.696 1.088 1.00 0.00 C ATOM 858 CE3 TRP A 146 4.717 6.720 1.975 1.00 0.00 C ATOM 859 CZ2 TRP A 146 6.633 6.923 -0.068 1.00 0.00 C ATOM 860 CZ3 TRP A 146 4.602 5.941 0.811 1.00 0.00 C ATOM 861 CH2 TRP A 146 5.558 6.044 -0.207 1.00 0.00 C ATOM 0 H TRP A 146 7.627 9.965 5.065 1.00 0.00 H new ATOM 0 HA TRP A 146 5.813 8.452 6.600 1.00 0.00 H new ATOM 0 HB2 TRP A 146 4.539 8.272 4.522 1.00 0.00 H new ATOM 0 HB3 TRP A 146 5.276 9.861 4.585 1.00 0.00 H new ATOM 0 HD1 TRP A 146 7.870 9.886 3.318 1.00 0.00 H new ATOM 0 HE1 TRP A 146 8.475 8.928 0.996 1.00 0.00 H new ATOM 0 HE3 TRP A 146 3.974 6.634 2.754 1.00 0.00 H new ATOM 0 HZ2 TRP A 146 7.374 7.004 -0.850 1.00 0.00 H new ATOM 0 HZ3 TRP A 146 3.772 5.259 0.701 1.00 0.00 H new ATOM 0 HH2 TRP A 146 5.463 5.443 -1.100 1.00 0.00 H new ATOM 872 N LYS A 147 7.886 6.580 4.950 1.00 0.00 N ATOM 873 CA LYS A 147 8.288 5.155 4.776 1.00 0.00 C ATOM 874 C LYS A 147 8.178 4.411 6.114 1.00 0.00 C ATOM 875 O LYS A 147 7.622 3.330 6.193 1.00 0.00 O ATOM 876 CB LYS A 147 9.738 5.109 4.299 1.00 0.00 C ATOM 877 CG LYS A 147 10.093 3.688 3.869 1.00 0.00 C ATOM 878 CD LYS A 147 11.602 3.593 3.652 1.00 0.00 C ATOM 879 CE LYS A 147 11.940 2.296 2.917 1.00 0.00 C ATOM 880 NZ LYS A 147 13.304 2.410 2.330 1.00 0.00 N ATOM 0 H LYS A 147 8.556 7.267 4.604 1.00 0.00 H new ATOM 0 HA LYS A 147 7.632 4.679 4.047 1.00 0.00 H new ATOM 0 HB2 LYS A 147 9.879 5.797 3.466 1.00 0.00 H new ATOM 0 HB3 LYS A 147 10.404 5.435 5.098 1.00 0.00 H new ATOM 0 HG2 LYS A 147 9.777 2.975 4.630 1.00 0.00 H new ATOM 0 HG3 LYS A 147 9.564 3.430 2.951 1.00 0.00 H new ATOM 0 HD2 LYS A 147 11.950 4.450 3.075 1.00 0.00 H new ATOM 0 HD3 LYS A 147 12.119 3.623 4.611 1.00 0.00 H new ATOM 0 HE2 LYS A 147 11.896 1.452 3.605 1.00 0.00 H new ATOM 0 HE3 LYS A 147 11.208 2.107 2.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 13.541 1.530 1.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 13.329 3.207 1.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 13.996 2.572 3.089 1.00 0.00 H new ATOM 894 N ASN A 148 8.716 4.975 7.161 1.00 0.00 N ATOM 895 CA ASN A 148 8.662 4.301 8.494 1.00 0.00 C ATOM 896 C ASN A 148 7.211 4.051 8.916 1.00 0.00 C ATOM 897 O ASN A 148 6.891 3.025 9.480 1.00 0.00 O ATOM 898 CB ASN A 148 9.345 5.191 9.540 1.00 0.00 C ATOM 899 CG ASN A 148 10.864 5.082 9.403 1.00 0.00 C ATOM 900 OD1 ASN A 148 11.365 4.164 8.780 1.00 0.00 O ATOM 901 ND2 ASN A 148 11.628 5.980 9.966 1.00 0.00 N ATOM 0 H ASN A 148 9.193 5.877 7.153 1.00 0.00 H new ATOM 0 HA ASN A 148 9.176 3.343 8.422 1.00 0.00 H new ATOM 0 HB2 ASN A 148 9.033 6.227 9.409 1.00 0.00 H new ATOM 0 HB3 ASN A 148 9.039 4.890 10.542 1.00 0.00 H new ATOM 0 HD21 ASN A 148 12.642 5.911 9.883 1.00 0.00 H new ATOM 0 HD22 ASN A 148 11.210 6.750 10.488 1.00 0.00 H new ATOM 908 N SER A 149 6.335 4.985 8.676 1.00 0.00 N ATOM 909 CA SER A 149 4.914 4.803 9.091 1.00 0.00 C ATOM 910 C SER A 149 4.312 3.539 8.476 1.00 0.00 C ATOM 911 O SER A 149 3.788 2.696 9.170 1.00 0.00 O ATOM 912 CB SER A 149 4.101 6.012 8.643 1.00 0.00 C ATOM 913 OG SER A 149 4.077 6.069 7.224 1.00 0.00 O ATOM 0 H SER A 149 6.540 5.869 8.210 1.00 0.00 H new ATOM 0 HA SER A 149 4.885 4.704 10.176 1.00 0.00 H new ATOM 0 HB2 SER A 149 3.085 5.944 9.032 1.00 0.00 H new ATOM 0 HB3 SER A 149 4.537 6.926 9.047 1.00 0.00 H new ATOM 0 HG SER A 149 4.995 6.116 6.883 1.00 0.00 H new ATOM 919 N ILE A 150 4.351 3.414 7.183 1.00 0.00 N ATOM 920 CA ILE A 150 3.744 2.214 6.536 1.00 0.00 C ATOM 921 C ILE A 150 4.416 0.929 7.031 1.00 0.00 C ATOM 922 O ILE A 150 3.763 -0.070 7.259 1.00 0.00 O ATOM 923 CB ILE A 150 3.873 2.338 5.017 1.00 0.00 C ATOM 924 CG1 ILE A 150 3.127 3.596 4.561 1.00 0.00 C ATOM 925 CG2 ILE A 150 3.260 1.108 4.344 1.00 0.00 C ATOM 926 CD1 ILE A 150 3.417 3.864 3.084 1.00 0.00 C ATOM 0 H ILE A 150 4.775 4.087 6.544 1.00 0.00 H new ATOM 0 HA ILE A 150 2.689 2.161 6.804 1.00 0.00 H new ATOM 0 HB ILE A 150 4.925 2.407 4.740 1.00 0.00 H new ATOM 0 HG12 ILE A 150 2.055 3.469 4.713 1.00 0.00 H new ATOM 0 HG13 ILE A 150 3.436 4.451 5.163 1.00 0.00 H new ATOM 0 HG21 ILE A 150 3.354 1.200 3.262 1.00 0.00 H new ATOM 0 HG22 ILE A 150 3.783 0.212 4.678 1.00 0.00 H new ATOM 0 HG23 ILE A 150 2.206 1.034 4.612 1.00 0.00 H new ATOM 0 HD11 ILE A 150 2.884 4.760 2.765 1.00 0.00 H new ATOM 0 HD12 ILE A 150 4.488 4.010 2.944 1.00 0.00 H new ATOM 0 HD13 ILE A 150 3.086 3.013 2.488 1.00 0.00 H new ATOM 938 N ARG A 151 5.708 0.932 7.201 1.00 0.00 N ATOM 939 CA ARG A 151 6.387 -0.306 7.683 1.00 0.00 C ATOM 940 C ARG A 151 5.691 -0.809 8.955 1.00 0.00 C ATOM 941 O ARG A 151 5.455 -1.990 9.116 1.00 0.00 O ATOM 942 CB ARG A 151 7.858 0.008 7.982 1.00 0.00 C ATOM 943 CG ARG A 151 8.612 -1.280 8.336 1.00 0.00 C ATOM 944 CD ARG A 151 10.019 -0.918 8.823 1.00 0.00 C ATOM 945 NE ARG A 151 10.815 -2.158 9.047 1.00 0.00 N ATOM 946 CZ ARG A 151 12.115 -2.086 9.172 1.00 0.00 C ATOM 947 NH1 ARG A 151 12.715 -0.926 9.105 1.00 0.00 N ATOM 948 NH2 ARG A 151 12.814 -3.170 9.368 1.00 0.00 N ATOM 0 H ARG A 151 6.320 1.730 7.029 1.00 0.00 H new ATOM 0 HA ARG A 151 6.332 -1.079 6.917 1.00 0.00 H new ATOM 0 HB2 ARG A 151 8.320 0.482 7.116 1.00 0.00 H new ATOM 0 HB3 ARG A 151 7.926 0.717 8.807 1.00 0.00 H new ATOM 0 HG2 ARG A 151 8.076 -1.829 9.110 1.00 0.00 H new ATOM 0 HG3 ARG A 151 8.672 -1.933 7.465 1.00 0.00 H new ATOM 0 HD2 ARG A 151 10.516 -0.285 8.088 1.00 0.00 H new ATOM 0 HD3 ARG A 151 9.956 -0.344 9.748 1.00 0.00 H new ATOM 0 HE ARG A 151 10.346 -3.062 9.103 1.00 0.00 H new ATOM 0 HH11 ARG A 151 12.169 -0.077 8.955 1.00 0.00 H new ATOM 0 HH12 ARG A 151 13.729 -0.870 9.202 1.00 0.00 H new ATOM 0 HH21 ARG A 151 12.347 -4.075 9.424 1.00 0.00 H new ATOM 0 HH22 ARG A 151 13.828 -3.113 9.465 1.00 0.00 H new ATOM 962 N HIS A 152 5.378 0.078 9.863 1.00 0.00 N ATOM 963 CA HIS A 152 4.713 -0.346 11.134 1.00 0.00 C ATOM 964 C HIS A 152 3.240 -0.720 10.904 1.00 0.00 C ATOM 965 O HIS A 152 2.725 -1.628 11.524 1.00 0.00 O ATOM 966 CB HIS A 152 4.806 0.788 12.163 1.00 0.00 C ATOM 967 CG HIS A 152 3.645 1.737 12.014 1.00 0.00 C ATOM 968 ND1 HIS A 152 3.794 3.008 11.481 1.00 0.00 N ATOM 969 CD2 HIS A 152 2.318 1.621 12.345 1.00 0.00 C ATOM 970 CE1 HIS A 152 2.587 3.605 11.511 1.00 0.00 C ATOM 971 NE2 HIS A 152 1.657 2.802 12.029 1.00 0.00 N ATOM 0 H HIS A 152 5.554 1.079 9.781 1.00 0.00 H new ATOM 0 HA HIS A 152 5.228 -1.231 11.507 1.00 0.00 H new ATOM 0 HB2 HIS A 152 4.815 0.372 13.170 1.00 0.00 H new ATOM 0 HB3 HIS A 152 5.743 1.329 12.032 1.00 0.00 H new ATOM 0 HD1 HIS A 152 4.660 3.417 11.130 1.00 0.00 H new ATOM 0 HD2 HIS A 152 1.859 0.747 12.783 1.00 0.00 H new ATOM 0 HE1 HIS A 152 2.396 4.608 11.160 1.00 0.00 H new ATOM 980 N ASN A 153 2.549 -0.017 10.049 1.00 0.00 N ATOM 981 CA ASN A 153 1.106 -0.334 9.835 1.00 0.00 C ATOM 982 C ASN A 153 0.967 -1.755 9.288 1.00 0.00 C ATOM 983 O ASN A 153 0.119 -2.509 9.719 1.00 0.00 O ATOM 984 CB ASN A 153 0.506 0.677 8.851 1.00 0.00 C ATOM 985 CG ASN A 153 0.450 2.058 9.513 1.00 0.00 C ATOM 986 OD1 ASN A 153 1.270 2.993 9.120 1.00 0.00 O flip ATOM 987 ND2 ASN A 153 -0.349 2.287 10.400 1.00 0.00 N flip ATOM 0 H ASN A 153 2.915 0.756 9.494 1.00 0.00 H new ATOM 0 HA ASN A 153 0.570 -0.270 10.782 1.00 0.00 H new ATOM 0 HB2 ASN A 153 1.109 0.720 7.944 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -0.495 0.363 8.554 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -0.991 1.557 10.709 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -0.377 3.209 10.835 1.00 0.00 H new ATOM 994 N LEU A 154 1.795 -2.138 8.364 1.00 0.00 N ATOM 995 CA LEU A 154 1.706 -3.523 7.828 1.00 0.00 C ATOM 996 C LEU A 154 1.922 -4.523 8.972 1.00 0.00 C ATOM 997 O LEU A 154 1.357 -5.600 8.986 1.00 0.00 O ATOM 998 CB LEU A 154 2.757 -3.707 6.740 1.00 0.00 C ATOM 999 CG LEU A 154 2.471 -2.707 5.618 1.00 0.00 C ATOM 1000 CD1 LEU A 154 3.633 -2.707 4.625 1.00 0.00 C ATOM 1001 CD2 LEU A 154 1.166 -3.091 4.894 1.00 0.00 C ATOM 0 H LEU A 154 2.528 -1.557 7.956 1.00 0.00 H new ATOM 0 HA LEU A 154 0.721 -3.698 7.395 1.00 0.00 H new ATOM 0 HB2 LEU A 154 3.756 -3.546 7.146 1.00 0.00 H new ATOM 0 HB3 LEU A 154 2.730 -4.727 6.355 1.00 0.00 H new ATOM 0 HG LEU A 154 2.360 -1.710 6.044 1.00 0.00 H new ATOM 0 HD11 LEU A 154 3.429 -1.994 3.826 1.00 0.00 H new ATOM 0 HD12 LEU A 154 4.551 -2.422 5.139 1.00 0.00 H new ATOM 0 HD13 LEU A 154 3.749 -3.704 4.201 1.00 0.00 H new ATOM 0 HD21 LEU A 154 0.968 -2.375 4.096 1.00 0.00 H new ATOM 0 HD22 LEU A 154 1.266 -4.090 4.469 1.00 0.00 H new ATOM 0 HD23 LEU A 154 0.339 -3.080 5.604 1.00 0.00 H new ATOM 1013 N SER A 155 2.726 -4.162 9.941 1.00 0.00 N ATOM 1014 CA SER A 155 2.968 -5.073 11.097 1.00 0.00 C ATOM 1015 C SER A 155 1.783 -4.976 12.056 1.00 0.00 C ATOM 1016 O SER A 155 1.217 -5.968 12.469 1.00 0.00 O ATOM 1017 CB SER A 155 4.239 -4.640 11.834 1.00 0.00 C ATOM 1018 OG SER A 155 5.383 -5.121 11.142 1.00 0.00 O ATOM 0 H SER A 155 3.225 -3.273 9.979 1.00 0.00 H new ATOM 0 HA SER A 155 3.084 -6.096 10.740 1.00 0.00 H new ATOM 0 HB2 SER A 155 4.276 -3.553 11.906 1.00 0.00 H new ATOM 0 HB3 SER A 155 4.229 -5.027 12.853 1.00 0.00 H new ATOM 0 HG SER A 155 6.194 -4.840 11.616 1.00 0.00 H new ATOM 1024 N LEU A 156 1.409 -3.777 12.406 1.00 0.00 N ATOM 1025 CA LEU A 156 0.263 -3.587 13.335 1.00 0.00 C ATOM 1026 C LEU A 156 -1.046 -3.797 12.570 1.00 0.00 C ATOM 1027 O LEU A 156 -1.068 -3.791 11.355 1.00 0.00 O ATOM 1028 CB LEU A 156 0.336 -2.177 13.929 1.00 0.00 C ATOM 1029 CG LEU A 156 1.686 -2.003 14.644 1.00 0.00 C ATOM 1030 CD1 LEU A 156 1.753 -0.632 15.326 1.00 0.00 C ATOM 1031 CD2 LEU A 156 1.859 -3.105 15.698 1.00 0.00 C ATOM 0 H LEU A 156 1.852 -2.916 12.086 1.00 0.00 H new ATOM 0 HA LEU A 156 0.304 -4.311 14.149 1.00 0.00 H new ATOM 0 HB2 LEU A 156 0.228 -1.431 13.142 1.00 0.00 H new ATOM 0 HB3 LEU A 156 -0.484 -2.021 14.630 1.00 0.00 H new ATOM 0 HG LEU A 156 2.485 -2.073 13.906 1.00 0.00 H new ATOM 0 HD11 LEU A 156 2.714 -0.522 15.828 1.00 0.00 H new ATOM 0 HD12 LEU A 156 1.643 0.153 14.577 1.00 0.00 H new ATOM 0 HD13 LEU A 156 0.950 -0.550 16.058 1.00 0.00 H new ATOM 0 HD21 LEU A 156 2.817 -2.979 16.203 1.00 0.00 H new ATOM 0 HD22 LEU A 156 1.053 -3.040 16.428 1.00 0.00 H new ATOM 0 HD23 LEU A 156 1.831 -4.080 15.213 1.00 0.00 H new ATOM 1043 N HIS A 157 -2.125 -4.024 13.271 1.00 0.00 N ATOM 1044 CA HIS A 157 -3.426 -4.278 12.585 1.00 0.00 C ATOM 1045 C HIS A 157 -3.370 -5.663 11.933 1.00 0.00 C ATOM 1046 O HIS A 157 -2.955 -5.812 10.799 1.00 0.00 O ATOM 1047 CB HIS A 157 -3.687 -3.213 11.510 1.00 0.00 C ATOM 1048 CG HIS A 157 -3.216 -1.869 11.995 1.00 0.00 C ATOM 1049 ND1 HIS A 157 -3.149 -1.315 13.250 1.00 0.00 N flip ATOM 1050 CD2 HIS A 157 -2.741 -0.897 11.125 1.00 0.00 C flip ATOM 1051 CE1 HIS A 157 -2.646 -0.022 13.158 1.00 0.00 C flip ATOM 1052 NE2 HIS A 157 -2.416 0.183 11.862 1.00 0.00 N flip ATOM 0 H HIS A 157 -2.162 -4.045 14.290 1.00 0.00 H new ATOM 0 HA HIS A 157 -4.235 -4.234 13.315 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -3.168 -3.479 10.589 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -4.751 -3.173 11.277 1.00 0.00 H new ATOM 0 HD1 HIS A 157 -3.425 -1.780 14.115 1.00 0.00 H new ATOM 0 HD2 HIS A 157 -2.649 -0.990 10.053 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -2.477 0.672 13.968 1.00 0.00 H new ATOM 1061 N SER A 158 -3.777 -6.679 12.646 1.00 0.00 N ATOM 1062 CA SER A 158 -3.743 -8.058 12.077 1.00 0.00 C ATOM 1063 C SER A 158 -4.449 -8.060 10.718 1.00 0.00 C ATOM 1064 O SER A 158 -4.423 -9.034 9.990 1.00 0.00 O ATOM 1065 CB SER A 158 -4.468 -9.015 13.025 1.00 0.00 C ATOM 1066 OG SER A 158 -5.839 -9.090 12.654 1.00 0.00 O ATOM 0 H SER A 158 -4.132 -6.613 13.600 1.00 0.00 H new ATOM 0 HA SER A 158 -2.709 -8.379 11.954 1.00 0.00 H new ATOM 0 HB2 SER A 158 -4.012 -10.004 12.981 1.00 0.00 H new ATOM 0 HB3 SER A 158 -4.376 -8.667 14.054 1.00 0.00 H new ATOM 0 HG SER A 158 -6.308 -9.703 13.257 1.00 0.00 H new ATOM 1072 N LYS A 159 -5.082 -6.973 10.383 1.00 0.00 N ATOM 1073 CA LYS A 159 -5.805 -6.881 9.084 1.00 0.00 C ATOM 1074 C LYS A 159 -4.904 -7.353 7.946 1.00 0.00 C ATOM 1075 O LYS A 159 -5.342 -8.025 7.034 1.00 0.00 O ATOM 1076 CB LYS A 159 -6.202 -5.421 8.850 1.00 0.00 C ATOM 1077 CG LYS A 159 -6.892 -5.274 7.494 1.00 0.00 C ATOM 1078 CD LYS A 159 -7.343 -3.822 7.311 1.00 0.00 C ATOM 1079 CE LYS A 159 -8.375 -3.739 6.187 1.00 0.00 C ATOM 1080 NZ LYS A 159 -9.580 -4.532 6.561 1.00 0.00 N ATOM 0 H LYS A 159 -5.130 -6.133 10.960 1.00 0.00 H new ATOM 0 HA LYS A 159 -6.692 -7.514 9.113 1.00 0.00 H new ATOM 0 HB2 LYS A 159 -6.869 -5.086 9.644 1.00 0.00 H new ATOM 0 HB3 LYS A 159 -5.317 -4.785 8.887 1.00 0.00 H new ATOM 0 HG2 LYS A 159 -6.210 -5.559 6.693 1.00 0.00 H new ATOM 0 HG3 LYS A 159 -7.750 -5.944 7.435 1.00 0.00 H new ATOM 0 HD2 LYS A 159 -7.772 -3.445 8.239 1.00 0.00 H new ATOM 0 HD3 LYS A 159 -6.485 -3.192 7.077 1.00 0.00 H new ATOM 0 HE2 LYS A 159 -8.651 -2.700 6.008 1.00 0.00 H new ATOM 0 HE3 LYS A 159 -7.949 -4.120 5.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 -10.436 -3.972 6.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 -9.609 -5.406 5.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 -9.537 -4.772 7.572 1.00 0.00 H new ATOM 1094 N PHE A 160 -3.653 -7.001 7.981 1.00 0.00 N ATOM 1095 CA PHE A 160 -2.738 -7.431 6.889 1.00 0.00 C ATOM 1096 C PHE A 160 -2.041 -8.725 7.288 1.00 0.00 C ATOM 1097 O PHE A 160 -1.307 -8.779 8.256 1.00 0.00 O ATOM 1098 CB PHE A 160 -1.697 -6.342 6.642 1.00 0.00 C ATOM 1099 CG PHE A 160 -2.405 -5.032 6.383 1.00 0.00 C ATOM 1100 CD1 PHE A 160 -3.365 -4.946 5.368 1.00 0.00 C ATOM 1101 CD2 PHE A 160 -2.107 -3.904 7.160 1.00 0.00 C ATOM 1102 CE1 PHE A 160 -4.026 -3.738 5.129 1.00 0.00 C ATOM 1103 CE2 PHE A 160 -2.770 -2.696 6.918 1.00 0.00 C ATOM 1104 CZ PHE A 160 -3.728 -2.613 5.902 1.00 0.00 C ATOM 0 H PHE A 160 -3.224 -6.437 8.714 1.00 0.00 H new ATOM 0 HA PHE A 160 -3.312 -7.598 5.977 1.00 0.00 H new ATOM 0 HB2 PHE A 160 -1.038 -6.249 7.505 1.00 0.00 H new ATOM 0 HB3 PHE A 160 -1.071 -6.606 5.790 1.00 0.00 H new ATOM 0 HD1 PHE A 160 -3.595 -5.814 4.769 1.00 0.00 H new ATOM 0 HD2 PHE A 160 -1.367 -3.967 7.944 1.00 0.00 H new ATOM 0 HE1 PHE A 160 -4.768 -3.674 4.346 1.00 0.00 H new ATOM 0 HE2 PHE A 160 -2.542 -1.826 7.516 1.00 0.00 H new ATOM 0 HZ PHE A 160 -4.237 -1.679 5.715 1.00 0.00 H new ATOM 1114 N ILE A 161 -2.264 -9.772 6.545 1.00 0.00 N ATOM 1115 CA ILE A 161 -1.618 -11.067 6.873 1.00 0.00 C ATOM 1116 C ILE A 161 -0.335 -11.212 6.057 1.00 0.00 C ATOM 1117 O ILE A 161 -0.265 -10.833 4.904 1.00 0.00 O ATOM 1118 CB ILE A 161 -2.589 -12.214 6.564 1.00 0.00 C ATOM 1119 CG1 ILE A 161 -2.908 -12.228 5.064 1.00 0.00 C ATOM 1120 CG2 ILE A 161 -3.882 -12.011 7.363 1.00 0.00 C ATOM 1121 CD1 ILE A 161 -4.127 -13.118 4.801 1.00 0.00 C ATOM 0 H ILE A 161 -2.868 -9.784 5.723 1.00 0.00 H new ATOM 0 HA ILE A 161 -1.365 -11.100 7.933 1.00 0.00 H new ATOM 0 HB ILE A 161 -2.133 -13.164 6.843 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -3.104 -11.214 4.715 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -2.049 -12.597 4.504 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -4.575 -12.824 7.146 1.00 0.00 H new ATOM 0 HG22 ILE A 161 -3.654 -12.003 8.429 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -4.338 -11.061 7.083 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -4.349 -13.124 3.734 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -3.914 -14.134 5.133 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -4.986 -12.730 5.348 1.00 0.00 H new ATOM 1133 N LYS A 162 0.686 -11.745 6.664 1.00 0.00 N ATOM 1134 CA LYS A 162 1.988 -11.909 5.962 1.00 0.00 C ATOM 1135 C LYS A 162 1.914 -13.134 5.047 1.00 0.00 C ATOM 1136 O LYS A 162 1.313 -14.136 5.382 1.00 0.00 O ATOM 1137 CB LYS A 162 3.081 -12.111 7.019 1.00 0.00 C ATOM 1138 CG LYS A 162 4.473 -11.955 6.395 1.00 0.00 C ATOM 1139 CD LYS A 162 4.800 -10.465 6.200 1.00 0.00 C ATOM 1140 CE LYS A 162 6.318 -10.278 6.064 1.00 0.00 C ATOM 1141 NZ LYS A 162 6.896 -9.950 7.398 1.00 0.00 N ATOM 0 H LYS A 162 0.674 -12.078 7.628 1.00 0.00 H new ATOM 0 HA LYS A 162 2.213 -11.029 5.359 1.00 0.00 H new ATOM 0 HB2 LYS A 162 2.954 -11.387 7.824 1.00 0.00 H new ATOM 0 HB3 LYS A 162 2.985 -13.101 7.464 1.00 0.00 H new ATOM 0 HG2 LYS A 162 5.222 -12.419 7.037 1.00 0.00 H new ATOM 0 HG3 LYS A 162 4.510 -12.472 5.436 1.00 0.00 H new ATOM 0 HD2 LYS A 162 4.297 -10.086 5.310 1.00 0.00 H new ATOM 0 HD3 LYS A 162 4.428 -9.888 7.047 1.00 0.00 H new ATOM 0 HE2 LYS A 162 6.774 -11.187 5.671 1.00 0.00 H new ATOM 0 HE3 LYS A 162 6.535 -9.480 5.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 7.924 -9.823 7.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 6.468 -9.072 7.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 6.699 -10.726 8.062 1.00 0.00 H new ATOM 1155 N VAL A 163 2.517 -13.057 3.889 1.00 0.00 N ATOM 1156 CA VAL A 163 2.483 -14.208 2.940 1.00 0.00 C ATOM 1157 C VAL A 163 3.857 -14.867 2.895 1.00 0.00 C ATOM 1158 O VAL A 163 4.862 -14.211 2.701 1.00 0.00 O ATOM 1159 CB VAL A 163 2.137 -13.696 1.545 1.00 0.00 C ATOM 1160 CG1 VAL A 163 2.200 -14.846 0.535 1.00 0.00 C ATOM 1161 CG2 VAL A 163 0.728 -13.094 1.548 1.00 0.00 C ATOM 0 H VAL A 163 3.034 -12.242 3.559 1.00 0.00 H new ATOM 0 HA VAL A 163 1.736 -14.930 3.270 1.00 0.00 H new ATOM 0 HB VAL A 163 2.858 -12.929 1.261 1.00 0.00 H new ATOM 0 HG11 VAL A 163 1.952 -14.472 -0.458 1.00 0.00 H new ATOM 0 HG12 VAL A 163 3.206 -15.266 0.524 1.00 0.00 H new ATOM 0 HG13 VAL A 163 1.487 -15.620 0.820 1.00 0.00 H new ATOM 0 HG21 VAL A 163 0.486 -12.730 0.550 1.00 0.00 H new ATOM 0 HG22 VAL A 163 0.007 -13.857 1.841 1.00 0.00 H new ATOM 0 HG23 VAL A 163 0.688 -12.266 2.256 1.00 0.00 H new ATOM 1171 N HIS A 164 3.919 -16.157 3.064 1.00 0.00 N ATOM 1172 CA HIS A 164 5.239 -16.839 3.021 1.00 0.00 C ATOM 1173 C HIS A 164 5.698 -16.982 1.569 1.00 0.00 C ATOM 1174 O HIS A 164 5.573 -18.026 0.956 1.00 0.00 O ATOM 1175 CB HIS A 164 5.137 -18.218 3.687 1.00 0.00 C ATOM 1176 CG HIS A 164 4.323 -19.152 2.832 1.00 0.00 C ATOM 1177 ND1 HIS A 164 3.091 -18.793 2.303 1.00 0.00 N ATOM 1178 CD2 HIS A 164 4.546 -20.445 2.421 1.00 0.00 C ATOM 1179 CE1 HIS A 164 2.622 -19.851 1.615 1.00 0.00 C ATOM 1180 NE2 HIS A 164 3.470 -20.881 1.658 1.00 0.00 N ATOM 0 H HIS A 164 3.117 -16.765 3.229 1.00 0.00 H new ATOM 0 HA HIS A 164 5.971 -16.242 3.565 1.00 0.00 H new ATOM 0 HB2 HIS A 164 6.134 -18.630 3.840 1.00 0.00 H new ATOM 0 HB3 HIS A 164 4.678 -18.121 4.671 1.00 0.00 H new ATOM 0 HD2 HIS A 164 5.422 -21.031 2.655 1.00 0.00 H new ATOM 0 HE1 HIS A 164 1.677 -19.865 1.093 1.00 0.00 H new ATOM 0 HE2 HIS A 164 3.353 -21.796 1.222 1.00 0.00 H new ATOM 1189 N ASN A 165 6.241 -15.936 1.014 1.00 0.00 N ATOM 1190 CA ASN A 165 6.721 -15.999 -0.393 1.00 0.00 C ATOM 1191 C ASN A 165 7.839 -17.029 -0.492 1.00 0.00 C ATOM 1192 O ASN A 165 8.775 -17.012 0.285 1.00 0.00 O ATOM 1193 CB ASN A 165 7.269 -14.631 -0.800 1.00 0.00 C ATOM 1194 CG ASN A 165 7.682 -14.664 -2.272 1.00 0.00 C ATOM 1195 OD1 ASN A 165 7.812 -15.722 -2.854 1.00 0.00 O ATOM 1196 ND2 ASN A 165 7.893 -13.541 -2.903 1.00 0.00 N ATOM 0 H ASN A 165 6.373 -15.037 1.476 1.00 0.00 H new ATOM 0 HA ASN A 165 5.898 -16.278 -1.050 1.00 0.00 H new ATOM 0 HB2 ASN A 165 6.513 -13.862 -0.641 1.00 0.00 H new ATOM 0 HB3 ASN A 165 8.125 -14.370 -0.177 1.00 0.00 H new ATOM 0 HD21 ASN A 165 8.167 -13.552 -3.885 1.00 0.00 H new ATOM 0 HD22 ASN A 165 7.784 -12.653 -2.414 1.00 0.00 H new ATOM 1203 N GLU A 166 7.770 -17.917 -1.440 1.00 0.00 N ATOM 1204 CA GLU A 166 8.853 -18.925 -1.569 1.00 0.00 C ATOM 1205 C GLU A 166 10.118 -18.191 -2.001 1.00 0.00 C ATOM 1206 O GLU A 166 11.221 -18.536 -1.623 1.00 0.00 O ATOM 1207 CB GLU A 166 8.478 -19.953 -2.638 1.00 0.00 C ATOM 1208 CG GLU A 166 7.129 -20.585 -2.291 1.00 0.00 C ATOM 1209 CD GLU A 166 6.805 -21.676 -3.312 1.00 0.00 C ATOM 1210 OE1 GLU A 166 7.737 -22.254 -3.846 1.00 0.00 O ATOM 1211 OE2 GLU A 166 5.631 -21.915 -3.543 1.00 0.00 O ATOM 0 H GLU A 166 7.018 -17.989 -2.125 1.00 0.00 H new ATOM 0 HA GLU A 166 9.006 -19.442 -0.621 1.00 0.00 H new ATOM 0 HB2 GLU A 166 8.426 -19.474 -3.616 1.00 0.00 H new ATOM 0 HB3 GLU A 166 9.246 -20.723 -2.702 1.00 0.00 H new ATOM 0 HG2 GLU A 166 7.160 -21.008 -1.287 1.00 0.00 H new ATOM 0 HG3 GLU A 166 6.347 -19.825 -2.293 1.00 0.00 H new ATOM 1218 N ALA A 167 9.948 -17.169 -2.791 1.00 0.00 N ATOM 1219 CA ALA A 167 11.103 -16.372 -3.271 1.00 0.00 C ATOM 1220 C ALA A 167 11.731 -15.624 -2.098 1.00 0.00 C ATOM 1221 O ALA A 167 11.608 -14.420 -1.985 1.00 0.00 O ATOM 1222 CB ALA A 167 10.621 -15.363 -4.314 1.00 0.00 C ATOM 0 H ALA A 167 9.040 -16.849 -3.129 1.00 0.00 H new ATOM 0 HA ALA A 167 11.844 -17.037 -3.716 1.00 0.00 H new ATOM 0 HB1 ALA A 167 11.467 -14.775 -4.670 1.00 0.00 H new ATOM 0 HB2 ALA A 167 10.170 -15.894 -5.152 1.00 0.00 H new ATOM 0 HB3 ALA A 167 9.882 -14.700 -3.864 1.00 0.00 H new ATOM 1228 N THR A 168 12.403 -16.319 -1.228 1.00 0.00 N ATOM 1229 CA THR A 168 13.037 -15.635 -0.064 1.00 0.00 C ATOM 1230 C THR A 168 13.800 -14.413 -0.570 1.00 0.00 C ATOM 1231 O THR A 168 13.768 -13.354 0.027 1.00 0.00 O ATOM 1232 CB THR A 168 14.014 -16.589 0.631 1.00 0.00 C ATOM 1233 OG1 THR A 168 13.343 -17.795 0.965 1.00 0.00 O ATOM 1234 CG2 THR A 168 14.549 -15.927 1.900 1.00 0.00 C ATOM 0 H THR A 168 12.542 -17.329 -1.269 1.00 0.00 H new ATOM 0 HA THR A 168 12.268 -15.332 0.647 1.00 0.00 H new ATOM 0 HB THR A 168 14.845 -16.815 -0.038 1.00 0.00 H new ATOM 0 HG1 THR A 168 13.969 -18.406 1.408 1.00 0.00 H new ATOM 0 HG21 THR A 168 15.245 -16.603 2.397 1.00 0.00 H new ATOM 0 HG22 THR A 168 15.065 -15.003 1.639 1.00 0.00 H new ATOM 0 HG23 THR A 168 13.720 -15.702 2.570 1.00 0.00 H new ATOM 1242 N GLY A 169 14.478 -14.548 -1.676 1.00 0.00 N ATOM 1243 CA GLY A 169 15.233 -13.393 -2.231 1.00 0.00 C ATOM 1244 C GLY A 169 14.260 -12.248 -2.508 1.00 0.00 C ATOM 1245 O GLY A 169 14.642 -11.094 -2.546 1.00 0.00 O ATOM 0 H GLY A 169 14.541 -15.409 -2.219 1.00 0.00 H new ATOM 0 HA2 GLY A 169 16.001 -13.072 -1.527 1.00 0.00 H new ATOM 0 HA3 GLY A 169 15.744 -13.683 -3.149 1.00 0.00 H new ATOM 1249 N LYS A 170 13.001 -12.552 -2.705 1.00 0.00 N ATOM 1250 CA LYS A 170 12.007 -11.472 -2.977 1.00 0.00 C ATOM 1251 C LYS A 170 11.272 -11.115 -1.684 1.00 0.00 C ATOM 1252 O LYS A 170 11.092 -11.943 -0.812 1.00 0.00 O ATOM 1253 CB LYS A 170 10.989 -11.929 -4.025 1.00 0.00 C ATOM 1254 CG LYS A 170 10.247 -10.693 -4.543 1.00 0.00 C ATOM 1255 CD LYS A 170 9.159 -11.096 -5.539 1.00 0.00 C ATOM 1256 CE LYS A 170 8.602 -9.839 -6.222 1.00 0.00 C ATOM 1257 NZ LYS A 170 8.163 -10.179 -7.605 1.00 0.00 N ATOM 0 H LYS A 170 12.621 -13.498 -2.689 1.00 0.00 H new ATOM 0 HA LYS A 170 12.538 -10.599 -3.357 1.00 0.00 H new ATOM 0 HB2 LYS A 170 11.492 -12.442 -4.845 1.00 0.00 H new ATOM 0 HB3 LYS A 170 10.286 -12.639 -3.588 1.00 0.00 H new ATOM 0 HG2 LYS A 170 9.801 -10.153 -3.708 1.00 0.00 H new ATOM 0 HG3 LYS A 170 10.952 -10.013 -5.022 1.00 0.00 H new ATOM 0 HD2 LYS A 170 9.568 -11.778 -6.285 1.00 0.00 H new ATOM 0 HD3 LYS A 170 8.359 -11.629 -5.025 1.00 0.00 H new ATOM 0 HE2 LYS A 170 7.763 -9.442 -5.650 1.00 0.00 H new ATOM 0 HE3 LYS A 170 9.364 -9.060 -6.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 170 7.634 -9.379 -8.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 170 8.996 -10.376 -8.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 170 7.552 -11.020 -7.578 1.00 0.00 H new ATOM 1271 N SER A 171 10.847 -9.889 -1.554 1.00 0.00 N ATOM 1272 CA SER A 171 10.124 -9.476 -0.320 1.00 0.00 C ATOM 1273 C SER A 171 8.830 -10.287 -0.187 1.00 0.00 C ATOM 1274 O SER A 171 8.274 -10.762 -1.160 1.00 0.00 O ATOM 1275 CB SER A 171 9.800 -7.981 -0.397 1.00 0.00 C ATOM 1276 OG SER A 171 8.687 -7.695 0.437 1.00 0.00 O ATOM 0 H SER A 171 10.970 -9.154 -2.251 1.00 0.00 H new ATOM 0 HA SER A 171 10.751 -9.663 0.552 1.00 0.00 H new ATOM 0 HB2 SER A 171 10.663 -7.394 -0.084 1.00 0.00 H new ATOM 0 HB3 SER A 171 9.579 -7.698 -1.426 1.00 0.00 H new ATOM 0 HG SER A 171 8.578 -6.724 0.516 1.00 0.00 H new ATOM 1282 N SER A 172 8.359 -10.461 1.017 1.00 0.00 N ATOM 1283 CA SER A 172 7.112 -11.253 1.235 1.00 0.00 C ATOM 1284 C SER A 172 5.923 -10.558 0.570 1.00 0.00 C ATOM 1285 O SER A 172 5.935 -9.364 0.347 1.00 0.00 O ATOM 1286 CB SER A 172 6.851 -11.373 2.737 1.00 0.00 C ATOM 1287 OG SER A 172 8.040 -11.809 3.385 1.00 0.00 O ATOM 0 H SER A 172 8.786 -10.087 1.865 1.00 0.00 H new ATOM 0 HA SER A 172 7.235 -12.243 0.796 1.00 0.00 H new ATOM 0 HB2 SER A 172 6.534 -10.412 3.141 1.00 0.00 H new ATOM 0 HB3 SER A 172 6.042 -12.079 2.922 1.00 0.00 H new ATOM 0 HG SER A 172 7.813 -12.456 4.085 1.00 0.00 H new ATOM 1293 N TRP A 173 4.889 -11.298 0.258 1.00 0.00 N ATOM 1294 CA TRP A 173 3.695 -10.674 -0.385 1.00 0.00 C ATOM 1295 C TRP A 173 2.731 -10.182 0.701 1.00 0.00 C ATOM 1296 O TRP A 173 2.540 -10.828 1.711 1.00 0.00 O ATOM 1297 CB TRP A 173 2.971 -11.703 -1.260 1.00 0.00 C ATOM 1298 CG TRP A 173 3.882 -12.219 -2.320 1.00 0.00 C ATOM 1299 CD1 TRP A 173 4.530 -13.403 -2.283 1.00 0.00 C ATOM 1300 CD2 TRP A 173 4.243 -11.597 -3.573 1.00 0.00 C ATOM 1301 NE1 TRP A 173 5.263 -13.549 -3.448 1.00 0.00 N ATOM 1302 CE2 TRP A 173 5.120 -12.453 -4.275 1.00 0.00 C ATOM 1303 CE3 TRP A 173 3.889 -10.380 -4.156 1.00 0.00 C ATOM 1304 CZ2 TRP A 173 5.632 -12.104 -5.525 1.00 0.00 C ATOM 1305 CZ3 TRP A 173 4.399 -10.019 -5.415 1.00 0.00 C ATOM 1306 CH2 TRP A 173 5.270 -10.882 -6.099 1.00 0.00 C ATOM 0 H TRP A 173 4.821 -12.303 0.420 1.00 0.00 H new ATOM 0 HA TRP A 173 4.023 -9.838 -1.003 1.00 0.00 H new ATOM 0 HB2 TRP A 173 2.617 -12.529 -0.643 1.00 0.00 H new ATOM 0 HB3 TRP A 173 2.093 -11.247 -1.717 1.00 0.00 H new ATOM 0 HD1 TRP A 173 4.484 -14.119 -1.476 1.00 0.00 H new ATOM 0 HE1 TRP A 173 5.836 -14.363 -3.668 1.00 0.00 H new ATOM 0 HE3 TRP A 173 3.219 -9.711 -3.637 1.00 0.00 H new ATOM 0 HZ2 TRP A 173 6.302 -12.772 -6.045 1.00 0.00 H new ATOM 0 HZ3 TRP A 173 4.120 -9.074 -5.858 1.00 0.00 H new ATOM 0 HH2 TRP A 173 5.660 -10.602 -7.067 1.00 0.00 H new ATOM 1317 N TRP A 174 2.112 -9.053 0.499 1.00 0.00 N ATOM 1318 CA TRP A 174 1.148 -8.545 1.520 1.00 0.00 C ATOM 1319 C TRP A 174 -0.273 -8.925 1.093 1.00 0.00 C ATOM 1320 O TRP A 174 -0.643 -8.792 -0.060 1.00 0.00 O ATOM 1321 CB TRP A 174 1.274 -7.023 1.643 1.00 0.00 C ATOM 1322 CG TRP A 174 2.485 -6.699 2.463 1.00 0.00 C ATOM 1323 CD1 TRP A 174 3.606 -6.106 1.992 1.00 0.00 C ATOM 1324 CD2 TRP A 174 2.720 -6.949 3.881 1.00 0.00 C ATOM 1325 NE1 TRP A 174 4.513 -5.978 3.028 1.00 0.00 N ATOM 1326 CE2 TRP A 174 4.015 -6.482 4.210 1.00 0.00 C ATOM 1327 CE3 TRP A 174 1.944 -7.533 4.907 1.00 0.00 C ATOM 1328 CZ2 TRP A 174 4.522 -6.585 5.506 1.00 0.00 C ATOM 1329 CZ3 TRP A 174 2.455 -7.636 6.210 1.00 0.00 C ATOM 1330 CH2 TRP A 174 3.741 -7.166 6.509 1.00 0.00 C ATOM 0 H TRP A 174 2.229 -8.461 -0.323 1.00 0.00 H new ATOM 0 HA TRP A 174 1.368 -8.990 2.490 1.00 0.00 H new ATOM 0 HB2 TRP A 174 1.357 -6.571 0.655 1.00 0.00 H new ATOM 0 HB3 TRP A 174 0.381 -6.608 2.110 1.00 0.00 H new ATOM 0 HD1 TRP A 174 3.766 -5.785 0.973 1.00 0.00 H new ATOM 0 HE1 TRP A 174 5.439 -5.561 2.929 1.00 0.00 H new ATOM 0 HE3 TRP A 174 0.953 -7.902 4.688 1.00 0.00 H new ATOM 0 HZ2 TRP A 174 5.512 -6.218 5.733 1.00 0.00 H new ATOM 0 HZ3 TRP A 174 1.853 -8.081 6.988 1.00 0.00 H new ATOM 0 HH2 TRP A 174 4.128 -7.253 7.513 1.00 0.00 H new ATOM 1341 N MET A 175 -1.062 -9.411 2.015 1.00 0.00 N ATOM 1342 CA MET A 175 -2.459 -9.821 1.681 1.00 0.00 C ATOM 1343 C MET A 175 -3.431 -9.257 2.723 1.00 0.00 C ATOM 1344 O MET A 175 -3.103 -9.119 3.883 1.00 0.00 O ATOM 1345 CB MET A 175 -2.554 -11.355 1.698 1.00 0.00 C ATOM 1346 CG MET A 175 -2.241 -11.917 0.309 1.00 0.00 C ATOM 1347 SD MET A 175 -3.702 -11.761 -0.752 1.00 0.00 S ATOM 1348 CE MET A 175 -4.662 -13.133 -0.061 1.00 0.00 C ATOM 0 H MET A 175 -0.797 -9.542 2.991 1.00 0.00 H new ATOM 0 HA MET A 175 -2.717 -9.437 0.694 1.00 0.00 H new ATOM 0 HB2 MET A 175 -1.856 -11.762 2.429 1.00 0.00 H new ATOM 0 HB3 MET A 175 -3.553 -11.662 2.006 1.00 0.00 H new ATOM 0 HG2 MET A 175 -1.400 -11.380 -0.131 1.00 0.00 H new ATOM 0 HG3 MET A 175 -1.945 -12.963 0.387 1.00 0.00 H new ATOM 0 HE1 MET A 175 -4.987 -13.792 -0.866 1.00 0.00 H new ATOM 0 HE2 MET A 175 -4.043 -13.694 0.639 1.00 0.00 H new ATOM 0 HE3 MET A 175 -5.535 -12.740 0.461 1.00 0.00 H new ATOM 1358 N LEU A 176 -4.634 -8.953 2.316 1.00 0.00 N ATOM 1359 CA LEU A 176 -5.642 -8.430 3.280 1.00 0.00 C ATOM 1360 C LEU A 176 -6.234 -9.607 4.060 1.00 0.00 C ATOM 1361 O LEU A 176 -6.038 -10.753 3.708 1.00 0.00 O ATOM 1362 CB LEU A 176 -6.758 -7.714 2.516 1.00 0.00 C ATOM 1363 CG LEU A 176 -6.146 -6.710 1.534 1.00 0.00 C ATOM 1364 CD1 LEU A 176 -7.255 -5.876 0.885 1.00 0.00 C ATOM 1365 CD2 LEU A 176 -5.184 -5.786 2.287 1.00 0.00 C ATOM 0 H LEU A 176 -4.962 -9.045 1.355 1.00 0.00 H new ATOM 0 HA LEU A 176 -5.169 -7.728 3.966 1.00 0.00 H new ATOM 0 HB2 LEU A 176 -7.367 -8.440 1.977 1.00 0.00 H new ATOM 0 HB3 LEU A 176 -7.418 -7.199 3.214 1.00 0.00 H new ATOM 0 HG LEU A 176 -5.603 -7.249 0.758 1.00 0.00 H new ATOM 0 HD11 LEU A 176 -6.814 -5.164 0.188 1.00 0.00 H new ATOM 0 HD12 LEU A 176 -7.938 -6.534 0.348 1.00 0.00 H new ATOM 0 HD13 LEU A 176 -7.803 -5.336 1.657 1.00 0.00 H new ATOM 0 HD21 LEU A 176 -4.747 -5.070 1.591 1.00 0.00 H new ATOM 0 HD22 LEU A 176 -5.728 -5.250 3.064 1.00 0.00 H new ATOM 0 HD23 LEU A 176 -4.391 -6.379 2.743 1.00 0.00 H new ATOM 1377 N ASN A 177 -6.967 -9.341 5.106 1.00 0.00 N ATOM 1378 CA ASN A 177 -7.575 -10.461 5.877 1.00 0.00 C ATOM 1379 C ASN A 177 -8.434 -11.286 4.913 1.00 0.00 C ATOM 1380 O ASN A 177 -8.691 -10.866 3.802 1.00 0.00 O ATOM 1381 CB ASN A 177 -8.447 -9.886 7.009 1.00 0.00 C ATOM 1382 CG ASN A 177 -8.007 -10.467 8.356 1.00 0.00 C ATOM 1383 OD1 ASN A 177 -6.830 -10.626 8.608 1.00 0.00 O ATOM 1384 ND2 ASN A 177 -8.913 -10.793 9.239 1.00 0.00 N ATOM 0 H ASN A 177 -7.170 -8.405 5.458 1.00 0.00 H new ATOM 0 HA ASN A 177 -6.803 -11.091 6.319 1.00 0.00 H new ATOM 0 HB2 ASN A 177 -8.363 -8.799 7.028 1.00 0.00 H new ATOM 0 HB3 ASN A 177 -9.496 -10.122 6.827 1.00 0.00 H new ATOM 0 HD21 ASN A 177 -8.631 -11.181 10.139 1.00 0.00 H new ATOM 0 HD22 ASN A 177 -9.902 -10.660 9.028 1.00 0.00 H new ATOM 1391 N PRO A 178 -8.874 -12.451 5.314 1.00 0.00 N ATOM 1392 CA PRO A 178 -9.710 -13.323 4.438 1.00 0.00 C ATOM 1393 C PRO A 178 -11.037 -12.649 4.068 1.00 0.00 C ATOM 1394 O PRO A 178 -11.920 -13.263 3.503 1.00 0.00 O ATOM 1395 CB PRO A 178 -9.960 -14.590 5.274 1.00 0.00 C ATOM 1396 CG PRO A 178 -8.983 -14.536 6.408 1.00 0.00 C ATOM 1397 CD PRO A 178 -8.639 -13.063 6.630 1.00 0.00 C ATOM 0 HA PRO A 178 -9.213 -13.536 3.492 1.00 0.00 H new ATOM 0 HB2 PRO A 178 -10.985 -14.618 5.643 1.00 0.00 H new ATOM 0 HB3 PRO A 178 -9.813 -15.488 4.675 1.00 0.00 H new ATOM 0 HG2 PRO A 178 -9.414 -14.972 7.309 1.00 0.00 H new ATOM 0 HG3 PRO A 178 -8.087 -15.110 6.173 1.00 0.00 H new ATOM 0 HD2 PRO A 178 -9.269 -12.616 7.399 1.00 0.00 H new ATOM 0 HD3 PRO A 178 -7.605 -12.937 6.952 1.00 0.00 H new ATOM 1405 N GLU A 179 -11.179 -11.387 4.389 1.00 0.00 N ATOM 1406 CA GLU A 179 -12.439 -10.663 4.068 1.00 0.00 C ATOM 1407 C GLU A 179 -12.142 -9.558 3.047 1.00 0.00 C ATOM 1408 O GLU A 179 -11.071 -8.980 3.039 1.00 0.00 O ATOM 1409 CB GLU A 179 -13.013 -10.063 5.359 1.00 0.00 C ATOM 1410 CG GLU A 179 -12.459 -8.652 5.594 1.00 0.00 C ATOM 1411 CD GLU A 179 -12.799 -8.205 7.017 1.00 0.00 C ATOM 1412 OE1 GLU A 179 -13.886 -8.522 7.472 1.00 0.00 O ATOM 1413 OE2 GLU A 179 -11.969 -7.552 7.626 1.00 0.00 O ATOM 0 H GLU A 179 -10.470 -10.827 4.862 1.00 0.00 H new ATOM 0 HA GLU A 179 -13.170 -11.349 3.639 1.00 0.00 H new ATOM 0 HB2 GLU A 179 -14.101 -10.026 5.297 1.00 0.00 H new ATOM 0 HB3 GLU A 179 -12.764 -10.703 6.206 1.00 0.00 H new ATOM 0 HG2 GLU A 179 -11.379 -8.644 5.446 1.00 0.00 H new ATOM 0 HG3 GLU A 179 -12.885 -7.957 4.871 1.00 0.00 H new ATOM 1420 N GLY A 180 -13.078 -9.266 2.184 1.00 0.00 N ATOM 1421 CA GLY A 180 -12.852 -8.207 1.155 1.00 0.00 C ATOM 1422 C GLY A 180 -12.276 -6.953 1.816 1.00 0.00 C ATOM 1423 O GLY A 180 -11.232 -6.463 1.433 1.00 0.00 O ATOM 0 H GLY A 180 -13.993 -9.716 2.146 1.00 0.00 H new ATOM 0 HA2 GLY A 180 -12.168 -8.572 0.389 1.00 0.00 H new ATOM 0 HA3 GLY A 180 -13.791 -7.967 0.655 1.00 0.00 H new ATOM 1427 N GLY A 181 -12.951 -6.429 2.804 1.00 0.00 N ATOM 1428 CA GLY A 181 -12.446 -5.202 3.490 1.00 0.00 C ATOM 1429 C GLY A 181 -12.836 -3.962 2.681 1.00 0.00 C ATOM 1430 O GLY A 181 -13.130 -2.920 3.235 1.00 0.00 O ATOM 0 H GLY A 181 -13.831 -6.797 3.166 1.00 0.00 H new ATOM 0 HA2 GLY A 181 -12.862 -5.138 4.495 1.00 0.00 H new ATOM 0 HA3 GLY A 181 -11.362 -5.253 3.596 1.00 0.00 H new TER 1434 GLY A 181