USER MOD reduce.3.24.130724 H: found=0, std=0, add=1018, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1016 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 122 TYR OH : rot 150:sc= 0.47 USER MOD Set 1.2: A 126 GLN : amide:sc= -1.39! C(o=-0.92!,f=-3.1!) USER MOD Set 2.1: A 47 GLN :FLIP amide:sc= -1.98! C(o=-4!,f=-2.9!) USER MOD Set 2.2: A 100 MET CE :methyl -144:sc= -0.878 (180deg=-2.09!) USER MOD Set 3.1: A 55 THR OG1 : rot 180:sc= 0.066 USER MOD Set 3.2: A 56 GLN :FLIP amide:sc= -3.25! C(o=-6.7!,f=-3.2!) USER MOD Set 4.1: A 52 ASN : amide:sc= -2.53 K(o=-5.7,f=-13!) USER MOD Set 4.2: A 54 THR OG1 : rot 6:sc= -1.84 USER MOD Set 4.3: A 59 MET CE :methyl 169:sc= -1.33 (180deg=-0.0513) USER MOD Set 5.1: A 20 THR OG1 : rot 180:sc= 0 USER MOD Set 5.2: A 98 THR OG1 : rot -130:sc= 0.0064 USER MOD Single : A 1 MET CE :methyl 147:sc= 0 (180deg=-0.00436) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 CYS SG : rot 180:sc= 0.126 USER MOD Single : A 6 SER OG : rot 72:sc= 0.152 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= -0.0908 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 TYR OH : rot 180:sc= -0.567 USER MOD Single : A 16 ASN :FLIP amide:sc= -2.37 F(o=-4.2!,f=-2.4) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 135:sc= -2.91! (180deg=-5.63!) USER MOD Single : A 32 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.433) USER MOD Single : A 34 ASN : amide:sc= -2.96! C(o=-3!,f=-9.4!) USER MOD Single : A 42 ASN : amide:sc= -1.87 K(o=-1.9,f=-2.8!) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 156:sc= -0.33 (180deg=-1.63!) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 163:sc= -1.63! USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 HIS : no HE2:sc= -5.37! C(o=-5.4!,f=-11!) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.382 X(o=-0.38,f=-0.27) USER MOD Single : A 69 CYS SG : rot -118:sc= -6.58! USER MOD Single : A 72 LYS NZ :NH3+ 176:sc= -4.53! (180deg=-5.05!) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 THR OG1 : rot 139:sc= 0.0102 USER MOD Single : A 78 LYS NZ :NH3+ 155:sc= -0.156 (180deg=-0.919) USER MOD Single : A 81 GLN : amide:sc= -2.33 K(o=-2.3,f=-4.2!) USER MOD Single : A 82 GLN :FLIP amide:sc= -2.81! C(o=-5.6!,f=-2.8!) USER MOD Single : A 84 ASN :FLIP amide:sc= -3.85 F(o=-12!,f=-3.8) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 CYS SG : rot -52:sc= -0.208 USER MOD Single : A 107 ASN : amide:sc= 1.15 K(o=1.1,f=-0.85) USER MOD Single : A 110 LYS NZ :NH3+ 148:sc= -1.72! (180deg=-2.44!) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 143:sc= -0.246 (180deg=-1.18!) USER MOD Single : A 113 MET CE :methyl -162:sc= -0.276 (180deg=-1.27) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 124 GLN : amide:sc= -0.277 X(o=-0.28,f=-0.15) USER MOD Single : A 125 HIS : no HE2:sc= -3.11 K(o=-3.1,f=-4.4!) USER MOD Single : A 129 LYS NZ :NH3+ -123:sc= -1.42 (180deg=-3.74!) USER MOD Single : A 131 LYS NZ :NH3+ -156:sc= -0.187 (180deg=-1.06) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.148 -12.922 21.214 1.00 0.00 N ATOM 2 CA MET A 1 -14.065 -12.688 20.061 1.00 0.00 C ATOM 3 C MET A 1 -13.841 -13.768 19.010 1.00 0.00 C ATOM 4 O MET A 1 -12.732 -13.934 18.502 1.00 0.00 O ATOM 5 CB MET A 1 -13.783 -11.308 19.462 1.00 0.00 C ATOM 6 CG MET A 1 -14.982 -10.862 18.623 1.00 0.00 C ATOM 7 SD MET A 1 -15.095 -11.889 17.137 1.00 0.00 S ATOM 8 CE MET A 1 -13.968 -10.921 16.105 1.00 0.00 C ATOM 0 H1 MET A 1 -13.299 -12.186 21.933 1.00 0.00 H new ATOM 0 H2 MET A 1 -13.343 -13.856 21.628 1.00 0.00 H new ATOM 0 H3 MET A 1 -12.162 -12.888 20.886 1.00 0.00 H new ATOM 0 HA MET A 1 -15.101 -12.727 20.398 1.00 0.00 H new ATOM 0 HB2 MET A 1 -13.593 -10.587 20.257 1.00 0.00 H new ATOM 0 HB3 MET A 1 -12.886 -11.344 18.844 1.00 0.00 H new ATOM 0 HG2 MET A 1 -15.899 -10.946 19.206 1.00 0.00 H new ATOM 0 HG3 MET A 1 -14.875 -9.813 18.346 1.00 0.00 H new ATOM 0 HE1 MET A 1 -13.433 -11.586 15.427 1.00 0.00 H new ATOM 0 HE2 MET A 1 -14.538 -10.195 15.526 1.00 0.00 H new ATOM 0 HE3 MET A 1 -13.252 -10.398 16.739 1.00 0.00 H new ATOM 18 N GLY A 2 -14.901 -14.501 18.686 1.00 0.00 N ATOM 19 CA GLY A 2 -14.808 -15.563 17.691 1.00 0.00 C ATOM 20 C GLY A 2 -14.300 -16.855 18.321 1.00 0.00 C ATOM 21 O GLY A 2 -14.290 -17.000 19.544 1.00 0.00 O ATOM 0 H GLY A 2 -15.828 -14.381 19.094 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -15.787 -15.733 17.242 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -14.137 -15.257 16.888 1.00 0.00 H new ATOM 25 N CYS A 3 -13.878 -17.792 17.478 1.00 0.00 N ATOM 26 CA CYS A 3 -13.370 -19.070 17.964 1.00 0.00 C ATOM 27 C CYS A 3 -12.036 -18.878 18.679 1.00 0.00 C ATOM 28 O CYS A 3 -11.369 -19.849 19.038 1.00 0.00 O ATOM 29 CB CYS A 3 -13.190 -20.040 16.795 1.00 0.00 C ATOM 30 SG CYS A 3 -12.338 -19.196 15.437 1.00 0.00 S ATOM 0 H CYS A 3 -13.877 -17.692 16.463 1.00 0.00 H new ATOM 0 HA CYS A 3 -14.092 -19.482 18.669 1.00 0.00 H new ATOM 0 HB2 CYS A 3 -12.615 -20.909 17.115 1.00 0.00 H new ATOM 0 HB3 CYS A 3 -14.160 -20.405 16.459 1.00 0.00 H new ATOM 0 HG CYS A 3 -12.182 -20.020 14.444 1.00 0.00 H new ATOM 36 N GLY A 4 -11.654 -17.622 18.882 1.00 0.00 N ATOM 37 CA GLY A 4 -10.397 -17.315 19.555 1.00 0.00 C ATOM 38 C GLY A 4 -9.229 -17.368 18.577 1.00 0.00 C ATOM 39 O GLY A 4 -8.082 -17.571 18.976 1.00 0.00 O ATOM 0 H GLY A 4 -12.192 -16.805 18.593 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -10.454 -16.324 20.006 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -10.231 -18.025 20.365 1.00 0.00 H new ATOM 43 N ALA A 5 -9.527 -17.183 17.296 1.00 0.00 N ATOM 44 CA ALA A 5 -8.492 -17.211 16.269 1.00 0.00 C ATOM 45 C ALA A 5 -7.476 -16.098 16.502 1.00 0.00 C ATOM 46 O ALA A 5 -6.311 -16.219 16.123 1.00 0.00 O ATOM 47 CB ALA A 5 -9.124 -17.046 14.885 1.00 0.00 C ATOM 0 H ALA A 5 -10.470 -17.013 16.945 1.00 0.00 H new ATOM 0 HA ALA A 5 -7.980 -18.172 16.322 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -8.344 -17.068 14.124 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -9.828 -17.859 14.707 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -9.651 -16.093 14.837 1.00 0.00 H new ATOM 53 N SER A 6 -7.924 -15.015 17.128 1.00 0.00 N ATOM 54 CA SER A 6 -7.044 -13.886 17.406 1.00 0.00 C ATOM 55 C SER A 6 -6.409 -13.371 16.118 1.00 0.00 C ATOM 56 O SER A 6 -6.667 -13.895 15.034 1.00 0.00 O ATOM 57 CB SER A 6 -5.947 -14.308 18.384 1.00 0.00 C ATOM 58 OG SER A 6 -6.546 -14.875 19.543 1.00 0.00 O ATOM 0 H SER A 6 -8.884 -14.895 17.450 1.00 0.00 H new ATOM 0 HA SER A 6 -7.638 -13.087 17.849 1.00 0.00 H new ATOM 0 HB2 SER A 6 -5.282 -15.032 17.913 1.00 0.00 H new ATOM 0 HB3 SER A 6 -5.338 -13.447 18.659 1.00 0.00 H new ATOM 0 HG SER A 6 -6.910 -15.758 19.324 1.00 0.00 H new ATOM 64 N SER A 7 -5.577 -12.342 16.245 1.00 0.00 N ATOM 65 CA SER A 7 -4.910 -11.764 15.084 1.00 0.00 C ATOM 66 C SER A 7 -3.899 -12.747 14.502 1.00 0.00 C ATOM 67 O SER A 7 -3.494 -13.701 15.166 1.00 0.00 O ATOM 68 CB SER A 7 -4.196 -10.472 15.482 1.00 0.00 C ATOM 69 OG SER A 7 -3.027 -10.792 16.226 1.00 0.00 O ATOM 0 H SER A 7 -5.350 -11.894 17.133 1.00 0.00 H new ATOM 0 HA SER A 7 -5.664 -11.545 14.328 1.00 0.00 H new ATOM 0 HB2 SER A 7 -3.930 -9.901 14.592 1.00 0.00 H new ATOM 0 HB3 SER A 7 -4.860 -9.845 16.077 1.00 0.00 H new ATOM 0 HG SER A 7 -2.566 -9.966 16.481 1.00 0.00 H new ATOM 75 N GLU A 8 -3.498 -12.509 13.258 1.00 0.00 N ATOM 76 CA GLU A 8 -2.534 -13.381 12.596 1.00 0.00 C ATOM 77 C GLU A 8 -1.571 -12.565 11.742 1.00 0.00 C ATOM 78 O GLU A 8 -1.849 -11.416 11.401 1.00 0.00 O ATOM 79 CB GLU A 8 -3.267 -14.396 11.716 1.00 0.00 C ATOM 80 CG GLU A 8 -4.019 -13.660 10.606 1.00 0.00 C ATOM 81 CD GLU A 8 -4.897 -14.640 9.833 1.00 0.00 C ATOM 82 OE1 GLU A 8 -4.806 -15.826 10.103 1.00 0.00 O ATOM 83 OE2 GLU A 8 -5.647 -14.189 8.983 1.00 0.00 O ATOM 0 H GLU A 8 -3.822 -11.726 12.691 1.00 0.00 H new ATOM 0 HA GLU A 8 -1.964 -13.908 13.361 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -2.555 -15.099 11.283 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -3.964 -14.978 12.318 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -4.633 -12.868 11.035 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -3.310 -13.182 9.930 1.00 0.00 H new ATOM 90 N ASN A 9 -0.436 -13.167 11.398 1.00 0.00 N ATOM 91 CA ASN A 9 0.562 -12.485 10.583 1.00 0.00 C ATOM 92 C ASN A 9 0.167 -12.522 9.110 1.00 0.00 C ATOM 93 O ASN A 9 -0.602 -13.385 8.685 1.00 0.00 O ATOM 94 CB ASN A 9 1.927 -13.151 10.763 1.00 0.00 C ATOM 95 CG ASN A 9 2.353 -13.079 12.226 1.00 0.00 C ATOM 96 OD1 ASN A 9 2.112 -12.075 12.895 1.00 0.00 O ATOM 97 ND2 ASN A 9 2.974 -14.092 12.765 1.00 0.00 N ATOM 0 H ASN A 9 -0.186 -14.118 11.669 1.00 0.00 H new ATOM 0 HA ASN A 9 0.619 -11.446 10.907 1.00 0.00 H new ATOM 0 HB2 ASN A 9 1.879 -14.191 10.440 1.00 0.00 H new ATOM 0 HB3 ASN A 9 2.668 -12.656 10.135 1.00 0.00 H new ATOM 0 HD21 ASN A 9 3.261 -14.053 13.743 1.00 0.00 H new ATOM 0 HD22 ASN A 9 3.173 -14.923 12.208 1.00 0.00 H new ATOM 104 N SER A 10 0.696 -11.581 8.336 1.00 0.00 N ATOM 105 CA SER A 10 0.391 -11.515 6.912 1.00 0.00 C ATOM 106 C SER A 10 1.665 -11.294 6.101 1.00 0.00 C ATOM 107 O SER A 10 2.647 -10.750 6.605 1.00 0.00 O ATOM 108 CB SER A 10 -0.593 -10.379 6.640 1.00 0.00 C ATOM 109 OG SER A 10 0.038 -9.135 6.919 1.00 0.00 O ATOM 0 H SER A 10 1.334 -10.858 8.668 1.00 0.00 H new ATOM 0 HA SER A 10 -0.058 -12.462 6.612 1.00 0.00 H new ATOM 0 HB2 SER A 10 -0.922 -10.408 5.601 1.00 0.00 H new ATOM 0 HB3 SER A 10 -1.482 -10.496 7.260 1.00 0.00 H new ATOM 0 HG SER A 10 -0.590 -8.403 6.744 1.00 0.00 H new ATOM 115 N SER A 11 1.638 -11.717 4.841 1.00 0.00 N ATOM 116 CA SER A 11 2.795 -11.559 3.968 1.00 0.00 C ATOM 117 C SER A 11 2.656 -10.302 3.115 1.00 0.00 C ATOM 118 O SER A 11 2.190 -9.266 3.591 1.00 0.00 O ATOM 119 CB SER A 11 2.934 -12.780 3.058 1.00 0.00 C ATOM 120 OG SER A 11 1.804 -12.858 2.201 1.00 0.00 O ATOM 0 H SER A 11 0.834 -12.168 4.405 1.00 0.00 H new ATOM 0 HA SER A 11 3.685 -11.466 4.591 1.00 0.00 H new ATOM 0 HB2 SER A 11 3.848 -12.706 2.468 1.00 0.00 H new ATOM 0 HB3 SER A 11 3.014 -13.687 3.657 1.00 0.00 H new ATOM 0 HG SER A 11 1.891 -13.639 1.615 1.00 0.00 H new ATOM 126 N VAL A 12 3.060 -10.399 1.854 1.00 0.00 N ATOM 127 CA VAL A 12 2.980 -9.261 0.946 1.00 0.00 C ATOM 128 C VAL A 12 2.319 -9.670 -0.367 1.00 0.00 C ATOM 129 O VAL A 12 2.572 -10.755 -0.890 1.00 0.00 O ATOM 130 CB VAL A 12 4.381 -8.716 0.665 1.00 0.00 C ATOM 131 CG1 VAL A 12 4.272 -7.321 0.047 1.00 0.00 C ATOM 132 CG2 VAL A 12 5.166 -8.631 1.977 1.00 0.00 C ATOM 0 H VAL A 12 3.444 -11.248 1.439 1.00 0.00 H new ATOM 0 HA VAL A 12 2.377 -8.485 1.418 1.00 0.00 H new ATOM 0 HB VAL A 12 4.897 -9.381 -0.027 1.00 0.00 H new ATOM 0 HG11 VAL A 12 5.271 -6.933 -0.153 1.00 0.00 H new ATOM 0 HG12 VAL A 12 3.711 -7.379 -0.886 1.00 0.00 H new ATOM 0 HG13 VAL A 12 3.756 -6.656 0.739 1.00 0.00 H new ATOM 0 HG21 VAL A 12 6.165 -8.243 1.779 1.00 0.00 H new ATOM 0 HG22 VAL A 12 4.649 -7.966 2.668 1.00 0.00 H new ATOM 0 HG23 VAL A 12 5.244 -9.624 2.419 1.00 0.00 H new ATOM 142 N THR A 13 1.470 -8.793 -0.894 1.00 0.00 N ATOM 143 CA THR A 13 0.780 -9.073 -2.149 1.00 0.00 C ATOM 144 C THR A 13 0.780 -7.843 -3.050 1.00 0.00 C ATOM 145 O THR A 13 0.745 -6.709 -2.569 1.00 0.00 O ATOM 146 CB THR A 13 -0.662 -9.501 -1.867 1.00 0.00 C ATOM 147 OG1 THR A 13 -1.243 -10.014 -3.058 1.00 0.00 O ATOM 148 CG2 THR A 13 -1.468 -8.296 -1.381 1.00 0.00 C ATOM 0 H THR A 13 1.244 -7.890 -0.476 1.00 0.00 H new ATOM 0 HA THR A 13 1.307 -9.880 -2.658 1.00 0.00 H new ATOM 0 HB THR A 13 -0.669 -10.273 -1.097 1.00 0.00 H new ATOM 0 HG1 THR A 13 -2.166 -10.290 -2.879 1.00 0.00 H new ATOM 0 HG21 THR A 13 -2.495 -8.602 -1.181 1.00 0.00 H new ATOM 0 HG22 THR A 13 -1.021 -7.904 -0.467 1.00 0.00 H new ATOM 0 HG23 THR A 13 -1.463 -7.522 -2.148 1.00 0.00 H new ATOM 156 N TYR A 14 0.816 -8.074 -4.358 1.00 0.00 N ATOM 157 CA TYR A 14 0.816 -6.976 -5.318 1.00 0.00 C ATOM 158 C TYR A 14 -0.219 -7.226 -6.411 1.00 0.00 C ATOM 159 O TYR A 14 -0.726 -8.339 -6.557 1.00 0.00 O ATOM 160 CB TYR A 14 2.202 -6.832 -5.948 1.00 0.00 C ATOM 161 CG TYR A 14 3.203 -6.454 -4.883 1.00 0.00 C ATOM 162 CD1 TYR A 14 3.101 -5.217 -4.235 1.00 0.00 C ATOM 163 CD2 TYR A 14 4.232 -7.340 -4.543 1.00 0.00 C ATOM 164 CE1 TYR A 14 4.029 -4.866 -3.248 1.00 0.00 C ATOM 165 CE2 TYR A 14 5.160 -6.988 -3.556 1.00 0.00 C ATOM 166 CZ TYR A 14 5.059 -5.752 -2.908 1.00 0.00 C ATOM 167 OH TYR A 14 5.974 -5.406 -1.934 1.00 0.00 O ATOM 0 H TYR A 14 0.845 -9.004 -4.775 1.00 0.00 H new ATOM 0 HA TYR A 14 0.561 -6.056 -4.792 1.00 0.00 H new ATOM 0 HB2 TYR A 14 2.496 -7.768 -6.423 1.00 0.00 H new ATOM 0 HB3 TYR A 14 2.181 -6.072 -6.729 1.00 0.00 H new ATOM 0 HD1 TYR A 14 2.306 -4.534 -4.497 1.00 0.00 H new ATOM 0 HD2 TYR A 14 4.310 -8.295 -5.042 1.00 0.00 H new ATOM 0 HE1 TYR A 14 3.951 -3.912 -2.748 1.00 0.00 H new ATOM 0 HE2 TYR A 14 5.955 -7.671 -3.294 1.00 0.00 H new ATOM 0 HH TYR A 14 6.621 -6.133 -1.820 1.00 0.00 H new ATOM 177 N VAL A 15 -0.528 -6.185 -7.177 1.00 0.00 N ATOM 178 CA VAL A 15 -1.518 -6.303 -8.242 1.00 0.00 C ATOM 179 C VAL A 15 -1.092 -5.492 -9.462 1.00 0.00 C ATOM 180 O VAL A 15 -0.870 -6.043 -10.540 1.00 0.00 O ATOM 181 CB VAL A 15 -2.878 -5.808 -7.749 1.00 0.00 C ATOM 182 CG1 VAL A 15 -2.675 -4.784 -6.631 1.00 0.00 C ATOM 183 CG2 VAL A 15 -3.632 -5.154 -8.907 1.00 0.00 C ATOM 0 H VAL A 15 -0.112 -5.259 -7.082 1.00 0.00 H new ATOM 0 HA VAL A 15 -1.595 -7.353 -8.525 1.00 0.00 H new ATOM 0 HB VAL A 15 -3.455 -6.651 -7.369 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -3.645 -4.431 -6.280 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -2.137 -5.249 -5.805 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -2.098 -3.941 -7.010 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -4.602 -4.801 -8.556 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -3.055 -4.311 -9.287 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -3.778 -5.883 -9.704 1.00 0.00 H new ATOM 193 N ASN A 16 -0.982 -4.179 -9.285 1.00 0.00 N ATOM 194 CA ASN A 16 -0.594 -3.300 -10.381 1.00 0.00 C ATOM 195 C ASN A 16 0.794 -3.666 -10.899 1.00 0.00 C ATOM 196 O ASN A 16 1.100 -3.466 -12.075 1.00 0.00 O ATOM 197 CB ASN A 16 -0.598 -1.845 -9.909 1.00 0.00 C ATOM 198 CG ASN A 16 -2.028 -1.388 -9.641 1.00 0.00 C ATOM 199 OD1 ASN A 16 -2.338 -0.897 -8.472 1.00 0.00 O flip ATOM 200 ND2 ASN A 16 -2.885 -1.480 -10.519 1.00 0.00 N flip ATOM 0 H ASN A 16 -1.155 -3.703 -8.399 1.00 0.00 H new ATOM 0 HA ASN A 16 -1.313 -3.422 -11.191 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -0.000 -1.746 -9.003 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -0.139 -1.208 -10.665 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -2.641 -1.864 -11.432 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -3.840 -1.172 -10.334 1.00 0.00 H new ATOM 207 N GLY A 17 1.627 -4.202 -10.015 1.00 0.00 N ATOM 208 CA GLY A 17 2.981 -4.591 -10.395 1.00 0.00 C ATOM 209 C GLY A 17 3.819 -4.924 -9.166 1.00 0.00 C ATOM 210 O GLY A 17 3.443 -4.598 -8.041 1.00 0.00 O ATOM 0 H GLY A 17 1.392 -4.376 -9.038 1.00 0.00 H new ATOM 0 HA2 GLY A 17 2.942 -5.455 -11.058 1.00 0.00 H new ATOM 0 HA3 GLY A 17 3.453 -3.782 -10.953 1.00 0.00 H new ATOM 214 N ARG A 18 4.955 -5.576 -9.390 1.00 0.00 N ATOM 215 CA ARG A 18 5.840 -5.948 -8.291 1.00 0.00 C ATOM 216 C ARG A 18 6.916 -4.887 -8.089 1.00 0.00 C ATOM 217 O ARG A 18 7.267 -4.159 -9.017 1.00 0.00 O ATOM 218 CB ARG A 18 6.497 -7.298 -8.586 1.00 0.00 C ATOM 219 CG ARG A 18 5.556 -8.428 -8.162 1.00 0.00 C ATOM 220 CD ARG A 18 4.202 -8.249 -8.850 1.00 0.00 C ATOM 221 NE ARG A 18 4.388 -8.031 -10.280 1.00 0.00 N ATOM 222 CZ ARG A 18 3.363 -8.095 -11.124 1.00 0.00 C ATOM 223 NH1 ARG A 18 2.166 -8.358 -10.677 1.00 0.00 N ATOM 224 NH2 ARG A 18 3.554 -7.896 -12.399 1.00 0.00 N ATOM 0 H ARG A 18 5.283 -5.856 -10.314 1.00 0.00 H new ATOM 0 HA ARG A 18 5.247 -6.025 -7.379 1.00 0.00 H new ATOM 0 HB2 ARG A 18 6.724 -7.379 -9.649 1.00 0.00 H new ATOM 0 HB3 ARG A 18 7.443 -7.378 -8.051 1.00 0.00 H new ATOM 0 HG2 ARG A 18 5.986 -9.393 -8.428 1.00 0.00 H new ATOM 0 HG3 ARG A 18 5.429 -8.423 -7.079 1.00 0.00 H new ATOM 0 HD2 ARG A 18 3.584 -9.132 -8.687 1.00 0.00 H new ATOM 0 HD3 ARG A 18 3.672 -7.403 -8.412 1.00 0.00 H new ATOM 0 HE ARG A 18 5.321 -7.826 -10.639 1.00 0.00 H new ATOM 0 HH11 ARG A 18 2.017 -8.514 -9.680 1.00 0.00 H new ATOM 0 HH12 ARG A 18 1.379 -8.407 -11.324 1.00 0.00 H new ATOM 0 HH21 ARG A 18 4.490 -7.691 -12.749 1.00 0.00 H new ATOM 0 HH22 ARG A 18 2.767 -7.945 -13.046 1.00 0.00 H new ATOM 238 N PRO A 19 7.438 -4.790 -6.897 1.00 0.00 N ATOM 239 CA PRO A 19 8.494 -3.798 -6.556 1.00 0.00 C ATOM 240 C PRO A 19 9.868 -4.215 -7.077 1.00 0.00 C ATOM 241 O PRO A 19 10.291 -5.356 -6.896 1.00 0.00 O ATOM 242 CB PRO A 19 8.477 -3.765 -5.028 1.00 0.00 C ATOM 243 CG PRO A 19 7.986 -5.112 -4.605 1.00 0.00 C ATOM 244 CD PRO A 19 7.075 -5.629 -5.723 1.00 0.00 C ATOM 0 HA PRO A 19 8.304 -2.826 -7.011 1.00 0.00 H new ATOM 0 HB2 PRO A 19 9.472 -3.567 -4.629 1.00 0.00 H new ATOM 0 HB3 PRO A 19 7.822 -2.975 -4.660 1.00 0.00 H new ATOM 0 HG2 PRO A 19 8.821 -5.793 -4.442 1.00 0.00 H new ATOM 0 HG3 PRO A 19 7.441 -5.045 -3.663 1.00 0.00 H new ATOM 0 HD2 PRO A 19 7.246 -6.687 -5.920 1.00 0.00 H new ATOM 0 HD3 PRO A 19 6.022 -5.519 -5.463 1.00 0.00 H new ATOM 252 N THR A 20 10.557 -3.280 -7.724 1.00 0.00 N ATOM 253 CA THR A 20 11.885 -3.560 -8.262 1.00 0.00 C ATOM 254 C THR A 20 12.873 -3.833 -7.133 1.00 0.00 C ATOM 255 O THR A 20 13.826 -4.594 -7.300 1.00 0.00 O ATOM 256 CB THR A 20 12.371 -2.370 -9.093 1.00 0.00 C ATOM 257 OG1 THR A 20 11.410 -2.070 -10.096 1.00 0.00 O ATOM 258 CG2 THR A 20 13.707 -2.716 -9.751 1.00 0.00 C ATOM 0 H THR A 20 10.222 -2.330 -7.888 1.00 0.00 H new ATOM 0 HA THR A 20 11.823 -4.445 -8.896 1.00 0.00 H new ATOM 0 HB THR A 20 12.502 -1.504 -8.445 1.00 0.00 H new ATOM 0 HG1 THR A 20 11.719 -1.307 -10.628 1.00 0.00 H new ATOM 0 HG21 THR A 20 14.052 -1.868 -10.342 1.00 0.00 H new ATOM 0 HG22 THR A 20 14.444 -2.945 -8.981 1.00 0.00 H new ATOM 0 HG23 THR A 20 13.579 -3.583 -10.400 1.00 0.00 H new ATOM 266 N PHE A 21 12.640 -3.205 -5.985 1.00 0.00 N ATOM 267 CA PHE A 21 13.516 -3.386 -4.834 1.00 0.00 C ATOM 268 C PHE A 21 12.813 -4.193 -3.747 1.00 0.00 C ATOM 269 O PHE A 21 11.641 -3.958 -3.448 1.00 0.00 O ATOM 270 CB PHE A 21 13.931 -2.023 -4.274 1.00 0.00 C ATOM 271 CG PHE A 21 14.964 -2.215 -3.191 1.00 0.00 C ATOM 272 CD1 PHE A 21 16.305 -2.432 -3.533 1.00 0.00 C ATOM 273 CD2 PHE A 21 14.582 -2.177 -1.845 1.00 0.00 C ATOM 274 CE1 PHE A 21 17.263 -2.611 -2.527 1.00 0.00 C ATOM 275 CE2 PHE A 21 15.540 -2.356 -0.839 1.00 0.00 C ATOM 276 CZ PHE A 21 16.881 -2.573 -1.181 1.00 0.00 C ATOM 0 H PHE A 21 11.857 -2.570 -5.828 1.00 0.00 H new ATOM 0 HA PHE A 21 14.403 -3.931 -5.158 1.00 0.00 H new ATOM 0 HB2 PHE A 21 14.336 -1.399 -5.071 1.00 0.00 H new ATOM 0 HB3 PHE A 21 13.061 -1.503 -3.873 1.00 0.00 H new ATOM 0 HD1 PHE A 21 16.600 -2.461 -4.572 1.00 0.00 H new ATOM 0 HD2 PHE A 21 13.548 -2.010 -1.582 1.00 0.00 H new ATOM 0 HE1 PHE A 21 18.297 -2.778 -2.790 1.00 0.00 H new ATOM 0 HE2 PHE A 21 15.245 -2.327 0.200 1.00 0.00 H new ATOM 0 HZ PHE A 21 17.620 -2.711 -0.406 1.00 0.00 H new ATOM 286 N VAL A 22 13.533 -5.142 -3.160 1.00 0.00 N ATOM 287 CA VAL A 22 12.965 -5.980 -2.109 1.00 0.00 C ATOM 288 C VAL A 22 13.949 -6.133 -0.953 1.00 0.00 C ATOM 289 O VAL A 22 15.092 -6.547 -1.150 1.00 0.00 O ATOM 290 CB VAL A 22 12.617 -7.360 -2.672 1.00 0.00 C ATOM 291 CG1 VAL A 22 11.390 -7.913 -1.947 1.00 0.00 C ATOM 292 CG2 VAL A 22 12.313 -7.238 -4.166 1.00 0.00 C ATOM 0 H VAL A 22 14.504 -5.350 -3.391 1.00 0.00 H new ATOM 0 HA VAL A 22 12.059 -5.500 -1.738 1.00 0.00 H new ATOM 0 HB VAL A 22 13.460 -8.035 -2.525 1.00 0.00 H new ATOM 0 HG11 VAL A 22 11.143 -8.896 -2.348 1.00 0.00 H new ATOM 0 HG12 VAL A 22 11.605 -8.000 -0.882 1.00 0.00 H new ATOM 0 HG13 VAL A 22 10.546 -7.238 -2.093 1.00 0.00 H new ATOM 0 HG21 VAL A 22 12.065 -8.220 -4.568 1.00 0.00 H new ATOM 0 HG22 VAL A 22 11.470 -6.563 -4.312 1.00 0.00 H new ATOM 0 HG23 VAL A 22 13.187 -6.844 -4.684 1.00 0.00 H new ATOM 302 N GLY A 23 13.497 -5.797 0.250 1.00 0.00 N ATOM 303 CA GLY A 23 14.347 -5.902 1.430 1.00 0.00 C ATOM 304 C GLY A 23 13.985 -7.133 2.255 1.00 0.00 C ATOM 305 O GLY A 23 14.198 -8.265 1.823 1.00 0.00 O ATOM 0 H GLY A 23 12.555 -5.452 0.433 1.00 0.00 H new ATOM 0 HA2 GLY A 23 15.392 -5.958 1.126 1.00 0.00 H new ATOM 0 HA3 GLY A 23 14.240 -5.006 2.041 1.00 0.00 H new ATOM 309 N GLU A 24 13.437 -6.903 3.443 1.00 0.00 N ATOM 310 CA GLU A 24 13.041 -8.002 4.315 1.00 0.00 C ATOM 311 C GLU A 24 11.763 -7.654 5.072 1.00 0.00 C ATOM 312 O GLU A 24 10.901 -8.507 5.280 1.00 0.00 O ATOM 313 CB GLU A 24 14.160 -8.307 5.313 1.00 0.00 C ATOM 314 CG GLU A 24 14.317 -7.131 6.279 1.00 0.00 C ATOM 315 CD GLU A 24 13.439 -7.345 7.507 1.00 0.00 C ATOM 316 OE1 GLU A 24 12.582 -8.211 7.454 1.00 0.00 O ATOM 317 OE2 GLU A 24 13.638 -6.642 8.483 1.00 0.00 O ATOM 0 H GLU A 24 13.258 -5.973 3.822 1.00 0.00 H new ATOM 0 HA GLU A 24 12.855 -8.881 3.697 1.00 0.00 H new ATOM 0 HB2 GLU A 24 13.930 -9.218 5.866 1.00 0.00 H new ATOM 0 HB3 GLU A 24 15.096 -8.484 4.783 1.00 0.00 H new ATOM 0 HG2 GLU A 24 15.360 -7.034 6.580 1.00 0.00 H new ATOM 0 HG3 GLU A 24 14.041 -6.201 5.781 1.00 0.00 H new ATOM 324 N GLU A 25 11.649 -6.395 5.483 1.00 0.00 N ATOM 325 CA GLU A 25 10.459 -5.939 6.192 1.00 0.00 C ATOM 326 C GLU A 25 9.548 -5.150 5.258 1.00 0.00 C ATOM 327 O GLU A 25 9.982 -4.197 4.610 1.00 0.00 O ATOM 328 CB GLU A 25 10.862 -5.059 7.377 1.00 0.00 C ATOM 329 CG GLU A 25 9.640 -4.797 8.259 1.00 0.00 C ATOM 330 CD GLU A 25 9.227 -6.080 8.970 1.00 0.00 C ATOM 331 OE1 GLU A 25 10.080 -6.933 9.155 1.00 0.00 O ATOM 332 OE2 GLU A 25 8.064 -6.193 9.321 1.00 0.00 O ATOM 0 H GLU A 25 12.360 -5.678 5.339 1.00 0.00 H new ATOM 0 HA GLU A 25 9.919 -6.813 6.555 1.00 0.00 H new ATOM 0 HB2 GLU A 25 11.644 -5.549 7.957 1.00 0.00 H new ATOM 0 HB3 GLU A 25 11.274 -4.115 7.019 1.00 0.00 H new ATOM 0 HG2 GLU A 25 9.869 -4.023 8.991 1.00 0.00 H new ATOM 0 HG3 GLU A 25 8.815 -4.426 7.651 1.00 0.00 H new ATOM 339 N VAL A 26 8.283 -5.554 5.192 1.00 0.00 N ATOM 340 CA VAL A 26 7.324 -4.888 4.318 1.00 0.00 C ATOM 341 C VAL A 26 6.018 -4.622 5.060 1.00 0.00 C ATOM 342 O VAL A 26 5.464 -5.515 5.701 1.00 0.00 O ATOM 343 CB VAL A 26 7.049 -5.755 3.089 1.00 0.00 C ATOM 344 CG1 VAL A 26 6.528 -4.876 1.950 1.00 0.00 C ATOM 345 CG2 VAL A 26 8.344 -6.442 2.650 1.00 0.00 C ATOM 0 H VAL A 26 7.901 -6.333 5.729 1.00 0.00 H new ATOM 0 HA VAL A 26 7.749 -3.935 4.002 1.00 0.00 H new ATOM 0 HB VAL A 26 6.302 -6.509 3.337 1.00 0.00 H new ATOM 0 HG11 VAL A 26 6.332 -5.494 1.074 1.00 0.00 H new ATOM 0 HG12 VAL A 26 5.606 -4.385 2.262 1.00 0.00 H new ATOM 0 HG13 VAL A 26 7.275 -4.121 1.702 1.00 0.00 H new ATOM 0 HG21 VAL A 26 8.149 -7.060 1.774 1.00 0.00 H new ATOM 0 HG22 VAL A 26 9.090 -5.687 2.403 1.00 0.00 H new ATOM 0 HG23 VAL A 26 8.716 -7.068 3.461 1.00 0.00 H new ATOM 355 N THR A 27 5.532 -3.389 4.967 1.00 0.00 N ATOM 356 CA THR A 27 4.281 -3.019 5.618 1.00 0.00 C ATOM 357 C THR A 27 3.556 -1.947 4.813 1.00 0.00 C ATOM 358 O THR A 27 4.186 -1.071 4.219 1.00 0.00 O ATOM 359 CB THR A 27 4.561 -2.500 7.030 1.00 0.00 C ATOM 360 OG1 THR A 27 3.349 -2.039 7.612 1.00 0.00 O ATOM 361 CG2 THR A 27 5.567 -1.351 6.963 1.00 0.00 C ATOM 0 H THR A 27 5.982 -2.633 4.451 1.00 0.00 H new ATOM 0 HA THR A 27 3.647 -3.904 5.676 1.00 0.00 H new ATOM 0 HB THR A 27 4.973 -3.305 7.639 1.00 0.00 H new ATOM 0 HG1 THR A 27 3.526 -1.708 8.517 1.00 0.00 H new ATOM 0 HG21 THR A 27 5.766 -0.982 7.969 1.00 0.00 H new ATOM 0 HG22 THR A 27 6.496 -1.706 6.517 1.00 0.00 H new ATOM 0 HG23 THR A 27 5.158 -0.544 6.355 1.00 0.00 H new ATOM 369 N LYS A 28 2.229 -2.021 4.796 1.00 0.00 N ATOM 370 CA LYS A 28 1.430 -1.053 4.053 1.00 0.00 C ATOM 371 C LYS A 28 1.119 0.163 4.920 1.00 0.00 C ATOM 372 O LYS A 28 0.706 0.027 6.071 1.00 0.00 O ATOM 373 CB LYS A 28 0.124 -1.700 3.589 1.00 0.00 C ATOM 374 CG LYS A 28 -0.613 -2.283 4.795 1.00 0.00 C ATOM 375 CD LYS A 28 -1.840 -3.064 4.316 1.00 0.00 C ATOM 376 CE LYS A 28 -2.557 -3.677 5.520 1.00 0.00 C ATOM 377 NZ LYS A 28 -2.666 -2.660 6.604 1.00 0.00 N ATOM 0 H LYS A 28 1.688 -2.735 5.284 1.00 0.00 H new ATOM 0 HA LYS A 28 2.002 -0.728 3.184 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -0.502 -0.961 3.089 1.00 0.00 H new ATOM 0 HB3 LYS A 28 0.333 -2.485 2.863 1.00 0.00 H new ATOM 0 HG2 LYS A 28 0.051 -2.938 5.358 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -0.919 -1.483 5.469 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -2.516 -2.403 3.774 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -1.537 -3.848 3.622 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -3.549 -4.022 5.229 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -2.009 -4.549 5.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -3.627 -2.677 7.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -1.979 -2.877 7.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -2.468 -1.716 6.215 1.00 0.00 H new ATOM 391 N GLY A 29 1.321 1.350 4.358 1.00 0.00 N ATOM 392 CA GLY A 29 1.046 2.585 5.084 1.00 0.00 C ATOM 393 C GLY A 29 -0.431 2.684 5.450 1.00 0.00 C ATOM 394 O GLY A 29 -0.795 2.614 6.624 1.00 0.00 O ATOM 0 H GLY A 29 1.671 1.483 3.409 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.652 2.622 5.989 1.00 0.00 H new ATOM 0 HA3 GLY A 29 1.332 3.442 4.474 1.00 0.00 H new ATOM 398 N PHE A 30 -1.277 2.847 4.438 1.00 0.00 N ATOM 399 CA PHE A 30 -2.715 2.939 4.664 1.00 0.00 C ATOM 400 C PHE A 30 -3.353 1.555 4.643 1.00 0.00 C ATOM 401 O PHE A 30 -3.166 0.789 3.698 1.00 0.00 O ATOM 402 CB PHE A 30 -3.356 3.816 3.587 1.00 0.00 C ATOM 403 CG PHE A 30 -2.888 5.242 3.754 1.00 0.00 C ATOM 404 CD1 PHE A 30 -3.309 5.991 4.860 1.00 0.00 C ATOM 405 CD2 PHE A 30 -2.034 5.814 2.804 1.00 0.00 C ATOM 406 CE1 PHE A 30 -2.874 7.313 5.016 1.00 0.00 C ATOM 407 CE2 PHE A 30 -1.599 7.136 2.960 1.00 0.00 C ATOM 408 CZ PHE A 30 -2.020 7.886 4.066 1.00 0.00 C ATOM 0 H PHE A 30 -0.995 2.918 3.460 1.00 0.00 H new ATOM 0 HA PHE A 30 -2.882 3.386 5.644 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -3.088 3.448 2.597 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -4.442 3.767 3.662 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -3.969 5.549 5.592 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -1.711 5.236 1.951 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -3.197 7.891 5.869 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -0.939 7.577 2.228 1.00 0.00 H new ATOM 0 HZ PHE A 30 -1.686 8.906 4.186 1.00 0.00 H new ATOM 418 N GLU A 31 -4.106 1.240 5.692 1.00 0.00 N ATOM 419 CA GLU A 31 -4.766 -0.056 5.785 1.00 0.00 C ATOM 420 C GLU A 31 -5.814 -0.205 4.687 1.00 0.00 C ATOM 421 O GLU A 31 -6.078 -1.310 4.212 1.00 0.00 O ATOM 422 CB GLU A 31 -5.433 -0.205 7.154 1.00 0.00 C ATOM 423 CG GLU A 31 -4.362 -0.198 8.247 1.00 0.00 C ATOM 424 CD GLU A 31 -5.007 -0.420 9.611 1.00 0.00 C ATOM 425 OE1 GLU A 31 -6.224 -0.376 9.683 1.00 0.00 O ATOM 426 OE2 GLU A 31 -4.274 -0.633 10.562 1.00 0.00 O ATOM 0 H GLU A 31 -4.273 1.860 6.484 1.00 0.00 H new ATOM 0 HA GLU A 31 -4.014 -0.835 5.660 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -6.139 0.609 7.317 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -6.002 -1.134 7.194 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -3.627 -0.979 8.052 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -3.828 0.752 8.238 1.00 0.00 H new ATOM 433 N LYS A 32 -6.409 0.914 4.288 1.00 0.00 N ATOM 434 CA LYS A 32 -7.432 0.896 3.249 1.00 0.00 C ATOM 435 C LYS A 32 -6.836 0.450 1.918 1.00 0.00 C ATOM 436 O LYS A 32 -5.697 0.785 1.594 1.00 0.00 O ATOM 437 CB LYS A 32 -8.046 2.288 3.095 1.00 0.00 C ATOM 438 CG LYS A 32 -9.286 2.204 2.202 1.00 0.00 C ATOM 439 CD LYS A 32 -10.466 1.668 3.014 1.00 0.00 C ATOM 440 CE LYS A 32 -11.768 1.927 2.256 1.00 0.00 C ATOM 441 NZ LYS A 32 -11.653 1.386 0.872 1.00 0.00 N ATOM 0 H LYS A 32 -6.202 1.839 4.665 1.00 0.00 H new ATOM 0 HA LYS A 32 -8.208 0.188 3.542 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -8.315 2.688 4.072 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -7.317 2.972 2.660 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -9.525 3.189 1.800 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -9.091 1.552 1.351 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -10.343 0.600 3.192 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -10.499 2.152 3.990 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -12.603 1.455 2.774 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -11.976 2.996 2.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -12.602 1.281 0.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -11.093 2.040 0.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -11.183 0.459 0.900 1.00 0.00 H new ATOM 455 N ASP A 33 -7.614 -0.307 1.150 1.00 0.00 N ATOM 456 CA ASP A 33 -7.154 -0.785 -0.148 1.00 0.00 C ATOM 457 C ASP A 33 -6.064 -1.839 0.026 1.00 0.00 C ATOM 458 O ASP A 33 -5.682 -2.171 1.147 1.00 0.00 O ATOM 459 CB ASP A 33 -6.611 0.383 -0.973 1.00 0.00 C ATOM 460 CG ASP A 33 -7.469 1.623 -0.749 1.00 0.00 C ATOM 461 OD1 ASP A 33 -8.650 1.564 -1.050 1.00 0.00 O ATOM 462 OD2 ASP A 33 -6.934 2.614 -0.280 1.00 0.00 O ATOM 0 H ASP A 33 -8.558 -0.600 1.402 1.00 0.00 H new ATOM 0 HA ASP A 33 -7.999 -1.235 -0.670 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -5.579 0.589 -0.691 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -6.606 0.120 -2.031 1.00 0.00 H new ATOM 467 N ASN A 34 -5.568 -2.361 -1.091 1.00 0.00 N ATOM 468 CA ASN A 34 -4.526 -3.380 -1.049 1.00 0.00 C ATOM 469 C ASN A 34 -3.364 -2.923 -0.175 1.00 0.00 C ATOM 470 O ASN A 34 -2.705 -3.736 0.474 1.00 0.00 O ATOM 471 CB ASN A 34 -4.020 -3.669 -2.464 1.00 0.00 C ATOM 472 CG ASN A 34 -3.238 -2.471 -2.992 1.00 0.00 C ATOM 473 OD1 ASN A 34 -2.238 -2.069 -2.396 1.00 0.00 O ATOM 474 ND2 ASN A 34 -3.633 -1.875 -4.083 1.00 0.00 N ATOM 0 H ASN A 34 -5.868 -2.098 -2.030 1.00 0.00 H new ATOM 0 HA ASN A 34 -4.951 -4.289 -0.623 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -3.385 -4.555 -2.458 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -4.861 -3.884 -3.123 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -3.113 -1.075 -4.444 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -4.461 -2.209 -4.575 1.00 0.00 H new ATOM 481 N GLY A 35 -3.117 -1.617 -0.161 1.00 0.00 N ATOM 482 CA GLY A 35 -2.030 -1.063 0.637 1.00 0.00 C ATOM 483 C GLY A 35 -1.532 0.250 0.042 1.00 0.00 C ATOM 484 O GLY A 35 -0.871 1.038 0.718 1.00 0.00 O ATOM 0 H GLY A 35 -3.651 -0.927 -0.689 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -2.372 -0.897 1.659 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -1.209 -1.778 0.687 1.00 0.00 H new ATOM 488 N LEU A 36 -1.854 0.478 -1.227 1.00 0.00 N ATOM 489 CA LEU A 36 -1.438 1.700 -1.903 1.00 0.00 C ATOM 490 C LEU A 36 0.084 1.779 -1.980 1.00 0.00 C ATOM 491 O LEU A 36 0.663 1.721 -3.064 1.00 0.00 O ATOM 492 CB LEU A 36 -1.978 2.920 -1.154 1.00 0.00 C ATOM 493 CG LEU A 36 -3.454 2.703 -0.821 1.00 0.00 C ATOM 494 CD1 LEU A 36 -4.034 3.983 -0.216 1.00 0.00 C ATOM 495 CD2 LEU A 36 -4.218 2.354 -2.101 1.00 0.00 C ATOM 0 H LEU A 36 -2.398 -0.163 -1.804 1.00 0.00 H new ATOM 0 HA LEU A 36 -1.841 1.688 -2.916 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.408 3.080 -0.239 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -1.860 3.816 -1.764 1.00 0.00 H new ATOM 0 HG LEU A 36 -3.549 1.887 -0.105 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -5.087 3.829 0.022 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.490 4.234 0.694 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -3.940 4.799 -0.932 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -5.271 2.199 -1.865 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -4.123 3.171 -2.816 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -3.805 1.443 -2.534 1.00 0.00 H new ATOM 507 N LEU A 37 0.725 1.914 -0.823 1.00 0.00 N ATOM 508 CA LEU A 37 2.179 2.015 -0.774 1.00 0.00 C ATOM 509 C LEU A 37 2.751 1.041 0.252 1.00 0.00 C ATOM 510 O LEU A 37 2.256 0.945 1.374 1.00 0.00 O ATOM 511 CB LEU A 37 2.592 3.442 -0.409 1.00 0.00 C ATOM 512 CG LEU A 37 4.108 3.586 -0.550 1.00 0.00 C ATOM 513 CD1 LEU A 37 4.469 3.773 -2.025 1.00 0.00 C ATOM 514 CD2 LEU A 37 4.581 4.804 0.246 1.00 0.00 C ATOM 0 H LEU A 37 0.265 1.956 0.086 1.00 0.00 H new ATOM 0 HA LEU A 37 2.574 1.762 -1.758 1.00 0.00 H new ATOM 0 HB2 LEU A 37 2.086 4.156 -1.059 1.00 0.00 H new ATOM 0 HB3 LEU A 37 2.288 3.670 0.613 1.00 0.00 H new ATOM 0 HG LEU A 37 4.594 2.689 -0.167 1.00 0.00 H new ATOM 0 HD11 LEU A 37 5.550 3.876 -2.125 1.00 0.00 H new ATOM 0 HD12 LEU A 37 4.133 2.907 -2.595 1.00 0.00 H new ATOM 0 HD13 LEU A 37 3.982 4.670 -2.408 1.00 0.00 H new ATOM 0 HD21 LEU A 37 5.661 4.907 0.146 1.00 0.00 H new ATOM 0 HD22 LEU A 37 4.094 5.701 -0.137 1.00 0.00 H new ATOM 0 HD23 LEU A 37 4.325 4.673 1.297 1.00 0.00 H new ATOM 526 N PHE A 38 3.797 0.323 -0.143 1.00 0.00 N ATOM 527 CA PHE A 38 4.441 -0.629 0.755 1.00 0.00 C ATOM 528 C PHE A 38 5.812 -0.116 1.183 1.00 0.00 C ATOM 529 O PHE A 38 6.585 0.376 0.362 1.00 0.00 O ATOM 530 CB PHE A 38 4.594 -1.983 0.061 1.00 0.00 C ATOM 531 CG PHE A 38 3.231 -2.600 -0.144 1.00 0.00 C ATOM 532 CD1 PHE A 38 2.504 -2.322 -1.307 1.00 0.00 C ATOM 533 CD2 PHE A 38 2.696 -3.451 0.830 1.00 0.00 C ATOM 534 CE1 PHE A 38 1.241 -2.894 -1.497 1.00 0.00 C ATOM 535 CE2 PHE A 38 1.432 -4.024 0.639 1.00 0.00 C ATOM 536 CZ PHE A 38 0.705 -3.746 -0.523 1.00 0.00 C ATOM 0 H PHE A 38 4.215 0.381 -1.072 1.00 0.00 H new ATOM 0 HA PHE A 38 3.816 -0.745 1.640 1.00 0.00 H new ATOM 0 HB2 PHE A 38 5.096 -1.857 -0.898 1.00 0.00 H new ATOM 0 HB3 PHE A 38 5.217 -2.644 0.663 1.00 0.00 H new ATOM 0 HD1 PHE A 38 2.918 -1.666 -2.058 1.00 0.00 H new ATOM 0 HD2 PHE A 38 3.257 -3.666 1.728 1.00 0.00 H new ATOM 0 HE1 PHE A 38 0.680 -2.679 -2.394 1.00 0.00 H new ATOM 0 HE2 PHE A 38 1.019 -4.681 1.390 1.00 0.00 H new ATOM 0 HZ PHE A 38 -0.269 -4.188 -0.669 1.00 0.00 H new ATOM 546 N ARG A 39 6.106 -0.233 2.474 1.00 0.00 N ATOM 547 CA ARG A 39 7.384 0.231 3.001 1.00 0.00 C ATOM 548 C ARG A 39 8.431 -0.876 2.923 1.00 0.00 C ATOM 549 O ARG A 39 8.421 -1.810 3.724 1.00 0.00 O ATOM 550 CB ARG A 39 7.219 0.678 4.454 1.00 0.00 C ATOM 551 CG ARG A 39 8.413 1.546 4.859 1.00 0.00 C ATOM 552 CD ARG A 39 8.217 2.046 6.291 1.00 0.00 C ATOM 553 NE ARG A 39 8.332 0.940 7.234 1.00 0.00 N ATOM 554 CZ ARG A 39 8.314 1.150 8.546 1.00 0.00 C ATOM 555 NH1 ARG A 39 8.193 2.363 9.010 1.00 0.00 N ATOM 556 NH2 ARG A 39 8.419 0.143 9.369 1.00 0.00 N ATOM 0 H ARG A 39 5.482 -0.642 3.170 1.00 0.00 H new ATOM 0 HA ARG A 39 7.719 1.075 2.397 1.00 0.00 H new ATOM 0 HB2 ARG A 39 6.292 1.239 4.570 1.00 0.00 H new ATOM 0 HB3 ARG A 39 7.149 -0.192 5.108 1.00 0.00 H new ATOM 0 HG2 ARG A 39 9.336 0.971 4.786 1.00 0.00 H new ATOM 0 HG3 ARG A 39 8.510 2.391 4.177 1.00 0.00 H new ATOM 0 HD2 ARG A 39 8.961 2.809 6.522 1.00 0.00 H new ATOM 0 HD3 ARG A 39 7.238 2.516 6.389 1.00 0.00 H new ATOM 0 HE ARG A 39 8.428 -0.012 6.880 1.00 0.00 H new ATOM 0 HH11 ARG A 39 8.112 3.150 8.366 1.00 0.00 H new ATOM 0 HH12 ARG A 39 8.179 2.525 10.017 1.00 0.00 H new ATOM 0 HH21 ARG A 39 8.515 -0.805 9.005 1.00 0.00 H new ATOM 0 HH22 ARG A 39 8.405 0.304 10.376 1.00 0.00 H new ATOM 570 N ILE A 40 9.332 -0.763 1.953 1.00 0.00 N ATOM 571 CA ILE A 40 10.386 -1.756 1.783 1.00 0.00 C ATOM 572 C ILE A 40 11.658 -1.314 2.499 1.00 0.00 C ATOM 573 O ILE A 40 12.212 -0.256 2.202 1.00 0.00 O ATOM 574 CB ILE A 40 10.679 -1.956 0.295 1.00 0.00 C ATOM 575 CG1 ILE A 40 9.360 -2.079 -0.472 1.00 0.00 C ATOM 576 CG2 ILE A 40 11.499 -3.233 0.103 1.00 0.00 C ATOM 577 CD1 ILE A 40 9.652 -2.291 -1.959 1.00 0.00 C ATOM 0 H ILE A 40 9.354 0.001 1.277 1.00 0.00 H new ATOM 0 HA ILE A 40 10.047 -2.697 2.216 1.00 0.00 H new ATOM 0 HB ILE A 40 11.242 -1.102 -0.082 1.00 0.00 H new ATOM 0 HG12 ILE A 40 8.777 -2.914 -0.082 1.00 0.00 H new ATOM 0 HG13 ILE A 40 8.761 -1.179 -0.333 1.00 0.00 H new ATOM 0 HG21 ILE A 40 11.708 -3.375 -0.957 1.00 0.00 H new ATOM 0 HG22 ILE A 40 12.438 -3.148 0.649 1.00 0.00 H new ATOM 0 HG23 ILE A 40 10.936 -4.087 0.480 1.00 0.00 H new ATOM 0 HD11 ILE A 40 8.713 -2.379 -2.505 1.00 0.00 H new ATOM 0 HD12 ILE A 40 10.218 -1.442 -2.343 1.00 0.00 H new ATOM 0 HD13 ILE A 40 10.234 -3.203 -2.089 1.00 0.00 H new ATOM 589 N VAL A 41 12.114 -2.130 3.444 1.00 0.00 N ATOM 590 CA VAL A 41 13.312 -1.803 4.208 1.00 0.00 C ATOM 591 C VAL A 41 14.295 -2.969 4.189 1.00 0.00 C ATOM 592 O VAL A 41 13.923 -4.111 4.458 1.00 0.00 O ATOM 593 CB VAL A 41 12.935 -1.472 5.653 1.00 0.00 C ATOM 594 CG1 VAL A 41 14.190 -1.067 6.429 1.00 0.00 C ATOM 595 CG2 VAL A 41 11.934 -0.314 5.665 1.00 0.00 C ATOM 0 H VAL A 41 11.676 -3.016 3.698 1.00 0.00 H new ATOM 0 HA VAL A 41 13.788 -0.936 3.750 1.00 0.00 H new ATOM 0 HB VAL A 41 12.486 -2.348 6.121 1.00 0.00 H new ATOM 0 HG11 VAL A 41 13.921 -0.831 7.459 1.00 0.00 H new ATOM 0 HG12 VAL A 41 14.905 -1.890 6.420 1.00 0.00 H new ATOM 0 HG13 VAL A 41 14.640 -0.191 5.962 1.00 0.00 H new ATOM 0 HG21 VAL A 41 11.664 -0.077 6.694 1.00 0.00 H new ATOM 0 HG22 VAL A 41 12.385 0.561 5.197 1.00 0.00 H new ATOM 0 HG23 VAL A 41 11.039 -0.601 5.112 1.00 0.00 H new ATOM 605 N ASN A 42 15.550 -2.673 3.872 1.00 0.00 N ATOM 606 CA ASN A 42 16.583 -3.702 3.835 1.00 0.00 C ATOM 607 C ASN A 42 17.581 -3.500 4.971 1.00 0.00 C ATOM 608 O ASN A 42 18.461 -2.643 4.892 1.00 0.00 O ATOM 609 CB ASN A 42 17.318 -3.658 2.494 1.00 0.00 C ATOM 610 CG ASN A 42 18.056 -4.972 2.260 1.00 0.00 C ATOM 611 OD1 ASN A 42 19.184 -4.972 1.767 1.00 0.00 O ATOM 612 ND2 ASN A 42 17.484 -6.098 2.587 1.00 0.00 N ATOM 0 H ASN A 42 15.876 -1.735 3.638 1.00 0.00 H new ATOM 0 HA ASN A 42 16.105 -4.674 3.955 1.00 0.00 H new ATOM 0 HB2 ASN A 42 16.608 -3.482 1.686 1.00 0.00 H new ATOM 0 HB3 ASN A 42 18.024 -2.828 2.484 1.00 0.00 H new ATOM 0 HD21 ASN A 42 17.971 -6.981 2.434 1.00 0.00 H new ATOM 0 HD22 ASN A 42 16.549 -6.095 2.995 1.00 0.00 H new ATOM 619 N LYS A 43 17.437 -4.293 6.027 1.00 0.00 N ATOM 620 CA LYS A 43 18.322 -4.183 7.181 1.00 0.00 C ATOM 621 C LYS A 43 19.782 -4.285 6.753 1.00 0.00 C ATOM 622 O LYS A 43 20.658 -3.659 7.349 1.00 0.00 O ATOM 623 CB LYS A 43 18.006 -5.290 8.189 1.00 0.00 C ATOM 624 CG LYS A 43 16.650 -5.015 8.842 1.00 0.00 C ATOM 625 CD LYS A 43 16.430 -5.998 9.994 1.00 0.00 C ATOM 626 CE LYS A 43 15.201 -5.572 10.799 1.00 0.00 C ATOM 627 NZ LYS A 43 14.667 -6.746 11.547 1.00 0.00 N ATOM 0 H LYS A 43 16.721 -5.015 6.108 1.00 0.00 H new ATOM 0 HA LYS A 43 18.160 -3.210 7.645 1.00 0.00 H new ATOM 0 HB2 LYS A 43 17.991 -6.258 7.689 1.00 0.00 H new ATOM 0 HB3 LYS A 43 18.785 -5.337 8.950 1.00 0.00 H new ATOM 0 HG2 LYS A 43 16.614 -3.990 9.212 1.00 0.00 H new ATOM 0 HG3 LYS A 43 15.853 -5.116 8.106 1.00 0.00 H new ATOM 0 HD2 LYS A 43 16.291 -7.006 9.604 1.00 0.00 H new ATOM 0 HD3 LYS A 43 17.309 -6.023 10.638 1.00 0.00 H new ATOM 0 HE2 LYS A 43 15.466 -4.775 11.493 1.00 0.00 H new ATOM 0 HE3 LYS A 43 14.436 -5.173 10.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 13.831 -6.458 12.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 14.400 -7.493 10.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 15.397 -7.107 12.194 1.00 0.00 H new ATOM 641 N LYS A 44 20.036 -5.078 5.718 1.00 0.00 N ATOM 642 CA LYS A 44 21.394 -5.250 5.217 1.00 0.00 C ATOM 643 C LYS A 44 22.062 -3.897 4.997 1.00 0.00 C ATOM 644 O LYS A 44 23.003 -3.536 5.705 1.00 0.00 O ATOM 645 CB LYS A 44 21.369 -6.029 3.899 1.00 0.00 C ATOM 646 CG LYS A 44 22.773 -6.557 3.592 1.00 0.00 C ATOM 647 CD LYS A 44 22.871 -6.917 2.109 1.00 0.00 C ATOM 648 CE LYS A 44 21.702 -7.825 1.725 1.00 0.00 C ATOM 649 NZ LYS A 44 21.969 -8.446 0.396 1.00 0.00 N ATOM 0 H LYS A 44 19.326 -5.608 5.213 1.00 0.00 H new ATOM 0 HA LYS A 44 21.966 -5.807 5.959 1.00 0.00 H new ATOM 0 HB2 LYS A 44 20.664 -6.858 3.967 1.00 0.00 H new ATOM 0 HB3 LYS A 44 21.026 -5.384 3.090 1.00 0.00 H new ATOM 0 HG2 LYS A 44 23.519 -5.804 3.844 1.00 0.00 H new ATOM 0 HG3 LYS A 44 22.985 -7.433 4.204 1.00 0.00 H new ATOM 0 HD2 LYS A 44 22.856 -6.011 1.503 1.00 0.00 H new ATOM 0 HD3 LYS A 44 23.817 -7.420 1.908 1.00 0.00 H new ATOM 0 HE2 LYS A 44 21.567 -8.600 2.480 1.00 0.00 H new ATOM 0 HE3 LYS A 44 20.777 -7.249 1.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 21.174 -9.063 0.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 22.077 -7.700 -0.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 22.842 -9.008 0.445 1.00 0.00 H new ATOM 663 N LYS A 45 21.570 -3.153 4.012 1.00 0.00 N ATOM 664 CA LYS A 45 22.119 -1.834 3.716 1.00 0.00 C ATOM 665 C LYS A 45 21.358 -0.753 4.478 1.00 0.00 C ATOM 666 O LYS A 45 21.710 0.426 4.417 1.00 0.00 O ATOM 667 CB LYS A 45 22.035 -1.560 2.213 1.00 0.00 C ATOM 668 CG LYS A 45 22.673 -2.721 1.447 1.00 0.00 C ATOM 669 CD LYS A 45 24.167 -2.788 1.771 1.00 0.00 C ATOM 670 CE LYS A 45 24.890 -3.586 0.685 1.00 0.00 C ATOM 671 NZ LYS A 45 26.333 -3.709 1.036 1.00 0.00 N ATOM 0 H LYS A 45 20.798 -3.438 3.409 1.00 0.00 H new ATOM 0 HA LYS A 45 23.163 -1.815 4.030 1.00 0.00 H new ATOM 0 HB2 LYS A 45 20.994 -1.440 1.912 1.00 0.00 H new ATOM 0 HB3 LYS A 45 22.546 -0.628 1.973 1.00 0.00 H new ATOM 0 HG2 LYS A 45 22.189 -3.659 1.719 1.00 0.00 H new ATOM 0 HG3 LYS A 45 22.528 -2.586 0.375 1.00 0.00 H new ATOM 0 HD2 LYS A 45 24.582 -1.782 1.834 1.00 0.00 H new ATOM 0 HD3 LYS A 45 24.318 -3.257 2.743 1.00 0.00 H new ATOM 0 HE2 LYS A 45 24.443 -4.575 0.587 1.00 0.00 H new ATOM 0 HE3 LYS A 45 24.780 -3.090 -0.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 26.825 -4.252 0.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 26.755 -2.761 1.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 26.428 -4.200 1.948 1.00 0.00 H new ATOM 685 N LYS A 46 20.318 -1.162 5.195 1.00 0.00 N ATOM 686 CA LYS A 46 19.514 -0.220 5.966 1.00 0.00 C ATOM 687 C LYS A 46 18.985 0.896 5.070 1.00 0.00 C ATOM 688 O LYS A 46 18.820 2.033 5.512 1.00 0.00 O ATOM 689 CB LYS A 46 20.355 0.384 7.092 1.00 0.00 C ATOM 690 CG LYS A 46 20.089 -0.377 8.392 1.00 0.00 C ATOM 691 CD LYS A 46 18.806 0.151 9.039 1.00 0.00 C ATOM 692 CE LYS A 46 18.120 -0.979 9.808 1.00 0.00 C ATOM 693 NZ LYS A 46 19.153 -1.883 10.389 1.00 0.00 N ATOM 0 H LYS A 46 20.013 -2.133 5.259 1.00 0.00 H new ATOM 0 HA LYS A 46 18.668 -0.759 6.392 1.00 0.00 H new ATOM 0 HB2 LYS A 46 21.414 0.332 6.838 1.00 0.00 H new ATOM 0 HB3 LYS A 46 20.109 1.438 7.219 1.00 0.00 H new ATOM 0 HG2 LYS A 46 19.994 -1.444 8.189 1.00 0.00 H new ATOM 0 HG3 LYS A 46 20.930 -0.256 9.075 1.00 0.00 H new ATOM 0 HD2 LYS A 46 19.039 0.975 9.713 1.00 0.00 H new ATOM 0 HD3 LYS A 46 18.136 0.544 8.275 1.00 0.00 H new ATOM 0 HE2 LYS A 46 17.495 -0.567 10.600 1.00 0.00 H new ATOM 0 HE3 LYS A 46 17.463 -1.540 9.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 18.755 -2.382 11.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 19.450 -2.576 9.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 19.976 -1.322 10.690 1.00 0.00 H new ATOM 707 N GLN A 47 18.719 0.564 3.811 1.00 0.00 N ATOM 708 CA GLN A 47 18.206 1.550 2.866 1.00 0.00 C ATOM 709 C GLN A 47 16.698 1.392 2.697 1.00 0.00 C ATOM 710 O GLN A 47 16.206 0.299 2.417 1.00 0.00 O ATOM 711 CB GLN A 47 18.894 1.385 1.509 1.00 0.00 C ATOM 712 CG GLN A 47 18.599 -0.010 0.952 1.00 0.00 C ATOM 713 CD GLN A 47 19.592 -0.348 -0.155 1.00 0.00 C ATOM 714 OE1 GLN A 47 20.456 0.552 -0.541 1.00 0.00 O flip ATOM 715 NE2 GLN A 47 19.581 -1.459 -0.682 1.00 0.00 N flip ATOM 0 H GLN A 47 18.848 -0.371 3.424 1.00 0.00 H new ATOM 0 HA GLN A 47 18.416 2.545 3.258 1.00 0.00 H new ATOM 0 HB2 GLN A 47 18.540 2.147 0.815 1.00 0.00 H new ATOM 0 HB3 GLN A 47 19.970 1.526 1.615 1.00 0.00 H new ATOM 0 HG2 GLN A 47 18.664 -0.751 1.749 1.00 0.00 H new ATOM 0 HG3 GLN A 47 17.581 -0.048 0.564 1.00 0.00 H new ATOM 0 HE21 GLN A 47 18.905 -2.161 -0.379 1.00 0.00 H new ATOM 0 HE22 GLN A 47 20.248 -1.679 -1.422 1.00 0.00 H new ATOM 724 N TRP A 48 15.970 2.491 2.871 1.00 0.00 N ATOM 725 CA TRP A 48 14.518 2.461 2.739 1.00 0.00 C ATOM 726 C TRP A 48 14.108 2.663 1.284 1.00 0.00 C ATOM 727 O TRP A 48 14.776 3.372 0.532 1.00 0.00 O ATOM 728 CB TRP A 48 13.892 3.557 3.604 1.00 0.00 C ATOM 729 CG TRP A 48 13.946 3.152 5.042 1.00 0.00 C ATOM 730 CD1 TRP A 48 14.786 2.223 5.557 1.00 0.00 C ATOM 731 CD2 TRP A 48 13.147 3.643 6.156 1.00 0.00 C ATOM 732 NE1 TRP A 48 14.551 2.114 6.917 1.00 0.00 N ATOM 733 CE2 TRP A 48 13.549 2.969 7.332 1.00 0.00 C ATOM 734 CE3 TRP A 48 12.120 4.600 6.258 1.00 0.00 C ATOM 735 CZ2 TRP A 48 12.955 3.234 8.568 1.00 0.00 C ATOM 736 CZ3 TRP A 48 11.519 4.869 7.499 1.00 0.00 C ATOM 737 CH2 TRP A 48 11.936 4.187 8.652 1.00 0.00 C ATOM 0 H TRP A 48 16.358 3.406 3.102 1.00 0.00 H new ATOM 0 HA TRP A 48 14.162 1.487 3.073 1.00 0.00 H new ATOM 0 HB2 TRP A 48 14.425 4.497 3.460 1.00 0.00 H new ATOM 0 HB3 TRP A 48 12.859 3.727 3.302 1.00 0.00 H new ATOM 0 HD1 TRP A 48 15.519 1.660 4.999 1.00 0.00 H new ATOM 0 HE1 TRP A 48 15.056 1.480 7.536 1.00 0.00 H new ATOM 0 HE3 TRP A 48 11.792 5.131 5.377 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 13.281 2.706 9.452 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 10.731 5.605 7.566 1.00 0.00 H new ATOM 0 HH2 TRP A 48 11.470 4.398 9.603 1.00 0.00 H new ATOM 748 N ALA A 49 13.001 2.036 0.894 1.00 0.00 N ATOM 749 CA ALA A 49 12.503 2.158 -0.470 1.00 0.00 C ATOM 750 C ALA A 49 10.978 2.114 -0.487 1.00 0.00 C ATOM 751 O ALA A 49 10.359 1.470 0.360 1.00 0.00 O ATOM 752 CB ALA A 49 13.058 1.023 -1.334 1.00 0.00 C ATOM 0 H ALA A 49 12.436 1.442 1.501 1.00 0.00 H new ATOM 0 HA ALA A 49 12.834 3.115 -0.874 1.00 0.00 H new ATOM 0 HB1 ALA A 49 12.680 1.122 -2.352 1.00 0.00 H new ATOM 0 HB2 ALA A 49 14.147 1.073 -1.344 1.00 0.00 H new ATOM 0 HB3 ALA A 49 12.743 0.064 -0.922 1.00 0.00 H new ATOM 758 N TYR A 50 10.379 2.801 -1.453 1.00 0.00 N ATOM 759 CA TYR A 50 8.925 2.838 -1.560 1.00 0.00 C ATOM 760 C TYR A 50 8.472 2.367 -2.938 1.00 0.00 C ATOM 761 O TYR A 50 9.116 2.656 -3.946 1.00 0.00 O ATOM 762 CB TYR A 50 8.419 4.260 -1.313 1.00 0.00 C ATOM 763 CG TYR A 50 8.526 4.582 0.158 1.00 0.00 C ATOM 764 CD1 TYR A 50 7.631 4.008 1.067 1.00 0.00 C ATOM 765 CD2 TYR A 50 9.523 5.455 0.612 1.00 0.00 C ATOM 766 CE1 TYR A 50 7.731 4.306 2.432 1.00 0.00 C ATOM 767 CE2 TYR A 50 9.623 5.753 1.976 1.00 0.00 C ATOM 768 CZ TYR A 50 8.727 5.178 2.886 1.00 0.00 C ATOM 769 OH TYR A 50 8.827 5.472 4.230 1.00 0.00 O ATOM 0 H TYR A 50 10.872 3.336 -2.168 1.00 0.00 H new ATOM 0 HA TYR A 50 8.510 2.168 -0.807 1.00 0.00 H new ATOM 0 HB2 TYR A 50 9.003 4.972 -1.896 1.00 0.00 H new ATOM 0 HB3 TYR A 50 7.384 4.352 -1.642 1.00 0.00 H new ATOM 0 HD1 TYR A 50 6.863 3.335 0.716 1.00 0.00 H new ATOM 0 HD2 TYR A 50 10.214 5.898 -0.090 1.00 0.00 H new ATOM 0 HE1 TYR A 50 7.040 3.863 3.134 1.00 0.00 H new ATOM 0 HE2 TYR A 50 10.391 6.426 2.327 1.00 0.00 H new ATOM 0 HH TYR A 50 9.572 6.092 4.375 1.00 0.00 H new ATOM 779 N TYR A 51 7.360 1.640 -2.970 1.00 0.00 N ATOM 780 CA TYR A 51 6.818 1.144 -4.230 1.00 0.00 C ATOM 781 C TYR A 51 5.366 1.582 -4.396 1.00 0.00 C ATOM 782 O TYR A 51 4.523 1.303 -3.544 1.00 0.00 O ATOM 783 CB TYR A 51 6.901 -0.383 -4.268 1.00 0.00 C ATOM 784 CG TYR A 51 6.084 -0.904 -5.425 1.00 0.00 C ATOM 785 CD1 TYR A 51 6.585 -0.818 -6.730 1.00 0.00 C ATOM 786 CD2 TYR A 51 4.827 -1.474 -5.195 1.00 0.00 C ATOM 787 CE1 TYR A 51 5.827 -1.302 -7.804 1.00 0.00 C ATOM 788 CE2 TYR A 51 4.069 -1.958 -6.269 1.00 0.00 C ATOM 789 CZ TYR A 51 4.570 -1.872 -7.572 1.00 0.00 C ATOM 790 OH TYR A 51 3.823 -2.348 -8.631 1.00 0.00 O ATOM 0 H TYR A 51 6.820 1.383 -2.144 1.00 0.00 H new ATOM 0 HA TYR A 51 7.407 1.560 -5.048 1.00 0.00 H new ATOM 0 HB2 TYR A 51 7.939 -0.699 -4.371 1.00 0.00 H new ATOM 0 HB3 TYR A 51 6.532 -0.801 -3.331 1.00 0.00 H new ATOM 0 HD1 TYR A 51 7.555 -0.379 -6.908 1.00 0.00 H new ATOM 0 HD2 TYR A 51 4.441 -1.541 -4.189 1.00 0.00 H new ATOM 0 HE1 TYR A 51 6.212 -1.235 -8.811 1.00 0.00 H new ATOM 0 HE2 TYR A 51 3.099 -2.397 -6.091 1.00 0.00 H new ATOM 0 HH TYR A 51 3.121 -2.943 -8.295 1.00 0.00 H new ATOM 800 N ASN A 52 5.083 2.272 -5.496 1.00 0.00 N ATOM 801 CA ASN A 52 3.730 2.751 -5.758 1.00 0.00 C ATOM 802 C ASN A 52 2.974 1.771 -6.649 1.00 0.00 C ATOM 803 O ASN A 52 3.494 1.314 -7.667 1.00 0.00 O ATOM 804 CB ASN A 52 3.782 4.122 -6.437 1.00 0.00 C ATOM 805 CG ASN A 52 2.371 4.670 -6.611 1.00 0.00 C ATOM 806 OD1 ASN A 52 1.408 4.076 -6.126 1.00 0.00 O ATOM 807 ND2 ASN A 52 2.189 5.777 -7.276 1.00 0.00 N ATOM 0 H ASN A 52 5.766 2.511 -6.215 1.00 0.00 H new ATOM 0 HA ASN A 52 3.207 2.836 -4.805 1.00 0.00 H new ATOM 0 HB2 ASN A 52 4.378 4.811 -5.838 1.00 0.00 H new ATOM 0 HB3 ASN A 52 4.271 4.038 -7.408 1.00 0.00 H new ATOM 0 HD21 ASN A 52 1.248 6.152 -7.395 1.00 0.00 H new ATOM 0 HD22 ASN A 52 2.988 6.268 -7.677 1.00 0.00 H new ATOM 814 N ASP A 53 1.743 1.455 -6.259 1.00 0.00 N ATOM 815 CA ASP A 53 0.921 0.530 -7.031 1.00 0.00 C ATOM 816 C ASP A 53 -0.244 1.270 -7.682 1.00 0.00 C ATOM 817 O ASP A 53 -0.730 0.873 -8.741 1.00 0.00 O ATOM 818 CB ASP A 53 0.382 -0.575 -6.121 1.00 0.00 C ATOM 819 CG ASP A 53 -0.511 0.027 -5.042 1.00 0.00 C ATOM 820 OD1 ASP A 53 -1.407 0.776 -5.393 1.00 0.00 O ATOM 821 OD2 ASP A 53 -0.287 -0.271 -3.881 1.00 0.00 O ATOM 0 H ASP A 53 1.295 1.823 -5.419 1.00 0.00 H new ATOM 0 HA ASP A 53 1.539 0.086 -7.812 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -0.182 -1.299 -6.709 1.00 0.00 H new ATOM 0 HB3 ASP A 53 1.210 -1.114 -5.660 1.00 0.00 H new ATOM 826 N THR A 54 -0.686 2.347 -7.041 1.00 0.00 N ATOM 827 CA THR A 54 -1.792 3.138 -7.569 1.00 0.00 C ATOM 828 C THR A 54 -1.422 3.740 -8.920 1.00 0.00 C ATOM 829 O THR A 54 -0.473 4.516 -9.026 1.00 0.00 O ATOM 830 CB THR A 54 -2.147 4.259 -6.589 1.00 0.00 C ATOM 831 OG1 THR A 54 -0.954 4.886 -6.137 1.00 0.00 O ATOM 832 CG2 THR A 54 -2.902 3.674 -5.394 1.00 0.00 C ATOM 0 H THR A 54 -0.299 2.690 -6.162 1.00 0.00 H new ATOM 0 HA THR A 54 -2.653 2.483 -7.699 1.00 0.00 H new ATOM 0 HB THR A 54 -2.777 4.994 -7.090 1.00 0.00 H new ATOM 0 HG1 THR A 54 -0.187 4.518 -6.623 1.00 0.00 H new ATOM 0 HG21 THR A 54 -3.154 4.473 -4.697 1.00 0.00 H new ATOM 0 HG22 THR A 54 -3.816 3.193 -5.741 1.00 0.00 H new ATOM 0 HG23 THR A 54 -2.274 2.939 -4.891 1.00 0.00 H new ATOM 840 N THR A 55 -2.179 3.378 -9.951 1.00 0.00 N ATOM 841 CA THR A 55 -1.917 3.884 -11.294 1.00 0.00 C ATOM 842 C THR A 55 -2.786 5.102 -11.588 1.00 0.00 C ATOM 843 O THR A 55 -2.916 5.520 -12.739 1.00 0.00 O ATOM 844 CB THR A 55 -2.198 2.792 -12.327 1.00 0.00 C ATOM 845 OG1 THR A 55 -3.542 2.351 -12.193 1.00 0.00 O ATOM 846 CG2 THR A 55 -1.248 1.614 -12.100 1.00 0.00 C ATOM 0 H THR A 55 -2.973 2.741 -9.884 1.00 0.00 H new ATOM 0 HA THR A 55 -0.869 4.178 -11.353 1.00 0.00 H new ATOM 0 HB THR A 55 -2.044 3.192 -13.329 1.00 0.00 H new ATOM 0 HG1 THR A 55 -3.725 1.652 -12.855 1.00 0.00 H new ATOM 0 HG21 THR A 55 -1.450 0.837 -12.837 1.00 0.00 H new ATOM 0 HG22 THR A 55 -0.217 1.953 -12.203 1.00 0.00 H new ATOM 0 HG23 THR A 55 -1.400 1.212 -11.098 1.00 0.00 H new ATOM 854 N GLN A 56 -3.379 5.667 -10.541 1.00 0.00 N ATOM 855 CA GLN A 56 -4.234 6.838 -10.700 1.00 0.00 C ATOM 856 C GLN A 56 -3.816 7.944 -9.738 1.00 0.00 C ATOM 857 O GLN A 56 -4.235 9.093 -9.877 1.00 0.00 O ATOM 858 CB GLN A 56 -5.693 6.458 -10.439 1.00 0.00 C ATOM 859 CG GLN A 56 -5.752 5.360 -9.375 1.00 0.00 C ATOM 860 CD GLN A 56 -5.416 4.010 -10.001 1.00 0.00 C ATOM 861 OE1 GLN A 56 -4.688 3.156 -9.337 1.00 0.00 O flip ATOM 862 NE2 GLN A 56 -5.830 3.727 -11.125 1.00 0.00 N flip ATOM 0 H GLN A 56 -3.285 5.336 -9.581 1.00 0.00 H new ATOM 0 HA GLN A 56 -4.130 7.203 -11.722 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -6.254 7.332 -10.107 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -6.160 6.111 -11.361 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -5.050 5.583 -8.571 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -6.746 5.326 -8.930 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -6.399 4.397 -11.642 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -5.604 2.823 -11.539 1.00 0.00 H new ATOM 871 N TYR A 57 -2.989 7.590 -8.759 1.00 0.00 N ATOM 872 CA TYR A 57 -2.522 8.562 -7.778 1.00 0.00 C ATOM 873 C TYR A 57 -1.026 8.401 -7.529 1.00 0.00 C ATOM 874 O TYR A 57 -0.493 7.292 -7.591 1.00 0.00 O ATOM 875 CB TYR A 57 -3.282 8.382 -6.464 1.00 0.00 C ATOM 876 CG TYR A 57 -4.712 7.995 -6.756 1.00 0.00 C ATOM 877 CD1 TYR A 57 -5.538 8.863 -7.481 1.00 0.00 C ATOM 878 CD2 TYR A 57 -5.212 6.768 -6.305 1.00 0.00 C ATOM 879 CE1 TYR A 57 -6.863 8.505 -7.753 1.00 0.00 C ATOM 880 CE2 TYR A 57 -6.538 6.409 -6.578 1.00 0.00 C ATOM 881 CZ TYR A 57 -7.364 7.277 -7.302 1.00 0.00 C ATOM 882 OH TYR A 57 -8.669 6.924 -7.570 1.00 0.00 O ATOM 0 H TYR A 57 -2.631 6.644 -8.625 1.00 0.00 H new ATOM 0 HA TYR A 57 -2.706 9.562 -8.171 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -2.803 7.613 -5.857 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -3.255 9.306 -5.887 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -5.152 9.809 -7.830 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -4.575 6.098 -5.746 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -7.500 9.176 -8.311 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -6.923 5.462 -6.230 1.00 0.00 H new ATOM 0 HH TYR A 57 -8.854 6.041 -7.187 1.00 0.00 H new ATOM 892 N GLU A 58 -0.355 9.512 -7.246 1.00 0.00 N ATOM 893 CA GLU A 58 1.076 9.478 -6.963 1.00 0.00 C ATOM 894 C GLU A 58 1.320 9.348 -5.463 1.00 0.00 C ATOM 895 O GLU A 58 0.558 9.874 -4.652 1.00 0.00 O ATOM 896 CB GLU A 58 1.741 10.754 -7.482 1.00 0.00 C ATOM 897 CG GLU A 58 0.706 11.878 -7.550 1.00 0.00 C ATOM 898 CD GLU A 58 1.386 13.193 -7.916 1.00 0.00 C ATOM 899 OE1 GLU A 58 2.585 13.174 -8.145 1.00 0.00 O ATOM 900 OE2 GLU A 58 0.699 14.200 -7.962 1.00 0.00 O ATOM 0 H GLU A 58 -0.775 10.441 -7.206 1.00 0.00 H new ATOM 0 HA GLU A 58 1.508 8.613 -7.467 1.00 0.00 H new ATOM 0 HB2 GLU A 58 2.563 11.041 -6.826 1.00 0.00 H new ATOM 0 HB3 GLU A 58 2.168 10.578 -8.469 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -0.057 11.636 -8.289 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.200 11.976 -6.590 1.00 0.00 H new ATOM 907 N MET A 59 2.387 8.642 -5.100 1.00 0.00 N ATOM 908 CA MET A 59 2.711 8.438 -3.693 1.00 0.00 C ATOM 909 C MET A 59 3.701 9.492 -3.209 1.00 0.00 C ATOM 910 O MET A 59 4.813 9.597 -3.725 1.00 0.00 O ATOM 911 CB MET A 59 3.311 7.045 -3.495 1.00 0.00 C ATOM 912 CG MET A 59 2.184 6.018 -3.350 1.00 0.00 C ATOM 913 SD MET A 59 0.854 6.416 -4.512 1.00 0.00 S ATOM 914 CE MET A 59 -0.502 5.684 -3.563 1.00 0.00 C ATOM 0 H MET A 59 3.036 8.205 -5.754 1.00 0.00 H new ATOM 0 HA MET A 59 1.793 8.527 -3.112 1.00 0.00 H new ATOM 0 HB2 MET A 59 3.945 6.787 -4.343 1.00 0.00 H new ATOM 0 HB3 MET A 59 3.944 7.033 -2.608 1.00 0.00 H new ATOM 0 HG2 MET A 59 2.564 5.015 -3.545 1.00 0.00 H new ATOM 0 HG3 MET A 59 1.803 6.022 -2.329 1.00 0.00 H new ATOM 0 HE1 MET A 59 -1.455 5.983 -4.000 1.00 0.00 H new ATOM 0 HE2 MET A 59 -0.417 4.598 -3.586 1.00 0.00 H new ATOM 0 HE3 MET A 59 -0.452 6.030 -2.531 1.00 0.00 H new ATOM 924 N HIS A 60 3.289 10.268 -2.212 1.00 0.00 N ATOM 925 CA HIS A 60 4.155 11.297 -1.647 1.00 0.00 C ATOM 926 C HIS A 60 4.592 10.906 -0.238 1.00 0.00 C ATOM 927 O HIS A 60 3.760 10.729 0.652 1.00 0.00 O ATOM 928 CB HIS A 60 3.421 12.638 -1.605 1.00 0.00 C ATOM 929 CG HIS A 60 3.063 13.057 -3.004 1.00 0.00 C ATOM 930 ND1 HIS A 60 3.735 14.073 -3.666 1.00 0.00 N ATOM 931 CD2 HIS A 60 2.106 12.608 -3.880 1.00 0.00 C ATOM 932 CE1 HIS A 60 3.178 14.200 -4.884 1.00 0.00 C ATOM 933 NE2 HIS A 60 2.181 13.331 -5.067 1.00 0.00 N ATOM 0 H HIS A 60 2.367 10.205 -1.781 1.00 0.00 H new ATOM 0 HA HIS A 60 5.038 11.392 -2.279 1.00 0.00 H new ATOM 0 HB2 HIS A 60 2.520 12.553 -0.998 1.00 0.00 H new ATOM 0 HB3 HIS A 60 4.050 13.395 -1.137 1.00 0.00 H new ATOM 0 HD1 HIS A 60 4.510 14.624 -3.297 1.00 0.00 H new ATOM 0 HD2 HIS A 60 1.402 11.814 -3.679 1.00 0.00 H new ATOM 0 HE1 HIS A 60 3.499 14.918 -5.624 1.00 0.00 H new ATOM 942 N VAL A 61 5.899 10.772 -0.042 1.00 0.00 N ATOM 943 CA VAL A 61 6.429 10.379 1.258 1.00 0.00 C ATOM 944 C VAL A 61 7.005 11.585 1.994 1.00 0.00 C ATOM 945 O VAL A 61 7.748 12.380 1.419 1.00 0.00 O ATOM 946 CB VAL A 61 7.518 9.320 1.079 1.00 0.00 C ATOM 947 CG1 VAL A 61 8.214 9.069 2.418 1.00 0.00 C ATOM 948 CG2 VAL A 61 6.884 8.018 0.584 1.00 0.00 C ATOM 0 H VAL A 61 6.606 10.928 -0.760 1.00 0.00 H new ATOM 0 HA VAL A 61 5.613 9.966 1.850 1.00 0.00 H new ATOM 0 HB VAL A 61 8.249 9.671 0.351 1.00 0.00 H new ATOM 0 HG11 VAL A 61 8.990 8.314 2.289 1.00 0.00 H new ATOM 0 HG12 VAL A 61 8.665 9.996 2.773 1.00 0.00 H new ATOM 0 HG13 VAL A 61 7.484 8.718 3.147 1.00 0.00 H new ATOM 0 HG21 VAL A 61 7.659 7.262 0.456 1.00 0.00 H new ATOM 0 HG22 VAL A 61 6.153 7.669 1.314 1.00 0.00 H new ATOM 0 HG23 VAL A 61 6.388 8.195 -0.370 1.00 0.00 H new ATOM 958 N LEU A 62 6.658 11.710 3.271 1.00 0.00 N ATOM 959 CA LEU A 62 7.159 12.810 4.088 1.00 0.00 C ATOM 960 C LEU A 62 7.456 12.328 5.503 1.00 0.00 C ATOM 961 O LEU A 62 6.579 12.333 6.367 1.00 0.00 O ATOM 962 CB LEU A 62 6.127 13.939 4.136 1.00 0.00 C ATOM 963 CG LEU A 62 6.696 15.116 4.928 1.00 0.00 C ATOM 964 CD1 LEU A 62 7.779 15.813 4.101 1.00 0.00 C ATOM 965 CD2 LEU A 62 5.575 16.111 5.238 1.00 0.00 C ATOM 0 H LEU A 62 6.035 11.067 3.761 1.00 0.00 H new ATOM 0 HA LEU A 62 8.080 13.182 3.640 1.00 0.00 H new ATOM 0 HB2 LEU A 62 5.872 14.256 3.125 1.00 0.00 H new ATOM 0 HB3 LEU A 62 5.207 13.585 4.600 1.00 0.00 H new ATOM 0 HG LEU A 62 7.128 14.751 5.860 1.00 0.00 H new ATOM 0 HD11 LEU A 62 8.185 16.652 4.666 1.00 0.00 H new ATOM 0 HD12 LEU A 62 8.578 15.106 3.878 1.00 0.00 H new ATOM 0 HD13 LEU A 62 7.347 16.178 3.169 1.00 0.00 H new ATOM 0 HD21 LEU A 62 5.980 16.951 5.803 1.00 0.00 H new ATOM 0 HD22 LEU A 62 5.144 16.475 4.306 1.00 0.00 H new ATOM 0 HD23 LEU A 62 4.802 15.617 5.827 1.00 0.00 H new ATOM 977 N VAL A 63 8.696 11.907 5.732 1.00 0.00 N ATOM 978 CA VAL A 63 9.091 11.405 7.044 1.00 0.00 C ATOM 979 C VAL A 63 10.088 12.350 7.707 1.00 0.00 C ATOM 980 O VAL A 63 11.070 12.764 7.091 1.00 0.00 O ATOM 981 CB VAL A 63 9.719 10.018 6.901 1.00 0.00 C ATOM 982 CG1 VAL A 63 10.096 9.483 8.283 1.00 0.00 C ATOM 983 CG2 VAL A 63 8.711 9.070 6.245 1.00 0.00 C ATOM 0 H VAL A 63 9.439 11.903 5.033 1.00 0.00 H new ATOM 0 HA VAL A 63 8.201 11.342 7.670 1.00 0.00 H new ATOM 0 HB VAL A 63 10.614 10.085 6.282 1.00 0.00 H new ATOM 0 HG11 VAL A 63 10.544 8.494 8.181 1.00 0.00 H new ATOM 0 HG12 VAL A 63 10.811 10.159 8.752 1.00 0.00 H new ATOM 0 HG13 VAL A 63 9.202 9.414 8.903 1.00 0.00 H new ATOM 0 HG21 VAL A 63 9.156 8.080 6.142 1.00 0.00 H new ATOM 0 HG22 VAL A 63 7.817 9.003 6.866 1.00 0.00 H new ATOM 0 HG23 VAL A 63 8.441 9.451 5.260 1.00 0.00 H new ATOM 993 N THR A 64 9.830 12.682 8.968 1.00 0.00 N ATOM 994 CA THR A 64 10.718 13.568 9.712 1.00 0.00 C ATOM 995 C THR A 64 11.468 12.787 10.787 1.00 0.00 C ATOM 996 O THR A 64 10.873 11.998 11.522 1.00 0.00 O ATOM 997 CB THR A 64 9.910 14.692 10.364 1.00 0.00 C ATOM 998 OG1 THR A 64 9.230 15.430 9.357 1.00 0.00 O ATOM 999 CG2 THR A 64 10.852 15.620 11.133 1.00 0.00 C ATOM 0 H THR A 64 9.019 12.354 9.493 1.00 0.00 H new ATOM 0 HA THR A 64 11.440 13.998 9.018 1.00 0.00 H new ATOM 0 HB THR A 64 9.183 14.265 11.054 1.00 0.00 H new ATOM 0 HG1 THR A 64 8.711 16.149 9.773 1.00 0.00 H new ATOM 0 HG21 THR A 64 10.276 16.420 11.597 1.00 0.00 H new ATOM 0 HG22 THR A 64 11.372 15.052 11.905 1.00 0.00 H new ATOM 0 HG23 THR A 64 11.581 16.049 10.446 1.00 0.00 H new ATOM 1007 N PHE A 65 12.775 13.008 10.870 1.00 0.00 N ATOM 1008 CA PHE A 65 13.595 12.314 11.858 1.00 0.00 C ATOM 1009 C PHE A 65 14.212 13.305 12.839 1.00 0.00 C ATOM 1010 O PHE A 65 14.362 14.487 12.533 1.00 0.00 O ATOM 1011 CB PHE A 65 14.702 11.529 11.155 1.00 0.00 C ATOM 1012 CG PHE A 65 14.196 11.032 9.822 1.00 0.00 C ATOM 1013 CD1 PHE A 65 14.111 11.909 8.734 1.00 0.00 C ATOM 1014 CD2 PHE A 65 13.812 9.694 9.673 1.00 0.00 C ATOM 1015 CE1 PHE A 65 13.643 11.448 7.498 1.00 0.00 C ATOM 1016 CE2 PHE A 65 13.344 9.233 8.437 1.00 0.00 C ATOM 1017 CZ PHE A 65 13.260 10.110 7.349 1.00 0.00 C ATOM 0 H PHE A 65 13.287 13.656 10.271 1.00 0.00 H new ATOM 0 HA PHE A 65 12.957 11.626 12.413 1.00 0.00 H new ATOM 0 HB2 PHE A 65 15.577 12.163 11.011 1.00 0.00 H new ATOM 0 HB3 PHE A 65 15.016 10.688 11.774 1.00 0.00 H new ATOM 0 HD1 PHE A 65 14.407 12.941 8.848 1.00 0.00 H new ATOM 0 HD2 PHE A 65 13.877 9.017 10.512 1.00 0.00 H new ATOM 0 HE1 PHE A 65 13.577 12.125 6.659 1.00 0.00 H new ATOM 0 HE2 PHE A 65 13.048 8.201 8.323 1.00 0.00 H new ATOM 0 HZ PHE A 65 12.900 9.754 6.395 1.00 0.00 H new ATOM 1027 N ASN A 66 14.567 12.812 14.022 1.00 0.00 N ATOM 1028 CA ASN A 66 15.175 13.659 15.042 1.00 0.00 C ATOM 1029 C ASN A 66 16.654 13.882 14.741 1.00 0.00 C ATOM 1030 O ASN A 66 17.286 13.081 14.053 1.00 0.00 O ATOM 1031 CB ASN A 66 15.027 13.007 16.418 1.00 0.00 C ATOM 1032 CG ASN A 66 15.363 14.015 17.511 1.00 0.00 C ATOM 1033 OD1 ASN A 66 14.697 15.042 17.637 1.00 0.00 O ATOM 1034 ND2 ASN A 66 16.364 13.781 18.316 1.00 0.00 N ATOM 0 H ASN A 66 14.445 11.837 14.296 1.00 0.00 H new ATOM 0 HA ASN A 66 14.665 14.622 15.039 1.00 0.00 H new ATOM 0 HB2 ASN A 66 14.008 12.642 16.549 1.00 0.00 H new ATOM 0 HB3 ASN A 66 15.687 12.143 16.493 1.00 0.00 H new ATOM 0 HD21 ASN A 66 16.595 14.450 19.051 1.00 0.00 H new ATOM 0 HD22 ASN A 66 16.915 12.929 18.210 1.00 0.00 H new ATOM 1041 N GLU A 67 17.200 14.976 15.263 1.00 0.00 N ATOM 1042 CA GLU A 67 18.605 15.295 15.045 1.00 0.00 C ATOM 1043 C GLU A 67 19.478 14.073 15.314 1.00 0.00 C ATOM 1044 O GLU A 67 20.392 13.770 14.547 1.00 0.00 O ATOM 1045 CB GLU A 67 19.030 16.439 15.968 1.00 0.00 C ATOM 1046 CG GLU A 67 20.558 16.499 16.038 1.00 0.00 C ATOM 1047 CD GLU A 67 21.002 17.859 16.565 1.00 0.00 C ATOM 1048 OE1 GLU A 67 20.146 18.707 16.756 1.00 0.00 O ATOM 1049 OE2 GLU A 67 22.192 18.033 16.770 1.00 0.00 O ATOM 0 H GLU A 67 16.694 15.652 15.836 1.00 0.00 H new ATOM 0 HA GLU A 67 18.733 15.599 14.006 1.00 0.00 H new ATOM 0 HB2 GLU A 67 18.635 17.385 15.597 1.00 0.00 H new ATOM 0 HB3 GLU A 67 18.615 16.289 16.965 1.00 0.00 H new ATOM 0 HG2 GLU A 67 20.932 15.708 16.688 1.00 0.00 H new ATOM 0 HG3 GLU A 67 20.983 16.326 15.049 1.00 0.00 H new ATOM 1056 N ASP A 68 19.188 13.375 16.407 1.00 0.00 N ATOM 1057 CA ASP A 68 19.952 12.186 16.767 1.00 0.00 C ATOM 1058 C ASP A 68 19.535 11.001 15.901 1.00 0.00 C ATOM 1059 O ASP A 68 18.905 10.059 16.383 1.00 0.00 O ATOM 1060 CB ASP A 68 19.726 11.848 18.242 1.00 0.00 C ATOM 1061 CG ASP A 68 20.318 12.941 19.125 1.00 0.00 C ATOM 1062 OD1 ASP A 68 21.076 13.745 18.609 1.00 0.00 O ATOM 1063 OD2 ASP A 68 20.004 12.958 20.304 1.00 0.00 O ATOM 0 H ASP A 68 18.436 13.609 17.054 1.00 0.00 H new ATOM 0 HA ASP A 68 21.010 12.390 16.600 1.00 0.00 H new ATOM 0 HB2 ASP A 68 18.659 11.747 18.441 1.00 0.00 H new ATOM 0 HB3 ASP A 68 20.187 10.889 18.478 1.00 0.00 H new ATOM 1068 N CYS A 69 19.890 11.054 14.622 1.00 0.00 N ATOM 1069 CA CYS A 69 19.554 9.975 13.701 1.00 0.00 C ATOM 1070 C CYS A 69 20.550 9.923 12.547 1.00 0.00 C ATOM 1071 O CYS A 69 20.618 10.842 11.731 1.00 0.00 O ATOM 1072 CB CYS A 69 18.141 10.180 13.149 1.00 0.00 C ATOM 1073 SG CYS A 69 16.990 10.438 14.522 1.00 0.00 S ATOM 0 H CYS A 69 20.407 11.827 14.202 1.00 0.00 H new ATOM 0 HA CYS A 69 19.598 9.032 14.246 1.00 0.00 H new ATOM 0 HB2 CYS A 69 18.122 11.039 12.478 1.00 0.00 H new ATOM 0 HB3 CYS A 69 17.838 9.312 12.564 1.00 0.00 H new ATOM 0 HG CYS A 69 16.108 9.483 14.534 1.00 0.00 H new ATOM 1079 N ASP A 70 21.321 8.841 12.485 1.00 0.00 N ATOM 1080 CA ASP A 70 22.311 8.682 11.426 1.00 0.00 C ATOM 1081 C ASP A 70 21.643 8.221 10.136 1.00 0.00 C ATOM 1082 O ASP A 70 21.704 7.045 9.779 1.00 0.00 O ATOM 1083 CB ASP A 70 23.369 7.661 11.850 1.00 0.00 C ATOM 1084 CG ASP A 70 24.571 7.737 10.916 1.00 0.00 C ATOM 1085 OD1 ASP A 70 24.599 8.635 10.090 1.00 0.00 O ATOM 1086 OD2 ASP A 70 25.447 6.897 11.039 1.00 0.00 O ATOM 0 H ASP A 70 21.280 8.068 13.149 1.00 0.00 H new ATOM 0 HA ASP A 70 22.788 9.646 11.250 1.00 0.00 H new ATOM 0 HB2 ASP A 70 23.682 7.855 12.876 1.00 0.00 H new ATOM 0 HB3 ASP A 70 22.946 6.657 11.830 1.00 0.00 H new ATOM 1091 N ILE A 71 21.005 9.157 9.441 1.00 0.00 N ATOM 1092 CA ILE A 71 20.322 8.835 8.192 1.00 0.00 C ATOM 1093 C ILE A 71 20.920 9.630 7.034 1.00 0.00 C ATOM 1094 O ILE A 71 21.508 10.692 7.236 1.00 0.00 O ATOM 1095 CB ILE A 71 18.832 9.152 8.316 1.00 0.00 C ATOM 1096 CG1 ILE A 71 18.652 10.643 8.608 1.00 0.00 C ATOM 1097 CG2 ILE A 71 18.230 8.335 9.460 1.00 0.00 C ATOM 1098 CD1 ILE A 71 17.167 10.949 8.816 1.00 0.00 C ATOM 0 H ILE A 71 20.946 10.137 9.718 1.00 0.00 H new ATOM 0 HA ILE A 71 20.451 7.771 7.992 1.00 0.00 H new ATOM 0 HB ILE A 71 18.328 8.899 7.383 1.00 0.00 H new ATOM 0 HG12 ILE A 71 19.219 10.921 9.496 1.00 0.00 H new ATOM 0 HG13 ILE A 71 19.044 11.236 7.781 1.00 0.00 H new ATOM 0 HG21 ILE A 71 17.167 8.561 9.549 1.00 0.00 H new ATOM 0 HG22 ILE A 71 18.359 7.272 9.255 1.00 0.00 H new ATOM 0 HG23 ILE A 71 18.734 8.589 10.393 1.00 0.00 H new ATOM 0 HD11 ILE A 71 17.040 12.011 9.024 1.00 0.00 H new ATOM 0 HD12 ILE A 71 16.612 10.687 7.915 1.00 0.00 H new ATOM 0 HD13 ILE A 71 16.790 10.367 9.657 1.00 0.00 H new ATOM 1110 N LYS A 72 20.766 9.107 5.821 1.00 0.00 N ATOM 1111 CA LYS A 72 21.304 9.773 4.640 1.00 0.00 C ATOM 1112 C LYS A 72 20.280 9.772 3.509 1.00 0.00 C ATOM 1113 O LYS A 72 19.304 9.022 3.543 1.00 0.00 O ATOM 1114 CB LYS A 72 22.578 9.063 4.177 1.00 0.00 C ATOM 1115 CG LYS A 72 23.408 10.015 3.313 1.00 0.00 C ATOM 1116 CD LYS A 72 23.744 9.336 1.984 1.00 0.00 C ATOM 1117 CE LYS A 72 24.858 8.311 2.201 1.00 0.00 C ATOM 1118 NZ LYS A 72 24.710 7.695 3.549 1.00 0.00 N ATOM 0 H LYS A 72 20.278 8.232 5.631 1.00 0.00 H new ATOM 0 HA LYS A 72 21.536 10.805 4.902 1.00 0.00 H new ATOM 0 HB2 LYS A 72 23.159 8.737 5.040 1.00 0.00 H new ATOM 0 HB3 LYS A 72 22.323 8.169 3.609 1.00 0.00 H new ATOM 0 HG2 LYS A 72 22.854 10.936 3.133 1.00 0.00 H new ATOM 0 HG3 LYS A 72 24.324 10.291 3.835 1.00 0.00 H new ATOM 0 HD2 LYS A 72 22.858 8.846 1.580 1.00 0.00 H new ATOM 0 HD3 LYS A 72 24.058 10.081 1.252 1.00 0.00 H new ATOM 0 HE2 LYS A 72 24.814 7.541 1.431 1.00 0.00 H new ATOM 0 HE3 LYS A 72 25.832 8.793 2.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 25.426 6.950 3.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 24.840 8.423 4.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 23.760 7.281 3.639 1.00 0.00 H new ATOM 1132 N ALA A 73 20.511 10.615 2.507 1.00 0.00 N ATOM 1133 CA ALA A 73 19.603 10.700 1.369 1.00 0.00 C ATOM 1134 C ALA A 73 20.102 9.828 0.221 1.00 0.00 C ATOM 1135 O ALA A 73 21.299 9.782 -0.061 1.00 0.00 O ATOM 1136 CB ALA A 73 19.491 12.152 0.898 1.00 0.00 C ATOM 0 H ALA A 73 21.313 11.244 2.460 1.00 0.00 H new ATOM 0 HA ALA A 73 18.622 10.343 1.682 1.00 0.00 H new ATOM 0 HB1 ALA A 73 18.811 12.207 0.048 1.00 0.00 H new ATOM 0 HB2 ALA A 73 19.107 12.769 1.710 1.00 0.00 H new ATOM 0 HB3 ALA A 73 20.475 12.515 0.600 1.00 0.00 H new ATOM 1142 N LEU A 74 19.176 9.137 -0.436 1.00 0.00 N ATOM 1143 CA LEU A 74 19.535 8.260 -1.544 1.00 0.00 C ATOM 1144 C LEU A 74 19.207 8.920 -2.880 1.00 0.00 C ATOM 1145 O LEU A 74 19.940 9.792 -3.348 1.00 0.00 O ATOM 1146 CB LEU A 74 18.779 6.935 -1.427 1.00 0.00 C ATOM 1147 CG LEU A 74 19.155 6.249 -0.112 1.00 0.00 C ATOM 1148 CD1 LEU A 74 18.272 5.018 0.095 1.00 0.00 C ATOM 1149 CD2 LEU A 74 20.623 5.819 -0.166 1.00 0.00 C ATOM 0 H LEU A 74 18.179 9.167 -0.223 1.00 0.00 H new ATOM 0 HA LEU A 74 20.608 8.071 -1.500 1.00 0.00 H new ATOM 0 HB2 LEU A 74 17.704 7.113 -1.463 1.00 0.00 H new ATOM 0 HB3 LEU A 74 19.023 6.289 -2.270 1.00 0.00 H new ATOM 0 HG LEU A 74 19.007 6.943 0.715 1.00 0.00 H new ATOM 0 HD11 LEU A 74 18.541 4.531 1.032 1.00 0.00 H new ATOM 0 HD12 LEU A 74 17.226 5.323 0.132 1.00 0.00 H new ATOM 0 HD13 LEU A 74 18.418 4.322 -0.731 1.00 0.00 H new ATOM 0 HD21 LEU A 74 20.894 5.330 0.770 1.00 0.00 H new ATOM 0 HD22 LEU A 74 20.769 5.125 -0.994 1.00 0.00 H new ATOM 0 HD23 LEU A 74 21.254 6.696 -0.313 1.00 0.00 H new ATOM 1161 N GLY A 75 18.104 8.498 -3.489 1.00 0.00 N ATOM 1162 CA GLY A 75 17.698 9.047 -4.777 1.00 0.00 C ATOM 1163 C GLY A 75 17.509 10.557 -4.691 1.00 0.00 C ATOM 1164 O GLY A 75 18.152 11.228 -3.883 1.00 0.00 O ATOM 0 H GLY A 75 17.480 7.783 -3.115 1.00 0.00 H new ATOM 0 HA2 GLY A 75 18.451 8.813 -5.530 1.00 0.00 H new ATOM 0 HA3 GLY A 75 16.768 8.578 -5.100 1.00 0.00 H new ATOM 1168 N LYS A 76 16.624 11.087 -5.530 1.00 0.00 N ATOM 1169 CA LYS A 76 16.366 12.522 -5.544 1.00 0.00 C ATOM 1170 C LYS A 76 15.878 12.991 -4.177 1.00 0.00 C ATOM 1171 O LYS A 76 15.678 14.186 -3.955 1.00 0.00 O ATOM 1172 CB LYS A 76 15.313 12.852 -6.605 1.00 0.00 C ATOM 1173 CG LYS A 76 14.094 11.949 -6.413 1.00 0.00 C ATOM 1174 CD LYS A 76 12.847 12.653 -6.950 1.00 0.00 C ATOM 1175 CE LYS A 76 12.835 12.577 -8.478 1.00 0.00 C ATOM 1176 NZ LYS A 76 11.896 13.601 -9.018 1.00 0.00 N ATOM 0 H LYS A 76 16.078 10.549 -6.203 1.00 0.00 H new ATOM 0 HA LYS A 76 17.296 13.038 -5.782 1.00 0.00 H new ATOM 0 HB2 LYS A 76 15.019 13.899 -6.527 1.00 0.00 H new ATOM 0 HB3 LYS A 76 15.730 12.711 -7.602 1.00 0.00 H new ATOM 0 HG2 LYS A 76 14.243 11.003 -6.934 1.00 0.00 H new ATOM 0 HG3 LYS A 76 13.965 11.714 -5.356 1.00 0.00 H new ATOM 0 HD2 LYS A 76 11.950 12.185 -6.545 1.00 0.00 H new ATOM 0 HD3 LYS A 76 12.837 13.694 -6.627 1.00 0.00 H new ATOM 0 HE2 LYS A 76 13.838 12.746 -8.869 1.00 0.00 H new ATOM 0 HE3 LYS A 76 12.530 11.582 -8.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 11.887 13.550 -10.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 10.939 13.420 -8.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 12.206 14.548 -8.720 1.00 0.00 H new ATOM 1190 N THR A 77 15.690 12.044 -3.265 1.00 0.00 N ATOM 1191 CA THR A 77 15.219 12.371 -1.925 1.00 0.00 C ATOM 1192 C THR A 77 15.972 13.576 -1.371 1.00 0.00 C ATOM 1193 O THR A 77 17.157 13.486 -1.051 1.00 0.00 O ATOM 1194 CB THR A 77 15.416 11.172 -0.994 1.00 0.00 C ATOM 1195 OG1 THR A 77 14.748 10.041 -1.535 1.00 0.00 O ATOM 1196 CG2 THR A 77 14.842 11.494 0.386 1.00 0.00 C ATOM 0 H THR A 77 15.855 11.051 -3.427 1.00 0.00 H new ATOM 0 HA THR A 77 14.158 12.615 -1.983 1.00 0.00 H new ATOM 0 HB THR A 77 16.480 10.956 -0.900 1.00 0.00 H new ATOM 0 HG1 THR A 77 15.308 9.245 -1.421 1.00 0.00 H new ATOM 0 HG21 THR A 77 14.983 10.639 1.047 1.00 0.00 H new ATOM 0 HG22 THR A 77 15.355 12.362 0.800 1.00 0.00 H new ATOM 0 HG23 THR A 77 13.778 11.711 0.296 1.00 0.00 H new ATOM 1204 N LYS A 78 15.277 14.704 -1.261 1.00 0.00 N ATOM 1205 CA LYS A 78 15.890 15.920 -0.741 1.00 0.00 C ATOM 1206 C LYS A 78 15.994 15.859 0.779 1.00 0.00 C ATOM 1207 O LYS A 78 14.985 15.741 1.475 1.00 0.00 O ATOM 1208 CB LYS A 78 15.062 17.140 -1.151 1.00 0.00 C ATOM 1209 CG LYS A 78 15.805 18.417 -0.755 1.00 0.00 C ATOM 1210 CD LYS A 78 14.963 19.636 -1.137 1.00 0.00 C ATOM 1211 CE LYS A 78 15.757 20.913 -0.854 1.00 0.00 C ATOM 1212 NZ LYS A 78 17.018 20.900 -1.647 1.00 0.00 N ATOM 0 H LYS A 78 14.296 14.801 -1.523 1.00 0.00 H new ATOM 0 HA LYS A 78 16.893 16.006 -1.159 1.00 0.00 H new ATOM 0 HB2 LYS A 78 14.885 17.128 -2.226 1.00 0.00 H new ATOM 0 HB3 LYS A 78 14.086 17.110 -0.667 1.00 0.00 H new ATOM 0 HG2 LYS A 78 16.001 18.419 0.317 1.00 0.00 H new ATOM 0 HG3 LYS A 78 16.772 18.458 -1.256 1.00 0.00 H new ATOM 0 HD2 LYS A 78 14.693 19.589 -2.192 1.00 0.00 H new ATOM 0 HD3 LYS A 78 14.032 19.641 -0.570 1.00 0.00 H new ATOM 0 HE2 LYS A 78 15.162 21.789 -1.112 1.00 0.00 H new ATOM 0 HE3 LYS A 78 15.984 20.984 0.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 17.340 21.876 -1.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 17.749 20.373 -1.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 16.846 20.442 -2.565 1.00 0.00 H new ATOM 1226 N LEU A 79 17.219 15.939 1.287 1.00 0.00 N ATOM 1227 CA LEU A 79 17.443 15.881 2.726 1.00 0.00 C ATOM 1228 C LEU A 79 17.975 17.215 3.242 1.00 0.00 C ATOM 1229 O LEU A 79 18.917 17.775 2.682 1.00 0.00 O ATOM 1230 CB LEU A 79 18.442 14.771 3.056 1.00 0.00 C ATOM 1231 CG LEU A 79 18.730 14.770 4.558 1.00 0.00 C ATOM 1232 CD1 LEU A 79 17.421 14.587 5.327 1.00 0.00 C ATOM 1233 CD2 LEU A 79 19.682 13.620 4.893 1.00 0.00 C ATOM 0 H LEU A 79 18.066 16.043 0.728 1.00 0.00 H new ATOM 0 HA LEU A 79 16.491 15.670 3.213 1.00 0.00 H new ATOM 0 HB2 LEU A 79 18.041 13.804 2.752 1.00 0.00 H new ATOM 0 HB3 LEU A 79 19.366 14.922 2.498 1.00 0.00 H new ATOM 0 HG LEU A 79 19.189 15.717 4.841 1.00 0.00 H new ATOM 0 HD11 LEU A 79 17.625 14.586 6.398 1.00 0.00 H new ATOM 0 HD12 LEU A 79 16.741 15.405 5.088 1.00 0.00 H new ATOM 0 HD13 LEU A 79 16.962 13.639 5.044 1.00 0.00 H new ATOM 0 HD21 LEU A 79 19.888 13.618 5.963 1.00 0.00 H new ATOM 0 HD22 LEU A 79 19.222 12.673 4.610 1.00 0.00 H new ATOM 0 HD23 LEU A 79 20.615 13.748 4.344 1.00 0.00 H new ATOM 1245 N GLU A 80 17.364 17.717 4.309 1.00 0.00 N ATOM 1246 CA GLU A 80 17.784 18.986 4.890 1.00 0.00 C ATOM 1247 C GLU A 80 17.450 19.031 6.378 1.00 0.00 C ATOM 1248 O GLU A 80 16.492 18.401 6.828 1.00 0.00 O ATOM 1249 CB GLU A 80 17.088 20.145 4.174 1.00 0.00 C ATOM 1250 CG GLU A 80 15.572 19.953 4.245 1.00 0.00 C ATOM 1251 CD GLU A 80 14.869 21.057 3.462 1.00 0.00 C ATOM 1252 OE1 GLU A 80 15.556 21.945 2.983 1.00 0.00 O ATOM 1253 OE2 GLU A 80 13.656 20.999 3.354 1.00 0.00 O ATOM 0 H GLU A 80 16.582 17.269 4.786 1.00 0.00 H new ATOM 0 HA GLU A 80 18.863 19.080 4.768 1.00 0.00 H new ATOM 0 HB2 GLU A 80 17.367 21.092 4.636 1.00 0.00 H new ATOM 0 HB3 GLU A 80 17.411 20.190 3.134 1.00 0.00 H new ATOM 0 HG2 GLU A 80 15.301 18.979 3.839 1.00 0.00 H new ATOM 0 HG3 GLU A 80 15.244 19.967 5.284 1.00 0.00 H new ATOM 1260 N GLN A 81 18.246 19.777 7.137 1.00 0.00 N ATOM 1261 CA GLN A 81 18.025 19.895 8.573 1.00 0.00 C ATOM 1262 C GLN A 81 17.494 21.280 8.924 1.00 0.00 C ATOM 1263 O GLN A 81 17.760 22.254 8.219 1.00 0.00 O ATOM 1264 CB GLN A 81 19.334 19.642 9.324 1.00 0.00 C ATOM 1265 CG GLN A 81 19.059 19.593 10.828 1.00 0.00 C ATOM 1266 CD GLN A 81 20.339 19.252 11.582 1.00 0.00 C ATOM 1267 OE1 GLN A 81 21.364 18.958 10.966 1.00 0.00 O ATOM 1268 NE2 GLN A 81 20.343 19.273 12.887 1.00 0.00 N ATOM 0 H GLN A 81 19.044 20.305 6.785 1.00 0.00 H new ATOM 0 HA GLN A 81 17.285 19.151 8.870 1.00 0.00 H new ATOM 0 HB2 GLN A 81 19.779 18.703 8.994 1.00 0.00 H new ATOM 0 HB3 GLN A 81 20.052 20.431 9.100 1.00 0.00 H new ATOM 0 HG2 GLN A 81 18.673 20.554 11.167 1.00 0.00 H new ATOM 0 HG3 GLN A 81 18.292 18.848 11.042 1.00 0.00 H new ATOM 0 HE21 GLN A 81 19.493 19.517 13.396 1.00 0.00 H new ATOM 0 HE22 GLN A 81 21.196 19.046 13.398 1.00 0.00 H new ATOM 1277 N GLN A 82 16.743 21.362 10.017 1.00 0.00 N ATOM 1278 CA GLN A 82 16.178 22.635 10.451 1.00 0.00 C ATOM 1279 C GLN A 82 16.896 23.142 11.698 1.00 0.00 C ATOM 1280 O GLN A 82 17.678 22.417 12.313 1.00 0.00 O ATOM 1281 CB GLN A 82 14.687 22.469 10.750 1.00 0.00 C ATOM 1282 CG GLN A 82 14.106 21.369 9.859 1.00 0.00 C ATOM 1283 CD GLN A 82 14.448 21.647 8.399 1.00 0.00 C ATOM 1284 OE1 GLN A 82 15.140 20.772 7.722 1.00 0.00 O flip ATOM 1285 NE2 GLN A 82 14.075 22.691 7.861 1.00 0.00 N flip ATOM 0 H GLN A 82 16.512 20.568 10.615 1.00 0.00 H new ATOM 0 HA GLN A 82 16.309 23.362 9.649 1.00 0.00 H new ATOM 0 HB2 GLN A 82 14.542 22.215 11.800 1.00 0.00 H new ATOM 0 HB3 GLN A 82 14.163 23.409 10.574 1.00 0.00 H new ATOM 0 HG2 GLN A 82 14.505 20.399 10.157 1.00 0.00 H new ATOM 0 HG3 GLN A 82 13.024 21.321 9.985 1.00 0.00 H new ATOM 0 HE21 GLN A 82 13.534 23.373 8.392 1.00 0.00 H new ATOM 0 HE22 GLN A 82 14.307 22.873 6.884 1.00 0.00 H new ATOM 1294 N GLU A 83 16.626 24.391 12.063 1.00 0.00 N ATOM 1295 CA GLU A 83 17.252 24.984 13.240 1.00 0.00 C ATOM 1296 C GLU A 83 16.822 24.248 14.504 1.00 0.00 C ATOM 1297 O GLU A 83 17.617 24.060 15.425 1.00 0.00 O ATOM 1298 CB GLU A 83 16.864 26.460 13.349 1.00 0.00 C ATOM 1299 CG GLU A 83 17.271 27.192 12.069 1.00 0.00 C ATOM 1300 CD GLU A 83 16.982 28.683 12.206 1.00 0.00 C ATOM 1301 OE1 GLU A 83 15.832 29.060 12.056 1.00 0.00 O ATOM 1302 OE2 GLU A 83 17.916 29.425 12.460 1.00 0.00 O ATOM 0 H GLU A 83 15.984 25.008 11.566 1.00 0.00 H new ATOM 0 HA GLU A 83 18.334 24.899 13.135 1.00 0.00 H new ATOM 0 HB2 GLU A 83 15.790 26.554 13.508 1.00 0.00 H new ATOM 0 HB3 GLU A 83 17.354 26.913 14.211 1.00 0.00 H new ATOM 0 HG2 GLU A 83 18.332 27.035 11.872 1.00 0.00 H new ATOM 0 HG3 GLU A 83 16.725 26.784 11.218 1.00 0.00 H new ATOM 1309 N ASN A 84 15.560 23.833 14.540 1.00 0.00 N ATOM 1310 CA ASN A 84 15.033 23.120 15.698 1.00 0.00 C ATOM 1311 C ASN A 84 15.840 21.853 15.960 1.00 0.00 C ATOM 1312 O ASN A 84 15.884 21.356 17.086 1.00 0.00 O ATOM 1313 CB ASN A 84 13.567 22.754 15.463 1.00 0.00 C ATOM 1314 CG ASN A 84 13.410 22.076 14.106 1.00 0.00 C ATOM 1315 OD1 ASN A 84 14.148 21.040 13.817 1.00 0.00 O flip ATOM 1316 ND2 ASN A 84 12.595 22.502 13.289 1.00 0.00 N flip ATOM 0 H ASN A 84 14.887 23.977 13.787 1.00 0.00 H new ATOM 0 HA ASN A 84 15.109 23.772 16.568 1.00 0.00 H new ATOM 0 HB2 ASN A 84 13.218 22.089 16.253 1.00 0.00 H new ATOM 0 HB3 ASN A 84 12.949 23.651 15.505 1.00 0.00 H new ATOM 0 HD21 ASN A 84 12.019 23.312 13.518 1.00 0.00 H new ATOM 0 HD22 ASN A 84 12.495 22.045 12.383 1.00 0.00 H new ATOM 1323 N GLY A 85 16.474 21.334 14.914 1.00 0.00 N ATOM 1324 CA GLY A 85 17.284 20.128 15.045 1.00 0.00 C ATOM 1325 C GLY A 85 16.503 18.898 14.594 1.00 0.00 C ATOM 1326 O GLY A 85 16.387 17.921 15.332 1.00 0.00 O ATOM 0 H GLY A 85 16.444 21.726 13.973 1.00 0.00 H new ATOM 0 HA2 GLY A 85 18.191 20.227 14.448 1.00 0.00 H new ATOM 0 HA3 GLY A 85 17.597 20.006 16.082 1.00 0.00 H new ATOM 1330 N GLU A 86 15.971 18.956 13.377 1.00 0.00 N ATOM 1331 CA GLU A 86 15.220 17.832 12.830 1.00 0.00 C ATOM 1332 C GLU A 86 15.565 17.621 11.359 1.00 0.00 C ATOM 1333 O GLU A 86 15.832 18.578 10.631 1.00 0.00 O ATOM 1334 CB GLU A 86 13.718 18.090 12.970 1.00 0.00 C ATOM 1335 CG GLU A 86 13.344 18.139 14.452 1.00 0.00 C ATOM 1336 CD GLU A 86 11.844 18.368 14.603 1.00 0.00 C ATOM 1337 OE1 GLU A 86 11.191 18.569 13.593 1.00 0.00 O ATOM 1338 OE2 GLU A 86 11.371 18.339 15.727 1.00 0.00 O ATOM 0 H GLU A 86 16.045 19.762 12.756 1.00 0.00 H new ATOM 0 HA GLU A 86 15.489 16.935 13.387 1.00 0.00 H new ATOM 0 HB2 GLU A 86 13.453 19.030 12.486 1.00 0.00 H new ATOM 0 HB3 GLU A 86 13.155 17.303 12.468 1.00 0.00 H new ATOM 0 HG2 GLU A 86 13.629 17.206 14.939 1.00 0.00 H new ATOM 0 HG3 GLU A 86 13.894 18.938 14.948 1.00 0.00 H new ATOM 1345 N TRP A 87 15.556 16.364 10.927 1.00 0.00 N ATOM 1346 CA TRP A 87 15.867 16.041 9.540 1.00 0.00 C ATOM 1347 C TRP A 87 14.586 15.773 8.755 1.00 0.00 C ATOM 1348 O TRP A 87 13.658 15.141 9.259 1.00 0.00 O ATOM 1349 CB TRP A 87 16.772 14.809 9.479 1.00 0.00 C ATOM 1350 CG TRP A 87 18.139 15.169 9.965 1.00 0.00 C ATOM 1351 CD1 TRP A 87 18.591 14.976 11.225 1.00 0.00 C ATOM 1352 CD2 TRP A 87 19.236 15.779 9.225 1.00 0.00 C ATOM 1353 NE1 TRP A 87 19.896 15.427 11.307 1.00 0.00 N ATOM 1354 CE2 TRP A 87 20.338 15.931 10.100 1.00 0.00 C ATOM 1355 CE3 TRP A 87 19.382 16.209 7.894 1.00 0.00 C ATOM 1356 CZ2 TRP A 87 21.541 16.491 9.668 1.00 0.00 C ATOM 1357 CZ3 TRP A 87 20.591 16.773 7.457 1.00 0.00 C ATOM 1358 CH2 TRP A 87 21.669 16.914 8.343 1.00 0.00 C ATOM 0 H TRP A 87 15.338 15.558 11.513 1.00 0.00 H new ATOM 0 HA TRP A 87 16.384 16.891 9.095 1.00 0.00 H new ATOM 0 HB2 TRP A 87 16.356 14.009 10.091 1.00 0.00 H new ATOM 0 HB3 TRP A 87 16.825 14.434 8.457 1.00 0.00 H new ATOM 0 HD1 TRP A 87 18.025 14.541 12.035 1.00 0.00 H new ATOM 0 HE1 TRP A 87 20.462 15.392 12.155 1.00 0.00 H new ATOM 0 HE3 TRP A 87 18.558 16.105 7.203 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 22.368 16.597 10.354 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 20.692 17.100 6.433 1.00 0.00 H new ATOM 0 HH2 TRP A 87 22.597 17.349 8.001 1.00 0.00 H new ATOM 1369 N VAL A 88 14.544 16.257 7.517 1.00 0.00 N ATOM 1370 CA VAL A 88 13.369 16.069 6.675 1.00 0.00 C ATOM 1371 C VAL A 88 13.760 15.444 5.340 1.00 0.00 C ATOM 1372 O VAL A 88 14.721 15.872 4.701 1.00 0.00 O ATOM 1373 CB VAL A 88 12.680 17.413 6.430 1.00 0.00 C ATOM 1374 CG1 VAL A 88 11.519 17.221 5.454 1.00 0.00 C ATOM 1375 CG2 VAL A 88 12.147 17.960 7.755 1.00 0.00 C ATOM 0 H VAL A 88 15.303 16.778 7.078 1.00 0.00 H new ATOM 0 HA VAL A 88 12.681 15.398 7.189 1.00 0.00 H new ATOM 0 HB VAL A 88 13.397 18.117 6.007 1.00 0.00 H new ATOM 0 HG11 VAL A 88 11.028 18.178 5.280 1.00 0.00 H new ATOM 0 HG12 VAL A 88 11.898 16.830 4.510 1.00 0.00 H new ATOM 0 HG13 VAL A 88 10.802 16.517 5.876 1.00 0.00 H new ATOM 0 HG21 VAL A 88 11.656 18.918 7.582 1.00 0.00 H new ATOM 0 HG22 VAL A 88 11.430 17.256 8.177 1.00 0.00 H new ATOM 0 HG23 VAL A 88 12.974 18.097 8.451 1.00 0.00 H new ATOM 1385 N ALA A 89 13.009 14.429 4.925 1.00 0.00 N ATOM 1386 CA ALA A 89 13.285 13.754 3.661 1.00 0.00 C ATOM 1387 C ALA A 89 11.987 13.471 2.913 1.00 0.00 C ATOM 1388 O ALA A 89 11.250 12.545 3.253 1.00 0.00 O ATOM 1389 CB ALA A 89 14.022 12.439 3.921 1.00 0.00 C ATOM 0 H ALA A 89 12.211 14.058 5.440 1.00 0.00 H new ATOM 0 HA ALA A 89 13.910 14.406 3.051 1.00 0.00 H new ATOM 0 HB1 ALA A 89 14.224 11.942 2.972 1.00 0.00 H new ATOM 0 HB2 ALA A 89 14.963 12.644 4.431 1.00 0.00 H new ATOM 0 HB3 ALA A 89 13.404 11.793 4.545 1.00 0.00 H new ATOM 1395 N SER A 90 11.710 14.277 1.891 1.00 0.00 N ATOM 1396 CA SER A 90 10.488 14.113 1.112 1.00 0.00 C ATOM 1397 C SER A 90 10.816 13.708 -0.321 1.00 0.00 C ATOM 1398 O SER A 90 11.829 14.128 -0.880 1.00 0.00 O ATOM 1399 CB SER A 90 9.695 15.420 1.105 1.00 0.00 C ATOM 1400 OG SER A 90 10.365 16.371 0.288 1.00 0.00 O ATOM 0 H SER A 90 12.310 15.043 1.586 1.00 0.00 H new ATOM 0 HA SER A 90 9.889 13.327 1.572 1.00 0.00 H new ATOM 0 HB2 SER A 90 8.687 15.245 0.728 1.00 0.00 H new ATOM 0 HB3 SER A 90 9.594 15.803 2.121 1.00 0.00 H new ATOM 0 HG SER A 90 9.858 17.210 0.280 1.00 0.00 H new ATOM 1406 N VAL A 91 9.951 12.890 -0.911 1.00 0.00 N ATOM 1407 CA VAL A 91 10.151 12.441 -2.284 1.00 0.00 C ATOM 1408 C VAL A 91 8.849 11.898 -2.864 1.00 0.00 C ATOM 1409 O VAL A 91 7.989 11.409 -2.131 1.00 0.00 O ATOM 1410 CB VAL A 91 11.224 11.351 -2.326 1.00 0.00 C ATOM 1411 CG1 VAL A 91 10.656 10.053 -1.751 1.00 0.00 C ATOM 1412 CG2 VAL A 91 11.658 11.120 -3.775 1.00 0.00 C ATOM 0 H VAL A 91 9.110 12.526 -0.463 1.00 0.00 H new ATOM 0 HA VAL A 91 10.475 13.293 -2.882 1.00 0.00 H new ATOM 0 HB VAL A 91 12.084 11.664 -1.734 1.00 0.00 H new ATOM 0 HG11 VAL A 91 11.420 9.277 -1.781 1.00 0.00 H new ATOM 0 HG12 VAL A 91 10.346 10.217 -0.719 1.00 0.00 H new ATOM 0 HG13 VAL A 91 9.796 9.739 -2.343 1.00 0.00 H new ATOM 0 HG21 VAL A 91 12.422 10.344 -3.806 1.00 0.00 H new ATOM 0 HG22 VAL A 91 10.798 10.807 -4.367 1.00 0.00 H new ATOM 0 HG23 VAL A 91 12.063 12.045 -4.185 1.00 0.00 H new ATOM 1422 N VAL A 92 8.709 11.989 -4.182 1.00 0.00 N ATOM 1423 CA VAL A 92 7.507 11.502 -4.849 1.00 0.00 C ATOM 1424 C VAL A 92 7.824 10.278 -5.702 1.00 0.00 C ATOM 1425 O VAL A 92 8.829 10.247 -6.412 1.00 0.00 O ATOM 1426 CB VAL A 92 6.919 12.604 -5.732 1.00 0.00 C ATOM 1427 CG1 VAL A 92 5.571 12.147 -6.289 1.00 0.00 C ATOM 1428 CG2 VAL A 92 6.723 13.873 -4.899 1.00 0.00 C ATOM 0 H VAL A 92 9.408 12.393 -4.806 1.00 0.00 H new ATOM 0 HA VAL A 92 6.780 11.219 -4.087 1.00 0.00 H new ATOM 0 HB VAL A 92 7.601 12.811 -6.557 1.00 0.00 H new ATOM 0 HG11 VAL A 92 5.152 12.932 -6.918 1.00 0.00 H new ATOM 0 HG12 VAL A 92 5.710 11.243 -6.882 1.00 0.00 H new ATOM 0 HG13 VAL A 92 4.888 11.940 -5.465 1.00 0.00 H new ATOM 0 HG21 VAL A 92 6.304 14.659 -5.527 1.00 0.00 H new ATOM 0 HG22 VAL A 92 6.041 13.665 -4.074 1.00 0.00 H new ATOM 0 HG23 VAL A 92 7.684 14.199 -4.502 1.00 0.00 H new ATOM 1438 N VAL A 93 6.957 9.273 -5.627 1.00 0.00 N ATOM 1439 CA VAL A 93 7.154 8.049 -6.395 1.00 0.00 C ATOM 1440 C VAL A 93 6.013 7.853 -7.388 1.00 0.00 C ATOM 1441 O VAL A 93 4.841 7.960 -7.030 1.00 0.00 O ATOM 1442 CB VAL A 93 7.225 6.846 -5.452 1.00 0.00 C ATOM 1443 CG1 VAL A 93 7.593 5.594 -6.249 1.00 0.00 C ATOM 1444 CG2 VAL A 93 8.288 7.100 -4.383 1.00 0.00 C ATOM 0 H VAL A 93 6.118 9.281 -5.047 1.00 0.00 H new ATOM 0 HA VAL A 93 8.091 8.133 -6.946 1.00 0.00 H new ATOM 0 HB VAL A 93 6.256 6.701 -4.975 1.00 0.00 H new ATOM 0 HG11 VAL A 93 7.644 4.737 -5.577 1.00 0.00 H new ATOM 0 HG12 VAL A 93 6.836 5.413 -7.012 1.00 0.00 H new ATOM 0 HG13 VAL A 93 8.562 5.738 -6.727 1.00 0.00 H new ATOM 0 HG21 VAL A 93 8.340 6.244 -3.711 1.00 0.00 H new ATOM 0 HG22 VAL A 93 9.257 7.245 -4.861 1.00 0.00 H new ATOM 0 HG23 VAL A 93 8.026 7.992 -3.815 1.00 0.00 H new ATOM 1454 N TYR A 94 6.364 7.563 -8.637 1.00 0.00 N ATOM 1455 CA TYR A 94 5.360 7.358 -9.673 1.00 0.00 C ATOM 1456 C TYR A 94 4.976 5.885 -9.762 1.00 0.00 C ATOM 1457 O TYR A 94 5.734 5.009 -9.346 1.00 0.00 O ATOM 1458 CB TYR A 94 5.899 7.833 -11.024 1.00 0.00 C ATOM 1459 CG TYR A 94 6.112 9.327 -10.982 1.00 0.00 C ATOM 1460 CD1 TYR A 94 5.019 10.186 -10.818 1.00 0.00 C ATOM 1461 CD2 TYR A 94 7.405 9.853 -11.095 1.00 0.00 C ATOM 1462 CE1 TYR A 94 5.219 11.571 -10.769 1.00 0.00 C ATOM 1463 CE2 TYR A 94 7.605 11.237 -11.046 1.00 0.00 C ATOM 1464 CZ TYR A 94 6.512 12.096 -10.883 1.00 0.00 C ATOM 1465 OH TYR A 94 6.708 13.461 -10.835 1.00 0.00 O ATOM 0 H TYR A 94 7.329 7.465 -8.954 1.00 0.00 H new ATOM 0 HA TYR A 94 4.473 7.936 -9.414 1.00 0.00 H new ATOM 0 HB2 TYR A 94 6.837 7.327 -11.252 1.00 0.00 H new ATOM 0 HB3 TYR A 94 5.198 7.577 -11.818 1.00 0.00 H new ATOM 0 HD1 TYR A 94 4.022 9.781 -10.729 1.00 0.00 H new ATOM 0 HD2 TYR A 94 8.248 9.190 -11.220 1.00 0.00 H new ATOM 0 HE1 TYR A 94 4.376 12.234 -10.643 1.00 0.00 H new ATOM 0 HE2 TYR A 94 8.602 11.642 -11.134 1.00 0.00 H new ATOM 0 HH TYR A 94 7.664 13.658 -10.928 1.00 0.00 H new ATOM 1475 N PRO A 95 3.818 5.604 -10.293 1.00 0.00 N ATOM 1476 CA PRO A 95 3.309 4.208 -10.430 1.00 0.00 C ATOM 1477 C PRO A 95 4.174 3.373 -11.371 1.00 0.00 C ATOM 1478 O PRO A 95 4.850 3.908 -12.249 1.00 0.00 O ATOM 1479 CB PRO A 95 1.895 4.379 -10.995 1.00 0.00 C ATOM 1480 CG PRO A 95 1.542 5.813 -10.775 1.00 0.00 C ATOM 1481 CD PRO A 95 2.848 6.602 -10.835 1.00 0.00 C ATOM 0 HA PRO A 95 3.325 3.675 -9.479 1.00 0.00 H new ATOM 0 HB2 PRO A 95 1.864 4.126 -12.055 1.00 0.00 H new ATOM 0 HB3 PRO A 95 1.189 3.720 -10.489 1.00 0.00 H new ATOM 0 HG2 PRO A 95 0.845 6.161 -11.537 1.00 0.00 H new ATOM 0 HG3 PRO A 95 1.053 5.947 -9.810 1.00 0.00 H new ATOM 0 HD2 PRO A 95 3.097 6.908 -11.851 1.00 0.00 H new ATOM 0 HD3 PRO A 95 2.809 7.508 -10.230 1.00 0.00 H new ATOM 1489 N CYS A 96 4.147 2.057 -11.178 1.00 0.00 N ATOM 1490 CA CYS A 96 4.928 1.156 -12.016 1.00 0.00 C ATOM 1491 C CYS A 96 6.405 1.536 -11.976 1.00 0.00 C ATOM 1492 O CYS A 96 7.154 1.257 -12.913 1.00 0.00 O ATOM 1493 CB CYS A 96 4.422 1.214 -13.459 1.00 0.00 C ATOM 1494 SG CYS A 96 5.142 -0.151 -14.406 1.00 0.00 S ATOM 0 H CYS A 96 3.597 1.595 -10.454 1.00 0.00 H new ATOM 0 HA CYS A 96 4.814 0.142 -11.633 1.00 0.00 H new ATOM 0 HB2 CYS A 96 3.334 1.149 -13.477 1.00 0.00 H new ATOM 0 HB3 CYS A 96 4.692 2.168 -13.912 1.00 0.00 H new ATOM 0 HG CYS A 96 6.433 -0.153 -14.251 1.00 0.00 H new ATOM 1500 N GLU A 97 6.816 2.173 -10.885 1.00 0.00 N ATOM 1501 CA GLU A 97 8.207 2.585 -10.731 1.00 0.00 C ATOM 1502 C GLU A 97 8.625 2.521 -9.265 1.00 0.00 C ATOM 1503 O GLU A 97 7.786 2.589 -8.366 1.00 0.00 O ATOM 1504 CB GLU A 97 8.389 4.012 -11.252 1.00 0.00 C ATOM 1505 CG GLU A 97 9.875 4.281 -11.495 1.00 0.00 C ATOM 1506 CD GLU A 97 10.075 5.718 -11.963 1.00 0.00 C ATOM 1507 OE1 GLU A 97 9.095 6.442 -12.023 1.00 0.00 O ATOM 1508 OE2 GLU A 97 11.205 6.074 -12.254 1.00 0.00 O ATOM 0 H GLU A 97 6.211 2.414 -10.100 1.00 0.00 H new ATOM 0 HA GLU A 97 8.834 1.904 -11.307 1.00 0.00 H new ATOM 0 HB2 GLU A 97 7.828 4.147 -12.177 1.00 0.00 H new ATOM 0 HB3 GLU A 97 7.992 4.727 -10.531 1.00 0.00 H new ATOM 0 HG2 GLU A 97 10.439 4.106 -10.579 1.00 0.00 H new ATOM 0 HG3 GLU A 97 10.261 3.589 -12.244 1.00 0.00 H new ATOM 1515 N THR A 98 9.927 2.390 -9.031 1.00 0.00 N ATOM 1516 CA THR A 98 10.446 2.319 -7.670 1.00 0.00 C ATOM 1517 C THR A 98 11.633 3.264 -7.501 1.00 0.00 C ATOM 1518 O THR A 98 12.519 3.319 -8.353 1.00 0.00 O ATOM 1519 CB THR A 98 10.880 0.888 -7.348 1.00 0.00 C ATOM 1520 OG1 THR A 98 9.841 -0.011 -7.707 1.00 0.00 O ATOM 1521 CG2 THR A 98 11.171 0.765 -5.852 1.00 0.00 C ATOM 0 H THR A 98 10.637 2.331 -9.761 1.00 0.00 H new ATOM 0 HA THR A 98 9.655 2.619 -6.983 1.00 0.00 H new ATOM 0 HB THR A 98 11.781 0.645 -7.911 1.00 0.00 H new ATOM 0 HG1 THR A 98 9.656 -0.614 -6.957 1.00 0.00 H new ATOM 0 HG21 THR A 98 11.480 -0.255 -5.624 1.00 0.00 H new ATOM 0 HG22 THR A 98 11.969 1.456 -5.579 1.00 0.00 H new ATOM 0 HG23 THR A 98 10.272 1.007 -5.285 1.00 0.00 H new ATOM 1529 N GLU A 99 11.642 4.004 -6.398 1.00 0.00 N ATOM 1530 CA GLU A 99 12.721 4.947 -6.132 1.00 0.00 C ATOM 1531 C GLU A 99 13.277 4.746 -4.725 1.00 0.00 C ATOM 1532 O GLU A 99 12.582 4.250 -3.838 1.00 0.00 O ATOM 1533 CB GLU A 99 12.211 6.382 -6.280 1.00 0.00 C ATOM 1534 CG GLU A 99 11.662 6.585 -7.693 1.00 0.00 C ATOM 1535 CD GLU A 99 11.215 8.032 -7.875 1.00 0.00 C ATOM 1536 OE1 GLU A 99 11.168 8.746 -6.887 1.00 0.00 O ATOM 1537 OE2 GLU A 99 10.927 8.404 -9.000 1.00 0.00 O ATOM 0 H GLU A 99 10.920 3.970 -5.679 1.00 0.00 H new ATOM 0 HA GLU A 99 13.518 4.768 -6.854 1.00 0.00 H new ATOM 0 HB2 GLU A 99 11.432 6.580 -5.544 1.00 0.00 H new ATOM 0 HB3 GLU A 99 13.019 7.088 -6.087 1.00 0.00 H new ATOM 0 HG2 GLU A 99 12.427 6.337 -8.429 1.00 0.00 H new ATOM 0 HG3 GLU A 99 10.823 5.912 -7.866 1.00 0.00 H new ATOM 1544 N MET A 100 14.533 5.133 -4.530 1.00 0.00 N ATOM 1545 CA MET A 100 15.170 4.999 -3.225 1.00 0.00 C ATOM 1546 C MET A 100 14.765 6.148 -2.308 1.00 0.00 C ATOM 1547 O MET A 100 14.429 7.238 -2.775 1.00 0.00 O ATOM 1548 CB MET A 100 16.692 4.985 -3.385 1.00 0.00 C ATOM 1549 CG MET A 100 17.109 3.770 -4.215 1.00 0.00 C ATOM 1550 SD MET A 100 18.714 3.167 -3.636 1.00 0.00 S ATOM 1551 CE MET A 100 18.103 2.219 -2.220 1.00 0.00 C ATOM 0 H MET A 100 15.127 5.539 -5.253 1.00 0.00 H new ATOM 0 HA MET A 100 14.842 4.060 -2.778 1.00 0.00 H new ATOM 0 HB2 MET A 100 17.025 5.902 -3.871 1.00 0.00 H new ATOM 0 HB3 MET A 100 17.170 4.951 -2.406 1.00 0.00 H new ATOM 0 HG2 MET A 100 16.360 2.983 -4.129 1.00 0.00 H new ATOM 0 HG3 MET A 100 17.168 4.039 -5.270 1.00 0.00 H new ATOM 0 HE1 MET A 100 18.815 2.292 -1.398 1.00 0.00 H new ATOM 0 HE2 MET A 100 17.140 2.619 -1.902 1.00 0.00 H new ATOM 0 HE3 MET A 100 17.985 1.174 -2.506 1.00 0.00 H new ATOM 1561 N PHE A 101 14.800 5.900 -1.004 1.00 0.00 N ATOM 1562 CA PHE A 101 14.418 6.917 -0.032 1.00 0.00 C ATOM 1563 C PHE A 101 15.631 7.371 0.774 1.00 0.00 C ATOM 1564 O PHE A 101 16.445 8.162 0.297 1.00 0.00 O ATOM 1565 CB PHE A 101 13.353 6.363 0.916 1.00 0.00 C ATOM 1566 CG PHE A 101 12.903 7.454 1.858 1.00 0.00 C ATOM 1567 CD1 PHE A 101 12.638 8.738 1.369 1.00 0.00 C ATOM 1568 CD2 PHE A 101 12.696 7.164 3.212 1.00 0.00 C ATOM 1569 CE1 PHE A 101 12.179 9.737 2.235 1.00 0.00 C ATOM 1570 CE2 PHE A 101 12.241 8.164 4.080 1.00 0.00 C ATOM 1571 CZ PHE A 101 11.983 9.450 3.592 1.00 0.00 C ATOM 0 H PHE A 101 15.087 5.010 -0.597 1.00 0.00 H new ATOM 0 HA PHE A 101 14.013 7.773 -0.572 1.00 0.00 H new ATOM 0 HB2 PHE A 101 12.504 5.986 0.346 1.00 0.00 H new ATOM 0 HB3 PHE A 101 13.755 5.522 1.481 1.00 0.00 H new ATOM 0 HD1 PHE A 101 12.788 8.958 0.322 1.00 0.00 H new ATOM 0 HD2 PHE A 101 12.887 6.169 3.587 1.00 0.00 H new ATOM 0 HE1 PHE A 101 11.976 10.728 1.857 1.00 0.00 H new ATOM 0 HE2 PHE A 101 12.089 7.943 5.126 1.00 0.00 H new ATOM 0 HZ PHE A 101 11.633 10.221 4.262 1.00 0.00 H new ATOM 1581 N ILE A 102 15.746 6.866 1.997 1.00 0.00 N ATOM 1582 CA ILE A 102 16.869 7.220 2.857 1.00 0.00 C ATOM 1583 C ILE A 102 17.549 5.965 3.396 1.00 0.00 C ATOM 1584 O ILE A 102 16.967 4.879 3.387 1.00 0.00 O ATOM 1585 CB ILE A 102 16.380 8.077 4.025 1.00 0.00 C ATOM 1586 CG1 ILE A 102 15.495 7.231 4.944 1.00 0.00 C ATOM 1587 CG2 ILE A 102 15.571 9.259 3.488 1.00 0.00 C ATOM 1588 CD1 ILE A 102 16.374 6.449 5.922 1.00 0.00 C ATOM 0 H ILE A 102 15.080 6.215 2.413 1.00 0.00 H new ATOM 0 HA ILE A 102 17.590 7.785 2.267 1.00 0.00 H new ATOM 0 HB ILE A 102 17.238 8.448 4.586 1.00 0.00 H new ATOM 0 HG12 ILE A 102 14.804 7.872 5.492 1.00 0.00 H new ATOM 0 HG13 ILE A 102 14.891 6.544 4.352 1.00 0.00 H new ATOM 0 HG21 ILE A 102 15.223 9.870 4.321 1.00 0.00 H new ATOM 0 HG22 ILE A 102 16.200 9.863 2.833 1.00 0.00 H new ATOM 0 HG23 ILE A 102 14.714 8.888 2.927 1.00 0.00 H new ATOM 0 HD11 ILE A 102 15.744 5.847 6.576 1.00 0.00 H new ATOM 0 HD12 ILE A 102 17.047 5.797 5.365 1.00 0.00 H new ATOM 0 HD13 ILE A 102 16.959 7.146 6.523 1.00 0.00 H new ATOM 1600 N GLU A 103 18.783 6.120 3.863 1.00 0.00 N ATOM 1601 CA GLU A 103 19.535 4.992 4.400 1.00 0.00 C ATOM 1602 C GLU A 103 20.263 5.392 5.680 1.00 0.00 C ATOM 1603 O GLU A 103 20.524 6.572 5.914 1.00 0.00 O ATOM 1604 CB GLU A 103 20.549 4.500 3.365 1.00 0.00 C ATOM 1605 CG GLU A 103 21.442 3.428 3.994 1.00 0.00 C ATOM 1606 CD GLU A 103 22.588 4.087 4.755 1.00 0.00 C ATOM 1607 OE1 GLU A 103 22.688 5.300 4.701 1.00 0.00 O ATOM 1608 OE2 GLU A 103 23.348 3.366 5.381 1.00 0.00 O ATOM 0 H GLU A 103 19.281 7.010 3.881 1.00 0.00 H new ATOM 0 HA GLU A 103 18.834 4.190 4.631 1.00 0.00 H new ATOM 0 HB2 GLU A 103 20.030 4.093 2.497 1.00 0.00 H new ATOM 0 HB3 GLU A 103 21.157 5.333 3.011 1.00 0.00 H new ATOM 0 HG2 GLU A 103 20.856 2.805 4.670 1.00 0.00 H new ATOM 0 HG3 GLU A 103 21.838 2.772 3.219 1.00 0.00 H new ATOM 1615 N GLY A 104 20.587 4.401 6.504 1.00 0.00 N ATOM 1616 CA GLY A 104 21.291 4.660 7.755 1.00 0.00 C ATOM 1617 C GLY A 104 20.466 4.193 8.950 1.00 0.00 C ATOM 1618 O GLY A 104 19.547 3.388 8.804 1.00 0.00 O ATOM 0 H GLY A 104 20.375 3.418 6.330 1.00 0.00 H new ATOM 0 HA2 GLY A 104 22.253 4.147 7.749 1.00 0.00 H new ATOM 0 HA3 GLY A 104 21.499 5.726 7.846 1.00 0.00 H new ATOM 1622 N ARG A 105 20.801 4.703 10.131 1.00 0.00 N ATOM 1623 CA ARG A 105 20.085 4.328 11.345 1.00 0.00 C ATOM 1624 C ARG A 105 18.936 5.296 11.607 1.00 0.00 C ATOM 1625 O ARG A 105 19.091 6.509 11.470 1.00 0.00 O ATOM 1626 CB ARG A 105 21.043 4.332 12.539 1.00 0.00 C ATOM 1627 CG ARG A 105 20.370 3.661 13.738 1.00 0.00 C ATOM 1628 CD ARG A 105 21.321 3.681 14.935 1.00 0.00 C ATOM 1629 NE ARG A 105 21.456 5.039 15.450 1.00 0.00 N ATOM 1630 CZ ARG A 105 22.385 5.342 16.351 1.00 0.00 C ATOM 1631 NH1 ARG A 105 23.194 4.418 16.790 1.00 0.00 N ATOM 1632 NH2 ARG A 105 22.487 6.565 16.796 1.00 0.00 N ATOM 0 H ARG A 105 21.558 5.372 10.273 1.00 0.00 H new ATOM 0 HA ARG A 105 19.678 3.326 11.211 1.00 0.00 H new ATOM 0 HB2 ARG A 105 21.962 3.805 12.283 1.00 0.00 H new ATOM 0 HB3 ARG A 105 21.322 5.355 12.791 1.00 0.00 H new ATOM 0 HG2 ARG A 105 19.445 4.181 13.987 1.00 0.00 H new ATOM 0 HG3 ARG A 105 20.102 2.634 13.490 1.00 0.00 H new ATOM 0 HD2 ARG A 105 20.945 3.023 15.718 1.00 0.00 H new ATOM 0 HD3 ARG A 105 22.298 3.298 14.639 1.00 0.00 H new ATOM 0 HE ARG A 105 20.827 5.768 15.113 1.00 0.00 H new ATOM 0 HH11 ARG A 105 23.114 3.463 16.442 1.00 0.00 H new ATOM 0 HH12 ARG A 105 23.907 4.651 17.481 1.00 0.00 H new ATOM 0 HH21 ARG A 105 21.854 7.287 16.452 1.00 0.00 H new ATOM 0 HH22 ARG A 105 23.200 6.798 17.487 1.00 0.00 H new ATOM 1646 N VAL A 106 17.783 4.752 11.982 1.00 0.00 N ATOM 1647 CA VAL A 106 16.614 5.581 12.256 1.00 0.00 C ATOM 1648 C VAL A 106 16.284 5.577 13.745 1.00 0.00 C ATOM 1649 O VAL A 106 16.170 4.519 14.363 1.00 0.00 O ATOM 1650 CB VAL A 106 15.411 5.063 11.465 1.00 0.00 C ATOM 1651 CG1 VAL A 106 14.340 6.153 11.391 1.00 0.00 C ATOM 1652 CG2 VAL A 106 15.856 4.690 10.049 1.00 0.00 C ATOM 0 H VAL A 106 17.633 3.750 12.102 1.00 0.00 H new ATOM 0 HA VAL A 106 16.840 6.603 11.951 1.00 0.00 H new ATOM 0 HB VAL A 106 15.001 4.184 11.962 1.00 0.00 H new ATOM 0 HG11 VAL A 106 13.483 5.784 10.827 1.00 0.00 H new ATOM 0 HG12 VAL A 106 14.023 6.421 12.399 1.00 0.00 H new ATOM 0 HG13 VAL A 106 14.750 7.032 10.894 1.00 0.00 H new ATOM 0 HG21 VAL A 106 15.000 4.321 9.484 1.00 0.00 H new ATOM 0 HG22 VAL A 106 16.266 5.570 9.553 1.00 0.00 H new ATOM 0 HG23 VAL A 106 16.619 3.914 10.100 1.00 0.00 H new ATOM 1662 N ASN A 107 16.129 6.769 14.311 1.00 0.00 N ATOM 1663 CA ASN A 107 15.812 6.898 15.729 1.00 0.00 C ATOM 1664 C ASN A 107 14.721 7.944 15.935 1.00 0.00 C ATOM 1665 O ASN A 107 14.888 9.108 15.571 1.00 0.00 O ATOM 1666 CB ASN A 107 17.063 7.300 16.512 1.00 0.00 C ATOM 1667 CG ASN A 107 16.665 7.931 17.842 1.00 0.00 C ATOM 1668 OD1 ASN A 107 15.791 7.416 18.539 1.00 0.00 O ATOM 1669 ND2 ASN A 107 17.259 9.024 18.239 1.00 0.00 N ATOM 0 H ASN A 107 16.217 7.655 13.813 1.00 0.00 H new ATOM 0 HA ASN A 107 15.454 5.935 16.093 1.00 0.00 H new ATOM 0 HB2 ASN A 107 17.689 6.425 16.688 1.00 0.00 H new ATOM 0 HB3 ASN A 107 17.656 8.004 15.929 1.00 0.00 H new ATOM 0 HD21 ASN A 107 16.999 9.452 19.128 1.00 0.00 H new ATOM 0 HD22 ASN A 107 17.983 9.450 17.661 1.00 0.00 H new ATOM 1676 N GLY A 108 13.602 7.523 16.515 1.00 0.00 N ATOM 1677 CA GLY A 108 12.493 8.437 16.763 1.00 0.00 C ATOM 1678 C GLY A 108 12.226 9.302 15.537 1.00 0.00 C ATOM 1679 O GLY A 108 12.918 10.292 15.303 1.00 0.00 O ATOM 0 H GLY A 108 13.439 6.563 16.820 1.00 0.00 H new ATOM 0 HA2 GLY A 108 11.597 7.870 17.017 1.00 0.00 H new ATOM 0 HA3 GLY A 108 12.722 9.071 17.619 1.00 0.00 H new ATOM 1683 N PHE A 109 11.221 8.923 14.755 1.00 0.00 N ATOM 1684 CA PHE A 109 10.887 9.670 13.548 1.00 0.00 C ATOM 1685 C PHE A 109 9.382 9.652 13.299 1.00 0.00 C ATOM 1686 O PHE A 109 8.687 8.717 13.700 1.00 0.00 O ATOM 1687 CB PHE A 109 11.608 9.058 12.345 1.00 0.00 C ATOM 1688 CG PHE A 109 11.202 7.612 12.199 1.00 0.00 C ATOM 1689 CD1 PHE A 109 11.750 6.642 13.047 1.00 0.00 C ATOM 1690 CD2 PHE A 109 10.269 7.242 11.223 1.00 0.00 C ATOM 1691 CE1 PHE A 109 11.367 5.302 12.917 1.00 0.00 C ATOM 1692 CE2 PHE A 109 9.886 5.901 11.094 1.00 0.00 C ATOM 1693 CZ PHE A 109 10.436 4.931 11.940 1.00 0.00 C ATOM 0 H PHE A 109 10.629 8.112 14.932 1.00 0.00 H new ATOM 0 HA PHE A 109 11.207 10.703 13.684 1.00 0.00 H new ATOM 0 HB2 PHE A 109 11.359 9.610 11.439 1.00 0.00 H new ATOM 0 HB3 PHE A 109 12.687 9.132 12.478 1.00 0.00 H new ATOM 0 HD1 PHE A 109 12.468 6.928 13.801 1.00 0.00 H new ATOM 0 HD2 PHE A 109 9.845 7.990 10.570 1.00 0.00 H new ATOM 0 HE1 PHE A 109 11.790 4.554 13.571 1.00 0.00 H new ATOM 0 HE2 PHE A 109 9.166 5.615 10.341 1.00 0.00 H new ATOM 0 HZ PHE A 109 10.142 3.897 11.839 1.00 0.00 H new ATOM 1703 N LYS A 110 8.886 10.690 12.633 1.00 0.00 N ATOM 1704 CA LYS A 110 7.466 10.779 12.318 1.00 0.00 C ATOM 1705 C LYS A 110 7.240 10.568 10.824 1.00 0.00 C ATOM 1706 O LYS A 110 7.940 11.148 9.993 1.00 0.00 O ATOM 1707 CB LYS A 110 6.922 12.147 12.732 1.00 0.00 C ATOM 1708 CG LYS A 110 7.074 12.320 14.245 1.00 0.00 C ATOM 1709 CD LYS A 110 6.904 13.796 14.611 1.00 0.00 C ATOM 1710 CE LYS A 110 5.581 14.314 14.040 1.00 0.00 C ATOM 1711 NZ LYS A 110 4.518 13.289 14.240 1.00 0.00 N ATOM 0 H LYS A 110 9.444 11.477 12.303 1.00 0.00 H new ATOM 0 HA LYS A 110 6.939 10.000 12.869 1.00 0.00 H new ATOM 0 HB2 LYS A 110 7.460 12.938 12.209 1.00 0.00 H new ATOM 0 HB3 LYS A 110 5.873 12.234 12.449 1.00 0.00 H new ATOM 0 HG2 LYS A 110 6.331 11.717 14.767 1.00 0.00 H new ATOM 0 HG3 LYS A 110 8.054 11.966 14.565 1.00 0.00 H new ATOM 0 HD2 LYS A 110 6.917 13.917 15.694 1.00 0.00 H new ATOM 0 HD3 LYS A 110 7.736 14.378 14.215 1.00 0.00 H new ATOM 0 HE2 LYS A 110 5.300 15.245 14.532 1.00 0.00 H new ATOM 0 HE3 LYS A 110 5.693 14.535 12.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 3.602 13.761 14.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 4.467 12.674 13.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 4.742 12.715 15.078 1.00 0.00 H new ATOM 1725 N SER A 111 6.265 9.730 10.490 1.00 0.00 N ATOM 1726 CA SER A 111 5.971 9.430 9.093 1.00 0.00 C ATOM 1727 C SER A 111 4.623 10.013 8.682 1.00 0.00 C ATOM 1728 O SER A 111 3.633 9.888 9.404 1.00 0.00 O ATOM 1729 CB SER A 111 5.961 7.918 8.878 1.00 0.00 C ATOM 1730 OG SER A 111 7.184 7.368 9.350 1.00 0.00 O ATOM 0 H SER A 111 5.668 9.249 11.163 1.00 0.00 H new ATOM 0 HA SER A 111 6.747 9.883 8.476 1.00 0.00 H new ATOM 0 HB2 SER A 111 5.120 7.470 9.406 1.00 0.00 H new ATOM 0 HB3 SER A 111 5.831 7.690 7.820 1.00 0.00 H new ATOM 0 HG SER A 111 7.180 6.397 9.215 1.00 0.00 H new ATOM 1736 N LYS A 112 4.594 10.647 7.514 1.00 0.00 N ATOM 1737 CA LYS A 112 3.358 11.222 6.993 1.00 0.00 C ATOM 1738 C LYS A 112 3.257 10.985 5.490 1.00 0.00 C ATOM 1739 O LYS A 112 4.054 11.513 4.714 1.00 0.00 O ATOM 1740 CB LYS A 112 3.318 12.725 7.278 1.00 0.00 C ATOM 1741 CG LYS A 112 1.950 13.284 6.880 1.00 0.00 C ATOM 1742 CD LYS A 112 1.914 14.789 7.150 1.00 0.00 C ATOM 1743 CE LYS A 112 0.504 15.320 6.889 1.00 0.00 C ATOM 1744 NZ LYS A 112 -0.479 14.532 7.686 1.00 0.00 N ATOM 0 H LYS A 112 5.408 10.775 6.913 1.00 0.00 H new ATOM 0 HA LYS A 112 2.515 10.739 7.487 1.00 0.00 H new ATOM 0 HB2 LYS A 112 3.505 12.910 8.336 1.00 0.00 H new ATOM 0 HB3 LYS A 112 4.106 13.233 6.722 1.00 0.00 H new ATOM 0 HG2 LYS A 112 1.759 13.089 5.825 1.00 0.00 H new ATOM 0 HG3 LYS A 112 1.163 12.784 7.444 1.00 0.00 H new ATOM 0 HD2 LYS A 112 2.205 14.991 8.181 1.00 0.00 H new ATOM 0 HD3 LYS A 112 2.632 15.302 6.509 1.00 0.00 H new ATOM 0 HE2 LYS A 112 0.445 16.374 7.159 1.00 0.00 H new ATOM 0 HE3 LYS A 112 0.268 15.249 5.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -1.231 15.162 8.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -0.895 13.790 7.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 0.003 14.094 8.497 1.00 0.00 H new ATOM 1758 N MET A 113 2.279 10.182 5.083 1.00 0.00 N ATOM 1759 CA MET A 113 2.104 9.865 3.670 1.00 0.00 C ATOM 1760 C MET A 113 0.732 10.311 3.175 1.00 0.00 C ATOM 1761 O MET A 113 -0.143 10.665 3.965 1.00 0.00 O ATOM 1762 CB MET A 113 2.259 8.358 3.453 1.00 0.00 C ATOM 1763 CG MET A 113 3.707 7.950 3.723 1.00 0.00 C ATOM 1764 SD MET A 113 3.930 6.205 3.297 1.00 0.00 S ATOM 1765 CE MET A 113 3.081 5.510 4.737 1.00 0.00 C ATOM 0 H MET A 113 1.601 9.742 5.705 1.00 0.00 H new ATOM 0 HA MET A 113 2.867 10.400 3.105 1.00 0.00 H new ATOM 0 HB2 MET A 113 1.587 7.813 4.116 1.00 0.00 H new ATOM 0 HB3 MET A 113 1.981 8.096 2.432 1.00 0.00 H new ATOM 0 HG2 MET A 113 4.386 8.569 3.136 1.00 0.00 H new ATOM 0 HG3 MET A 113 3.953 8.114 4.772 1.00 0.00 H new ATOM 0 HE1 MET A 113 3.364 4.464 4.856 1.00 0.00 H new ATOM 0 HE2 MET A 113 3.364 6.067 5.630 1.00 0.00 H new ATOM 0 HE3 MET A 113 2.003 5.580 4.593 1.00 0.00 H new ATOM 1775 N ASP A 114 0.555 10.287 1.858 1.00 0.00 N ATOM 1776 CA ASP A 114 -0.712 10.684 1.254 1.00 0.00 C ATOM 1777 C ASP A 114 -0.803 10.167 -0.178 1.00 0.00 C ATOM 1778 O ASP A 114 0.171 9.644 -0.720 1.00 0.00 O ATOM 1779 CB ASP A 114 -0.838 12.209 1.260 1.00 0.00 C ATOM 1780 CG ASP A 114 -2.296 12.612 1.068 1.00 0.00 C ATOM 1781 OD1 ASP A 114 -2.726 12.683 -0.073 1.00 0.00 O ATOM 1782 OD2 ASP A 114 -2.962 12.845 2.062 1.00 0.00 O ATOM 0 H ASP A 114 1.270 9.998 1.191 1.00 0.00 H new ATOM 0 HA ASP A 114 -1.525 10.252 1.837 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -0.462 12.610 2.202 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -0.226 12.636 0.465 1.00 0.00 H new ATOM 1787 N ALA A 115 -1.976 10.311 -0.785 1.00 0.00 N ATOM 1788 CA ALA A 115 -2.175 9.851 -2.155 1.00 0.00 C ATOM 1789 C ALA A 115 -2.762 10.964 -3.019 1.00 0.00 C ATOM 1790 O ALA A 115 -3.980 11.085 -3.147 1.00 0.00 O ATOM 1791 CB ALA A 115 -3.113 8.643 -2.172 1.00 0.00 C ATOM 0 H ALA A 115 -2.796 10.738 -0.355 1.00 0.00 H new ATOM 0 HA ALA A 115 -1.205 9.564 -2.562 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -3.255 8.307 -3.199 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -2.677 7.836 -1.583 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -4.076 8.924 -1.746 1.00 0.00 H new ATOM 1797 N LEU A 116 -1.887 11.770 -3.609 1.00 0.00 N ATOM 1798 CA LEU A 116 -2.328 12.872 -4.456 1.00 0.00 C ATOM 1799 C LEU A 116 -2.550 12.390 -5.886 1.00 0.00 C ATOM 1800 O LEU A 116 -2.115 11.302 -6.263 1.00 0.00 O ATOM 1801 CB LEU A 116 -1.281 13.988 -4.446 1.00 0.00 C ATOM 1802 CG LEU A 116 -0.849 14.267 -3.006 1.00 0.00 C ATOM 1803 CD1 LEU A 116 0.307 15.269 -3.002 1.00 0.00 C ATOM 1804 CD2 LEU A 116 -2.030 14.850 -2.225 1.00 0.00 C ATOM 0 H LEU A 116 -0.875 11.683 -3.518 1.00 0.00 H new ATOM 0 HA LEU A 116 -3.270 13.256 -4.064 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -0.419 13.698 -5.046 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -1.693 14.892 -4.895 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.524 13.337 -2.539 1.00 0.00 H new ATOM 0 HD11 LEU A 116 0.614 15.467 -1.975 1.00 0.00 H new ATOM 0 HD12 LEU A 116 1.148 14.856 -3.559 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -0.016 16.199 -3.470 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -1.724 15.050 -1.198 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -2.353 15.779 -2.694 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -2.854 14.137 -2.226 1.00 0.00 H new ATOM 1816 N PRO A 117 -3.222 13.179 -6.680 1.00 0.00 N ATOM 1817 CA PRO A 117 -3.514 12.836 -8.103 1.00 0.00 C ATOM 1818 C PRO A 117 -2.315 13.088 -9.013 1.00 0.00 C ATOM 1819 O PRO A 117 -1.492 13.963 -8.744 1.00 0.00 O ATOM 1820 CB PRO A 117 -4.682 13.756 -8.473 1.00 0.00 C ATOM 1821 CG PRO A 117 -5.036 14.479 -7.215 1.00 0.00 C ATOM 1822 CD PRO A 117 -3.776 14.499 -6.351 1.00 0.00 C ATOM 0 HA PRO A 117 -3.747 11.778 -8.226 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -4.397 14.454 -9.260 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -5.530 13.182 -8.848 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -5.372 15.493 -7.433 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -5.853 13.977 -6.697 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -3.101 15.313 -6.617 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -4.000 14.604 -5.289 1.00 0.00 H new ATOM 1830 N LEU A 118 -2.225 12.318 -10.094 1.00 0.00 N ATOM 1831 CA LEU A 118 -1.121 12.468 -11.034 1.00 0.00 C ATOM 1832 C LEU A 118 -1.331 13.697 -11.912 1.00 0.00 C ATOM 1833 O LEU A 118 -2.319 13.789 -12.641 1.00 0.00 O ATOM 1834 CB LEU A 118 -1.011 11.223 -11.917 1.00 0.00 C ATOM 1835 CG LEU A 118 -0.761 9.994 -11.042 1.00 0.00 C ATOM 1836 CD1 LEU A 118 -1.222 8.739 -11.784 1.00 0.00 C ATOM 1837 CD2 LEU A 118 0.734 9.882 -10.734 1.00 0.00 C ATOM 0 H LEU A 118 -2.897 11.591 -10.338 1.00 0.00 H new ATOM 0 HA LEU A 118 -0.199 12.592 -10.465 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -1.927 11.091 -12.493 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -0.198 11.343 -12.633 1.00 0.00 H new ATOM 0 HG LEU A 118 -1.318 10.092 -10.110 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -1.044 7.862 -11.161 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -2.286 8.817 -12.005 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -0.664 8.642 -12.715 1.00 0.00 H new ATOM 0 HD21 LEU A 118 0.912 9.006 -10.110 1.00 0.00 H new ATOM 0 HD22 LEU A 118 1.291 9.784 -11.666 1.00 0.00 H new ATOM 0 HD23 LEU A 118 1.065 10.777 -10.206 1.00 0.00 H new ATOM 1849 N SER A 119 -0.397 14.638 -11.835 1.00 0.00 N ATOM 1850 CA SER A 119 -0.491 15.859 -12.628 1.00 0.00 C ATOM 1851 C SER A 119 0.175 15.669 -13.986 1.00 0.00 C ATOM 1852 O SER A 119 0.622 14.572 -14.320 1.00 0.00 O ATOM 1853 CB SER A 119 0.180 17.014 -11.886 1.00 0.00 C ATOM 1854 OG SER A 119 -0.567 17.318 -10.715 1.00 0.00 O ATOM 0 H SER A 119 0.427 14.581 -11.237 1.00 0.00 H new ATOM 0 HA SER A 119 -1.545 16.089 -12.783 1.00 0.00 H new ATOM 0 HB2 SER A 119 1.202 16.745 -11.619 1.00 0.00 H new ATOM 0 HB3 SER A 119 0.239 17.890 -12.531 1.00 0.00 H new ATOM 0 HG SER A 119 -0.138 18.057 -10.236 1.00 0.00 H new ATOM 1860 N GLU A 120 0.236 16.744 -14.765 1.00 0.00 N ATOM 1861 CA GLU A 120 0.851 16.682 -16.086 1.00 0.00 C ATOM 1862 C GLU A 120 2.303 16.230 -15.977 1.00 0.00 C ATOM 1863 O GLU A 120 2.840 15.607 -16.893 1.00 0.00 O ATOM 1864 CB GLU A 120 0.791 18.056 -16.755 1.00 0.00 C ATOM 1865 CG GLU A 120 1.725 19.024 -16.025 1.00 0.00 C ATOM 1866 CD GLU A 120 3.141 18.894 -16.574 1.00 0.00 C ATOM 1867 OE1 GLU A 120 3.337 18.090 -17.471 1.00 0.00 O ATOM 1868 OE2 GLU A 120 4.010 19.600 -16.089 1.00 0.00 O ATOM 0 H GLU A 120 -0.129 17.661 -14.508 1.00 0.00 H new ATOM 0 HA GLU A 120 0.301 15.961 -16.690 1.00 0.00 H new ATOM 0 HB2 GLU A 120 1.082 17.975 -17.802 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -0.230 18.436 -16.736 1.00 0.00 H new ATOM 0 HG2 GLU A 120 1.371 20.047 -16.148 1.00 0.00 H new ATOM 0 HG3 GLU A 120 1.719 18.811 -14.956 1.00 0.00 H new ATOM 1875 N GLU A 121 2.933 16.546 -14.851 1.00 0.00 N ATOM 1876 CA GLU A 121 4.323 16.166 -14.632 1.00 0.00 C ATOM 1877 C GLU A 121 4.496 14.659 -14.789 1.00 0.00 C ATOM 1878 O GLU A 121 5.471 14.194 -15.381 1.00 0.00 O ATOM 1879 CB GLU A 121 4.768 16.589 -13.230 1.00 0.00 C ATOM 1880 CG GLU A 121 6.280 16.407 -13.096 1.00 0.00 C ATOM 1881 CD GLU A 121 7.007 17.425 -13.969 1.00 0.00 C ATOM 1882 OE1 GLU A 121 6.417 18.453 -14.261 1.00 0.00 O ATOM 1883 OE2 GLU A 121 8.141 17.163 -14.331 1.00 0.00 O ATOM 0 H GLU A 121 2.507 17.061 -14.081 1.00 0.00 H new ATOM 0 HA GLU A 121 4.939 16.672 -15.375 1.00 0.00 H new ATOM 0 HB2 GLU A 121 4.499 17.630 -13.051 1.00 0.00 H new ATOM 0 HB3 GLU A 121 4.252 15.993 -12.478 1.00 0.00 H new ATOM 0 HG2 GLU A 121 6.579 16.529 -12.055 1.00 0.00 H new ATOM 0 HG3 GLU A 121 6.561 15.396 -13.391 1.00 0.00 H new ATOM 1890 N TYR A 122 3.543 13.899 -14.258 1.00 0.00 N ATOM 1891 CA TYR A 122 3.599 12.445 -14.353 1.00 0.00 C ATOM 1892 C TYR A 122 3.487 12.004 -15.808 1.00 0.00 C ATOM 1893 O TYR A 122 4.193 11.094 -16.247 1.00 0.00 O ATOM 1894 CB TYR A 122 2.463 11.822 -13.540 1.00 0.00 C ATOM 1895 CG TYR A 122 2.239 10.401 -13.996 1.00 0.00 C ATOM 1896 CD1 TYR A 122 3.205 9.422 -13.734 1.00 0.00 C ATOM 1897 CD2 TYR A 122 1.077 10.066 -14.701 1.00 0.00 C ATOM 1898 CE1 TYR A 122 3.012 8.111 -14.182 1.00 0.00 C ATOM 1899 CE2 TYR A 122 0.880 8.753 -15.142 1.00 0.00 C ATOM 1900 CZ TYR A 122 1.848 7.775 -14.883 1.00 0.00 C ATOM 1901 OH TYR A 122 1.655 6.480 -15.321 1.00 0.00 O ATOM 0 H TYR A 122 2.729 14.262 -13.762 1.00 0.00 H new ATOM 0 HA TYR A 122 4.555 12.109 -13.953 1.00 0.00 H new ATOM 0 HB2 TYR A 122 2.709 11.840 -12.478 1.00 0.00 H new ATOM 0 HB3 TYR A 122 1.550 12.404 -13.666 1.00 0.00 H new ATOM 0 HD1 TYR A 122 4.099 9.679 -13.186 1.00 0.00 H new ATOM 0 HD2 TYR A 122 0.332 10.821 -14.905 1.00 0.00 H new ATOM 0 HE1 TYR A 122 3.761 7.358 -13.987 1.00 0.00 H new ATOM 0 HE2 TYR A 122 -0.019 8.494 -15.682 1.00 0.00 H new ATOM 0 HH TYR A 122 0.696 6.282 -15.343 1.00 0.00 H new ATOM 1911 N ARG A 123 2.599 12.654 -16.552 1.00 0.00 N ATOM 1912 CA ARG A 123 2.402 12.318 -17.957 1.00 0.00 C ATOM 1913 C ARG A 123 3.721 12.412 -18.718 1.00 0.00 C ATOM 1914 O ARG A 123 4.005 11.591 -19.590 1.00 0.00 O ATOM 1915 CB ARG A 123 1.381 13.270 -18.584 1.00 0.00 C ATOM 1916 CG ARG A 123 0.049 13.154 -17.842 1.00 0.00 C ATOM 1917 CD ARG A 123 -1.029 13.926 -18.602 1.00 0.00 C ATOM 1918 NE ARG A 123 -2.269 13.952 -17.834 1.00 0.00 N ATOM 1919 CZ ARG A 123 -3.422 14.290 -18.401 1.00 0.00 C ATOM 1920 NH1 ARG A 123 -3.459 14.604 -19.667 1.00 0.00 N ATOM 1921 NH2 ARG A 123 -4.517 14.306 -17.691 1.00 0.00 N ATOM 0 H ARG A 123 2.008 13.411 -16.209 1.00 0.00 H new ATOM 0 HA ARG A 123 2.030 11.295 -18.019 1.00 0.00 H new ATOM 0 HB2 ARG A 123 1.747 14.295 -18.536 1.00 0.00 H new ATOM 0 HB3 ARG A 123 1.244 13.029 -19.638 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -0.237 12.106 -17.749 1.00 0.00 H new ATOM 0 HG3 ARG A 123 0.149 13.548 -16.831 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -0.690 14.944 -18.793 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -1.204 13.461 -19.572 1.00 0.00 H new ATOM 0 HE ARG A 123 -2.250 13.706 -16.844 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -2.603 14.590 -20.221 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -4.344 14.863 -20.102 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -4.487 14.059 -16.702 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -5.403 14.565 -18.125 1.00 0.00 H new ATOM 1935 N GLN A 124 4.521 13.417 -18.379 1.00 0.00 N ATOM 1936 CA GLN A 124 5.814 13.603 -19.027 1.00 0.00 C ATOM 1937 C GLN A 124 6.781 12.495 -18.622 1.00 0.00 C ATOM 1938 O GLN A 124 7.558 12.005 -19.441 1.00 0.00 O ATOM 1939 CB GLN A 124 6.401 14.962 -18.641 1.00 0.00 C ATOM 1940 CG GLN A 124 7.604 15.270 -19.533 1.00 0.00 C ATOM 1941 CD GLN A 124 7.134 15.617 -20.941 1.00 0.00 C ATOM 1942 OE1 GLN A 124 7.563 14.993 -21.912 1.00 0.00 O ATOM 1943 NE2 GLN A 124 6.270 16.581 -21.111 1.00 0.00 N ATOM 0 H GLN A 124 4.299 14.111 -17.665 1.00 0.00 H new ATOM 0 HA GLN A 124 5.667 13.564 -20.106 1.00 0.00 H new ATOM 0 HB2 GLN A 124 5.646 15.740 -18.750 1.00 0.00 H new ATOM 0 HB3 GLN A 124 6.704 14.955 -17.594 1.00 0.00 H new ATOM 0 HG2 GLN A 124 8.173 16.101 -19.116 1.00 0.00 H new ATOM 0 HG3 GLN A 124 8.273 14.410 -19.566 1.00 0.00 H new ATOM 0 HE21 GLN A 124 5.916 17.097 -20.305 1.00 0.00 H new ATOM 0 HE22 GLN A 124 5.949 16.819 -22.050 1.00 0.00 H new ATOM 1952 N HIS A 125 6.726 12.105 -17.352 1.00 0.00 N ATOM 1953 CA HIS A 125 7.600 11.052 -16.849 1.00 0.00 C ATOM 1954 C HIS A 125 7.415 9.772 -17.657 1.00 0.00 C ATOM 1955 O HIS A 125 8.359 9.008 -17.854 1.00 0.00 O ATOM 1956 CB HIS A 125 7.294 10.778 -15.376 1.00 0.00 C ATOM 1957 CG HIS A 125 7.926 9.477 -14.966 1.00 0.00 C ATOM 1958 ND1 HIS A 125 9.196 9.415 -14.413 1.00 0.00 N ATOM 1959 CD2 HIS A 125 7.467 8.183 -15.000 1.00 0.00 C ATOM 1960 CE1 HIS A 125 9.455 8.123 -14.138 1.00 0.00 C ATOM 1961 NE2 HIS A 125 8.434 7.331 -14.476 1.00 0.00 N ATOM 0 H HIS A 125 6.091 12.499 -16.658 1.00 0.00 H new ATOM 0 HA HIS A 125 8.633 11.384 -16.948 1.00 0.00 H new ATOM 0 HB2 HIS A 125 7.675 11.590 -14.757 1.00 0.00 H new ATOM 0 HB3 HIS A 125 6.216 10.736 -15.219 1.00 0.00 H new ATOM 0 HD1 HIS A 125 9.820 10.204 -14.245 1.00 0.00 H new ATOM 0 HD2 HIS A 125 6.503 7.874 -15.376 1.00 0.00 H new ATOM 0 HE1 HIS A 125 10.376 7.770 -13.698 1.00 0.00 H new ATOM 1970 N GLN A 126 6.190 9.545 -18.120 1.00 0.00 N ATOM 1971 CA GLN A 126 5.889 8.353 -18.905 1.00 0.00 C ATOM 1972 C GLN A 126 6.774 8.293 -20.147 1.00 0.00 C ATOM 1973 O GLN A 126 7.220 7.219 -20.550 1.00 0.00 O ATOM 1974 CB GLN A 126 4.418 8.363 -19.323 1.00 0.00 C ATOM 1975 CG GLN A 126 3.532 8.285 -18.077 1.00 0.00 C ATOM 1976 CD GLN A 126 2.065 8.414 -18.472 1.00 0.00 C ATOM 1977 OE1 GLN A 126 1.749 8.997 -19.509 1.00 0.00 O ATOM 1978 NE2 GLN A 126 1.143 7.902 -17.702 1.00 0.00 N ATOM 0 H GLN A 126 5.395 10.165 -17.967 1.00 0.00 H new ATOM 0 HA GLN A 126 6.086 7.475 -18.290 1.00 0.00 H new ATOM 0 HB2 GLN A 126 4.195 9.270 -19.885 1.00 0.00 H new ATOM 0 HB3 GLN A 126 4.211 7.520 -19.983 1.00 0.00 H new ATOM 0 HG2 GLN A 126 3.697 7.338 -17.562 1.00 0.00 H new ATOM 0 HG3 GLN A 126 3.801 9.078 -17.379 1.00 0.00 H new ATOM 0 HE21 GLN A 126 1.406 7.419 -16.843 1.00 0.00 H new ATOM 0 HE22 GLN A 126 0.160 7.985 -17.960 1.00 0.00 H new ATOM 1987 N ALA A 127 7.022 9.452 -20.747 1.00 0.00 N ATOM 1988 CA ALA A 127 7.855 9.519 -21.942 1.00 0.00 C ATOM 1989 C ALA A 127 9.281 9.080 -21.624 1.00 0.00 C ATOM 1990 O ALA A 127 9.941 8.439 -22.441 1.00 0.00 O ATOM 1991 CB ALA A 127 7.868 10.947 -22.491 1.00 0.00 C ATOM 0 H ALA A 127 6.661 10.351 -20.429 1.00 0.00 H new ATOM 0 HA ALA A 127 7.438 8.847 -22.692 1.00 0.00 H new ATOM 0 HB1 ALA A 127 8.492 10.988 -23.383 1.00 0.00 H new ATOM 0 HB2 ALA A 127 6.852 11.248 -22.745 1.00 0.00 H new ATOM 0 HB3 ALA A 127 8.269 11.623 -21.736 1.00 0.00 H new ATOM 1997 N GLU A 128 9.749 9.432 -20.431 1.00 0.00 N ATOM 1998 CA GLU A 128 11.100 9.072 -20.015 1.00 0.00 C ATOM 1999 C GLU A 128 11.236 7.558 -19.891 1.00 0.00 C ATOM 2000 O GLU A 128 12.276 6.990 -20.228 1.00 0.00 O ATOM 2001 CB GLU A 128 11.424 9.727 -18.671 1.00 0.00 C ATOM 2002 CG GLU A 128 11.401 11.249 -18.826 1.00 0.00 C ATOM 2003 CD GLU A 128 12.529 11.698 -19.748 1.00 0.00 C ATOM 2004 OE1 GLU A 128 13.444 10.919 -19.954 1.00 0.00 O ATOM 2005 OE2 GLU A 128 12.460 12.814 -20.236 1.00 0.00 O ATOM 0 H GLU A 128 9.218 9.962 -19.740 1.00 0.00 H new ATOM 0 HA GLU A 128 11.800 9.428 -20.771 1.00 0.00 H new ATOM 0 HB2 GLU A 128 10.699 9.416 -17.919 1.00 0.00 H new ATOM 0 HB3 GLU A 128 12.404 9.401 -18.322 1.00 0.00 H new ATOM 0 HG2 GLU A 128 10.441 11.567 -19.232 1.00 0.00 H new ATOM 0 HG3 GLU A 128 11.507 11.723 -17.850 1.00 0.00 H new ATOM 2012 N LYS A 129 10.182 6.912 -19.407 1.00 0.00 N ATOM 2013 CA LYS A 129 10.197 5.463 -19.240 1.00 0.00 C ATOM 2014 C LYS A 129 10.402 4.772 -20.585 1.00 0.00 C ATOM 2015 O LYS A 129 11.104 3.764 -20.674 1.00 0.00 O ATOM 2016 CB LYS A 129 8.879 4.994 -18.621 1.00 0.00 C ATOM 2017 CG LYS A 129 8.818 5.433 -17.156 1.00 0.00 C ATOM 2018 CD LYS A 129 7.456 5.062 -16.568 1.00 0.00 C ATOM 2019 CE LYS A 129 7.273 3.544 -16.617 1.00 0.00 C ATOM 2020 NZ LYS A 129 6.683 3.157 -17.930 1.00 0.00 N ATOM 0 H LYS A 129 9.312 7.364 -19.125 1.00 0.00 H new ATOM 0 HA LYS A 129 11.023 5.201 -18.578 1.00 0.00 H new ATOM 0 HB2 LYS A 129 8.037 5.412 -19.172 1.00 0.00 H new ATOM 0 HB3 LYS A 129 8.798 3.909 -18.690 1.00 0.00 H new ATOM 0 HG2 LYS A 129 9.614 4.952 -16.588 1.00 0.00 H new ATOM 0 HG3 LYS A 129 8.978 6.509 -17.081 1.00 0.00 H new ATOM 0 HD2 LYS A 129 7.385 5.414 -15.539 1.00 0.00 H new ATOM 0 HD3 LYS A 129 6.660 5.553 -17.129 1.00 0.00 H new ATOM 0 HE2 LYS A 129 8.233 3.047 -16.477 1.00 0.00 H new ATOM 0 HE3 LYS A 129 6.623 3.219 -15.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 5.798 2.635 -17.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 6.486 4.012 -18.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 7.353 2.553 -18.447 1.00 0.00 H new ATOM 2034 N ASP A 130 9.787 5.320 -21.627 1.00 0.00 N ATOM 2035 CA ASP A 130 9.909 4.748 -22.963 1.00 0.00 C ATOM 2036 C ASP A 130 11.047 5.416 -23.729 1.00 0.00 C ATOM 2037 O ASP A 130 11.942 4.743 -24.241 1.00 0.00 O ATOM 2038 CB ASP A 130 8.599 4.928 -23.731 1.00 0.00 C ATOM 2039 CG ASP A 130 8.088 6.355 -23.563 1.00 0.00 C ATOM 2040 OD1 ASP A 130 8.658 7.244 -24.174 1.00 0.00 O ATOM 2041 OD2 ASP A 130 7.134 6.538 -22.824 1.00 0.00 O ATOM 0 H ASP A 130 9.203 6.154 -21.574 1.00 0.00 H new ATOM 0 HA ASP A 130 10.127 3.685 -22.864 1.00 0.00 H new ATOM 0 HB2 ASP A 130 8.755 4.711 -24.788 1.00 0.00 H new ATOM 0 HB3 ASP A 130 7.854 4.221 -23.366 1.00 0.00 H new ATOM 2046 N LYS A 131 11.005 6.742 -23.804 1.00 0.00 N ATOM 2047 CA LYS A 131 12.038 7.490 -24.510 1.00 0.00 C ATOM 2048 C LYS A 131 13.313 7.563 -23.676 1.00 0.00 C ATOM 2049 O LYS A 131 13.331 8.323 -22.722 1.00 0.00 O ATOM 2050 CB LYS A 131 11.543 8.906 -24.813 1.00 0.00 C ATOM 2051 CG LYS A 131 12.489 9.576 -25.811 1.00 0.00 C ATOM 2052 CD LYS A 131 12.083 9.197 -27.235 1.00 0.00 C ATOM 2053 CE LYS A 131 12.960 9.950 -28.235 1.00 0.00 C ATOM 2054 NZ LYS A 131 12.895 11.412 -27.952 1.00 0.00 N ATOM 2055 OXT LYS A 131 14.252 6.856 -24.003 1.00 0.00 O ATOM 0 H LYS A 131 10.273 7.317 -23.388 1.00 0.00 H new ATOM 0 HA LYS A 131 12.258 6.974 -25.445 1.00 0.00 H new ATOM 0 HB2 LYS A 131 10.533 8.870 -25.221 1.00 0.00 H new ATOM 0 HB3 LYS A 131 11.494 9.490 -23.894 1.00 0.00 H new ATOM 0 HG2 LYS A 131 12.456 10.659 -25.688 1.00 0.00 H new ATOM 0 HG3 LYS A 131 13.516 9.265 -25.620 1.00 0.00 H new ATOM 0 HD2 LYS A 131 12.189 8.122 -27.380 1.00 0.00 H new ATOM 0 HD3 LYS A 131 11.033 9.439 -27.402 1.00 0.00 H new ATOM 0 HE2 LYS A 131 13.990 9.601 -28.166 1.00 0.00 H new ATOM 0 HE3 LYS A 131 12.623 9.751 -29.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 13.128 11.943 -28.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 11.935 11.663 -27.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 13.577 11.651 -27.204 1.00 0.00 H new TER 2069 LYS A 131