USER MOD reduce.3.24.130724 H: found=0, std=0, add=1096, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1096 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 40 THR OG1 : rot -158:sc= 1.17 USER MOD Set 1.2: A 127 LYS NZ :NH3+ 144:sc= 2.56 (180deg=1.47) USER MOD Set 2.1: A 95 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.2: A 96 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 89 HIS : no HE2:sc= -4.21! C(o=-4.4!,f=-14!) USER MOD Set 3.2: A 107 ASN : amide:sc= -1.15 K(o=-4.4,f=-6.2!) USER MOD Set 3.3: A 108 GLN : amide:sc= 0.965 K(o=-4.4,f=-5.6) USER MOD Set 4.1: A 32 SER OG : rot 66:sc= 1.3 USER MOD Set 4.2: A 37 HIS : no HE2:sc= -0.0396! C(o=1.3!,f=-3.7!) USER MOD Single : A 1 MET CE :methyl 138:sc= -0.173 (180deg=-0.628) USER MOD Single : A 1 MET N :NH3+ -130:sc= 1.28 (180deg=-1.12!) USER MOD Single : A 11 GLN : amide:sc=-0.00781 K(o=-0.0078,f=-1) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.614 K(o=-0.61,f=-1.6) USER MOD Single : A 15 TYR OH : rot -160:sc= 0.0765 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0.0202 USER MOD Single : A 21 ASN : amide:sc= -0.0484 X(o=-0.048,f=-0.42) USER MOD Single : A 22 LYS NZ :NH3+ -151:sc= -0.587 (180deg=-1.87!) USER MOD Single : A 23 THR OG1 : rot -103:sc= 1.41 USER MOD Single : A 27 SER OG : rot -34:sc= -0.157 USER MOD Single : A 30 ASN : amide:sc= 0.0833 K(o=0.083,f=-8.8!) USER MOD Single : A 34 MET CE :methyl -167:sc= -0.0247 (180deg=-0.249) USER MOD Single : A 39 MET CE :methyl -139:sc= -0.623 (180deg=-6.28!) USER MOD Single : A 42 SER OG : rot -53:sc= 0.896 USER MOD Single : A 43 THR OG1 : rot 180:sc= -0.747 USER MOD Single : A 47 GLN : amide:sc= -0.238 X(o=-0.24,f=0) USER MOD Single : A 48 ASN : amide:sc= 1.14 K(o=1.1,f=-0.041) USER MOD Single : A 52 GLN :FLIP amide:sc= 0 F(o=-0.69,f=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= 0.162 X(o=0.16,f=-0.043) USER MOD Single : A 70 LYS NZ :NH3+ -176:sc= 1.8 (180deg=1.62) USER MOD Single : A 72 GLN :FLIP amide:sc= 0 F(o=-0.96,f=0) USER MOD Single : A 78 GLN :FLIP amide:sc= 0 F(o=-2.1,f=0) USER MOD Single : A 79 THR OG1 : rot 88:sc= 1.29 USER MOD Single : A 82 ASN : amide:sc= -1.2 K(o=-1.2,f=-3.1) USER MOD Single : A 90 LYS NZ :NH3+ 141:sc= 0.15 (180deg=-0.354!) USER MOD Single : A 91 ASN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 97 GLN : amide:sc= -0.37! C(o=-0.37!,f=-4.6!) USER MOD Single : A 100 ASN : amide:sc= -0.253 X(o=-0.25,f=-0.083) USER MOD Single : A 106 TYR OH : rot 94:sc= 1 USER MOD Single : A 110 LYS NZ :NH3+ -171:sc= 1.21 (180deg=1.14) USER MOD Single : A 114 ASN :FLIP amide:sc= 0 F(o=-0.87,f=0) USER MOD Single : A 119 ASN : amide:sc= -0.0642 X(o=-0.064,f=-0.18) USER MOD Single : A 123 SER OG : rot -120:sc= -0.784 USER MOD Single : A 131 THR OG1 : rot 180:sc= -0.672 USER MOD Single : A 132 THR OG1 : rot 111:sc= 0.543 USER MOD Single : A 134 ASN :FLIP amide:sc= 0 F(o=-0.75,f=0) USER MOD Single : A 137 ASN : amide:sc= 1.19 K(o=1.2,f=-0.21) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 GLN : amide:sc= -0.389 X(o=-0.39,f=-0.1) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 20.183 64.475 -14.589 1.00 0.00 N ATOM 2 CA MET A 1 18.895 64.540 -15.323 1.00 0.00 C ATOM 3 C MET A 1 17.931 63.514 -14.749 1.00 0.00 C ATOM 4 O MET A 1 17.078 63.847 -13.934 1.00 0.00 O ATOM 5 CB MET A 1 19.109 64.295 -16.821 1.00 0.00 C ATOM 6 CG MET A 1 17.844 64.442 -17.655 1.00 0.00 C ATOM 7 SD MET A 1 18.138 64.186 -19.416 1.00 0.00 S ATOM 8 CE MET A 1 18.707 62.487 -19.432 1.00 0.00 C ATOM 0 H1 MET A 1 20.462 65.432 -14.291 1.00 0.00 H new ATOM 0 H2 MET A 1 20.075 63.869 -13.751 1.00 0.00 H new ATOM 0 H3 MET A 1 20.917 64.078 -15.210 1.00 0.00 H new ATOM 0 HA MET A 1 18.471 65.537 -15.204 1.00 0.00 H new ATOM 0 HB2 MET A 1 19.860 64.994 -17.190 1.00 0.00 H new ATOM 0 HB3 MET A 1 19.511 63.292 -16.962 1.00 0.00 H new ATOM 0 HG2 MET A 1 17.099 63.726 -17.307 1.00 0.00 H new ATOM 0 HG3 MET A 1 17.426 65.437 -17.501 1.00 0.00 H new ATOM 0 HE1 MET A 1 18.253 61.959 -20.271 1.00 0.00 H new ATOM 0 HE2 MET A 1 19.792 62.468 -19.535 1.00 0.00 H new ATOM 0 HE3 MET A 1 18.423 61.999 -18.500 1.00 0.00 H new ATOM 20 N VAL A 2 18.079 62.264 -15.165 1.00 0.00 N ATOM 21 CA VAL A 2 17.346 61.179 -14.540 1.00 0.00 C ATOM 22 C VAL A 2 18.211 60.581 -13.446 1.00 0.00 C ATOM 23 O VAL A 2 19.278 60.038 -13.725 1.00 0.00 O ATOM 24 CB VAL A 2 16.970 60.081 -15.562 1.00 0.00 C ATOM 25 CG1 VAL A 2 16.266 58.916 -14.877 1.00 0.00 C ATOM 26 CG2 VAL A 2 16.102 60.659 -16.670 1.00 0.00 C ATOM 0 H VAL A 2 18.695 61.980 -15.927 1.00 0.00 H new ATOM 0 HA VAL A 2 16.419 61.576 -14.127 1.00 0.00 H new ATOM 0 HB VAL A 2 17.890 59.702 -16.007 1.00 0.00 H new ATOM 0 HG11 VAL A 2 16.012 58.158 -15.618 1.00 0.00 H new ATOM 0 HG12 VAL A 2 16.926 58.483 -14.126 1.00 0.00 H new ATOM 0 HG13 VAL A 2 15.355 59.273 -14.397 1.00 0.00 H new ATOM 0 HG21 VAL A 2 15.847 59.872 -17.380 1.00 0.00 H new ATOM 0 HG22 VAL A 2 15.189 61.070 -16.240 1.00 0.00 H new ATOM 0 HG23 VAL A 2 16.648 61.450 -17.185 1.00 0.00 H new ATOM 36 N CYS A 3 17.742 60.687 -12.212 1.00 0.00 N ATOM 37 CA CYS A 3 18.506 60.270 -11.042 1.00 0.00 C ATOM 38 C CYS A 3 17.542 60.037 -9.883 1.00 0.00 C ATOM 39 O CYS A 3 16.350 60.322 -10.014 1.00 0.00 O ATOM 40 CB CYS A 3 19.522 61.359 -10.642 1.00 0.00 C ATOM 41 SG CYS A 3 20.700 61.847 -11.941 1.00 0.00 S ATOM 0 H CYS A 3 16.820 61.065 -11.991 1.00 0.00 H new ATOM 0 HA CYS A 3 19.048 59.354 -11.279 1.00 0.00 H new ATOM 0 HB2 CYS A 3 18.972 62.245 -10.323 1.00 0.00 H new ATOM 0 HB3 CYS A 3 20.086 61.006 -9.779 1.00 0.00 H new ATOM 46 N PRO A 4 18.024 59.496 -8.746 1.00 0.00 N ATOM 47 CA PRO A 4 17.235 59.461 -7.511 1.00 0.00 C ATOM 48 C PRO A 4 16.819 60.870 -7.087 1.00 0.00 C ATOM 49 O PRO A 4 17.510 61.843 -7.392 1.00 0.00 O ATOM 50 CB PRO A 4 18.190 58.838 -6.488 1.00 0.00 C ATOM 51 CG PRO A 4 19.185 58.084 -7.298 1.00 0.00 C ATOM 52 CD PRO A 4 19.340 58.853 -8.579 1.00 0.00 C ATOM 0 HA PRO A 4 16.307 58.899 -7.618 1.00 0.00 H new ATOM 0 HB2 PRO A 4 18.674 59.604 -5.882 1.00 0.00 H new ATOM 0 HB3 PRO A 4 17.658 58.178 -5.802 1.00 0.00 H new ATOM 0 HG2 PRO A 4 20.137 58.004 -6.773 1.00 0.00 H new ATOM 0 HG3 PRO A 4 18.842 57.068 -7.491 1.00 0.00 H new ATOM 0 HD2 PRO A 4 20.142 59.588 -8.513 1.00 0.00 H new ATOM 0 HD3 PRO A 4 19.577 58.197 -9.417 1.00 0.00 H new ATOM 60 N ILE A 5 15.698 60.979 -6.383 1.00 0.00 N ATOM 61 CA ILE A 5 15.111 62.281 -6.071 1.00 0.00 C ATOM 62 C ILE A 5 15.899 63.010 -4.975 1.00 0.00 C ATOM 63 O ILE A 5 15.795 64.233 -4.820 1.00 0.00 O ATOM 64 CB ILE A 5 13.623 62.137 -5.665 1.00 0.00 C ATOM 65 CG1 ILE A 5 12.960 63.515 -5.537 1.00 0.00 C ATOM 66 CG2 ILE A 5 13.488 61.349 -4.366 1.00 0.00 C ATOM 67 CD1 ILE A 5 11.481 63.453 -5.223 1.00 0.00 C ATOM 0 H ILE A 5 15.176 60.183 -6.017 1.00 0.00 H new ATOM 0 HA ILE A 5 15.165 62.885 -6.977 1.00 0.00 H new ATOM 0 HB ILE A 5 13.109 61.583 -6.451 1.00 0.00 H new ATOM 0 HG12 ILE A 5 13.465 64.080 -4.753 1.00 0.00 H new ATOM 0 HG13 ILE A 5 13.102 64.064 -6.468 1.00 0.00 H new ATOM 0 HG21 ILE A 5 12.434 61.261 -4.102 1.00 0.00 H new ATOM 0 HG22 ILE A 5 13.913 60.354 -4.498 1.00 0.00 H new ATOM 0 HG23 ILE A 5 14.020 61.868 -3.569 1.00 0.00 H new ATOM 0 HD11 ILE A 5 11.082 64.465 -5.148 1.00 0.00 H new ATOM 0 HD12 ILE A 5 10.962 62.917 -6.018 1.00 0.00 H new ATOM 0 HD13 ILE A 5 11.331 62.933 -4.277 1.00 0.00 H new ATOM 79 N ASP A 6 16.697 62.263 -4.228 1.00 0.00 N ATOM 80 CA ASP A 6 17.539 62.846 -3.193 1.00 0.00 C ATOM 81 C ASP A 6 18.722 63.566 -3.830 1.00 0.00 C ATOM 82 O ASP A 6 19.189 64.588 -3.320 1.00 0.00 O ATOM 83 CB ASP A 6 18.010 61.769 -2.208 1.00 0.00 C ATOM 84 CG ASP A 6 18.619 60.565 -2.897 1.00 0.00 C ATOM 85 OD1 ASP A 6 17.891 59.888 -3.656 1.00 0.00 O ATOM 86 OD2 ASP A 6 19.818 60.300 -2.685 1.00 0.00 O ATOM 0 H ASP A 6 16.780 61.250 -4.319 1.00 0.00 H new ATOM 0 HA ASP A 6 16.955 63.575 -2.631 1.00 0.00 H new ATOM 0 HB2 ASP A 6 18.744 62.202 -1.528 1.00 0.00 H new ATOM 0 HB3 ASP A 6 17.165 61.445 -1.601 1.00 0.00 H new ATOM 91 N TRP A 7 19.178 63.049 -4.964 1.00 0.00 N ATOM 92 CA TRP A 7 20.206 63.713 -5.753 1.00 0.00 C ATOM 93 C TRP A 7 19.607 64.938 -6.440 1.00 0.00 C ATOM 94 O TRP A 7 18.570 64.848 -7.099 1.00 0.00 O ATOM 95 CB TRP A 7 20.795 62.760 -6.804 1.00 0.00 C ATOM 96 CG TRP A 7 21.565 61.608 -6.225 1.00 0.00 C ATOM 97 CD1 TRP A 7 21.072 60.595 -5.458 1.00 0.00 C ATOM 98 CD2 TRP A 7 22.966 61.342 -6.382 1.00 0.00 C ATOM 99 NE1 TRP A 7 22.078 59.725 -5.116 1.00 0.00 N ATOM 100 CE2 TRP A 7 23.250 60.159 -5.672 1.00 0.00 C ATOM 101 CE3 TRP A 7 24.008 61.992 -7.049 1.00 0.00 C ATOM 102 CZ2 TRP A 7 24.532 59.612 -5.613 1.00 0.00 C ATOM 103 CZ3 TRP A 7 25.278 61.449 -6.989 1.00 0.00 C ATOM 104 CH2 TRP A 7 25.530 60.271 -6.276 1.00 0.00 C ATOM 0 H TRP A 7 18.850 62.168 -5.359 1.00 0.00 H new ATOM 0 HA TRP A 7 21.011 64.022 -5.086 1.00 0.00 H new ATOM 0 HB2 TRP A 7 19.984 62.369 -7.419 1.00 0.00 H new ATOM 0 HB3 TRP A 7 21.451 63.326 -7.465 1.00 0.00 H new ATOM 0 HD1 TRP A 7 20.039 60.491 -5.162 1.00 0.00 H new ATOM 0 HE1 TRP A 7 21.969 58.890 -4.540 1.00 0.00 H new ATOM 0 HE3 TRP A 7 23.824 62.902 -7.601 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 24.729 58.703 -5.065 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 26.090 61.943 -7.502 1.00 0.00 H new ATOM 0 HH2 TRP A 7 26.534 59.874 -6.249 1.00 0.00 H new ATOM 115 N ARG A 8 20.246 66.085 -6.279 1.00 0.00 N ATOM 116 CA ARG A 8 19.727 67.316 -6.851 1.00 0.00 C ATOM 117 C ARG A 8 20.158 67.450 -8.304 1.00 0.00 C ATOM 118 O ARG A 8 21.349 67.459 -8.607 1.00 0.00 O ATOM 119 CB ARG A 8 20.194 68.524 -6.045 1.00 0.00 C ATOM 120 CG ARG A 8 19.283 69.717 -6.215 1.00 0.00 C ATOM 121 CD ARG A 8 17.852 69.360 -5.853 1.00 0.00 C ATOM 122 NE ARG A 8 17.718 68.954 -4.452 1.00 0.00 N ATOM 123 CZ ARG A 8 17.321 67.741 -4.055 1.00 0.00 C ATOM 124 NH1 ARG A 8 17.003 66.808 -4.950 1.00 0.00 N ATOM 125 NH2 ARG A 8 17.240 67.465 -2.761 1.00 0.00 N ATOM 0 H ARG A 8 21.118 66.189 -5.761 1.00 0.00 H new ATOM 0 HA ARG A 8 18.638 67.278 -6.813 1.00 0.00 H new ATOM 0 HB2 ARG A 8 20.244 68.256 -4.990 1.00 0.00 H new ATOM 0 HB3 ARG A 8 21.204 68.795 -6.353 1.00 0.00 H new ATOM 0 HG2 ARG A 8 19.628 70.537 -5.585 1.00 0.00 H new ATOM 0 HG3 ARG A 8 19.325 70.068 -7.246 1.00 0.00 H new ATOM 0 HD2 ARG A 8 17.207 70.217 -6.044 1.00 0.00 H new ATOM 0 HD3 ARG A 8 17.507 68.552 -6.498 1.00 0.00 H new ATOM 0 HE ARG A 8 17.942 69.642 -3.733 1.00 0.00 H new ATOM 0 HH11 ARG A 8 17.061 67.016 -5.947 1.00 0.00 H new ATOM 0 HH12 ARG A 8 16.701 65.885 -4.639 1.00 0.00 H new ATOM 0 HH21 ARG A 8 17.480 68.177 -2.072 1.00 0.00 H new ATOM 0 HH22 ARG A 8 16.937 66.540 -2.455 1.00 0.00 H new ATOM 139 N ALA A 9 19.187 67.545 -9.199 1.00 0.00 N ATOM 140 CA ALA A 9 19.469 67.580 -10.625 1.00 0.00 C ATOM 141 C ALA A 9 19.606 69.008 -11.145 1.00 0.00 C ATOM 142 O ALA A 9 18.851 69.900 -10.760 1.00 0.00 O ATOM 143 CB ALA A 9 18.380 66.844 -11.392 1.00 0.00 C ATOM 0 H ALA A 9 18.196 67.599 -8.963 1.00 0.00 H new ATOM 0 HA ALA A 9 20.425 67.081 -10.784 1.00 0.00 H new ATOM 0 HB1 ALA A 9 18.601 66.876 -12.459 1.00 0.00 H new ATOM 0 HB2 ALA A 9 18.340 65.806 -11.061 1.00 0.00 H new ATOM 0 HB3 ALA A 9 17.418 67.322 -11.206 1.00 0.00 H new ATOM 149 N PHE A 10 20.586 69.206 -12.014 1.00 0.00 N ATOM 150 CA PHE A 10 20.779 70.474 -12.700 1.00 0.00 C ATOM 151 C PHE A 10 20.960 70.203 -14.187 1.00 0.00 C ATOM 152 O PHE A 10 22.029 69.762 -14.620 1.00 0.00 O ATOM 153 CB PHE A 10 21.999 71.214 -12.142 1.00 0.00 C ATOM 154 CG PHE A 10 22.226 72.574 -12.743 1.00 0.00 C ATOM 155 CD1 PHE A 10 21.456 73.656 -12.354 1.00 0.00 C ATOM 156 CD2 PHE A 10 23.214 72.767 -13.695 1.00 0.00 C ATOM 157 CE1 PHE A 10 21.665 74.906 -12.904 1.00 0.00 C ATOM 158 CE2 PHE A 10 23.429 74.014 -14.248 1.00 0.00 C ATOM 159 CZ PHE A 10 22.653 75.086 -13.852 1.00 0.00 C ATOM 0 H PHE A 10 21.270 68.492 -12.263 1.00 0.00 H new ATOM 0 HA PHE A 10 19.905 71.107 -12.543 1.00 0.00 H new ATOM 0 HB2 PHE A 10 21.882 71.321 -11.064 1.00 0.00 H new ATOM 0 HB3 PHE A 10 22.887 70.604 -12.308 1.00 0.00 H new ATOM 0 HD1 PHE A 10 20.683 73.522 -11.612 1.00 0.00 H new ATOM 0 HD2 PHE A 10 23.823 71.932 -14.008 1.00 0.00 H new ATOM 0 HE1 PHE A 10 21.056 75.742 -12.593 1.00 0.00 H new ATOM 0 HE2 PHE A 10 24.203 74.151 -14.989 1.00 0.00 H new ATOM 0 HZ PHE A 10 22.819 76.062 -14.283 1.00 0.00 H new ATOM 169 N GLN A 11 19.901 70.443 -14.954 1.00 0.00 N ATOM 170 CA GLN A 11 19.871 70.117 -16.379 1.00 0.00 C ATOM 171 C GLN A 11 20.109 68.621 -16.597 1.00 0.00 C ATOM 172 O GLN A 11 19.192 67.809 -16.471 1.00 0.00 O ATOM 173 CB GLN A 11 20.903 70.933 -17.169 1.00 0.00 C ATOM 174 CG GLN A 11 20.612 72.424 -17.231 1.00 0.00 C ATOM 175 CD GLN A 11 21.607 73.160 -18.106 1.00 0.00 C ATOM 176 OE1 GLN A 11 22.164 72.589 -19.044 1.00 0.00 O ATOM 177 NE2 GLN A 11 21.830 74.431 -17.823 1.00 0.00 N ATOM 0 H GLN A 11 19.041 70.868 -14.608 1.00 0.00 H new ATOM 0 HA GLN A 11 18.880 70.377 -16.750 1.00 0.00 H new ATOM 0 HB2 GLN A 11 21.885 70.785 -16.720 1.00 0.00 H new ATOM 0 HB3 GLN A 11 20.955 70.543 -18.185 1.00 0.00 H new ATOM 0 HG2 GLN A 11 19.605 72.581 -17.616 1.00 0.00 H new ATOM 0 HG3 GLN A 11 20.637 72.841 -16.224 1.00 0.00 H new ATOM 0 HE21 GLN A 11 21.350 74.870 -17.038 1.00 0.00 H new ATOM 0 HE22 GLN A 11 22.482 74.973 -18.390 1.00 0.00 H new ATOM 186 N SER A 12 21.351 68.257 -16.883 1.00 0.00 N ATOM 187 CA SER A 12 21.694 66.869 -17.138 1.00 0.00 C ATOM 188 C SER A 12 22.448 66.272 -15.950 1.00 0.00 C ATOM 189 O SER A 12 22.589 65.055 -15.841 1.00 0.00 O ATOM 190 CB SER A 12 22.533 66.763 -18.418 1.00 0.00 C ATOM 191 OG SER A 12 22.714 65.414 -18.809 1.00 0.00 O ATOM 0 H SER A 12 22.136 68.905 -16.944 1.00 0.00 H new ATOM 0 HA SER A 12 20.774 66.301 -17.274 1.00 0.00 H new ATOM 0 HB2 SER A 12 22.044 67.313 -19.222 1.00 0.00 H new ATOM 0 HB3 SER A 12 23.505 67.230 -18.257 1.00 0.00 H new ATOM 0 HG SER A 12 23.251 65.380 -19.628 1.00 0.00 H new ATOM 197 N ASN A 13 22.880 67.125 -15.030 1.00 0.00 N ATOM 198 CA ASN A 13 23.709 66.688 -13.908 1.00 0.00 C ATOM 199 C ASN A 13 22.861 66.366 -12.684 1.00 0.00 C ATOM 200 O ASN A 13 21.687 66.729 -12.620 1.00 0.00 O ATOM 201 CB ASN A 13 24.728 67.769 -13.536 1.00 0.00 C ATOM 202 CG ASN A 13 25.676 68.107 -14.668 1.00 0.00 C ATOM 203 OD1 ASN A 13 26.690 67.440 -14.864 1.00 0.00 O ATOM 204 ND2 ASN A 13 25.367 69.165 -15.403 1.00 0.00 N ATOM 0 H ASN A 13 22.672 68.123 -15.036 1.00 0.00 H new ATOM 0 HA ASN A 13 24.231 65.785 -14.225 1.00 0.00 H new ATOM 0 HB2 ASN A 13 24.197 68.671 -13.233 1.00 0.00 H new ATOM 0 HB3 ASN A 13 25.305 67.434 -12.674 1.00 0.00 H new ATOM 0 HD21 ASN A 13 25.981 69.453 -16.165 1.00 0.00 H new ATOM 0 HD22 ASN A 13 24.515 69.691 -15.207 1.00 0.00 H new ATOM 211 N CYS A 14 23.466 65.666 -11.731 1.00 0.00 N ATOM 212 CA CYS A 14 22.852 65.379 -10.440 1.00 0.00 C ATOM 213 C CYS A 14 23.927 65.407 -9.354 1.00 0.00 C ATOM 214 O CYS A 14 24.992 64.811 -9.515 1.00 0.00 O ATOM 215 CB CYS A 14 22.164 64.010 -10.454 1.00 0.00 C ATOM 216 SG CYS A 14 20.843 63.847 -11.694 1.00 0.00 S ATOM 0 H CYS A 14 24.404 65.279 -11.834 1.00 0.00 H new ATOM 0 HA CYS A 14 22.097 66.137 -10.234 1.00 0.00 H new ATOM 0 HB2 CYS A 14 22.915 63.241 -10.637 1.00 0.00 H new ATOM 0 HB3 CYS A 14 21.745 63.817 -9.466 1.00 0.00 H new ATOM 221 N TYR A 15 23.661 66.113 -8.266 1.00 0.00 N ATOM 222 CA TYR A 15 24.646 66.284 -7.208 1.00 0.00 C ATOM 223 C TYR A 15 24.084 65.802 -5.881 1.00 0.00 C ATOM 224 O TYR A 15 22.942 66.111 -5.537 1.00 0.00 O ATOM 225 CB TYR A 15 25.035 67.761 -7.068 1.00 0.00 C ATOM 226 CG TYR A 15 25.186 68.490 -8.382 1.00 0.00 C ATOM 227 CD1 TYR A 15 24.069 68.955 -9.061 1.00 0.00 C ATOM 228 CD2 TYR A 15 26.434 68.717 -8.943 1.00 0.00 C ATOM 229 CE1 TYR A 15 24.190 69.617 -10.258 1.00 0.00 C ATOM 230 CE2 TYR A 15 26.560 69.385 -10.144 1.00 0.00 C ATOM 231 CZ TYR A 15 25.432 69.831 -10.799 1.00 0.00 C ATOM 232 OH TYR A 15 25.546 70.501 -11.993 1.00 0.00 O ATOM 0 H TYR A 15 22.770 66.578 -8.092 1.00 0.00 H new ATOM 0 HA TYR A 15 25.526 65.698 -7.472 1.00 0.00 H new ATOM 0 HB2 TYR A 15 24.279 68.269 -6.469 1.00 0.00 H new ATOM 0 HB3 TYR A 15 25.974 67.827 -6.519 1.00 0.00 H new ATOM 0 HD1 TYR A 15 23.087 68.794 -8.641 1.00 0.00 H new ATOM 0 HD2 TYR A 15 27.319 68.366 -8.433 1.00 0.00 H new ATOM 0 HE1 TYR A 15 23.308 69.969 -10.773 1.00 0.00 H new ATOM 0 HE2 TYR A 15 27.538 69.558 -10.569 1.00 0.00 H new ATOM 0 HH TYR A 15 26.414 70.299 -12.400 1.00 0.00 H new ATOM 242 N PHE A 16 24.875 65.048 -5.141 1.00 0.00 N ATOM 243 CA PHE A 16 24.486 64.640 -3.804 1.00 0.00 C ATOM 244 C PHE A 16 25.556 65.056 -2.800 1.00 0.00 C ATOM 245 O PHE A 16 26.700 64.598 -2.873 1.00 0.00 O ATOM 246 CB PHE A 16 24.256 63.131 -3.745 1.00 0.00 C ATOM 247 CG PHE A 16 23.575 62.677 -2.487 1.00 0.00 C ATOM 248 CD1 PHE A 16 22.279 63.078 -2.201 1.00 0.00 C ATOM 249 CD2 PHE A 16 24.227 61.848 -1.592 1.00 0.00 C ATOM 250 CE1 PHE A 16 21.650 62.660 -1.045 1.00 0.00 C ATOM 251 CE2 PHE A 16 23.603 61.428 -0.435 1.00 0.00 C ATOM 252 CZ PHE A 16 22.314 61.835 -0.160 1.00 0.00 C ATOM 0 H PHE A 16 25.788 64.706 -5.442 1.00 0.00 H new ATOM 0 HA PHE A 16 23.550 65.136 -3.547 1.00 0.00 H new ATOM 0 HB2 PHE A 16 23.655 62.829 -4.603 1.00 0.00 H new ATOM 0 HB3 PHE A 16 25.216 62.622 -3.833 1.00 0.00 H new ATOM 0 HD1 PHE A 16 21.756 63.724 -2.890 1.00 0.00 H new ATOM 0 HD2 PHE A 16 25.236 61.526 -1.801 1.00 0.00 H new ATOM 0 HE1 PHE A 16 20.640 62.978 -0.834 1.00 0.00 H new ATOM 0 HE2 PHE A 16 24.124 60.781 0.255 1.00 0.00 H new ATOM 0 HZ PHE A 16 21.825 61.509 0.746 1.00 0.00 H new ATOM 262 N PRO A 17 25.209 65.962 -1.875 1.00 0.00 N ATOM 263 CA PRO A 17 26.120 66.431 -0.838 1.00 0.00 C ATOM 264 C PRO A 17 26.179 65.480 0.351 1.00 0.00 C ATOM 265 O PRO A 17 25.165 65.213 0.996 1.00 0.00 O ATOM 266 CB PRO A 17 25.525 67.782 -0.409 1.00 0.00 C ATOM 267 CG PRO A 17 24.275 67.970 -1.219 1.00 0.00 C ATOM 268 CD PRO A 17 23.908 66.621 -1.770 1.00 0.00 C ATOM 0 HA PRO A 17 27.144 66.502 -1.204 1.00 0.00 H new ATOM 0 HB2 PRO A 17 25.301 67.787 0.658 1.00 0.00 H new ATOM 0 HB3 PRO A 17 26.231 68.593 -0.590 1.00 0.00 H new ATOM 0 HG2 PRO A 17 23.470 68.367 -0.601 1.00 0.00 H new ATOM 0 HG3 PRO A 17 24.440 68.685 -2.025 1.00 0.00 H new ATOM 0 HD2 PRO A 17 23.231 66.082 -1.107 1.00 0.00 H new ATOM 0 HD3 PRO A 17 23.412 66.698 -2.738 1.00 0.00 H new ATOM 276 N LEU A 18 27.363 64.962 0.634 1.00 0.00 N ATOM 277 CA LEU A 18 27.552 64.089 1.777 1.00 0.00 C ATOM 278 C LEU A 18 28.139 64.867 2.940 1.00 0.00 C ATOM 279 O LEU A 18 29.036 65.696 2.762 1.00 0.00 O ATOM 280 CB LEU A 18 28.487 62.916 1.448 1.00 0.00 C ATOM 281 CG LEU A 18 27.893 61.775 0.615 1.00 0.00 C ATOM 282 CD1 LEU A 18 26.627 61.235 1.258 1.00 0.00 C ATOM 283 CD2 LEU A 18 27.628 62.210 -0.817 1.00 0.00 C ATOM 0 H LEU A 18 28.207 65.132 0.087 1.00 0.00 H new ATOM 0 HA LEU A 18 26.573 63.692 2.044 1.00 0.00 H new ATOM 0 HB2 LEU A 18 29.353 63.310 0.916 1.00 0.00 H new ATOM 0 HB3 LEU A 18 28.852 62.498 2.386 1.00 0.00 H new ATOM 0 HG LEU A 18 28.630 60.972 0.586 1.00 0.00 H new ATOM 0 HD11 LEU A 18 26.225 60.426 0.647 1.00 0.00 H new ATOM 0 HD12 LEU A 18 26.857 60.857 2.254 1.00 0.00 H new ATOM 0 HD13 LEU A 18 25.889 62.033 1.334 1.00 0.00 H new ATOM 0 HD21 LEU A 18 27.207 61.376 -1.379 1.00 0.00 H new ATOM 0 HD22 LEU A 18 26.924 63.042 -0.820 1.00 0.00 H new ATOM 0 HD23 LEU A 18 28.563 62.525 -1.281 1.00 0.00 H new ATOM 295 N THR A 19 27.640 64.584 4.125 1.00 0.00 N ATOM 296 CA THR A 19 28.192 65.146 5.343 1.00 0.00 C ATOM 297 C THR A 19 29.199 64.175 5.936 1.00 0.00 C ATOM 298 O THR A 19 29.854 64.459 6.940 1.00 0.00 O ATOM 299 CB THR A 19 27.082 65.448 6.366 1.00 0.00 C ATOM 300 OG1 THR A 19 26.129 64.375 6.379 1.00 0.00 O ATOM 301 CG2 THR A 19 26.379 66.755 6.036 1.00 0.00 C ATOM 0 H THR A 19 26.845 63.962 4.273 1.00 0.00 H new ATOM 0 HA THR A 19 28.688 66.085 5.100 1.00 0.00 H new ATOM 0 HB THR A 19 27.540 65.543 7.351 1.00 0.00 H new ATOM 0 HG1 THR A 19 25.425 64.570 7.033 1.00 0.00 H new ATOM 0 HG21 THR A 19 25.599 66.945 6.774 1.00 0.00 H new ATOM 0 HG22 THR A 19 27.101 67.571 6.053 1.00 0.00 H new ATOM 0 HG23 THR A 19 25.931 66.687 5.044 1.00 0.00 H new ATOM 309 N ASP A 20 29.310 63.025 5.281 1.00 0.00 N ATOM 310 CA ASP A 20 30.243 61.983 5.675 1.00 0.00 C ATOM 311 C ASP A 20 31.679 62.448 5.504 1.00 0.00 C ATOM 312 O ASP A 20 32.034 63.056 4.492 1.00 0.00 O ATOM 313 CB ASP A 20 29.986 60.718 4.853 1.00 0.00 C ATOM 314 CG ASP A 20 31.146 59.743 4.879 1.00 0.00 C ATOM 315 OD1 ASP A 20 31.546 59.310 5.979 1.00 0.00 O ATOM 316 OD2 ASP A 20 31.655 59.385 3.791 1.00 0.00 O ATOM 0 H ASP A 20 28.752 62.791 4.460 1.00 0.00 H new ATOM 0 HA ASP A 20 30.088 61.758 6.730 1.00 0.00 H new ATOM 0 HB2 ASP A 20 29.093 60.221 5.233 1.00 0.00 H new ATOM 0 HB3 ASP A 20 29.779 60.999 3.820 1.00 0.00 H new ATOM 321 N ASN A 21 32.491 62.160 6.504 1.00 0.00 N ATOM 322 CA ASN A 21 33.886 62.570 6.500 1.00 0.00 C ATOM 323 C ASN A 21 34.762 61.527 5.819 1.00 0.00 C ATOM 324 O ASN A 21 34.798 60.359 6.218 1.00 0.00 O ATOM 325 CB ASN A 21 34.390 62.872 7.925 1.00 0.00 C ATOM 326 CG ASN A 21 33.931 61.878 8.993 1.00 0.00 C ATOM 327 OD1 ASN A 21 33.729 62.252 10.146 1.00 0.00 O ATOM 328 ND2 ASN A 21 33.778 60.611 8.635 1.00 0.00 N ATOM 0 H ASN A 21 32.208 61.641 7.335 1.00 0.00 H new ATOM 0 HA ASN A 21 33.955 63.493 5.925 1.00 0.00 H new ATOM 0 HB2 ASN A 21 35.480 62.893 7.913 1.00 0.00 H new ATOM 0 HB3 ASN A 21 34.055 63.870 8.210 1.00 0.00 H new ATOM 0 HD21 ASN A 21 33.485 59.918 9.324 1.00 0.00 H new ATOM 0 HD22 ASN A 21 33.953 60.329 7.670 1.00 0.00 H new ATOM 335 N LYS A 22 35.441 61.950 4.768 1.00 0.00 N ATOM 336 CA LYS A 22 36.363 61.089 4.042 1.00 0.00 C ATOM 337 C LYS A 22 37.554 61.885 3.555 1.00 0.00 C ATOM 338 O LYS A 22 37.451 63.088 3.311 1.00 0.00 O ATOM 339 CB LYS A 22 35.686 60.440 2.828 1.00 0.00 C ATOM 340 CG LYS A 22 34.691 59.346 3.167 1.00 0.00 C ATOM 341 CD LYS A 22 35.371 58.155 3.821 1.00 0.00 C ATOM 342 CE LYS A 22 34.371 57.059 4.146 1.00 0.00 C ATOM 343 NZ LYS A 22 33.260 57.559 4.998 1.00 0.00 N ATOM 0 H LYS A 22 35.371 62.896 4.393 1.00 0.00 H new ATOM 0 HA LYS A 22 36.686 60.309 4.732 1.00 0.00 H new ATOM 0 HB2 LYS A 22 35.173 61.215 2.258 1.00 0.00 H new ATOM 0 HB3 LYS A 22 36.456 60.023 2.179 1.00 0.00 H new ATOM 0 HG2 LYS A 22 33.927 59.742 3.836 1.00 0.00 H new ATOM 0 HG3 LYS A 22 34.182 59.022 2.259 1.00 0.00 H new ATOM 0 HD2 LYS A 22 36.141 57.763 3.156 1.00 0.00 H new ATOM 0 HD3 LYS A 22 35.872 58.476 4.734 1.00 0.00 H new ATOM 0 HE2 LYS A 22 33.964 56.652 3.220 1.00 0.00 H new ATOM 0 HE3 LYS A 22 34.881 56.242 4.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 32.898 56.782 5.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 33.609 58.324 5.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 32.495 57.921 4.394 1.00 0.00 H new ATOM 357 N THR A 23 38.682 61.213 3.433 1.00 0.00 N ATOM 358 CA THR A 23 39.816 61.763 2.728 1.00 0.00 C ATOM 359 C THR A 23 39.474 61.832 1.244 1.00 0.00 C ATOM 360 O THR A 23 38.572 61.124 0.791 1.00 0.00 O ATOM 361 CB THR A 23 41.056 60.885 2.950 1.00 0.00 C ATOM 362 OG1 THR A 23 40.690 59.738 3.727 1.00 0.00 O ATOM 363 CG2 THR A 23 42.140 61.656 3.673 1.00 0.00 C ATOM 0 H THR A 23 38.835 60.280 3.816 1.00 0.00 H new ATOM 0 HA THR A 23 40.038 62.762 3.103 1.00 0.00 H new ATOM 0 HB THR A 23 41.441 60.574 1.979 1.00 0.00 H new ATOM 0 HG1 THR A 23 40.995 59.858 4.651 1.00 0.00 H new ATOM 0 HG21 THR A 23 43.008 61.013 3.819 1.00 0.00 H new ATOM 0 HG22 THR A 23 42.427 62.524 3.079 1.00 0.00 H new ATOM 0 HG23 THR A 23 41.767 61.987 4.642 1.00 0.00 H new ATOM 371 N TRP A 24 40.171 62.673 0.491 1.00 0.00 N ATOM 372 CA TRP A 24 39.851 62.872 -0.922 1.00 0.00 C ATOM 373 C TRP A 24 39.788 61.540 -1.672 1.00 0.00 C ATOM 374 O TRP A 24 38.837 61.278 -2.410 1.00 0.00 O ATOM 375 CB TRP A 24 40.883 63.788 -1.578 1.00 0.00 C ATOM 376 CG TRP A 24 40.531 64.184 -2.981 1.00 0.00 C ATOM 377 CD1 TRP A 24 39.812 65.278 -3.362 1.00 0.00 C ATOM 378 CD2 TRP A 24 40.884 63.495 -4.191 1.00 0.00 C ATOM 379 NE1 TRP A 24 39.694 65.313 -4.727 1.00 0.00 N ATOM 380 CE2 TRP A 24 40.342 64.230 -5.261 1.00 0.00 C ATOM 381 CE3 TRP A 24 41.603 62.328 -4.472 1.00 0.00 C ATOM 382 CZ2 TRP A 24 40.498 63.840 -6.587 1.00 0.00 C ATOM 383 CZ3 TRP A 24 41.755 61.941 -5.790 1.00 0.00 C ATOM 384 CH2 TRP A 24 41.206 62.696 -6.833 1.00 0.00 C ATOM 0 H TRP A 24 40.958 63.227 0.830 1.00 0.00 H new ATOM 0 HA TRP A 24 38.869 63.341 -0.976 1.00 0.00 H new ATOM 0 HB2 TRP A 24 40.994 64.688 -0.973 1.00 0.00 H new ATOM 0 HB3 TRP A 24 41.850 63.286 -1.583 1.00 0.00 H new ATOM 0 HD1 TRP A 24 39.396 66.011 -2.686 1.00 0.00 H new ATOM 0 HE1 TRP A 24 39.203 66.030 -5.260 1.00 0.00 H new ATOM 0 HE3 TRP A 24 42.031 61.740 -3.673 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 40.075 64.420 -7.394 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 42.307 61.041 -6.019 1.00 0.00 H new ATOM 0 HH2 TRP A 24 41.344 62.368 -7.853 1.00 0.00 H new ATOM 395 N ALA A 25 40.793 60.700 -1.460 1.00 0.00 N ATOM 396 CA ALA A 25 40.875 59.414 -2.139 1.00 0.00 C ATOM 397 C ALA A 25 39.701 58.514 -1.764 1.00 0.00 C ATOM 398 O ALA A 25 39.072 57.906 -2.630 1.00 0.00 O ATOM 399 CB ALA A 25 42.195 58.731 -1.809 1.00 0.00 C ATOM 0 H ALA A 25 41.565 60.888 -0.821 1.00 0.00 H new ATOM 0 HA ALA A 25 40.827 59.594 -3.213 1.00 0.00 H new ATOM 0 HB1 ALA A 25 42.246 57.770 -2.322 1.00 0.00 H new ATOM 0 HB2 ALA A 25 43.022 59.361 -2.136 1.00 0.00 H new ATOM 0 HB3 ALA A 25 42.263 58.572 -0.733 1.00 0.00 H new ATOM 405 N GLU A 26 39.391 58.457 -0.475 1.00 0.00 N ATOM 406 CA GLU A 26 38.330 57.590 0.021 1.00 0.00 C ATOM 407 C GLU A 26 36.962 58.110 -0.405 1.00 0.00 C ATOM 408 O GLU A 26 36.007 57.343 -0.543 1.00 0.00 O ATOM 409 CB GLU A 26 38.404 57.471 1.544 1.00 0.00 C ATOM 410 CG GLU A 26 39.782 57.070 2.049 1.00 0.00 C ATOM 411 CD GLU A 26 40.392 55.942 1.241 1.00 0.00 C ATOM 412 OE1 GLU A 26 40.010 54.771 1.450 1.00 0.00 O ATOM 413 OE2 GLU A 26 41.243 56.229 0.376 1.00 0.00 O ATOM 0 H GLU A 26 39.861 59.003 0.248 1.00 0.00 H new ATOM 0 HA GLU A 26 38.470 56.600 -0.413 1.00 0.00 H new ATOM 0 HB2 GLU A 26 38.124 58.425 1.990 1.00 0.00 H new ATOM 0 HB3 GLU A 26 37.673 56.736 1.880 1.00 0.00 H new ATOM 0 HG2 GLU A 26 40.444 57.936 2.015 1.00 0.00 H new ATOM 0 HG3 GLU A 26 39.708 56.766 3.093 1.00 0.00 H new ATOM 420 N SER A 27 36.873 59.416 -0.612 1.00 0.00 N ATOM 421 CA SER A 27 35.657 60.027 -1.118 1.00 0.00 C ATOM 422 C SER A 27 35.341 59.494 -2.514 1.00 0.00 C ATOM 423 O SER A 27 34.197 59.147 -2.814 1.00 0.00 O ATOM 424 CB SER A 27 35.805 61.552 -1.152 1.00 0.00 C ATOM 425 OG SER A 27 34.629 62.170 -1.647 1.00 0.00 O ATOM 0 H SER A 27 37.633 60.073 -0.436 1.00 0.00 H new ATOM 0 HA SER A 27 34.833 59.772 -0.452 1.00 0.00 H new ATOM 0 HB2 SER A 27 36.019 61.922 -0.149 1.00 0.00 H new ATOM 0 HB3 SER A 27 36.654 61.824 -1.780 1.00 0.00 H new ATOM 0 HG SER A 27 34.220 61.597 -2.328 1.00 0.00 H new ATOM 431 N GLU A 28 36.370 59.407 -3.352 1.00 0.00 N ATOM 432 CA GLU A 28 36.205 58.926 -4.718 1.00 0.00 C ATOM 433 C GLU A 28 36.125 57.401 -4.737 1.00 0.00 C ATOM 434 O GLU A 28 35.627 56.810 -5.684 1.00 0.00 O ATOM 435 CB GLU A 28 37.347 59.429 -5.610 1.00 0.00 C ATOM 436 CG GLU A 28 37.131 59.166 -7.097 1.00 0.00 C ATOM 437 CD GLU A 28 35.836 59.764 -7.628 1.00 0.00 C ATOM 438 OE1 GLU A 28 34.791 59.093 -7.550 1.00 0.00 O ATOM 439 OE2 GLU A 28 35.862 60.896 -8.158 1.00 0.00 O ATOM 0 H GLU A 28 37.327 59.664 -3.108 1.00 0.00 H new ATOM 0 HA GLU A 28 35.271 59.321 -5.116 1.00 0.00 H new ATOM 0 HB2 GLU A 28 37.471 60.501 -5.455 1.00 0.00 H new ATOM 0 HB3 GLU A 28 38.276 58.952 -5.298 1.00 0.00 H new ATOM 0 HG2 GLU A 28 37.970 59.577 -7.658 1.00 0.00 H new ATOM 0 HG3 GLU A 28 37.126 58.090 -7.272 1.00 0.00 H new ATOM 446 N ARG A 29 36.637 56.764 -3.687 1.00 0.00 N ATOM 447 CA ARG A 29 36.493 55.320 -3.532 1.00 0.00 C ATOM 448 C ARG A 29 35.041 54.943 -3.238 1.00 0.00 C ATOM 449 O ARG A 29 34.584 53.862 -3.606 1.00 0.00 O ATOM 450 CB ARG A 29 37.406 54.795 -2.421 1.00 0.00 C ATOM 451 CG ARG A 29 38.862 54.663 -2.837 1.00 0.00 C ATOM 452 CD ARG A 29 39.719 54.133 -1.700 1.00 0.00 C ATOM 453 NE ARG A 29 41.061 53.758 -2.148 1.00 0.00 N ATOM 454 CZ ARG A 29 42.055 53.419 -1.323 1.00 0.00 C ATOM 455 NH1 ARG A 29 41.896 53.505 -0.009 1.00 0.00 N ATOM 456 NH2 ARG A 29 43.224 53.025 -1.819 1.00 0.00 N ATOM 0 H ARG A 29 37.152 57.222 -2.935 1.00 0.00 H new ATOM 0 HA ARG A 29 36.788 54.856 -4.473 1.00 0.00 H new ATOM 0 HB2 ARG A 29 37.342 55.465 -1.563 1.00 0.00 H new ATOM 0 HB3 ARG A 29 37.041 53.821 -2.093 1.00 0.00 H new ATOM 0 HG2 ARG A 29 38.938 53.994 -3.694 1.00 0.00 H new ATOM 0 HG3 ARG A 29 39.240 55.634 -3.157 1.00 0.00 H new ATOM 0 HD2 ARG A 29 39.797 54.892 -0.921 1.00 0.00 H new ATOM 0 HD3 ARG A 29 39.232 53.266 -1.253 1.00 0.00 H new ATOM 0 HE ARG A 29 41.248 53.755 -3.151 1.00 0.00 H new ATOM 0 HH11 ARG A 29 41.010 53.832 0.377 1.00 0.00 H new ATOM 0 HH12 ARG A 29 42.659 53.244 0.615 1.00 0.00 H new ATOM 0 HH21 ARG A 29 43.361 52.982 -2.829 1.00 0.00 H new ATOM 0 HH22 ARG A 29 43.984 52.766 -1.190 1.00 0.00 H new ATOM 470 N ASN A 30 34.320 55.833 -2.561 1.00 0.00 N ATOM 471 CA ASN A 30 32.898 55.621 -2.306 1.00 0.00 C ATOM 472 C ASN A 30 32.081 56.118 -3.496 1.00 0.00 C ATOM 473 O ASN A 30 30.987 55.625 -3.775 1.00 0.00 O ATOM 474 CB ASN A 30 32.465 56.335 -1.022 1.00 0.00 C ATOM 475 CG ASN A 30 31.013 56.065 -0.655 1.00 0.00 C ATOM 476 OD1 ASN A 30 30.332 56.936 -0.115 1.00 0.00 O ATOM 477 ND2 ASN A 30 30.534 54.859 -0.923 1.00 0.00 N ATOM 0 H ASN A 30 34.694 56.703 -2.181 1.00 0.00 H new ATOM 0 HA ASN A 30 32.720 54.554 -2.174 1.00 0.00 H new ATOM 0 HB2 ASN A 30 33.107 56.016 -0.201 1.00 0.00 H new ATOM 0 HB3 ASN A 30 32.610 57.409 -1.143 1.00 0.00 H new ATOM 0 HD21 ASN A 30 29.571 54.627 -0.681 1.00 0.00 H new ATOM 0 HD22 ASN A 30 31.129 54.162 -1.372 1.00 0.00 H new ATOM 484 N CYS A 31 32.627 57.101 -4.194 1.00 0.00 N ATOM 485 CA CYS A 31 32.072 57.549 -5.460 1.00 0.00 C ATOM 486 C CYS A 31 32.610 56.654 -6.572 1.00 0.00 C ATOM 487 O CYS A 31 33.308 55.683 -6.285 1.00 0.00 O ATOM 488 CB CYS A 31 32.393 59.027 -5.714 1.00 0.00 C ATOM 489 SG CYS A 31 31.483 60.176 -4.629 1.00 0.00 S ATOM 0 H CYS A 31 33.462 57.608 -3.901 1.00 0.00 H new ATOM 0 HA CYS A 31 30.985 57.470 -5.433 1.00 0.00 H new ATOM 0 HB2 CYS A 31 33.463 59.185 -5.579 1.00 0.00 H new ATOM 0 HB3 CYS A 31 32.164 59.265 -6.753 1.00 0.00 H new ATOM 494 N SER A 32 32.210 56.915 -7.815 1.00 0.00 N ATOM 495 CA SER A 32 32.579 56.075 -8.961 1.00 0.00 C ATOM 496 C SER A 32 31.811 54.755 -8.948 1.00 0.00 C ATOM 497 O SER A 32 31.269 54.341 -9.971 1.00 0.00 O ATOM 498 CB SER A 32 34.092 55.829 -9.015 1.00 0.00 C ATOM 499 OG SER A 32 34.796 57.039 -9.234 1.00 0.00 O ATOM 0 H SER A 32 31.622 57.712 -8.060 1.00 0.00 H new ATOM 0 HA SER A 32 32.301 56.617 -9.865 1.00 0.00 H new ATOM 0 HB2 SER A 32 34.424 55.375 -8.081 1.00 0.00 H new ATOM 0 HB3 SER A 32 34.321 55.122 -9.812 1.00 0.00 H new ATOM 0 HG SER A 32 34.683 57.628 -8.459 1.00 0.00 H new ATOM 505 N GLY A 33 31.747 54.114 -7.786 1.00 0.00 N ATOM 506 CA GLY A 33 30.941 52.916 -7.636 1.00 0.00 C ATOM 507 C GLY A 33 29.470 53.201 -7.855 1.00 0.00 C ATOM 508 O GLY A 33 28.715 52.331 -8.271 1.00 0.00 O ATOM 0 H GLY A 33 32.241 54.404 -6.942 1.00 0.00 H new ATOM 0 HA2 GLY A 33 31.275 52.161 -8.347 1.00 0.00 H new ATOM 0 HA3 GLY A 33 31.087 52.501 -6.639 1.00 0.00 H new ATOM 512 N MET A 34 29.070 54.437 -7.578 1.00 0.00 N ATOM 513 CA MET A 34 27.698 54.872 -7.809 1.00 0.00 C ATOM 514 C MET A 34 27.564 55.504 -9.192 1.00 0.00 C ATOM 515 O MET A 34 26.524 56.063 -9.530 1.00 0.00 O ATOM 516 CB MET A 34 27.257 55.877 -6.738 1.00 0.00 C ATOM 517 CG MET A 34 27.183 55.293 -5.336 1.00 0.00 C ATOM 518 SD MET A 34 26.545 56.462 -4.117 1.00 0.00 S ATOM 519 CE MET A 34 27.828 57.713 -4.106 1.00 0.00 C ATOM 0 H MET A 34 29.679 55.158 -7.192 1.00 0.00 H new ATOM 0 HA MET A 34 27.054 53.994 -7.753 1.00 0.00 H new ATOM 0 HB2 MET A 34 27.952 56.717 -6.735 1.00 0.00 H new ATOM 0 HB3 MET A 34 26.278 56.274 -7.008 1.00 0.00 H new ATOM 0 HG2 MET A 34 26.547 54.408 -5.350 1.00 0.00 H new ATOM 0 HG3 MET A 34 28.177 54.966 -5.032 1.00 0.00 H new ATOM 0 HE1 MET A 34 27.689 58.369 -3.247 1.00 0.00 H new ATOM 0 HE2 MET A 34 28.804 57.232 -4.041 1.00 0.00 H new ATOM 0 HE3 MET A 34 27.772 58.299 -5.023 1.00 0.00 H new ATOM 529 N GLY A 35 28.630 55.416 -9.984 1.00 0.00 N ATOM 530 CA GLY A 35 28.639 56.027 -11.304 1.00 0.00 C ATOM 531 C GLY A 35 28.980 57.504 -11.254 1.00 0.00 C ATOM 532 O GLY A 35 29.156 58.149 -12.286 1.00 0.00 O ATOM 0 H GLY A 35 29.491 54.930 -9.734 1.00 0.00 H new ATOM 0 HA2 GLY A 35 29.362 55.511 -11.936 1.00 0.00 H new ATOM 0 HA3 GLY A 35 27.661 55.898 -11.768 1.00 0.00 H new ATOM 536 N ALA A 36 29.085 58.032 -10.045 1.00 0.00 N ATOM 537 CA ALA A 36 29.334 59.449 -9.841 1.00 0.00 C ATOM 538 C ALA A 36 30.816 59.724 -9.612 1.00 0.00 C ATOM 539 O ALA A 36 31.634 58.813 -9.666 1.00 0.00 O ATOM 540 CB ALA A 36 28.513 59.943 -8.663 1.00 0.00 C ATOM 0 H ALA A 36 29.001 57.494 -9.183 1.00 0.00 H new ATOM 0 HA ALA A 36 29.036 59.987 -10.741 1.00 0.00 H new ATOM 0 HB1 ALA A 36 28.700 61.006 -8.510 1.00 0.00 H new ATOM 0 HB2 ALA A 36 27.454 59.786 -8.866 1.00 0.00 H new ATOM 0 HB3 ALA A 36 28.796 59.392 -7.766 1.00 0.00 H new ATOM 546 N HIS A 37 31.150 60.981 -9.368 1.00 0.00 N ATOM 547 CA HIS A 37 32.524 61.395 -9.091 1.00 0.00 C ATOM 548 C HIS A 37 32.528 62.583 -8.147 1.00 0.00 C ATOM 549 O HIS A 37 31.475 63.148 -7.866 1.00 0.00 O ATOM 550 CB HIS A 37 33.258 61.772 -10.380 1.00 0.00 C ATOM 551 CG HIS A 37 33.888 60.612 -11.076 1.00 0.00 C ATOM 552 ND1 HIS A 37 35.045 60.021 -10.632 1.00 0.00 N ATOM 553 CD2 HIS A 37 33.523 59.935 -12.189 1.00 0.00 C ATOM 554 CE1 HIS A 37 35.372 59.033 -11.440 1.00 0.00 C ATOM 555 NE2 HIS A 37 34.464 58.955 -12.396 1.00 0.00 N ATOM 0 H HIS A 37 30.477 61.748 -9.355 1.00 0.00 H new ATOM 0 HA HIS A 37 33.040 60.554 -8.629 1.00 0.00 H new ATOM 0 HB2 HIS A 37 32.555 62.253 -11.060 1.00 0.00 H new ATOM 0 HB3 HIS A 37 34.029 62.506 -10.146 1.00 0.00 H new ATOM 0 HD1 HIS A 37 35.570 60.303 -9.804 1.00 0.00 H new ATOM 0 HD2 HIS A 37 32.654 60.129 -12.801 1.00 0.00 H new ATOM 0 HE1 HIS A 37 36.237 58.394 -11.338 1.00 0.00 H new ATOM 564 N LEU A 38 33.700 62.941 -7.638 1.00 0.00 N ATOM 565 CA LEU A 38 33.839 64.152 -6.834 1.00 0.00 C ATOM 566 C LEU A 38 33.323 65.364 -7.601 1.00 0.00 C ATOM 567 O LEU A 38 33.476 65.442 -8.820 1.00 0.00 O ATOM 568 CB LEU A 38 35.299 64.375 -6.425 1.00 0.00 C ATOM 569 CG LEU A 38 35.680 63.842 -5.043 1.00 0.00 C ATOM 570 CD1 LEU A 38 34.916 64.586 -3.958 1.00 0.00 C ATOM 571 CD2 LEU A 38 35.408 62.351 -4.953 1.00 0.00 C ATOM 0 H LEU A 38 34.564 62.415 -7.766 1.00 0.00 H new ATOM 0 HA LEU A 38 33.243 64.024 -5.930 1.00 0.00 H new ATOM 0 HB2 LEU A 38 35.943 63.904 -7.168 1.00 0.00 H new ATOM 0 HB3 LEU A 38 35.508 65.444 -6.454 1.00 0.00 H new ATOM 0 HG LEU A 38 36.747 64.008 -4.893 1.00 0.00 H new ATOM 0 HD11 LEU A 38 35.198 64.195 -2.981 1.00 0.00 H new ATOM 0 HD12 LEU A 38 35.156 65.648 -4.007 1.00 0.00 H new ATOM 0 HD13 LEU A 38 33.845 64.449 -4.108 1.00 0.00 H new ATOM 0 HD21 LEU A 38 35.685 61.990 -3.963 1.00 0.00 H new ATOM 0 HD22 LEU A 38 34.348 62.164 -5.124 1.00 0.00 H new ATOM 0 HD23 LEU A 38 35.995 61.828 -5.708 1.00 0.00 H new ATOM 583 N MET A 39 32.698 66.289 -6.875 1.00 0.00 N ATOM 584 CA MET A 39 32.094 67.478 -7.469 1.00 0.00 C ATOM 585 C MET A 39 33.057 68.195 -8.411 1.00 0.00 C ATOM 586 O MET A 39 34.052 68.788 -7.982 1.00 0.00 O ATOM 587 CB MET A 39 31.618 68.440 -6.378 1.00 0.00 C ATOM 588 CG MET A 39 31.037 69.736 -6.920 1.00 0.00 C ATOM 589 SD MET A 39 29.665 69.461 -8.055 1.00 0.00 S ATOM 590 CE MET A 39 29.267 71.146 -8.511 1.00 0.00 C ATOM 0 H MET A 39 32.597 66.235 -5.861 1.00 0.00 H new ATOM 0 HA MET A 39 31.237 67.146 -8.056 1.00 0.00 H new ATOM 0 HB2 MET A 39 30.865 67.941 -5.769 1.00 0.00 H new ATOM 0 HB3 MET A 39 32.456 68.674 -5.721 1.00 0.00 H new ATOM 0 HG2 MET A 39 30.697 70.353 -6.088 1.00 0.00 H new ATOM 0 HG3 MET A 39 31.820 70.295 -7.432 1.00 0.00 H new ATOM 0 HE1 MET A 39 28.184 71.267 -8.548 1.00 0.00 H new ATOM 0 HE2 MET A 39 29.683 71.831 -7.772 1.00 0.00 H new ATOM 0 HE3 MET A 39 29.691 71.368 -9.490 1.00 0.00 H new ATOM 600 N THR A 40 32.758 68.117 -9.694 1.00 0.00 N ATOM 601 CA THR A 40 33.541 68.792 -10.703 1.00 0.00 C ATOM 602 C THR A 40 32.768 69.979 -11.267 1.00 0.00 C ATOM 603 O THR A 40 31.796 69.813 -12.002 1.00 0.00 O ATOM 604 CB THR A 40 33.944 67.819 -11.827 1.00 0.00 C ATOM 605 OG1 THR A 40 32.794 67.109 -12.312 1.00 0.00 O ATOM 606 CG2 THR A 40 34.971 66.823 -11.314 1.00 0.00 C ATOM 0 H THR A 40 31.969 67.586 -10.061 1.00 0.00 H new ATOM 0 HA THR A 40 34.454 69.164 -10.238 1.00 0.00 H new ATOM 0 HB THR A 40 34.377 68.398 -12.643 1.00 0.00 H new ATOM 0 HG1 THR A 40 33.081 66.277 -12.743 1.00 0.00 H new ATOM 0 HG21 THR A 40 35.248 66.140 -12.117 1.00 0.00 H new ATOM 0 HG22 THR A 40 35.856 67.358 -10.970 1.00 0.00 H new ATOM 0 HG23 THR A 40 34.546 66.256 -10.486 1.00 0.00 H new ATOM 614 N ILE A 41 33.188 71.178 -10.889 1.00 0.00 N ATOM 615 CA ILE A 41 32.490 72.391 -11.285 1.00 0.00 C ATOM 616 C ILE A 41 32.891 72.815 -12.693 1.00 0.00 C ATOM 617 O ILE A 41 34.048 73.144 -12.955 1.00 0.00 O ATOM 618 CB ILE A 41 32.755 73.544 -10.292 1.00 0.00 C ATOM 619 CG1 ILE A 41 32.317 73.133 -8.883 1.00 0.00 C ATOM 620 CG2 ILE A 41 32.028 74.808 -10.733 1.00 0.00 C ATOM 621 CD1 ILE A 41 32.502 74.212 -7.837 1.00 0.00 C ATOM 0 H ILE A 41 34.011 71.336 -10.307 1.00 0.00 H new ATOM 0 HA ILE A 41 31.423 72.169 -11.275 1.00 0.00 H new ATOM 0 HB ILE A 41 33.824 73.756 -10.278 1.00 0.00 H new ATOM 0 HG12 ILE A 41 31.266 72.846 -8.911 1.00 0.00 H new ATOM 0 HG13 ILE A 41 32.881 72.250 -8.582 1.00 0.00 H new ATOM 0 HG21 ILE A 41 32.227 75.609 -10.021 1.00 0.00 H new ATOM 0 HG22 ILE A 41 32.381 75.105 -11.721 1.00 0.00 H new ATOM 0 HG23 ILE A 41 30.956 74.616 -10.773 1.00 0.00 H new ATOM 0 HD11 ILE A 41 32.168 73.841 -6.868 1.00 0.00 H new ATOM 0 HD12 ILE A 41 33.556 74.484 -7.778 1.00 0.00 H new ATOM 0 HD13 ILE A 41 31.916 75.089 -8.111 1.00 0.00 H new ATOM 633 N SER A 42 31.922 72.796 -13.590 1.00 0.00 N ATOM 634 CA SER A 42 32.149 73.146 -14.979 1.00 0.00 C ATOM 635 C SER A 42 31.636 74.553 -15.281 1.00 0.00 C ATOM 636 O SER A 42 32.192 75.261 -16.124 1.00 0.00 O ATOM 637 CB SER A 42 31.471 72.120 -15.893 1.00 0.00 C ATOM 638 OG SER A 42 30.093 71.968 -15.577 1.00 0.00 O ATOM 0 H SER A 42 30.958 72.538 -13.376 1.00 0.00 H new ATOM 0 HA SER A 42 33.223 73.134 -15.167 1.00 0.00 H new ATOM 0 HB2 SER A 42 31.574 72.433 -16.932 1.00 0.00 H new ATOM 0 HB3 SER A 42 31.975 71.158 -15.798 1.00 0.00 H new ATOM 0 HG SER A 42 29.996 71.767 -14.623 1.00 0.00 H new ATOM 644 N THR A 43 30.581 74.967 -14.590 1.00 0.00 N ATOM 645 CA THR A 43 29.998 76.274 -14.840 1.00 0.00 C ATOM 646 C THR A 43 29.777 77.056 -13.547 1.00 0.00 C ATOM 647 O THR A 43 29.704 76.487 -12.452 1.00 0.00 O ATOM 648 CB THR A 43 28.667 76.166 -15.617 1.00 0.00 C ATOM 649 OG1 THR A 43 27.741 75.346 -14.901 1.00 0.00 O ATOM 650 CG2 THR A 43 28.891 75.583 -17.004 1.00 0.00 C ATOM 0 H THR A 43 30.118 74.423 -13.862 1.00 0.00 H new ATOM 0 HA THR A 43 30.717 76.818 -15.453 1.00 0.00 H new ATOM 0 HB THR A 43 28.258 77.171 -15.721 1.00 0.00 H new ATOM 0 HG1 THR A 43 26.901 75.287 -15.402 1.00 0.00 H new ATOM 0 HG21 THR A 43 27.938 75.518 -17.529 1.00 0.00 H new ATOM 0 HG22 THR A 43 29.571 76.226 -17.563 1.00 0.00 H new ATOM 0 HG23 THR A 43 29.325 74.587 -16.914 1.00 0.00 H new ATOM 658 N GLU A 44 29.661 78.367 -13.695 1.00 0.00 N ATOM 659 CA GLU A 44 29.504 79.276 -12.571 1.00 0.00 C ATOM 660 C GLU A 44 28.148 79.081 -11.906 1.00 0.00 C ATOM 661 O GLU A 44 28.034 79.110 -10.681 1.00 0.00 O ATOM 662 CB GLU A 44 29.655 80.705 -13.080 1.00 0.00 C ATOM 663 CG GLU A 44 31.025 80.972 -13.674 1.00 0.00 C ATOM 664 CD GLU A 44 31.031 82.141 -14.634 1.00 0.00 C ATOM 665 OE1 GLU A 44 31.173 83.288 -14.186 1.00 0.00 O ATOM 666 OE2 GLU A 44 30.900 81.895 -15.857 1.00 0.00 O ATOM 0 H GLU A 44 29.673 78.832 -14.603 1.00 0.00 H new ATOM 0 HA GLU A 44 30.268 79.070 -11.822 1.00 0.00 H new ATOM 0 HB2 GLU A 44 28.892 80.901 -13.834 1.00 0.00 H new ATOM 0 HB3 GLU A 44 29.478 81.400 -12.259 1.00 0.00 H new ATOM 0 HG2 GLU A 44 31.733 81.166 -12.869 1.00 0.00 H new ATOM 0 HG3 GLU A 44 31.370 80.079 -14.194 1.00 0.00 H new ATOM 673 N ALA A 45 27.124 78.865 -12.723 1.00 0.00 N ATOM 674 CA ALA A 45 25.779 78.633 -12.211 1.00 0.00 C ATOM 675 C ALA A 45 25.705 77.297 -11.487 1.00 0.00 C ATOM 676 O ALA A 45 24.975 77.154 -10.510 1.00 0.00 O ATOM 677 CB ALA A 45 24.762 78.687 -13.337 1.00 0.00 C ATOM 0 H ALA A 45 27.199 78.846 -13.740 1.00 0.00 H new ATOM 0 HA ALA A 45 25.543 79.423 -11.498 1.00 0.00 H new ATOM 0 HB1 ALA A 45 23.764 78.511 -12.935 1.00 0.00 H new ATOM 0 HB2 ALA A 45 24.795 79.668 -13.810 1.00 0.00 H new ATOM 0 HB3 ALA A 45 24.996 77.920 -14.075 1.00 0.00 H new ATOM 683 N GLU A 46 26.476 76.327 -11.970 1.00 0.00 N ATOM 684 CA GLU A 46 26.555 75.018 -11.337 1.00 0.00 C ATOM 685 C GLU A 46 27.031 75.159 -9.897 1.00 0.00 C ATOM 686 O GLU A 46 26.406 74.633 -8.973 1.00 0.00 O ATOM 687 CB GLU A 46 27.505 74.115 -12.124 1.00 0.00 C ATOM 688 CG GLU A 46 27.673 72.725 -11.539 1.00 0.00 C ATOM 689 CD GLU A 46 28.486 71.818 -12.438 1.00 0.00 C ATOM 690 OE1 GLU A 46 29.483 72.290 -13.015 1.00 0.00 O ATOM 691 OE2 GLU A 46 28.124 70.631 -12.586 1.00 0.00 O ATOM 0 H GLU A 46 27.057 76.426 -12.802 1.00 0.00 H new ATOM 0 HA GLU A 46 25.563 74.566 -11.332 1.00 0.00 H new ATOM 0 HB2 GLU A 46 27.138 74.024 -13.146 1.00 0.00 H new ATOM 0 HB3 GLU A 46 28.482 74.595 -12.178 1.00 0.00 H new ATOM 0 HG2 GLU A 46 28.159 72.799 -10.566 1.00 0.00 H new ATOM 0 HG3 GLU A 46 26.691 72.282 -11.372 1.00 0.00 H new ATOM 698 N GLN A 47 28.132 75.888 -9.712 1.00 0.00 N ATOM 699 CA GLN A 47 28.656 76.148 -8.376 1.00 0.00 C ATOM 700 C GLN A 47 27.608 76.835 -7.509 1.00 0.00 C ATOM 701 O GLN A 47 27.261 76.345 -6.437 1.00 0.00 O ATOM 702 CB GLN A 47 29.913 77.023 -8.432 1.00 0.00 C ATOM 703 CG GLN A 47 30.440 77.386 -7.048 1.00 0.00 C ATOM 704 CD GLN A 47 31.685 78.248 -7.081 1.00 0.00 C ATOM 705 OE1 GLN A 47 31.612 79.479 -7.075 1.00 0.00 O ATOM 706 NE2 GLN A 47 32.841 77.606 -7.105 1.00 0.00 N ATOM 0 H GLN A 47 28.674 76.306 -10.468 1.00 0.00 H new ATOM 0 HA GLN A 47 28.915 75.184 -7.938 1.00 0.00 H new ATOM 0 HB2 GLN A 47 30.691 76.499 -8.986 1.00 0.00 H new ATOM 0 HB3 GLN A 47 29.690 77.937 -8.983 1.00 0.00 H new ATOM 0 HG2 GLN A 47 29.659 77.911 -6.497 1.00 0.00 H new ATOM 0 HG3 GLN A 47 30.657 76.470 -6.499 1.00 0.00 H new ATOM 0 HE21 GLN A 47 32.858 76.586 -7.109 1.00 0.00 H new ATOM 0 HE22 GLN A 47 33.716 78.131 -7.119 1.00 0.00 H new ATOM 715 N ASN A 48 27.098 77.961 -7.993 1.00 0.00 N ATOM 716 CA ASN A 48 26.168 78.778 -7.225 1.00 0.00 C ATOM 717 C ASN A 48 24.910 78.006 -6.840 1.00 0.00 C ATOM 718 O ASN A 48 24.394 78.171 -5.741 1.00 0.00 O ATOM 719 CB ASN A 48 25.795 80.042 -8.006 1.00 0.00 C ATOM 720 CG ASN A 48 26.860 81.123 -7.915 1.00 0.00 C ATOM 721 OD1 ASN A 48 26.860 81.938 -6.991 1.00 0.00 O ATOM 722 ND2 ASN A 48 27.775 81.146 -8.873 1.00 0.00 N ATOM 0 H ASN A 48 27.315 78.330 -8.919 1.00 0.00 H new ATOM 0 HA ASN A 48 26.674 79.062 -6.302 1.00 0.00 H new ATOM 0 HB2 ASN A 48 25.634 79.783 -9.053 1.00 0.00 H new ATOM 0 HB3 ASN A 48 24.852 80.434 -7.626 1.00 0.00 H new ATOM 0 HD21 ASN A 48 28.509 81.854 -8.860 1.00 0.00 H new ATOM 0 HD22 ASN A 48 27.745 80.456 -9.623 1.00 0.00 H new ATOM 729 N PHE A 49 24.436 77.147 -7.730 1.00 0.00 N ATOM 730 CA PHE A 49 23.209 76.400 -7.482 1.00 0.00 C ATOM 731 C PHE A 49 23.410 75.362 -6.377 1.00 0.00 C ATOM 732 O PHE A 49 22.604 75.273 -5.454 1.00 0.00 O ATOM 733 CB PHE A 49 22.737 75.715 -8.768 1.00 0.00 C ATOM 734 CG PHE A 49 21.275 75.372 -8.782 1.00 0.00 C ATOM 735 CD1 PHE A 49 20.314 76.366 -8.671 1.00 0.00 C ATOM 736 CD2 PHE A 49 20.860 74.057 -8.916 1.00 0.00 C ATOM 737 CE1 PHE A 49 18.968 76.053 -8.691 1.00 0.00 C ATOM 738 CE2 PHE A 49 19.515 73.739 -8.938 1.00 0.00 C ATOM 739 CZ PHE A 49 18.568 74.739 -8.825 1.00 0.00 C ATOM 0 H PHE A 49 24.879 76.949 -8.627 1.00 0.00 H new ATOM 0 HA PHE A 49 22.445 77.104 -7.152 1.00 0.00 H new ATOM 0 HB2 PHE A 49 22.954 76.367 -9.614 1.00 0.00 H new ATOM 0 HB3 PHE A 49 23.314 74.802 -8.913 1.00 0.00 H new ATOM 0 HD1 PHE A 49 20.621 77.396 -8.568 1.00 0.00 H new ATOM 0 HD2 PHE A 49 21.596 73.271 -9.004 1.00 0.00 H new ATOM 0 HE1 PHE A 49 18.230 76.836 -8.602 1.00 0.00 H new ATOM 0 HE2 PHE A 49 19.205 72.710 -9.043 1.00 0.00 H new ATOM 0 HZ PHE A 49 17.517 74.493 -8.842 1.00 0.00 H new ATOM 749 N ILE A 50 24.496 74.592 -6.456 1.00 0.00 N ATOM 750 CA ILE A 50 24.715 73.498 -5.510 1.00 0.00 C ATOM 751 C ILE A 50 25.047 74.022 -4.110 1.00 0.00 C ATOM 752 O ILE A 50 24.641 73.437 -3.097 1.00 0.00 O ATOM 753 CB ILE A 50 25.822 72.522 -5.989 1.00 0.00 C ATOM 754 CG1 ILE A 50 25.932 71.324 -5.039 1.00 0.00 C ATOM 755 CG2 ILE A 50 27.167 73.225 -6.103 1.00 0.00 C ATOM 756 CD1 ILE A 50 24.655 70.516 -4.931 1.00 0.00 C ATOM 0 H ILE A 50 25.229 74.703 -7.156 1.00 0.00 H new ATOM 0 HA ILE A 50 23.777 72.944 -5.461 1.00 0.00 H new ATOM 0 HB ILE A 50 25.541 72.163 -6.979 1.00 0.00 H new ATOM 0 HG12 ILE A 50 26.736 70.673 -5.381 1.00 0.00 H new ATOM 0 HG13 ILE A 50 26.211 71.681 -4.048 1.00 0.00 H new ATOM 0 HG21 ILE A 50 27.921 72.514 -6.441 1.00 0.00 H new ATOM 0 HG22 ILE A 50 27.091 74.042 -6.821 1.00 0.00 H new ATOM 0 HG23 ILE A 50 27.453 73.623 -5.129 1.00 0.00 H new ATOM 0 HD11 ILE A 50 24.807 69.685 -4.242 1.00 0.00 H new ATOM 0 HD12 ILE A 50 23.852 71.153 -4.560 1.00 0.00 H new ATOM 0 HD13 ILE A 50 24.386 70.128 -5.913 1.00 0.00 H new ATOM 768 N ILE A 51 25.747 75.147 -4.046 1.00 0.00 N ATOM 769 CA ILE A 51 26.151 75.710 -2.765 1.00 0.00 C ATOM 770 C ILE A 51 24.950 76.280 -2.017 1.00 0.00 C ATOM 771 O ILE A 51 25.038 76.606 -0.833 1.00 0.00 O ATOM 772 CB ILE A 51 27.236 76.793 -2.930 1.00 0.00 C ATOM 773 CG1 ILE A 51 26.702 77.988 -3.725 1.00 0.00 C ATOM 774 CG2 ILE A 51 28.465 76.200 -3.607 1.00 0.00 C ATOM 775 CD1 ILE A 51 27.687 79.132 -3.846 1.00 0.00 C ATOM 0 H ILE A 51 26.045 75.684 -4.860 1.00 0.00 H new ATOM 0 HA ILE A 51 26.577 74.896 -2.179 1.00 0.00 H new ATOM 0 HB ILE A 51 27.520 77.153 -1.941 1.00 0.00 H new ATOM 0 HG12 ILE A 51 26.425 77.653 -4.724 1.00 0.00 H new ATOM 0 HG13 ILE A 51 25.793 78.353 -3.247 1.00 0.00 H new ATOM 0 HG21 ILE A 51 29.226 76.972 -3.720 1.00 0.00 H new ATOM 0 HG22 ILE A 51 28.860 75.387 -2.997 1.00 0.00 H new ATOM 0 HG23 ILE A 51 28.190 75.816 -4.589 1.00 0.00 H new ATOM 0 HD11 ILE A 51 27.237 79.940 -4.422 1.00 0.00 H new ATOM 0 HD12 ILE A 51 27.946 79.496 -2.852 1.00 0.00 H new ATOM 0 HD13 ILE A 51 28.588 78.784 -4.352 1.00 0.00 H new ATOM 787 N GLN A 52 23.827 76.384 -2.720 1.00 0.00 N ATOM 788 CA GLN A 52 22.567 76.787 -2.116 1.00 0.00 C ATOM 789 C GLN A 52 21.952 75.630 -1.331 1.00 0.00 C ATOM 790 O GLN A 52 21.207 75.843 -0.377 1.00 0.00 O ATOM 791 CB GLN A 52 21.590 77.251 -3.198 1.00 0.00 C ATOM 792 CG GLN A 52 22.010 78.532 -3.899 1.00 0.00 C ATOM 793 CD GLN A 52 21.166 78.836 -5.125 1.00 0.00 C ATOM 794 OE1 GLN A 52 19.933 78.358 -5.134 1.00 0.00 O flip ATOM 795 NE2 GLN A 52 21.623 79.482 -6.065 1.00 0.00 N flip ATOM 0 H GLN A 52 23.767 76.192 -3.720 1.00 0.00 H new ATOM 0 HA GLN A 52 22.764 77.611 -1.430 1.00 0.00 H new ATOM 0 HB2 GLN A 52 21.483 76.460 -3.941 1.00 0.00 H new ATOM 0 HB3 GLN A 52 20.609 77.400 -2.748 1.00 0.00 H new ATOM 0 HG2 GLN A 52 21.938 79.364 -3.199 1.00 0.00 H new ATOM 0 HG3 GLN A 52 23.056 78.453 -4.194 1.00 0.00 H new ATOM 0 HE21 GLN A 52 22.579 79.836 -6.024 1.00 0.00 H new ATOM 0 HE22 GLN A 52 21.046 79.665 -6.886 1.00 0.00 H new ATOM 804 N PHE A 53 22.263 74.404 -1.744 1.00 0.00 N ATOM 805 CA PHE A 53 21.724 73.219 -1.088 1.00 0.00 C ATOM 806 C PHE A 53 22.642 72.766 0.037 1.00 0.00 C ATOM 807 O PHE A 53 22.223 72.041 0.940 1.00 0.00 O ATOM 808 CB PHE A 53 21.544 72.077 -2.088 1.00 0.00 C ATOM 809 CG PHE A 53 20.738 72.449 -3.295 1.00 0.00 C ATOM 810 CD1 PHE A 53 19.379 72.695 -3.199 1.00 0.00 C ATOM 811 CD2 PHE A 53 21.347 72.551 -4.529 1.00 0.00 C ATOM 812 CE1 PHE A 53 18.646 73.041 -4.318 1.00 0.00 C ATOM 813 CE2 PHE A 53 20.623 72.894 -5.650 1.00 0.00 C ATOM 814 CZ PHE A 53 19.272 73.142 -5.547 1.00 0.00 C ATOM 0 H PHE A 53 22.884 74.207 -2.528 1.00 0.00 H new ATOM 0 HA PHE A 53 20.751 73.483 -0.673 1.00 0.00 H new ATOM 0 HB2 PHE A 53 22.526 71.732 -2.411 1.00 0.00 H new ATOM 0 HB3 PHE A 53 21.061 71.239 -1.585 1.00 0.00 H new ATOM 0 HD1 PHE A 53 18.887 72.616 -2.241 1.00 0.00 H new ATOM 0 HD2 PHE A 53 22.406 72.359 -4.617 1.00 0.00 H new ATOM 0 HE1 PHE A 53 17.586 73.232 -4.233 1.00 0.00 H new ATOM 0 HE2 PHE A 53 21.114 72.968 -6.609 1.00 0.00 H new ATOM 0 HZ PHE A 53 18.703 73.415 -6.424 1.00 0.00 H new ATOM 824 N LEU A 54 23.903 73.175 -0.044 1.00 0.00 N ATOM 825 CA LEU A 54 24.885 72.854 0.987 1.00 0.00 C ATOM 826 C LEU A 54 24.492 73.463 2.338 1.00 0.00 C ATOM 827 O LEU A 54 23.856 74.516 2.401 1.00 0.00 O ATOM 828 CB LEU A 54 26.271 73.342 0.563 1.00 0.00 C ATOM 829 CG LEU A 54 26.807 72.720 -0.728 1.00 0.00 C ATOM 830 CD1 LEU A 54 28.199 73.243 -1.041 1.00 0.00 C ATOM 831 CD2 LEU A 54 26.818 71.203 -0.623 1.00 0.00 C ATOM 0 H LEU A 54 24.271 73.732 -0.816 1.00 0.00 H new ATOM 0 HA LEU A 54 24.911 71.771 1.106 1.00 0.00 H new ATOM 0 HB2 LEU A 54 26.237 74.425 0.440 1.00 0.00 H new ATOM 0 HB3 LEU A 54 26.975 73.134 1.369 1.00 0.00 H new ATOM 0 HG LEU A 54 26.145 73.005 -1.545 1.00 0.00 H new ATOM 0 HD11 LEU A 54 28.560 72.787 -1.963 1.00 0.00 H new ATOM 0 HD12 LEU A 54 28.162 74.326 -1.162 1.00 0.00 H new ATOM 0 HD13 LEU A 54 28.874 72.992 -0.223 1.00 0.00 H new ATOM 0 HD21 LEU A 54 27.202 70.777 -1.550 1.00 0.00 H new ATOM 0 HD22 LEU A 54 27.456 70.900 0.207 1.00 0.00 H new ATOM 0 HD23 LEU A 54 25.804 70.843 -0.451 1.00 0.00 H new ATOM 843 N ASP A 55 24.893 72.790 3.413 1.00 0.00 N ATOM 844 CA ASP A 55 24.515 73.171 4.780 1.00 0.00 C ATOM 845 C ASP A 55 25.146 74.502 5.221 1.00 0.00 C ATOM 846 O ASP A 55 24.734 75.086 6.223 1.00 0.00 O ATOM 847 CB ASP A 55 24.916 72.050 5.747 1.00 0.00 C ATOM 848 CG ASP A 55 24.486 72.313 7.177 1.00 0.00 C ATOM 849 OD1 ASP A 55 23.306 72.073 7.510 1.00 0.00 O ATOM 850 OD2 ASP A 55 25.328 72.756 7.977 1.00 0.00 O ATOM 0 H ASP A 55 25.490 71.964 3.366 1.00 0.00 H new ATOM 0 HA ASP A 55 23.435 73.316 4.796 1.00 0.00 H new ATOM 0 HB2 ASP A 55 24.476 71.112 5.409 1.00 0.00 H new ATOM 0 HB3 ASP A 55 25.998 71.923 5.717 1.00 0.00 H new ATOM 855 N ARG A 56 26.135 74.976 4.460 1.00 0.00 N ATOM 856 CA ARG A 56 26.829 76.239 4.765 1.00 0.00 C ATOM 857 C ARG A 56 27.635 76.125 6.055 1.00 0.00 C ATOM 858 O ARG A 56 27.844 77.111 6.758 1.00 0.00 O ATOM 859 CB ARG A 56 25.833 77.403 4.860 1.00 0.00 C ATOM 860 CG ARG A 56 25.083 77.676 3.566 1.00 0.00 C ATOM 861 CD ARG A 56 24.048 78.776 3.741 1.00 0.00 C ATOM 862 NE ARG A 56 24.658 80.070 4.053 1.00 0.00 N ATOM 863 CZ ARG A 56 24.346 80.806 5.121 1.00 0.00 C ATOM 864 NH1 ARG A 56 23.465 80.359 6.012 1.00 0.00 N ATOM 865 NH2 ARG A 56 24.920 81.988 5.301 1.00 0.00 N ATOM 0 H ARG A 56 26.478 74.505 3.623 1.00 0.00 H new ATOM 0 HA ARG A 56 27.520 76.442 3.947 1.00 0.00 H new ATOM 0 HB2 ARG A 56 25.112 77.188 5.649 1.00 0.00 H new ATOM 0 HB3 ARG A 56 26.369 78.305 5.155 1.00 0.00 H new ATOM 0 HG2 ARG A 56 25.791 77.962 2.788 1.00 0.00 H new ATOM 0 HG3 ARG A 56 24.591 76.763 3.230 1.00 0.00 H new ATOM 0 HD2 ARG A 56 23.459 78.866 2.828 1.00 0.00 H new ATOM 0 HD3 ARG A 56 23.359 78.500 4.539 1.00 0.00 H new ATOM 0 HE ARG A 56 25.366 80.431 3.414 1.00 0.00 H new ATOM 0 HH11 ARG A 56 23.024 79.449 5.881 1.00 0.00 H new ATOM 0 HH12 ARG A 56 23.231 80.927 6.827 1.00 0.00 H new ATOM 0 HH21 ARG A 56 25.599 82.334 4.623 1.00 0.00 H new ATOM 0 HH22 ARG A 56 24.682 82.551 6.117 1.00 0.00 H new ATOM 879 N ARG A 57 28.115 74.922 6.339 1.00 0.00 N ATOM 880 CA ARG A 57 28.863 74.670 7.564 1.00 0.00 C ATOM 881 C ARG A 57 30.144 73.900 7.268 1.00 0.00 C ATOM 882 O ARG A 57 31.243 74.341 7.605 1.00 0.00 O ATOM 883 CB ARG A 57 28.003 73.861 8.533 1.00 0.00 C ATOM 884 CG ARG A 57 28.560 73.774 9.946 1.00 0.00 C ATOM 885 CD ARG A 57 27.812 72.736 10.774 1.00 0.00 C ATOM 886 NE ARG A 57 26.424 72.585 10.340 1.00 0.00 N ATOM 887 CZ ARG A 57 25.459 72.026 11.062 1.00 0.00 C ATOM 888 NH1 ARG A 57 25.695 71.606 12.299 1.00 0.00 N ATOM 889 NH2 ARG A 57 24.250 71.889 10.535 1.00 0.00 N ATOM 0 H ARG A 57 28.000 74.106 5.739 1.00 0.00 H new ATOM 0 HA ARG A 57 29.125 75.630 8.010 1.00 0.00 H new ATOM 0 HB2 ARG A 57 27.008 74.305 8.574 1.00 0.00 H new ATOM 0 HB3 ARG A 57 27.885 72.851 8.139 1.00 0.00 H new ATOM 0 HG2 ARG A 57 29.618 73.517 9.907 1.00 0.00 H new ATOM 0 HG3 ARG A 57 28.487 74.749 10.429 1.00 0.00 H new ATOM 0 HD2 ARG A 57 28.322 71.776 10.698 1.00 0.00 H new ATOM 0 HD3 ARG A 57 27.834 73.026 11.824 1.00 0.00 H new ATOM 0 HE ARG A 57 26.178 72.935 9.414 1.00 0.00 H new ATOM 0 HH11 ARG A 57 26.625 71.711 12.705 1.00 0.00 H new ATOM 0 HH12 ARG A 57 24.946 71.178 12.844 1.00 0.00 H new ATOM 0 HH21 ARG A 57 24.068 72.211 9.584 1.00 0.00 H new ATOM 0 HH22 ARG A 57 23.502 71.461 11.080 1.00 0.00 H new ATOM 903 N LEU A 58 29.990 72.745 6.633 1.00 0.00 N ATOM 904 CA LEU A 58 31.112 71.848 6.382 1.00 0.00 C ATOM 905 C LEU A 58 31.885 72.257 5.129 1.00 0.00 C ATOM 906 O LEU A 58 31.453 73.129 4.378 1.00 0.00 O ATOM 907 CB LEU A 58 30.623 70.398 6.231 1.00 0.00 C ATOM 908 CG LEU A 58 29.970 69.759 7.468 1.00 0.00 C ATOM 909 CD1 LEU A 58 30.798 70.027 8.716 1.00 0.00 C ATOM 910 CD2 LEU A 58 28.538 70.245 7.650 1.00 0.00 C ATOM 0 H LEU A 58 29.095 72.406 6.281 1.00 0.00 H new ATOM 0 HA LEU A 58 31.781 71.917 7.240 1.00 0.00 H new ATOM 0 HB2 LEU A 58 29.905 70.364 5.411 1.00 0.00 H new ATOM 0 HB3 LEU A 58 31.472 69.781 5.937 1.00 0.00 H new ATOM 0 HG LEU A 58 29.936 68.681 7.308 1.00 0.00 H new ATOM 0 HD11 LEU A 58 30.317 69.565 9.578 1.00 0.00 H new ATOM 0 HD12 LEU A 58 31.795 69.606 8.589 1.00 0.00 H new ATOM 0 HD13 LEU A 58 30.876 71.102 8.877 1.00 0.00 H new ATOM 0 HD21 LEU A 58 28.104 69.775 8.533 1.00 0.00 H new ATOM 0 HD22 LEU A 58 28.534 71.328 7.776 1.00 0.00 H new ATOM 0 HD23 LEU A 58 27.950 69.980 6.772 1.00 0.00 H new ATOM 922 N SER A 59 33.031 71.618 4.919 1.00 0.00 N ATOM 923 CA SER A 59 33.847 71.849 3.733 1.00 0.00 C ATOM 924 C SER A 59 33.830 70.599 2.851 1.00 0.00 C ATOM 925 O SER A 59 34.137 69.504 3.318 1.00 0.00 O ATOM 926 CB SER A 59 35.278 72.195 4.153 1.00 0.00 C ATOM 927 OG SER A 59 35.279 73.255 5.095 1.00 0.00 O ATOM 0 H SER A 59 33.419 70.929 5.563 1.00 0.00 H new ATOM 0 HA SER A 59 33.441 72.685 3.163 1.00 0.00 H new ATOM 0 HB2 SER A 59 35.758 71.317 4.585 1.00 0.00 H new ATOM 0 HB3 SER A 59 35.861 72.479 3.277 1.00 0.00 H new ATOM 0 HG SER A 59 36.201 73.462 5.354 1.00 0.00 H new ATOM 933 N TYR A 60 33.465 70.765 1.584 1.00 0.00 N ATOM 934 CA TYR A 60 33.244 69.626 0.693 1.00 0.00 C ATOM 935 C TYR A 60 34.349 69.512 -0.358 1.00 0.00 C ATOM 936 O TYR A 60 34.627 70.470 -1.072 1.00 0.00 O ATOM 937 CB TYR A 60 31.888 69.765 -0.009 1.00 0.00 C ATOM 938 CG TYR A 60 30.698 69.874 0.926 1.00 0.00 C ATOM 939 CD1 TYR A 60 30.467 71.034 1.656 1.00 0.00 C ATOM 940 CD2 TYR A 60 29.797 68.826 1.065 1.00 0.00 C ATOM 941 CE1 TYR A 60 29.382 71.142 2.501 1.00 0.00 C ATOM 942 CE2 TYR A 60 28.704 68.930 1.907 1.00 0.00 C ATOM 943 CZ TYR A 60 28.504 70.090 2.622 1.00 0.00 C ATOM 944 OH TYR A 60 27.420 70.200 3.463 1.00 0.00 O ATOM 0 H TYR A 60 33.315 71.675 1.149 1.00 0.00 H new ATOM 0 HA TYR A 60 33.256 68.722 1.302 1.00 0.00 H new ATOM 0 HB2 TYR A 60 31.913 70.648 -0.647 1.00 0.00 H new ATOM 0 HB3 TYR A 60 31.742 68.904 -0.662 1.00 0.00 H new ATOM 0 HD1 TYR A 60 31.149 71.866 1.560 1.00 0.00 H new ATOM 0 HD2 TYR A 60 29.952 67.915 0.507 1.00 0.00 H new ATOM 0 HE1 TYR A 60 29.223 72.049 3.065 1.00 0.00 H new ATOM 0 HE2 TYR A 60 28.012 68.107 2.003 1.00 0.00 H new ATOM 0 HH TYR A 60 26.898 69.371 3.434 1.00 0.00 H new ATOM 954 N PHE A 61 34.967 68.336 -0.450 1.00 0.00 N ATOM 955 CA PHE A 61 36.018 68.080 -1.443 1.00 0.00 C ATOM 956 C PHE A 61 35.516 68.243 -2.877 1.00 0.00 C ATOM 957 O PHE A 61 34.343 67.997 -3.175 1.00 0.00 O ATOM 958 CB PHE A 61 36.590 66.672 -1.279 1.00 0.00 C ATOM 959 CG PHE A 61 37.729 66.588 -0.311 1.00 0.00 C ATOM 960 CD1 PHE A 61 38.980 67.071 -0.660 1.00 0.00 C ATOM 961 CD2 PHE A 61 37.558 66.019 0.936 1.00 0.00 C ATOM 962 CE1 PHE A 61 40.039 66.989 0.219 1.00 0.00 C ATOM 963 CE2 PHE A 61 38.613 65.936 1.820 1.00 0.00 C ATOM 964 CZ PHE A 61 39.856 66.422 1.462 1.00 0.00 C ATOM 0 H PHE A 61 34.759 67.540 0.152 1.00 0.00 H new ATOM 0 HA PHE A 61 36.795 68.823 -1.263 1.00 0.00 H new ATOM 0 HB2 PHE A 61 35.795 66.004 -0.948 1.00 0.00 H new ATOM 0 HB3 PHE A 61 36.925 66.311 -2.251 1.00 0.00 H new ATOM 0 HD1 PHE A 61 39.127 67.517 -1.632 1.00 0.00 H new ATOM 0 HD2 PHE A 61 36.589 65.636 1.221 1.00 0.00 H new ATOM 0 HE1 PHE A 61 41.009 67.368 -0.066 1.00 0.00 H new ATOM 0 HE2 PHE A 61 38.468 65.491 2.793 1.00 0.00 H new ATOM 0 HZ PHE A 61 40.682 66.358 2.155 1.00 0.00 H new ATOM 974 N LEU A 62 36.429 68.644 -3.758 1.00 0.00 N ATOM 975 CA LEU A 62 36.130 68.799 -5.175 1.00 0.00 C ATOM 976 C LEU A 62 37.038 67.900 -6.009 1.00 0.00 C ATOM 977 O LEU A 62 37.873 67.181 -5.467 1.00 0.00 O ATOM 978 CB LEU A 62 36.315 70.256 -5.602 1.00 0.00 C ATOM 979 CG LEU A 62 35.440 71.268 -4.867 1.00 0.00 C ATOM 980 CD1 LEU A 62 35.770 72.674 -5.326 1.00 0.00 C ATOM 981 CD2 LEU A 62 33.967 70.964 -5.094 1.00 0.00 C ATOM 0 H LEU A 62 37.392 68.869 -3.509 1.00 0.00 H new ATOM 0 HA LEU A 62 35.092 68.510 -5.341 1.00 0.00 H new ATOM 0 HB2 LEU A 62 37.360 70.530 -5.456 1.00 0.00 H new ATOM 0 HB3 LEU A 62 36.112 70.333 -6.670 1.00 0.00 H new ATOM 0 HG LEU A 62 35.643 71.194 -3.799 1.00 0.00 H new ATOM 0 HD11 LEU A 62 35.140 73.387 -4.795 1.00 0.00 H new ATOM 0 HD12 LEU A 62 36.818 72.889 -5.116 1.00 0.00 H new ATOM 0 HD13 LEU A 62 35.590 72.758 -6.398 1.00 0.00 H new ATOM 0 HD21 LEU A 62 33.358 71.696 -4.563 1.00 0.00 H new ATOM 0 HD22 LEU A 62 33.745 71.013 -6.160 1.00 0.00 H new ATOM 0 HD23 LEU A 62 33.740 69.965 -4.722 1.00 0.00 H new ATOM 993 N GLY A 63 36.887 67.958 -7.327 1.00 0.00 N ATOM 994 CA GLY A 63 37.646 67.080 -8.201 1.00 0.00 C ATOM 995 C GLY A 63 39.060 67.561 -8.493 1.00 0.00 C ATOM 996 O GLY A 63 39.896 66.775 -8.934 1.00 0.00 O ATOM 0 H GLY A 63 36.253 68.597 -7.807 1.00 0.00 H new ATOM 0 HA2 GLY A 63 37.697 66.090 -7.747 1.00 0.00 H new ATOM 0 HA3 GLY A 63 37.109 66.971 -9.143 1.00 0.00 H new ATOM 1000 N LEU A 64 39.338 68.840 -8.258 1.00 0.00 N ATOM 1001 CA LEU A 64 40.669 69.382 -8.530 1.00 0.00 C ATOM 1002 C LEU A 64 41.673 68.863 -7.511 1.00 0.00 C ATOM 1003 O LEU A 64 41.504 69.061 -6.305 1.00 0.00 O ATOM 1004 CB LEU A 64 40.663 70.913 -8.496 1.00 0.00 C ATOM 1005 CG LEU A 64 39.960 71.611 -9.660 1.00 0.00 C ATOM 1006 CD1 LEU A 64 39.877 73.105 -9.400 1.00 0.00 C ATOM 1007 CD2 LEU A 64 40.691 71.342 -10.965 1.00 0.00 C ATOM 0 H LEU A 64 38.670 69.515 -7.885 1.00 0.00 H new ATOM 0 HA LEU A 64 40.958 69.054 -9.529 1.00 0.00 H new ATOM 0 HB2 LEU A 64 40.189 71.233 -7.568 1.00 0.00 H new ATOM 0 HB3 LEU A 64 41.696 71.259 -8.463 1.00 0.00 H new ATOM 0 HG LEU A 64 38.949 71.212 -9.744 1.00 0.00 H new ATOM 0 HD11 LEU A 64 39.374 73.592 -10.235 1.00 0.00 H new ATOM 0 HD12 LEU A 64 39.315 73.284 -8.484 1.00 0.00 H new ATOM 0 HD13 LEU A 64 40.882 73.512 -9.294 1.00 0.00 H new ATOM 0 HD21 LEU A 64 40.175 71.847 -11.782 1.00 0.00 H new ATOM 0 HD22 LEU A 64 41.712 71.716 -10.894 1.00 0.00 H new ATOM 0 HD23 LEU A 64 40.710 70.269 -11.157 1.00 0.00 H new ATOM 1019 N ARG A 65 42.714 68.195 -7.988 1.00 0.00 N ATOM 1020 CA ARG A 65 43.721 67.655 -7.085 1.00 0.00 C ATOM 1021 C ARG A 65 45.135 68.046 -7.495 1.00 0.00 C ATOM 1022 O ARG A 65 45.397 68.420 -8.647 1.00 0.00 O ATOM 1023 CB ARG A 65 43.630 66.134 -7.007 1.00 0.00 C ATOM 1024 CG ARG A 65 44.040 65.429 -8.287 1.00 0.00 C ATOM 1025 CD ARG A 65 44.359 63.963 -8.038 1.00 0.00 C ATOM 1026 NE ARG A 65 45.630 63.790 -7.330 1.00 0.00 N ATOM 1027 CZ ARG A 65 45.752 63.594 -6.018 1.00 0.00 C ATOM 1028 NH1 ARG A 65 44.683 63.587 -5.231 1.00 0.00 N ATOM 1029 NH2 ARG A 65 46.958 63.415 -5.499 1.00 0.00 N ATOM 0 H ARG A 65 42.883 68.016 -8.978 1.00 0.00 H new ATOM 0 HA ARG A 65 43.514 68.087 -6.106 1.00 0.00 H new ATOM 0 HB2 ARG A 65 44.262 65.783 -6.191 1.00 0.00 H new ATOM 0 HB3 ARG A 65 42.606 65.853 -6.760 1.00 0.00 H new ATOM 0 HG2 ARG A 65 43.238 65.508 -9.020 1.00 0.00 H new ATOM 0 HG3 ARG A 65 44.912 65.925 -8.714 1.00 0.00 H new ATOM 0 HD2 ARG A 65 43.556 63.511 -7.456 1.00 0.00 H new ATOM 0 HD3 ARG A 65 44.400 63.434 -8.990 1.00 0.00 H new ATOM 0 HE ARG A 65 46.486 63.822 -7.884 1.00 0.00 H new ATOM 0 HH11 ARG A 65 43.755 63.733 -5.629 1.00 0.00 H new ATOM 0 HH12 ARG A 65 44.789 63.436 -4.228 1.00 0.00 H new ATOM 0 HH21 ARG A 65 47.780 63.428 -6.103 1.00 0.00 H new ATOM 0 HH22 ARG A 65 47.064 63.264 -4.496 1.00 0.00 H new ATOM 1043 N ASP A 66 46.034 67.917 -6.536 1.00 0.00 N ATOM 1044 CA ASP A 66 47.451 68.183 -6.727 1.00 0.00 C ATOM 1045 C ASP A 66 48.272 67.077 -6.079 1.00 0.00 C ATOM 1046 O ASP A 66 47.826 66.450 -5.119 1.00 0.00 O ATOM 1047 CB ASP A 66 47.836 69.539 -6.120 1.00 0.00 C ATOM 1048 CG ASP A 66 49.319 69.645 -5.823 1.00 0.00 C ATOM 1049 OD1 ASP A 66 50.114 69.626 -6.778 1.00 0.00 O ATOM 1050 OD2 ASP A 66 49.697 69.707 -4.632 1.00 0.00 O ATOM 0 H ASP A 66 45.798 67.620 -5.589 1.00 0.00 H new ATOM 0 HA ASP A 66 47.658 68.212 -7.797 1.00 0.00 H new ATOM 0 HB2 ASP A 66 47.549 70.335 -6.807 1.00 0.00 H new ATOM 0 HB3 ASP A 66 47.273 69.694 -5.200 1.00 0.00 H new ATOM 1055 N GLU A 67 49.457 66.830 -6.616 1.00 0.00 N ATOM 1056 CA GLU A 67 50.357 65.845 -6.044 1.00 0.00 C ATOM 1057 C GLU A 67 51.582 66.539 -5.460 1.00 0.00 C ATOM 1058 O GLU A 67 52.116 66.110 -4.439 1.00 0.00 O ATOM 1059 CB GLU A 67 50.811 64.802 -7.082 1.00 0.00 C ATOM 1060 CG GLU A 67 50.169 64.929 -8.460 1.00 0.00 C ATOM 1061 CD GLU A 67 48.689 64.595 -8.471 1.00 0.00 C ATOM 1062 OE1 GLU A 67 48.295 63.607 -7.825 1.00 0.00 O ATOM 1063 OE2 GLU A 67 47.915 65.323 -9.133 1.00 0.00 O ATOM 0 H GLU A 67 49.816 67.299 -7.447 1.00 0.00 H new ATOM 0 HA GLU A 67 49.809 65.322 -5.260 1.00 0.00 H new ATOM 0 HB2 GLU A 67 51.893 64.874 -7.196 1.00 0.00 H new ATOM 0 HB3 GLU A 67 50.597 63.807 -6.690 1.00 0.00 H new ATOM 0 HG2 GLU A 67 50.306 65.947 -8.824 1.00 0.00 H new ATOM 0 HG3 GLU A 67 50.687 64.269 -9.156 1.00 0.00 H new ATOM 1070 N ASN A 68 52.004 67.635 -6.087 1.00 0.00 N ATOM 1071 CA ASN A 68 53.252 68.284 -5.717 1.00 0.00 C ATOM 1072 C ASN A 68 53.301 69.723 -6.229 1.00 0.00 C ATOM 1073 O ASN A 68 54.015 70.015 -7.191 1.00 0.00 O ATOM 1074 CB ASN A 68 54.436 67.502 -6.295 1.00 0.00 C ATOM 1075 CG ASN A 68 55.769 67.924 -5.704 1.00 0.00 C ATOM 1076 OD1 ASN A 68 56.246 67.345 -4.731 1.00 0.00 O ATOM 1077 ND2 ASN A 68 56.371 68.947 -6.286 1.00 0.00 N ATOM 0 H ASN A 68 51.500 68.088 -6.850 1.00 0.00 H new ATOM 0 HA ASN A 68 53.312 68.301 -4.629 1.00 0.00 H new ATOM 0 HB2 ASN A 68 54.285 66.438 -6.114 1.00 0.00 H new ATOM 0 HB3 ASN A 68 54.463 67.641 -7.376 1.00 0.00 H new ATOM 0 HD21 ASN A 68 57.265 69.283 -5.929 1.00 0.00 H new ATOM 0 HD22 ASN A 68 55.941 69.400 -7.092 1.00 0.00 H new ATOM 1084 N ALA A 69 52.501 70.601 -5.621 1.00 0.00 N ATOM 1085 CA ALA A 69 52.532 72.037 -5.930 1.00 0.00 C ATOM 1086 C ALA A 69 52.333 72.292 -7.426 1.00 0.00 C ATOM 1087 O ALA A 69 52.923 73.210 -7.998 1.00 0.00 O ATOM 1088 CB ALA A 69 53.845 72.648 -5.454 1.00 0.00 C ATOM 0 H ALA A 69 51.819 70.343 -4.907 1.00 0.00 H new ATOM 0 HA ALA A 69 51.706 72.514 -5.401 1.00 0.00 H new ATOM 0 HB1 ALA A 69 53.857 73.712 -5.688 1.00 0.00 H new ATOM 0 HB2 ALA A 69 53.940 72.512 -4.377 1.00 0.00 H new ATOM 0 HB3 ALA A 69 54.678 72.157 -5.956 1.00 0.00 H new ATOM 1094 N LYS A 70 51.487 71.479 -8.040 1.00 0.00 N ATOM 1095 CA LYS A 70 51.234 71.549 -9.471 1.00 0.00 C ATOM 1096 C LYS A 70 50.614 72.886 -9.863 1.00 0.00 C ATOM 1097 O LYS A 70 49.610 73.307 -9.291 1.00 0.00 O ATOM 1098 CB LYS A 70 50.281 70.429 -9.886 1.00 0.00 C ATOM 1099 CG LYS A 70 50.796 69.026 -9.610 1.00 0.00 C ATOM 1100 CD LYS A 70 49.646 68.033 -9.562 1.00 0.00 C ATOM 1101 CE LYS A 70 48.734 68.136 -10.770 1.00 0.00 C ATOM 1102 NZ LYS A 70 47.433 67.458 -10.525 1.00 0.00 N ATOM 0 H LYS A 70 50.956 70.752 -7.560 1.00 0.00 H new ATOM 0 HA LYS A 70 52.192 71.442 -9.980 1.00 0.00 H new ATOM 0 HB2 LYS A 70 49.334 70.564 -9.364 1.00 0.00 H new ATOM 0 HB3 LYS A 70 50.073 70.523 -10.952 1.00 0.00 H new ATOM 0 HG2 LYS A 70 51.504 68.734 -10.386 1.00 0.00 H new ATOM 0 HG3 LYS A 70 51.336 69.011 -8.663 1.00 0.00 H new ATOM 0 HD2 LYS A 70 50.047 67.021 -9.500 1.00 0.00 H new ATOM 0 HD3 LYS A 70 49.063 68.201 -8.656 1.00 0.00 H new ATOM 0 HE2 LYS A 70 48.560 69.185 -11.009 1.00 0.00 H new ATOM 0 HE3 LYS A 70 49.222 67.689 -11.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 46.858 67.487 -11.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 47.603 66.468 -10.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 46.927 67.944 -9.758 1.00 0.00 H new ATOM 1116 N GLY A 71 51.213 73.543 -10.844 1.00 0.00 N ATOM 1117 CA GLY A 71 50.609 74.735 -11.404 1.00 0.00 C ATOM 1118 C GLY A 71 49.481 74.382 -12.350 1.00 0.00 C ATOM 1119 O GLY A 71 48.671 75.230 -12.719 1.00 0.00 O ATOM 0 H GLY A 71 52.104 73.274 -11.262 1.00 0.00 H new ATOM 0 HA2 GLY A 71 50.230 75.366 -10.600 1.00 0.00 H new ATOM 0 HA3 GLY A 71 51.365 75.314 -11.934 1.00 0.00 H new ATOM 1123 N GLN A 72 49.434 73.115 -12.738 1.00 0.00 N ATOM 1124 CA GLN A 72 48.395 72.616 -13.622 1.00 0.00 C ATOM 1125 C GLN A 72 47.420 71.732 -12.846 1.00 0.00 C ATOM 1126 O GLN A 72 47.780 70.659 -12.355 1.00 0.00 O ATOM 1127 CB GLN A 72 49.016 71.839 -14.790 1.00 0.00 C ATOM 1128 CG GLN A 72 49.971 70.736 -14.354 1.00 0.00 C ATOM 1129 CD GLN A 72 50.585 69.984 -15.519 1.00 0.00 C ATOM 1130 OE1 GLN A 72 49.857 69.888 -16.621 1.00 0.00 O flip ATOM 1131 NE2 GLN A 72 51.704 69.491 -15.426 1.00 0.00 N flip ATOM 0 H GLN A 72 50.112 72.409 -12.450 1.00 0.00 H new ATOM 0 HA GLN A 72 47.844 73.464 -14.028 1.00 0.00 H new ATOM 0 HB2 GLN A 72 48.217 71.400 -15.388 1.00 0.00 H new ATOM 0 HB3 GLN A 72 49.551 72.536 -15.435 1.00 0.00 H new ATOM 0 HG2 GLN A 72 50.767 71.171 -13.750 1.00 0.00 H new ATOM 0 HG3 GLN A 72 49.436 70.032 -13.716 1.00 0.00 H new ATOM 0 HE21 GLN A 72 52.233 69.587 -14.559 1.00 0.00 H new ATOM 0 HE22 GLN A 72 52.106 68.985 -16.215 1.00 0.00 H new ATOM 1140 N TRP A 73 46.190 72.193 -12.723 1.00 0.00 N ATOM 1141 CA TRP A 73 45.174 71.461 -11.985 1.00 0.00 C ATOM 1142 C TRP A 73 44.273 70.682 -12.934 1.00 0.00 C ATOM 1143 O TRP A 73 44.190 70.991 -14.122 1.00 0.00 O ATOM 1144 CB TRP A 73 44.339 72.420 -11.136 1.00 0.00 C ATOM 1145 CG TRP A 73 45.101 73.032 -10.000 1.00 0.00 C ATOM 1146 CD1 TRP A 73 46.111 73.949 -10.082 1.00 0.00 C ATOM 1147 CD2 TRP A 73 44.906 72.775 -8.605 1.00 0.00 C ATOM 1148 NE1 TRP A 73 46.561 74.266 -8.825 1.00 0.00 N ATOM 1149 CE2 TRP A 73 45.836 73.562 -7.901 1.00 0.00 C ATOM 1150 CE3 TRP A 73 44.035 71.953 -7.882 1.00 0.00 C ATOM 1151 CZ2 TRP A 73 45.920 73.553 -6.512 1.00 0.00 C ATOM 1152 CZ3 TRP A 73 44.120 71.946 -6.504 1.00 0.00 C ATOM 1153 CH2 TRP A 73 45.056 72.741 -5.832 1.00 0.00 C ATOM 0 H TRP A 73 45.868 73.073 -13.125 1.00 0.00 H new ATOM 0 HA TRP A 73 45.676 70.752 -11.326 1.00 0.00 H new ATOM 0 HB2 TRP A 73 43.953 73.215 -11.774 1.00 0.00 H new ATOM 0 HB3 TRP A 73 43.477 71.884 -10.738 1.00 0.00 H new ATOM 0 HD1 TRP A 73 46.498 74.363 -11.001 1.00 0.00 H new ATOM 0 HE1 TRP A 73 47.314 74.920 -8.613 1.00 0.00 H new ATOM 0 HE3 TRP A 73 43.310 71.336 -8.392 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 46.641 74.165 -5.991 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 43.453 71.316 -5.935 1.00 0.00 H new ATOM 0 HH2 TRP A 73 45.096 72.712 -4.753 1.00 0.00 H new ATOM 1164 N ARG A 74 43.617 69.664 -12.404 1.00 0.00 N ATOM 1165 CA ARG A 74 42.670 68.875 -13.174 1.00 0.00 C ATOM 1166 C ARG A 74 41.618 68.294 -12.244 1.00 0.00 C ATOM 1167 O ARG A 74 41.900 68.034 -11.067 1.00 0.00 O ATOM 1168 CB ARG A 74 43.369 67.733 -13.924 1.00 0.00 C ATOM 1169 CG ARG A 74 42.400 66.888 -14.738 1.00 0.00 C ATOM 1170 CD ARG A 74 42.946 65.505 -15.036 1.00 0.00 C ATOM 1171 NE ARG A 74 41.890 64.493 -14.958 1.00 0.00 N ATOM 1172 CZ ARG A 74 41.654 63.570 -15.892 1.00 0.00 C ATOM 1173 NH1 ARG A 74 42.382 63.541 -17.003 1.00 0.00 N ATOM 1174 NH2 ARG A 74 40.683 62.682 -15.714 1.00 0.00 N ATOM 0 H ARG A 74 43.724 69.362 -11.435 1.00 0.00 H new ATOM 0 HA ARG A 74 42.203 69.531 -13.909 1.00 0.00 H new ATOM 0 HB2 ARG A 74 44.128 68.149 -14.587 1.00 0.00 H new ATOM 0 HB3 ARG A 74 43.887 67.096 -13.207 1.00 0.00 H new ATOM 0 HG2 ARG A 74 41.459 66.795 -14.195 1.00 0.00 H new ATOM 0 HG3 ARG A 74 42.178 67.397 -15.676 1.00 0.00 H new ATOM 0 HD2 ARG A 74 43.392 65.493 -16.030 1.00 0.00 H new ATOM 0 HD3 ARG A 74 43.739 65.263 -14.328 1.00 0.00 H new ATOM 0 HE ARG A 74 41.293 64.494 -14.131 1.00 0.00 H new ATOM 0 HH11 ARG A 74 43.124 64.226 -17.144 1.00 0.00 H new ATOM 0 HH12 ARG A 74 42.198 62.834 -17.715 1.00 0.00 H new ATOM 0 HH21 ARG A 74 40.119 62.706 -14.864 1.00 0.00 H new ATOM 0 HH22 ARG A 74 40.501 61.976 -16.427 1.00 0.00 H new ATOM 1188 N TRP A 75 40.412 68.112 -12.767 1.00 0.00 N ATOM 1189 CA TRP A 75 39.340 67.479 -12.021 1.00 0.00 C ATOM 1190 C TRP A 75 39.477 65.957 -12.109 1.00 0.00 C ATOM 1191 O TRP A 75 40.446 65.446 -12.677 1.00 0.00 O ATOM 1192 CB TRP A 75 37.983 67.926 -12.562 1.00 0.00 C ATOM 1193 CG TRP A 75 37.755 69.413 -12.507 1.00 0.00 C ATOM 1194 CD1 TRP A 75 38.038 70.320 -13.487 1.00 0.00 C ATOM 1195 CD2 TRP A 75 37.196 70.164 -11.420 1.00 0.00 C ATOM 1196 NE1 TRP A 75 37.674 71.582 -13.086 1.00 0.00 N ATOM 1197 CE2 TRP A 75 37.160 71.515 -11.820 1.00 0.00 C ATOM 1198 CE3 TRP A 75 36.720 69.830 -10.150 1.00 0.00 C ATOM 1199 CZ2 TRP A 75 36.668 72.525 -10.997 1.00 0.00 C ATOM 1200 CZ3 TRP A 75 36.233 70.834 -9.333 1.00 0.00 C ATOM 1201 CH2 TRP A 75 36.209 72.167 -9.760 1.00 0.00 C ATOM 0 H TRP A 75 40.154 68.397 -13.712 1.00 0.00 H new ATOM 0 HA TRP A 75 39.408 67.779 -10.975 1.00 0.00 H new ATOM 0 HB2 TRP A 75 37.889 67.594 -13.596 1.00 0.00 H new ATOM 0 HB3 TRP A 75 37.197 67.428 -11.995 1.00 0.00 H new ATOM 0 HD1 TRP A 75 38.484 70.080 -14.441 1.00 0.00 H new ATOM 0 HE1 TRP A 75 37.771 72.432 -13.642 1.00 0.00 H new ATOM 0 HE3 TRP A 75 36.732 68.804 -9.812 1.00 0.00 H new ATOM 0 HZ2 TRP A 75 36.650 73.554 -11.324 1.00 0.00 H new ATOM 0 HZ3 TRP A 75 35.865 70.585 -8.349 1.00 0.00 H new ATOM 0 HH2 TRP A 75 35.820 72.928 -9.099 1.00 0.00 H new ATOM 1212 N VAL A 76 38.508 65.233 -11.568 1.00 0.00 N ATOM 1213 CA VAL A 76 38.605 63.780 -11.497 1.00 0.00 C ATOM 1214 C VAL A 76 38.201 63.115 -12.811 1.00 0.00 C ATOM 1215 O VAL A 76 39.035 62.497 -13.473 1.00 0.00 O ATOM 1216 CB VAL A 76 37.739 63.199 -10.363 1.00 0.00 C ATOM 1217 CG1 VAL A 76 37.975 61.707 -10.232 1.00 0.00 C ATOM 1218 CG2 VAL A 76 38.027 63.897 -9.049 1.00 0.00 C ATOM 0 H VAL A 76 37.652 65.623 -11.174 1.00 0.00 H new ATOM 0 HA VAL A 76 39.654 63.564 -11.294 1.00 0.00 H new ATOM 0 HB VAL A 76 36.692 63.368 -10.614 1.00 0.00 H new ATOM 0 HG11 VAL A 76 37.357 61.310 -9.427 1.00 0.00 H new ATOM 0 HG12 VAL A 76 37.713 61.214 -11.168 1.00 0.00 H new ATOM 0 HG13 VAL A 76 39.026 61.523 -10.007 1.00 0.00 H new ATOM 0 HG21 VAL A 76 37.403 63.468 -8.265 1.00 0.00 H new ATOM 0 HG22 VAL A 76 39.077 63.765 -8.789 1.00 0.00 H new ATOM 0 HG23 VAL A 76 37.808 64.960 -9.146 1.00 0.00 H new ATOM 1228 N ASP A 77 36.925 63.259 -13.179 1.00 0.00 N ATOM 1229 CA ASP A 77 36.352 62.556 -14.336 1.00 0.00 C ATOM 1230 C ASP A 77 37.190 62.725 -15.604 1.00 0.00 C ATOM 1231 O ASP A 77 37.930 61.819 -15.993 1.00 0.00 O ATOM 1232 CB ASP A 77 34.901 63.006 -14.586 1.00 0.00 C ATOM 1233 CG ASP A 77 34.679 64.501 -14.390 1.00 0.00 C ATOM 1234 OD1 ASP A 77 35.223 65.308 -15.178 1.00 0.00 O ATOM 1235 OD2 ASP A 77 33.970 64.870 -13.434 1.00 0.00 O ATOM 0 H ASP A 77 36.262 63.861 -12.690 1.00 0.00 H new ATOM 0 HA ASP A 77 36.358 61.494 -14.090 1.00 0.00 H new ATOM 0 HB2 ASP A 77 34.617 62.736 -15.603 1.00 0.00 H new ATOM 0 HB3 ASP A 77 34.240 62.459 -13.914 1.00 0.00 H new ATOM 1240 N GLN A 78 37.069 63.872 -16.239 1.00 0.00 N ATOM 1241 CA GLN A 78 37.823 64.170 -17.446 1.00 0.00 C ATOM 1242 C GLN A 78 38.003 65.671 -17.583 1.00 0.00 C ATOM 1243 O GLN A 78 38.870 66.137 -18.321 1.00 0.00 O ATOM 1244 CB GLN A 78 37.107 63.605 -18.682 1.00 0.00 C ATOM 1245 CG GLN A 78 35.740 64.227 -18.959 1.00 0.00 C ATOM 1246 CD GLN A 78 35.758 65.205 -20.122 1.00 0.00 C ATOM 1247 OE1 GLN A 78 35.996 66.479 -19.839 1.00 0.00 O flip ATOM 1248 NE2 GLN A 78 35.551 64.821 -21.270 1.00 0.00 N flip ATOM 0 H GLN A 78 36.449 64.623 -15.937 1.00 0.00 H new ATOM 0 HA GLN A 78 38.803 63.699 -17.373 1.00 0.00 H new ATOM 0 HB2 GLN A 78 37.743 63.753 -19.555 1.00 0.00 H new ATOM 0 HB3 GLN A 78 36.984 62.529 -18.556 1.00 0.00 H new ATOM 0 HG2 GLN A 78 35.022 63.434 -19.169 1.00 0.00 H new ATOM 0 HG3 GLN A 78 35.393 64.742 -18.063 1.00 0.00 H new ATOM 0 HE21 GLN A 78 35.371 63.834 -21.453 1.00 0.00 H new ATOM 0 HE22 GLN A 78 35.559 65.489 -22.041 1.00 0.00 H new ATOM 1257 N THR A 79 37.174 66.417 -16.859 1.00 0.00 N ATOM 1258 CA THR A 79 37.157 67.866 -16.939 1.00 0.00 C ATOM 1259 C THR A 79 38.529 68.471 -16.626 1.00 0.00 C ATOM 1260 O THR A 79 39.079 68.277 -15.538 1.00 0.00 O ATOM 1261 CB THR A 79 36.101 68.446 -15.980 1.00 0.00 C ATOM 1262 OG1 THR A 79 34.859 67.751 -16.155 1.00 0.00 O ATOM 1263 CG2 THR A 79 35.884 69.931 -16.237 1.00 0.00 C ATOM 0 H THR A 79 36.497 66.030 -16.202 1.00 0.00 H new ATOM 0 HA THR A 79 36.899 68.130 -17.965 1.00 0.00 H new ATOM 0 HB THR A 79 36.462 68.319 -14.959 1.00 0.00 H new ATOM 0 HG1 THR A 79 34.839 66.964 -15.571 1.00 0.00 H new ATOM 0 HG21 THR A 79 35.133 70.314 -15.546 1.00 0.00 H new ATOM 0 HG22 THR A 79 36.821 70.467 -16.088 1.00 0.00 H new ATOM 0 HG23 THR A 79 35.542 70.077 -17.262 1.00 0.00 H new ATOM 1271 N PRO A 80 39.111 69.174 -17.606 1.00 0.00 N ATOM 1272 CA PRO A 80 40.347 69.934 -17.417 1.00 0.00 C ATOM 1273 C PRO A 80 40.116 71.175 -16.561 1.00 0.00 C ATOM 1274 O PRO A 80 38.972 71.528 -16.269 1.00 0.00 O ATOM 1275 CB PRO A 80 40.743 70.334 -18.841 1.00 0.00 C ATOM 1276 CG PRO A 80 39.462 70.330 -19.606 1.00 0.00 C ATOM 1277 CD PRO A 80 38.612 69.260 -18.991 1.00 0.00 C ATOM 0 HA PRO A 80 41.113 69.357 -16.900 1.00 0.00 H new ATOM 0 HB2 PRO A 80 41.212 71.318 -18.860 1.00 0.00 H new ATOM 0 HB3 PRO A 80 41.460 69.631 -19.265 1.00 0.00 H new ATOM 0 HG2 PRO A 80 38.970 71.301 -19.546 1.00 0.00 H new ATOM 0 HG3 PRO A 80 39.640 70.127 -20.662 1.00 0.00 H new ATOM 0 HD2 PRO A 80 37.554 69.522 -19.021 1.00 0.00 H new ATOM 0 HD3 PRO A 80 38.720 68.311 -19.516 1.00 0.00 H new ATOM 1285 N PHE A 81 41.198 71.825 -16.148 1.00 0.00 N ATOM 1286 CA PHE A 81 41.092 73.048 -15.364 1.00 0.00 C ATOM 1287 C PHE A 81 40.347 74.114 -16.159 1.00 0.00 C ATOM 1288 O PHE A 81 40.577 74.290 -17.356 1.00 0.00 O ATOM 1289 CB PHE A 81 42.478 73.549 -14.956 1.00 0.00 C ATOM 1290 CG PHE A 81 42.445 74.750 -14.051 1.00 0.00 C ATOM 1291 CD1 PHE A 81 42.070 74.618 -12.724 1.00 0.00 C ATOM 1292 CD2 PHE A 81 42.786 76.008 -14.526 1.00 0.00 C ATOM 1293 CE1 PHE A 81 42.034 75.715 -11.887 1.00 0.00 C ATOM 1294 CE2 PHE A 81 42.752 77.109 -13.692 1.00 0.00 C ATOM 1295 CZ PHE A 81 42.376 76.963 -12.371 1.00 0.00 C ATOM 0 H PHE A 81 42.154 71.527 -16.342 1.00 0.00 H new ATOM 0 HA PHE A 81 40.530 72.833 -14.455 1.00 0.00 H new ATOM 0 HB2 PHE A 81 43.013 72.742 -14.455 1.00 0.00 H new ATOM 0 HB3 PHE A 81 43.044 73.797 -15.854 1.00 0.00 H new ATOM 0 HD1 PHE A 81 41.803 73.645 -12.340 1.00 0.00 H new ATOM 0 HD2 PHE A 81 43.081 76.128 -15.558 1.00 0.00 H new ATOM 0 HE1 PHE A 81 41.739 75.598 -10.855 1.00 0.00 H new ATOM 0 HE2 PHE A 81 43.019 78.084 -14.073 1.00 0.00 H new ATOM 0 HZ PHE A 81 42.349 77.823 -11.718 1.00 0.00 H new ATOM 1305 N ASN A 82 39.457 74.819 -15.485 1.00 0.00 N ATOM 1306 CA ASN A 82 38.558 75.750 -16.149 1.00 0.00 C ATOM 1307 C ASN A 82 39.098 77.174 -16.069 1.00 0.00 C ATOM 1308 O ASN A 82 39.270 77.715 -14.979 1.00 0.00 O ATOM 1309 CB ASN A 82 37.179 75.655 -15.497 1.00 0.00 C ATOM 1310 CG ASN A 82 36.060 76.159 -16.382 1.00 0.00 C ATOM 1311 OD1 ASN A 82 36.205 77.135 -17.121 1.00 0.00 O ATOM 1312 ND2 ASN A 82 34.931 75.477 -16.313 1.00 0.00 N ATOM 0 H ASN A 82 39.336 74.765 -14.474 1.00 0.00 H new ATOM 0 HA ASN A 82 38.479 75.489 -17.204 1.00 0.00 H new ATOM 0 HB2 ASN A 82 36.982 74.617 -15.231 1.00 0.00 H new ATOM 0 HB3 ASN A 82 37.184 76.227 -14.569 1.00 0.00 H new ATOM 0 HD21 ASN A 82 34.133 75.752 -16.886 1.00 0.00 H new ATOM 0 HD22 ASN A 82 34.857 74.675 -15.687 1.00 0.00 H new ATOM 1319 N PRO A 83 39.372 77.795 -17.231 1.00 0.00 N ATOM 1320 CA PRO A 83 39.974 79.136 -17.309 1.00 0.00 C ATOM 1321 C PRO A 83 39.145 80.228 -16.628 1.00 0.00 C ATOM 1322 O PRO A 83 39.683 81.044 -15.881 1.00 0.00 O ATOM 1323 CB PRO A 83 40.070 79.408 -18.817 1.00 0.00 C ATOM 1324 CG PRO A 83 39.139 78.434 -19.456 1.00 0.00 C ATOM 1325 CD PRO A 83 39.133 77.226 -18.567 1.00 0.00 C ATOM 0 HA PRO A 83 40.931 79.158 -16.787 1.00 0.00 H new ATOM 0 HB2 PRO A 83 39.785 80.434 -19.050 1.00 0.00 H new ATOM 0 HB3 PRO A 83 41.090 79.271 -19.177 1.00 0.00 H new ATOM 0 HG2 PRO A 83 38.138 78.855 -19.550 1.00 0.00 H new ATOM 0 HG3 PRO A 83 39.472 78.177 -20.461 1.00 0.00 H new ATOM 0 HD2 PRO A 83 38.182 76.695 -18.615 1.00 0.00 H new ATOM 0 HD3 PRO A 83 39.910 76.515 -18.847 1.00 0.00 H new ATOM 1333 N ARG A 84 37.841 80.252 -16.889 1.00 0.00 N ATOM 1334 CA ARG A 84 36.982 81.295 -16.336 1.00 0.00 C ATOM 1335 C ARG A 84 36.492 80.951 -14.939 1.00 0.00 C ATOM 1336 O ARG A 84 36.281 81.836 -14.113 1.00 0.00 O ATOM 1337 CB ARG A 84 35.785 81.565 -17.240 1.00 0.00 C ATOM 1338 CG ARG A 84 36.098 82.495 -18.394 1.00 0.00 C ATOM 1339 CD ARG A 84 34.833 83.159 -18.898 1.00 0.00 C ATOM 1340 NE ARG A 84 35.111 84.187 -19.896 1.00 0.00 N ATOM 1341 CZ ARG A 84 34.500 85.371 -19.933 1.00 0.00 C ATOM 1342 NH1 ARG A 84 33.540 85.664 -19.062 1.00 0.00 N ATOM 1343 NH2 ARG A 84 34.843 86.262 -20.852 1.00 0.00 N ATOM 0 H ARG A 84 37.360 79.569 -17.474 1.00 0.00 H new ATOM 0 HA ARG A 84 37.594 82.195 -16.274 1.00 0.00 H new ATOM 0 HB2 ARG A 84 35.418 80.618 -17.636 1.00 0.00 H new ATOM 0 HB3 ARG A 84 34.980 81.995 -16.645 1.00 0.00 H new ATOM 0 HG2 ARG A 84 36.812 83.254 -18.074 1.00 0.00 H new ATOM 0 HG3 ARG A 84 36.569 81.936 -19.202 1.00 0.00 H new ATOM 0 HD2 ARG A 84 34.175 82.404 -19.329 1.00 0.00 H new ATOM 0 HD3 ARG A 84 34.299 83.605 -18.059 1.00 0.00 H new ATOM 0 HE ARG A 84 35.814 83.988 -20.607 1.00 0.00 H new ATOM 0 HH11 ARG A 84 33.265 84.980 -18.357 1.00 0.00 H new ATOM 0 HH12 ARG A 84 33.078 86.573 -19.098 1.00 0.00 H new ATOM 0 HH21 ARG A 84 35.573 86.041 -21.529 1.00 0.00 H new ATOM 0 HH22 ARG A 84 34.377 87.169 -20.882 1.00 0.00 H new ATOM 1357 N ARG A 85 36.313 79.670 -14.669 1.00 0.00 N ATOM 1358 CA ARG A 85 35.770 79.253 -13.387 1.00 0.00 C ATOM 1359 C ARG A 85 36.897 78.982 -12.405 1.00 0.00 C ATOM 1360 O ARG A 85 37.305 77.843 -12.202 1.00 0.00 O ATOM 1361 CB ARG A 85 34.847 78.034 -13.532 1.00 0.00 C ATOM 1362 CG ARG A 85 33.532 78.350 -14.239 1.00 0.00 C ATOM 1363 CD ARG A 85 33.732 78.579 -15.730 1.00 0.00 C ATOM 1364 NE ARG A 85 32.760 79.513 -16.292 1.00 0.00 N ATOM 1365 CZ ARG A 85 32.498 79.626 -17.593 1.00 0.00 C ATOM 1366 NH1 ARG A 85 33.089 78.815 -18.469 1.00 0.00 N ATOM 1367 NH2 ARG A 85 31.651 80.554 -18.015 1.00 0.00 N ATOM 0 H ARG A 85 36.532 78.908 -15.311 1.00 0.00 H new ATOM 0 HA ARG A 85 35.159 80.066 -12.995 1.00 0.00 H new ATOM 0 HB2 ARG A 85 35.371 77.255 -14.086 1.00 0.00 H new ATOM 0 HB3 ARG A 85 34.631 77.631 -12.542 1.00 0.00 H new ATOM 0 HG2 ARG A 85 32.832 77.528 -14.088 1.00 0.00 H new ATOM 0 HG3 ARG A 85 33.083 79.237 -13.792 1.00 0.00 H new ATOM 0 HD2 ARG A 85 34.738 78.960 -15.903 1.00 0.00 H new ATOM 0 HD3 ARG A 85 33.658 77.626 -16.253 1.00 0.00 H new ATOM 0 HE ARG A 85 32.250 80.117 -15.648 1.00 0.00 H new ATOM 0 HH11 ARG A 85 33.745 78.104 -18.144 1.00 0.00 H new ATOM 0 HH12 ARG A 85 32.886 78.905 -19.465 1.00 0.00 H new ATOM 0 HH21 ARG A 85 31.203 81.178 -17.344 1.00 0.00 H new ATOM 0 HH22 ARG A 85 31.448 80.644 -19.010 1.00 0.00 H new ATOM 1381 N VAL A 86 37.415 80.063 -11.838 1.00 0.00 N ATOM 1382 CA VAL A 86 38.505 80.003 -10.876 1.00 0.00 C ATOM 1383 C VAL A 86 38.126 80.794 -9.626 1.00 0.00 C ATOM 1384 O VAL A 86 38.135 82.024 -9.636 1.00 0.00 O ATOM 1385 CB VAL A 86 39.807 80.582 -11.480 1.00 0.00 C ATOM 1386 CG1 VAL A 86 40.951 80.519 -10.488 1.00 0.00 C ATOM 1387 CG2 VAL A 86 40.181 79.858 -12.762 1.00 0.00 C ATOM 0 H VAL A 86 37.089 81.010 -12.034 1.00 0.00 H new ATOM 0 HA VAL A 86 38.680 78.959 -10.616 1.00 0.00 H new ATOM 0 HB VAL A 86 39.619 81.630 -11.716 1.00 0.00 H new ATOM 0 HG11 VAL A 86 41.851 80.933 -10.943 1.00 0.00 H new ATOM 0 HG12 VAL A 86 40.695 81.097 -9.600 1.00 0.00 H new ATOM 0 HG13 VAL A 86 41.132 79.482 -10.206 1.00 0.00 H new ATOM 0 HG21 VAL A 86 41.099 80.284 -13.166 1.00 0.00 H new ATOM 0 HG22 VAL A 86 40.334 78.800 -12.551 1.00 0.00 H new ATOM 0 HG23 VAL A 86 39.378 79.970 -13.491 1.00 0.00 H new ATOM 1397 N PHE A 87 37.769 80.090 -8.558 1.00 0.00 N ATOM 1398 CA PHE A 87 37.258 80.747 -7.357 1.00 0.00 C ATOM 1399 C PHE A 87 38.028 80.308 -6.113 1.00 0.00 C ATOM 1400 O PHE A 87 37.470 79.637 -5.249 1.00 0.00 O ATOM 1401 CB PHE A 87 35.771 80.419 -7.151 1.00 0.00 C ATOM 1402 CG PHE A 87 34.947 80.372 -8.410 1.00 0.00 C ATOM 1403 CD1 PHE A 87 34.360 81.516 -8.923 1.00 0.00 C ATOM 1404 CD2 PHE A 87 34.748 79.169 -9.070 1.00 0.00 C ATOM 1405 CE1 PHE A 87 33.589 81.462 -10.070 1.00 0.00 C ATOM 1406 CE2 PHE A 87 33.983 79.108 -10.217 1.00 0.00 C ATOM 1407 CZ PHE A 87 33.401 80.255 -10.718 1.00 0.00 C ATOM 0 H PHE A 87 37.822 79.073 -8.497 1.00 0.00 H new ATOM 0 HA PHE A 87 37.387 81.820 -7.500 1.00 0.00 H new ATOM 0 HB2 PHE A 87 35.694 79.455 -6.649 1.00 0.00 H new ATOM 0 HB3 PHE A 87 35.340 81.163 -6.481 1.00 0.00 H new ATOM 0 HD1 PHE A 87 34.506 82.461 -8.422 1.00 0.00 H new ATOM 0 HD2 PHE A 87 35.198 78.267 -8.681 1.00 0.00 H new ATOM 0 HE1 PHE A 87 33.134 82.361 -10.459 1.00 0.00 H new ATOM 0 HE2 PHE A 87 33.840 78.164 -10.722 1.00 0.00 H new ATOM 0 HZ PHE A 87 32.800 80.210 -11.614 1.00 0.00 H new ATOM 1417 N TRP A 88 39.297 80.681 -6.017 1.00 0.00 N ATOM 1418 CA TRP A 88 40.109 80.319 -4.854 1.00 0.00 C ATOM 1419 C TRP A 88 39.906 81.326 -3.722 1.00 0.00 C ATOM 1420 O TRP A 88 38.970 82.127 -3.749 1.00 0.00 O ATOM 1421 CB TRP A 88 41.594 80.263 -5.230 1.00 0.00 C ATOM 1422 CG TRP A 88 41.906 79.286 -6.321 1.00 0.00 C ATOM 1423 CD1 TRP A 88 42.074 79.570 -7.642 1.00 0.00 C ATOM 1424 CD2 TRP A 88 42.093 77.873 -6.187 1.00 0.00 C ATOM 1425 NE1 TRP A 88 42.343 78.422 -8.344 1.00 0.00 N ATOM 1426 CE2 TRP A 88 42.364 77.365 -7.472 1.00 0.00 C ATOM 1427 CE3 TRP A 88 42.056 76.987 -5.106 1.00 0.00 C ATOM 1428 CZ2 TRP A 88 42.595 76.012 -7.704 1.00 0.00 C ATOM 1429 CZ3 TRP A 88 42.287 75.645 -5.339 1.00 0.00 C ATOM 1430 CH2 TRP A 88 42.553 75.169 -6.628 1.00 0.00 C ATOM 0 H TRP A 88 39.787 81.230 -6.723 1.00 0.00 H new ATOM 0 HA TRP A 88 39.790 79.333 -4.515 1.00 0.00 H new ATOM 0 HB2 TRP A 88 41.918 81.256 -5.541 1.00 0.00 H new ATOM 0 HB3 TRP A 88 42.174 80.002 -4.345 1.00 0.00 H new ATOM 0 HD1 TRP A 88 42.005 80.557 -8.075 1.00 0.00 H new ATOM 0 HE1 TRP A 88 42.501 78.365 -9.350 1.00 0.00 H new ATOM 0 HE3 TRP A 88 41.851 77.345 -4.108 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 42.800 75.642 -8.698 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 42.262 74.951 -4.512 1.00 0.00 H new ATOM 0 HH2 TRP A 88 42.729 74.114 -6.776 1.00 0.00 H new ATOM 1441 N HIS A 89 40.779 81.280 -2.724 1.00 0.00 N ATOM 1442 CA HIS A 89 40.757 82.264 -1.648 1.00 0.00 C ATOM 1443 C HIS A 89 42.116 82.927 -1.563 1.00 0.00 C ATOM 1444 O HIS A 89 43.107 82.255 -1.283 1.00 0.00 O ATOM 1445 CB HIS A 89 40.415 81.628 -0.292 1.00 0.00 C ATOM 1446 CG HIS A 89 38.962 81.316 -0.089 1.00 0.00 C ATOM 1447 ND1 HIS A 89 37.982 82.284 0.000 1.00 0.00 N ATOM 1448 CD2 HIS A 89 38.326 80.132 0.080 1.00 0.00 C ATOM 1449 CE1 HIS A 89 36.814 81.711 0.217 1.00 0.00 C ATOM 1450 NE2 HIS A 89 36.994 80.404 0.271 1.00 0.00 N ATOM 0 H HIS A 89 41.510 80.574 -2.637 1.00 0.00 H new ATOM 0 HA HIS A 89 39.981 82.996 -1.874 1.00 0.00 H new ATOM 0 HB2 HIS A 89 40.988 80.707 -0.184 1.00 0.00 H new ATOM 0 HB3 HIS A 89 40.741 82.301 0.501 1.00 0.00 H new ATOM 0 HD1 HIS A 89 38.137 83.288 -0.088 1.00 0.00 H new ATOM 0 HD2 HIS A 89 38.783 79.154 0.067 1.00 0.00 H new ATOM 0 HE1 HIS A 89 35.870 82.224 0.331 1.00 0.00 H new ATOM 1459 N LYS A 90 42.168 84.234 -1.815 1.00 0.00 N ATOM 1460 CA LYS A 90 43.442 84.936 -1.813 1.00 0.00 C ATOM 1461 C LYS A 90 44.103 84.853 -0.450 1.00 0.00 C ATOM 1462 O LYS A 90 43.674 85.474 0.527 1.00 0.00 O ATOM 1463 CB LYS A 90 43.309 86.387 -2.265 1.00 0.00 C ATOM 1464 CG LYS A 90 44.611 87.176 -2.151 1.00 0.00 C ATOM 1465 CD LYS A 90 45.818 86.416 -2.697 1.00 0.00 C ATOM 1466 CE LYS A 90 45.740 86.193 -4.198 1.00 0.00 C ATOM 1467 NZ LYS A 90 46.887 85.379 -4.689 1.00 0.00 N ATOM 0 H LYS A 90 41.356 84.816 -2.019 1.00 0.00 H new ATOM 0 HA LYS A 90 44.081 84.435 -2.541 1.00 0.00 H new ATOM 0 HB2 LYS A 90 42.969 86.408 -3.300 1.00 0.00 H new ATOM 0 HB3 LYS A 90 42.541 86.878 -1.667 1.00 0.00 H new ATOM 0 HG2 LYS A 90 44.507 88.118 -2.690 1.00 0.00 H new ATOM 0 HG3 LYS A 90 44.788 87.425 -1.105 1.00 0.00 H new ATOM 0 HD2 LYS A 90 46.727 86.970 -2.463 1.00 0.00 H new ATOM 0 HD3 LYS A 90 45.893 85.452 -2.194 1.00 0.00 H new ATOM 0 HE2 LYS A 90 44.804 85.691 -4.444 1.00 0.00 H new ATOM 0 HE3 LYS A 90 45.730 87.155 -4.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 46.556 84.718 -5.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 47.611 86.007 -5.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 47.297 84.843 -3.897 1.00 0.00 H new ATOM 1481 N ASN A 91 45.175 84.097 -0.457 1.00 0.00 N ATOM 1482 CA ASN A 91 45.914 83.682 0.722 1.00 0.00 C ATOM 1483 C ASN A 91 46.743 82.473 0.335 1.00 0.00 C ATOM 1484 O ASN A 91 47.961 82.464 0.510 1.00 0.00 O ATOM 1485 CB ASN A 91 44.980 83.303 1.884 1.00 0.00 C ATOM 1486 CG ASN A 91 45.731 82.757 3.085 1.00 0.00 C ATOM 1487 OD1 ASN A 91 45.954 81.552 3.201 1.00 0.00 O ATOM 1488 ND2 ASN A 91 46.121 83.635 3.992 1.00 0.00 N ATOM 0 H ASN A 91 45.578 83.736 -1.322 1.00 0.00 H new ATOM 0 HA ASN A 91 46.536 84.510 1.063 1.00 0.00 H new ATOM 0 HB2 ASN A 91 44.408 84.180 2.186 1.00 0.00 H new ATOM 0 HB3 ASN A 91 44.262 82.558 1.540 1.00 0.00 H new ATOM 0 HD21 ASN A 91 46.625 83.322 4.822 1.00 0.00 H new ATOM 0 HD22 ASN A 91 45.919 84.626 3.862 1.00 0.00 H new ATOM 1495 N GLU A 92 46.044 81.491 -0.255 1.00 0.00 N ATOM 1496 CA GLU A 92 46.601 80.189 -0.649 1.00 0.00 C ATOM 1497 C GLU A 92 47.657 79.697 0.348 1.00 0.00 C ATOM 1498 O GLU A 92 48.839 80.050 0.255 1.00 0.00 O ATOM 1499 CB GLU A 92 47.167 80.221 -2.075 1.00 0.00 C ATOM 1500 CG GLU A 92 46.281 80.923 -3.102 1.00 0.00 C ATOM 1501 CD GLU A 92 46.602 82.397 -3.261 1.00 0.00 C ATOM 1502 OE1 GLU A 92 47.682 82.724 -3.795 1.00 0.00 O ATOM 1503 OE2 GLU A 92 45.782 83.239 -2.862 1.00 0.00 O ATOM 0 H GLU A 92 45.053 81.583 -0.476 1.00 0.00 H new ATOM 0 HA GLU A 92 45.776 79.477 -0.636 1.00 0.00 H new ATOM 0 HB2 GLU A 92 48.137 80.717 -2.054 1.00 0.00 H new ATOM 0 HB3 GLU A 92 47.340 79.197 -2.405 1.00 0.00 H new ATOM 0 HG2 GLU A 92 46.392 80.428 -4.067 1.00 0.00 H new ATOM 0 HG3 GLU A 92 45.237 80.815 -2.806 1.00 0.00 H new ATOM 1510 N PRO A 93 47.232 78.865 1.315 1.00 0.00 N ATOM 1511 CA PRO A 93 48.063 78.462 2.457 1.00 0.00 C ATOM 1512 C PRO A 93 49.335 77.713 2.067 1.00 0.00 C ATOM 1513 O PRO A 93 49.308 76.508 1.806 1.00 0.00 O ATOM 1514 CB PRO A 93 47.143 77.549 3.280 1.00 0.00 C ATOM 1515 CG PRO A 93 45.764 77.863 2.811 1.00 0.00 C ATOM 1516 CD PRO A 93 45.900 78.243 1.368 1.00 0.00 C ATOM 0 HA PRO A 93 48.422 79.339 2.995 1.00 0.00 H new ATOM 0 HB2 PRO A 93 47.384 76.498 3.119 1.00 0.00 H new ATOM 0 HB3 PRO A 93 47.250 77.741 4.348 1.00 0.00 H new ATOM 0 HG2 PRO A 93 45.106 77.002 2.928 1.00 0.00 H new ATOM 0 HG3 PRO A 93 45.330 78.678 3.391 1.00 0.00 H new ATOM 0 HD2 PRO A 93 45.834 77.374 0.714 1.00 0.00 H new ATOM 0 HD3 PRO A 93 45.118 78.936 1.057 1.00 0.00 H new ATOM 1524 N ASP A 94 50.452 78.431 2.043 1.00 0.00 N ATOM 1525 CA ASP A 94 51.753 77.809 1.831 1.00 0.00 C ATOM 1526 C ASP A 94 52.239 77.221 3.151 1.00 0.00 C ATOM 1527 O ASP A 94 53.172 77.720 3.783 1.00 0.00 O ATOM 1528 CB ASP A 94 52.764 78.821 1.270 1.00 0.00 C ATOM 1529 CG ASP A 94 54.139 78.216 1.030 1.00 0.00 C ATOM 1530 OD1 ASP A 94 54.275 77.367 0.130 1.00 0.00 O ATOM 1531 OD2 ASP A 94 55.095 78.603 1.738 1.00 0.00 O ATOM 0 H ASP A 94 50.483 79.443 2.168 1.00 0.00 H new ATOM 0 HA ASP A 94 51.657 77.011 1.094 1.00 0.00 H new ATOM 0 HB2 ASP A 94 52.383 79.226 0.333 1.00 0.00 H new ATOM 0 HB3 ASP A 94 52.857 79.657 1.964 1.00 0.00 H new ATOM 1536 N ASN A 95 51.540 76.190 3.590 1.00 0.00 N ATOM 1537 CA ASN A 95 51.847 75.522 4.845 1.00 0.00 C ATOM 1538 C ASN A 95 52.117 74.047 4.595 1.00 0.00 C ATOM 1539 O ASN A 95 52.860 73.400 5.329 1.00 0.00 O ATOM 1540 CB ASN A 95 50.681 75.691 5.827 1.00 0.00 C ATOM 1541 CG ASN A 95 50.965 75.092 7.191 1.00 0.00 C ATOM 1542 OD1 ASN A 95 51.541 75.747 8.059 1.00 0.00 O ATOM 1543 ND2 ASN A 95 50.542 73.853 7.400 1.00 0.00 N ATOM 0 H ASN A 95 50.745 75.792 3.089 1.00 0.00 H new ATOM 0 HA ASN A 95 52.739 75.973 5.280 1.00 0.00 H new ATOM 0 HB2 ASN A 95 50.460 76.752 5.941 1.00 0.00 H new ATOM 0 HB3 ASN A 95 49.790 75.223 5.409 1.00 0.00 H new ATOM 0 HD21 ASN A 95 50.690 73.410 8.307 1.00 0.00 H new ATOM 0 HD22 ASN A 95 50.068 73.343 6.654 1.00 0.00 H new ATOM 1550 N SER A 96 51.494 73.519 3.555 1.00 0.00 N ATOM 1551 CA SER A 96 51.702 72.141 3.161 1.00 0.00 C ATOM 1552 C SER A 96 51.749 72.042 1.645 1.00 0.00 C ATOM 1553 O SER A 96 50.722 71.901 0.986 1.00 0.00 O ATOM 1554 CB SER A 96 50.595 71.255 3.719 1.00 0.00 C ATOM 1555 OG SER A 96 50.426 71.485 5.110 1.00 0.00 O ATOM 0 H SER A 96 50.836 74.030 2.966 1.00 0.00 H new ATOM 0 HA SER A 96 52.652 71.796 3.568 1.00 0.00 H new ATOM 0 HB2 SER A 96 49.661 71.457 3.195 1.00 0.00 H new ATOM 0 HB3 SER A 96 50.838 70.207 3.545 1.00 0.00 H new ATOM 0 HG SER A 96 49.710 70.909 5.452 1.00 0.00 H new ATOM 1561 N GLN A 97 52.945 72.167 1.108 1.00 0.00 N ATOM 1562 CA GLN A 97 53.159 72.105 -0.325 1.00 0.00 C ATOM 1563 C GLN A 97 53.202 70.654 -0.797 1.00 0.00 C ATOM 1564 O GLN A 97 54.139 69.917 -0.498 1.00 0.00 O ATOM 1565 CB GLN A 97 54.448 72.848 -0.709 1.00 0.00 C ATOM 1566 CG GLN A 97 55.641 72.563 0.200 1.00 0.00 C ATOM 1567 CD GLN A 97 55.614 73.359 1.498 1.00 0.00 C ATOM 1568 OE1 GLN A 97 55.119 72.885 2.522 1.00 0.00 O ATOM 1569 NE2 GLN A 97 56.117 74.581 1.458 1.00 0.00 N ATOM 0 H GLN A 97 53.796 72.314 1.651 1.00 0.00 H new ATOM 0 HA GLN A 97 52.324 72.598 -0.823 1.00 0.00 H new ATOM 0 HB2 GLN A 97 54.715 72.581 -1.731 1.00 0.00 H new ATOM 0 HB3 GLN A 97 54.250 73.920 -0.701 1.00 0.00 H new ATOM 0 HG2 GLN A 97 55.664 71.499 0.435 1.00 0.00 H new ATOM 0 HG3 GLN A 97 56.561 72.790 -0.338 1.00 0.00 H new ATOM 0 HE21 GLN A 97 56.519 74.939 0.591 1.00 0.00 H new ATOM 0 HE22 GLN A 97 56.103 75.166 2.294 1.00 0.00 H new ATOM 1578 N GLY A 98 52.167 70.253 -1.518 1.00 0.00 N ATOM 1579 CA GLY A 98 52.048 68.879 -1.957 1.00 0.00 C ATOM 1580 C GLY A 98 50.707 68.296 -1.566 1.00 0.00 C ATOM 1581 O GLY A 98 50.183 68.622 -0.498 1.00 0.00 O ATOM 0 H GLY A 98 51.401 70.860 -1.809 1.00 0.00 H new ATOM 0 HA2 GLY A 98 52.169 68.828 -3.039 1.00 0.00 H new ATOM 0 HA3 GLY A 98 52.849 68.283 -1.519 1.00 0.00 H new ATOM 1585 N GLU A 99 50.145 67.459 -2.434 1.00 0.00 N ATOM 1586 CA GLU A 99 48.824 66.870 -2.213 1.00 0.00 C ATOM 1587 C GLU A 99 47.758 67.936 -1.990 1.00 0.00 C ATOM 1588 O GLU A 99 46.810 67.719 -1.241 1.00 0.00 O ATOM 1589 CB GLU A 99 48.835 65.921 -1.014 1.00 0.00 C ATOM 1590 CG GLU A 99 49.237 64.500 -1.352 1.00 0.00 C ATOM 1591 CD GLU A 99 48.937 63.549 -0.214 1.00 0.00 C ATOM 1592 OE1 GLU A 99 47.742 63.394 0.133 1.00 0.00 O ATOM 1593 OE2 GLU A 99 49.884 62.968 0.343 1.00 0.00 O ATOM 0 H GLU A 99 50.588 67.170 -3.306 1.00 0.00 H new ATOM 0 HA GLU A 99 48.580 66.312 -3.117 1.00 0.00 H new ATOM 0 HB2 GLU A 99 49.520 66.312 -0.262 1.00 0.00 H new ATOM 0 HB3 GLU A 99 47.842 65.909 -0.565 1.00 0.00 H new ATOM 0 HG2 GLU A 99 48.707 64.175 -2.247 1.00 0.00 H new ATOM 0 HG3 GLU A 99 50.302 64.468 -1.582 1.00 0.00 H new ATOM 1600 N ASN A 100 47.892 69.076 -2.643 1.00 0.00 N ATOM 1601 CA ASN A 100 46.932 70.156 -2.457 1.00 0.00 C ATOM 1602 C ASN A 100 45.634 69.855 -3.192 1.00 0.00 C ATOM 1603 O ASN A 100 45.498 70.109 -4.382 1.00 0.00 O ATOM 1604 CB ASN A 100 47.518 71.495 -2.913 1.00 0.00 C ATOM 1605 CG ASN A 100 48.470 72.099 -1.893 1.00 0.00 C ATOM 1606 OD1 ASN A 100 48.633 73.314 -1.823 1.00 0.00 O ATOM 1607 ND2 ASN A 100 49.106 71.257 -1.090 1.00 0.00 N ATOM 0 H ASN A 100 48.645 69.280 -3.300 1.00 0.00 H new ATOM 0 HA ASN A 100 46.711 70.232 -1.392 1.00 0.00 H new ATOM 0 HB2 ASN A 100 48.046 71.353 -3.856 1.00 0.00 H new ATOM 0 HB3 ASN A 100 46.705 72.196 -3.104 1.00 0.00 H new ATOM 0 HD21 ASN A 100 49.754 71.613 -0.387 1.00 0.00 H new ATOM 0 HD22 ASN A 100 48.947 70.253 -1.175 1.00 0.00 H new ATOM 1614 N CYS A 101 44.695 69.269 -2.480 1.00 0.00 N ATOM 1615 CA CYS A 101 43.394 68.971 -3.038 1.00 0.00 C ATOM 1616 C CYS A 101 42.388 70.002 -2.542 1.00 0.00 C ATOM 1617 O CYS A 101 42.437 70.423 -1.388 1.00 0.00 O ATOM 1618 CB CYS A 101 42.985 67.535 -2.687 1.00 0.00 C ATOM 1619 SG CYS A 101 44.031 66.283 -3.493 1.00 0.00 S ATOM 0 H CYS A 101 44.810 68.988 -1.506 1.00 0.00 H new ATOM 0 HA CYS A 101 43.426 69.033 -4.126 1.00 0.00 H new ATOM 0 HB2 CYS A 101 43.036 67.402 -1.606 1.00 0.00 H new ATOM 0 HB3 CYS A 101 41.947 67.377 -2.979 1.00 0.00 H new ATOM 1624 N VAL A 102 41.505 70.435 -3.426 1.00 0.00 N ATOM 1625 CA VAL A 102 40.653 71.581 -3.144 1.00 0.00 C ATOM 1626 C VAL A 102 39.321 71.178 -2.513 1.00 0.00 C ATOM 1627 O VAL A 102 38.768 70.116 -2.814 1.00 0.00 O ATOM 1628 CB VAL A 102 40.389 72.392 -4.430 1.00 0.00 C ATOM 1629 CG1 VAL A 102 39.595 71.578 -5.436 1.00 0.00 C ATOM 1630 CG2 VAL A 102 39.673 73.688 -4.114 1.00 0.00 C ATOM 0 H VAL A 102 41.359 70.013 -4.343 1.00 0.00 H new ATOM 0 HA VAL A 102 41.190 72.198 -2.423 1.00 0.00 H new ATOM 0 HB VAL A 102 41.355 72.633 -4.874 1.00 0.00 H new ATOM 0 HG11 VAL A 102 39.424 72.174 -6.332 1.00 0.00 H new ATOM 0 HG12 VAL A 102 40.154 70.680 -5.699 1.00 0.00 H new ATOM 0 HG13 VAL A 102 38.637 71.295 -5.000 1.00 0.00 H new ATOM 0 HG21 VAL A 102 39.498 74.242 -5.037 1.00 0.00 H new ATOM 0 HG22 VAL A 102 38.718 73.469 -3.636 1.00 0.00 H new ATOM 0 HG23 VAL A 102 40.286 74.288 -3.442 1.00 0.00 H new ATOM 1640 N VAL A 103 38.826 72.031 -1.623 1.00 0.00 N ATOM 1641 CA VAL A 103 37.509 71.850 -1.033 1.00 0.00 C ATOM 1642 C VAL A 103 36.684 73.129 -1.158 1.00 0.00 C ATOM 1643 O VAL A 103 37.234 74.225 -1.286 1.00 0.00 O ATOM 1644 CB VAL A 103 37.589 71.453 0.460 1.00 0.00 C ATOM 1645 CG1 VAL A 103 38.422 70.201 0.642 1.00 0.00 C ATOM 1646 CG2 VAL A 103 38.149 72.589 1.304 1.00 0.00 C ATOM 0 H VAL A 103 39.322 72.859 -1.294 1.00 0.00 H new ATOM 0 HA VAL A 103 37.030 71.039 -1.582 1.00 0.00 H new ATOM 0 HB VAL A 103 36.574 71.246 0.800 1.00 0.00 H new ATOM 0 HG11 VAL A 103 38.463 69.942 1.700 1.00 0.00 H new ATOM 0 HG12 VAL A 103 37.971 69.380 0.085 1.00 0.00 H new ATOM 0 HG13 VAL A 103 39.432 70.379 0.272 1.00 0.00 H new ATOM 0 HG21 VAL A 103 38.193 72.279 2.348 1.00 0.00 H new ATOM 0 HG22 VAL A 103 39.152 72.840 0.958 1.00 0.00 H new ATOM 0 HG23 VAL A 103 37.504 73.463 1.212 1.00 0.00 H new ATOM 1656 N LEU A 104 35.370 72.977 -1.143 1.00 0.00 N ATOM 1657 CA LEU A 104 34.463 74.109 -1.065 1.00 0.00 C ATOM 1658 C LEU A 104 34.203 74.453 0.390 1.00 0.00 C ATOM 1659 O LEU A 104 33.697 73.625 1.149 1.00 0.00 O ATOM 1660 CB LEU A 104 33.132 73.802 -1.759 1.00 0.00 C ATOM 1661 CG LEU A 104 33.121 73.958 -3.279 1.00 0.00 C ATOM 1662 CD1 LEU A 104 31.769 73.549 -3.843 1.00 0.00 C ATOM 1663 CD2 LEU A 104 33.445 75.393 -3.665 1.00 0.00 C ATOM 0 H LEU A 104 34.904 72.070 -1.184 1.00 0.00 H new ATOM 0 HA LEU A 104 34.929 74.954 -1.572 1.00 0.00 H new ATOM 0 HB2 LEU A 104 32.845 72.779 -1.516 1.00 0.00 H new ATOM 0 HB3 LEU A 104 32.367 74.456 -1.340 1.00 0.00 H new ATOM 0 HG LEU A 104 33.884 73.305 -3.701 1.00 0.00 H new ATOM 0 HD11 LEU A 104 31.777 73.666 -4.927 1.00 0.00 H new ATOM 0 HD12 LEU A 104 31.570 72.507 -3.591 1.00 0.00 H new ATOM 0 HD13 LEU A 104 30.990 74.181 -3.416 1.00 0.00 H new ATOM 0 HD21 LEU A 104 33.434 75.489 -4.751 1.00 0.00 H new ATOM 0 HD22 LEU A 104 32.701 76.063 -3.234 1.00 0.00 H new ATOM 0 HD23 LEU A 104 34.433 75.657 -3.288 1.00 0.00 H new ATOM 1675 N VAL A 105 34.566 75.660 0.780 1.00 0.00 N ATOM 1676 CA VAL A 105 34.332 76.117 2.137 1.00 0.00 C ATOM 1677 C VAL A 105 33.662 77.490 2.129 1.00 0.00 C ATOM 1678 O VAL A 105 33.966 78.339 1.281 1.00 0.00 O ATOM 1679 CB VAL A 105 35.647 76.161 2.954 1.00 0.00 C ATOM 1680 CG1 VAL A 105 36.666 77.073 2.299 1.00 0.00 C ATOM 1681 CG2 VAL A 105 35.385 76.589 4.391 1.00 0.00 C ATOM 0 H VAL A 105 35.024 76.342 0.176 1.00 0.00 H new ATOM 0 HA VAL A 105 33.665 75.403 2.619 1.00 0.00 H new ATOM 0 HB VAL A 105 36.059 75.152 2.972 1.00 0.00 H new ATOM 0 HG11 VAL A 105 37.579 77.085 2.894 1.00 0.00 H new ATOM 0 HG12 VAL A 105 36.890 76.707 1.297 1.00 0.00 H new ATOM 0 HG13 VAL A 105 36.262 78.083 2.235 1.00 0.00 H new ATOM 0 HG21 VAL A 105 36.326 76.611 4.941 1.00 0.00 H new ATOM 0 HG22 VAL A 105 34.937 77.582 4.399 1.00 0.00 H new ATOM 0 HG23 VAL A 105 34.705 75.880 4.863 1.00 0.00 H new ATOM 1691 N TYR A 106 32.734 77.685 3.057 1.00 0.00 N ATOM 1692 CA TYR A 106 32.004 78.936 3.166 1.00 0.00 C ATOM 1693 C TYR A 106 32.898 80.000 3.795 1.00 0.00 C ATOM 1694 O TYR A 106 33.209 79.944 4.985 1.00 0.00 O ATOM 1695 CB TYR A 106 30.737 78.732 4.006 1.00 0.00 C ATOM 1696 CG TYR A 106 29.718 79.843 3.875 1.00 0.00 C ATOM 1697 CD1 TYR A 106 29.798 80.991 4.653 1.00 0.00 C ATOM 1698 CD2 TYR A 106 28.663 79.733 2.976 1.00 0.00 C ATOM 1699 CE1 TYR A 106 28.857 81.997 4.539 1.00 0.00 C ATOM 1700 CE2 TYR A 106 27.723 80.734 2.855 1.00 0.00 C ATOM 1701 CZ TYR A 106 27.822 81.862 3.639 1.00 0.00 C ATOM 1702 OH TYR A 106 26.875 82.854 3.526 1.00 0.00 O ATOM 0 H TYR A 106 32.469 76.984 3.750 1.00 0.00 H new ATOM 0 HA TYR A 106 31.709 79.270 2.171 1.00 0.00 H new ATOM 0 HB2 TYR A 106 30.270 77.791 3.716 1.00 0.00 H new ATOM 0 HB3 TYR A 106 31.021 78.637 5.054 1.00 0.00 H new ATOM 0 HD1 TYR A 106 30.609 81.099 5.358 1.00 0.00 H new ATOM 0 HD2 TYR A 106 28.579 78.848 2.362 1.00 0.00 H new ATOM 0 HE1 TYR A 106 28.932 82.883 5.151 1.00 0.00 H new ATOM 0 HE2 TYR A 106 26.912 80.634 2.148 1.00 0.00 H new ATOM 0 HH TYR A 106 27.127 83.466 2.803 1.00 0.00 H new ATOM 1712 N ASN A 107 33.321 80.953 2.984 1.00 0.00 N ATOM 1713 CA ASN A 107 34.218 82.006 3.427 1.00 0.00 C ATOM 1714 C ASN A 107 34.111 83.191 2.478 1.00 0.00 C ATOM 1715 O ASN A 107 33.946 83.001 1.274 1.00 0.00 O ATOM 1716 CB ASN A 107 35.659 81.484 3.487 1.00 0.00 C ATOM 1717 CG ASN A 107 36.642 82.520 3.997 1.00 0.00 C ATOM 1718 OD1 ASN A 107 37.224 83.275 3.222 1.00 0.00 O ATOM 1719 ND2 ASN A 107 36.835 82.560 5.306 1.00 0.00 N ATOM 0 H ASN A 107 33.053 81.019 2.002 1.00 0.00 H new ATOM 0 HA ASN A 107 33.935 82.329 4.429 1.00 0.00 H new ATOM 0 HB2 ASN A 107 35.696 80.607 4.133 1.00 0.00 H new ATOM 0 HB3 ASN A 107 35.964 81.160 2.492 1.00 0.00 H new ATOM 0 HD21 ASN A 107 37.487 83.235 5.705 1.00 0.00 H new ATOM 0 HD22 ASN A 107 36.332 81.915 5.916 1.00 0.00 H new ATOM 1726 N GLN A 108 34.195 84.402 3.026 1.00 0.00 N ATOM 1727 CA GLN A 108 33.969 85.628 2.256 1.00 0.00 C ATOM 1728 C GLN A 108 32.507 85.702 1.821 1.00 0.00 C ATOM 1729 O GLN A 108 32.187 86.174 0.729 1.00 0.00 O ATOM 1730 CB GLN A 108 34.905 85.718 1.043 1.00 0.00 C ATOM 1731 CG GLN A 108 36.370 85.895 1.416 1.00 0.00 C ATOM 1732 CD GLN A 108 37.280 85.968 0.206 1.00 0.00 C ATOM 1733 OE1 GLN A 108 37.795 84.953 -0.266 1.00 0.00 O ATOM 1734 NE2 GLN A 108 37.485 87.171 -0.309 1.00 0.00 N ATOM 0 H GLN A 108 34.420 84.563 4.008 1.00 0.00 H new ATOM 0 HA GLN A 108 34.195 86.480 2.898 1.00 0.00 H new ATOM 0 HB2 GLN A 108 34.798 84.814 0.444 1.00 0.00 H new ATOM 0 HB3 GLN A 108 34.595 86.554 0.416 1.00 0.00 H new ATOM 0 HG2 GLN A 108 36.483 86.805 2.005 1.00 0.00 H new ATOM 0 HG3 GLN A 108 36.682 85.065 2.050 1.00 0.00 H new ATOM 0 HE21 GLN A 108 37.041 87.988 0.110 1.00 0.00 H new ATOM 0 HE22 GLN A 108 38.087 87.281 -1.125 1.00 0.00 H new ATOM 1743 N ASP A 109 31.639 85.208 2.707 1.00 0.00 N ATOM 1744 CA ASP A 109 30.181 85.280 2.556 1.00 0.00 C ATOM 1745 C ASP A 109 29.658 84.368 1.450 1.00 0.00 C ATOM 1746 O ASP A 109 28.461 84.348 1.167 1.00 0.00 O ATOM 1747 CB ASP A 109 29.720 86.721 2.318 1.00 0.00 C ATOM 1748 CG ASP A 109 28.581 87.108 3.236 1.00 0.00 C ATOM 1749 OD1 ASP A 109 28.846 87.361 4.432 1.00 0.00 O ATOM 1750 OD2 ASP A 109 27.418 87.138 2.784 1.00 0.00 O ATOM 0 H ASP A 109 31.933 84.739 3.564 1.00 0.00 H new ATOM 0 HA ASP A 109 29.758 84.924 3.496 1.00 0.00 H new ATOM 0 HB2 ASP A 109 30.558 87.401 2.473 1.00 0.00 H new ATOM 0 HB3 ASP A 109 29.405 86.835 1.281 1.00 0.00 H new ATOM 1755 N LYS A 110 30.539 83.590 0.845 1.00 0.00 N ATOM 1756 CA LYS A 110 30.129 82.655 -0.190 1.00 0.00 C ATOM 1757 C LYS A 110 30.977 81.395 -0.128 1.00 0.00 C ATOM 1758 O LYS A 110 31.905 81.299 0.669 1.00 0.00 O ATOM 1759 CB LYS A 110 30.246 83.295 -1.580 1.00 0.00 C ATOM 1760 CG LYS A 110 31.677 83.613 -1.997 1.00 0.00 C ATOM 1761 CD LYS A 110 31.729 84.273 -3.369 1.00 0.00 C ATOM 1762 CE LYS A 110 31.164 83.375 -4.464 1.00 0.00 C ATOM 1763 NZ LYS A 110 32.030 82.189 -4.729 1.00 0.00 N ATOM 0 H LYS A 110 31.538 83.586 1.051 1.00 0.00 H new ATOM 0 HA LYS A 110 29.086 82.392 -0.016 1.00 0.00 H new ATOM 0 HB2 LYS A 110 29.805 82.623 -2.316 1.00 0.00 H new ATOM 0 HB3 LYS A 110 29.661 84.214 -1.596 1.00 0.00 H new ATOM 0 HG2 LYS A 110 32.134 84.272 -1.258 1.00 0.00 H new ATOM 0 HG3 LYS A 110 32.265 82.695 -2.012 1.00 0.00 H new ATOM 0 HD2 LYS A 110 31.168 85.207 -3.342 1.00 0.00 H new ATOM 0 HD3 LYS A 110 32.761 84.528 -3.608 1.00 0.00 H new ATOM 0 HE2 LYS A 110 30.168 83.038 -4.176 1.00 0.00 H new ATOM 0 HE3 LYS A 110 31.052 83.952 -5.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 31.690 81.693 -5.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 33.010 82.502 -4.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 31.995 81.544 -3.914 1.00 0.00 H new ATOM 1777 N TRP A 111 30.644 80.425 -0.957 1.00 0.00 N ATOM 1778 CA TRP A 111 31.459 79.233 -1.083 1.00 0.00 C ATOM 1779 C TRP A 111 32.570 79.473 -2.088 1.00 0.00 C ATOM 1780 O TRP A 111 32.344 80.083 -3.135 1.00 0.00 O ATOM 1781 CB TRP A 111 30.615 78.049 -1.535 1.00 0.00 C ATOM 1782 CG TRP A 111 29.637 77.572 -0.512 1.00 0.00 C ATOM 1783 CD1 TRP A 111 28.392 78.072 -0.263 1.00 0.00 C ATOM 1784 CD2 TRP A 111 29.822 76.482 0.388 1.00 0.00 C ATOM 1785 NE1 TRP A 111 27.785 77.343 0.727 1.00 0.00 N ATOM 1786 CE2 TRP A 111 28.647 76.365 1.146 1.00 0.00 C ATOM 1787 CE3 TRP A 111 30.869 75.590 0.620 1.00 0.00 C ATOM 1788 CZ2 TRP A 111 28.493 75.390 2.121 1.00 0.00 C ATOM 1789 CZ3 TRP A 111 30.714 74.624 1.591 1.00 0.00 C ATOM 1790 CH2 TRP A 111 29.531 74.529 2.330 1.00 0.00 C ATOM 0 H TRP A 111 29.816 80.439 -1.552 1.00 0.00 H new ATOM 0 HA TRP A 111 31.889 79.006 -0.107 1.00 0.00 H new ATOM 0 HB2 TRP A 111 30.073 78.327 -2.439 1.00 0.00 H new ATOM 0 HB3 TRP A 111 31.277 77.225 -1.801 1.00 0.00 H new ATOM 0 HD1 TRP A 111 27.950 78.917 -0.771 1.00 0.00 H new ATOM 0 HE1 TRP A 111 26.846 77.503 1.091 1.00 0.00 H new ATOM 0 HE3 TRP A 111 31.784 75.655 0.050 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 27.582 75.315 2.696 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 31.519 73.930 1.784 1.00 0.00 H new ATOM 0 HH2 TRP A 111 29.437 73.759 3.081 1.00 0.00 H new ATOM 1801 N ALA A 112 33.764 79.015 -1.766 1.00 0.00 N ATOM 1802 CA ALA A 112 34.884 79.119 -2.683 1.00 0.00 C ATOM 1803 C ALA A 112 35.913 78.040 -2.390 1.00 0.00 C ATOM 1804 O ALA A 112 35.794 77.308 -1.404 1.00 0.00 O ATOM 1805 CB ALA A 112 35.512 80.503 -2.620 1.00 0.00 C ATOM 0 H ALA A 112 33.984 78.567 -0.876 1.00 0.00 H new ATOM 0 HA ALA A 112 34.512 78.969 -3.696 1.00 0.00 H new ATOM 0 HB1 ALA A 112 36.349 80.555 -3.316 1.00 0.00 H new ATOM 0 HB2 ALA A 112 34.768 81.253 -2.890 1.00 0.00 H new ATOM 0 HB3 ALA A 112 35.870 80.695 -1.608 1.00 0.00 H new ATOM 1811 N TRP A 113 36.920 77.966 -3.241 1.00 0.00 N ATOM 1812 CA TRP A 113 37.908 76.902 -3.196 1.00 0.00 C ATOM 1813 C TRP A 113 38.973 77.172 -2.139 1.00 0.00 C ATOM 1814 O TRP A 113 39.454 78.297 -2.002 1.00 0.00 O ATOM 1815 CB TRP A 113 38.567 76.764 -4.571 1.00 0.00 C ATOM 1816 CG TRP A 113 37.614 76.387 -5.667 1.00 0.00 C ATOM 1817 CD1 TRP A 113 36.318 75.983 -5.528 1.00 0.00 C ATOM 1818 CD2 TRP A 113 37.888 76.373 -7.072 1.00 0.00 C ATOM 1819 NE1 TRP A 113 35.770 75.718 -6.759 1.00 0.00 N ATOM 1820 CE2 TRP A 113 36.714 75.949 -7.722 1.00 0.00 C ATOM 1821 CE3 TRP A 113 39.011 76.676 -7.843 1.00 0.00 C ATOM 1822 CZ2 TRP A 113 36.633 75.823 -9.105 1.00 0.00 C ATOM 1823 CZ3 TRP A 113 38.931 76.551 -9.216 1.00 0.00 C ATOM 1824 CH2 TRP A 113 37.750 76.126 -9.834 1.00 0.00 C ATOM 0 H TRP A 113 37.077 78.645 -3.986 1.00 0.00 H new ATOM 0 HA TRP A 113 37.400 75.975 -2.929 1.00 0.00 H new ATOM 0 HB2 TRP A 113 39.047 77.708 -4.829 1.00 0.00 H new ATOM 0 HB3 TRP A 113 39.354 76.012 -4.512 1.00 0.00 H new ATOM 0 HD1 TRP A 113 35.798 75.886 -4.586 1.00 0.00 H new ATOM 0 HE1 TRP A 113 34.815 75.401 -6.928 1.00 0.00 H new ATOM 0 HE3 TRP A 113 39.927 77.003 -7.374 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 35.722 75.498 -9.585 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 39.794 76.785 -9.822 1.00 0.00 H new ATOM 0 HH2 TRP A 113 37.720 76.035 -10.910 1.00 0.00 H new ATOM 1835 N ASN A 114 39.322 76.139 -1.385 1.00 0.00 N ATOM 1836 CA ASN A 114 40.396 76.233 -0.407 1.00 0.00 C ATOM 1837 C ASN A 114 41.370 75.076 -0.586 1.00 0.00 C ATOM 1838 O ASN A 114 40.962 73.916 -0.681 1.00 0.00 O ATOM 1839 CB ASN A 114 39.836 76.232 1.016 1.00 0.00 C ATOM 1840 CG ASN A 114 40.915 76.360 2.081 1.00 0.00 C ATOM 1841 OD1 ASN A 114 41.981 77.092 1.777 1.00 0.00 O flip ATOM 1842 ND2 ASN A 114 40.783 75.822 3.176 1.00 0.00 N flip ATOM 0 H ASN A 114 38.875 75.223 -1.432 1.00 0.00 H new ATOM 0 HA ASN A 114 40.925 77.172 -0.568 1.00 0.00 H new ATOM 0 HB2 ASN A 114 39.129 77.055 1.123 1.00 0.00 H new ATOM 0 HB3 ASN A 114 39.279 75.310 1.180 1.00 0.00 H new ATOM 0 HD21 ASN A 114 39.951 75.267 3.374 1.00 0.00 H new ATOM 0 HD22 ASN A 114 41.506 75.930 3.888 1.00 0.00 H new ATOM 1849 N ASP A 115 42.649 75.409 -0.656 1.00 0.00 N ATOM 1850 CA ASP A 115 43.706 74.424 -0.819 1.00 0.00 C ATOM 1851 C ASP A 115 44.006 73.748 0.515 1.00 0.00 C ATOM 1852 O ASP A 115 44.318 74.419 1.500 1.00 0.00 O ATOM 1853 CB ASP A 115 44.979 75.113 -1.326 1.00 0.00 C ATOM 1854 CG ASP A 115 44.685 76.394 -2.088 1.00 0.00 C ATOM 1855 OD1 ASP A 115 44.343 77.411 -1.431 1.00 0.00 O ATOM 1856 OD2 ASP A 115 44.784 76.387 -3.329 1.00 0.00 O ATOM 0 H ASP A 115 42.984 76.371 -0.601 1.00 0.00 H new ATOM 0 HA ASP A 115 43.377 73.674 -1.539 1.00 0.00 H new ATOM 0 HB2 ASP A 115 45.627 75.339 -0.479 1.00 0.00 H new ATOM 0 HB3 ASP A 115 45.526 74.427 -1.973 1.00 0.00 H new ATOM 1861 N VAL A 116 43.915 72.424 0.548 1.00 0.00 N ATOM 1862 CA VAL A 116 44.245 71.661 1.749 1.00 0.00 C ATOM 1863 C VAL A 116 44.968 70.372 1.381 1.00 0.00 C ATOM 1864 O VAL A 116 44.885 69.914 0.239 1.00 0.00 O ATOM 1865 CB VAL A 116 42.991 71.304 2.590 1.00 0.00 C ATOM 1866 CG1 VAL A 116 42.355 72.548 3.192 1.00 0.00 C ATOM 1867 CG2 VAL A 116 41.974 70.537 1.757 1.00 0.00 C ATOM 0 H VAL A 116 43.615 71.854 -0.243 1.00 0.00 H new ATOM 0 HA VAL A 116 44.891 72.300 2.351 1.00 0.00 H new ATOM 0 HB VAL A 116 43.319 70.663 3.408 1.00 0.00 H new ATOM 0 HG11 VAL A 116 41.479 72.263 3.775 1.00 0.00 H new ATOM 0 HG12 VAL A 116 43.075 73.048 3.840 1.00 0.00 H new ATOM 0 HG13 VAL A 116 42.054 73.226 2.393 1.00 0.00 H new ATOM 0 HG21 VAL A 116 41.105 70.300 2.371 1.00 0.00 H new ATOM 0 HG22 VAL A 116 41.663 71.148 0.909 1.00 0.00 H new ATOM 0 HG23 VAL A 116 42.424 69.613 1.393 1.00 0.00 H new ATOM 1877 N PRO A 117 45.717 69.781 2.331 1.00 0.00 N ATOM 1878 CA PRO A 117 46.306 68.455 2.150 1.00 0.00 C ATOM 1879 C PRO A 117 45.241 67.430 1.775 1.00 0.00 C ATOM 1880 O PRO A 117 44.156 67.407 2.354 1.00 0.00 O ATOM 1881 CB PRO A 117 46.916 68.124 3.520 1.00 0.00 C ATOM 1882 CG PRO A 117 46.347 69.133 4.462 1.00 0.00 C ATOM 1883 CD PRO A 117 46.067 70.355 3.638 1.00 0.00 C ATOM 0 HA PRO A 117 47.041 68.435 1.346 1.00 0.00 H new ATOM 0 HB2 PRO A 117 46.661 67.110 3.829 1.00 0.00 H new ATOM 0 HB3 PRO A 117 48.004 68.184 3.490 1.00 0.00 H new ATOM 0 HG2 PRO A 117 45.436 68.760 4.929 1.00 0.00 H new ATOM 0 HG3 PRO A 117 47.049 69.356 5.265 1.00 0.00 H new ATOM 0 HD2 PRO A 117 45.251 70.947 4.053 1.00 0.00 H new ATOM 0 HD3 PRO A 117 46.936 71.010 3.574 1.00 0.00 H new ATOM 1891 N CYS A 118 45.553 66.596 0.801 1.00 0.00 N ATOM 1892 CA CYS A 118 44.593 65.643 0.270 1.00 0.00 C ATOM 1893 C CYS A 118 44.264 64.574 1.305 1.00 0.00 C ATOM 1894 O CYS A 118 43.170 64.001 1.301 1.00 0.00 O ATOM 1895 CB CYS A 118 45.144 65.012 -1.007 1.00 0.00 C ATOM 1896 SG CYS A 118 43.883 64.686 -2.270 1.00 0.00 S ATOM 0 H CYS A 118 46.471 66.559 0.358 1.00 0.00 H new ATOM 0 HA CYS A 118 43.669 66.169 0.031 1.00 0.00 H new ATOM 0 HB2 CYS A 118 45.903 65.671 -1.428 1.00 0.00 H new ATOM 0 HB3 CYS A 118 45.640 64.075 -0.753 1.00 0.00 H new ATOM 1901 N ASN A 119 45.212 64.319 2.196 1.00 0.00 N ATOM 1902 CA ASN A 119 45.001 63.393 3.298 1.00 0.00 C ATOM 1903 C ASN A 119 44.370 64.112 4.494 1.00 0.00 C ATOM 1904 O ASN A 119 44.935 64.177 5.582 1.00 0.00 O ATOM 1905 CB ASN A 119 46.316 62.700 3.690 1.00 0.00 C ATOM 1906 CG ASN A 119 47.473 63.669 3.887 1.00 0.00 C ATOM 1907 OD1 ASN A 119 47.705 64.174 4.985 1.00 0.00 O ATOM 1908 ND2 ASN A 119 48.220 63.925 2.824 1.00 0.00 N ATOM 0 H ASN A 119 46.139 64.743 2.176 1.00 0.00 H new ATOM 0 HA ASN A 119 44.307 62.620 2.969 1.00 0.00 H new ATOM 0 HB2 ASN A 119 46.162 62.138 4.611 1.00 0.00 H new ATOM 0 HB3 ASN A 119 46.583 61.979 2.917 1.00 0.00 H new ATOM 0 HD21 ASN A 119 49.016 64.558 2.901 1.00 0.00 H new ATOM 0 HD22 ASN A 119 47.999 63.489 1.929 1.00 0.00 H new ATOM 1915 N PHE A 120 43.187 64.664 4.259 1.00 0.00 N ATOM 1916 CA PHE A 120 42.420 65.337 5.296 1.00 0.00 C ATOM 1917 C PHE A 120 40.948 64.948 5.194 1.00 0.00 C ATOM 1918 O PHE A 120 40.308 65.198 4.177 1.00 0.00 O ATOM 1919 CB PHE A 120 42.581 66.858 5.153 1.00 0.00 C ATOM 1920 CG PHE A 120 41.709 67.664 6.074 1.00 0.00 C ATOM 1921 CD1 PHE A 120 41.983 67.727 7.428 1.00 0.00 C ATOM 1922 CD2 PHE A 120 40.614 68.359 5.581 1.00 0.00 C ATOM 1923 CE1 PHE A 120 41.183 68.467 8.277 1.00 0.00 C ATOM 1924 CE2 PHE A 120 39.809 69.102 6.424 1.00 0.00 C ATOM 1925 CZ PHE A 120 40.094 69.155 7.775 1.00 0.00 C ATOM 0 H PHE A 120 42.734 64.657 3.345 1.00 0.00 H new ATOM 0 HA PHE A 120 42.793 65.032 6.274 1.00 0.00 H new ATOM 0 HB2 PHE A 120 43.623 67.120 5.337 1.00 0.00 H new ATOM 0 HB3 PHE A 120 42.359 67.139 4.124 1.00 0.00 H new ATOM 0 HD1 PHE A 120 42.832 67.192 7.826 1.00 0.00 H new ATOM 0 HD2 PHE A 120 40.388 68.319 4.526 1.00 0.00 H new ATOM 0 HE1 PHE A 120 41.408 68.508 9.332 1.00 0.00 H new ATOM 0 HE2 PHE A 120 38.960 69.639 6.028 1.00 0.00 H new ATOM 0 HZ PHE A 120 39.467 69.733 8.438 1.00 0.00 H new ATOM 1935 N GLU A 121 40.434 64.296 6.225 1.00 0.00 N ATOM 1936 CA GLU A 121 39.024 63.934 6.286 1.00 0.00 C ATOM 1937 C GLU A 121 38.126 65.169 6.304 1.00 0.00 C ATOM 1938 O GLU A 121 38.189 65.988 7.223 1.00 0.00 O ATOM 1939 CB GLU A 121 38.746 63.081 7.525 1.00 0.00 C ATOM 1940 CG GLU A 121 39.166 61.623 7.389 1.00 0.00 C ATOM 1941 CD GLU A 121 40.636 61.437 7.083 1.00 0.00 C ATOM 1942 OE1 GLU A 121 41.467 62.151 7.681 1.00 0.00 O ATOM 1943 OE2 GLU A 121 40.954 60.580 6.232 1.00 0.00 O ATOM 0 H GLU A 121 40.976 64.004 7.038 1.00 0.00 H new ATOM 0 HA GLU A 121 38.796 63.359 5.388 1.00 0.00 H new ATOM 0 HB2 GLU A 121 39.266 63.519 8.377 1.00 0.00 H new ATOM 0 HB3 GLU A 121 37.680 63.121 7.747 1.00 0.00 H new ATOM 0 HG2 GLU A 121 38.928 61.098 8.314 1.00 0.00 H new ATOM 0 HG3 GLU A 121 38.578 61.157 6.598 1.00 0.00 H new ATOM 1950 N ALA A 122 37.292 65.294 5.282 1.00 0.00 N ATOM 1951 CA ALA A 122 36.329 66.381 5.197 1.00 0.00 C ATOM 1952 C ALA A 122 35.042 65.884 4.550 1.00 0.00 C ATOM 1953 O ALA A 122 34.916 64.696 4.249 1.00 0.00 O ATOM 1954 CB ALA A 122 36.908 67.546 4.408 1.00 0.00 C ATOM 0 H ALA A 122 37.264 64.649 4.493 1.00 0.00 H new ATOM 0 HA ALA A 122 36.104 66.731 6.204 1.00 0.00 H new ATOM 0 HB1 ALA A 122 36.174 68.350 4.355 1.00 0.00 H new ATOM 0 HB2 ALA A 122 37.808 67.909 4.903 1.00 0.00 H new ATOM 0 HB3 ALA A 122 37.157 67.215 3.400 1.00 0.00 H new ATOM 1960 N SER A 123 34.092 66.787 4.337 1.00 0.00 N ATOM 1961 CA SER A 123 32.842 66.431 3.689 1.00 0.00 C ATOM 1962 C SER A 123 33.050 66.332 2.181 1.00 0.00 C ATOM 1963 O SER A 123 34.108 66.697 1.665 1.00 0.00 O ATOM 1964 CB SER A 123 31.757 67.449 4.032 1.00 0.00 C ATOM 1965 OG SER A 123 31.613 67.569 5.438 1.00 0.00 O ATOM 0 H SER A 123 34.166 67.769 4.604 1.00 0.00 H new ATOM 0 HA SER A 123 32.513 65.458 4.054 1.00 0.00 H new ATOM 0 HB2 SER A 123 32.011 68.418 3.603 1.00 0.00 H new ATOM 0 HB3 SER A 123 30.810 67.142 3.589 1.00 0.00 H new ATOM 0 HG SER A 123 30.698 67.330 5.695 1.00 0.00 H new ATOM 1971 N ARG A 124 32.045 65.854 1.468 1.00 0.00 N ATOM 1972 CA ARG A 124 32.235 65.480 0.078 1.00 0.00 C ATOM 1973 C ARG A 124 30.952 65.602 -0.733 1.00 0.00 C ATOM 1974 O ARG A 124 29.883 65.200 -0.285 1.00 0.00 O ATOM 1975 CB ARG A 124 32.753 64.042 0.035 1.00 0.00 C ATOM 1976 CG ARG A 124 32.084 63.142 1.065 1.00 0.00 C ATOM 1977 CD ARG A 124 32.681 61.748 1.084 1.00 0.00 C ATOM 1978 NE ARG A 124 32.431 61.034 -0.163 1.00 0.00 N ATOM 1979 CZ ARG A 124 31.690 59.933 -0.248 1.00 0.00 C ATOM 1980 NH1 ARG A 124 31.195 59.371 0.852 1.00 0.00 N ATOM 1981 NH2 ARG A 124 31.460 59.374 -1.431 1.00 0.00 N ATOM 0 H ARG A 124 31.099 65.717 1.824 1.00 0.00 H new ATOM 0 HA ARG A 124 32.955 66.164 -0.372 1.00 0.00 H new ATOM 0 HB2 ARG A 124 32.588 63.631 -0.961 1.00 0.00 H new ATOM 0 HB3 ARG A 124 33.830 64.043 0.205 1.00 0.00 H new ATOM 0 HG2 ARG A 124 32.181 63.590 2.054 1.00 0.00 H new ATOM 0 HG3 ARG A 124 31.018 63.076 0.849 1.00 0.00 H new ATOM 0 HD2 ARG A 124 33.755 61.815 1.255 1.00 0.00 H new ATOM 0 HD3 ARG A 124 32.260 61.184 1.916 1.00 0.00 H new ATOM 0 HE ARG A 124 32.848 61.400 -1.019 1.00 0.00 H new ATOM 0 HH11 ARG A 124 31.383 59.785 1.765 1.00 0.00 H new ATOM 0 HH12 ARG A 124 30.627 58.527 0.782 1.00 0.00 H new ATOM 0 HH21 ARG A 124 31.852 59.789 -2.276 1.00 0.00 H new ATOM 0 HH22 ARG A 124 30.891 58.530 -1.494 1.00 0.00 H new ATOM 1995 N ILE A 125 31.062 66.170 -1.923 1.00 0.00 N ATOM 1996 CA ILE A 125 29.947 66.204 -2.856 1.00 0.00 C ATOM 1997 C ILE A 125 30.196 65.206 -3.972 1.00 0.00 C ATOM 1998 O ILE A 125 31.261 65.216 -4.589 1.00 0.00 O ATOM 1999 CB ILE A 125 29.741 67.605 -3.477 1.00 0.00 C ATOM 2000 CG1 ILE A 125 29.539 68.658 -2.389 1.00 0.00 C ATOM 2001 CG2 ILE A 125 28.549 67.592 -4.431 1.00 0.00 C ATOM 2002 CD1 ILE A 125 29.440 70.073 -2.920 1.00 0.00 C ATOM 0 H ILE A 125 31.913 66.615 -2.266 1.00 0.00 H new ATOM 0 HA ILE A 125 29.047 65.950 -2.297 1.00 0.00 H new ATOM 0 HB ILE A 125 30.638 67.864 -4.040 1.00 0.00 H new ATOM 0 HG12 ILE A 125 28.631 68.424 -1.834 1.00 0.00 H new ATOM 0 HG13 ILE A 125 30.368 68.602 -1.683 1.00 0.00 H new ATOM 0 HG21 ILE A 125 28.416 68.585 -4.861 1.00 0.00 H new ATOM 0 HG22 ILE A 125 28.730 66.872 -5.229 1.00 0.00 H new ATOM 0 HG23 ILE A 125 27.649 67.309 -3.885 1.00 0.00 H new ATOM 0 HD11 ILE A 125 29.297 70.764 -2.089 1.00 0.00 H new ATOM 0 HD12 ILE A 125 30.358 70.328 -3.450 1.00 0.00 H new ATOM 0 HD13 ILE A 125 28.594 70.147 -3.603 1.00 0.00 H new ATOM 2014 N CYS A 126 29.236 64.334 -4.217 1.00 0.00 N ATOM 2015 CA CYS A 126 29.363 63.362 -5.285 1.00 0.00 C ATOM 2016 C CYS A 126 28.428 63.753 -6.428 1.00 0.00 C ATOM 2017 O CYS A 126 27.220 63.905 -6.234 1.00 0.00 O ATOM 2018 CB CYS A 126 29.056 61.953 -4.763 1.00 0.00 C ATOM 2019 SG CYS A 126 29.834 60.610 -5.713 1.00 0.00 S ATOM 0 H CYS A 126 28.363 64.279 -3.693 1.00 0.00 H new ATOM 0 HA CYS A 126 30.387 63.353 -5.659 1.00 0.00 H new ATOM 0 HB2 CYS A 126 29.384 61.884 -3.726 1.00 0.00 H new ATOM 0 HB3 CYS A 126 27.976 61.805 -4.767 1.00 0.00 H new ATOM 2024 N LYS A 127 29.004 63.950 -7.602 1.00 0.00 N ATOM 2025 CA LYS A 127 28.272 64.422 -8.767 1.00 0.00 C ATOM 2026 C LYS A 127 28.188 63.335 -9.834 1.00 0.00 C ATOM 2027 O LYS A 127 29.198 62.742 -10.210 1.00 0.00 O ATOM 2028 CB LYS A 127 28.961 65.669 -9.333 1.00 0.00 C ATOM 2029 CG LYS A 127 28.529 66.032 -10.746 1.00 0.00 C ATOM 2030 CD LYS A 127 29.284 67.244 -11.266 1.00 0.00 C ATOM 2031 CE LYS A 127 29.059 67.442 -12.757 1.00 0.00 C ATOM 2032 NZ LYS A 127 29.715 68.675 -13.262 1.00 0.00 N ATOM 0 H LYS A 127 29.996 63.787 -7.775 1.00 0.00 H new ATOM 0 HA LYS A 127 27.256 64.675 -8.464 1.00 0.00 H new ATOM 0 HB2 LYS A 127 28.758 66.513 -8.674 1.00 0.00 H new ATOM 0 HB3 LYS A 127 30.039 65.510 -9.324 1.00 0.00 H new ATOM 0 HG2 LYS A 127 28.700 65.184 -11.409 1.00 0.00 H new ATOM 0 HG3 LYS A 127 27.458 66.236 -10.759 1.00 0.00 H new ATOM 0 HD2 LYS A 127 28.961 68.134 -10.727 1.00 0.00 H new ATOM 0 HD3 LYS A 127 30.349 67.122 -11.071 1.00 0.00 H new ATOM 0 HE2 LYS A 127 29.445 66.579 -13.299 1.00 0.00 H new ATOM 0 HE3 LYS A 127 27.989 67.493 -12.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 30.078 68.507 -14.222 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 29.024 69.452 -13.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 30.503 68.931 -12.634 1.00 0.00 H new ATOM 2046 N ILE A 128 26.982 63.080 -10.315 1.00 0.00 N ATOM 2047 CA ILE A 128 26.763 62.099 -11.369 1.00 0.00 C ATOM 2048 C ILE A 128 25.919 62.716 -12.482 1.00 0.00 C ATOM 2049 O ILE A 128 25.022 63.517 -12.216 1.00 0.00 O ATOM 2050 CB ILE A 128 26.054 60.826 -10.829 1.00 0.00 C ATOM 2051 CG1 ILE A 128 26.045 59.717 -11.888 1.00 0.00 C ATOM 2052 CG2 ILE A 128 24.630 61.141 -10.390 1.00 0.00 C ATOM 2053 CD1 ILE A 128 25.343 58.449 -11.445 1.00 0.00 C ATOM 0 H ILE A 128 26.133 63.542 -9.990 1.00 0.00 H new ATOM 0 HA ILE A 128 27.738 61.806 -11.758 1.00 0.00 H new ATOM 0 HB ILE A 128 26.614 60.476 -9.962 1.00 0.00 H new ATOM 0 HG12 ILE A 128 25.560 60.093 -12.789 1.00 0.00 H new ATOM 0 HG13 ILE A 128 27.074 59.476 -12.156 1.00 0.00 H new ATOM 0 HG21 ILE A 128 24.155 60.234 -10.016 1.00 0.00 H new ATOM 0 HG22 ILE A 128 24.650 61.892 -9.600 1.00 0.00 H new ATOM 0 HG23 ILE A 128 24.064 61.523 -11.239 1.00 0.00 H new ATOM 0 HD11 ILE A 128 25.379 57.713 -12.248 1.00 0.00 H new ATOM 0 HD12 ILE A 128 25.840 58.047 -10.562 1.00 0.00 H new ATOM 0 HD13 ILE A 128 24.304 58.673 -11.205 1.00 0.00 H new ATOM 2065 N PRO A 129 26.223 62.408 -13.748 1.00 0.00 N ATOM 2066 CA PRO A 129 25.354 62.769 -14.864 1.00 0.00 C ATOM 2067 C PRO A 129 24.082 61.927 -14.847 1.00 0.00 C ATOM 2068 O PRO A 129 24.002 60.937 -14.119 1.00 0.00 O ATOM 2069 CB PRO A 129 26.192 62.453 -16.113 1.00 0.00 C ATOM 2070 CG PRO A 129 27.578 62.192 -15.615 1.00 0.00 C ATOM 2071 CD PRO A 129 27.434 61.715 -14.200 1.00 0.00 C ATOM 0 HA PRO A 129 25.036 63.811 -14.826 1.00 0.00 H new ATOM 0 HB2 PRO A 129 25.796 61.586 -16.641 1.00 0.00 H new ATOM 0 HB3 PRO A 129 26.179 63.287 -16.815 1.00 0.00 H new ATOM 0 HG2 PRO A 129 28.077 61.442 -16.229 1.00 0.00 H new ATOM 0 HG3 PRO A 129 28.184 63.097 -15.661 1.00 0.00 H new ATOM 0 HD2 PRO A 129 27.324 60.632 -14.147 1.00 0.00 H new ATOM 0 HD3 PRO A 129 28.301 61.978 -13.594 1.00 0.00 H new ATOM 2079 N GLY A 130 23.086 62.321 -15.630 1.00 0.00 N ATOM 2080 CA GLY A 130 21.869 61.528 -15.738 1.00 0.00 C ATOM 2081 C GLY A 130 22.091 60.252 -16.531 1.00 0.00 C ATOM 2082 O GLY A 130 21.419 60.007 -17.530 1.00 0.00 O ATOM 0 H GLY A 130 23.095 63.172 -16.192 1.00 0.00 H new ATOM 0 HA2 GLY A 130 21.510 61.277 -14.740 1.00 0.00 H new ATOM 0 HA3 GLY A 130 21.090 62.122 -16.217 1.00 0.00 H new ATOM 2086 N THR A 131 23.028 59.439 -16.065 1.00 0.00 N ATOM 2087 CA THR A 131 23.461 58.254 -16.783 1.00 0.00 C ATOM 2088 C THR A 131 22.919 56.984 -16.122 1.00 0.00 C ATOM 2089 O THR A 131 23.391 55.879 -16.387 1.00 0.00 O ATOM 2090 CB THR A 131 25.009 58.203 -16.854 1.00 0.00 C ATOM 2091 OG1 THR A 131 25.439 57.189 -17.769 1.00 0.00 O ATOM 2092 CG2 THR A 131 25.619 57.946 -15.481 1.00 0.00 C ATOM 0 H THR A 131 23.509 59.585 -15.177 1.00 0.00 H new ATOM 0 HA THR A 131 23.063 58.307 -17.796 1.00 0.00 H new ATOM 0 HB THR A 131 25.352 59.175 -17.208 1.00 0.00 H new ATOM 0 HG1 THR A 131 26.418 57.172 -17.802 1.00 0.00 H new ATOM 0 HG21 THR A 131 26.705 57.916 -15.565 1.00 0.00 H new ATOM 0 HG22 THR A 131 25.330 58.746 -14.799 1.00 0.00 H new ATOM 0 HG23 THR A 131 25.259 56.992 -15.095 1.00 0.00 H new ATOM 2100 N THR A 132 21.900 57.142 -15.283 1.00 0.00 N ATOM 2101 CA THR A 132 21.288 56.008 -14.598 1.00 0.00 C ATOM 2102 C THR A 132 20.697 55.009 -15.598 1.00 0.00 C ATOM 2103 O THR A 132 20.495 53.838 -15.283 1.00 0.00 O ATOM 2104 CB THR A 132 20.197 56.494 -13.624 1.00 0.00 C ATOM 2105 OG1 THR A 132 20.707 57.582 -12.844 1.00 0.00 O ATOM 2106 CG2 THR A 132 19.745 55.376 -12.694 1.00 0.00 C ATOM 0 H THR A 132 21.480 58.045 -15.061 1.00 0.00 H new ATOM 0 HA THR A 132 22.068 55.499 -14.031 1.00 0.00 H new ATOM 0 HB THR A 132 19.337 56.819 -14.210 1.00 0.00 H new ATOM 0 HG1 THR A 132 20.248 58.410 -13.097 1.00 0.00 H new ATOM 0 HG21 THR A 132 18.975 55.752 -12.020 1.00 0.00 H new ATOM 0 HG22 THR A 132 19.341 54.553 -13.284 1.00 0.00 H new ATOM 0 HG23 THR A 132 20.595 55.021 -12.112 1.00 0.00 H new ATOM 2114 N LEU A 133 20.452 55.480 -16.813 1.00 0.00 N ATOM 2115 CA LEU A 133 19.909 54.642 -17.870 1.00 0.00 C ATOM 2116 C LEU A 133 21.007 53.791 -18.500 1.00 0.00 C ATOM 2117 O LEU A 133 20.744 52.721 -19.041 1.00 0.00 O ATOM 2118 CB LEU A 133 19.235 55.500 -18.948 1.00 0.00 C ATOM 2119 CG LEU A 133 18.043 56.346 -18.481 1.00 0.00 C ATOM 2120 CD1 LEU A 133 18.502 57.567 -17.699 1.00 0.00 C ATOM 2121 CD2 LEU A 133 17.205 56.768 -19.671 1.00 0.00 C ATOM 0 H LEU A 133 20.623 56.446 -17.091 1.00 0.00 H new ATOM 0 HA LEU A 133 19.163 53.983 -17.426 1.00 0.00 H new ATOM 0 HB2 LEU A 133 19.984 56.167 -19.376 1.00 0.00 H new ATOM 0 HB3 LEU A 133 18.898 54.843 -19.750 1.00 0.00 H new ATOM 0 HG LEU A 133 17.435 55.733 -17.816 1.00 0.00 H new ATOM 0 HD11 LEU A 133 17.633 58.144 -17.383 1.00 0.00 H new ATOM 0 HD12 LEU A 133 19.064 57.247 -16.821 1.00 0.00 H new ATOM 0 HD13 LEU A 133 19.139 58.186 -18.331 1.00 0.00 H new ATOM 0 HD21 LEU A 133 16.362 57.368 -19.328 1.00 0.00 H new ATOM 0 HD22 LEU A 133 17.815 57.358 -20.355 1.00 0.00 H new ATOM 0 HD23 LEU A 133 16.834 55.883 -20.187 1.00 0.00 H new ATOM 2133 N ASN A 134 22.237 54.287 -18.441 1.00 0.00 N ATOM 2134 CA ASN A 134 23.386 53.554 -18.962 1.00 0.00 C ATOM 2135 C ASN A 134 23.952 52.641 -17.882 1.00 0.00 C ATOM 2136 O ASN A 134 24.376 51.523 -18.153 1.00 0.00 O ATOM 2137 CB ASN A 134 24.464 54.527 -19.452 1.00 0.00 C ATOM 2138 CG ASN A 134 25.687 53.830 -20.027 1.00 0.00 C ATOM 2139 OD1 ASN A 134 25.488 52.674 -20.638 1.00 0.00 O flip ATOM 2140 ND2 ASN A 134 26.803 54.337 -19.929 1.00 0.00 N flip ATOM 0 H ASN A 134 22.465 55.195 -18.037 1.00 0.00 H new ATOM 0 HA ASN A 134 23.061 52.946 -19.806 1.00 0.00 H new ATOM 0 HB2 ASN A 134 24.036 55.180 -20.212 1.00 0.00 H new ATOM 0 HB3 ASN A 134 24.773 55.163 -18.623 1.00 0.00 H new ATOM 0 HD21 ASN A 134 26.917 55.230 -19.450 1.00 0.00 H new ATOM 0 HD22 ASN A 134 27.615 53.864 -20.327 1.00 0.00 H new ATOM 2147 N ALA A 135 23.941 53.132 -16.651 1.00 0.00 N ATOM 2148 CA ALA A 135 24.435 52.374 -15.511 1.00 0.00 C ATOM 2149 C ALA A 135 23.319 51.534 -14.896 1.00 0.00 C ATOM 2150 O ALA A 135 23.230 51.399 -13.673 1.00 0.00 O ATOM 2151 CB ALA A 135 25.011 53.325 -14.477 1.00 0.00 C ATOM 0 H ALA A 135 23.592 54.061 -16.415 1.00 0.00 H new ATOM 0 HA ALA A 135 25.219 51.697 -15.852 1.00 0.00 H new ATOM 0 HB1 ALA A 135 25.380 52.755 -13.624 1.00 0.00 H new ATOM 0 HB2 ALA A 135 25.832 53.889 -14.919 1.00 0.00 H new ATOM 0 HB3 ALA A 135 24.235 54.014 -14.144 1.00 0.00 H new ATOM 2157 N GLU A 136 22.501 50.944 -15.755 1.00 0.00 N ATOM 2158 CA GLU A 136 21.316 50.206 -15.323 1.00 0.00 C ATOM 2159 C GLU A 136 21.678 48.997 -14.457 1.00 0.00 C ATOM 2160 O GLU A 136 21.240 48.897 -13.310 1.00 0.00 O ATOM 2161 CB GLU A 136 20.448 49.790 -16.530 1.00 0.00 C ATOM 2162 CG GLU A 136 21.193 49.632 -17.861 1.00 0.00 C ATOM 2163 CD GLU A 136 22.182 48.483 -17.872 1.00 0.00 C ATOM 2164 OE1 GLU A 136 23.326 48.673 -17.410 1.00 0.00 O ATOM 2165 OE2 GLU A 136 21.811 47.383 -18.321 1.00 0.00 O ATOM 0 H GLU A 136 22.636 50.961 -16.766 1.00 0.00 H new ATOM 0 HA GLU A 136 20.726 50.880 -14.701 1.00 0.00 H new ATOM 0 HB2 GLU A 136 19.959 48.845 -16.294 1.00 0.00 H new ATOM 0 HB3 GLU A 136 19.661 50.532 -16.661 1.00 0.00 H new ATOM 0 HG2 GLU A 136 20.466 49.482 -18.659 1.00 0.00 H new ATOM 0 HG3 GLU A 136 21.723 50.558 -18.083 1.00 0.00 H new ATOM 2172 N ASN A 137 22.494 48.098 -14.988 1.00 0.00 N ATOM 2173 CA ASN A 137 22.894 46.903 -14.256 1.00 0.00 C ATOM 2174 C ASN A 137 23.901 47.250 -13.176 1.00 0.00 C ATOM 2175 O ASN A 137 24.031 46.535 -12.185 1.00 0.00 O ATOM 2176 CB ASN A 137 23.471 45.842 -15.194 1.00 0.00 C ATOM 2177 CG ASN A 137 22.416 44.875 -15.697 1.00 0.00 C ATOM 2178 OD1 ASN A 137 22.152 43.851 -15.068 1.00 0.00 O ATOM 2179 ND2 ASN A 137 21.808 45.183 -16.830 1.00 0.00 N ATOM 0 H ASN A 137 22.893 48.173 -15.924 1.00 0.00 H new ATOM 0 HA ASN A 137 22.001 46.490 -13.786 1.00 0.00 H new ATOM 0 HB2 ASN A 137 23.945 46.333 -16.044 1.00 0.00 H new ATOM 0 HB3 ASN A 137 24.250 45.286 -14.673 1.00 0.00 H new ATOM 0 HD21 ASN A 137 21.093 44.562 -17.210 1.00 0.00 H new ATOM 0 HD22 ASN A 137 22.054 46.041 -17.324 1.00 0.00 H new ATOM 2186 N LEU A 138 24.605 48.358 -13.364 1.00 0.00 N ATOM 2187 CA LEU A 138 25.546 48.831 -12.363 1.00 0.00 C ATOM 2188 C LEU A 138 24.781 49.192 -11.095 1.00 0.00 C ATOM 2189 O LEU A 138 25.094 48.713 -10.010 1.00 0.00 O ATOM 2190 CB LEU A 138 26.319 50.050 -12.891 1.00 0.00 C ATOM 2191 CG LEU A 138 27.706 50.297 -12.271 1.00 0.00 C ATOM 2192 CD1 LEU A 138 28.378 51.482 -12.942 1.00 0.00 C ATOM 2193 CD2 LEU A 138 27.616 50.535 -10.772 1.00 0.00 C ATOM 0 H LEU A 138 24.542 48.943 -14.197 1.00 0.00 H new ATOM 0 HA LEU A 138 26.267 48.045 -12.139 1.00 0.00 H new ATOM 0 HB2 LEU A 138 26.441 49.938 -13.968 1.00 0.00 H new ATOM 0 HB3 LEU A 138 25.709 50.939 -12.730 1.00 0.00 H new ATOM 0 HG LEU A 138 28.304 49.400 -12.434 1.00 0.00 H new ATOM 0 HD11 LEU A 138 29.358 51.646 -12.494 1.00 0.00 H new ATOM 0 HD12 LEU A 138 28.495 51.279 -14.007 1.00 0.00 H new ATOM 0 HD13 LEU A 138 27.764 52.373 -12.807 1.00 0.00 H new ATOM 0 HD21 LEU A 138 28.615 50.705 -10.370 1.00 0.00 H new ATOM 0 HD22 LEU A 138 26.993 51.408 -10.579 1.00 0.00 H new ATOM 0 HD23 LEU A 138 27.175 49.662 -10.291 1.00 0.00 H new ATOM 2205 N TYR A 139 23.749 50.011 -11.256 1.00 0.00 N ATOM 2206 CA TYR A 139 22.924 50.437 -10.136 1.00 0.00 C ATOM 2207 C TYR A 139 22.075 49.273 -9.627 1.00 0.00 C ATOM 2208 O TYR A 139 21.650 49.256 -8.478 1.00 0.00 O ATOM 2209 CB TYR A 139 22.031 51.606 -10.565 1.00 0.00 C ATOM 2210 CG TYR A 139 21.219 52.208 -9.440 1.00 0.00 C ATOM 2211 CD1 TYR A 139 21.792 53.111 -8.554 1.00 0.00 C ATOM 2212 CD2 TYR A 139 19.883 51.872 -9.265 1.00 0.00 C ATOM 2213 CE1 TYR A 139 21.055 53.662 -7.524 1.00 0.00 C ATOM 2214 CE2 TYR A 139 19.140 52.418 -8.237 1.00 0.00 C ATOM 2215 CZ TYR A 139 19.731 53.311 -7.369 1.00 0.00 C ATOM 2216 OH TYR A 139 18.994 53.859 -6.345 1.00 0.00 O ATOM 0 H TYR A 139 23.464 50.394 -12.157 1.00 0.00 H new ATOM 0 HA TYR A 139 23.571 50.768 -9.324 1.00 0.00 H new ATOM 0 HB2 TYR A 139 22.655 52.384 -11.005 1.00 0.00 H new ATOM 0 HB3 TYR A 139 21.352 51.263 -11.346 1.00 0.00 H new ATOM 0 HD1 TYR A 139 22.830 53.387 -8.672 1.00 0.00 H new ATOM 0 HD2 TYR A 139 19.418 51.173 -9.944 1.00 0.00 H new ATOM 0 HE1 TYR A 139 21.514 54.364 -6.844 1.00 0.00 H new ATOM 0 HE2 TYR A 139 18.102 52.147 -8.114 1.00 0.00 H new ATOM 0 HH TYR A 139 18.079 53.508 -6.376 1.00 0.00 H new ATOM 2226 N PHE A 140 21.839 48.299 -10.496 1.00 0.00 N ATOM 2227 CA PHE A 140 21.070 47.115 -10.132 1.00 0.00 C ATOM 2228 C PHE A 140 21.870 46.228 -9.178 1.00 0.00 C ATOM 2229 O PHE A 140 21.304 45.526 -8.343 1.00 0.00 O ATOM 2230 CB PHE A 140 20.682 46.333 -11.392 1.00 0.00 C ATOM 2231 CG PHE A 140 19.767 45.170 -11.135 1.00 0.00 C ATOM 2232 CD1 PHE A 140 18.423 45.376 -10.866 1.00 0.00 C ATOM 2233 CD2 PHE A 140 20.249 43.871 -11.165 1.00 0.00 C ATOM 2234 CE1 PHE A 140 17.578 44.309 -10.633 1.00 0.00 C ATOM 2235 CE2 PHE A 140 19.408 42.800 -10.933 1.00 0.00 C ATOM 2236 CZ PHE A 140 18.070 43.019 -10.665 1.00 0.00 C ATOM 0 H PHE A 140 22.170 48.305 -11.461 1.00 0.00 H new ATOM 0 HA PHE A 140 20.161 47.432 -9.622 1.00 0.00 H new ATOM 0 HB2 PHE A 140 20.199 47.013 -12.094 1.00 0.00 H new ATOM 0 HB3 PHE A 140 21.589 45.968 -11.874 1.00 0.00 H new ATOM 0 HD1 PHE A 140 18.032 46.382 -10.838 1.00 0.00 H new ATOM 0 HD2 PHE A 140 21.294 43.694 -11.372 1.00 0.00 H new ATOM 0 HE1 PHE A 140 16.532 44.483 -10.426 1.00 0.00 H new ATOM 0 HE2 PHE A 140 19.796 41.792 -10.961 1.00 0.00 H new ATOM 0 HZ PHE A 140 17.411 42.183 -10.481 1.00 0.00 H new ATOM 2246 N GLN A 141 23.189 46.241 -9.337 1.00 0.00 N ATOM 2247 CA GLN A 141 24.079 45.477 -8.468 1.00 0.00 C ATOM 2248 C GLN A 141 24.496 46.289 -7.242 1.00 0.00 C ATOM 2249 O GLN A 141 25.172 45.773 -6.353 1.00 0.00 O ATOM 2250 CB GLN A 141 25.316 45.020 -9.244 1.00 0.00 C ATOM 2251 CG GLN A 141 25.001 44.039 -10.363 1.00 0.00 C ATOM 2252 CD GLN A 141 24.433 42.728 -9.851 1.00 0.00 C ATOM 2253 OE1 GLN A 141 25.169 41.783 -9.578 1.00 0.00 O ATOM 2254 NE2 GLN A 141 23.118 42.664 -9.709 1.00 0.00 N ATOM 0 H GLN A 141 23.668 46.774 -10.063 1.00 0.00 H new ATOM 0 HA GLN A 141 23.532 44.601 -8.120 1.00 0.00 H new ATOM 0 HB2 GLN A 141 25.814 45.893 -9.666 1.00 0.00 H new ATOM 0 HB3 GLN A 141 26.019 44.556 -8.552 1.00 0.00 H new ATOM 0 HG2 GLN A 141 24.288 44.495 -11.050 1.00 0.00 H new ATOM 0 HG3 GLN A 141 25.909 43.839 -10.932 1.00 0.00 H new ATOM 0 HE21 GLN A 141 22.540 43.470 -9.946 1.00 0.00 H new ATOM 0 HE22 GLN A 141 22.684 41.809 -9.362 1.00 0.00 H new ATOM 2263 N SER A 142 24.113 47.560 -7.220 1.00 0.00 N ATOM 2264 CA SER A 142 24.491 48.459 -6.141 1.00 0.00 C ATOM 2265 C SER A 142 23.382 48.541 -5.086 1.00 0.00 C ATOM 2266 O SER A 142 23.343 47.665 -4.197 1.00 0.00 O ATOM 2267 CB SER A 142 24.804 49.851 -6.707 1.00 0.00 C ATOM 2268 OG SER A 142 25.091 50.776 -5.671 1.00 0.00 O ATOM 0 H SER A 142 23.537 47.992 -7.943 1.00 0.00 H new ATOM 0 HA SER A 142 25.385 48.066 -5.657 1.00 0.00 H new ATOM 0 HB2 SER A 142 25.654 49.787 -7.386 1.00 0.00 H new ATOM 0 HB3 SER A 142 23.956 50.208 -7.291 1.00 0.00 H new ATOM 0 HG SER A 142 25.288 51.653 -6.061 1.00 0.00 H new TER 2274 SER A 142