USER MOD reduce.3.24.130724 H: found=0, std=0, add=1247, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1248 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 38 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 172 LYS NZ :NH3+ -171:sc= -0.0481 (180deg=-0.162) USER MOD Set 2.1: A 143 THR OG1 : rot -34:sc= 0.311 USER MOD Set 2.2: A 144 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 23 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 130 LYS NZ :NH3+ 166:sc= 0.0409 (180deg=-0.0283) USER MOD Set 4.1: A 103 GLN : amide:sc= -0.536 K(o=-1.7,f=-6.1!) USER MOD Set 4.2: A 117 GLN : amide:sc= -1.19 K(o=-1.7,f=-7.6!) USER MOD Set 5.1: A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.2: A 90 THR OG1 : rot 39:sc= -0.877 USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.333 USER MOD Single : A 22 SER OG : rot 160:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.109) USER MOD Single : A 29 GLN : amide:sc= -3.83 K(o=-3.8,f=-9.8!) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot -64:sc= 0.134 USER MOD Single : A 45 CYS SG : rot -110:sc= -2.04 USER MOD Single : A 46 ASN : amide:sc= -0.0114 X(o=-0.011,f=-0.14) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot 100:sc= -2.81 USER MOD Single : A 49 ASN : amide:sc= -0.21 X(o=-0.21,f=0) USER MOD Single : A 50 MET CE :methyl 155:sc= -1.88 (180deg=-4.49!) USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 ASN : amide:sc= -0.302 K(o=-0.3,f=-2.2!) USER MOD Single : A 68 MET CE :methyl 174:sc= -2.55! (180deg=-2.82!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 77 SER OG : rot 180:sc= 0.0239 USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.69 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot 175:sc= -0.826! USER MOD Single : A 101 TYR OH : rot 142:sc= -1.6 USER MOD Single : A 104 ASN : amide:sc= -0.0654 K(o=-0.065,f=-0.72) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 160:sc= -0.394 USER MOD Single : A 112 GLN : amide:sc= -1.26 K(o=-1.3,f=-5.2!) USER MOD Single : A 118 MET CE :methyl -155:sc= -0.351 (180deg=-1.54) USER MOD Single : A 119 SER OG : rot -170:sc= 0 USER MOD Single : A 120 THR OG1 : rot 88:sc= -4.57! USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 GLN : amide:sc= -0.158 K(o=-0.16,f=-1.7!) USER MOD Single : A 128 GLN : amide:sc= -4.17! C(o=-4.2!,f=-6.2!) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 ASN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.09 USER MOD Single : A 139 THR OG1 : rot -160:sc= 0 USER MOD Single : A 145 ASN :FLIP amide:sc= -3.33 F(o=-5.4!,f=-3.3) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 GLN : amide:sc= -0.031 X(o=-0.031,f=-0.19) USER MOD Single : A 155 GLN : amide:sc= -0.68 K(o=-0.68,f=-1.3) USER MOD Single : A 156 ASN : amide:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 157 GLN : amide:sc= -0.135 X(o=-0.14,f=-0.016) USER MOD Single : A 160 GLN : amide:sc= -0.0217 X(o=-0.022,f=0) USER MOD Single : A 162 MET CE :methyl -158:sc= -16.8! (180deg=-20.1!) USER MOD Single : A 163 THR OG1 : rot 70:sc= 0.7 USER MOD Single : A 164 THR OG1 : rot 91:sc= 0.529 USER MOD Single : A 165 HIS : no HE2:sc= -7.96! C(o=-8!,f=-9!) USER MOD Single : A 170 SER OG : rot 180:sc= 0 USER MOD Single : A 176 GLN : amide:sc=-0.00863 X(o=-0.0086,f=-0.17) USER MOD Single : A 177 SER OG : rot 180:sc= 0.0822 USER MOD Single : A 178 SER OG : rot -80:sc= -0.0628 USER MOD Single : A 184 GLN : amide:sc= -1.15 K(o=-1.2,f=-4.2!) USER MOD Single : A 185 MET CE :methyl -111:sc= -0.266 (180deg=-3.7!) USER MOD ----------------------------------------------------------------- ATOM 20 N THR A 21 20.123 11.448 0.780 1.00 0.33 N ATOM 21 CA THR A 21 20.427 10.356 -0.187 1.00 0.37 C ATOM 22 C THR A 21 19.131 9.861 -0.832 1.00 0.32 C ATOM 23 O THR A 21 18.046 10.223 -0.427 1.00 0.28 O ATOM 24 CB THR A 21 21.107 9.197 0.547 1.00 0.38 C ATOM 25 OG1 THR A 21 21.238 8.094 -0.337 1.00 0.64 O ATOM 26 CG2 THR A 21 20.262 8.789 1.755 1.00 0.45 C ATOM 0 HA THR A 21 21.092 10.737 -0.962 1.00 0.37 H new ATOM 0 HB THR A 21 22.094 9.510 0.888 1.00 0.38 H new ATOM 0 HG1 THR A 21 21.675 7.351 0.130 1.00 0.64 H new ATOM 0 HG21 THR A 21 20.747 7.964 2.276 1.00 0.45 H new ATOM 0 HG22 THR A 21 20.162 9.637 2.432 1.00 0.45 H new ATOM 0 HG23 THR A 21 19.274 8.475 1.418 1.00 0.45 H new ATOM 34 N SER A 22 19.239 9.036 -1.839 1.00 0.33 N ATOM 35 CA SER A 22 18.017 8.518 -2.517 1.00 0.30 C ATOM 36 C SER A 22 17.109 7.824 -1.499 1.00 0.32 C ATOM 37 O SER A 22 15.925 7.664 -1.720 1.00 0.60 O ATOM 38 CB SER A 22 18.424 7.515 -3.597 1.00 0.37 C ATOM 39 OG SER A 22 17.299 7.229 -4.417 1.00 1.71 O ATOM 0 H SER A 22 20.122 8.698 -2.221 1.00 0.33 H new ATOM 0 HA SER A 22 17.478 9.351 -2.969 1.00 0.30 H new ATOM 0 HB2 SER A 22 19.235 7.922 -4.201 1.00 0.37 H new ATOM 0 HB3 SER A 22 18.797 6.599 -3.138 1.00 0.37 H new ATOM 0 HG SER A 22 17.603 6.861 -5.273 1.00 1.71 H new ATOM 45 N SER A 23 17.650 7.408 -0.386 1.00 0.07 N ATOM 46 CA SER A 23 16.810 6.723 0.636 1.00 0.13 C ATOM 47 C SER A 23 16.089 7.767 1.490 1.00 0.22 C ATOM 48 O SER A 23 14.881 7.760 1.602 1.00 0.11 O ATOM 49 CB SER A 23 17.697 5.858 1.529 1.00 0.26 C ATOM 50 OG SER A 23 16.880 5.012 2.326 1.00 0.56 O ATOM 0 H SER A 23 18.635 7.513 -0.141 1.00 0.07 H new ATOM 0 HA SER A 23 16.074 6.093 0.136 1.00 0.13 H new ATOM 0 HB2 SER A 23 18.373 5.259 0.919 1.00 0.26 H new ATOM 0 HB3 SER A 23 18.317 6.489 2.166 1.00 0.26 H new ATOM 0 HG SER A 23 17.447 4.455 2.899 1.00 0.56 H new ATOM 56 N GLU A 24 16.813 8.669 2.090 1.00 0.49 N ATOM 57 CA GLU A 24 16.150 9.710 2.927 1.00 0.63 C ATOM 58 C GLU A 24 15.085 10.422 2.091 1.00 0.62 C ATOM 59 O GLU A 24 14.140 10.977 2.613 1.00 0.71 O ATOM 60 CB GLU A 24 17.196 10.717 3.405 1.00 0.86 C ATOM 61 CG GLU A 24 17.411 10.551 4.912 1.00 1.46 C ATOM 62 CD GLU A 24 18.504 9.507 5.164 1.00 2.91 C ATOM 63 OE1 GLU A 24 18.840 8.792 4.234 1.00 3.92 O ATOM 64 OE2 GLU A 24 18.983 9.440 6.283 1.00 3.37 O ATOM 0 H GLU A 24 17.830 8.732 2.039 1.00 0.49 H new ATOM 0 HA GLU A 24 15.679 9.246 3.793 1.00 0.63 H new ATOM 0 HB2 GLU A 24 18.135 10.563 2.873 1.00 0.86 H new ATOM 0 HB3 GLU A 24 16.867 11.732 3.183 1.00 0.86 H new ATOM 0 HG2 GLU A 24 17.696 11.505 5.356 1.00 1.46 H new ATOM 0 HG3 GLU A 24 16.482 10.242 5.390 1.00 1.46 H new ATOM 71 N ARG A 25 15.223 10.394 0.793 1.00 0.57 N ATOM 72 CA ARG A 25 14.212 11.053 -0.078 1.00 0.62 C ATOM 73 C ARG A 25 13.056 10.079 -0.315 1.00 0.45 C ATOM 74 O ARG A 25 11.908 10.469 -0.401 1.00 0.56 O ATOM 75 CB ARG A 25 14.851 11.425 -1.416 1.00 0.72 C ATOM 76 CG ARG A 25 14.241 12.732 -1.924 1.00 0.76 C ATOM 77 CD ARG A 25 13.084 12.419 -2.873 1.00 2.17 C ATOM 78 NE ARG A 25 13.404 12.935 -4.232 1.00 2.15 N ATOM 79 CZ ARG A 25 12.694 13.903 -4.746 1.00 2.96 C ATOM 80 NH1 ARG A 25 12.891 15.132 -4.357 1.00 2.74 N ATOM 81 NH2 ARG A 25 11.785 13.641 -5.645 1.00 4.24 N ATOM 0 H ARG A 25 15.993 9.943 0.299 1.00 0.57 H new ATOM 0 HA ARG A 25 13.842 11.958 0.404 1.00 0.62 H new ATOM 0 HB2 ARG A 25 15.929 11.535 -1.299 1.00 0.72 H new ATOM 0 HB3 ARG A 25 14.689 10.629 -2.143 1.00 0.72 H new ATOM 0 HG2 ARG A 25 13.886 13.330 -1.085 1.00 0.76 H new ATOM 0 HG3 ARG A 25 14.998 13.323 -2.439 1.00 0.76 H new ATOM 0 HD2 ARG A 25 12.912 11.343 -2.912 1.00 2.17 H new ATOM 0 HD3 ARG A 25 12.165 12.876 -2.506 1.00 2.17 H new ATOM 0 HE ARG A 25 14.177 12.533 -4.762 1.00 2.15 H new ATOM 0 HH11 ARG A 25 13.599 15.336 -3.652 1.00 2.74 H new ATOM 0 HH12 ARG A 25 12.337 15.889 -4.758 1.00 2.74 H new ATOM 0 HH21 ARG A 25 11.629 12.679 -5.947 1.00 4.24 H new ATOM 0 HH22 ARG A 25 11.231 14.398 -6.046 1.00 4.24 H new ATOM 95 N ILE A 26 13.353 8.811 -0.419 1.00 0.23 N ATOM 96 CA ILE A 26 12.272 7.811 -0.648 1.00 0.25 C ATOM 97 C ILE A 26 11.288 7.853 0.532 1.00 0.18 C ATOM 98 O ILE A 26 10.114 7.572 0.391 1.00 0.23 O ATOM 99 CB ILE A 26 12.900 6.409 -0.818 1.00 0.37 C ATOM 100 CG1 ILE A 26 11.933 5.519 -1.599 1.00 1.40 C ATOM 101 CG2 ILE A 26 13.205 5.756 0.537 1.00 1.46 C ATOM 102 CD1 ILE A 26 12.723 4.561 -2.494 1.00 0.57 C ATOM 0 H ILE A 26 14.295 8.426 -0.355 1.00 0.23 H new ATOM 0 HA ILE A 26 11.720 8.045 -1.559 1.00 0.25 H new ATOM 0 HB ILE A 26 13.840 6.522 -1.358 1.00 0.37 H new ATOM 0 HG12 ILE A 26 11.306 4.954 -0.909 1.00 1.40 H new ATOM 0 HG13 ILE A 26 11.267 6.133 -2.205 1.00 1.40 H new ATOM 0 HG21 ILE A 26 13.645 4.772 0.376 1.00 1.46 H new ATOM 0 HG22 ILE A 26 13.905 6.380 1.092 1.00 1.46 H new ATOM 0 HG23 ILE A 26 12.282 5.651 1.107 1.00 1.46 H new ATOM 0 HD11 ILE A 26 12.031 3.928 -3.049 1.00 0.57 H new ATOM 0 HD12 ILE A 26 13.331 5.135 -3.193 1.00 0.57 H new ATOM 0 HD13 ILE A 26 13.370 3.937 -1.877 1.00 0.57 H new ATOM 114 N ASP A 27 11.766 8.222 1.690 1.00 0.15 N ATOM 115 CA ASP A 27 10.876 8.305 2.880 1.00 0.14 C ATOM 116 C ASP A 27 9.913 9.479 2.692 1.00 0.09 C ATOM 117 O ASP A 27 8.732 9.386 2.977 1.00 0.07 O ATOM 118 CB ASP A 27 11.733 8.531 4.128 1.00 0.15 C ATOM 119 CG ASP A 27 10.831 8.724 5.350 1.00 0.33 C ATOM 120 OD1 ASP A 27 10.081 9.686 5.361 1.00 0.51 O ATOM 121 OD2 ASP A 27 10.908 7.908 6.253 1.00 1.05 O ATOM 0 H ASP A 27 12.740 8.470 1.862 1.00 0.15 H new ATOM 0 HA ASP A 27 10.308 7.382 2.995 1.00 0.14 H new ATOM 0 HB2 ASP A 27 12.395 7.679 4.284 1.00 0.15 H new ATOM 0 HB3 ASP A 27 12.367 9.407 3.991 1.00 0.15 H new ATOM 126 N LYS A 28 10.406 10.580 2.196 1.00 0.08 N ATOM 127 CA LYS A 28 9.528 11.755 1.968 1.00 0.06 C ATOM 128 C LYS A 28 8.568 11.426 0.817 1.00 0.15 C ATOM 129 O LYS A 28 7.497 11.989 0.711 1.00 0.22 O ATOM 130 CB LYS A 28 10.403 12.968 1.617 1.00 0.07 C ATOM 131 CG LYS A 28 9.540 14.114 1.081 1.00 0.86 C ATOM 132 CD LYS A 28 9.628 14.133 -0.444 1.00 1.60 C ATOM 133 CE LYS A 28 9.278 15.530 -0.965 1.00 2.07 C ATOM 134 NZ LYS A 28 7.866 15.853 -0.616 1.00 2.03 N ATOM 0 H LYS A 28 11.384 10.714 1.939 1.00 0.08 H new ATOM 0 HA LYS A 28 8.948 11.989 2.861 1.00 0.06 H new ATOM 0 HB2 LYS A 28 10.949 13.298 2.501 1.00 0.07 H new ATOM 0 HB3 LYS A 28 11.146 12.685 0.871 1.00 0.07 H new ATOM 0 HG2 LYS A 28 8.505 13.985 1.397 1.00 0.86 H new ATOM 0 HG3 LYS A 28 9.881 15.065 1.490 1.00 0.86 H new ATOM 0 HD2 LYS A 28 10.633 13.857 -0.763 1.00 1.60 H new ATOM 0 HD3 LYS A 28 8.945 13.396 -0.866 1.00 1.60 H new ATOM 0 HE2 LYS A 28 9.949 16.270 -0.530 1.00 2.07 H new ATOM 0 HE3 LYS A 28 9.415 15.571 -2.046 1.00 2.07 H new ATOM 0 HZ1 LYS A 28 7.576 16.721 -1.111 1.00 2.03 H new ATOM 0 HZ2 LYS A 28 7.249 15.067 -0.904 1.00 2.03 H new ATOM 0 HZ3 LYS A 28 7.786 15.997 0.411 1.00 2.03 H new ATOM 148 N GLN A 29 8.944 10.510 -0.039 1.00 0.16 N ATOM 149 CA GLN A 29 8.051 10.138 -1.171 1.00 0.24 C ATOM 150 C GLN A 29 6.822 9.415 -0.620 1.00 0.21 C ATOM 151 O GLN A 29 5.703 9.684 -1.024 1.00 0.28 O ATOM 152 CB GLN A 29 8.800 9.219 -2.139 1.00 0.27 C ATOM 153 CG GLN A 29 9.961 9.985 -2.776 1.00 1.13 C ATOM 154 CD GLN A 29 9.900 9.830 -4.297 1.00 1.44 C ATOM 155 OE1 GLN A 29 8.843 9.934 -4.887 1.00 1.22 O ATOM 156 NE2 GLN A 29 10.996 9.586 -4.960 1.00 2.62 N ATOM 0 H GLN A 29 9.830 10.006 -0.001 1.00 0.16 H new ATOM 0 HA GLN A 29 7.740 11.037 -1.704 1.00 0.24 H new ATOM 0 HB2 GLN A 29 9.175 8.344 -1.609 1.00 0.27 H new ATOM 0 HB3 GLN A 29 8.122 8.857 -2.912 1.00 0.27 H new ATOM 0 HG2 GLN A 29 9.908 11.039 -2.505 1.00 1.13 H new ATOM 0 HG3 GLN A 29 10.911 9.606 -2.399 1.00 1.13 H new ATOM 0 HE21 GLN A 29 11.883 9.499 -4.464 1.00 2.62 H new ATOM 0 HE22 GLN A 29 10.966 9.482 -5.974 1.00 2.62 H new ATOM 165 N ILE A 30 7.003 8.510 0.310 1.00 0.20 N ATOM 166 CA ILE A 30 5.813 7.815 0.871 1.00 0.27 C ATOM 167 C ILE A 30 4.992 8.841 1.642 1.00 0.32 C ATOM 168 O ILE A 30 3.789 8.758 1.701 1.00 0.36 O ATOM 169 CB ILE A 30 6.215 6.674 1.806 1.00 0.33 C ATOM 170 CG1 ILE A 30 7.052 5.647 1.029 1.00 0.46 C ATOM 171 CG2 ILE A 30 4.945 6.010 2.340 1.00 0.48 C ATOM 172 CD1 ILE A 30 7.244 4.377 1.869 1.00 0.74 C ATOM 0 H ILE A 30 7.905 8.229 0.696 1.00 0.20 H new ATOM 0 HA ILE A 30 5.236 7.380 0.055 1.00 0.27 H new ATOM 0 HB ILE A 30 6.807 7.059 2.636 1.00 0.33 H new ATOM 0 HG12 ILE A 30 6.557 5.399 0.090 1.00 0.46 H new ATOM 0 HG13 ILE A 30 8.022 6.074 0.775 1.00 0.46 H new ATOM 0 HG21 ILE A 30 5.215 5.193 3.009 1.00 0.48 H new ATOM 0 HG22 ILE A 30 4.352 6.744 2.885 1.00 0.48 H new ATOM 0 HG23 ILE A 30 4.361 5.618 1.507 1.00 0.48 H new ATOM 0 HD11 ILE A 30 7.839 3.656 1.308 1.00 0.74 H new ATOM 0 HD12 ILE A 30 7.759 4.629 2.796 1.00 0.74 H new ATOM 0 HD13 ILE A 30 6.271 3.943 2.100 1.00 0.74 H new ATOM 184 N ARG A 31 5.633 9.830 2.216 1.00 0.35 N ATOM 185 CA ARG A 31 4.872 10.879 2.956 1.00 0.43 C ATOM 186 C ARG A 31 3.770 11.409 2.035 1.00 0.40 C ATOM 187 O ARG A 31 2.702 11.797 2.468 1.00 0.41 O ATOM 188 CB ARG A 31 5.820 12.016 3.342 1.00 0.56 C ATOM 189 CG ARG A 31 5.138 12.921 4.365 1.00 0.67 C ATOM 190 CD ARG A 31 6.173 13.860 4.987 1.00 1.13 C ATOM 191 NE ARG A 31 5.834 15.271 4.649 1.00 1.84 N ATOM 192 CZ ARG A 31 4.881 15.886 5.294 1.00 1.47 C ATOM 193 NH1 ARG A 31 5.089 16.322 6.507 1.00 1.22 N ATOM 194 NH2 ARG A 31 3.721 16.068 4.725 1.00 2.38 N ATOM 0 H ARG A 31 6.645 9.954 2.203 1.00 0.35 H new ATOM 0 HA ARG A 31 4.432 10.464 3.863 1.00 0.43 H new ATOM 0 HB2 ARG A 31 6.742 11.610 3.757 1.00 0.56 H new ATOM 0 HB3 ARG A 31 6.095 12.591 2.458 1.00 0.56 H new ATOM 0 HG2 ARG A 31 4.349 13.500 3.885 1.00 0.67 H new ATOM 0 HG3 ARG A 31 4.665 12.319 5.141 1.00 0.67 H new ATOM 0 HD2 ARG A 31 6.194 13.729 6.069 1.00 1.13 H new ATOM 0 HD3 ARG A 31 7.169 13.616 4.617 1.00 1.13 H new ATOM 0 HE ARG A 31 6.347 15.756 3.913 1.00 1.84 H new ATOM 0 HH11 ARG A 31 5.997 16.182 6.951 1.00 1.22 H new ATOM 0 HH12 ARG A 31 4.344 16.803 7.011 1.00 1.22 H new ATOM 0 HH21 ARG A 31 3.560 15.730 3.776 1.00 2.38 H new ATOM 0 HH22 ARG A 31 2.976 16.549 5.229 1.00 2.38 H new ATOM 208 N TYR A 32 4.026 11.387 0.755 1.00 0.37 N ATOM 209 CA TYR A 32 3.016 11.844 -0.232 1.00 0.36 C ATOM 210 C TYR A 32 2.001 10.718 -0.417 1.00 0.28 C ATOM 211 O TYR A 32 0.812 10.944 -0.518 1.00 0.23 O ATOM 212 CB TYR A 32 3.712 12.126 -1.565 1.00 0.38 C ATOM 213 CG TYR A 32 3.378 13.518 -2.037 1.00 0.37 C ATOM 214 CD1 TYR A 32 3.967 14.625 -1.416 1.00 1.70 C ATOM 215 CD2 TYR A 32 2.487 13.702 -3.099 1.00 1.21 C ATOM 216 CE1 TYR A 32 3.665 15.917 -1.857 1.00 1.96 C ATOM 217 CE2 TYR A 32 2.183 14.994 -3.541 1.00 0.97 C ATOM 218 CZ TYR A 32 2.773 16.103 -2.921 1.00 0.75 C ATOM 219 OH TYR A 32 2.475 17.377 -3.355 1.00 0.99 O ATOM 0 H TYR A 32 4.905 11.067 0.350 1.00 0.37 H new ATOM 0 HA TYR A 32 2.520 12.751 0.113 1.00 0.36 H new ATOM 0 HB2 TYR A 32 4.791 12.021 -1.451 1.00 0.38 H new ATOM 0 HB3 TYR A 32 3.398 11.395 -2.310 1.00 0.38 H new ATOM 0 HD1 TYR A 32 4.655 14.481 -0.596 1.00 1.70 H new ATOM 0 HD2 TYR A 32 2.034 12.847 -3.578 1.00 1.21 H new ATOM 0 HE1 TYR A 32 4.119 16.771 -1.377 1.00 1.96 H new ATOM 0 HE2 TYR A 32 1.494 15.136 -4.360 1.00 0.97 H new ATOM 0 HH TYR A 32 1.841 17.329 -4.101 1.00 0.99 H new ATOM 229 N ILE A 33 2.473 9.498 -0.459 1.00 0.29 N ATOM 230 CA ILE A 33 1.549 8.341 -0.636 1.00 0.23 C ATOM 231 C ILE A 33 0.427 8.413 0.407 1.00 0.24 C ATOM 232 O ILE A 33 -0.730 8.247 0.092 1.00 0.24 O ATOM 233 CB ILE A 33 2.322 7.030 -0.464 1.00 0.18 C ATOM 234 CG1 ILE A 33 3.397 6.928 -1.549 1.00 0.21 C ATOM 235 CG2 ILE A 33 1.360 5.847 -0.598 1.00 0.07 C ATOM 236 CD1 ILE A 33 4.171 5.619 -1.382 1.00 0.18 C ATOM 0 H ILE A 33 3.460 9.255 -0.378 1.00 0.29 H new ATOM 0 HA ILE A 33 1.118 8.377 -1.636 1.00 0.23 H new ATOM 0 HB ILE A 33 2.789 7.012 0.521 1.00 0.18 H new ATOM 0 HG12 ILE A 33 2.937 6.967 -2.536 1.00 0.21 H new ATOM 0 HG13 ILE A 33 4.078 7.776 -1.481 1.00 0.21 H new ATOM 0 HG21 ILE A 33 1.911 4.914 -0.476 1.00 0.07 H new ATOM 0 HG22 ILE A 33 0.589 5.916 0.169 1.00 0.07 H new ATOM 0 HG23 ILE A 33 0.894 5.867 -1.583 1.00 0.07 H new ATOM 0 HD11 ILE A 33 4.936 5.548 -2.155 1.00 0.18 H new ATOM 0 HD12 ILE A 33 4.644 5.599 -0.400 1.00 0.18 H new ATOM 0 HD13 ILE A 33 3.485 4.777 -1.472 1.00 0.18 H new ATOM 248 N LEU A 34 0.765 8.661 1.644 1.00 0.25 N ATOM 249 CA LEU A 34 -0.273 8.746 2.708 1.00 0.27 C ATOM 250 C LEU A 34 -1.097 10.018 2.511 1.00 0.32 C ATOM 251 O LEU A 34 -2.302 10.010 2.651 1.00 0.33 O ATOM 252 CB LEU A 34 0.406 8.787 4.080 1.00 0.27 C ATOM 253 CG LEU A 34 -0.008 7.564 4.898 1.00 0.46 C ATOM 254 CD1 LEU A 34 0.655 6.316 4.316 1.00 0.91 C ATOM 255 CD2 LEU A 34 0.440 7.744 6.351 1.00 0.37 C ATOM 0 H LEU A 34 1.722 8.809 1.964 1.00 0.25 H new ATOM 0 HA LEU A 34 -0.926 7.875 2.651 1.00 0.27 H new ATOM 0 HB2 LEU A 34 1.489 8.806 3.960 1.00 0.27 H new ATOM 0 HB3 LEU A 34 0.128 9.700 4.607 1.00 0.27 H new ATOM 0 HG LEU A 34 -1.092 7.454 4.862 1.00 0.46 H new ATOM 0 HD11 LEU A 34 0.361 5.443 4.898 1.00 0.91 H new ATOM 0 HD12 LEU A 34 0.339 6.185 3.281 1.00 0.91 H new ATOM 0 HD13 LEU A 34 1.739 6.429 4.353 1.00 0.91 H new ATOM 0 HD21 LEU A 34 0.144 6.872 6.934 1.00 0.37 H new ATOM 0 HD22 LEU A 34 1.524 7.854 6.387 1.00 0.37 H new ATOM 0 HD23 LEU A 34 -0.029 8.635 6.769 1.00 0.37 H new ATOM 267 N ASP A 35 -0.459 11.116 2.173 1.00 0.35 N ATOM 268 CA ASP A 35 -1.220 12.383 1.953 1.00 0.40 C ATOM 269 C ASP A 35 -2.361 12.093 0.983 1.00 0.34 C ATOM 270 O ASP A 35 -3.422 12.681 1.049 1.00 0.35 O ATOM 271 CB ASP A 35 -0.296 13.448 1.358 1.00 0.47 C ATOM 272 CG ASP A 35 -0.070 14.559 2.386 1.00 0.48 C ATOM 273 OD1 ASP A 35 0.090 14.238 3.551 1.00 1.15 O ATOM 274 OD2 ASP A 35 -0.061 15.713 1.988 1.00 0.80 O ATOM 0 H ASP A 35 0.550 11.186 2.041 1.00 0.35 H new ATOM 0 HA ASP A 35 -1.614 12.752 2.900 1.00 0.40 H new ATOM 0 HB2 ASP A 35 0.657 13.001 1.074 1.00 0.47 H new ATOM 0 HB3 ASP A 35 -0.737 13.861 0.451 1.00 0.47 H new ATOM 279 N GLY A 36 -2.149 11.158 0.103 1.00 0.26 N ATOM 280 CA GLY A 36 -3.213 10.782 -0.855 1.00 0.20 C ATOM 281 C GLY A 36 -4.230 9.915 -0.117 1.00 0.14 C ATOM 282 O GLY A 36 -5.412 10.176 -0.128 1.00 0.11 O ATOM 0 H GLY A 36 -1.277 10.637 0.008 1.00 0.26 H new ATOM 0 HA2 GLY A 36 -3.694 11.673 -1.259 1.00 0.20 H new ATOM 0 HA3 GLY A 36 -2.790 10.238 -1.699 1.00 0.20 H new ATOM 286 N ILE A 37 -3.761 8.884 0.531 1.00 0.19 N ATOM 287 CA ILE A 37 -4.670 7.970 1.284 1.00 0.17 C ATOM 288 C ILE A 37 -5.573 8.752 2.245 1.00 0.19 C ATOM 289 O ILE A 37 -6.594 8.252 2.674 1.00 0.25 O ATOM 290 CB ILE A 37 -3.844 6.969 2.091 1.00 0.24 C ATOM 291 CG1 ILE A 37 -2.928 6.177 1.150 1.00 0.25 C ATOM 292 CG2 ILE A 37 -4.795 6.009 2.810 1.00 0.23 C ATOM 293 CD1 ILE A 37 -3.771 5.363 0.171 1.00 0.13 C ATOM 0 H ILE A 37 -2.773 8.632 0.572 1.00 0.19 H new ATOM 0 HA ILE A 37 -5.295 7.449 0.559 1.00 0.17 H new ATOM 0 HB ILE A 37 -3.231 7.499 2.820 1.00 0.24 H new ATOM 0 HG12 ILE A 37 -2.276 6.859 0.603 1.00 0.25 H new ATOM 0 HG13 ILE A 37 -2.284 5.514 1.728 1.00 0.25 H new ATOM 0 HG21 ILE A 37 -4.216 5.290 3.389 1.00 0.23 H new ATOM 0 HG22 ILE A 37 -5.446 6.574 3.478 1.00 0.23 H new ATOM 0 HG23 ILE A 37 -5.401 5.479 2.075 1.00 0.23 H new ATOM 0 HD11 ILE A 37 -3.115 4.802 -0.495 1.00 0.13 H new ATOM 0 HD12 ILE A 37 -4.404 4.670 0.725 1.00 0.13 H new ATOM 0 HD13 ILE A 37 -4.396 6.035 -0.417 1.00 0.13 H new ATOM 305 N SER A 38 -5.229 9.965 2.590 1.00 0.21 N ATOM 306 CA SER A 38 -6.103 10.734 3.513 1.00 0.22 C ATOM 307 C SER A 38 -7.361 11.096 2.746 1.00 0.17 C ATOM 308 O SER A 38 -8.473 10.887 3.197 1.00 0.21 O ATOM 309 CB SER A 38 -5.390 12.009 3.972 1.00 0.25 C ATOM 310 OG SER A 38 -4.862 11.809 5.277 1.00 0.86 O ATOM 0 H SER A 38 -4.389 10.449 2.274 1.00 0.21 H new ATOM 0 HA SER A 38 -6.343 10.143 4.397 1.00 0.22 H new ATOM 0 HB2 SER A 38 -4.588 12.261 3.278 1.00 0.25 H new ATOM 0 HB3 SER A 38 -6.086 12.848 3.974 1.00 0.25 H new ATOM 0 HG SER A 38 -4.403 12.623 5.573 1.00 0.86 H new ATOM 316 N ALA A 39 -7.187 11.607 1.564 1.00 0.16 N ATOM 317 CA ALA A 39 -8.360 11.954 0.742 1.00 0.21 C ATOM 318 C ALA A 39 -8.963 10.665 0.183 1.00 0.21 C ATOM 319 O ALA A 39 -10.074 10.651 -0.309 1.00 0.26 O ATOM 320 CB ALA A 39 -7.935 12.871 -0.405 1.00 0.26 C ATOM 0 H ALA A 39 -6.281 11.797 1.136 1.00 0.16 H new ATOM 0 HA ALA A 39 -9.100 12.475 1.350 1.00 0.21 H new ATOM 0 HB1 ALA A 39 -8.806 13.125 -1.010 1.00 0.26 H new ATOM 0 HB2 ALA A 39 -7.497 13.783 0.001 1.00 0.26 H new ATOM 0 HB3 ALA A 39 -7.199 12.360 -1.025 1.00 0.26 H new ATOM 326 N LEU A 40 -8.240 9.574 0.261 1.00 0.19 N ATOM 327 CA LEU A 40 -8.777 8.293 -0.259 1.00 0.19 C ATOM 328 C LEU A 40 -9.325 7.451 0.892 1.00 0.23 C ATOM 329 O LEU A 40 -9.916 6.418 0.675 1.00 0.24 O ATOM 330 CB LEU A 40 -7.672 7.512 -0.965 1.00 0.20 C ATOM 331 CG LEU A 40 -6.952 8.423 -1.955 1.00 0.30 C ATOM 332 CD1 LEU A 40 -5.601 7.810 -2.316 1.00 0.46 C ATOM 333 CD2 LEU A 40 -7.799 8.567 -3.216 1.00 0.15 C ATOM 0 H LEU A 40 -7.304 9.522 0.663 1.00 0.19 H new ATOM 0 HA LEU A 40 -9.578 8.512 -0.965 1.00 0.19 H new ATOM 0 HB2 LEU A 40 -6.964 7.122 -0.233 1.00 0.20 H new ATOM 0 HB3 LEU A 40 -8.096 6.654 -1.487 1.00 0.20 H new ATOM 0 HG LEU A 40 -6.798 9.404 -1.506 1.00 0.30 H new ATOM 0 HD11 LEU A 40 -5.084 8.459 -3.023 1.00 0.46 H new ATOM 0 HD12 LEU A 40 -4.998 7.703 -1.415 1.00 0.46 H new ATOM 0 HD13 LEU A 40 -5.755 6.830 -2.768 1.00 0.46 H new ATOM 0 HD21 LEU A 40 -7.287 9.217 -3.926 1.00 0.15 H new ATOM 0 HD22 LEU A 40 -7.950 7.586 -3.667 1.00 0.15 H new ATOM 0 HD23 LEU A 40 -8.765 9.001 -2.958 1.00 0.15 H new ATOM 345 N ARG A 41 -9.144 7.877 2.114 1.00 0.31 N ATOM 346 CA ARG A 41 -9.671 7.077 3.253 1.00 0.42 C ATOM 347 C ARG A 41 -10.600 7.938 4.111 1.00 0.46 C ATOM 348 O ARG A 41 -11.110 7.492 5.119 1.00 0.59 O ATOM 349 CB ARG A 41 -8.513 6.563 4.106 1.00 0.48 C ATOM 350 CG ARG A 41 -8.949 5.279 4.810 1.00 0.67 C ATOM 351 CD ARG A 41 -7.793 4.742 5.657 1.00 0.79 C ATOM 352 NE ARG A 41 -8.334 3.873 6.739 1.00 1.24 N ATOM 353 CZ ARG A 41 -8.282 4.266 7.982 1.00 0.81 C ATOM 354 NH1 ARG A 41 -9.083 5.205 8.405 1.00 0.62 N ATOM 355 NH2 ARG A 41 -7.426 3.723 8.803 1.00 1.69 N ATOM 0 H ARG A 41 -8.658 8.737 2.369 1.00 0.31 H new ATOM 0 HA ARG A 41 -10.232 6.229 2.860 1.00 0.42 H new ATOM 0 HB2 ARG A 41 -7.640 6.373 3.481 1.00 0.48 H new ATOM 0 HB3 ARG A 41 -8.222 7.315 4.839 1.00 0.48 H new ATOM 0 HG2 ARG A 41 -9.816 5.474 5.441 1.00 0.67 H new ATOM 0 HG3 ARG A 41 -9.252 4.534 4.075 1.00 0.67 H new ATOM 0 HD2 ARG A 41 -7.102 4.176 5.032 1.00 0.79 H new ATOM 0 HD3 ARG A 41 -7.229 5.569 6.088 1.00 0.79 H new ATOM 0 HE ARG A 41 -8.746 2.969 6.508 1.00 1.24 H new ATOM 0 HH11 ARG A 41 -9.751 5.633 7.764 1.00 0.62 H new ATOM 0 HH12 ARG A 41 -9.041 5.511 9.377 1.00 0.62 H new ATOM 0 HH21 ARG A 41 -6.797 2.991 8.473 1.00 1.69 H new ATOM 0 HH22 ARG A 41 -7.386 4.031 9.775 1.00 1.69 H new ATOM 369 N LYS A 42 -10.840 9.160 3.726 1.00 0.35 N ATOM 370 CA LYS A 42 -11.756 10.007 4.528 1.00 0.41 C ATOM 371 C LYS A 42 -13.184 9.724 4.075 1.00 0.50 C ATOM 372 O LYS A 42 -14.096 9.600 4.874 1.00 0.61 O ATOM 373 CB LYS A 42 -11.423 11.483 4.294 1.00 0.35 C ATOM 374 CG LYS A 42 -11.153 12.166 5.636 1.00 1.10 C ATOM 375 CD LYS A 42 -9.683 11.979 6.017 1.00 2.77 C ATOM 376 CE LYS A 42 -9.453 12.502 7.438 1.00 3.35 C ATOM 377 NZ LYS A 42 -8.013 12.361 7.800 1.00 4.82 N ATOM 0 H LYS A 42 -10.444 9.603 2.897 1.00 0.35 H new ATOM 0 HA LYS A 42 -11.647 9.785 5.590 1.00 0.41 H new ATOM 0 HB2 LYS A 42 -10.550 11.571 3.647 1.00 0.35 H new ATOM 0 HB3 LYS A 42 -12.250 11.976 3.783 1.00 0.35 H new ATOM 0 HG2 LYS A 42 -11.390 13.228 5.570 1.00 1.10 H new ATOM 0 HG3 LYS A 42 -11.796 11.743 6.407 1.00 1.10 H new ATOM 0 HD2 LYS A 42 -9.412 10.925 5.958 1.00 2.77 H new ATOM 0 HD3 LYS A 42 -9.043 12.512 5.314 1.00 2.77 H new ATOM 0 HE2 LYS A 42 -9.754 13.548 7.504 1.00 3.35 H new ATOM 0 HE3 LYS A 42 -10.071 11.948 8.144 1.00 3.35 H new ATOM 0 HZ1 LYS A 42 -7.861 12.717 8.765 1.00 4.82 H new ATOM 0 HZ2 LYS A 42 -7.740 11.359 7.754 1.00 4.82 H new ATOM 0 HZ3 LYS A 42 -7.432 12.909 7.134 1.00 4.82 H new ATOM 391 N GLU A 43 -13.379 9.600 2.792 1.00 0.48 N ATOM 392 CA GLU A 43 -14.731 9.317 2.264 1.00 0.58 C ATOM 393 C GLU A 43 -15.000 7.820 2.355 1.00 0.64 C ATOM 394 O GLU A 43 -15.977 7.392 2.948 1.00 0.84 O ATOM 395 CB GLU A 43 -14.802 9.758 0.798 1.00 0.56 C ATOM 396 CG GLU A 43 -16.255 9.727 0.323 1.00 1.16 C ATOM 397 CD GLU A 43 -16.621 11.077 -0.299 1.00 0.64 C ATOM 398 OE1 GLU A 43 -16.233 11.309 -1.431 1.00 0.62 O ATOM 399 OE2 GLU A 43 -17.283 11.854 0.369 1.00 1.78 O ATOM 0 H GLU A 43 -12.649 9.684 2.085 1.00 0.48 H new ATOM 0 HA GLU A 43 -15.476 9.860 2.846 1.00 0.58 H new ATOM 0 HB2 GLU A 43 -14.395 10.763 0.690 1.00 0.56 H new ATOM 0 HB3 GLU A 43 -14.192 9.099 0.180 1.00 0.56 H new ATOM 0 HG2 GLU A 43 -16.392 8.930 -0.407 1.00 1.16 H new ATOM 0 HG3 GLU A 43 -16.917 9.510 1.161 1.00 1.16 H new ATOM 406 N THR A 44 -14.141 7.027 1.757 1.00 0.46 N ATOM 407 CA THR A 44 -14.336 5.552 1.775 1.00 0.53 C ATOM 408 C THR A 44 -13.739 4.935 3.042 1.00 0.77 C ATOM 409 O THR A 44 -12.910 4.051 2.990 1.00 1.06 O ATOM 410 CB THR A 44 -13.690 4.927 0.532 1.00 0.28 C ATOM 411 OG1 THR A 44 -14.066 3.560 0.442 1.00 0.42 O ATOM 412 CG2 THR A 44 -12.168 5.032 0.619 1.00 0.33 C ATOM 0 H THR A 44 -13.311 7.345 1.257 1.00 0.46 H new ATOM 0 HA THR A 44 -15.406 5.347 1.769 1.00 0.53 H new ATOM 0 HB THR A 44 -14.032 5.463 -0.354 1.00 0.28 H new ATOM 0 HG1 THR A 44 -13.712 3.072 1.215 1.00 0.42 H new ATOM 0 HG21 THR A 44 -11.721 4.585 -0.269 1.00 0.33 H new ATOM 0 HG22 THR A 44 -11.879 6.081 0.682 1.00 0.33 H new ATOM 0 HG23 THR A 44 -11.817 4.505 1.506 1.00 0.33 H new ATOM 420 N CYS A 45 -14.180 5.383 4.176 1.00 0.79 N ATOM 421 CA CYS A 45 -13.682 4.826 5.456 1.00 1.04 C ATOM 422 C CYS A 45 -14.389 5.569 6.584 1.00 1.29 C ATOM 423 O CYS A 45 -14.743 4.997 7.595 1.00 1.60 O ATOM 424 CB CYS A 45 -12.165 5.001 5.552 1.00 1.17 C ATOM 425 SG CYS A 45 -11.362 3.373 5.600 1.00 2.06 S ATOM 0 H CYS A 45 -14.875 6.123 4.272 1.00 0.79 H new ATOM 0 HA CYS A 45 -13.891 3.758 5.523 1.00 1.04 H new ATOM 0 HB2 CYS A 45 -11.800 5.572 4.698 1.00 1.17 H new ATOM 0 HB3 CYS A 45 -11.911 5.569 6.447 1.00 1.17 H new ATOM 0 HG CYS A 45 -10.866 3.169 6.784 1.00 2.06 H new ATOM 430 N ASN A 46 -14.631 6.842 6.402 1.00 1.18 N ATOM 431 CA ASN A 46 -15.352 7.607 7.445 1.00 1.45 C ATOM 432 C ASN A 46 -16.855 7.524 7.155 1.00 1.38 C ATOM 433 O ASN A 46 -17.642 7.174 8.011 1.00 1.47 O ATOM 434 CB ASN A 46 -14.902 9.069 7.415 1.00 1.64 C ATOM 435 CG ASN A 46 -14.969 9.655 8.826 1.00 1.93 C ATOM 436 OD1 ASN A 46 -14.313 9.175 9.729 1.00 2.92 O ATOM 437 ND2 ASN A 46 -15.743 10.680 9.057 1.00 1.28 N ATOM 0 H ASN A 46 -14.359 7.377 5.577 1.00 1.18 H new ATOM 0 HA ASN A 46 -15.137 7.192 8.430 1.00 1.45 H new ATOM 0 HB2 ASN A 46 -13.885 9.139 7.029 1.00 1.64 H new ATOM 0 HB3 ASN A 46 -15.539 9.642 6.741 1.00 1.64 H new ATOM 0 HD21 ASN A 46 -15.797 11.077 9.995 1.00 1.28 H new ATOM 0 HD22 ASN A 46 -16.294 11.084 8.300 1.00 1.28 H new ATOM 444 N LYS A 47 -17.260 7.841 5.948 1.00 1.27 N ATOM 445 CA LYS A 47 -18.710 7.773 5.613 1.00 1.33 C ATOM 446 C LYS A 47 -19.055 6.413 4.992 1.00 1.03 C ATOM 447 O LYS A 47 -20.128 6.228 4.451 1.00 1.10 O ATOM 448 CB LYS A 47 -19.055 8.885 4.619 1.00 1.49 C ATOM 449 CG LYS A 47 -18.568 10.230 5.163 1.00 2.66 C ATOM 450 CD LYS A 47 -19.685 10.889 5.975 1.00 3.27 C ATOM 451 CE LYS A 47 -20.420 11.909 5.100 1.00 2.87 C ATOM 452 NZ LYS A 47 -20.415 13.246 5.763 1.00 4.17 N ATOM 0 H LYS A 47 -16.650 8.142 5.188 1.00 1.27 H new ATOM 0 HA LYS A 47 -19.288 7.899 6.529 1.00 1.33 H new ATOM 0 HB2 LYS A 47 -18.590 8.682 3.655 1.00 1.49 H new ATOM 0 HB3 LYS A 47 -20.132 8.917 4.453 1.00 1.49 H new ATOM 0 HG2 LYS A 47 -17.687 10.084 5.789 1.00 2.66 H new ATOM 0 HG3 LYS A 47 -18.270 10.880 4.340 1.00 2.66 H new ATOM 0 HD2 LYS A 47 -20.383 10.133 6.334 1.00 3.27 H new ATOM 0 HD3 LYS A 47 -19.268 11.381 6.854 1.00 3.27 H new ATOM 0 HE2 LYS A 47 -19.940 11.976 4.124 1.00 2.87 H new ATOM 0 HE3 LYS A 47 -21.446 11.582 4.929 1.00 2.87 H new ATOM 0 HZ1 LYS A 47 -20.915 13.933 5.163 1.00 4.17 H new ATOM 0 HZ2 LYS A 47 -20.892 13.178 6.684 1.00 4.17 H new ATOM 0 HZ3 LYS A 47 -19.434 13.560 5.904 1.00 4.17 H new ATOM 466 N SER A 48 -18.160 5.464 5.042 1.00 0.78 N ATOM 467 CA SER A 48 -18.455 4.137 4.426 1.00 0.50 C ATOM 468 C SER A 48 -19.107 3.192 5.443 1.00 0.66 C ATOM 469 O SER A 48 -19.428 2.066 5.126 1.00 0.89 O ATOM 470 CB SER A 48 -17.154 3.513 3.925 1.00 0.34 C ATOM 471 OG SER A 48 -16.115 3.782 4.858 1.00 1.91 O ATOM 0 H SER A 48 -17.243 5.548 5.480 1.00 0.78 H new ATOM 0 HA SER A 48 -19.147 4.287 3.597 1.00 0.50 H new ATOM 0 HB2 SER A 48 -17.277 2.437 3.801 1.00 0.34 H new ATOM 0 HB3 SER A 48 -16.895 3.919 2.947 1.00 0.34 H new ATOM 0 HG SER A 48 -15.972 2.995 5.424 1.00 1.91 H new ATOM 477 N ASN A 49 -19.292 3.623 6.663 1.00 1.17 N ATOM 478 CA ASN A 49 -19.918 2.731 7.694 1.00 1.29 C ATOM 479 C ASN A 49 -19.274 1.334 7.669 1.00 0.97 C ATOM 480 O ASN A 49 -19.852 0.369 8.129 1.00 0.99 O ATOM 481 CB ASN A 49 -21.415 2.597 7.405 1.00 1.54 C ATOM 482 CG ASN A 49 -22.073 3.977 7.459 1.00 1.87 C ATOM 483 OD1 ASN A 49 -22.821 4.339 6.574 1.00 1.73 O ATOM 484 ND2 ASN A 49 -21.825 4.767 8.467 1.00 3.14 N ATOM 0 H ASN A 49 -19.038 4.554 6.994 1.00 1.17 H new ATOM 0 HA ASN A 49 -19.761 3.173 8.678 1.00 1.29 H new ATOM 0 HB2 ASN A 49 -21.568 2.148 6.423 1.00 1.54 H new ATOM 0 HB3 ASN A 49 -21.879 1.933 8.135 1.00 1.54 H new ATOM 0 HD21 ASN A 49 -22.260 5.689 8.512 1.00 3.14 H new ATOM 0 HD22 ASN A 49 -21.197 4.463 9.211 1.00 3.14 H new ATOM 491 N MET A 50 -18.087 1.219 7.139 1.00 0.87 N ATOM 492 CA MET A 50 -17.409 -0.107 7.085 1.00 0.57 C ATOM 493 C MET A 50 -15.900 0.118 7.166 1.00 0.69 C ATOM 494 O MET A 50 -15.146 -0.324 6.323 1.00 0.70 O ATOM 495 CB MET A 50 -17.749 -0.807 5.767 1.00 0.47 C ATOM 496 CG MET A 50 -18.859 -1.836 5.999 1.00 0.99 C ATOM 497 SD MET A 50 -20.073 -1.727 4.662 1.00 1.96 S ATOM 498 CE MET A 50 -19.309 -2.944 3.561 1.00 0.84 C ATOM 0 H MET A 50 -17.555 1.992 6.739 1.00 0.87 H new ATOM 0 HA MET A 50 -17.743 -0.730 7.915 1.00 0.57 H new ATOM 0 HB2 MET A 50 -18.069 -0.074 5.027 1.00 0.47 H new ATOM 0 HB3 MET A 50 -16.863 -1.299 5.366 1.00 0.47 H new ATOM 0 HG2 MET A 50 -18.436 -2.840 6.039 1.00 0.99 H new ATOM 0 HG3 MET A 50 -19.342 -1.655 6.959 1.00 0.99 H new ATOM 0 HE1 MET A 50 -20.069 -3.368 2.904 1.00 0.84 H new ATOM 0 HE2 MET A 50 -18.540 -2.459 2.960 1.00 0.84 H new ATOM 0 HE3 MET A 50 -18.858 -3.739 4.155 1.00 0.84 H new ATOM 660 N ASN A 62 -9.280 -8.191 5.951 1.00 1.24 N ATOM 661 CA ASN A 62 -7.822 -7.917 5.778 1.00 1.53 C ATOM 662 C ASN A 62 -7.387 -8.230 4.339 1.00 1.56 C ATOM 663 O ASN A 62 -6.213 -8.205 4.027 1.00 2.77 O ATOM 664 CB ASN A 62 -7.016 -8.780 6.756 1.00 1.71 C ATOM 665 CG ASN A 62 -6.355 -7.884 7.805 1.00 2.77 C ATOM 666 OD1 ASN A 62 -5.258 -7.403 7.607 1.00 4.14 O ATOM 667 ND2 ASN A 62 -6.983 -7.638 8.923 1.00 2.38 N ATOM 0 HA ASN A 62 -7.636 -6.862 5.982 1.00 1.53 H new ATOM 0 HB2 ASN A 62 -7.670 -9.505 7.242 1.00 1.71 H new ATOM 0 HB3 ASN A 62 -6.257 -9.347 6.217 1.00 1.71 H new ATOM 0 HD21 ASN A 62 -6.552 -7.042 9.630 1.00 2.38 H new ATOM 0 HD22 ASN A 62 -7.905 -8.042 9.090 1.00 2.38 H new ATOM 674 N LEU A 63 -8.316 -8.520 3.456 1.00 0.38 N ATOM 675 CA LEU A 63 -7.939 -8.827 2.040 1.00 0.40 C ATOM 676 C LEU A 63 -6.790 -9.842 2.019 1.00 0.27 C ATOM 677 O LEU A 63 -6.463 -10.437 3.027 1.00 0.23 O ATOM 678 CB LEU A 63 -7.505 -7.534 1.343 1.00 0.47 C ATOM 679 CG LEU A 63 -8.723 -6.868 0.700 1.00 0.52 C ATOM 680 CD1 LEU A 63 -8.334 -5.478 0.192 1.00 0.62 C ATOM 681 CD2 LEU A 63 -9.211 -7.720 -0.473 1.00 0.42 C ATOM 0 H LEU A 63 -9.316 -8.557 3.656 1.00 0.38 H new ATOM 0 HA LEU A 63 -8.796 -9.252 1.517 1.00 0.40 H new ATOM 0 HB2 LEU A 63 -7.045 -6.857 2.063 1.00 0.47 H new ATOM 0 HB3 LEU A 63 -6.753 -7.752 0.584 1.00 0.47 H new ATOM 0 HG LEU A 63 -9.519 -6.777 1.439 1.00 0.52 H new ATOM 0 HD11 LEU A 63 -9.201 -5.002 -0.266 1.00 0.62 H new ATOM 0 HD12 LEU A 63 -7.986 -4.870 1.027 1.00 0.62 H new ATOM 0 HD13 LEU A 63 -7.538 -5.570 -0.547 1.00 0.62 H new ATOM 0 HD21 LEU A 63 -10.079 -7.246 -0.931 1.00 0.42 H new ATOM 0 HD22 LEU A 63 -8.415 -7.812 -1.212 1.00 0.42 H new ATOM 0 HD23 LEU A 63 -9.487 -8.711 -0.113 1.00 0.42 H new ATOM 693 N ASN A 64 -6.174 -10.049 0.887 1.00 0.34 N ATOM 694 CA ASN A 64 -5.052 -11.027 0.829 1.00 0.46 C ATOM 695 C ASN A 64 -3.767 -10.314 0.405 1.00 0.42 C ATOM 696 O ASN A 64 -3.181 -10.626 -0.612 1.00 0.82 O ATOM 697 CB ASN A 64 -5.383 -12.127 -0.180 1.00 0.65 C ATOM 698 CG ASN A 64 -4.654 -13.414 0.212 1.00 0.75 C ATOM 699 OD1 ASN A 64 -4.423 -13.664 1.379 1.00 1.29 O ATOM 700 ND2 ASN A 64 -4.280 -14.247 -0.719 1.00 1.33 N ATOM 0 H ASN A 64 -6.397 -9.587 0.006 1.00 0.34 H new ATOM 0 HA ASN A 64 -4.910 -11.470 1.815 1.00 0.46 H new ATOM 0 HB2 ASN A 64 -6.459 -12.299 -0.206 1.00 0.65 H new ATOM 0 HB3 ASN A 64 -5.085 -11.818 -1.182 1.00 0.65 H new ATOM 0 HD21 ASN A 64 -3.794 -15.108 -0.468 1.00 1.33 H new ATOM 0 HD22 ASN A 64 -4.474 -14.038 -1.698 1.00 1.33 H new ATOM 707 N LEU A 65 -3.321 -9.364 1.180 1.00 0.34 N ATOM 708 CA LEU A 65 -2.069 -8.641 0.819 1.00 0.44 C ATOM 709 C LEU A 65 -1.146 -8.542 2.045 1.00 0.50 C ATOM 710 O LEU A 65 -0.771 -7.455 2.437 1.00 0.46 O ATOM 711 CB LEU A 65 -2.424 -7.234 0.330 1.00 0.42 C ATOM 712 CG LEU A 65 -3.110 -6.451 1.452 1.00 0.36 C ATOM 713 CD1 LEU A 65 -2.619 -5.002 1.432 1.00 0.24 C ATOM 714 CD2 LEU A 65 -4.625 -6.475 1.238 1.00 0.44 C ATOM 0 H LEU A 65 -3.767 -9.058 2.045 1.00 0.34 H new ATOM 0 HA LEU A 65 -1.552 -9.187 0.030 1.00 0.44 H new ATOM 0 HB2 LEU A 65 -1.522 -6.713 0.009 1.00 0.42 H new ATOM 0 HB3 LEU A 65 -3.082 -7.296 -0.537 1.00 0.42 H new ATOM 0 HG LEU A 65 -2.870 -6.906 2.413 1.00 0.36 H new ATOM 0 HD11 LEU A 65 -3.106 -4.442 2.230 1.00 0.24 H new ATOM 0 HD12 LEU A 65 -1.539 -4.982 1.581 1.00 0.24 H new ATOM 0 HD13 LEU A 65 -2.861 -4.549 0.471 1.00 0.24 H new ATOM 0 HD21 LEU A 65 -5.114 -5.918 2.037 1.00 0.44 H new ATOM 0 HD22 LEU A 65 -4.864 -6.018 0.278 1.00 0.44 H new ATOM 0 HD23 LEU A 65 -4.977 -7.506 1.247 1.00 0.44 H new ATOM 726 N PRO A 66 -0.797 -9.675 2.623 1.00 1.26 N ATOM 727 CA PRO A 66 0.085 -9.706 3.805 1.00 1.42 C ATOM 728 C PRO A 66 1.545 -9.485 3.398 1.00 1.25 C ATOM 729 O PRO A 66 1.997 -9.969 2.379 1.00 1.86 O ATOM 730 CB PRO A 66 -0.111 -11.115 4.369 1.00 2.48 C ATOM 731 CG PRO A 66 -0.625 -11.984 3.199 1.00 2.90 C ATOM 732 CD PRO A 66 -1.235 -11.017 2.168 1.00 2.12 C ATOM 0 HA PRO A 66 -0.150 -8.924 4.528 1.00 1.42 H new ATOM 0 HB2 PRO A 66 0.825 -11.509 4.764 1.00 2.48 H new ATOM 0 HB3 PRO A 66 -0.826 -11.108 5.192 1.00 2.48 H new ATOM 0 HG2 PRO A 66 0.189 -12.559 2.757 1.00 2.90 H new ATOM 0 HG3 PRO A 66 -1.370 -12.700 3.546 1.00 2.90 H new ATOM 0 HD2 PRO A 66 -0.878 -11.232 1.161 1.00 2.12 H new ATOM 0 HD3 PRO A 66 -2.322 -11.094 2.144 1.00 2.12 H new ATOM 740 N LYS A 67 2.284 -8.760 4.192 1.00 0.83 N ATOM 741 CA LYS A 67 3.716 -8.507 3.864 1.00 1.40 C ATOM 742 C LYS A 67 4.309 -7.562 4.908 1.00 0.95 C ATOM 743 O LYS A 67 4.959 -6.587 4.586 1.00 1.41 O ATOM 744 CB LYS A 67 3.824 -7.873 2.477 1.00 2.06 C ATOM 745 CG LYS A 67 4.893 -8.607 1.667 1.00 3.22 C ATOM 746 CD LYS A 67 4.393 -8.822 0.237 1.00 3.82 C ATOM 747 CE LYS A 67 4.251 -10.322 -0.034 1.00 4.04 C ATOM 748 NZ LYS A 67 4.803 -10.640 -1.383 1.00 5.51 N ATOM 0 H LYS A 67 1.957 -8.330 5.057 1.00 0.83 H new ATOM 0 HA LYS A 67 4.264 -9.449 3.868 1.00 1.40 H new ATOM 0 HB2 LYS A 67 2.863 -7.926 1.965 1.00 2.06 H new ATOM 0 HB3 LYS A 67 4.080 -6.817 2.566 1.00 2.06 H new ATOM 0 HG2 LYS A 67 5.817 -8.029 1.657 1.00 3.22 H new ATOM 0 HG3 LYS A 67 5.122 -9.566 2.132 1.00 3.22 H new ATOM 0 HD2 LYS A 67 3.434 -8.324 0.097 1.00 3.82 H new ATOM 0 HD3 LYS A 67 5.090 -8.378 -0.474 1.00 3.82 H new ATOM 0 HE2 LYS A 67 4.780 -10.892 0.730 1.00 4.04 H new ATOM 0 HE3 LYS A 67 3.202 -10.614 0.019 1.00 4.04 H new ATOM 0 HZ1 LYS A 67 4.706 -11.659 -1.566 1.00 5.51 H new ATOM 0 HZ2 LYS A 67 4.280 -10.107 -2.107 1.00 5.51 H new ATOM 0 HZ3 LYS A 67 5.808 -10.376 -1.418 1.00 5.51 H new ATOM 762 N MET A 68 4.086 -7.847 6.161 1.00 0.82 N ATOM 763 CA MET A 68 4.630 -6.973 7.237 1.00 0.37 C ATOM 764 C MET A 68 4.345 -7.608 8.598 1.00 0.31 C ATOM 765 O MET A 68 3.248 -8.057 8.868 1.00 0.26 O ATOM 766 CB MET A 68 3.964 -5.596 7.166 1.00 0.81 C ATOM 767 CG MET A 68 5.020 -4.533 6.858 1.00 0.98 C ATOM 768 SD MET A 68 5.553 -3.748 8.400 1.00 1.14 S ATOM 769 CE MET A 68 6.894 -2.756 7.695 1.00 0.56 C ATOM 0 H MET A 68 3.549 -8.650 6.487 1.00 0.82 H new ATOM 0 HA MET A 68 5.706 -6.861 7.105 1.00 0.37 H new ATOM 0 HB2 MET A 68 3.194 -5.592 6.395 1.00 0.81 H new ATOM 0 HB3 MET A 68 3.470 -5.370 8.111 1.00 0.81 H new ATOM 0 HG2 MET A 68 5.873 -4.988 6.355 1.00 0.98 H new ATOM 0 HG3 MET A 68 4.611 -3.785 6.179 1.00 0.98 H new ATOM 0 HE1 MET A 68 7.303 -2.099 8.463 1.00 0.56 H new ATOM 0 HE2 MET A 68 7.679 -3.416 7.325 1.00 0.56 H new ATOM 0 HE3 MET A 68 6.508 -2.155 6.872 1.00 0.56 H new ATOM 779 N ALA A 69 5.327 -7.656 9.455 1.00 0.35 N ATOM 780 CA ALA A 69 5.114 -8.268 10.795 1.00 0.31 C ATOM 781 C ALA A 69 6.425 -8.239 11.583 1.00 0.57 C ATOM 782 O ALA A 69 7.397 -7.642 11.165 1.00 1.02 O ATOM 783 CB ALA A 69 4.657 -9.716 10.617 1.00 0.31 C ATOM 0 H ALA A 69 6.267 -7.298 9.285 1.00 0.35 H new ATOM 0 HA ALA A 69 4.354 -7.707 11.339 1.00 0.31 H new ATOM 0 HB1 ALA A 69 4.499 -10.171 11.595 1.00 0.31 H new ATOM 0 HB2 ALA A 69 3.725 -9.737 10.053 1.00 0.31 H new ATOM 0 HB3 ALA A 69 5.421 -10.275 10.076 1.00 0.31 H new ATOM 789 N GLU A 70 6.460 -8.880 12.720 1.00 0.40 N ATOM 790 CA GLU A 70 7.712 -8.888 13.531 1.00 0.64 C ATOM 791 C GLU A 70 8.820 -9.597 12.756 1.00 0.76 C ATOM 792 O GLU A 70 9.992 -9.383 12.995 1.00 0.81 O ATOM 793 CB GLU A 70 7.464 -9.618 14.853 1.00 0.96 C ATOM 794 CG GLU A 70 6.423 -8.857 15.677 1.00 0.23 C ATOM 795 CD GLU A 70 6.388 -9.408 17.106 1.00 0.90 C ATOM 796 OE1 GLU A 70 7.178 -10.291 17.405 1.00 1.63 O ATOM 797 OE2 GLU A 70 5.571 -8.935 17.880 1.00 1.31 O ATOM 0 H GLU A 70 5.678 -9.397 13.122 1.00 0.40 H new ATOM 0 HA GLU A 70 8.014 -7.861 13.737 1.00 0.64 H new ATOM 0 HB2 GLU A 70 7.117 -10.633 14.659 1.00 0.96 H new ATOM 0 HB3 GLU A 70 8.395 -9.701 15.414 1.00 0.96 H new ATOM 0 HG2 GLU A 70 6.665 -7.794 15.693 1.00 0.23 H new ATOM 0 HG3 GLU A 70 5.440 -8.953 15.216 1.00 0.23 H new ATOM 804 N LYS A 71 8.461 -10.436 11.829 1.00 0.97 N ATOM 805 CA LYS A 71 9.495 -11.152 11.037 1.00 1.28 C ATOM 806 C LYS A 71 10.292 -10.138 10.217 1.00 1.10 C ATOM 807 O LYS A 71 11.487 -10.270 10.035 1.00 1.17 O ATOM 808 CB LYS A 71 8.810 -12.138 10.097 1.00 1.86 C ATOM 809 CG LYS A 71 7.865 -13.037 10.894 1.00 1.31 C ATOM 810 CD LYS A 71 8.023 -14.485 10.427 1.00 1.46 C ATOM 811 CE LYS A 71 6.646 -15.078 10.117 1.00 1.87 C ATOM 812 NZ LYS A 71 6.308 -14.846 8.682 1.00 3.05 N ATOM 0 H LYS A 71 7.496 -10.657 11.585 1.00 0.97 H new ATOM 0 HA LYS A 71 10.167 -11.690 11.706 1.00 1.28 H new ATOM 0 HB2 LYS A 71 8.254 -11.598 9.330 1.00 1.86 H new ATOM 0 HB3 LYS A 71 9.556 -12.744 9.583 1.00 1.86 H new ATOM 0 HG2 LYS A 71 8.085 -12.961 11.959 1.00 1.31 H new ATOM 0 HG3 LYS A 71 6.834 -12.710 10.758 1.00 1.31 H new ATOM 0 HD2 LYS A 71 8.655 -14.525 9.540 1.00 1.46 H new ATOM 0 HD3 LYS A 71 8.519 -15.074 11.198 1.00 1.46 H new ATOM 0 HE2 LYS A 71 6.643 -16.146 10.333 1.00 1.87 H new ATOM 0 HE3 LYS A 71 5.891 -14.621 10.757 1.00 1.87 H new ATOM 0 HZ1 LYS A 71 5.372 -15.250 8.476 1.00 3.05 H new ATOM 0 HZ2 LYS A 71 6.294 -13.824 8.490 1.00 3.05 H new ATOM 0 HZ3 LYS A 71 7.022 -15.302 8.079 1.00 3.05 H new ATOM 826 N ASP A 72 9.638 -9.126 9.717 1.00 1.03 N ATOM 827 CA ASP A 72 10.352 -8.103 8.907 1.00 1.23 C ATOM 828 C ASP A 72 11.364 -7.370 9.787 1.00 1.21 C ATOM 829 O ASP A 72 12.487 -7.126 9.389 1.00 1.72 O ATOM 830 CB ASP A 72 9.342 -7.099 8.348 1.00 1.60 C ATOM 831 CG ASP A 72 9.927 -6.433 7.102 1.00 2.71 C ATOM 832 OD1 ASP A 72 10.820 -7.013 6.508 1.00 2.97 O ATOM 833 OD2 ASP A 72 9.471 -5.353 6.763 1.00 3.41 O ATOM 0 H ASP A 72 8.638 -8.964 9.836 1.00 1.03 H new ATOM 0 HA ASP A 72 10.873 -8.592 8.084 1.00 1.23 H new ATOM 0 HB2 ASP A 72 8.409 -7.605 8.100 1.00 1.60 H new ATOM 0 HB3 ASP A 72 9.106 -6.346 9.100 1.00 1.60 H new ATOM 838 N GLY A 73 10.979 -7.015 10.980 1.00 0.86 N ATOM 839 CA GLY A 73 11.922 -6.298 11.884 1.00 1.28 C ATOM 840 C GLY A 73 11.759 -4.788 11.704 1.00 1.17 C ATOM 841 O GLY A 73 12.685 -4.026 11.908 1.00 1.48 O ATOM 0 H GLY A 73 10.052 -7.190 11.369 1.00 0.86 H new ATOM 0 HA2 GLY A 73 11.728 -6.574 12.921 1.00 1.28 H new ATOM 0 HA3 GLY A 73 12.948 -6.592 11.663 1.00 1.28 H new ATOM 845 N CYS A 74 10.591 -4.343 11.326 1.00 0.80 N ATOM 846 CA CYS A 74 10.378 -2.880 11.139 1.00 0.80 C ATOM 847 C CYS A 74 9.820 -2.274 12.429 1.00 0.93 C ATOM 848 O CYS A 74 9.215 -1.220 12.420 1.00 1.07 O ATOM 849 CB CYS A 74 9.390 -2.647 9.994 1.00 0.57 C ATOM 850 SG CYS A 74 10.300 -2.234 8.484 1.00 0.90 S ATOM 0 H CYS A 74 9.777 -4.928 11.139 1.00 0.80 H new ATOM 0 HA CYS A 74 11.329 -2.405 10.898 1.00 0.80 H new ATOM 0 HB2 CYS A 74 8.786 -3.540 9.834 1.00 0.57 H new ATOM 0 HB3 CYS A 74 8.704 -1.839 10.250 1.00 0.57 H new ATOM 855 N PHE A 75 10.020 -2.929 13.542 1.00 0.94 N ATOM 856 CA PHE A 75 9.504 -2.387 14.828 1.00 1.11 C ATOM 857 C PHE A 75 10.505 -2.691 15.945 1.00 1.22 C ATOM 858 O PHE A 75 10.131 -2.938 17.075 1.00 2.82 O ATOM 859 CB PHE A 75 8.159 -3.038 15.157 1.00 1.26 C ATOM 860 CG PHE A 75 7.239 -2.920 13.966 1.00 1.06 C ATOM 861 CD1 PHE A 75 7.316 -3.857 12.928 1.00 1.40 C ATOM 862 CD2 PHE A 75 6.310 -1.875 13.898 1.00 2.39 C ATOM 863 CE1 PHE A 75 6.464 -3.748 11.822 1.00 1.74 C ATOM 864 CE2 PHE A 75 5.458 -1.767 12.793 1.00 2.19 C ATOM 865 CZ PHE A 75 5.535 -2.704 11.755 1.00 1.15 C ATOM 0 H PHE A 75 10.519 -3.816 13.614 1.00 0.94 H new ATOM 0 HA PHE A 75 9.371 -1.309 14.740 1.00 1.11 H new ATOM 0 HB2 PHE A 75 8.304 -4.087 15.416 1.00 1.26 H new ATOM 0 HB3 PHE A 75 7.711 -2.554 16.025 1.00 1.26 H new ATOM 0 HD1 PHE A 75 8.032 -4.664 12.981 1.00 1.40 H new ATOM 0 HD2 PHE A 75 6.251 -1.152 14.698 1.00 2.39 H new ATOM 0 HE1 PHE A 75 6.524 -4.470 11.021 1.00 1.74 H new ATOM 0 HE2 PHE A 75 4.741 -0.961 12.741 1.00 2.19 H new ATOM 0 HZ PHE A 75 4.877 -2.621 10.903 1.00 1.15 H new ATOM 875 N GLN A 76 11.778 -2.679 15.634 1.00 0.85 N ATOM 876 CA GLN A 76 12.825 -2.968 16.667 1.00 0.67 C ATOM 877 C GLN A 76 12.855 -4.467 16.999 1.00 0.63 C ATOM 878 O GLN A 76 13.629 -4.906 17.826 1.00 0.38 O ATOM 879 CB GLN A 76 12.526 -2.180 17.945 1.00 0.61 C ATOM 880 CG GLN A 76 13.755 -1.360 18.343 1.00 1.17 C ATOM 881 CD GLN A 76 13.784 -0.055 17.545 1.00 2.72 C ATOM 882 OE1 GLN A 76 14.129 -0.050 16.379 1.00 3.85 O ATOM 883 NE2 GLN A 76 13.436 1.060 18.127 1.00 3.13 N ATOM 0 H GLN A 76 12.141 -2.480 14.702 1.00 0.85 H new ATOM 0 HA GLN A 76 13.794 -2.670 16.266 1.00 0.67 H new ATOM 0 HB2 GLN A 76 11.673 -1.521 17.786 1.00 0.61 H new ATOM 0 HB3 GLN A 76 12.256 -2.863 18.750 1.00 0.61 H new ATOM 0 HG2 GLN A 76 13.730 -1.144 19.411 1.00 1.17 H new ATOM 0 HG3 GLN A 76 14.663 -1.933 18.155 1.00 1.17 H new ATOM 0 HE21 GLN A 76 13.147 1.056 19.105 1.00 3.13 H new ATOM 0 HE22 GLN A 76 13.453 1.935 17.604 1.00 3.13 H new ATOM 892 N SER A 77 12.028 -5.257 16.366 1.00 1.31 N ATOM 893 CA SER A 77 12.028 -6.718 16.659 1.00 1.42 C ATOM 894 C SER A 77 12.864 -7.444 15.605 1.00 1.39 C ATOM 895 O SER A 77 12.382 -8.313 14.906 1.00 1.69 O ATOM 896 CB SER A 77 10.592 -7.243 16.622 1.00 1.73 C ATOM 897 OG SER A 77 9.913 -6.673 15.511 1.00 3.76 O ATOM 0 H SER A 77 11.355 -4.954 15.662 1.00 1.31 H new ATOM 0 HA SER A 77 12.453 -6.894 17.647 1.00 1.42 H new ATOM 0 HB2 SER A 77 10.592 -8.330 16.544 1.00 1.73 H new ATOM 0 HB3 SER A 77 10.076 -6.989 17.548 1.00 1.73 H new ATOM 0 HG SER A 77 8.993 -7.008 15.483 1.00 3.76 H new ATOM 903 N GLY A 78 14.113 -7.092 15.484 1.00 1.13 N ATOM 904 CA GLY A 78 14.980 -7.758 14.471 1.00 1.10 C ATOM 905 C GLY A 78 15.198 -6.809 13.293 1.00 1.12 C ATOM 906 O GLY A 78 15.123 -7.198 12.145 1.00 1.21 O ATOM 0 H GLY A 78 14.572 -6.372 16.042 1.00 1.13 H new ATOM 0 HA2 GLY A 78 15.937 -8.030 14.916 1.00 1.10 H new ATOM 0 HA3 GLY A 78 14.515 -8.682 14.128 1.00 1.10 H new ATOM 910 N PHE A 79 15.470 -5.563 13.572 1.00 1.05 N ATOM 911 CA PHE A 79 15.697 -4.583 12.478 1.00 1.10 C ATOM 912 C PHE A 79 16.901 -5.026 11.646 1.00 1.08 C ATOM 913 O PHE A 79 18.017 -5.065 12.127 1.00 1.04 O ATOM 914 CB PHE A 79 15.975 -3.218 13.104 1.00 1.00 C ATOM 915 CG PHE A 79 15.665 -2.123 12.113 1.00 0.80 C ATOM 916 CD1 PHE A 79 16.428 -1.992 10.947 1.00 2.36 C ATOM 917 CD2 PHE A 79 14.616 -1.233 12.368 1.00 1.57 C ATOM 918 CE1 PHE A 79 16.138 -0.972 10.033 1.00 2.12 C ATOM 919 CE2 PHE A 79 14.327 -0.212 11.455 1.00 1.81 C ATOM 920 CZ PHE A 79 15.088 -0.081 10.287 1.00 0.64 C ATOM 0 H PHE A 79 15.545 -5.183 14.515 1.00 1.05 H new ATOM 0 HA PHE A 79 14.821 -4.524 11.832 1.00 1.10 H new ATOM 0 HB2 PHE A 79 15.369 -3.090 14.001 1.00 1.00 H new ATOM 0 HB3 PHE A 79 17.019 -3.156 13.412 1.00 1.00 H new ATOM 0 HD1 PHE A 79 17.240 -2.677 10.753 1.00 2.36 H new ATOM 0 HD2 PHE A 79 14.029 -1.334 13.269 1.00 1.57 H new ATOM 0 HE1 PHE A 79 16.724 -0.872 9.132 1.00 2.12 H new ATOM 0 HE2 PHE A 79 13.517 0.475 11.652 1.00 1.81 H new ATOM 0 HZ PHE A 79 14.865 0.707 9.582 1.00 0.64 H new ATOM 930 N ASN A 80 16.690 -5.370 10.404 1.00 1.17 N ATOM 931 CA ASN A 80 17.832 -5.818 9.558 1.00 1.18 C ATOM 932 C ASN A 80 18.060 -4.846 8.399 1.00 1.33 C ATOM 933 O ASN A 80 18.883 -5.087 7.542 1.00 2.69 O ATOM 934 CB ASN A 80 17.545 -7.215 9.006 1.00 1.27 C ATOM 935 CG ASN A 80 18.808 -8.072 9.104 1.00 1.94 C ATOM 936 OD1 ASN A 80 19.900 -7.595 8.870 1.00 2.77 O ATOM 937 ND2 ASN A 80 18.704 -9.328 9.442 1.00 1.76 N ATOM 0 H ASN A 80 15.781 -5.360 9.941 1.00 1.17 H new ATOM 0 HA ASN A 80 18.731 -5.843 10.173 1.00 1.18 H new ATOM 0 HB2 ASN A 80 16.733 -7.679 9.566 1.00 1.27 H new ATOM 0 HB3 ASN A 80 17.218 -7.147 7.968 1.00 1.27 H new ATOM 0 HD21 ASN A 80 19.540 -9.909 9.510 1.00 1.76 H new ATOM 0 HD22 ASN A 80 17.787 -9.729 9.639 1.00 1.76 H new ATOM 944 N GLU A 81 17.356 -3.745 8.375 1.00 0.66 N ATOM 945 CA GLU A 81 17.546 -2.746 7.286 1.00 0.62 C ATOM 946 C GLU A 81 17.192 -3.347 5.916 1.00 0.51 C ATOM 947 O GLU A 81 16.089 -3.194 5.435 1.00 0.26 O ATOM 948 CB GLU A 81 19.001 -2.265 7.284 1.00 0.65 C ATOM 949 CG GLU A 81 19.306 -1.571 8.613 1.00 0.64 C ATOM 950 CD GLU A 81 20.808 -1.641 8.903 1.00 0.45 C ATOM 951 OE1 GLU A 81 21.486 -2.404 8.234 1.00 0.87 O ATOM 952 OE2 GLU A 81 21.253 -0.930 9.788 1.00 0.75 O ATOM 0 H GLU A 81 16.652 -3.494 9.070 1.00 0.66 H new ATOM 0 HA GLU A 81 16.879 -1.903 7.468 1.00 0.62 H new ATOM 0 HB2 GLU A 81 19.675 -3.109 7.138 1.00 0.65 H new ATOM 0 HB3 GLU A 81 19.168 -1.577 6.455 1.00 0.65 H new ATOM 0 HG2 GLU A 81 18.982 -0.531 8.573 1.00 0.64 H new ATOM 0 HG3 GLU A 81 18.748 -2.048 9.419 1.00 0.64 H new ATOM 959 N GLU A 82 18.120 -4.002 5.274 1.00 0.82 N ATOM 960 CA GLU A 82 17.843 -4.589 3.928 1.00 0.75 C ATOM 961 C GLU A 82 16.612 -5.506 3.975 1.00 0.66 C ATOM 962 O GLU A 82 15.982 -5.754 2.968 1.00 0.60 O ATOM 963 CB GLU A 82 19.065 -5.402 3.485 1.00 0.78 C ATOM 964 CG GLU A 82 18.855 -5.939 2.066 1.00 0.71 C ATOM 965 CD GLU A 82 19.478 -7.333 1.955 1.00 0.49 C ATOM 966 OE1 GLU A 82 19.174 -8.164 2.796 1.00 0.25 O ATOM 967 OE2 GLU A 82 20.247 -7.545 1.032 1.00 0.94 O ATOM 0 H GLU A 82 19.065 -4.158 5.625 1.00 0.82 H new ATOM 0 HA GLU A 82 17.644 -3.782 3.222 1.00 0.75 H new ATOM 0 HB2 GLU A 82 19.958 -4.778 3.517 1.00 0.78 H new ATOM 0 HB3 GLU A 82 19.230 -6.230 4.175 1.00 0.78 H new ATOM 0 HG2 GLU A 82 17.791 -5.985 1.836 1.00 0.71 H new ATOM 0 HG3 GLU A 82 19.310 -5.266 1.339 1.00 0.71 H new ATOM 974 N THR A 83 16.263 -6.021 5.123 1.00 0.67 N ATOM 975 CA THR A 83 15.081 -6.929 5.191 1.00 0.61 C ATOM 976 C THR A 83 13.794 -6.111 5.267 1.00 0.52 C ATOM 977 O THR A 83 12.754 -6.532 4.799 1.00 0.40 O ATOM 978 CB THR A 83 15.188 -7.822 6.428 1.00 0.66 C ATOM 979 OG1 THR A 83 16.402 -8.556 6.378 1.00 0.71 O ATOM 980 CG2 THR A 83 14.003 -8.787 6.452 1.00 0.62 C ATOM 0 H THR A 83 16.740 -5.855 6.009 1.00 0.67 H new ATOM 0 HA THR A 83 15.060 -7.547 4.294 1.00 0.61 H new ATOM 0 HB THR A 83 15.177 -7.208 7.329 1.00 0.66 H new ATOM 0 HG1 THR A 83 16.472 -9.127 7.171 1.00 0.71 H new ATOM 0 HG21 THR A 83 14.073 -9.427 7.332 1.00 0.62 H new ATOM 0 HG22 THR A 83 13.073 -8.220 6.489 1.00 0.62 H new ATOM 0 HG23 THR A 83 14.017 -9.403 5.553 1.00 0.62 H new ATOM 988 N CYS A 84 13.849 -4.951 5.852 1.00 0.60 N ATOM 989 CA CYS A 84 12.621 -4.118 5.953 1.00 0.50 C ATOM 990 C CYS A 84 12.347 -3.459 4.600 1.00 0.47 C ATOM 991 O CYS A 84 11.213 -3.270 4.202 1.00 0.64 O ATOM 992 CB CYS A 84 12.821 -3.037 7.015 1.00 0.53 C ATOM 993 SG CYS A 84 11.894 -3.476 8.507 1.00 0.78 S ATOM 0 H CYS A 84 14.688 -4.543 6.264 1.00 0.60 H new ATOM 0 HA CYS A 84 11.776 -4.746 6.233 1.00 0.50 H new ATOM 0 HB2 CYS A 84 13.881 -2.934 7.250 1.00 0.53 H new ATOM 0 HB3 CYS A 84 12.484 -2.073 6.635 1.00 0.53 H new ATOM 998 N LEU A 85 13.384 -3.111 3.894 1.00 0.41 N ATOM 999 CA LEU A 85 13.214 -2.466 2.566 1.00 0.43 C ATOM 1000 C LEU A 85 12.732 -3.509 1.558 1.00 0.37 C ATOM 1001 O LEU A 85 11.855 -3.256 0.762 1.00 0.36 O ATOM 1002 CB LEU A 85 14.565 -1.900 2.123 1.00 0.55 C ATOM 1003 CG LEU A 85 14.365 -0.708 1.184 1.00 0.65 C ATOM 1004 CD1 LEU A 85 13.525 0.368 1.879 1.00 0.61 C ATOM 1005 CD2 LEU A 85 15.733 -0.124 0.821 1.00 0.85 C ATOM 0 H LEU A 85 14.352 -3.248 4.184 1.00 0.41 H new ATOM 0 HA LEU A 85 12.480 -1.662 2.626 1.00 0.43 H new ATOM 0 HB2 LEU A 85 15.140 -1.590 2.996 1.00 0.55 H new ATOM 0 HB3 LEU A 85 15.143 -2.675 1.619 1.00 0.55 H new ATOM 0 HG LEU A 85 13.849 -1.039 0.283 1.00 0.65 H new ATOM 0 HD11 LEU A 85 13.387 1.213 1.205 1.00 0.61 H new ATOM 0 HD12 LEU A 85 12.553 -0.046 2.146 1.00 0.61 H new ATOM 0 HD13 LEU A 85 14.037 0.703 2.781 1.00 0.61 H new ATOM 0 HD21 LEU A 85 15.600 0.726 0.152 1.00 0.85 H new ATOM 0 HD22 LEU A 85 16.241 0.204 1.728 1.00 0.85 H new ATOM 0 HD23 LEU A 85 16.334 -0.886 0.324 1.00 0.85 H new ATOM 1017 N VAL A 86 13.299 -4.681 1.594 1.00 0.37 N ATOM 1018 CA VAL A 86 12.878 -5.752 0.645 1.00 0.28 C ATOM 1019 C VAL A 86 11.407 -6.106 0.883 1.00 0.05 C ATOM 1020 O VAL A 86 10.633 -6.221 -0.040 1.00 0.21 O ATOM 1021 CB VAL A 86 13.734 -6.997 0.887 1.00 0.36 C ATOM 1022 CG1 VAL A 86 13.270 -8.131 -0.030 1.00 0.49 C ATOM 1023 CG2 VAL A 86 15.201 -6.675 0.593 1.00 0.50 C ATOM 0 H VAL A 86 14.040 -4.946 2.243 1.00 0.37 H new ATOM 0 HA VAL A 86 13.006 -5.400 -0.379 1.00 0.28 H new ATOM 0 HB VAL A 86 13.629 -7.307 1.927 1.00 0.36 H new ATOM 0 HG11 VAL A 86 13.883 -9.015 0.146 1.00 0.49 H new ATOM 0 HG12 VAL A 86 12.226 -8.365 0.180 1.00 0.49 H new ATOM 0 HG13 VAL A 86 13.370 -7.822 -1.070 1.00 0.49 H new ATOM 0 HG21 VAL A 86 15.810 -7.562 0.766 1.00 0.50 H new ATOM 0 HG22 VAL A 86 15.303 -6.361 -0.446 1.00 0.50 H new ATOM 0 HG23 VAL A 86 15.536 -5.872 1.249 1.00 0.50 H new ATOM 1033 N LYS A 87 11.019 -6.302 2.114 1.00 0.12 N ATOM 1034 CA LYS A 87 9.602 -6.674 2.391 1.00 0.34 C ATOM 1035 C LYS A 87 8.660 -5.601 1.843 1.00 0.44 C ATOM 1036 O LYS A 87 7.675 -5.904 1.200 1.00 0.65 O ATOM 1037 CB LYS A 87 9.390 -6.820 3.900 1.00 0.43 C ATOM 1038 CG LYS A 87 9.511 -8.295 4.297 1.00 1.02 C ATOM 1039 CD LYS A 87 8.471 -9.124 3.535 1.00 0.15 C ATOM 1040 CE LYS A 87 7.472 -9.731 4.523 1.00 0.79 C ATOM 1041 NZ LYS A 87 7.680 -11.204 4.606 1.00 0.84 N ATOM 0 H LYS A 87 11.618 -6.221 2.936 1.00 0.12 H new ATOM 0 HA LYS A 87 9.385 -7.623 1.901 1.00 0.34 H new ATOM 0 HB2 LYS A 87 10.128 -6.226 4.440 1.00 0.43 H new ATOM 0 HB3 LYS A 87 8.408 -6.438 4.178 1.00 0.43 H new ATOM 0 HG2 LYS A 87 10.514 -8.660 4.075 1.00 1.02 H new ATOM 0 HG3 LYS A 87 9.362 -8.406 5.371 1.00 1.02 H new ATOM 0 HD2 LYS A 87 7.948 -8.496 2.814 1.00 0.15 H new ATOM 0 HD3 LYS A 87 8.965 -9.915 2.970 1.00 0.15 H new ATOM 0 HE2 LYS A 87 7.599 -9.280 5.507 1.00 0.79 H new ATOM 0 HE3 LYS A 87 6.453 -9.515 4.203 1.00 0.79 H new ATOM 0 HZ1 LYS A 87 7.000 -11.613 5.278 1.00 0.84 H new ATOM 0 HZ2 LYS A 87 7.537 -11.628 3.667 1.00 0.84 H new ATOM 0 HZ3 LYS A 87 8.648 -11.400 4.931 1.00 0.84 H new ATOM 1055 N ILE A 88 8.947 -4.351 2.083 1.00 0.62 N ATOM 1056 CA ILE A 88 8.050 -3.279 1.558 1.00 0.88 C ATOM 1057 C ILE A 88 8.245 -3.147 0.041 1.00 0.67 C ATOM 1058 O ILE A 88 7.421 -2.590 -0.656 1.00 0.56 O ATOM 1059 CB ILE A 88 8.380 -1.946 2.241 1.00 1.28 C ATOM 1060 CG1 ILE A 88 8.108 -2.069 3.745 1.00 1.50 C ATOM 1061 CG2 ILE A 88 7.505 -0.836 1.646 1.00 1.73 C ATOM 1062 CD1 ILE A 88 8.315 -0.715 4.430 1.00 0.75 C ATOM 0 H ILE A 88 9.755 -4.026 2.614 1.00 0.62 H new ATOM 0 HA ILE A 88 7.013 -3.540 1.768 1.00 0.88 H new ATOM 0 HB ILE A 88 9.430 -1.700 2.080 1.00 1.28 H new ATOM 0 HG12 ILE A 88 7.088 -2.417 3.911 1.00 1.50 H new ATOM 0 HG13 ILE A 88 8.774 -2.813 4.183 1.00 1.50 H new ATOM 0 HG21 ILE A 88 7.739 0.111 2.131 1.00 1.73 H new ATOM 0 HG22 ILE A 88 7.699 -0.754 0.577 1.00 1.73 H new ATOM 0 HG23 ILE A 88 6.454 -1.076 1.807 1.00 1.73 H new ATOM 0 HD11 ILE A 88 8.119 -0.814 5.498 1.00 0.75 H new ATOM 0 HD12 ILE A 88 9.342 -0.384 4.279 1.00 0.75 H new ATOM 0 HD13 ILE A 88 7.631 0.018 4.002 1.00 0.75 H new ATOM 1074 N ILE A 89 9.331 -3.661 -0.471 1.00 0.62 N ATOM 1075 CA ILE A 89 9.592 -3.574 -1.934 1.00 0.48 C ATOM 1076 C ILE A 89 8.643 -4.539 -2.670 1.00 0.19 C ATOM 1077 O ILE A 89 7.781 -4.124 -3.427 1.00 0.14 O ATOM 1078 CB ILE A 89 11.082 -3.918 -2.159 1.00 0.65 C ATOM 1079 CG1 ILE A 89 11.907 -2.635 -2.015 1.00 0.63 C ATOM 1080 CG2 ILE A 89 11.341 -4.518 -3.548 1.00 0.85 C ATOM 1081 CD1 ILE A 89 11.595 -1.694 -3.180 1.00 2.07 C ATOM 0 H ILE A 89 10.053 -4.141 0.067 1.00 0.62 H new ATOM 0 HA ILE A 89 9.402 -2.576 -2.329 1.00 0.48 H new ATOM 0 HB ILE A 89 11.368 -4.664 -1.417 1.00 0.65 H new ATOM 0 HG12 ILE A 89 11.677 -2.147 -1.068 1.00 0.63 H new ATOM 0 HG13 ILE A 89 12.970 -2.874 -2.001 1.00 0.63 H new ATOM 0 HG21 ILE A 89 12.402 -4.742 -3.655 1.00 0.85 H new ATOM 0 HG22 ILE A 89 10.763 -5.435 -3.662 1.00 0.85 H new ATOM 0 HG23 ILE A 89 11.042 -3.803 -4.315 1.00 0.85 H new ATOM 0 HD11 ILE A 89 12.182 -0.781 -3.078 1.00 2.07 H new ATOM 0 HD12 ILE A 89 11.847 -2.184 -4.121 1.00 2.07 H new ATOM 0 HD13 ILE A 89 10.534 -1.446 -3.173 1.00 2.07 H new ATOM 1093 N THR A 90 8.779 -5.817 -2.450 1.00 0.16 N ATOM 1094 CA THR A 90 7.872 -6.784 -3.126 1.00 0.39 C ATOM 1095 C THR A 90 6.441 -6.512 -2.658 1.00 0.51 C ATOM 1096 O THR A 90 5.485 -6.723 -3.379 1.00 0.68 O ATOM 1097 CB THR A 90 8.276 -8.214 -2.757 1.00 0.62 C ATOM 1098 OG1 THR A 90 7.438 -9.136 -3.440 1.00 1.72 O ATOM 1099 CG2 THR A 90 8.133 -8.418 -1.249 1.00 0.64 C ATOM 0 H THR A 90 9.477 -6.232 -1.833 1.00 0.16 H new ATOM 0 HA THR A 90 7.939 -6.669 -4.208 1.00 0.39 H new ATOM 0 HB THR A 90 9.313 -8.380 -3.047 1.00 0.62 H new ATOM 0 HG1 THR A 90 7.268 -8.812 -4.349 1.00 1.72 H new ATOM 0 HG21 THR A 90 8.421 -9.437 -0.991 1.00 0.64 H new ATOM 0 HG22 THR A 90 8.778 -7.714 -0.724 1.00 0.64 H new ATOM 0 HG23 THR A 90 7.097 -8.249 -0.956 1.00 0.64 H new ATOM 1107 N GLY A 91 6.296 -6.033 -1.452 1.00 0.65 N ATOM 1108 CA GLY A 91 4.938 -5.730 -0.923 1.00 0.82 C ATOM 1109 C GLY A 91 4.379 -4.514 -1.655 1.00 0.69 C ATOM 1110 O GLY A 91 3.184 -4.353 -1.789 1.00 0.72 O ATOM 0 H GLY A 91 7.064 -5.838 -0.809 1.00 0.65 H new ATOM 0 HA2 GLY A 91 4.280 -6.588 -1.062 1.00 0.82 H new ATOM 0 HA3 GLY A 91 4.986 -5.535 0.148 1.00 0.82 H new ATOM 1114 N LEU A 92 5.238 -3.658 -2.137 1.00 0.58 N ATOM 1115 CA LEU A 92 4.763 -2.454 -2.872 1.00 0.49 C ATOM 1116 C LEU A 92 4.227 -2.884 -4.238 1.00 0.39 C ATOM 1117 O LEU A 92 3.296 -2.304 -4.753 1.00 0.44 O ATOM 1118 CB LEU A 92 5.922 -1.476 -3.062 1.00 0.54 C ATOM 1119 CG LEU A 92 5.655 -0.208 -2.251 1.00 0.46 C ATOM 1120 CD1 LEU A 92 6.984 0.456 -1.887 1.00 0.42 C ATOM 1121 CD2 LEU A 92 4.813 0.760 -3.085 1.00 1.03 C ATOM 0 H LEU A 92 6.251 -3.742 -2.053 1.00 0.58 H new ATOM 0 HA LEU A 92 3.973 -1.965 -2.303 1.00 0.49 H new ATOM 0 HB2 LEU A 92 6.857 -1.936 -2.741 1.00 0.54 H new ATOM 0 HB3 LEU A 92 6.034 -1.229 -4.118 1.00 0.54 H new ATOM 0 HG LEU A 92 5.118 -0.466 -1.339 1.00 0.46 H new ATOM 0 HD11 LEU A 92 6.793 1.360 -1.309 1.00 0.42 H new ATOM 0 HD12 LEU A 92 7.585 -0.234 -1.294 1.00 0.42 H new ATOM 0 HD13 LEU A 92 7.523 0.715 -2.798 1.00 0.42 H new ATOM 0 HD21 LEU A 92 4.621 1.665 -2.509 1.00 1.03 H new ATOM 0 HD22 LEU A 92 5.351 1.018 -3.997 1.00 1.03 H new ATOM 0 HD23 LEU A 92 3.866 0.288 -3.344 1.00 1.03 H new ATOM 1133 N LEU A 93 4.809 -3.898 -4.831 1.00 0.32 N ATOM 1134 CA LEU A 93 4.317 -4.362 -6.168 1.00 0.25 C ATOM 1135 C LEU A 93 2.864 -4.847 -6.031 1.00 0.25 C ATOM 1136 O LEU A 93 1.973 -4.427 -6.759 1.00 0.20 O ATOM 1137 CB LEU A 93 5.203 -5.509 -6.671 1.00 0.33 C ATOM 1138 CG LEU A 93 6.409 -4.931 -7.416 1.00 0.80 C ATOM 1139 CD1 LEU A 93 7.672 -5.711 -7.039 1.00 0.67 C ATOM 1140 CD2 LEU A 93 6.175 -5.039 -8.924 1.00 1.27 C ATOM 0 H LEU A 93 5.598 -4.422 -4.451 1.00 0.32 H new ATOM 0 HA LEU A 93 4.359 -3.539 -6.882 1.00 0.25 H new ATOM 0 HB2 LEU A 93 5.538 -6.119 -5.832 1.00 0.33 H new ATOM 0 HB3 LEU A 93 4.632 -6.161 -7.332 1.00 0.33 H new ATOM 0 HG LEU A 93 6.536 -3.884 -7.140 1.00 0.80 H new ATOM 0 HD11 LEU A 93 8.528 -5.297 -7.571 1.00 0.67 H new ATOM 0 HD12 LEU A 93 7.840 -5.634 -5.965 1.00 0.67 H new ATOM 0 HD13 LEU A 93 7.548 -6.759 -7.312 1.00 0.67 H new ATOM 0 HD21 LEU A 93 7.033 -4.628 -9.456 1.00 1.27 H new ATOM 0 HD22 LEU A 93 6.046 -6.086 -9.198 1.00 1.27 H new ATOM 0 HD23 LEU A 93 5.279 -4.480 -9.194 1.00 1.27 H new ATOM 1152 N GLU A 94 2.603 -5.715 -5.092 1.00 0.32 N ATOM 1153 CA GLU A 94 1.207 -6.188 -4.909 1.00 0.33 C ATOM 1154 C GLU A 94 0.361 -4.979 -4.519 1.00 0.25 C ATOM 1155 O GLU A 94 -0.781 -4.843 -4.915 1.00 0.24 O ATOM 1156 CB GLU A 94 1.156 -7.243 -3.802 1.00 0.46 C ATOM 1157 CG GLU A 94 1.347 -8.633 -4.416 1.00 0.78 C ATOM 1158 CD GLU A 94 0.247 -9.574 -3.919 1.00 1.07 C ATOM 1159 OE1 GLU A 94 -0.831 -9.089 -3.615 1.00 1.54 O ATOM 1160 OE2 GLU A 94 0.499 -10.766 -3.856 1.00 1.20 O ATOM 0 H GLU A 94 3.290 -6.112 -4.451 1.00 0.32 H new ATOM 0 HA GLU A 94 0.829 -6.639 -5.826 1.00 0.33 H new ATOM 0 HB2 GLU A 94 1.934 -7.049 -3.064 1.00 0.46 H new ATOM 0 HB3 GLU A 94 0.201 -7.192 -3.279 1.00 0.46 H new ATOM 0 HG2 GLU A 94 1.318 -8.567 -5.504 1.00 0.78 H new ATOM 0 HG3 GLU A 94 2.326 -9.029 -4.146 1.00 0.78 H new ATOM 1167 N PHE A 95 0.934 -4.083 -3.766 1.00 0.23 N ATOM 1168 CA PHE A 95 0.197 -2.857 -3.362 1.00 0.17 C ATOM 1169 C PHE A 95 -0.200 -2.093 -4.621 1.00 0.12 C ATOM 1170 O PHE A 95 -1.210 -1.425 -4.660 1.00 0.14 O ATOM 1171 CB PHE A 95 1.112 -1.979 -2.511 1.00 0.23 C ATOM 1172 CG PHE A 95 0.810 -2.193 -1.050 1.00 0.21 C ATOM 1173 CD1 PHE A 95 -0.508 -2.120 -0.588 1.00 1.01 C ATOM 1174 CD2 PHE A 95 1.853 -2.461 -0.157 1.00 1.22 C ATOM 1175 CE1 PHE A 95 -0.784 -2.315 0.769 1.00 1.07 C ATOM 1176 CE2 PHE A 95 1.577 -2.657 1.200 1.00 1.17 C ATOM 1177 CZ PHE A 95 0.258 -2.584 1.665 1.00 0.26 C ATOM 0 H PHE A 95 1.888 -4.149 -3.411 1.00 0.23 H new ATOM 0 HA PHE A 95 -0.690 -3.124 -2.788 1.00 0.17 H new ATOM 0 HB2 PHE A 95 2.155 -2.220 -2.715 1.00 0.23 H new ATOM 0 HB3 PHE A 95 0.970 -0.930 -2.771 1.00 0.23 H new ATOM 0 HD1 PHE A 95 -1.312 -1.913 -1.279 1.00 1.01 H new ATOM 0 HD2 PHE A 95 2.870 -2.516 -0.515 1.00 1.22 H new ATOM 0 HE1 PHE A 95 -1.802 -2.258 1.126 1.00 1.07 H new ATOM 0 HE2 PHE A 95 2.382 -2.865 1.890 1.00 1.17 H new ATOM 0 HZ PHE A 95 0.045 -2.735 2.713 1.00 0.26 H new ATOM 1187 N GLU A 96 0.594 -2.195 -5.655 1.00 0.15 N ATOM 1188 CA GLU A 96 0.266 -1.486 -6.920 1.00 0.20 C ATOM 1189 C GLU A 96 -1.025 -2.068 -7.476 1.00 0.23 C ATOM 1190 O GLU A 96 -1.883 -1.349 -7.937 1.00 0.26 O ATOM 1191 CB GLU A 96 1.388 -1.669 -7.945 1.00 0.28 C ATOM 1192 CG GLU A 96 2.596 -0.825 -7.540 1.00 1.22 C ATOM 1193 CD GLU A 96 2.254 0.658 -7.696 1.00 2.34 C ATOM 1194 OE1 GLU A 96 1.640 1.002 -8.694 1.00 2.46 O ATOM 1195 OE2 GLU A 96 2.611 1.424 -6.817 1.00 3.44 O ATOM 0 H GLU A 96 1.456 -2.740 -5.675 1.00 0.15 H new ATOM 0 HA GLU A 96 0.152 -0.421 -6.719 1.00 0.20 H new ATOM 0 HB2 GLU A 96 1.670 -2.720 -8.006 1.00 0.28 H new ATOM 0 HB3 GLU A 96 1.041 -1.374 -8.935 1.00 0.28 H new ATOM 0 HG2 GLU A 96 2.874 -1.039 -6.508 1.00 1.22 H new ATOM 0 HG3 GLU A 96 3.455 -1.079 -8.160 1.00 1.22 H new ATOM 1202 N VAL A 97 -1.177 -3.366 -7.433 1.00 0.22 N ATOM 1203 CA VAL A 97 -2.443 -3.967 -7.957 1.00 0.25 C ATOM 1204 C VAL A 97 -3.631 -3.364 -7.180 1.00 0.24 C ATOM 1205 O VAL A 97 -4.631 -2.964 -7.751 1.00 0.24 O ATOM 1206 CB VAL A 97 -2.390 -5.512 -7.818 1.00 0.30 C ATOM 1207 CG1 VAL A 97 -3.128 -6.006 -6.559 1.00 0.81 C ATOM 1208 CG2 VAL A 97 -3.037 -6.146 -9.050 1.00 0.31 C ATOM 0 H VAL A 97 -0.493 -4.028 -7.065 1.00 0.22 H new ATOM 0 HA VAL A 97 -2.566 -3.740 -9.016 1.00 0.25 H new ATOM 0 HB VAL A 97 -1.343 -5.803 -7.731 1.00 0.30 H new ATOM 0 HG11 VAL A 97 -3.065 -7.093 -6.503 1.00 0.81 H new ATOM 0 HG12 VAL A 97 -2.668 -5.570 -5.673 1.00 0.81 H new ATOM 0 HG13 VAL A 97 -4.175 -5.706 -6.609 1.00 0.81 H new ATOM 0 HG21 VAL A 97 -3.004 -7.232 -8.960 1.00 0.31 H new ATOM 0 HG22 VAL A 97 -4.074 -5.820 -9.125 1.00 0.31 H new ATOM 0 HG23 VAL A 97 -2.495 -5.839 -9.944 1.00 0.31 H new ATOM 1218 N TYR A 98 -3.517 -3.290 -5.880 1.00 0.27 N ATOM 1219 CA TYR A 98 -4.623 -2.704 -5.070 1.00 0.26 C ATOM 1220 C TYR A 98 -4.758 -1.222 -5.432 1.00 0.23 C ATOM 1221 O TYR A 98 -5.821 -0.635 -5.329 1.00 0.21 O ATOM 1222 CB TYR A 98 -4.299 -2.845 -3.582 1.00 0.27 C ATOM 1223 CG TYR A 98 -4.358 -4.303 -3.198 1.00 0.35 C ATOM 1224 CD1 TYR A 98 -5.591 -4.908 -2.931 1.00 0.54 C ATOM 1225 CD2 TYR A 98 -3.179 -5.050 -3.115 1.00 0.34 C ATOM 1226 CE1 TYR A 98 -5.644 -6.262 -2.582 1.00 0.61 C ATOM 1227 CE2 TYR A 98 -3.230 -6.404 -2.765 1.00 0.41 C ATOM 1228 CZ TYR A 98 -4.464 -7.010 -2.499 1.00 0.51 C ATOM 1229 OH TYR A 98 -4.515 -8.346 -2.155 1.00 0.59 O ATOM 0 H TYR A 98 -2.708 -3.609 -5.346 1.00 0.27 H new ATOM 0 HA TYR A 98 -5.557 -3.225 -5.279 1.00 0.26 H new ATOM 0 HB2 TYR A 98 -3.308 -2.441 -3.373 1.00 0.27 H new ATOM 0 HB3 TYR A 98 -5.009 -2.271 -2.987 1.00 0.27 H new ATOM 0 HD1 TYR A 98 -6.501 -4.330 -2.994 1.00 0.54 H new ATOM 0 HD2 TYR A 98 -2.228 -4.582 -3.321 1.00 0.34 H new ATOM 0 HE1 TYR A 98 -6.595 -6.730 -2.377 1.00 0.61 H new ATOM 0 HE2 TYR A 98 -2.319 -6.981 -2.700 1.00 0.41 H new ATOM 0 HH TYR A 98 -3.618 -8.735 -2.222 1.00 0.59 H new ATOM 1239 N LEU A 99 -3.692 -0.620 -5.886 1.00 0.22 N ATOM 1240 CA LEU A 99 -3.755 0.807 -6.287 1.00 0.20 C ATOM 1241 C LEU A 99 -4.514 0.872 -7.605 1.00 0.16 C ATOM 1242 O LEU A 99 -5.192 1.833 -7.904 1.00 0.14 O ATOM 1243 CB LEU A 99 -2.339 1.358 -6.453 1.00 0.24 C ATOM 1244 CG LEU A 99 -1.699 1.503 -5.072 1.00 0.31 C ATOM 1245 CD1 LEU A 99 -0.178 1.420 -5.196 1.00 0.53 C ATOM 1246 CD2 LEU A 99 -2.088 2.854 -4.472 1.00 0.19 C ATOM 0 H LEU A 99 -2.778 -1.060 -5.995 1.00 0.22 H new ATOM 0 HA LEU A 99 -4.260 1.407 -5.530 1.00 0.20 H new ATOM 0 HB2 LEU A 99 -1.745 0.689 -7.075 1.00 0.24 H new ATOM 0 HB3 LEU A 99 -2.367 2.323 -6.959 1.00 0.24 H new ATOM 0 HG LEU A 99 -2.051 0.700 -4.425 1.00 0.31 H new ATOM 0 HD11 LEU A 99 0.274 1.524 -4.209 1.00 0.53 H new ATOM 0 HD12 LEU A 99 0.100 0.456 -5.623 1.00 0.53 H new ATOM 0 HD13 LEU A 99 0.178 2.220 -5.844 1.00 0.53 H new ATOM 0 HD21 LEU A 99 -1.633 2.959 -3.487 1.00 0.19 H new ATOM 0 HD22 LEU A 99 -1.737 3.655 -5.122 1.00 0.19 H new ATOM 0 HD23 LEU A 99 -3.172 2.912 -4.378 1.00 0.19 H new ATOM 1258 N GLU A 100 -4.453 -0.189 -8.366 1.00 0.19 N ATOM 1259 CA GLU A 100 -5.216 -0.250 -9.628 1.00 0.18 C ATOM 1260 C GLU A 100 -6.682 -0.165 -9.225 1.00 0.21 C ATOM 1261 O GLU A 100 -7.501 0.444 -9.884 1.00 0.23 O ATOM 1262 CB GLU A 100 -4.932 -1.587 -10.317 1.00 0.20 C ATOM 1263 CG GLU A 100 -4.988 -1.415 -11.833 1.00 0.19 C ATOM 1264 CD GLU A 100 -6.396 -0.986 -12.249 1.00 0.80 C ATOM 1265 OE1 GLU A 100 -7.335 -1.673 -11.884 1.00 1.46 O ATOM 1266 OE2 GLU A 100 -6.511 0.022 -12.926 1.00 0.77 O ATOM 0 H GLU A 100 -3.899 -1.020 -8.157 1.00 0.19 H new ATOM 0 HA GLU A 100 -4.948 0.550 -10.318 1.00 0.18 H new ATOM 0 HB2 GLU A 100 -3.950 -1.957 -10.021 1.00 0.20 H new ATOM 0 HB3 GLU A 100 -5.662 -2.331 -10.000 1.00 0.20 H new ATOM 0 HG2 GLU A 100 -4.260 -0.668 -12.152 1.00 0.19 H new ATOM 0 HG3 GLU A 100 -4.721 -2.350 -12.325 1.00 0.19 H new ATOM 1273 N TYR A 101 -6.991 -0.753 -8.100 1.00 0.25 N ATOM 1274 CA TYR A 101 -8.372 -0.700 -7.573 1.00 0.31 C ATOM 1275 C TYR A 101 -8.760 0.757 -7.369 1.00 0.29 C ATOM 1276 O TYR A 101 -9.799 1.210 -7.807 1.00 0.34 O ATOM 1277 CB TYR A 101 -8.419 -1.426 -6.226 1.00 0.36 C ATOM 1278 CG TYR A 101 -9.529 -2.441 -6.239 1.00 0.31 C ATOM 1279 CD1 TYR A 101 -9.594 -3.386 -7.266 1.00 0.24 C ATOM 1280 CD2 TYR A 101 -10.491 -2.436 -5.226 1.00 0.41 C ATOM 1281 CE1 TYR A 101 -10.627 -4.329 -7.283 1.00 0.29 C ATOM 1282 CE2 TYR A 101 -11.525 -3.378 -5.240 1.00 0.43 C ATOM 1283 CZ TYR A 101 -11.593 -4.326 -6.270 1.00 0.38 C ATOM 1284 OH TYR A 101 -12.612 -5.256 -6.284 1.00 0.46 O ATOM 0 H TYR A 101 -6.331 -1.273 -7.521 1.00 0.25 H new ATOM 0 HA TYR A 101 -9.060 -1.175 -8.272 1.00 0.31 H new ATOM 0 HB2 TYR A 101 -7.465 -1.917 -6.033 1.00 0.36 H new ATOM 0 HB3 TYR A 101 -8.577 -0.709 -5.420 1.00 0.36 H new ATOM 0 HD1 TYR A 101 -8.847 -3.388 -8.046 1.00 0.24 H new ATOM 0 HD2 TYR A 101 -10.436 -1.705 -4.433 1.00 0.41 H new ATOM 0 HE1 TYR A 101 -10.679 -5.059 -8.077 1.00 0.29 H new ATOM 0 HE2 TYR A 101 -12.270 -3.375 -4.458 1.00 0.43 H new ATOM 0 HH TYR A 101 -12.802 -5.547 -5.368 1.00 0.46 H new ATOM 1294 N LEU A 102 -7.932 1.483 -6.683 1.00 0.23 N ATOM 1295 CA LEU A 102 -8.230 2.915 -6.412 1.00 0.23 C ATOM 1296 C LEU A 102 -7.635 3.799 -7.510 1.00 0.22 C ATOM 1297 O LEU A 102 -7.578 5.005 -7.380 1.00 0.27 O ATOM 1298 CB LEU A 102 -7.628 3.298 -5.060 1.00 0.19 C ATOM 1299 CG LEU A 102 -7.917 2.198 -4.034 1.00 0.24 C ATOM 1300 CD1 LEU A 102 -6.646 1.891 -3.248 1.00 0.23 C ATOM 1301 CD2 LEU A 102 -9.015 2.667 -3.085 1.00 0.29 C ATOM 0 H LEU A 102 -7.052 1.145 -6.293 1.00 0.23 H new ATOM 0 HA LEU A 102 -9.310 3.063 -6.395 1.00 0.23 H new ATOM 0 HB2 LEU A 102 -6.552 3.443 -5.158 1.00 0.19 H new ATOM 0 HB3 LEU A 102 -8.047 4.245 -4.720 1.00 0.19 H new ATOM 0 HG LEU A 102 -8.248 1.295 -4.546 1.00 0.24 H new ATOM 0 HD11 LEU A 102 -6.850 1.108 -2.517 1.00 0.23 H new ATOM 0 HD12 LEU A 102 -5.867 1.554 -3.932 1.00 0.23 H new ATOM 0 HD13 LEU A 102 -6.311 2.791 -2.732 1.00 0.23 H new ATOM 0 HD21 LEU A 102 -9.222 1.886 -2.354 1.00 0.29 H new ATOM 0 HD22 LEU A 102 -8.689 3.570 -2.569 1.00 0.29 H new ATOM 0 HD23 LEU A 102 -9.920 2.881 -3.653 1.00 0.29 H new ATOM 1313 N GLN A 103 -7.186 3.218 -8.589 1.00 0.19 N ATOM 1314 CA GLN A 103 -6.598 4.040 -9.681 1.00 0.21 C ATOM 1315 C GLN A 103 -7.710 4.491 -10.630 1.00 0.30 C ATOM 1316 O GLN A 103 -7.587 5.481 -11.325 1.00 0.48 O ATOM 1317 CB GLN A 103 -5.575 3.202 -10.453 1.00 0.12 C ATOM 1318 CG GLN A 103 -4.974 4.039 -11.584 1.00 0.08 C ATOM 1319 CD GLN A 103 -4.239 3.122 -12.561 1.00 0.46 C ATOM 1320 OE1 GLN A 103 -4.049 1.953 -12.290 1.00 1.29 O ATOM 1321 NE2 GLN A 103 -3.815 3.606 -13.697 1.00 0.68 N ATOM 0 H GLN A 103 -7.201 2.213 -8.760 1.00 0.19 H new ATOM 0 HA GLN A 103 -6.105 4.915 -9.257 1.00 0.21 H new ATOM 0 HB2 GLN A 103 -4.787 2.862 -9.781 1.00 0.12 H new ATOM 0 HB3 GLN A 103 -6.053 2.311 -10.861 1.00 0.12 H new ATOM 0 HG2 GLN A 103 -5.761 4.586 -12.104 1.00 0.08 H new ATOM 0 HG3 GLN A 103 -4.286 4.780 -11.177 1.00 0.08 H new ATOM 0 HE21 GLN A 103 -3.975 4.587 -13.925 1.00 0.68 H new ATOM 0 HE22 GLN A 103 -3.324 3.003 -14.357 1.00 0.68 H new ATOM 1330 N ASN A 104 -8.796 3.766 -10.672 1.00 0.20 N ATOM 1331 CA ASN A 104 -9.912 4.146 -11.584 1.00 0.29 C ATOM 1332 C ASN A 104 -11.234 4.213 -10.808 1.00 0.36 C ATOM 1333 O ASN A 104 -12.122 4.972 -11.149 1.00 0.48 O ATOM 1334 CB ASN A 104 -10.031 3.104 -12.698 1.00 0.27 C ATOM 1335 CG ASN A 104 -10.232 3.810 -14.039 1.00 0.48 C ATOM 1336 OD1 ASN A 104 -10.814 4.875 -14.097 1.00 1.00 O ATOM 1337 ND2 ASN A 104 -9.772 3.258 -15.129 1.00 1.02 N ATOM 0 H ASN A 104 -8.958 2.928 -10.114 1.00 0.20 H new ATOM 0 HA ASN A 104 -9.703 5.126 -12.012 1.00 0.29 H new ATOM 0 HB2 ASN A 104 -9.133 2.487 -12.731 1.00 0.27 H new ATOM 0 HB3 ASN A 104 -10.869 2.436 -12.498 1.00 0.27 H new ATOM 0 HD21 ASN A 104 -9.901 3.721 -16.029 1.00 1.02 H new ATOM 0 HD22 ASN A 104 -9.283 2.364 -15.081 1.00 1.02 H new ATOM 1344 N ARG A 105 -11.381 3.431 -9.773 1.00 0.32 N ATOM 1345 CA ARG A 105 -12.651 3.463 -8.994 1.00 0.41 C ATOM 1346 C ARG A 105 -12.907 4.888 -8.507 1.00 0.47 C ATOM 1347 O ARG A 105 -14.028 5.357 -8.489 1.00 0.70 O ATOM 1348 CB ARG A 105 -12.537 2.530 -7.788 1.00 0.42 C ATOM 1349 CG ARG A 105 -12.965 1.118 -8.190 1.00 0.71 C ATOM 1350 CD ARG A 105 -13.144 0.264 -6.934 1.00 1.12 C ATOM 1351 NE ARG A 105 -14.593 -0.003 -6.719 1.00 0.89 N ATOM 1352 CZ ARG A 105 -15.212 0.533 -5.702 1.00 1.40 C ATOM 1353 NH1 ARG A 105 -15.570 1.787 -5.745 1.00 1.47 N ATOM 1354 NH2 ARG A 105 -15.467 -0.184 -4.643 1.00 2.61 N ATOM 0 H ARG A 105 -10.679 2.773 -9.434 1.00 0.32 H new ATOM 0 HA ARG A 105 -13.475 3.136 -9.629 1.00 0.41 H new ATOM 0 HB2 ARG A 105 -11.511 2.519 -7.420 1.00 0.42 H new ATOM 0 HB3 ARG A 105 -13.164 2.893 -6.974 1.00 0.42 H new ATOM 0 HG2 ARG A 105 -13.897 1.155 -8.753 1.00 0.71 H new ATOM 0 HG3 ARG A 105 -12.215 0.671 -8.843 1.00 0.71 H new ATOM 0 HD2 ARG A 105 -12.602 -0.676 -7.040 1.00 1.12 H new ATOM 0 HD3 ARG A 105 -12.725 0.778 -6.069 1.00 1.12 H new ATOM 0 HE ARG A 105 -15.102 -0.605 -7.366 1.00 0.89 H new ATOM 0 HH11 ARG A 105 -15.366 2.347 -6.573 1.00 1.47 H new ATOM 0 HH12 ARG A 105 -16.054 2.207 -4.951 1.00 1.47 H new ATOM 0 HH21 ARG A 105 -15.183 -1.163 -4.609 1.00 2.61 H new ATOM 0 HH22 ARG A 105 -15.951 0.234 -3.848 1.00 2.61 H new ATOM 1368 N PHE A 106 -11.876 5.579 -8.111 1.00 0.37 N ATOM 1369 CA PHE A 106 -12.057 6.976 -7.627 1.00 0.46 C ATOM 1370 C PHE A 106 -12.503 7.861 -8.794 1.00 0.44 C ATOM 1371 O PHE A 106 -11.693 8.431 -9.496 1.00 0.39 O ATOM 1372 CB PHE A 106 -10.733 7.498 -7.064 1.00 0.47 C ATOM 1373 CG PHE A 106 -10.751 7.406 -5.557 1.00 0.59 C ATOM 1374 CD1 PHE A 106 -11.491 8.329 -4.807 1.00 1.19 C ATOM 1375 CD2 PHE A 106 -10.028 6.398 -4.908 1.00 0.62 C ATOM 1376 CE1 PHE A 106 -11.508 8.244 -3.409 1.00 1.33 C ATOM 1377 CE2 PHE A 106 -10.044 6.313 -3.510 1.00 0.61 C ATOM 1378 CZ PHE A 106 -10.783 7.236 -2.761 1.00 0.84 C ATOM 0 H PHE A 106 -10.915 5.237 -8.101 1.00 0.37 H new ATOM 0 HA PHE A 106 -12.814 6.996 -6.843 1.00 0.46 H new ATOM 0 HB2 PHE A 106 -9.902 6.917 -7.464 1.00 0.47 H new ATOM 0 HB3 PHE A 106 -10.577 8.531 -7.373 1.00 0.47 H new ATOM 0 HD1 PHE A 106 -12.049 9.107 -5.307 1.00 1.19 H new ATOM 0 HD2 PHE A 106 -9.458 5.686 -5.486 1.00 0.62 H new ATOM 0 HE1 PHE A 106 -12.080 8.955 -2.831 1.00 1.33 H new ATOM 0 HE2 PHE A 106 -9.486 5.535 -3.010 1.00 0.61 H new ATOM 0 HZ PHE A 106 -10.794 7.171 -1.683 1.00 0.84 H new ATOM 1388 N GLU A 107 -13.785 7.977 -9.010 1.00 0.53 N ATOM 1389 CA GLU A 107 -14.281 8.822 -10.133 1.00 0.53 C ATOM 1390 C GLU A 107 -14.631 10.223 -9.616 1.00 0.54 C ATOM 1391 O GLU A 107 -14.748 11.163 -10.376 1.00 0.53 O ATOM 1392 CB GLU A 107 -15.530 8.180 -10.740 1.00 0.52 C ATOM 1393 CG GLU A 107 -16.053 9.058 -11.879 1.00 1.75 C ATOM 1394 CD GLU A 107 -16.268 8.201 -13.129 1.00 2.21 C ATOM 1395 OE1 GLU A 107 -15.512 7.262 -13.316 1.00 2.54 O ATOM 1396 OE2 GLU A 107 -17.186 8.499 -13.876 1.00 2.74 O ATOM 0 H GLU A 107 -14.511 7.522 -8.456 1.00 0.53 H new ATOM 0 HA GLU A 107 -13.503 8.902 -10.892 1.00 0.53 H new ATOM 0 HB2 GLU A 107 -15.295 7.183 -11.114 1.00 0.52 H new ATOM 0 HB3 GLU A 107 -16.298 8.061 -9.976 1.00 0.52 H new ATOM 0 HG2 GLU A 107 -16.989 9.533 -11.586 1.00 1.75 H new ATOM 0 HG3 GLU A 107 -15.343 9.857 -12.091 1.00 1.75 H new ATOM 1403 N SER A 108 -14.790 10.371 -8.329 1.00 0.56 N ATOM 1404 CA SER A 108 -15.124 11.711 -7.768 1.00 0.57 C ATOM 1405 C SER A 108 -13.823 12.431 -7.433 1.00 0.57 C ATOM 1406 O SER A 108 -13.684 13.623 -7.624 1.00 0.62 O ATOM 1407 CB SER A 108 -15.960 11.542 -6.501 1.00 0.60 C ATOM 1408 OG SER A 108 -17.310 11.276 -6.861 1.00 0.45 O ATOM 0 H SER A 108 -14.703 9.622 -7.642 1.00 0.56 H new ATOM 0 HA SER A 108 -15.696 12.290 -8.493 1.00 0.57 H new ATOM 0 HB2 SER A 108 -15.565 10.725 -5.897 1.00 0.60 H new ATOM 0 HB3 SER A 108 -15.905 12.444 -5.892 1.00 0.60 H new ATOM 0 HG SER A 108 -17.849 11.165 -6.050 1.00 0.45 H new ATOM 1414 N SER A 109 -12.864 11.701 -6.945 1.00 0.56 N ATOM 1415 CA SER A 109 -11.552 12.309 -6.604 1.00 0.59 C ATOM 1416 C SER A 109 -10.471 11.556 -7.371 1.00 0.54 C ATOM 1417 O SER A 109 -9.393 11.310 -6.869 1.00 0.60 O ATOM 1418 CB SER A 109 -11.301 12.184 -5.101 1.00 0.70 C ATOM 1419 OG SER A 109 -10.350 13.161 -4.700 1.00 0.80 O ATOM 0 H SER A 109 -12.934 10.699 -6.766 1.00 0.56 H new ATOM 0 HA SER A 109 -11.541 13.365 -6.873 1.00 0.59 H new ATOM 0 HB2 SER A 109 -12.233 12.321 -4.553 1.00 0.70 H new ATOM 0 HB3 SER A 109 -10.935 11.185 -4.864 1.00 0.70 H new ATOM 0 HG SER A 109 -10.419 13.307 -3.733 1.00 0.80 H new ATOM 1425 N GLU A 110 -10.770 11.173 -8.586 1.00 0.45 N ATOM 1426 CA GLU A 110 -9.795 10.415 -9.416 1.00 0.40 C ATOM 1427 C GLU A 110 -8.401 11.047 -9.319 1.00 0.40 C ATOM 1428 O GLU A 110 -7.399 10.362 -9.295 1.00 0.40 O ATOM 1429 CB GLU A 110 -10.264 10.440 -10.872 1.00 0.35 C ATOM 1430 CG GLU A 110 -9.297 9.635 -11.737 1.00 0.60 C ATOM 1431 CD GLU A 110 -9.451 10.056 -13.199 1.00 1.19 C ATOM 1432 OE1 GLU A 110 -9.663 11.234 -13.436 1.00 1.85 O ATOM 1433 OE2 GLU A 110 -9.354 9.194 -14.058 1.00 1.07 O ATOM 0 H GLU A 110 -11.663 11.358 -9.042 1.00 0.45 H new ATOM 0 HA GLU A 110 -9.737 9.388 -9.054 1.00 0.40 H new ATOM 0 HB2 GLU A 110 -11.268 10.023 -10.948 1.00 0.35 H new ATOM 0 HB3 GLU A 110 -10.317 11.468 -11.230 1.00 0.35 H new ATOM 0 HG2 GLU A 110 -8.272 9.800 -11.406 1.00 0.60 H new ATOM 0 HG3 GLU A 110 -9.498 8.569 -11.631 1.00 0.60 H new ATOM 1440 N GLU A 111 -8.332 12.350 -9.265 1.00 0.44 N ATOM 1441 CA GLU A 111 -7.004 13.024 -9.172 1.00 0.44 C ATOM 1442 C GLU A 111 -6.263 12.534 -7.925 1.00 0.41 C ATOM 1443 O GLU A 111 -5.112 12.149 -7.988 1.00 0.32 O ATOM 1444 CB GLU A 111 -7.208 14.539 -9.084 1.00 0.48 C ATOM 1445 CG GLU A 111 -5.989 15.256 -9.673 1.00 1.31 C ATOM 1446 CD GLU A 111 -6.053 16.745 -9.322 1.00 1.83 C ATOM 1447 OE1 GLU A 111 -7.144 17.228 -9.068 1.00 1.51 O ATOM 1448 OE2 GLU A 111 -5.007 17.376 -9.312 1.00 2.73 O ATOM 0 H GLU A 111 -9.137 12.977 -9.281 1.00 0.44 H new ATOM 0 HA GLU A 111 -6.414 12.786 -10.057 1.00 0.44 H new ATOM 0 HB2 GLU A 111 -8.109 14.827 -9.626 1.00 0.48 H new ATOM 0 HB3 GLU A 111 -7.351 14.837 -8.045 1.00 0.48 H new ATOM 0 HG2 GLU A 111 -5.071 14.818 -9.280 1.00 1.31 H new ATOM 0 HG3 GLU A 111 -5.966 15.127 -10.755 1.00 1.31 H new ATOM 1455 N GLN A 112 -6.910 12.545 -6.788 1.00 0.50 N ATOM 1456 CA GLN A 112 -6.237 12.079 -5.542 1.00 0.48 C ATOM 1457 C GLN A 112 -5.845 10.609 -5.697 1.00 0.35 C ATOM 1458 O GLN A 112 -4.751 10.207 -5.353 1.00 0.35 O ATOM 1459 CB GLN A 112 -7.192 12.237 -4.358 1.00 0.57 C ATOM 1460 CG GLN A 112 -7.359 13.723 -4.033 1.00 0.87 C ATOM 1461 CD GLN A 112 -6.332 14.134 -2.976 1.00 1.30 C ATOM 1462 OE1 GLN A 112 -5.668 13.294 -2.401 1.00 1.87 O ATOM 1463 NE2 GLN A 112 -6.171 15.399 -2.694 1.00 1.44 N ATOM 0 H GLN A 112 -7.874 12.856 -6.670 1.00 0.50 H new ATOM 0 HA GLN A 112 -5.342 12.675 -5.364 1.00 0.48 H new ATOM 0 HB2 GLN A 112 -8.159 11.795 -4.596 1.00 0.57 H new ATOM 0 HB3 GLN A 112 -6.803 11.705 -3.490 1.00 0.57 H new ATOM 0 HG2 GLN A 112 -7.227 14.320 -4.935 1.00 0.87 H new ATOM 0 HG3 GLN A 112 -8.368 13.915 -3.669 1.00 0.87 H new ATOM 0 HE21 GLN A 112 -6.728 16.104 -3.177 1.00 1.44 H new ATOM 0 HE22 GLN A 112 -5.488 15.682 -1.991 1.00 1.44 H new ATOM 1472 N ALA A 113 -6.726 9.804 -6.222 1.00 0.32 N ATOM 1473 CA ALA A 113 -6.400 8.362 -6.412 1.00 0.22 C ATOM 1474 C ALA A 113 -5.165 8.251 -7.309 1.00 0.14 C ATOM 1475 O ALA A 113 -4.417 7.295 -7.240 1.00 0.19 O ATOM 1476 CB ALA A 113 -7.584 7.660 -7.082 1.00 0.30 C ATOM 0 H ALA A 113 -7.658 10.082 -6.528 1.00 0.32 H new ATOM 0 HA ALA A 113 -6.201 7.893 -5.448 1.00 0.22 H new ATOM 0 HB1 ALA A 113 -7.349 6.605 -7.223 1.00 0.30 H new ATOM 0 HB2 ALA A 113 -8.468 7.754 -6.451 1.00 0.30 H new ATOM 0 HB3 ALA A 113 -7.779 8.120 -8.050 1.00 0.30 H new ATOM 1482 N ARG A 114 -4.948 9.228 -8.148 1.00 0.36 N ATOM 1483 CA ARG A 114 -3.765 9.192 -9.053 1.00 0.30 C ATOM 1484 C ARG A 114 -2.526 9.662 -8.288 1.00 0.23 C ATOM 1485 O ARG A 114 -1.417 9.259 -8.577 1.00 0.14 O ATOM 1486 CB ARG A 114 -4.010 10.120 -10.244 1.00 0.41 C ATOM 1487 CG ARG A 114 -3.321 9.551 -11.485 1.00 0.35 C ATOM 1488 CD ARG A 114 -4.340 9.421 -12.619 1.00 0.45 C ATOM 1489 NE ARG A 114 -3.867 8.404 -13.599 1.00 1.14 N ATOM 1490 CZ ARG A 114 -4.645 8.033 -14.578 1.00 1.85 C ATOM 1491 NH1 ARG A 114 -4.759 8.781 -15.641 1.00 1.44 N ATOM 1492 NH2 ARG A 114 -5.309 6.913 -14.494 1.00 3.27 N ATOM 0 H ARG A 114 -5.542 10.052 -8.245 1.00 0.36 H new ATOM 0 HA ARG A 114 -3.608 8.174 -9.410 1.00 0.30 H new ATOM 0 HB2 ARG A 114 -5.080 10.223 -10.424 1.00 0.41 H new ATOM 0 HB3 ARG A 114 -3.626 11.117 -10.027 1.00 0.41 H new ATOM 0 HG2 ARG A 114 -2.502 10.202 -11.790 1.00 0.35 H new ATOM 0 HG3 ARG A 114 -2.886 8.577 -11.259 1.00 0.35 H new ATOM 0 HD2 ARG A 114 -5.311 9.131 -12.218 1.00 0.45 H new ATOM 0 HD3 ARG A 114 -4.474 10.383 -13.114 1.00 0.45 H new ATOM 0 HE ARG A 114 -2.936 7.998 -13.505 1.00 1.14 H new ATOM 0 HH11 ARG A 114 -4.240 9.656 -15.707 1.00 1.44 H new ATOM 0 HH12 ARG A 114 -5.368 8.490 -16.406 1.00 1.44 H new ATOM 0 HH21 ARG A 114 -5.220 6.328 -13.663 1.00 3.27 H new ATOM 0 HH22 ARG A 114 -5.918 6.622 -15.259 1.00 3.27 H new ATOM 1506 N ALA A 115 -2.706 10.509 -7.313 1.00 0.32 N ATOM 1507 CA ALA A 115 -1.540 11.001 -6.529 1.00 0.36 C ATOM 1508 C ALA A 115 -1.032 9.882 -5.618 1.00 0.27 C ATOM 1509 O ALA A 115 0.146 9.788 -5.333 1.00 0.34 O ATOM 1510 CB ALA A 115 -1.962 12.199 -5.675 1.00 0.51 C ATOM 0 H ALA A 115 -3.611 10.882 -7.025 1.00 0.32 H new ATOM 0 HA ALA A 115 -0.747 11.305 -7.213 1.00 0.36 H new ATOM 0 HB1 ALA A 115 -1.106 12.557 -5.102 1.00 0.51 H new ATOM 0 HB2 ALA A 115 -2.325 12.997 -6.322 1.00 0.51 H new ATOM 0 HB3 ALA A 115 -2.756 11.897 -4.991 1.00 0.51 H new ATOM 1516 N VAL A 116 -1.909 9.030 -5.156 1.00 0.16 N ATOM 1517 CA VAL A 116 -1.463 7.923 -4.266 1.00 0.15 C ATOM 1518 C VAL A 116 -0.888 6.782 -5.123 1.00 0.20 C ATOM 1519 O VAL A 116 0.044 6.106 -4.734 1.00 0.37 O ATOM 1520 CB VAL A 116 -2.650 7.422 -3.420 1.00 0.08 C ATOM 1521 CG1 VAL A 116 -3.605 6.568 -4.265 1.00 0.53 C ATOM 1522 CG2 VAL A 116 -2.120 6.582 -2.256 1.00 0.56 C ATOM 0 H VAL A 116 -2.909 9.054 -5.356 1.00 0.16 H new ATOM 0 HA VAL A 116 -0.687 8.283 -3.590 1.00 0.15 H new ATOM 0 HB VAL A 116 -3.198 8.287 -3.045 1.00 0.08 H new ATOM 0 HG11 VAL A 116 -4.434 6.227 -3.645 1.00 0.53 H new ATOM 0 HG12 VAL A 116 -3.992 7.164 -5.091 1.00 0.53 H new ATOM 0 HG13 VAL A 116 -3.069 5.705 -4.660 1.00 0.53 H new ATOM 0 HG21 VAL A 116 -2.956 6.225 -1.654 1.00 0.56 H new ATOM 0 HG22 VAL A 116 -1.564 5.730 -2.646 1.00 0.56 H new ATOM 0 HG23 VAL A 116 -1.462 7.192 -1.637 1.00 0.56 H new ATOM 1532 N GLN A 117 -1.453 6.563 -6.283 1.00 0.15 N ATOM 1533 CA GLN A 117 -0.964 5.469 -7.170 1.00 0.29 C ATOM 1534 C GLN A 117 0.365 5.863 -7.820 1.00 0.30 C ATOM 1535 O GLN A 117 1.394 5.268 -7.567 1.00 0.23 O ATOM 1536 CB GLN A 117 -1.998 5.214 -8.268 1.00 0.36 C ATOM 1537 CG GLN A 117 -1.695 3.883 -8.952 1.00 0.50 C ATOM 1538 CD GLN A 117 -1.176 4.143 -10.369 1.00 0.26 C ATOM 1539 OE1 GLN A 117 -0.495 5.120 -10.608 1.00 1.29 O ATOM 1540 NE2 GLN A 117 -1.471 3.304 -11.326 1.00 0.72 N ATOM 0 H GLN A 117 -2.237 7.100 -6.654 1.00 0.15 H new ATOM 0 HA GLN A 117 -0.816 4.569 -6.573 1.00 0.29 H new ATOM 0 HB2 GLN A 117 -3.001 5.196 -7.841 1.00 0.36 H new ATOM 0 HB3 GLN A 117 -1.977 6.023 -8.998 1.00 0.36 H new ATOM 0 HG2 GLN A 117 -0.953 3.328 -8.378 1.00 0.50 H new ATOM 0 HG3 GLN A 117 -2.594 3.268 -8.990 1.00 0.50 H new ATOM 0 HE21 GLN A 117 -2.043 2.483 -11.126 1.00 0.72 H new ATOM 0 HE22 GLN A 117 -1.130 3.470 -12.273 1.00 0.72 H new ATOM 1549 N MET A 118 0.349 6.853 -8.673 1.00 0.50 N ATOM 1550 CA MET A 118 1.606 7.278 -9.358 1.00 0.57 C ATOM 1551 C MET A 118 2.738 7.440 -8.338 1.00 0.51 C ATOM 1552 O MET A 118 3.896 7.221 -8.641 1.00 0.45 O ATOM 1553 CB MET A 118 1.367 8.608 -10.077 1.00 0.71 C ATOM 1554 CG MET A 118 0.206 8.451 -11.061 1.00 0.71 C ATOM 1555 SD MET A 118 0.290 9.758 -12.310 1.00 1.02 S ATOM 1556 CE MET A 118 -0.053 11.150 -11.208 1.00 1.55 C ATOM 0 H MET A 118 -0.482 7.387 -8.926 1.00 0.50 H new ATOM 0 HA MET A 118 1.893 6.515 -10.082 1.00 0.57 H new ATOM 0 HB2 MET A 118 1.141 9.390 -9.353 1.00 0.71 H new ATOM 0 HB3 MET A 118 2.269 8.915 -10.607 1.00 0.71 H new ATOM 0 HG2 MET A 118 0.251 7.473 -11.540 1.00 0.71 H new ATOM 0 HG3 MET A 118 -0.744 8.502 -10.529 1.00 0.71 H new ATOM 0 HE1 MET A 118 -0.481 11.972 -11.782 1.00 1.55 H new ATOM 0 HE2 MET A 118 -0.759 10.839 -10.438 1.00 1.55 H new ATOM 0 HE3 MET A 118 0.874 11.480 -10.739 1.00 1.55 H new ATOM 1566 N SER A 119 2.418 7.814 -7.131 1.00 0.58 N ATOM 1567 CA SER A 119 3.482 7.980 -6.103 1.00 0.53 C ATOM 1568 C SER A 119 3.983 6.603 -5.661 1.00 0.49 C ATOM 1569 O SER A 119 5.171 6.363 -5.580 1.00 0.46 O ATOM 1570 CB SER A 119 2.920 8.732 -4.896 1.00 0.54 C ATOM 1571 OG SER A 119 3.989 9.109 -4.040 1.00 0.93 O ATOM 0 H SER A 119 1.469 8.011 -6.813 1.00 0.58 H new ATOM 0 HA SER A 119 4.309 8.549 -6.528 1.00 0.53 H new ATOM 0 HB2 SER A 119 2.373 9.616 -5.226 1.00 0.54 H new ATOM 0 HB3 SER A 119 2.212 8.102 -4.357 1.00 0.54 H new ATOM 0 HG SER A 119 3.627 9.448 -3.195 1.00 0.93 H new ATOM 1577 N THR A 120 3.091 5.694 -5.373 1.00 0.49 N ATOM 1578 CA THR A 120 3.531 4.339 -4.937 1.00 0.44 C ATOM 1579 C THR A 120 4.397 3.705 -6.029 1.00 0.38 C ATOM 1580 O THR A 120 5.173 2.807 -5.773 1.00 0.33 O ATOM 1581 CB THR A 120 2.312 3.456 -4.671 1.00 0.51 C ATOM 1582 OG1 THR A 120 1.524 3.367 -5.853 1.00 1.27 O ATOM 1583 CG2 THR A 120 1.485 4.063 -3.532 1.00 0.53 C ATOM 0 H THR A 120 2.081 5.831 -5.421 1.00 0.49 H new ATOM 0 HA THR A 120 4.113 4.430 -4.020 1.00 0.44 H new ATOM 0 HB THR A 120 2.637 2.456 -4.384 1.00 0.51 H new ATOM 0 HG1 THR A 120 1.850 2.628 -6.408 1.00 1.27 H new ATOM 0 HG21 THR A 120 0.615 3.435 -3.340 1.00 0.53 H new ATOM 0 HG22 THR A 120 2.095 4.123 -2.631 1.00 0.53 H new ATOM 0 HG23 THR A 120 1.156 5.063 -3.814 1.00 0.53 H new ATOM 1591 N LYS A 121 4.291 4.179 -7.242 1.00 0.40 N ATOM 1592 CA LYS A 121 5.130 3.615 -8.334 1.00 0.35 C ATOM 1593 C LYS A 121 6.495 4.284 -8.253 1.00 0.29 C ATOM 1594 O LYS A 121 7.521 3.674 -8.473 1.00 0.28 O ATOM 1595 CB LYS A 121 4.491 3.919 -9.691 1.00 0.39 C ATOM 1596 CG LYS A 121 3.432 2.863 -10.009 1.00 0.80 C ATOM 1597 CD LYS A 121 3.660 2.326 -11.423 1.00 0.76 C ATOM 1598 CE LYS A 121 3.442 3.451 -12.437 1.00 1.29 C ATOM 1599 NZ LYS A 121 1.996 3.538 -12.794 1.00 2.30 N ATOM 0 H LYS A 121 3.661 4.931 -7.521 1.00 0.40 H new ATOM 0 HA LYS A 121 5.220 2.534 -8.228 1.00 0.35 H new ATOM 0 HB2 LYS A 121 4.038 4.910 -9.677 1.00 0.39 H new ATOM 0 HB3 LYS A 121 5.254 3.929 -10.469 1.00 0.39 H new ATOM 0 HG2 LYS A 121 3.485 2.049 -9.286 1.00 0.80 H new ATOM 0 HG3 LYS A 121 2.435 3.296 -9.929 1.00 0.80 H new ATOM 0 HD2 LYS A 121 4.672 1.930 -11.515 1.00 0.76 H new ATOM 0 HD3 LYS A 121 2.976 1.502 -11.625 1.00 0.76 H new ATOM 0 HE2 LYS A 121 3.780 4.399 -12.020 1.00 1.29 H new ATOM 0 HE3 LYS A 121 4.036 3.266 -13.332 1.00 1.29 H new ATOM 0 HZ1 LYS A 121 1.854 4.304 -13.483 1.00 2.30 H new ATOM 0 HZ2 LYS A 121 1.686 2.636 -13.210 1.00 2.30 H new ATOM 0 HZ3 LYS A 121 1.438 3.734 -11.938 1.00 2.30 H new ATOM 1613 N VAL A 122 6.502 5.541 -7.912 1.00 0.32 N ATOM 1614 CA VAL A 122 7.783 6.275 -7.780 1.00 0.25 C ATOM 1615 C VAL A 122 8.600 5.641 -6.653 1.00 0.24 C ATOM 1616 O VAL A 122 9.809 5.731 -6.620 1.00 0.19 O ATOM 1617 CB VAL A 122 7.482 7.734 -7.440 1.00 0.28 C ATOM 1618 CG1 VAL A 122 8.790 8.491 -7.236 1.00 0.25 C ATOM 1619 CG2 VAL A 122 6.697 8.370 -8.588 1.00 0.30 C ATOM 0 H VAL A 122 5.667 6.093 -7.718 1.00 0.32 H new ATOM 0 HA VAL A 122 8.347 6.227 -8.711 1.00 0.25 H new ATOM 0 HB VAL A 122 6.892 7.780 -6.525 1.00 0.28 H new ATOM 0 HG11 VAL A 122 8.574 9.532 -6.994 1.00 0.25 H new ATOM 0 HG12 VAL A 122 9.350 8.037 -6.419 1.00 0.25 H new ATOM 0 HG13 VAL A 122 9.382 8.447 -8.150 1.00 0.25 H new ATOM 0 HG21 VAL A 122 6.481 9.411 -8.348 1.00 0.30 H new ATOM 0 HG22 VAL A 122 7.288 8.324 -9.503 1.00 0.30 H new ATOM 0 HG23 VAL A 122 5.762 7.829 -8.733 1.00 0.30 H new ATOM 1629 N LEU A 123 7.940 4.995 -5.728 1.00 0.33 N ATOM 1630 CA LEU A 123 8.665 4.344 -4.601 1.00 0.35 C ATOM 1631 C LEU A 123 9.220 3.000 -5.075 1.00 0.24 C ATOM 1632 O LEU A 123 10.242 2.533 -4.611 1.00 0.22 O ATOM 1633 CB LEU A 123 7.679 4.102 -3.451 1.00 0.53 C ATOM 1634 CG LEU A 123 7.669 5.297 -2.496 1.00 0.50 C ATOM 1635 CD1 LEU A 123 9.022 5.396 -1.795 1.00 0.75 C ATOM 1636 CD2 LEU A 123 7.401 6.587 -3.276 1.00 0.36 C ATOM 0 H LEU A 123 6.926 4.891 -5.706 1.00 0.33 H new ATOM 0 HA LEU A 123 9.481 4.983 -4.264 1.00 0.35 H new ATOM 0 HB2 LEU A 123 6.678 3.939 -3.850 1.00 0.53 H new ATOM 0 HB3 LEU A 123 7.957 3.198 -2.909 1.00 0.53 H new ATOM 0 HG LEU A 123 6.881 5.158 -1.755 1.00 0.50 H new ATOM 0 HD11 LEU A 123 9.017 6.247 -1.114 1.00 0.75 H new ATOM 0 HD12 LEU A 123 9.208 4.481 -1.232 1.00 0.75 H new ATOM 0 HD13 LEU A 123 9.808 5.530 -2.538 1.00 0.75 H new ATOM 0 HD21 LEU A 123 7.395 7.433 -2.589 1.00 0.36 H new ATOM 0 HD22 LEU A 123 8.183 6.730 -4.022 1.00 0.36 H new ATOM 0 HD23 LEU A 123 6.434 6.517 -3.773 1.00 0.36 H new ATOM 1648 N ILE A 124 8.536 2.374 -5.990 1.00 0.26 N ATOM 1649 CA ILE A 124 8.981 1.050 -6.510 1.00 0.25 C ATOM 1650 C ILE A 124 10.205 1.218 -7.410 1.00 0.20 C ATOM 1651 O ILE A 124 11.087 0.383 -7.425 1.00 0.23 O ATOM 1652 CB ILE A 124 7.832 0.430 -7.309 1.00 0.35 C ATOM 1653 CG1 ILE A 124 6.656 0.163 -6.370 1.00 0.16 C ATOM 1654 CG2 ILE A 124 8.279 -0.886 -7.946 1.00 0.65 C ATOM 1655 CD1 ILE A 124 5.379 -0.008 -7.190 1.00 0.39 C ATOM 0 H ILE A 124 7.675 2.728 -6.406 1.00 0.26 H new ATOM 0 HA ILE A 124 9.253 0.402 -5.677 1.00 0.25 H new ATOM 0 HB ILE A 124 7.532 1.121 -8.097 1.00 0.35 H new ATOM 0 HG12 ILE A 124 6.845 -0.734 -5.779 1.00 0.16 H new ATOM 0 HG13 ILE A 124 6.542 0.989 -5.668 1.00 0.16 H new ATOM 0 HG21 ILE A 124 7.452 -1.316 -8.511 1.00 0.65 H new ATOM 0 HG22 ILE A 124 9.118 -0.699 -8.616 1.00 0.65 H new ATOM 0 HG23 ILE A 124 8.586 -1.582 -7.166 1.00 0.65 H new ATOM 0 HD11 ILE A 124 4.540 -0.198 -6.521 1.00 0.39 H new ATOM 0 HD12 ILE A 124 5.189 0.901 -7.761 1.00 0.39 H new ATOM 0 HD13 ILE A 124 5.496 -0.849 -7.874 1.00 0.39 H new ATOM 1667 N GLN A 125 10.263 2.276 -8.167 1.00 0.15 N ATOM 1668 CA GLN A 125 11.421 2.477 -9.071 1.00 0.16 C ATOM 1669 C GLN A 125 12.575 3.127 -8.303 1.00 0.13 C ATOM 1670 O GLN A 125 13.715 2.724 -8.419 1.00 0.17 O ATOM 1671 CB GLN A 125 10.988 3.380 -10.221 1.00 0.18 C ATOM 1672 CG GLN A 125 10.674 2.519 -11.445 1.00 0.34 C ATOM 1673 CD GLN A 125 11.105 3.256 -12.715 1.00 0.48 C ATOM 1674 OE1 GLN A 125 11.314 4.453 -12.697 1.00 0.78 O ATOM 1675 NE2 GLN A 125 11.245 2.587 -13.827 1.00 0.76 N ATOM 0 H GLN A 125 9.556 3.010 -8.197 1.00 0.15 H new ATOM 0 HA GLN A 125 11.760 1.517 -9.460 1.00 0.16 H new ATOM 0 HB2 GLN A 125 10.110 3.959 -9.934 1.00 0.18 H new ATOM 0 HB3 GLN A 125 11.778 4.094 -10.456 1.00 0.18 H new ATOM 0 HG2 GLN A 125 11.193 1.563 -11.373 1.00 0.34 H new ATOM 0 HG3 GLN A 125 9.607 2.300 -11.484 1.00 0.34 H new ATOM 0 HE21 GLN A 125 11.070 1.582 -13.843 1.00 0.76 H new ATOM 0 HE22 GLN A 125 11.530 3.069 -14.680 1.00 0.76 H new ATOM 1684 N PHE A 126 12.290 4.129 -7.521 1.00 0.13 N ATOM 1685 CA PHE A 126 13.373 4.802 -6.749 1.00 0.13 C ATOM 1686 C PHE A 126 14.041 3.793 -5.810 1.00 0.15 C ATOM 1687 O PHE A 126 15.215 3.888 -5.525 1.00 0.23 O ATOM 1688 CB PHE A 126 12.779 5.944 -5.923 1.00 0.17 C ATOM 1689 CG PHE A 126 12.796 7.217 -6.733 1.00 0.21 C ATOM 1690 CD1 PHE A 126 12.240 7.237 -8.018 1.00 0.19 C ATOM 1691 CD2 PHE A 126 13.367 8.379 -6.199 1.00 0.28 C ATOM 1692 CE1 PHE A 126 12.254 8.417 -8.768 1.00 0.25 C ATOM 1693 CE2 PHE A 126 13.381 9.560 -6.950 1.00 0.36 C ATOM 1694 CZ PHE A 126 12.824 9.580 -8.234 1.00 0.34 C ATOM 0 H PHE A 126 11.355 4.512 -7.382 1.00 0.13 H new ATOM 0 HA PHE A 126 14.114 5.199 -7.443 1.00 0.13 H new ATOM 0 HB2 PHE A 126 11.758 5.701 -5.630 1.00 0.17 H new ATOM 0 HB3 PHE A 126 13.351 6.078 -5.005 1.00 0.17 H new ATOM 0 HD1 PHE A 126 11.800 6.341 -8.430 1.00 0.19 H new ATOM 0 HD2 PHE A 126 13.796 8.364 -5.208 1.00 0.28 H new ATOM 0 HE1 PHE A 126 11.825 8.432 -9.759 1.00 0.25 H new ATOM 0 HE2 PHE A 126 13.822 10.456 -6.539 1.00 0.36 H new ATOM 0 HZ PHE A 126 12.834 10.492 -8.813 1.00 0.34 H new ATOM 1704 N LEU A 127 13.299 2.834 -5.322 1.00 0.11 N ATOM 1705 CA LEU A 127 13.895 1.828 -4.391 1.00 0.16 C ATOM 1706 C LEU A 127 14.634 0.746 -5.184 1.00 0.16 C ATOM 1707 O LEU A 127 15.831 0.586 -5.060 1.00 0.42 O ATOM 1708 CB LEU A 127 12.779 1.171 -3.572 1.00 0.18 C ATOM 1709 CG LEU A 127 13.328 0.640 -2.236 1.00 1.02 C ATOM 1710 CD1 LEU A 127 14.519 -0.290 -2.481 1.00 2.65 C ATOM 1711 CD2 LEU A 127 13.772 1.811 -1.356 1.00 0.29 C ATOM 0 H LEU A 127 12.308 2.703 -5.527 1.00 0.11 H new ATOM 0 HA LEU A 127 14.599 2.333 -3.729 1.00 0.16 H new ATOM 0 HB2 LEU A 127 11.985 1.894 -3.384 1.00 0.18 H new ATOM 0 HB3 LEU A 127 12.337 0.353 -4.141 1.00 0.18 H new ATOM 0 HG LEU A 127 12.538 0.082 -1.733 1.00 1.02 H new ATOM 0 HD11 LEU A 127 14.896 -0.657 -1.527 1.00 2.65 H new ATOM 0 HD12 LEU A 127 14.202 -1.133 -3.095 1.00 2.65 H new ATOM 0 HD13 LEU A 127 15.308 0.257 -2.996 1.00 2.65 H new ATOM 0 HD21 LEU A 127 14.160 1.430 -0.411 1.00 0.29 H new ATOM 0 HD22 LEU A 127 14.552 2.375 -1.867 1.00 0.29 H new ATOM 0 HD23 LEU A 127 12.921 2.463 -1.162 1.00 0.29 H new ATOM 1723 N GLN A 128 13.920 -0.012 -5.983 1.00 0.47 N ATOM 1724 CA GLN A 128 14.558 -1.107 -6.782 1.00 0.56 C ATOM 1725 C GLN A 128 15.860 -0.606 -7.414 1.00 0.47 C ATOM 1726 O GLN A 128 16.829 -1.331 -7.529 1.00 0.44 O ATOM 1727 CB GLN A 128 13.593 -1.563 -7.882 1.00 0.73 C ATOM 1728 CG GLN A 128 13.354 -0.421 -8.873 1.00 1.65 C ATOM 1729 CD GLN A 128 12.271 -0.832 -9.874 1.00 1.68 C ATOM 1730 OE1 GLN A 128 11.093 -0.714 -9.597 1.00 2.17 O ATOM 1731 NE2 GLN A 128 12.623 -1.314 -11.035 1.00 2.06 N ATOM 0 H GLN A 128 12.913 0.082 -6.117 1.00 0.47 H new ATOM 0 HA GLN A 128 14.784 -1.946 -6.124 1.00 0.56 H new ATOM 0 HB2 GLN A 128 14.004 -2.428 -8.403 1.00 0.73 H new ATOM 0 HB3 GLN A 128 12.647 -1.877 -7.441 1.00 0.73 H new ATOM 0 HG2 GLN A 128 13.049 0.479 -8.340 1.00 1.65 H new ATOM 0 HG3 GLN A 128 14.278 -0.182 -9.399 1.00 1.65 H new ATOM 0 HE21 GLN A 128 13.611 -1.413 -11.268 1.00 2.06 H new ATOM 0 HE22 GLN A 128 11.910 -1.591 -11.709 1.00 2.06 H new ATOM 1740 N LYS A 129 15.889 0.635 -7.809 1.00 0.46 N ATOM 1741 CA LYS A 129 17.125 1.195 -8.413 1.00 0.41 C ATOM 1742 C LYS A 129 18.088 1.577 -7.288 1.00 0.38 C ATOM 1743 O LYS A 129 19.272 1.310 -7.352 1.00 0.33 O ATOM 1744 CB LYS A 129 16.777 2.440 -9.232 1.00 0.45 C ATOM 1745 CG LYS A 129 16.314 2.022 -10.629 1.00 0.69 C ATOM 1746 CD LYS A 129 15.430 3.118 -11.226 1.00 0.64 C ATOM 1747 CE LYS A 129 16.214 4.431 -11.294 1.00 0.77 C ATOM 1748 NZ LYS A 129 15.590 5.327 -12.309 1.00 1.08 N ATOM 0 H LYS A 129 15.107 1.286 -7.739 1.00 0.46 H new ATOM 0 HA LYS A 129 17.588 0.456 -9.067 1.00 0.41 H new ATOM 0 HB2 LYS A 129 15.992 3.009 -8.733 1.00 0.45 H new ATOM 0 HB3 LYS A 129 17.646 3.094 -9.306 1.00 0.45 H new ATOM 0 HG2 LYS A 129 17.177 1.846 -11.272 1.00 0.69 H new ATOM 0 HG3 LYS A 129 15.761 1.084 -10.574 1.00 0.69 H new ATOM 0 HD2 LYS A 129 15.099 2.829 -12.223 1.00 0.64 H new ATOM 0 HD3 LYS A 129 14.535 3.248 -10.618 1.00 0.64 H new ATOM 0 HE2 LYS A 129 16.218 4.916 -10.318 1.00 0.77 H new ATOM 0 HE3 LYS A 129 17.253 4.234 -11.556 1.00 0.77 H new ATOM 0 HZ1 LYS A 129 16.121 6.220 -12.357 1.00 1.08 H new ATOM 0 HZ2 LYS A 129 15.608 4.863 -13.240 1.00 1.08 H new ATOM 0 HZ3 LYS A 129 14.605 5.524 -12.039 1.00 1.08 H new ATOM 1762 N LYS A 130 17.585 2.195 -6.249 1.00 0.42 N ATOM 1763 CA LYS A 130 18.471 2.585 -5.118 1.00 0.42 C ATOM 1764 C LYS A 130 18.509 1.465 -4.071 1.00 0.48 C ATOM 1765 O LYS A 130 18.766 1.707 -2.910 1.00 0.57 O ATOM 1766 CB LYS A 130 17.985 3.915 -4.496 1.00 0.31 C ATOM 1767 CG LYS A 130 16.879 3.685 -3.452 1.00 1.11 C ATOM 1768 CD LYS A 130 17.462 3.867 -2.047 1.00 0.89 C ATOM 1769 CE LYS A 130 16.941 2.762 -1.125 1.00 1.58 C ATOM 1770 NZ LYS A 130 18.007 2.386 -0.151 1.00 1.49 N ATOM 0 H LYS A 130 16.602 2.444 -6.138 1.00 0.42 H new ATOM 0 HA LYS A 130 19.484 2.737 -5.490 1.00 0.42 H new ATOM 0 HB2 LYS A 130 18.826 4.427 -4.028 1.00 0.31 H new ATOM 0 HB3 LYS A 130 17.612 4.570 -5.283 1.00 0.31 H new ATOM 0 HG2 LYS A 130 16.060 4.387 -3.612 1.00 1.11 H new ATOM 0 HG3 LYS A 130 16.465 2.682 -3.559 1.00 1.11 H new ATOM 0 HD2 LYS A 130 18.551 3.836 -2.088 1.00 0.89 H new ATOM 0 HD3 LYS A 130 17.185 4.844 -1.652 1.00 0.89 H new ATOM 0 HE2 LYS A 130 16.053 3.105 -0.594 1.00 1.58 H new ATOM 0 HE3 LYS A 130 16.646 1.892 -1.712 1.00 1.58 H new ATOM 0 HZ1 LYS A 130 17.592 1.819 0.616 1.00 1.49 H new ATOM 0 HZ2 LYS A 130 18.740 1.830 -0.636 1.00 1.49 H new ATOM 0 HZ3 LYS A 130 18.433 3.247 0.247 1.00 1.49 H new ATOM 1784 N ALA A 131 18.257 0.242 -4.463 1.00 0.46 N ATOM 1785 CA ALA A 131 18.296 -0.870 -3.470 1.00 0.52 C ATOM 1786 C ALA A 131 19.743 -1.353 -3.286 1.00 0.62 C ATOM 1787 O ALA A 131 20.000 -2.537 -3.230 1.00 0.68 O ATOM 1788 CB ALA A 131 17.435 -2.045 -3.953 1.00 0.49 C ATOM 0 H ALA A 131 18.028 -0.032 -5.419 1.00 0.46 H new ATOM 0 HA ALA A 131 17.905 -0.502 -2.521 1.00 0.52 H new ATOM 0 HB1 ALA A 131 17.473 -2.850 -3.219 1.00 0.49 H new ATOM 0 HB2 ALA A 131 16.404 -1.714 -4.076 1.00 0.49 H new ATOM 0 HB3 ALA A 131 17.816 -2.407 -4.908 1.00 0.49 H new ATOM 1794 N LYS A 132 20.697 -0.456 -3.181 1.00 0.72 N ATOM 1795 CA LYS A 132 22.110 -0.894 -2.985 1.00 0.90 C ATOM 1796 C LYS A 132 22.163 -1.868 -1.808 1.00 1.04 C ATOM 1797 O LYS A 132 21.407 -1.749 -0.864 1.00 1.01 O ATOM 1798 CB LYS A 132 23.001 0.321 -2.694 1.00 0.92 C ATOM 1799 CG LYS A 132 22.272 1.298 -1.766 1.00 0.82 C ATOM 1800 CD LYS A 132 23.289 1.999 -0.863 1.00 1.11 C ATOM 1801 CE LYS A 132 23.447 1.208 0.438 1.00 1.43 C ATOM 1802 NZ LYS A 132 23.785 2.141 1.550 1.00 1.90 N ATOM 0 H LYS A 132 20.556 0.553 -3.223 1.00 0.72 H new ATOM 0 HA LYS A 132 22.472 -1.383 -3.889 1.00 0.90 H new ATOM 0 HB2 LYS A 132 23.933 -0.004 -2.232 1.00 0.92 H new ATOM 0 HB3 LYS A 132 23.264 0.820 -3.626 1.00 0.92 H new ATOM 0 HG2 LYS A 132 21.724 2.034 -2.354 1.00 0.82 H new ATOM 0 HG3 LYS A 132 21.540 0.764 -1.161 1.00 0.82 H new ATOM 0 HD2 LYS A 132 24.250 2.078 -1.372 1.00 1.11 H new ATOM 0 HD3 LYS A 132 22.959 3.015 -0.646 1.00 1.11 H new ATOM 0 HE2 LYS A 132 22.525 0.674 0.665 1.00 1.43 H new ATOM 0 HE3 LYS A 132 24.231 0.458 0.327 1.00 1.43 H new ATOM 0 HZ1 LYS A 132 23.892 1.603 2.434 1.00 1.90 H new ATOM 0 HZ2 LYS A 132 24.676 2.632 1.333 1.00 1.90 H new ATOM 0 HZ3 LYS A 132 23.023 2.840 1.660 1.00 1.90 H new ATOM 1816 N ASN A 133 23.022 -2.844 -1.864 1.00 1.24 N ATOM 1817 CA ASN A 133 23.080 -3.831 -0.752 1.00 1.40 C ATOM 1818 C ASN A 133 21.715 -4.501 -0.639 1.00 1.19 C ATOM 1819 O ASN A 133 21.238 -4.805 0.436 1.00 1.25 O ATOM 1820 CB ASN A 133 23.420 -3.120 0.559 1.00 1.59 C ATOM 1821 CG ASN A 133 24.933 -3.126 0.770 1.00 1.38 C ATOM 1822 OD1 ASN A 133 25.690 -2.891 -0.152 1.00 1.11 O ATOM 1823 ND2 ASN A 133 25.412 -3.386 1.956 1.00 2.15 N ATOM 0 H ASN A 133 23.682 -3.001 -2.625 1.00 1.24 H new ATOM 0 HA ASN A 133 23.850 -4.576 -0.951 1.00 1.40 H new ATOM 0 HB2 ASN A 133 23.051 -2.095 0.534 1.00 1.59 H new ATOM 0 HB3 ASN A 133 22.925 -3.617 1.393 1.00 1.59 H new ATOM 0 HD21 ASN A 133 26.420 -3.392 2.109 1.00 2.15 H new ATOM 0 HD22 ASN A 133 24.778 -3.583 2.730 1.00 2.15 H new ATOM 1830 N LEU A 134 21.090 -4.725 -1.757 1.00 0.98 N ATOM 1831 CA LEU A 134 19.749 -5.370 -1.766 1.00 0.79 C ATOM 1832 C LEU A 134 19.628 -6.237 -3.018 1.00 0.88 C ATOM 1833 O LEU A 134 20.605 -6.462 -3.700 1.00 1.05 O ATOM 1834 CB LEU A 134 18.657 -4.298 -1.774 1.00 0.56 C ATOM 1835 CG LEU A 134 17.483 -4.754 -0.905 1.00 1.12 C ATOM 1836 CD1 LEU A 134 17.308 -3.781 0.263 1.00 1.41 C ATOM 1837 CD2 LEU A 134 16.203 -4.775 -1.744 1.00 1.74 C ATOM 0 H LEU A 134 21.456 -4.486 -2.679 1.00 0.98 H new ATOM 0 HA LEU A 134 19.631 -5.987 -0.875 1.00 0.79 H new ATOM 0 HB2 LEU A 134 19.056 -3.356 -1.399 1.00 0.56 H new ATOM 0 HB3 LEU A 134 18.319 -4.117 -2.794 1.00 0.56 H new ATOM 0 HG LEU A 134 17.682 -5.755 -0.521 1.00 1.12 H new ATOM 0 HD11 LEU A 134 16.472 -4.104 0.883 1.00 1.41 H new ATOM 0 HD12 LEU A 134 18.219 -3.764 0.862 1.00 1.41 H new ATOM 0 HD13 LEU A 134 17.108 -2.781 -0.123 1.00 1.41 H new ATOM 0 HD21 LEU A 134 15.367 -5.100 -1.124 1.00 1.74 H new ATOM 0 HD22 LEU A 134 16.003 -3.775 -2.128 1.00 1.74 H new ATOM 0 HD23 LEU A 134 16.326 -5.466 -2.578 1.00 1.74 H new ATOM 1849 N ASP A 135 18.430 -6.703 -3.314 1.00 0.93 N ATOM 1850 CA ASP A 135 18.168 -7.571 -4.523 1.00 1.25 C ATOM 1851 C ASP A 135 17.091 -8.600 -4.167 1.00 2.34 C ATOM 1852 O ASP A 135 17.343 -9.790 -4.151 1.00 3.30 O ATOM 1853 CB ASP A 135 19.418 -8.346 -4.970 1.00 2.05 C ATOM 1854 CG ASP A 135 20.149 -7.562 -6.062 1.00 1.82 C ATOM 1855 OD1 ASP A 135 19.478 -6.963 -6.886 1.00 1.74 O ATOM 1856 OD2 ASP A 135 21.369 -7.574 -6.055 1.00 2.59 O ATOM 0 H ASP A 135 17.599 -6.513 -2.753 1.00 0.93 H new ATOM 0 HA ASP A 135 17.858 -6.913 -5.335 1.00 1.25 H new ATOM 0 HB2 ASP A 135 20.081 -8.508 -4.120 1.00 2.05 H new ATOM 0 HB3 ASP A 135 19.133 -9.330 -5.344 1.00 2.05 H new ATOM 1861 N ALA A 136 15.896 -8.165 -3.885 1.00 2.45 N ATOM 1862 CA ALA A 136 14.831 -9.136 -3.540 1.00 3.68 C ATOM 1863 C ALA A 136 13.473 -8.548 -3.845 1.00 2.46 C ATOM 1864 O ALA A 136 12.611 -8.463 -2.993 1.00 3.19 O ATOM 1865 CB ALA A 136 14.903 -9.491 -2.061 1.00 5.58 C ATOM 0 H ALA A 136 15.615 -7.185 -3.879 1.00 2.45 H new ATOM 0 HA ALA A 136 14.978 -10.037 -4.136 1.00 3.68 H new ATOM 0 HB1 ALA A 136 14.116 -10.205 -1.819 1.00 5.58 H new ATOM 0 HB2 ALA A 136 15.874 -9.933 -1.840 1.00 5.58 H new ATOM 0 HB3 ALA A 136 14.771 -8.589 -1.463 1.00 5.58 H new ATOM 1871 N ILE A 137 13.271 -8.154 -5.055 1.00 0.87 N ATOM 1872 CA ILE A 137 11.963 -7.582 -5.420 1.00 1.13 C ATOM 1873 C ILE A 137 11.045 -8.722 -5.854 1.00 0.83 C ATOM 1874 O ILE A 137 10.719 -8.868 -7.015 1.00 1.26 O ATOM 1875 CB ILE A 137 12.143 -6.565 -6.556 1.00 2.33 C ATOM 1876 CG1 ILE A 137 12.900 -5.287 -6.094 1.00 3.17 C ATOM 1877 CG2 ILE A 137 10.765 -6.150 -7.057 1.00 3.42 C ATOM 1878 CD1 ILE A 137 13.827 -5.538 -4.885 1.00 1.67 C ATOM 0 H ILE A 137 13.955 -8.203 -5.810 1.00 0.87 H new ATOM 0 HA ILE A 137 11.521 -7.064 -4.569 1.00 1.13 H new ATOM 0 HB ILE A 137 12.734 -7.042 -7.338 1.00 2.33 H new ATOM 0 HG12 ILE A 137 13.492 -4.902 -6.924 1.00 3.17 H new ATOM 0 HG13 ILE A 137 12.175 -4.516 -5.835 1.00 3.17 H new ATOM 0 HG21 ILE A 137 10.874 -5.427 -7.865 1.00 3.42 H new ATOM 0 HG22 ILE A 137 10.232 -7.027 -7.424 1.00 3.42 H new ATOM 0 HG23 ILE A 137 10.202 -5.699 -6.240 1.00 3.42 H new ATOM 0 HD11 ILE A 137 14.327 -4.609 -4.610 1.00 1.67 H new ATOM 0 HD12 ILE A 137 13.236 -5.895 -4.042 1.00 1.67 H new ATOM 0 HD13 ILE A 137 14.574 -6.287 -5.148 1.00 1.67 H new ATOM 1890 N THR A 138 10.626 -9.528 -4.923 1.00 2.13 N ATOM 1891 CA THR A 138 9.727 -10.656 -5.271 1.00 2.68 C ATOM 1892 C THR A 138 8.455 -10.095 -5.903 1.00 2.25 C ATOM 1893 O THR A 138 8.132 -8.934 -5.737 1.00 2.07 O ATOM 1894 CB THR A 138 9.363 -11.439 -4.009 1.00 3.39 C ATOM 1895 OG1 THR A 138 10.351 -11.224 -3.010 1.00 3.39 O ATOM 1896 CG2 THR A 138 9.292 -12.926 -4.341 1.00 4.22 C ATOM 0 H THR A 138 10.868 -9.453 -3.935 1.00 2.13 H new ATOM 0 HA THR A 138 10.231 -11.323 -5.971 1.00 2.68 H new ATOM 0 HB THR A 138 8.396 -11.099 -3.638 1.00 3.39 H new ATOM 0 HG1 THR A 138 10.114 -11.726 -2.202 1.00 3.39 H new ATOM 0 HG21 THR A 138 9.033 -13.487 -3.443 1.00 4.22 H new ATOM 0 HG22 THR A 138 8.533 -13.092 -5.105 1.00 4.22 H new ATOM 0 HG23 THR A 138 10.260 -13.263 -4.712 1.00 4.22 H new ATOM 1904 N THR A 139 7.730 -10.897 -6.629 1.00 2.13 N ATOM 1905 CA THR A 139 6.487 -10.387 -7.263 1.00 1.78 C ATOM 1906 C THR A 139 5.705 -11.553 -7.899 1.00 1.63 C ATOM 1907 O THR A 139 6.304 -12.469 -8.424 1.00 1.69 O ATOM 1908 CB THR A 139 6.869 -9.359 -8.332 1.00 1.49 C ATOM 1909 OG1 THR A 139 5.703 -8.688 -8.783 1.00 1.42 O ATOM 1910 CG2 THR A 139 7.556 -10.054 -9.512 1.00 1.57 C ATOM 0 H THR A 139 7.943 -11.878 -6.810 1.00 2.13 H new ATOM 0 HA THR A 139 5.852 -9.917 -6.512 1.00 1.78 H new ATOM 0 HB THR A 139 7.560 -8.636 -7.899 1.00 1.49 H new ATOM 0 HG1 THR A 139 5.878 -8.278 -9.656 1.00 1.42 H new ATOM 0 HG21 THR A 139 7.823 -9.313 -10.266 1.00 1.57 H new ATOM 0 HG22 THR A 139 8.458 -10.558 -9.163 1.00 1.57 H new ATOM 0 HG23 THR A 139 6.877 -10.787 -9.948 1.00 1.57 H new ATOM 1958 N THR A 143 0.602 -11.680 -14.292 1.00 0.43 N ATOM 1959 CA THR A 143 -0.348 -12.754 -14.681 1.00 0.40 C ATOM 1960 C THR A 143 -1.001 -13.319 -13.421 1.00 0.40 C ATOM 1961 O THR A 143 -2.162 -13.676 -13.422 1.00 0.53 O ATOM 1962 CB THR A 143 0.403 -13.867 -15.415 1.00 0.39 C ATOM 1963 OG1 THR A 143 1.571 -14.211 -14.683 1.00 0.80 O ATOM 1964 CG2 THR A 143 0.797 -13.381 -16.809 1.00 0.78 C ATOM 0 HA THR A 143 -1.113 -12.346 -15.342 1.00 0.40 H new ATOM 0 HB THR A 143 -0.239 -14.743 -15.505 1.00 0.39 H new ATOM 0 HG1 THR A 143 1.932 -13.411 -14.248 1.00 0.80 H new ATOM 0 HG21 THR A 143 1.332 -14.173 -17.333 1.00 0.78 H new ATOM 0 HG22 THR A 143 -0.100 -13.117 -17.369 1.00 0.78 H new ATOM 0 HG23 THR A 143 1.440 -12.506 -16.721 1.00 0.78 H new ATOM 1972 N THR A 144 -0.273 -13.387 -12.335 1.00 0.32 N ATOM 1973 CA THR A 144 -0.881 -13.914 -11.083 1.00 0.32 C ATOM 1974 C THR A 144 -1.537 -12.748 -10.347 1.00 0.34 C ATOM 1975 O THR A 144 -2.565 -12.890 -9.709 1.00 0.34 O ATOM 1976 CB THR A 144 0.202 -14.546 -10.208 1.00 0.42 C ATOM 1977 OG1 THR A 144 1.152 -15.203 -11.035 1.00 0.53 O ATOM 1978 CG2 THR A 144 -0.437 -15.560 -9.257 1.00 0.62 C ATOM 0 H THR A 144 0.704 -13.103 -12.264 1.00 0.32 H new ATOM 0 HA THR A 144 -1.625 -14.677 -11.314 1.00 0.32 H new ATOM 0 HB THR A 144 0.700 -13.770 -9.627 1.00 0.42 H new ATOM 0 HG1 THR A 144 1.848 -15.607 -10.476 1.00 0.53 H new ATOM 0 HG21 THR A 144 0.335 -16.011 -8.633 1.00 0.62 H new ATOM 0 HG22 THR A 144 -1.166 -15.055 -8.624 1.00 0.62 H new ATOM 0 HG23 THR A 144 -0.935 -16.338 -9.836 1.00 0.62 H new ATOM 1986 N ASN A 145 -0.963 -11.585 -10.464 1.00 0.39 N ATOM 1987 CA ASN A 145 -1.558 -10.394 -9.811 1.00 0.45 C ATOM 1988 C ASN A 145 -2.855 -10.062 -10.541 1.00 0.44 C ATOM 1989 O ASN A 145 -3.775 -9.513 -9.976 1.00 0.42 O ATOM 1990 CB ASN A 145 -0.590 -9.212 -9.902 1.00 0.52 C ATOM 1991 CG ASN A 145 -0.455 -8.563 -8.527 1.00 0.37 C ATOM 1992 OD1 ASN A 145 -1.525 -8.362 -7.809 1.00 0.41 O flip ATOM 1993 ND2 ASN A 145 0.635 -8.238 -8.099 1.00 0.40 N flip ATOM 0 H ASN A 145 -0.104 -11.410 -10.986 1.00 0.39 H new ATOM 0 HA ASN A 145 -1.755 -10.595 -8.758 1.00 0.45 H new ATOM 0 HB2 ASN A 145 0.384 -9.551 -10.254 1.00 0.52 H new ATOM 0 HB3 ASN A 145 -0.955 -8.484 -10.626 1.00 0.52 H new ATOM 0 HD21 ASN A 145 1.471 -8.396 -8.661 1.00 0.40 H new ATOM 0 HD22 ASN A 145 0.713 -7.808 -7.178 1.00 0.40 H new ATOM 2000 N ALA A 146 -2.940 -10.419 -11.796 1.00 0.51 N ATOM 2001 CA ALA A 146 -4.186 -10.157 -12.564 1.00 0.54 C ATOM 2002 C ALA A 146 -5.300 -11.014 -11.974 1.00 0.51 C ATOM 2003 O ALA A 146 -6.465 -10.690 -12.075 1.00 0.51 O ATOM 2004 CB ALA A 146 -3.967 -10.531 -14.032 1.00 0.58 C ATOM 0 H ALA A 146 -2.197 -10.881 -12.320 1.00 0.51 H new ATOM 0 HA ALA A 146 -4.455 -9.102 -12.504 1.00 0.54 H new ATOM 0 HB1 ALA A 146 -4.880 -10.339 -14.596 1.00 0.58 H new ATOM 0 HB2 ALA A 146 -3.154 -9.932 -14.443 1.00 0.58 H new ATOM 0 HB3 ALA A 146 -3.711 -11.588 -14.104 1.00 0.58 H new ATOM 2010 N SER A 147 -4.946 -12.100 -11.339 1.00 0.49 N ATOM 2011 CA SER A 147 -5.981 -12.964 -10.720 1.00 0.46 C ATOM 2012 C SER A 147 -6.391 -12.340 -9.387 1.00 0.45 C ATOM 2013 O SER A 147 -7.545 -12.354 -9.016 1.00 0.46 O ATOM 2014 CB SER A 147 -5.419 -14.368 -10.489 1.00 0.43 C ATOM 2015 OG SER A 147 -6.348 -15.128 -9.728 1.00 0.98 O ATOM 0 H SER A 147 -3.985 -12.422 -11.225 1.00 0.49 H new ATOM 0 HA SER A 147 -6.846 -13.043 -11.378 1.00 0.46 H new ATOM 0 HB2 SER A 147 -5.228 -14.857 -11.444 1.00 0.43 H new ATOM 0 HB3 SER A 147 -4.465 -14.308 -9.965 1.00 0.43 H new ATOM 0 HG SER A 147 -5.991 -16.028 -9.580 1.00 0.98 H new ATOM 2021 N LEU A 148 -5.460 -11.769 -8.667 1.00 0.42 N ATOM 2022 CA LEU A 148 -5.837 -11.127 -7.377 1.00 0.40 C ATOM 2023 C LEU A 148 -6.846 -10.017 -7.680 1.00 0.34 C ATOM 2024 O LEU A 148 -7.849 -9.889 -7.021 1.00 0.29 O ATOM 2025 CB LEU A 148 -4.596 -10.530 -6.687 1.00 0.44 C ATOM 2026 CG LEU A 148 -5.025 -9.486 -5.641 1.00 0.44 C ATOM 2027 CD1 LEU A 148 -5.979 -10.124 -4.632 1.00 0.30 C ATOM 2028 CD2 LEU A 148 -3.804 -8.950 -4.909 1.00 0.65 C ATOM 0 H LEU A 148 -4.471 -11.720 -8.913 1.00 0.42 H new ATOM 0 HA LEU A 148 -6.272 -11.869 -6.707 1.00 0.40 H new ATOM 0 HB2 LEU A 148 -4.020 -11.322 -6.207 1.00 0.44 H new ATOM 0 HB3 LEU A 148 -3.945 -10.067 -7.429 1.00 0.44 H new ATOM 0 HG LEU A 148 -5.530 -8.665 -6.151 1.00 0.44 H new ATOM 0 HD11 LEU A 148 -6.279 -9.380 -3.894 1.00 0.30 H new ATOM 0 HD12 LEU A 148 -6.862 -10.497 -5.151 1.00 0.30 H new ATOM 0 HD13 LEU A 148 -5.477 -10.951 -4.130 1.00 0.30 H new ATOM 0 HD21 LEU A 148 -4.117 -8.212 -4.171 1.00 0.65 H new ATOM 0 HD22 LEU A 148 -3.292 -9.771 -4.407 1.00 0.65 H new ATOM 0 HD23 LEU A 148 -3.127 -8.483 -5.624 1.00 0.65 H new ATOM 2040 N LEU A 149 -6.575 -9.212 -8.669 1.00 0.34 N ATOM 2041 CA LEU A 149 -7.512 -8.110 -9.013 1.00 0.28 C ATOM 2042 C LEU A 149 -8.827 -8.718 -9.494 1.00 0.22 C ATOM 2043 O LEU A 149 -9.896 -8.263 -9.144 1.00 0.10 O ATOM 2044 CB LEU A 149 -6.898 -7.252 -10.125 1.00 0.30 C ATOM 2045 CG LEU A 149 -7.903 -6.193 -10.590 1.00 0.36 C ATOM 2046 CD1 LEU A 149 -8.357 -5.351 -9.395 1.00 0.56 C ATOM 2047 CD2 LEU A 149 -7.237 -5.290 -11.629 1.00 0.41 C ATOM 0 H LEU A 149 -5.742 -9.271 -9.255 1.00 0.34 H new ATOM 0 HA LEU A 149 -7.695 -7.484 -8.139 1.00 0.28 H new ATOM 0 HB2 LEU A 149 -5.991 -6.769 -9.763 1.00 0.30 H new ATOM 0 HB3 LEU A 149 -6.609 -7.884 -10.965 1.00 0.30 H new ATOM 0 HG LEU A 149 -8.770 -6.683 -11.032 1.00 0.36 H new ATOM 0 HD11 LEU A 149 -9.072 -4.599 -9.730 1.00 0.56 H new ATOM 0 HD12 LEU A 149 -8.829 -5.996 -8.654 1.00 0.56 H new ATOM 0 HD13 LEU A 149 -7.494 -4.857 -8.949 1.00 0.56 H new ATOM 0 HD21 LEU A 149 -7.948 -4.534 -11.963 1.00 0.41 H new ATOM 0 HD22 LEU A 149 -6.370 -4.801 -11.184 1.00 0.41 H new ATOM 0 HD23 LEU A 149 -6.917 -5.890 -12.481 1.00 0.41 H new ATOM 2059 N THR A 150 -8.756 -9.755 -10.280 1.00 0.31 N ATOM 2060 CA THR A 150 -10.002 -10.403 -10.764 1.00 0.29 C ATOM 2061 C THR A 150 -10.728 -11.027 -9.555 1.00 0.32 C ATOM 2062 O THR A 150 -11.898 -11.346 -9.613 1.00 0.36 O ATOM 2063 CB THR A 150 -9.640 -11.456 -11.845 1.00 0.37 C ATOM 2064 OG1 THR A 150 -10.658 -11.475 -12.834 1.00 0.26 O ATOM 2065 CG2 THR A 150 -9.487 -12.867 -11.258 1.00 0.57 C ATOM 0 H THR A 150 -7.889 -10.181 -10.607 1.00 0.31 H new ATOM 0 HA THR A 150 -10.674 -9.680 -11.226 1.00 0.29 H new ATOM 0 HB THR A 150 -8.680 -11.170 -12.276 1.00 0.37 H new ATOM 0 HG1 THR A 150 -10.434 -12.137 -13.521 1.00 0.26 H new ATOM 0 HG21 THR A 150 -9.234 -13.567 -12.054 1.00 0.57 H new ATOM 0 HG22 THR A 150 -8.694 -12.866 -10.510 1.00 0.57 H new ATOM 0 HG23 THR A 150 -10.424 -13.171 -10.792 1.00 0.57 H new ATOM 2073 N LYS A 151 -10.025 -11.196 -8.460 1.00 0.35 N ATOM 2074 CA LYS A 151 -10.643 -11.787 -7.242 1.00 0.37 C ATOM 2075 C LYS A 151 -11.320 -10.682 -6.424 1.00 0.27 C ATOM 2076 O LYS A 151 -12.399 -10.867 -5.898 1.00 0.30 O ATOM 2077 CB LYS A 151 -9.555 -12.454 -6.397 1.00 0.47 C ATOM 2078 CG LYS A 151 -10.204 -13.386 -5.374 1.00 0.52 C ATOM 2079 CD LYS A 151 -9.141 -13.896 -4.401 1.00 0.94 C ATOM 2080 CE LYS A 151 -9.509 -13.473 -2.979 1.00 0.75 C ATOM 2081 NZ LYS A 151 -10.203 -14.598 -2.292 1.00 1.29 N ATOM 0 H LYS A 151 -9.041 -10.946 -8.363 1.00 0.35 H new ATOM 0 HA LYS A 151 -11.387 -12.529 -7.533 1.00 0.37 H new ATOM 0 HB2 LYS A 151 -8.876 -13.016 -7.038 1.00 0.47 H new ATOM 0 HB3 LYS A 151 -8.959 -11.696 -5.888 1.00 0.47 H new ATOM 0 HG2 LYS A 151 -10.986 -12.857 -4.830 1.00 0.52 H new ATOM 0 HG3 LYS A 151 -10.680 -14.225 -5.881 1.00 0.52 H new ATOM 0 HD2 LYS A 151 -9.068 -14.982 -4.462 1.00 0.94 H new ATOM 0 HD3 LYS A 151 -8.164 -13.495 -4.670 1.00 0.94 H new ATOM 0 HE2 LYS A 151 -8.611 -13.194 -2.427 1.00 0.75 H new ATOM 0 HE3 LYS A 151 -10.154 -12.595 -3.004 1.00 0.75 H new ATOM 0 HZ1 LYS A 151 -10.454 -14.312 -1.324 1.00 1.29 H new ATOM 0 HZ2 LYS A 151 -11.067 -14.844 -2.815 1.00 1.29 H new ATOM 0 HZ3 LYS A 151 -9.573 -15.425 -2.256 1.00 1.29 H new ATOM 2095 N LEU A 152 -10.711 -9.525 -6.327 1.00 0.20 N ATOM 2096 CA LEU A 152 -11.352 -8.421 -5.559 1.00 0.19 C ATOM 2097 C LEU A 152 -12.606 -8.011 -6.319 1.00 0.27 C ATOM 2098 O LEU A 152 -13.591 -7.589 -5.747 1.00 0.29 O ATOM 2099 CB LEU A 152 -10.429 -7.190 -5.452 1.00 0.25 C ATOM 2100 CG LEU A 152 -8.948 -7.584 -5.439 1.00 0.33 C ATOM 2101 CD1 LEU A 152 -8.095 -6.346 -5.150 1.00 0.48 C ATOM 2102 CD2 LEU A 152 -8.698 -8.629 -4.353 1.00 0.52 C ATOM 0 H LEU A 152 -9.807 -9.302 -6.743 1.00 0.20 H new ATOM 0 HA LEU A 152 -11.571 -8.770 -4.550 1.00 0.19 H new ATOM 0 HB2 LEU A 152 -10.619 -6.520 -6.291 1.00 0.25 H new ATOM 0 HB3 LEU A 152 -10.665 -6.637 -4.543 1.00 0.25 H new ATOM 0 HG LEU A 152 -8.680 -8.000 -6.410 1.00 0.33 H new ATOM 0 HD11 LEU A 152 -7.041 -6.624 -5.140 1.00 0.48 H new ATOM 0 HD12 LEU A 152 -8.266 -5.598 -5.924 1.00 0.48 H new ATOM 0 HD13 LEU A 152 -8.370 -5.933 -4.179 1.00 0.48 H new ATOM 0 HD21 LEU A 152 -7.643 -8.905 -4.349 1.00 0.52 H new ATOM 0 HD22 LEU A 152 -8.969 -8.216 -3.381 1.00 0.52 H new ATOM 0 HD23 LEU A 152 -9.303 -9.513 -4.553 1.00 0.52 H new ATOM 2114 N GLN A 153 -12.563 -8.128 -7.616 1.00 0.37 N ATOM 2115 CA GLN A 153 -13.732 -7.743 -8.440 1.00 0.50 C ATOM 2116 C GLN A 153 -14.709 -8.916 -8.548 1.00 0.57 C ATOM 2117 O GLN A 153 -15.861 -8.743 -8.894 1.00 0.72 O ATOM 2118 CB GLN A 153 -13.255 -7.345 -9.839 1.00 0.51 C ATOM 2119 CG GLN A 153 -12.642 -5.945 -9.788 1.00 0.49 C ATOM 2120 CD GLN A 153 -13.494 -4.983 -10.617 1.00 0.33 C ATOM 2121 OE1 GLN A 153 -14.704 -4.973 -10.504 1.00 0.94 O ATOM 2122 NE2 GLN A 153 -12.910 -4.168 -11.452 1.00 0.31 N ATOM 0 H GLN A 153 -11.761 -8.477 -8.141 1.00 0.37 H new ATOM 0 HA GLN A 153 -14.240 -6.901 -7.970 1.00 0.50 H new ATOM 0 HB2 GLN A 153 -12.520 -8.063 -10.202 1.00 0.51 H new ATOM 0 HB3 GLN A 153 -14.091 -7.363 -10.539 1.00 0.51 H new ATOM 0 HG2 GLN A 153 -12.585 -5.599 -8.756 1.00 0.49 H new ATOM 0 HG3 GLN A 153 -11.623 -5.969 -10.173 1.00 0.49 H new ATOM 0 HE21 GLN A 153 -11.894 -4.176 -11.547 1.00 0.31 H new ATOM 0 HE22 GLN A 153 -13.469 -3.522 -12.010 1.00 0.31 H new ATOM 2131 N ALA A 154 -14.265 -10.109 -8.260 1.00 0.50 N ATOM 2132 CA ALA A 154 -15.177 -11.283 -8.353 1.00 0.60 C ATOM 2133 C ALA A 154 -15.989 -11.404 -7.065 1.00 0.56 C ATOM 2134 O ALA A 154 -17.070 -11.959 -7.050 1.00 0.58 O ATOM 2135 CB ALA A 154 -14.352 -12.555 -8.559 1.00 0.61 C ATOM 0 H ALA A 154 -13.312 -10.321 -7.965 1.00 0.50 H new ATOM 0 HA ALA A 154 -15.855 -11.149 -9.196 1.00 0.60 H new ATOM 0 HB1 ALA A 154 -15.019 -13.414 -8.627 1.00 0.61 H new ATOM 0 HB2 ALA A 154 -13.775 -12.469 -9.480 1.00 0.61 H new ATOM 0 HB3 ALA A 154 -13.673 -12.689 -7.717 1.00 0.61 H new ATOM 2141 N GLN A 155 -15.480 -10.888 -5.984 1.00 1.00 N ATOM 2142 CA GLN A 155 -16.223 -10.969 -4.696 1.00 0.96 C ATOM 2143 C GLN A 155 -17.632 -10.398 -4.882 1.00 1.03 C ATOM 2144 O GLN A 155 -17.994 -9.959 -5.956 1.00 1.27 O ATOM 2145 CB GLN A 155 -15.480 -10.159 -3.636 1.00 0.79 C ATOM 2146 CG GLN A 155 -14.042 -10.667 -3.521 1.00 0.80 C ATOM 2147 CD GLN A 155 -13.858 -11.378 -2.179 1.00 0.77 C ATOM 2148 OE1 GLN A 155 -14.624 -12.255 -1.834 1.00 0.90 O ATOM 2149 NE2 GLN A 155 -12.868 -11.034 -1.402 1.00 0.85 N ATOM 0 H GLN A 155 -14.579 -10.412 -5.935 1.00 1.00 H new ATOM 0 HA GLN A 155 -16.294 -12.009 -4.379 1.00 0.96 H new ATOM 0 HB2 GLN A 155 -15.483 -9.102 -3.902 1.00 0.79 H new ATOM 0 HB3 GLN A 155 -15.986 -10.247 -2.675 1.00 0.79 H new ATOM 0 HG2 GLN A 155 -13.820 -11.351 -4.340 1.00 0.80 H new ATOM 0 HG3 GLN A 155 -13.343 -9.834 -3.602 1.00 0.80 H new ATOM 0 HE21 GLN A 155 -12.225 -10.297 -1.692 1.00 0.85 H new ATOM 0 HE22 GLN A 155 -12.737 -11.502 -0.505 1.00 0.85 H new ATOM 2158 N ASN A 156 -18.430 -10.395 -3.849 1.00 0.87 N ATOM 2159 CA ASN A 156 -19.807 -9.847 -3.979 1.00 0.92 C ATOM 2160 C ASN A 156 -19.749 -8.326 -3.862 1.00 0.86 C ATOM 2161 O ASN A 156 -18.761 -7.769 -3.434 1.00 0.84 O ATOM 2162 CB ASN A 156 -20.692 -10.412 -2.866 1.00 0.89 C ATOM 2163 CG ASN A 156 -21.157 -11.817 -3.250 1.00 1.22 C ATOM 2164 OD1 ASN A 156 -21.960 -11.979 -4.149 1.00 1.41 O ATOM 2165 ND2 ASN A 156 -20.684 -12.847 -2.604 1.00 1.51 N ATOM 0 H ASN A 156 -18.187 -10.748 -2.923 1.00 0.87 H new ATOM 0 HA ASN A 156 -20.225 -10.128 -4.946 1.00 0.92 H new ATOM 0 HB2 ASN A 156 -20.139 -10.444 -1.927 1.00 0.89 H new ATOM 0 HB3 ASN A 156 -21.553 -9.763 -2.706 1.00 0.89 H new ATOM 0 HD21 ASN A 156 -20.988 -13.788 -2.853 1.00 1.51 H new ATOM 0 HD22 ASN A 156 -20.011 -12.711 -1.850 1.00 1.51 H new ATOM 2172 N GLN A 157 -20.802 -7.649 -4.236 1.00 0.94 N ATOM 2173 CA GLN A 157 -20.814 -6.157 -4.142 1.00 0.96 C ATOM 2174 C GLN A 157 -20.334 -5.724 -2.758 1.00 0.85 C ATOM 2175 O GLN A 157 -19.538 -4.818 -2.609 1.00 0.96 O ATOM 2176 CB GLN A 157 -22.241 -5.651 -4.348 1.00 1.08 C ATOM 2177 CG GLN A 157 -23.212 -6.420 -3.445 1.00 3.10 C ATOM 2178 CD GLN A 157 -24.600 -6.440 -4.087 1.00 4.05 C ATOM 2179 OE1 GLN A 157 -25.565 -6.011 -3.487 1.00 4.42 O ATOM 2180 NE2 GLN A 157 -24.744 -6.924 -5.291 1.00 4.84 N ATOM 0 H GLN A 157 -21.658 -8.065 -4.604 1.00 0.94 H new ATOM 0 HA GLN A 157 -20.155 -5.744 -4.905 1.00 0.96 H new ATOM 0 HB2 GLN A 157 -22.292 -4.585 -4.125 1.00 1.08 H new ATOM 0 HB3 GLN A 157 -22.530 -5.772 -5.392 1.00 1.08 H new ATOM 0 HG2 GLN A 157 -22.855 -7.439 -3.294 1.00 3.10 H new ATOM 0 HG3 GLN A 157 -23.261 -5.950 -2.463 1.00 3.10 H new ATOM 0 HE21 GLN A 157 -23.934 -7.285 -5.796 1.00 4.84 H new ATOM 0 HE22 GLN A 157 -25.666 -6.942 -5.727 1.00 4.84 H new ATOM 2189 N TRP A 158 -20.829 -6.374 -1.754 1.00 0.66 N ATOM 2190 CA TRP A 158 -20.435 -6.037 -0.355 1.00 0.57 C ATOM 2191 C TRP A 158 -18.909 -6.073 -0.220 1.00 0.50 C ATOM 2192 O TRP A 158 -18.280 -5.088 0.118 1.00 0.53 O ATOM 2193 CB TRP A 158 -21.051 -7.070 0.589 1.00 0.50 C ATOM 2194 CG TRP A 158 -20.686 -6.745 2.003 1.00 0.43 C ATOM 2195 CD1 TRP A 158 -19.648 -7.289 2.680 1.00 0.60 C ATOM 2196 CD2 TRP A 158 -21.336 -5.822 2.921 1.00 0.49 C ATOM 2197 NE1 TRP A 158 -19.621 -6.756 3.957 1.00 0.45 N ATOM 2198 CE2 TRP A 158 -20.642 -5.847 4.154 1.00 0.47 C ATOM 2199 CE3 TRP A 158 -22.453 -4.973 2.806 1.00 0.82 C ATOM 2200 CZ2 TRP A 158 -21.039 -5.057 5.233 1.00 0.74 C ATOM 2201 CZ3 TRP A 158 -22.855 -4.175 3.891 1.00 1.17 C ATOM 2202 CH2 TRP A 158 -22.150 -4.218 5.102 1.00 1.13 C ATOM 0 H TRP A 158 -21.501 -7.137 -1.837 1.00 0.66 H new ATOM 0 HA TRP A 158 -20.790 -5.038 -0.104 1.00 0.57 H new ATOM 0 HB2 TRP A 158 -22.135 -7.078 0.476 1.00 0.50 H new ATOM 0 HB3 TRP A 158 -20.696 -8.068 0.332 1.00 0.50 H new ATOM 0 HD1 TRP A 158 -18.955 -8.019 2.288 1.00 0.60 H new ATOM 0 HE1 TRP A 158 -18.931 -7.004 4.666 1.00 0.45 H new ATOM 0 HE3 TRP A 158 -23.005 -4.935 1.878 1.00 0.82 H new ATOM 0 HZ2 TRP A 158 -20.492 -5.093 6.163 1.00 0.74 H new ATOM 0 HZ3 TRP A 158 -23.712 -3.525 3.791 1.00 1.17 H new ATOM 0 HH2 TRP A 158 -22.465 -3.604 5.933 1.00 1.13 H new ATOM 2213 N LEU A 159 -18.313 -7.205 -0.472 1.00 0.44 N ATOM 2214 CA LEU A 159 -16.831 -7.312 -0.348 1.00 0.41 C ATOM 2215 C LEU A 159 -16.151 -6.376 -1.353 1.00 0.47 C ATOM 2216 O LEU A 159 -14.979 -6.078 -1.240 1.00 0.55 O ATOM 2217 CB LEU A 159 -16.400 -8.755 -0.618 1.00 0.39 C ATOM 2218 CG LEU A 159 -16.686 -9.615 0.616 1.00 0.29 C ATOM 2219 CD1 LEU A 159 -17.842 -10.572 0.320 1.00 0.68 C ATOM 2220 CD2 LEU A 159 -15.436 -10.423 0.973 1.00 1.10 C ATOM 0 H LEU A 159 -18.787 -8.061 -0.759 1.00 0.44 H new ATOM 0 HA LEU A 159 -16.535 -7.025 0.661 1.00 0.41 H new ATOM 0 HB2 LEU A 159 -16.936 -9.150 -1.481 1.00 0.39 H new ATOM 0 HB3 LEU A 159 -15.338 -8.789 -0.859 1.00 0.39 H new ATOM 0 HG LEU A 159 -16.956 -8.970 1.452 1.00 0.29 H new ATOM 0 HD11 LEU A 159 -18.043 -11.183 1.200 1.00 0.68 H new ATOM 0 HD12 LEU A 159 -18.733 -9.998 0.065 1.00 0.68 H new ATOM 0 HD13 LEU A 159 -17.575 -11.218 -0.516 1.00 0.68 H new ATOM 0 HD21 LEU A 159 -15.638 -11.036 1.851 1.00 1.10 H new ATOM 0 HD22 LEU A 159 -15.167 -11.067 0.135 1.00 1.10 H new ATOM 0 HD23 LEU A 159 -14.612 -9.743 1.187 1.00 1.10 H new ATOM 2232 N GLN A 160 -16.876 -5.901 -2.329 1.00 0.45 N ATOM 2233 CA GLN A 160 -16.268 -4.978 -3.329 1.00 0.54 C ATOM 2234 C GLN A 160 -16.093 -3.609 -2.682 1.00 0.61 C ATOM 2235 O GLN A 160 -15.148 -2.894 -2.954 1.00 0.80 O ATOM 2236 CB GLN A 160 -17.193 -4.856 -4.543 1.00 0.56 C ATOM 2237 CG GLN A 160 -16.446 -5.287 -5.805 1.00 0.90 C ATOM 2238 CD GLN A 160 -17.057 -4.589 -7.022 1.00 1.01 C ATOM 2239 OE1 GLN A 160 -16.351 -4.009 -7.822 1.00 1.58 O ATOM 2240 NE2 GLN A 160 -18.350 -4.620 -7.197 1.00 1.54 N ATOM 0 H GLN A 160 -17.863 -6.112 -2.477 1.00 0.45 H new ATOM 0 HA GLN A 160 -15.302 -5.364 -3.655 1.00 0.54 H new ATOM 0 HB2 GLN A 160 -18.078 -5.477 -4.402 1.00 0.56 H new ATOM 0 HB3 GLN A 160 -17.539 -3.828 -4.647 1.00 0.56 H new ATOM 0 HG2 GLN A 160 -15.389 -5.034 -5.719 1.00 0.90 H new ATOM 0 HG3 GLN A 160 -16.506 -6.369 -5.925 1.00 0.90 H new ATOM 0 HE21 GLN A 160 -18.944 -5.107 -6.526 1.00 1.54 H new ATOM 0 HE22 GLN A 160 -18.767 -4.157 -8.005 1.00 1.54 H new ATOM 2249 N ASP A 161 -16.997 -3.241 -1.819 1.00 0.49 N ATOM 2250 CA ASP A 161 -16.887 -1.925 -1.143 1.00 0.56 C ATOM 2251 C ASP A 161 -15.907 -2.043 0.025 1.00 0.54 C ATOM 2252 O ASP A 161 -15.327 -1.068 0.458 1.00 0.63 O ATOM 2253 CB ASP A 161 -18.261 -1.499 -0.623 1.00 0.65 C ATOM 2254 CG ASP A 161 -18.182 -0.067 -0.089 1.00 0.63 C ATOM 2255 OD1 ASP A 161 -17.306 0.659 -0.528 1.00 0.86 O ATOM 2256 OD2 ASP A 161 -18.998 0.277 0.749 1.00 0.73 O ATOM 0 H ASP A 161 -17.809 -3.798 -1.554 1.00 0.49 H new ATOM 0 HA ASP A 161 -16.526 -1.178 -1.849 1.00 0.56 H new ATOM 0 HB2 ASP A 161 -18.999 -1.560 -1.422 1.00 0.65 H new ATOM 0 HB3 ASP A 161 -18.589 -2.175 0.166 1.00 0.65 H new ATOM 2261 N MET A 162 -15.714 -3.229 0.545 1.00 0.50 N ATOM 2262 CA MET A 162 -14.768 -3.379 1.685 1.00 0.48 C ATOM 2263 C MET A 162 -13.325 -3.373 1.164 1.00 0.42 C ATOM 2264 O MET A 162 -12.426 -2.872 1.809 1.00 0.44 O ATOM 2265 CB MET A 162 -15.102 -4.662 2.491 1.00 0.39 C ATOM 2266 CG MET A 162 -14.348 -5.908 1.983 1.00 1.21 C ATOM 2267 SD MET A 162 -13.113 -6.415 3.212 1.00 0.79 S ATOM 2268 CE MET A 162 -11.751 -5.374 2.631 1.00 0.64 C ATOM 0 H MET A 162 -16.166 -4.088 0.232 1.00 0.50 H new ATOM 0 HA MET A 162 -14.873 -2.536 2.368 1.00 0.48 H new ATOM 0 HB2 MET A 162 -14.857 -4.499 3.540 1.00 0.39 H new ATOM 0 HB3 MET A 162 -16.175 -4.848 2.439 1.00 0.39 H new ATOM 0 HG2 MET A 162 -15.050 -6.722 1.801 1.00 1.21 H new ATOM 0 HG3 MET A 162 -13.861 -5.689 1.033 1.00 1.21 H new ATOM 0 HE1 MET A 162 -10.803 -5.790 2.973 1.00 0.64 H new ATOM 0 HE2 MET A 162 -11.760 -5.338 1.542 1.00 0.64 H new ATOM 0 HE3 MET A 162 -11.869 -4.366 3.028 1.00 0.64 H new ATOM 2278 N THR A 163 -13.098 -3.910 -0.007 1.00 0.39 N ATOM 2279 CA THR A 163 -11.718 -3.929 -0.574 1.00 0.37 C ATOM 2280 C THR A 163 -11.112 -2.520 -0.509 1.00 0.42 C ATOM 2281 O THR A 163 -9.910 -2.350 -0.492 1.00 0.73 O ATOM 2282 CB THR A 163 -11.785 -4.416 -2.030 1.00 0.36 C ATOM 2283 OG1 THR A 163 -12.187 -5.779 -2.043 1.00 0.40 O ATOM 2284 CG2 THR A 163 -10.410 -4.290 -2.692 1.00 0.60 C ATOM 0 H THR A 163 -13.812 -4.338 -0.596 1.00 0.39 H new ATOM 0 HA THR A 163 -11.087 -4.604 0.004 1.00 0.37 H new ATOM 0 HB THR A 163 -12.502 -3.807 -2.581 1.00 0.36 H new ATOM 0 HG1 THR A 163 -13.125 -5.846 -1.768 1.00 0.40 H new ATOM 0 HG21 THR A 163 -10.469 -4.638 -3.723 1.00 0.60 H new ATOM 0 HG22 THR A 163 -10.094 -3.247 -2.679 1.00 0.60 H new ATOM 0 HG23 THR A 163 -9.686 -4.895 -2.146 1.00 0.60 H new ATOM 2292 N THR A 164 -11.934 -1.510 -0.472 1.00 0.52 N ATOM 2293 CA THR A 164 -11.403 -0.120 -0.414 1.00 0.63 C ATOM 2294 C THR A 164 -10.898 0.213 0.999 1.00 0.50 C ATOM 2295 O THR A 164 -9.820 0.748 1.167 1.00 0.36 O ATOM 2296 CB THR A 164 -12.516 0.859 -0.798 1.00 0.81 C ATOM 2297 OG1 THR A 164 -13.508 0.174 -1.550 1.00 1.36 O ATOM 2298 CG2 THR A 164 -11.931 1.995 -1.636 1.00 0.81 C ATOM 0 H THR A 164 -12.951 -1.586 -0.479 1.00 0.52 H new ATOM 0 HA THR A 164 -10.568 -0.034 -1.110 1.00 0.63 H new ATOM 0 HB THR A 164 -12.965 1.272 0.105 1.00 0.81 H new ATOM 0 HG1 THR A 164 -14.192 -0.179 -0.944 1.00 1.36 H new ATOM 0 HG21 THR A 164 -12.724 2.691 -1.909 1.00 0.81 H new ATOM 0 HG22 THR A 164 -11.171 2.520 -1.058 1.00 0.81 H new ATOM 0 HG23 THR A 164 -11.481 1.585 -2.540 1.00 0.81 H new ATOM 2306 N HIS A 165 -11.669 -0.077 2.013 1.00 0.56 N ATOM 2307 CA HIS A 165 -11.222 0.259 3.405 1.00 0.47 C ATOM 2308 C HIS A 165 -9.942 -0.504 3.759 1.00 0.34 C ATOM 2309 O HIS A 165 -8.996 0.060 4.271 1.00 0.44 O ATOM 2310 CB HIS A 165 -12.295 -0.114 4.442 1.00 0.67 C ATOM 2311 CG HIS A 165 -13.677 0.059 3.880 1.00 2.25 C ATOM 2312 ND1 HIS A 165 -14.609 -0.961 3.917 1.00 3.49 N ATOM 2313 CD2 HIS A 165 -14.297 1.114 3.257 1.00 3.74 C ATOM 2314 CE1 HIS A 165 -15.730 -0.509 3.331 1.00 5.60 C ATOM 2315 NE2 HIS A 165 -15.597 0.752 2.910 1.00 5.86 N ATOM 0 H HIS A 165 -12.581 -0.528 1.944 1.00 0.56 H new ATOM 0 HA HIS A 165 -11.044 1.334 3.430 1.00 0.47 H new ATOM 0 HB2 HIS A 165 -12.155 -1.148 4.758 1.00 0.67 H new ATOM 0 HB3 HIS A 165 -12.180 0.509 5.329 1.00 0.67 H new ATOM 0 HD1 HIS A 165 -14.471 -1.889 4.317 1.00 3.49 H new ATOM 0 HD2 HIS A 165 -13.846 2.077 3.065 1.00 3.74 H new ATOM 0 HE1 HIS A 165 -16.630 -1.094 3.214 1.00 5.60 H new ATOM 2323 N LEU A 166 -9.919 -1.787 3.528 1.00 0.29 N ATOM 2324 CA LEU A 166 -8.716 -2.589 3.894 1.00 0.30 C ATOM 2325 C LEU A 166 -7.490 -2.137 3.101 1.00 0.28 C ATOM 2326 O LEU A 166 -6.418 -1.992 3.654 1.00 0.28 O ATOM 2327 CB LEU A 166 -8.976 -4.069 3.618 1.00 0.48 C ATOM 2328 CG LEU A 166 -9.485 -4.760 4.892 1.00 1.58 C ATOM 2329 CD1 LEU A 166 -8.452 -4.611 6.011 1.00 1.44 C ATOM 2330 CD2 LEU A 166 -10.806 -4.127 5.342 1.00 2.73 C ATOM 0 H LEU A 166 -10.680 -2.316 3.102 1.00 0.29 H new ATOM 0 HA LEU A 166 -8.520 -2.437 4.955 1.00 0.30 H new ATOM 0 HB2 LEU A 166 -9.710 -4.175 2.819 1.00 0.48 H new ATOM 0 HB3 LEU A 166 -8.060 -4.550 3.275 1.00 0.48 H new ATOM 0 HG LEU A 166 -9.644 -5.817 4.677 1.00 1.58 H new ATOM 0 HD11 LEU A 166 -8.818 -5.103 6.912 1.00 1.44 H new ATOM 0 HD12 LEU A 166 -7.513 -5.071 5.703 1.00 1.44 H new ATOM 0 HD13 LEU A 166 -8.288 -3.553 6.216 1.00 1.44 H new ATOM 0 HD21 LEU A 166 -11.158 -4.624 6.246 1.00 2.73 H new ATOM 0 HD22 LEU A 166 -10.651 -3.068 5.547 1.00 2.73 H new ATOM 0 HD23 LEU A 166 -11.550 -4.238 4.553 1.00 2.73 H new ATOM 2342 N ILE A 167 -7.611 -1.924 1.817 1.00 0.26 N ATOM 2343 CA ILE A 167 -6.409 -1.495 1.045 1.00 0.25 C ATOM 2344 C ILE A 167 -5.825 -0.232 1.685 1.00 0.21 C ATOM 2345 O ILE A 167 -4.685 -0.202 2.104 1.00 0.30 O ATOM 2346 CB ILE A 167 -6.781 -1.209 -0.414 1.00 0.22 C ATOM 2347 CG1 ILE A 167 -7.176 -2.522 -1.093 1.00 0.23 C ATOM 2348 CG2 ILE A 167 -5.574 -0.592 -1.146 1.00 0.18 C ATOM 2349 CD1 ILE A 167 -7.808 -2.224 -2.454 1.00 0.24 C ATOM 0 H ILE A 167 -8.471 -2.026 1.279 1.00 0.26 H new ATOM 0 HA ILE A 167 -5.670 -2.296 1.063 1.00 0.25 H new ATOM 0 HB ILE A 167 -7.616 -0.509 -0.450 1.00 0.22 H new ATOM 0 HG12 ILE A 167 -6.299 -3.157 -1.219 1.00 0.23 H new ATOM 0 HG13 ILE A 167 -7.879 -3.071 -0.466 1.00 0.23 H new ATOM 0 HG21 ILE A 167 -5.842 -0.390 -2.183 1.00 0.18 H new ATOM 0 HG22 ILE A 167 -5.289 0.339 -0.657 1.00 0.18 H new ATOM 0 HG23 ILE A 167 -4.736 -1.288 -1.117 1.00 0.18 H new ATOM 0 HD11 ILE A 167 -8.089 -3.160 -2.937 1.00 0.24 H new ATOM 0 HD12 ILE A 167 -8.695 -1.606 -2.316 1.00 0.24 H new ATOM 0 HD13 ILE A 167 -7.090 -1.694 -3.080 1.00 0.24 H new ATOM 2361 N LEU A 168 -6.603 0.809 1.763 1.00 0.24 N ATOM 2362 CA LEU A 168 -6.102 2.067 2.374 1.00 0.25 C ATOM 2363 C LEU A 168 -5.739 1.813 3.842 1.00 0.22 C ATOM 2364 O LEU A 168 -4.999 2.564 4.444 1.00 0.23 O ATOM 2365 CB LEU A 168 -7.190 3.137 2.283 1.00 0.37 C ATOM 2366 CG LEU A 168 -7.666 3.250 0.832 1.00 0.50 C ATOM 2367 CD1 LEU A 168 -9.193 3.329 0.794 1.00 0.52 C ATOM 2368 CD2 LEU A 168 -7.081 4.514 0.196 1.00 0.62 C ATOM 0 H LEU A 168 -7.566 0.842 1.429 1.00 0.24 H new ATOM 0 HA LEU A 168 -5.214 2.409 1.842 1.00 0.25 H new ATOM 0 HB2 LEU A 168 -8.026 2.879 2.933 1.00 0.37 H new ATOM 0 HB3 LEU A 168 -6.803 4.096 2.627 1.00 0.37 H new ATOM 0 HG LEU A 168 -7.332 2.373 0.278 1.00 0.50 H new ATOM 0 HD11 LEU A 168 -9.528 3.409 -0.240 1.00 0.52 H new ATOM 0 HD12 LEU A 168 -9.615 2.430 1.243 1.00 0.52 H new ATOM 0 HD13 LEU A 168 -9.526 4.204 1.352 1.00 0.52 H new ATOM 0 HD21 LEU A 168 -7.421 4.593 -0.837 1.00 0.62 H new ATOM 0 HD22 LEU A 168 -7.412 5.389 0.755 1.00 0.62 H new ATOM 0 HD23 LEU A 168 -5.992 4.461 0.217 1.00 0.62 H new ATOM 2380 N ARG A 169 -6.251 0.759 4.422 1.00 0.26 N ATOM 2381 CA ARG A 169 -5.929 0.460 5.847 1.00 0.32 C ATOM 2382 C ARG A 169 -4.467 0.020 5.955 1.00 0.27 C ATOM 2383 O ARG A 169 -3.763 0.396 6.874 1.00 0.30 O ATOM 2384 CB ARG A 169 -6.833 -0.666 6.351 1.00 0.39 C ATOM 2385 CG ARG A 169 -6.505 -0.971 7.814 1.00 0.64 C ATOM 2386 CD ARG A 169 -6.071 -2.433 7.945 1.00 1.75 C ATOM 2387 NE ARG A 169 -5.054 -2.555 9.027 1.00 2.32 N ATOM 2388 CZ ARG A 169 -5.412 -2.438 10.276 1.00 1.80 C ATOM 2389 NH1 ARG A 169 -6.195 -3.331 10.817 1.00 1.80 N ATOM 2390 NH2 ARG A 169 -4.988 -1.428 10.983 1.00 1.94 N ATOM 0 H ARG A 169 -6.878 0.093 3.970 1.00 0.26 H new ATOM 0 HA ARG A 169 -6.090 1.354 6.450 1.00 0.32 H new ATOM 0 HB2 ARG A 169 -7.879 -0.377 6.255 1.00 0.39 H new ATOM 0 HB3 ARG A 169 -6.692 -1.559 5.742 1.00 0.39 H new ATOM 0 HG2 ARG A 169 -5.711 -0.312 8.165 1.00 0.64 H new ATOM 0 HG3 ARG A 169 -7.377 -0.782 8.440 1.00 0.64 H new ATOM 0 HD2 ARG A 169 -6.933 -3.061 8.170 1.00 1.75 H new ATOM 0 HD3 ARG A 169 -5.657 -2.786 7.001 1.00 1.75 H new ATOM 0 HE ARG A 169 -4.077 -2.730 8.791 1.00 2.32 H new ATOM 0 HH11 ARG A 169 -6.527 -4.121 10.263 1.00 1.80 H new ATOM 0 HH12 ARG A 169 -6.475 -3.239 11.794 1.00 1.80 H new ATOM 0 HH21 ARG A 169 -4.377 -0.730 10.560 1.00 1.94 H new ATOM 0 HH22 ARG A 169 -5.268 -1.336 11.960 1.00 1.94 H new ATOM 2404 N SER A 170 -3.999 -0.762 5.020 1.00 0.25 N ATOM 2405 CA SER A 170 -2.589 -1.209 5.066 1.00 0.26 C ATOM 2406 C SER A 170 -1.709 -0.034 4.675 1.00 0.25 C ATOM 2407 O SER A 170 -0.762 0.288 5.344 1.00 0.30 O ATOM 2408 CB SER A 170 -2.385 -2.362 4.083 1.00 0.26 C ATOM 2409 OG SER A 170 -1.900 -3.499 4.785 1.00 0.50 O ATOM 0 H SER A 170 -4.539 -1.108 4.227 1.00 0.25 H new ATOM 0 HA SER A 170 -2.331 -1.554 6.067 1.00 0.26 H new ATOM 0 HB2 SER A 170 -3.325 -2.601 3.586 1.00 0.26 H new ATOM 0 HB3 SER A 170 -1.678 -2.071 3.306 1.00 0.26 H new ATOM 0 HG SER A 170 -1.770 -4.240 4.157 1.00 0.50 H new ATOM 2415 N PHE A 171 -2.025 0.632 3.602 1.00 0.22 N ATOM 2416 CA PHE A 171 -1.197 1.799 3.193 1.00 0.21 C ATOM 2417 C PHE A 171 -1.024 2.739 4.388 1.00 0.22 C ATOM 2418 O PHE A 171 0.038 3.271 4.618 1.00 0.19 O ATOM 2419 CB PHE A 171 -1.879 2.532 2.038 1.00 0.21 C ATOM 2420 CG PHE A 171 -1.536 1.846 0.735 1.00 0.28 C ATOM 2421 CD1 PHE A 171 -0.216 1.462 0.465 1.00 1.39 C ATOM 2422 CD2 PHE A 171 -2.541 1.595 -0.205 1.00 1.70 C ATOM 2423 CE1 PHE A 171 0.099 0.833 -0.740 1.00 1.37 C ATOM 2424 CE2 PHE A 171 -2.226 0.962 -1.412 1.00 1.74 C ATOM 2425 CZ PHE A 171 -0.904 0.582 -1.678 1.00 0.38 C ATOM 0 H PHE A 171 -2.816 0.421 2.993 1.00 0.22 H new ATOM 0 HA PHE A 171 -0.216 1.458 2.862 1.00 0.21 H new ATOM 0 HB2 PHE A 171 -2.959 2.539 2.185 1.00 0.21 H new ATOM 0 HB3 PHE A 171 -1.554 3.572 2.011 1.00 0.21 H new ATOM 0 HD1 PHE A 171 0.560 1.653 1.192 1.00 1.39 H new ATOM 0 HD2 PHE A 171 -3.559 1.890 0.001 1.00 1.70 H new ATOM 0 HE1 PHE A 171 1.118 0.541 -0.947 1.00 1.37 H new ATOM 0 HE2 PHE A 171 -3.001 0.766 -2.138 1.00 1.74 H new ATOM 0 HZ PHE A 171 -0.660 0.094 -2.610 1.00 0.38 H new ATOM 2435 N LYS A 172 -2.054 2.919 5.168 1.00 0.28 N ATOM 2436 CA LYS A 172 -1.933 3.802 6.360 1.00 0.30 C ATOM 2437 C LYS A 172 -0.868 3.230 7.302 1.00 0.28 C ATOM 2438 O LYS A 172 0.180 3.815 7.497 1.00 0.28 O ATOM 2439 CB LYS A 172 -3.277 3.871 7.088 1.00 0.34 C ATOM 2440 CG LYS A 172 -4.204 4.846 6.361 1.00 1.20 C ATOM 2441 CD LYS A 172 -3.580 6.244 6.365 1.00 0.42 C ATOM 2442 CE LYS A 172 -4.681 7.292 6.537 1.00 0.92 C ATOM 2443 NZ LYS A 172 -4.433 8.429 5.608 1.00 1.88 N ATOM 0 H LYS A 172 -2.971 2.494 5.032 1.00 0.28 H new ATOM 0 HA LYS A 172 -1.645 4.805 6.045 1.00 0.30 H new ATOM 0 HB2 LYS A 172 -3.732 2.881 7.127 1.00 0.34 H new ATOM 0 HB3 LYS A 172 -3.128 4.194 8.118 1.00 0.34 H new ATOM 0 HG2 LYS A 172 -4.368 4.513 5.336 1.00 1.20 H new ATOM 0 HG3 LYS A 172 -5.179 4.870 6.849 1.00 1.20 H new ATOM 0 HD2 LYS A 172 -2.854 6.328 7.173 1.00 0.42 H new ATOM 0 HD3 LYS A 172 -3.041 6.416 5.433 1.00 0.42 H new ATOM 0 HE2 LYS A 172 -5.655 6.848 6.334 1.00 0.92 H new ATOM 0 HE3 LYS A 172 -4.702 7.648 7.567 1.00 0.92 H new ATOM 0 HZ1 LYS A 172 -5.088 9.206 5.828 1.00 1.88 H new ATOM 0 HZ2 LYS A 172 -3.453 8.760 5.718 1.00 1.88 H new ATOM 0 HZ3 LYS A 172 -4.585 8.116 4.628 1.00 1.88 H new ATOM 2457 N GLU A 173 -1.121 2.084 7.882 1.00 0.27 N ATOM 2458 CA GLU A 173 -0.113 1.479 8.802 1.00 0.24 C ATOM 2459 C GLU A 173 1.112 1.057 7.989 1.00 0.19 C ATOM 2460 O GLU A 173 2.173 1.622 8.121 1.00 0.21 O ATOM 2461 CB GLU A 173 -0.715 0.253 9.494 1.00 0.22 C ATOM 2462 CG GLU A 173 -1.529 0.697 10.713 1.00 0.91 C ATOM 2463 CD GLU A 173 -0.705 0.486 11.984 1.00 0.66 C ATOM 2464 OE1 GLU A 173 0.510 0.488 11.886 1.00 1.66 O ATOM 2465 OE2 GLU A 173 -1.304 0.328 13.036 1.00 0.92 O ATOM 0 H GLU A 173 -1.978 1.544 7.759 1.00 0.27 H new ATOM 0 HA GLU A 173 0.178 2.208 9.558 1.00 0.24 H new ATOM 0 HB2 GLU A 173 -1.352 -0.293 8.798 1.00 0.22 H new ATOM 0 HB3 GLU A 173 0.078 -0.429 9.802 1.00 0.22 H new ATOM 0 HG2 GLU A 173 -1.805 1.747 10.616 1.00 0.91 H new ATOM 0 HG3 GLU A 173 -2.457 0.128 10.770 1.00 0.91 H new ATOM 2472 N PHE A 174 0.953 0.061 7.154 1.00 0.15 N ATOM 2473 CA PHE A 174 2.073 -0.452 6.288 1.00 0.12 C ATOM 2474 C PHE A 174 3.045 0.670 5.867 1.00 0.17 C ATOM 2475 O PHE A 174 4.190 0.686 6.274 1.00 0.27 O ATOM 2476 CB PHE A 174 1.461 -1.076 5.029 1.00 0.13 C ATOM 2477 CG PHE A 174 2.376 -2.136 4.475 1.00 0.14 C ATOM 2478 CD1 PHE A 174 3.554 -1.762 3.824 1.00 0.81 C ATOM 2479 CD2 PHE A 174 2.045 -3.490 4.609 1.00 0.71 C ATOM 2480 CE1 PHE A 174 4.407 -2.743 3.303 1.00 0.86 C ATOM 2481 CE2 PHE A 174 2.897 -4.472 4.088 1.00 0.67 C ATOM 2482 CZ PHE A 174 4.079 -4.098 3.436 1.00 0.21 C ATOM 0 H PHE A 174 0.071 -0.435 7.029 1.00 0.15 H new ATOM 0 HA PHE A 174 2.641 -1.183 6.863 1.00 0.12 H new ATOM 0 HB2 PHE A 174 0.490 -1.511 5.265 1.00 0.13 H new ATOM 0 HB3 PHE A 174 1.290 -0.304 4.278 1.00 0.13 H new ATOM 0 HD1 PHE A 174 3.807 -0.717 3.723 1.00 0.81 H new ATOM 0 HD2 PHE A 174 1.134 -3.777 5.113 1.00 0.71 H new ATOM 0 HE1 PHE A 174 5.318 -2.455 2.799 1.00 0.86 H new ATOM 0 HE2 PHE A 174 2.643 -5.517 4.189 1.00 0.67 H new ATOM 0 HZ PHE A 174 4.738 -4.855 3.036 1.00 0.21 H new ATOM 2492 N LEU A 175 2.611 1.603 5.053 1.00 0.14 N ATOM 2493 CA LEU A 175 3.545 2.691 4.624 1.00 0.18 C ATOM 2494 C LEU A 175 4.108 3.403 5.859 1.00 0.24 C ATOM 2495 O LEU A 175 5.270 3.755 5.903 1.00 0.28 O ATOM 2496 CB LEU A 175 2.813 3.714 3.745 1.00 0.18 C ATOM 2497 CG LEU A 175 2.361 3.063 2.431 1.00 0.20 C ATOM 2498 CD1 LEU A 175 1.203 3.867 1.836 1.00 0.21 C ATOM 2499 CD2 LEU A 175 3.517 3.056 1.426 1.00 0.20 C ATOM 0 H LEU A 175 1.666 1.659 4.673 1.00 0.14 H new ATOM 0 HA LEU A 175 4.356 2.244 4.049 1.00 0.18 H new ATOM 0 HB2 LEU A 175 1.949 4.109 4.279 1.00 0.18 H new ATOM 0 HB3 LEU A 175 3.470 4.558 3.533 1.00 0.18 H new ATOM 0 HG LEU A 175 2.044 2.040 2.635 1.00 0.20 H new ATOM 0 HD11 LEU A 175 0.881 3.405 0.903 1.00 0.21 H new ATOM 0 HD12 LEU A 175 0.371 3.881 2.540 1.00 0.21 H new ATOM 0 HD13 LEU A 175 1.531 4.888 1.641 1.00 0.21 H new ATOM 0 HD21 LEU A 175 3.188 2.592 0.496 1.00 0.20 H new ATOM 0 HD22 LEU A 175 3.834 4.080 1.229 1.00 0.20 H new ATOM 0 HD23 LEU A 175 4.353 2.491 1.837 1.00 0.20 H new ATOM 2511 N GLN A 176 3.298 3.622 6.860 1.00 0.25 N ATOM 2512 CA GLN A 176 3.801 4.316 8.084 1.00 0.30 C ATOM 2513 C GLN A 176 5.048 3.597 8.614 1.00 0.29 C ATOM 2514 O GLN A 176 6.004 4.220 9.036 1.00 0.39 O ATOM 2515 CB GLN A 176 2.712 4.311 9.162 1.00 0.31 C ATOM 2516 CG GLN A 176 2.142 5.722 9.326 1.00 0.34 C ATOM 2517 CD GLN A 176 2.064 6.074 10.811 1.00 0.28 C ATOM 2518 OE1 GLN A 176 1.623 5.276 11.614 1.00 1.00 O ATOM 2519 NE2 GLN A 176 2.478 7.245 11.214 1.00 1.17 N ATOM 0 H GLN A 176 2.315 3.353 6.885 1.00 0.25 H new ATOM 0 HA GLN A 176 4.058 5.345 7.831 1.00 0.30 H new ATOM 0 HB2 GLN A 176 1.918 3.617 8.887 1.00 0.31 H new ATOM 0 HB3 GLN A 176 3.125 3.963 10.109 1.00 0.31 H new ATOM 0 HG2 GLN A 176 2.772 6.442 8.804 1.00 0.34 H new ATOM 0 HG3 GLN A 176 1.151 5.779 8.876 1.00 0.34 H new ATOM 0 HE21 GLN A 176 2.848 7.915 10.540 1.00 1.17 H new ATOM 0 HE22 GLN A 176 2.431 7.490 12.203 1.00 1.17 H new ATOM 2528 N SER A 177 5.050 2.290 8.590 1.00 0.20 N ATOM 2529 CA SER A 177 6.232 1.535 9.086 1.00 0.19 C ATOM 2530 C SER A 177 7.399 1.746 8.123 1.00 0.22 C ATOM 2531 O SER A 177 8.546 1.758 8.517 1.00 0.24 O ATOM 2532 CB SER A 177 5.891 0.046 9.157 1.00 0.15 C ATOM 2533 OG SER A 177 4.488 -0.107 9.331 1.00 0.98 O ATOM 0 H SER A 177 4.281 1.714 8.247 1.00 0.20 H new ATOM 0 HA SER A 177 6.507 1.890 10.079 1.00 0.19 H new ATOM 0 HB2 SER A 177 6.213 -0.456 8.245 1.00 0.15 H new ATOM 0 HB3 SER A 177 6.425 -0.422 9.984 1.00 0.15 H new ATOM 0 HG SER A 177 4.266 -1.060 9.375 1.00 0.98 H new ATOM 2539 N SER A 178 7.111 1.910 6.862 1.00 0.24 N ATOM 2540 CA SER A 178 8.199 2.121 5.867 1.00 0.29 C ATOM 2541 C SER A 178 8.986 3.388 6.220 1.00 0.29 C ATOM 2542 O SER A 178 10.199 3.381 6.274 1.00 0.42 O ATOM 2543 CB SER A 178 7.587 2.277 4.475 1.00 0.38 C ATOM 2544 OG SER A 178 8.612 2.179 3.495 1.00 0.88 O ATOM 0 H SER A 178 6.167 1.907 6.477 1.00 0.24 H new ATOM 0 HA SER A 178 8.872 1.263 5.880 1.00 0.29 H new ATOM 0 HB2 SER A 178 6.834 1.506 4.308 1.00 0.38 H new ATOM 0 HB3 SER A 178 7.082 3.239 4.394 1.00 0.38 H new ATOM 0 HG SER A 178 9.084 3.035 3.429 1.00 0.88 H new ATOM 2550 N LEU A 179 8.305 4.477 6.455 1.00 0.32 N ATOM 2551 CA LEU A 179 9.012 5.745 6.799 1.00 0.29 C ATOM 2552 C LEU A 179 9.822 5.559 8.087 1.00 0.28 C ATOM 2553 O LEU A 179 10.984 5.906 8.158 1.00 0.24 O ATOM 2554 CB LEU A 179 7.985 6.860 7.013 1.00 0.31 C ATOM 2555 CG LEU A 179 7.382 7.273 5.670 1.00 0.38 C ATOM 2556 CD1 LEU A 179 6.050 6.549 5.462 1.00 0.56 C ATOM 2557 CD2 LEU A 179 7.143 8.785 5.665 1.00 0.55 C ATOM 0 H LEU A 179 7.288 4.544 6.424 1.00 0.32 H new ATOM 0 HA LEU A 179 9.684 6.010 5.982 1.00 0.29 H new ATOM 0 HB2 LEU A 179 7.198 6.518 7.686 1.00 0.31 H new ATOM 0 HB3 LEU A 179 8.460 7.718 7.488 1.00 0.31 H new ATOM 0 HG LEU A 179 8.069 7.007 4.867 1.00 0.38 H new ATOM 0 HD11 LEU A 179 5.621 6.844 4.504 1.00 0.56 H new ATOM 0 HD12 LEU A 179 6.216 5.472 5.468 1.00 0.56 H new ATOM 0 HD13 LEU A 179 5.362 6.815 6.265 1.00 0.56 H new ATOM 0 HD21 LEU A 179 6.713 9.082 4.708 1.00 0.55 H new ATOM 0 HD22 LEU A 179 6.455 9.047 6.469 1.00 0.55 H new ATOM 0 HD23 LEU A 179 8.090 9.304 5.814 1.00 0.55 H new ATOM 2569 N ARG A 180 9.208 5.029 9.111 1.00 0.36 N ATOM 2570 CA ARG A 180 9.931 4.834 10.404 1.00 0.39 C ATOM 2571 C ARG A 180 11.172 3.958 10.200 1.00 0.40 C ATOM 2572 O ARG A 180 12.162 4.101 10.891 1.00 0.49 O ATOM 2573 CB ARG A 180 8.993 4.157 11.408 1.00 0.36 C ATOM 2574 CG ARG A 180 9.178 4.787 12.790 1.00 0.50 C ATOM 2575 CD ARG A 180 8.672 3.821 13.865 1.00 1.27 C ATOM 2576 NE ARG A 180 7.804 4.556 14.827 1.00 1.13 N ATOM 2577 CZ ARG A 180 6.782 3.954 15.375 1.00 1.70 C ATOM 2578 NH1 ARG A 180 5.763 3.601 14.641 1.00 2.31 N ATOM 2579 NH2 ARG A 180 6.780 3.704 16.656 1.00 2.36 N ATOM 0 H ARG A 180 8.235 4.722 9.109 1.00 0.36 H new ATOM 0 HA ARG A 180 10.247 5.807 10.782 1.00 0.39 H new ATOM 0 HB2 ARG A 180 7.958 4.265 11.084 1.00 0.36 H new ATOM 0 HB3 ARG A 180 9.203 3.088 11.453 1.00 0.36 H new ATOM 0 HG2 ARG A 180 10.230 5.016 12.959 1.00 0.50 H new ATOM 0 HG3 ARG A 180 8.633 5.729 12.847 1.00 0.50 H new ATOM 0 HD2 ARG A 180 8.113 3.007 13.403 1.00 1.27 H new ATOM 0 HD3 ARG A 180 9.515 3.371 14.390 1.00 1.27 H new ATOM 0 HE ARG A 180 8.007 5.529 15.058 1.00 1.13 H new ATOM 0 HH11 ARG A 180 5.764 3.795 13.640 1.00 2.31 H new ATOM 0 HH12 ARG A 180 4.965 3.131 15.068 1.00 2.31 H new ATOM 0 HH21 ARG A 180 7.577 3.979 17.230 1.00 2.36 H new ATOM 0 HH22 ARG A 180 5.982 3.234 17.083 1.00 2.36 H new ATOM 2593 N ALA A 181 11.133 3.055 9.261 1.00 0.33 N ATOM 2594 CA ALA A 181 12.313 2.180 9.030 1.00 0.41 C ATOM 2595 C ALA A 181 13.371 2.963 8.260 1.00 0.54 C ATOM 2596 O ALA A 181 14.555 2.721 8.390 1.00 0.54 O ATOM 2597 CB ALA A 181 11.889 0.952 8.222 1.00 0.36 C ATOM 0 H ALA A 181 10.337 2.886 8.646 1.00 0.33 H new ATOM 0 HA ALA A 181 12.723 1.854 9.986 1.00 0.41 H new ATOM 0 HB1 ALA A 181 12.754 0.311 8.053 1.00 0.36 H new ATOM 0 HB2 ALA A 181 11.129 0.398 8.774 1.00 0.36 H new ATOM 0 HB3 ALA A 181 11.481 1.271 7.263 1.00 0.36 H new ATOM 2603 N LEU A 182 12.957 3.910 7.466 1.00 0.66 N ATOM 2604 CA LEU A 182 13.947 4.711 6.705 1.00 0.79 C ATOM 2605 C LEU A 182 14.728 5.579 7.688 1.00 0.75 C ATOM 2606 O LEU A 182 15.926 5.746 7.574 1.00 0.75 O ATOM 2607 CB LEU A 182 13.225 5.596 5.688 1.00 0.99 C ATOM 2608 CG LEU A 182 12.862 4.762 4.458 1.00 1.06 C ATOM 2609 CD1 LEU A 182 11.577 5.303 3.834 1.00 2.22 C ATOM 2610 CD2 LEU A 182 13.996 4.841 3.433 1.00 0.68 C ATOM 0 H LEU A 182 11.980 4.161 7.313 1.00 0.66 H new ATOM 0 HA LEU A 182 14.630 4.051 6.170 1.00 0.79 H new ATOM 0 HB2 LEU A 182 12.325 6.020 6.132 1.00 0.99 H new ATOM 0 HB3 LEU A 182 13.862 6.432 5.399 1.00 0.99 H new ATOM 0 HG LEU A 182 12.713 3.725 4.757 1.00 1.06 H new ATOM 0 HD11 LEU A 182 11.319 4.708 2.958 1.00 2.22 H new ATOM 0 HD12 LEU A 182 10.767 5.247 4.562 1.00 2.22 H new ATOM 0 HD13 LEU A 182 11.726 6.341 3.537 1.00 2.22 H new ATOM 0 HD21 LEU A 182 13.737 4.247 2.557 1.00 0.68 H new ATOM 0 HD22 LEU A 182 14.146 5.879 3.136 1.00 0.68 H new ATOM 0 HD23 LEU A 182 14.914 4.454 3.875 1.00 0.68 H new ATOM 2622 N ARG A 183 14.055 6.120 8.668 1.00 0.74 N ATOM 2623 CA ARG A 183 14.749 6.963 9.677 1.00 0.75 C ATOM 2624 C ARG A 183 15.626 6.061 10.543 1.00 0.51 C ATOM 2625 O ARG A 183 16.656 6.467 11.043 1.00 0.50 O ATOM 2626 CB ARG A 183 13.710 7.665 10.555 1.00 0.85 C ATOM 2627 CG ARG A 183 13.970 9.172 10.552 1.00 0.92 C ATOM 2628 CD ARG A 183 12.888 9.876 11.372 1.00 1.48 C ATOM 2629 NE ARG A 183 12.016 10.670 10.464 1.00 1.67 N ATOM 2630 CZ ARG A 183 10.820 11.023 10.850 1.00 2.80 C ATOM 2631 NH1 ARG A 183 10.672 11.770 11.910 1.00 3.05 N ATOM 2632 NH2 ARG A 183 9.774 10.626 10.178 1.00 4.01 N ATOM 0 H ARG A 183 13.051 6.012 8.811 1.00 0.74 H new ATOM 0 HA ARG A 183 15.363 7.714 9.181 1.00 0.75 H new ATOM 0 HB2 ARG A 183 12.706 7.458 10.184 1.00 0.85 H new ATOM 0 HB3 ARG A 183 13.759 7.279 11.573 1.00 0.85 H new ATOM 0 HG2 ARG A 183 14.954 9.383 10.971 1.00 0.92 H new ATOM 0 HG3 ARG A 183 13.971 9.550 9.530 1.00 0.92 H new ATOM 0 HD2 ARG A 183 12.293 9.142 11.915 1.00 1.48 H new ATOM 0 HD3 ARG A 183 13.346 10.528 12.116 1.00 1.48 H new ATOM 0 HE ARG A 183 12.353 10.938 9.540 1.00 1.67 H new ATOM 0 HH11 ARG A 183 11.490 12.077 12.436 1.00 3.05 H new ATOM 0 HH12 ARG A 183 9.738 12.047 12.213 1.00 3.05 H new ATOM 0 HH21 ARG A 183 9.891 10.040 9.351 1.00 4.01 H new ATOM 0 HH22 ARG A 183 8.839 10.902 10.479 1.00 4.01 H new ATOM 2646 N GLN A 184 15.227 4.828 10.712 1.00 0.32 N ATOM 2647 CA GLN A 184 16.034 3.884 11.528 1.00 0.07 C ATOM 2648 C GLN A 184 17.256 3.451 10.721 1.00 0.27 C ATOM 2649 O GLN A 184 18.265 3.046 11.264 1.00 0.25 O ATOM 2650 CB GLN A 184 15.183 2.656 11.864 1.00 0.24 C ATOM 2651 CG GLN A 184 14.705 2.738 13.316 1.00 0.40 C ATOM 2652 CD GLN A 184 13.921 4.035 13.528 1.00 1.51 C ATOM 2653 OE1 GLN A 184 14.491 5.107 13.538 1.00 2.13 O ATOM 2654 NE2 GLN A 184 12.628 3.980 13.700 1.00 2.82 N ATOM 0 H GLN A 184 14.372 4.436 10.317 1.00 0.32 H new ATOM 0 HA GLN A 184 16.355 4.368 12.450 1.00 0.07 H new ATOM 0 HB2 GLN A 184 14.326 2.601 11.192 1.00 0.24 H new ATOM 0 HB3 GLN A 184 15.765 1.747 11.714 1.00 0.24 H new ATOM 0 HG2 GLN A 184 14.076 1.879 13.551 1.00 0.40 H new ATOM 0 HG3 GLN A 184 15.559 2.703 13.993 1.00 0.40 H new ATOM 0 HE21 GLN A 184 12.150 3.079 13.691 1.00 2.82 H new ATOM 0 HE22 GLN A 184 12.096 4.838 13.843 1.00 2.82 H new ATOM 2663 N MET A 185 17.171 3.532 9.421 1.00 0.54 N ATOM 2664 CA MET A 185 18.319 3.126 8.572 1.00 0.81 C ATOM 2665 C MET A 185 19.436 4.166 8.688 1.00 0.95 C ATOM 2666 O MET A 185 20.472 3.835 9.242 1.00 1.06 O ATOM 2667 CB MET A 185 17.861 3.031 7.115 1.00 1.24 C ATOM 2668 CG MET A 185 17.138 1.702 6.892 1.00 0.88 C ATOM 2669 SD MET A 185 16.031 1.850 5.468 1.00 1.47 S ATOM 2670 CE MET A 185 14.735 0.741 6.072 1.00 0.95 C ATOM 2671 OXT MET A 185 19.237 5.276 8.222 1.00 1.99 O ATOM 0 H MET A 185 16.352 3.863 8.912 1.00 0.54 H new ATOM 0 HA MET A 185 18.692 2.157 8.903 1.00 0.81 H new ATOM 0 HB2 MET A 185 17.198 3.862 6.877 1.00 1.24 H new ATOM 0 HB3 MET A 185 18.719 3.106 6.447 1.00 1.24 H new ATOM 0 HG2 MET A 185 17.862 0.906 6.722 1.00 0.88 H new ATOM 0 HG3 MET A 185 16.570 1.431 7.782 1.00 0.88 H new ATOM 0 HE1 MET A 185 14.721 -0.165 5.467 1.00 0.95 H new ATOM 0 HE2 MET A 185 14.934 0.480 7.111 1.00 0.95 H new ATOM 0 HE3 MET A 185 13.768 1.239 6.002 1.00 0.95 H new