USER MOD reduce.3.24.130724 H: found=0, std=0, add=1086, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1086 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 13 ASN : amide:sc= -0.0559 K(o=0.84,f=-1.7) USER MOD Set 1.2: A 46 TYR OH : rot 13:sc= 0.896 USER MOD Set 2.1: A 7 GLN : amide:sc= -0.161 K(o=-0.31,f=-1.7) USER MOD Set 2.2: A 11 LYS NZ :NH3+ 149:sc= -0.15 (180deg=-0.758) USER MOD Set 3.1: A 9 THR OG1 : rot 78:sc= 0.566 USER MOD Set 3.2: A 42 MET CE :methyl -148:sc= -0.407 (180deg=-1.58) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 68:sc= 1.3 USER MOD Single : A 14 THR OG1 : rot -41:sc= 0.89 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 SER OG : rot -150:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 103:sc= 0.224 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 GLN :FLIP amide:sc= 0.339 F(o=-0.38,f=0.34) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= -0.0611 (180deg=-0.0611) USER MOD Single : A 47 MET CE :methyl -124:sc= -2.92! (180deg=-6.46!) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0.048 USER MOD Single : A 57 LYS NZ :NH3+ -158:sc= 0.00761 (180deg=0) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -0.0897 K(o=-0.09,f=-1.2!) USER MOD Single : A 66 HIS : no HD1:sc= -0.0518 X(o=-0.052,f=-0.17) USER MOD Single : A 69 GLN : amide:sc= -0.0349 K(o=-0.035,f=-0.87) USER MOD Single : A 70 GLN : amide:sc= -0.0911 X(o=-0.091,f=0) USER MOD Single : A 72 LYS NZ :NH3+ -150:sc= 0.722 (180deg=0.193) USER MOD Single : A 74 GLN : amide:sc= -1.73 K(o=-1.7,f=-2.8) USER MOD Single : A 75 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0438) USER MOD Single : A 78 GLN : amide:sc= -0.189 X(o=-0.19,f=-0.076) USER MOD Single : A 80 GLN : amide:sc= -1.12 X(o=-1.1,f=-0.67) USER MOD Single : A 82 SER OG : rot 76:sc= -1.14 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= -4.41! C(o=-4.4!,f=-6.7!) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 LYS NZ :NH3+ 154:sc= -0.152 (180deg=-0.916) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -2.05 K(o=-2,f=-3.1!) USER MOD Single : A 114 LYS NZ :NH3+ 169:sc= -0.267 (180deg=-0.374) USER MOD Single : A 117 ASN : amide:sc= -0.19 K(o=-0.19,f=-1.8!) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 123:sc= -0.161 (180deg=-0.57) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=-0.063) USER MOD Single : A 125 ASN :FLIP amide:sc= -0.152 F(o=-0.87,f=-0.15) USER MOD Single : A 130 SER OG : rot 86:sc= 0.226 USER MOD ----------------------------------------------------------------- ATOM 42 N SER A 5 1.580 -6.557 1.308 1.00 33.43 N ATOM 43 CA SER A 5 1.195 -6.395 2.706 1.00 62.24 C ATOM 44 C SER A 5 0.938 -7.750 3.359 1.00 51.41 C ATOM 45 O SER A 5 1.042 -7.893 4.577 1.00 44.54 O ATOM 46 CB SER A 5 -0.054 -5.518 2.814 1.00 24.24 C ATOM 47 OG SER A 5 -1.205 -6.213 2.369 1.00 73.32 O ATOM 0 HA SER A 5 2.018 -5.909 3.231 1.00 62.24 H new ATOM 0 HB2 SER A 5 -0.193 -5.203 3.848 1.00 24.24 H new ATOM 0 HB3 SER A 5 0.081 -4.614 2.221 1.00 24.24 H new ATOM 0 HG SER A 5 -1.990 -5.632 2.450 1.00 73.32 H new ATOM 53 N GLU A 6 0.601 -8.741 2.539 1.00 12.53 N ATOM 54 CA GLU A 6 0.327 -10.083 3.037 1.00 25.54 C ATOM 55 C GLU A 6 1.538 -10.647 3.775 1.00 5.04 C ATOM 56 O GLU A 6 1.396 -11.434 4.711 1.00 4.40 O ATOM 57 CB GLU A 6 -0.057 -11.011 1.883 1.00 71.20 C ATOM 58 CG GLU A 6 -0.505 -12.391 2.334 1.00 23.34 C ATOM 59 CD GLU A 6 -1.865 -12.373 3.005 1.00 64.20 C ATOM 60 OE1 GLU A 6 -2.747 -11.624 2.538 1.00 53.14 O ATOM 61 OE2 GLU A 6 -2.046 -13.109 3.998 1.00 64.34 O ATOM 0 H GLU A 6 0.511 -8.639 1.528 1.00 12.53 H new ATOM 0 HA GLU A 6 -0.507 -10.020 3.736 1.00 25.54 H new ATOM 0 HB2 GLU A 6 -0.859 -10.548 1.307 1.00 71.20 H new ATOM 0 HB3 GLU A 6 0.797 -11.116 1.213 1.00 71.20 H new ATOM 0 HG2 GLU A 6 -0.538 -13.058 1.472 1.00 23.34 H new ATOM 0 HG3 GLU A 6 0.232 -12.800 3.025 1.00 23.34 H new ATOM 68 N GLN A 7 2.728 -10.239 3.346 1.00 2.43 N ATOM 69 CA GLN A 7 3.964 -10.704 3.965 1.00 11.42 C ATOM 70 C GLN A 7 4.085 -10.186 5.395 1.00 41.24 C ATOM 71 O GLN A 7 4.324 -10.954 6.326 1.00 23.51 O ATOM 72 CB GLN A 7 5.172 -10.253 3.143 1.00 42.33 C ATOM 73 CG GLN A 7 5.727 -11.336 2.232 1.00 20.44 C ATOM 74 CD GLN A 7 6.250 -12.533 3.002 1.00 62.44 C ATOM 75 OE1 GLN A 7 6.739 -12.399 4.124 1.00 63.33 O ATOM 76 NE2 GLN A 7 6.150 -13.713 2.401 1.00 34.41 N ATOM 0 H GLN A 7 2.863 -9.588 2.573 1.00 2.43 H new ATOM 0 HA GLN A 7 3.939 -11.793 3.993 1.00 11.42 H new ATOM 0 HB2 GLN A 7 4.888 -9.392 2.538 1.00 42.33 H new ATOM 0 HB3 GLN A 7 5.959 -9.922 3.821 1.00 42.33 H new ATOM 0 HG2 GLN A 7 4.947 -11.663 1.545 1.00 20.44 H new ATOM 0 HG3 GLN A 7 6.531 -10.919 1.626 1.00 20.44 H new ATOM 0 HE21 GLN A 7 5.738 -13.778 1.470 1.00 34.41 H new ATOM 0 HE22 GLN A 7 6.486 -14.554 2.870 1.00 34.41 H new ATOM 85 N PHE A 8 3.919 -8.878 5.561 1.00 51.20 N ATOM 86 CA PHE A 8 4.011 -8.257 6.877 1.00 1.31 C ATOM 87 C PHE A 8 2.990 -8.861 7.836 1.00 12.14 C ATOM 88 O PHE A 8 3.296 -9.134 8.998 1.00 41.44 O ATOM 89 CB PHE A 8 3.794 -6.746 6.768 1.00 73.10 C ATOM 90 CG PHE A 8 4.114 -6.002 8.032 1.00 11.55 C ATOM 91 CD1 PHE A 8 5.339 -6.166 8.658 1.00 62.31 C ATOM 92 CD2 PHE A 8 3.189 -5.137 8.596 1.00 21.11 C ATOM 93 CE1 PHE A 8 5.637 -5.482 9.821 1.00 22.35 C ATOM 94 CE2 PHE A 8 3.482 -4.450 9.759 1.00 34.21 C ATOM 95 CZ PHE A 8 4.707 -4.624 10.373 1.00 14.13 C ATOM 0 H PHE A 8 3.720 -8.228 4.801 1.00 51.20 H new ATOM 0 HA PHE A 8 5.010 -8.446 7.271 1.00 1.31 H new ATOM 0 HB2 PHE A 8 4.412 -6.356 5.960 1.00 73.10 H new ATOM 0 HB3 PHE A 8 2.756 -6.555 6.496 1.00 73.10 H new ATOM 0 HD1 PHE A 8 6.070 -6.837 8.232 1.00 62.31 H new ATOM 0 HD2 PHE A 8 2.229 -4.998 8.121 1.00 21.11 H new ATOM 0 HE1 PHE A 8 6.596 -5.618 10.298 1.00 22.35 H new ATOM 0 HE2 PHE A 8 2.754 -3.778 10.187 1.00 34.21 H new ATOM 0 HZ PHE A 8 4.937 -4.090 11.283 1.00 14.13 H new ATOM 105 N THR A 9 1.773 -9.067 7.343 1.00 72.54 N ATOM 106 CA THR A 9 0.705 -9.637 8.155 1.00 61.24 C ATOM 107 C THR A 9 0.973 -11.106 8.463 1.00 52.13 C ATOM 108 O THR A 9 0.948 -11.523 9.621 1.00 33.12 O ATOM 109 CB THR A 9 -0.661 -9.512 7.454 1.00 31.12 C ATOM 110 OG1 THR A 9 -0.778 -8.226 6.835 1.00 73.30 O ATOM 111 CG2 THR A 9 -1.798 -9.708 8.446 1.00 23.41 C ATOM 0 H THR A 9 1.502 -8.847 6.384 1.00 72.54 H new ATOM 0 HA THR A 9 0.680 -9.072 9.087 1.00 61.24 H new ATOM 0 HB THR A 9 -0.726 -10.289 6.692 1.00 31.12 H new ATOM 0 HG1 THR A 9 -0.270 -8.219 5.997 1.00 73.30 H new ATOM 0 HG21 THR A 9 -2.753 -9.615 7.928 1.00 23.41 H new ATOM 0 HG22 THR A 9 -1.723 -10.699 8.894 1.00 23.41 H new ATOM 0 HG23 THR A 9 -1.734 -8.951 9.227 1.00 23.41 H new ATOM 119 N THR A 10 1.230 -11.888 7.419 1.00 51.24 N ATOM 120 CA THR A 10 1.502 -13.311 7.578 1.00 40.41 C ATOM 121 C THR A 10 2.681 -13.543 8.516 1.00 34.42 C ATOM 122 O THR A 10 2.636 -14.418 9.382 1.00 74.04 O ATOM 123 CB THR A 10 1.799 -13.981 6.223 1.00 11.11 C ATOM 124 OG1 THR A 10 0.671 -13.844 5.351 1.00 3.42 O ATOM 125 CG2 THR A 10 2.126 -15.455 6.409 1.00 43.22 C ATOM 0 H THR A 10 1.255 -11.559 6.454 1.00 51.24 H new ATOM 0 HA THR A 10 0.606 -13.759 8.007 1.00 40.41 H new ATOM 0 HB THR A 10 2.663 -13.486 5.779 1.00 11.11 H new ATOM 0 HG1 THR A 10 0.565 -12.903 5.099 1.00 3.42 H new ATOM 0 HG21 THR A 10 2.332 -15.907 5.439 1.00 43.22 H new ATOM 0 HG22 THR A 10 3.002 -15.555 7.050 1.00 43.22 H new ATOM 0 HG23 THR A 10 1.278 -15.960 6.872 1.00 43.22 H new ATOM 133 N LYS A 11 3.736 -12.755 8.340 1.00 14.03 N ATOM 134 CA LYS A 11 4.927 -12.873 9.173 1.00 71.15 C ATOM 135 C LYS A 11 4.630 -12.458 10.610 1.00 33.50 C ATOM 136 O LYS A 11 5.037 -13.131 11.558 1.00 65.21 O ATOM 137 CB LYS A 11 6.058 -12.012 8.606 1.00 53.25 C ATOM 138 CG LYS A 11 6.589 -12.507 7.271 1.00 11.34 C ATOM 139 CD LYS A 11 7.755 -13.464 7.456 1.00 53.42 C ATOM 140 CE LYS A 11 7.295 -14.913 7.431 1.00 62.40 C ATOM 141 NZ LYS A 11 6.679 -15.278 6.125 1.00 1.41 N ATOM 0 H LYS A 11 3.791 -12.027 7.627 1.00 14.03 H new ATOM 0 HA LYS A 11 5.238 -13.918 9.172 1.00 71.15 H new ATOM 0 HB2 LYS A 11 5.701 -10.989 8.489 1.00 53.25 H new ATOM 0 HB3 LYS A 11 6.877 -11.983 9.325 1.00 53.25 H new ATOM 0 HG2 LYS A 11 5.790 -13.007 6.723 1.00 11.34 H new ATOM 0 HG3 LYS A 11 6.907 -11.657 6.667 1.00 11.34 H new ATOM 0 HD2 LYS A 11 8.490 -13.301 6.668 1.00 53.42 H new ATOM 0 HD3 LYS A 11 8.252 -13.255 8.403 1.00 53.42 H new ATOM 0 HE2 LYS A 11 8.145 -15.567 7.627 1.00 62.40 H new ATOM 0 HE3 LYS A 11 6.574 -15.079 8.231 1.00 62.40 H new ATOM 0 HZ1 LYS A 11 6.854 -16.284 5.928 1.00 1.41 H new ATOM 0 HZ2 LYS A 11 5.654 -15.106 6.164 1.00 1.41 H new ATOM 0 HZ3 LYS A 11 7.098 -14.699 5.370 1.00 1.41 H new ATOM 155 N LEU A 12 3.916 -11.349 10.765 1.00 3.33 N ATOM 156 CA LEU A 12 3.563 -10.845 12.088 1.00 72.20 C ATOM 157 C LEU A 12 2.730 -11.867 12.855 1.00 23.42 C ATOM 158 O LEU A 12 2.795 -11.941 14.081 1.00 3.45 O ATOM 159 CB LEU A 12 2.790 -9.530 11.965 1.00 25.52 C ATOM 160 CG LEU A 12 3.637 -8.261 11.874 1.00 43.43 C ATOM 161 CD1 LEU A 12 2.775 -7.071 11.479 1.00 23.51 C ATOM 162 CD2 LEU A 12 4.344 -7.994 13.195 1.00 71.42 C ATOM 0 H LEU A 12 3.570 -10.781 9.991 1.00 3.33 H new ATOM 0 HA LEU A 12 4.486 -10.667 12.640 1.00 72.20 H new ATOM 0 HB2 LEU A 12 2.157 -9.585 11.079 1.00 25.52 H new ATOM 0 HB3 LEU A 12 2.127 -9.440 12.825 1.00 25.52 H new ATOM 0 HG LEU A 12 4.394 -8.408 11.104 1.00 43.43 H new ATOM 0 HD11 LEU A 12 3.395 -6.177 11.419 1.00 23.51 H new ATOM 0 HD12 LEU A 12 2.316 -7.260 10.508 1.00 23.51 H new ATOM 0 HD13 LEU A 12 1.995 -6.923 12.226 1.00 23.51 H new ATOM 0 HD21 LEU A 12 4.942 -7.087 13.111 1.00 71.42 H new ATOM 0 HD22 LEU A 12 3.604 -7.869 13.985 1.00 71.42 H new ATOM 0 HD23 LEU A 12 4.993 -8.835 13.437 1.00 71.42 H new ATOM 174 N ASN A 13 1.950 -12.656 12.124 1.00 71.34 N ATOM 175 CA ASN A 13 1.106 -13.676 12.735 1.00 33.13 C ATOM 176 C ASN A 13 1.936 -14.880 13.170 1.00 34.31 C ATOM 177 O ASN A 13 1.690 -15.471 14.222 1.00 32.32 O ATOM 178 CB ASN A 13 0.016 -14.120 11.757 1.00 1.11 C ATOM 179 CG ASN A 13 -1.110 -13.110 11.649 1.00 43.35 C ATOM 180 OD1 ASN A 13 -1.503 -12.493 12.639 1.00 72.31 O ATOM 181 ND2 ASN A 13 -1.634 -12.936 10.441 1.00 41.12 N ATOM 0 H ASN A 13 1.885 -12.609 11.107 1.00 71.34 H new ATOM 0 HA ASN A 13 0.637 -13.242 13.618 1.00 33.13 H new ATOM 0 HB2 ASN A 13 0.457 -14.276 10.772 1.00 1.11 H new ATOM 0 HB3 ASN A 13 -0.389 -15.079 12.080 1.00 1.11 H new ATOM 0 HD21 ASN A 13 -2.394 -12.269 10.306 1.00 41.12 H new ATOM 0 HD22 ASN A 13 -1.277 -13.469 9.648 1.00 41.12 H new ATOM 188 N THR A 14 2.921 -15.239 12.353 1.00 20.20 N ATOM 189 CA THR A 14 3.787 -16.372 12.652 1.00 63.51 C ATOM 190 C THR A 14 5.073 -15.917 13.332 1.00 21.24 C ATOM 191 O THR A 14 6.078 -16.630 13.325 1.00 34.20 O ATOM 192 CB THR A 14 4.145 -17.158 11.376 1.00 3.30 C ATOM 193 OG1 THR A 14 4.856 -18.353 11.719 1.00 14.34 O ATOM 194 CG2 THR A 14 4.992 -16.310 10.439 1.00 70.14 C ATOM 0 H THR A 14 3.139 -14.761 11.479 1.00 20.20 H new ATOM 0 HA THR A 14 3.233 -17.023 13.328 1.00 63.51 H new ATOM 0 HB THR A 14 3.218 -17.421 10.866 1.00 3.30 H new ATOM 0 HG1 THR A 14 5.496 -18.159 12.435 1.00 14.34 H new ATOM 0 HG21 THR A 14 5.233 -16.885 9.545 1.00 70.14 H new ATOM 0 HG22 THR A 14 4.437 -15.415 10.156 1.00 70.14 H new ATOM 0 HG23 THR A 14 5.914 -16.021 10.943 1.00 70.14 H new ATOM 202 N LEU A 15 5.036 -14.727 13.921 1.00 40.34 N ATOM 203 CA LEU A 15 6.199 -14.176 14.607 1.00 24.14 C ATOM 204 C LEU A 15 6.451 -14.906 15.923 1.00 65.44 C ATOM 205 O LEU A 15 5.536 -15.098 16.722 1.00 51.00 O ATOM 206 CB LEU A 15 6.001 -12.682 14.870 1.00 23.32 C ATOM 207 CG LEU A 15 6.752 -11.731 13.938 1.00 64.33 C ATOM 208 CD1 LEU A 15 6.453 -10.284 14.297 1.00 21.21 C ATOM 209 CD2 LEU A 15 8.249 -11.999 13.996 1.00 4.34 C ATOM 0 H LEU A 15 4.213 -14.125 13.937 1.00 40.34 H new ATOM 0 HA LEU A 15 7.068 -14.313 13.964 1.00 24.14 H new ATOM 0 HB2 LEU A 15 4.936 -12.460 14.802 1.00 23.32 H new ATOM 0 HB3 LEU A 15 6.306 -12.470 15.895 1.00 23.32 H new ATOM 0 HG LEU A 15 6.411 -11.908 12.918 1.00 64.33 H new ATOM 0 HD11 LEU A 15 6.996 -9.622 13.623 1.00 21.21 H new ATOM 0 HD12 LEU A 15 5.383 -10.099 14.202 1.00 21.21 H new ATOM 0 HD13 LEU A 15 6.765 -10.092 15.324 1.00 21.21 H new ATOM 0 HD21 LEU A 15 8.768 -11.313 13.326 1.00 4.34 H new ATOM 0 HD22 LEU A 15 8.606 -11.851 15.015 1.00 4.34 H new ATOM 0 HD23 LEU A 15 8.447 -13.026 13.688 1.00 4.34 H new ATOM 221 N GLU A 16 7.699 -15.310 16.140 1.00 45.40 N ATOM 222 CA GLU A 16 8.071 -16.017 17.359 1.00 24.54 C ATOM 223 C GLU A 16 9.120 -15.235 18.145 1.00 53.43 C ATOM 224 O GLU A 16 9.639 -14.224 17.671 1.00 63.23 O ATOM 225 CB GLU A 16 8.606 -17.411 17.024 1.00 74.44 C ATOM 226 CG GLU A 16 7.648 -18.246 16.190 1.00 13.11 C ATOM 227 CD GLU A 16 8.269 -19.543 15.711 1.00 23.53 C ATOM 228 OE1 GLU A 16 8.789 -20.299 16.559 1.00 64.54 O ATOM 229 OE2 GLU A 16 8.236 -19.803 14.490 1.00 1.14 O ATOM 0 H GLU A 16 8.469 -15.160 15.488 1.00 45.40 H new ATOM 0 HA GLU A 16 7.178 -16.116 17.976 1.00 24.54 H new ATOM 0 HB2 GLU A 16 9.549 -17.310 16.487 1.00 74.44 H new ATOM 0 HB3 GLU A 16 8.823 -17.940 17.952 1.00 74.44 H new ATOM 0 HG2 GLU A 16 6.759 -18.469 16.780 1.00 13.11 H new ATOM 0 HG3 GLU A 16 7.321 -17.664 15.328 1.00 13.11 H new ATOM 236 N ASP A 17 9.425 -15.708 19.348 1.00 74.33 N ATOM 237 CA ASP A 17 10.411 -15.054 20.200 1.00 71.13 C ATOM 238 C ASP A 17 11.813 -15.583 19.913 1.00 52.21 C ATOM 239 O ASP A 17 12.284 -16.510 20.571 1.00 0.03 O ATOM 240 CB ASP A 17 10.064 -15.267 21.674 1.00 11.30 C ATOM 241 CG ASP A 17 9.834 -16.727 22.010 1.00 23.10 C ATOM 242 OD1 ASP A 17 8.743 -17.245 21.692 1.00 11.12 O ATOM 243 OD2 ASP A 17 10.746 -17.352 22.590 1.00 62.51 O ATOM 0 H ASP A 17 9.003 -16.543 19.756 1.00 74.33 H new ATOM 0 HA ASP A 17 10.393 -13.986 19.981 1.00 71.13 H new ATOM 0 HB2 ASP A 17 10.871 -14.877 22.294 1.00 11.30 H new ATOM 0 HB3 ASP A 17 9.169 -14.695 21.920 1.00 11.30 H new ATOM 248 N SER A 18 12.474 -14.987 18.925 1.00 32.34 N ATOM 249 CA SER A 18 13.820 -15.401 18.548 1.00 61.41 C ATOM 250 C SER A 18 14.616 -14.223 17.995 1.00 21.03 C ATOM 251 O SER A 18 14.098 -13.422 17.218 1.00 45.40 O ATOM 252 CB SER A 18 13.759 -16.523 17.509 1.00 41.53 C ATOM 253 OG SER A 18 15.026 -17.135 17.344 1.00 44.31 O ATOM 0 H SER A 18 12.099 -14.216 18.372 1.00 32.34 H new ATOM 0 HA SER A 18 14.324 -15.770 19.442 1.00 61.41 H new ATOM 0 HB2 SER A 18 13.028 -17.270 17.819 1.00 41.53 H new ATOM 0 HB3 SER A 18 13.419 -16.121 16.555 1.00 41.53 H new ATOM 0 HG SER A 18 14.960 -17.849 16.676 1.00 44.31 H new ATOM 259 N GLN A 19 15.877 -14.126 18.403 1.00 43.20 N ATOM 260 CA GLN A 19 16.745 -13.045 17.950 1.00 61.35 C ATOM 261 C GLN A 19 16.862 -13.043 16.429 1.00 40.21 C ATOM 262 O GLN A 19 16.984 -11.987 15.809 1.00 61.13 O ATOM 263 CB GLN A 19 18.133 -13.179 18.579 1.00 13.34 C ATOM 264 CG GLN A 19 18.212 -12.637 19.997 1.00 13.15 C ATOM 265 CD GLN A 19 18.552 -11.160 20.040 1.00 64.30 C ATOM 266 OE1 GLN A 19 19.721 -10.783 20.138 1.00 74.54 O ATOM 267 NE2 GLN A 19 17.531 -10.315 19.966 1.00 3.44 N ATOM 0 H GLN A 19 16.320 -14.782 19.046 1.00 43.20 H new ATOM 0 HA GLN A 19 16.301 -12.100 18.264 1.00 61.35 H new ATOM 0 HB2 GLN A 19 18.421 -14.230 18.584 1.00 13.34 H new ATOM 0 HB3 GLN A 19 18.857 -12.653 17.957 1.00 13.34 H new ATOM 0 HG2 GLN A 19 17.258 -12.801 20.498 1.00 13.15 H new ATOM 0 HG3 GLN A 19 18.965 -13.195 20.554 1.00 13.15 H new ATOM 0 HE21 GLN A 19 16.579 -10.672 19.886 1.00 3.44 H new ATOM 0 HE22 GLN A 19 17.699 -9.309 19.989 1.00 3.44 H new ATOM 276 N GLU A 20 16.824 -14.232 15.835 1.00 2.33 N ATOM 277 CA GLU A 20 16.927 -14.365 14.387 1.00 63.21 C ATOM 278 C GLU A 20 15.619 -13.967 13.709 1.00 22.23 C ATOM 279 O GLU A 20 15.620 -13.432 12.601 1.00 53.11 O ATOM 280 CB GLU A 20 17.293 -15.802 14.010 1.00 62.23 C ATOM 281 CG GLU A 20 18.791 -16.052 13.943 1.00 14.34 C ATOM 282 CD GLU A 20 19.147 -17.513 14.133 1.00 25.21 C ATOM 283 OE1 GLU A 20 18.634 -18.129 15.091 1.00 63.12 O ATOM 284 OE2 GLU A 20 19.939 -18.041 13.325 1.00 45.22 O ATOM 0 H GLU A 20 16.723 -15.116 16.334 1.00 2.33 H new ATOM 0 HA GLU A 20 17.714 -13.694 14.041 1.00 63.21 H new ATOM 0 HB2 GLU A 20 16.852 -16.483 14.738 1.00 62.23 H new ATOM 0 HB3 GLU A 20 16.850 -16.039 13.043 1.00 62.23 H new ATOM 0 HG2 GLU A 20 19.170 -15.712 12.979 1.00 14.34 H new ATOM 0 HG3 GLU A 20 19.289 -15.458 14.709 1.00 14.34 H new ATOM 291 N SER A 21 14.505 -14.234 14.384 1.00 43.51 N ATOM 292 CA SER A 21 13.190 -13.908 13.846 1.00 14.21 C ATOM 293 C SER A 21 13.012 -12.398 13.722 1.00 44.55 C ATOM 294 O SER A 21 12.614 -11.893 12.671 1.00 22.12 O ATOM 295 CB SER A 21 12.092 -14.490 14.739 1.00 10.51 C ATOM 296 OG SER A 21 10.809 -14.265 14.182 1.00 74.14 O ATOM 0 H SER A 21 14.487 -14.675 15.304 1.00 43.51 H new ATOM 0 HA SER A 21 13.113 -14.348 12.852 1.00 14.21 H new ATOM 0 HB2 SER A 21 12.253 -15.560 14.868 1.00 10.51 H new ATOM 0 HB3 SER A 21 12.146 -14.038 15.729 1.00 10.51 H new ATOM 0 HG SER A 21 10.149 -14.188 14.902 1.00 74.14 H new ATOM 302 N ILE A 22 13.311 -11.682 14.801 1.00 72.32 N ATOM 303 CA ILE A 22 13.186 -10.230 14.813 1.00 72.13 C ATOM 304 C ILE A 22 13.963 -9.602 13.661 1.00 51.11 C ATOM 305 O ILE A 22 13.450 -8.737 12.951 1.00 74.32 O ATOM 306 CB ILE A 22 13.687 -9.633 16.141 1.00 15.21 C ATOM 307 CG1 ILE A 22 12.885 -10.200 17.315 1.00 64.23 C ATOM 308 CG2 ILE A 22 13.588 -8.115 16.110 1.00 51.01 C ATOM 309 CD1 ILE A 22 11.423 -9.813 17.291 1.00 23.35 C ATOM 0 H ILE A 22 13.642 -12.084 15.678 1.00 72.32 H new ATOM 0 HA ILE A 22 12.126 -10.003 14.699 1.00 72.13 H new ATOM 0 HB ILE A 22 14.734 -9.907 16.274 1.00 15.21 H new ATOM 0 HG12 ILE A 22 12.965 -11.287 17.308 1.00 64.23 H new ATOM 0 HG13 ILE A 22 13.329 -9.854 18.248 1.00 64.23 H new ATOM 0 HG21 ILE A 22 13.946 -7.708 17.056 1.00 51.01 H new ATOM 0 HG22 ILE A 22 14.198 -7.727 15.294 1.00 51.01 H new ATOM 0 HG23 ILE A 22 12.549 -7.821 15.958 1.00 51.01 H new ATOM 0 HD11 ILE A 22 10.917 -10.250 18.152 1.00 23.35 H new ATOM 0 HD12 ILE A 22 11.333 -8.727 17.329 1.00 23.35 H new ATOM 0 HD13 ILE A 22 10.964 -10.183 16.374 1.00 23.35 H new ATOM 321 N SER A 23 15.203 -10.044 13.480 1.00 23.23 N ATOM 322 CA SER A 23 16.053 -9.524 12.415 1.00 32.04 C ATOM 323 C SER A 23 15.577 -10.016 11.052 1.00 62.02 C ATOM 324 O SER A 23 15.706 -9.316 10.047 1.00 23.14 O ATOM 325 CB SER A 23 17.506 -9.943 12.643 1.00 64.40 C ATOM 326 OG SER A 23 18.379 -9.258 11.761 1.00 31.51 O ATOM 0 H SER A 23 15.642 -10.761 14.057 1.00 23.23 H new ATOM 0 HA SER A 23 15.990 -8.436 12.431 1.00 32.04 H new ATOM 0 HB2 SER A 23 17.790 -9.735 13.675 1.00 64.40 H new ATOM 0 HB3 SER A 23 17.605 -11.018 12.495 1.00 64.40 H new ATOM 0 HG SER A 23 19.302 -9.542 11.928 1.00 31.51 H new ATOM 332 N SER A 24 15.027 -11.226 11.025 1.00 14.52 N ATOM 333 CA SER A 24 14.535 -11.814 9.785 1.00 34.32 C ATOM 334 C SER A 24 13.476 -10.923 9.143 1.00 45.43 C ATOM 335 O SER A 24 13.524 -10.650 7.944 1.00 74.04 O ATOM 336 CB SER A 24 13.953 -13.204 10.051 1.00 24.32 C ATOM 337 OG SER A 24 13.506 -13.809 8.850 1.00 1.50 O ATOM 0 H SER A 24 14.911 -11.818 11.848 1.00 14.52 H new ATOM 0 HA SER A 24 15.375 -11.904 9.097 1.00 34.32 H new ATOM 0 HB2 SER A 24 14.709 -13.834 10.520 1.00 24.32 H new ATOM 0 HB3 SER A 24 13.123 -13.126 10.753 1.00 24.32 H new ATOM 0 HG SER A 24 13.140 -14.696 9.047 1.00 1.50 H new ATOM 343 N ALA A 25 12.522 -10.471 9.950 1.00 23.44 N ATOM 344 CA ALA A 25 11.453 -9.609 9.463 1.00 62.04 C ATOM 345 C ALA A 25 11.903 -8.153 9.410 1.00 63.03 C ATOM 346 O ALA A 25 11.556 -7.419 8.485 1.00 73.14 O ATOM 347 CB ALA A 25 10.219 -9.750 10.341 1.00 31.30 C ATOM 0 H ALA A 25 12.468 -10.688 10.945 1.00 23.44 H new ATOM 0 HA ALA A 25 11.202 -9.922 8.450 1.00 62.04 H new ATOM 0 HB1 ALA A 25 9.429 -9.100 9.965 1.00 31.30 H new ATOM 0 HB2 ALA A 25 9.877 -10.785 10.324 1.00 31.30 H new ATOM 0 HB3 ALA A 25 10.466 -9.466 11.364 1.00 31.30 H new ATOM 353 N SER A 26 12.678 -7.741 10.408 1.00 30.32 N ATOM 354 CA SER A 26 13.172 -6.371 10.477 1.00 30.05 C ATOM 355 C SER A 26 13.957 -6.012 9.219 1.00 30.34 C ATOM 356 O SER A 26 13.790 -4.931 8.656 1.00 54.42 O ATOM 357 CB SER A 26 14.055 -6.187 11.713 1.00 11.42 C ATOM 358 OG SER A 26 13.273 -6.121 12.893 1.00 22.24 O ATOM 0 H SER A 26 12.977 -8.337 11.180 1.00 30.32 H new ATOM 0 HA SER A 26 12.313 -5.704 10.550 1.00 30.05 H new ATOM 0 HB2 SER A 26 14.760 -7.015 11.786 1.00 11.42 H new ATOM 0 HB3 SER A 26 14.643 -5.275 11.611 1.00 11.42 H new ATOM 0 HG SER A 26 13.319 -6.979 13.364 1.00 22.24 H new ATOM 364 N LYS A 27 14.815 -6.929 8.784 1.00 41.51 N ATOM 365 CA LYS A 27 15.627 -6.712 7.592 1.00 33.20 C ATOM 366 C LYS A 27 14.747 -6.411 6.382 1.00 25.44 C ATOM 367 O LYS A 27 15.139 -5.659 5.491 1.00 43.34 O ATOM 368 CB LYS A 27 16.495 -7.940 7.312 1.00 64.43 C ATOM 369 CG LYS A 27 15.773 -9.034 6.543 1.00 3.43 C ATOM 370 CD LYS A 27 16.404 -10.395 6.785 1.00 12.21 C ATOM 371 CE LYS A 27 16.715 -11.105 5.477 1.00 72.43 C ATOM 372 NZ LYS A 27 17.015 -12.549 5.687 1.00 10.31 N ATOM 0 H LYS A 27 14.966 -7.829 9.239 1.00 41.51 H new ATOM 0 HA LYS A 27 16.272 -5.852 7.773 1.00 33.20 H new ATOM 0 HB2 LYS A 27 17.375 -7.631 6.748 1.00 64.43 H new ATOM 0 HB3 LYS A 27 16.850 -8.347 8.259 1.00 64.43 H new ATOM 0 HG2 LYS A 27 14.725 -9.059 6.842 1.00 3.43 H new ATOM 0 HG3 LYS A 27 15.795 -8.806 5.477 1.00 3.43 H new ATOM 0 HD2 LYS A 27 17.321 -10.275 7.362 1.00 12.21 H new ATOM 0 HD3 LYS A 27 15.730 -11.009 7.382 1.00 12.21 H new ATOM 0 HE2 LYS A 27 15.867 -11.005 4.799 1.00 72.43 H new ATOM 0 HE3 LYS A 27 17.566 -10.623 4.996 1.00 72.43 H new ATOM 0 HZ1 LYS A 27 17.222 -12.997 4.772 1.00 10.31 H new ATOM 0 HZ2 LYS A 27 17.840 -12.645 6.313 1.00 10.31 H new ATOM 0 HZ3 LYS A 27 16.193 -13.014 6.123 1.00 10.31 H new ATOM 386 N TRP A 28 13.559 -7.003 6.360 1.00 55.54 N ATOM 387 CA TRP A 28 12.623 -6.796 5.259 1.00 24.05 C ATOM 388 C TRP A 28 11.956 -5.429 5.362 1.00 73.21 C ATOM 389 O TRP A 28 11.905 -4.678 4.387 1.00 14.54 O ATOM 390 CB TRP A 28 11.562 -7.897 5.252 1.00 14.11 C ATOM 391 CG TRP A 28 10.584 -7.772 4.123 1.00 64.15 C ATOM 392 CD1 TRP A 28 10.870 -7.777 2.787 1.00 4.11 C ATOM 393 CD2 TRP A 28 9.165 -7.622 4.230 1.00 13.03 C ATOM 394 NE1 TRP A 28 9.714 -7.639 2.058 1.00 12.22 N ATOM 395 CE2 TRP A 28 8.653 -7.543 2.920 1.00 5.31 C ATOM 396 CE3 TRP A 28 8.275 -7.549 5.306 1.00 43.03 C ATOM 397 CZ2 TRP A 28 7.294 -7.393 2.660 1.00 50.14 C ATOM 398 CZ3 TRP A 28 6.926 -7.400 5.045 1.00 3.05 C ATOM 399 CH2 TRP A 28 6.446 -7.324 3.731 1.00 30.13 C ATOM 0 H TRP A 28 13.220 -7.629 7.090 1.00 55.54 H new ATOM 0 HA TRP A 28 13.183 -6.836 4.325 1.00 24.05 H new ATOM 0 HB2 TRP A 28 12.056 -8.867 5.190 1.00 14.11 H new ATOM 0 HB3 TRP A 28 11.020 -7.875 6.197 1.00 14.11 H new ATOM 0 HD1 TRP A 28 11.860 -7.875 2.366 1.00 4.11 H new ATOM 0 HE1 TRP A 28 9.655 -7.612 1.040 1.00 12.22 H new ATOM 0 HE3 TRP A 28 8.635 -7.608 6.322 1.00 43.03 H new ATOM 0 HZ2 TRP A 28 6.922 -7.333 1.648 1.00 50.14 H new ATOM 0 HZ3 TRP A 28 6.230 -7.341 5.868 1.00 3.05 H new ATOM 0 HH2 TRP A 28 5.386 -7.209 3.560 1.00 30.13 H new ATOM 410 N LEU A 29 11.445 -5.112 6.547 1.00 61.43 N ATOM 411 CA LEU A 29 10.780 -3.834 6.776 1.00 21.42 C ATOM 412 C LEU A 29 11.700 -2.671 6.421 1.00 53.52 C ATOM 413 O LEU A 29 11.246 -1.630 5.944 1.00 54.35 O ATOM 414 CB LEU A 29 10.338 -3.722 8.236 1.00 33.32 C ATOM 415 CG LEU A 29 9.030 -4.428 8.597 1.00 0.14 C ATOM 416 CD1 LEU A 29 9.095 -4.981 10.013 1.00 41.24 C ATOM 417 CD2 LEU A 29 7.852 -3.476 8.448 1.00 32.41 C ATOM 0 H LEU A 29 11.479 -5.722 7.364 1.00 61.43 H new ATOM 0 HA LEU A 29 9.902 -3.788 6.132 1.00 21.42 H new ATOM 0 HB2 LEU A 29 11.131 -4.124 8.867 1.00 33.32 H new ATOM 0 HB3 LEU A 29 10.238 -2.665 8.485 1.00 33.32 H new ATOM 0 HG LEU A 29 8.887 -5.262 7.910 1.00 0.14 H new ATOM 0 HD11 LEU A 29 8.156 -5.480 10.252 1.00 41.24 H new ATOM 0 HD12 LEU A 29 9.915 -5.696 10.087 1.00 41.24 H new ATOM 0 HD13 LEU A 29 9.261 -4.164 10.715 1.00 41.24 H new ATOM 0 HD21 LEU A 29 6.930 -3.995 8.709 1.00 32.41 H new ATOM 0 HD22 LEU A 29 7.988 -2.622 9.112 1.00 32.41 H new ATOM 0 HD23 LEU A 29 7.793 -3.128 7.417 1.00 32.41 H new ATOM 429 N LEU A 30 12.994 -2.854 6.654 1.00 5.25 N ATOM 430 CA LEU A 30 13.980 -1.820 6.357 1.00 55.21 C ATOM 431 C LEU A 30 13.919 -1.417 4.887 1.00 62.11 C ATOM 432 O LEU A 30 14.143 -0.256 4.540 1.00 35.43 O ATOM 433 CB LEU A 30 15.385 -2.312 6.705 1.00 5.44 C ATOM 434 CG LEU A 30 16.239 -1.362 7.547 1.00 21.42 C ATOM 435 CD1 LEU A 30 16.268 0.024 6.924 1.00 43.35 C ATOM 436 CD2 LEU A 30 15.714 -1.297 8.974 1.00 2.50 C ATOM 0 H LEU A 30 13.386 -3.709 7.048 1.00 5.25 H new ATOM 0 HA LEU A 30 13.748 -0.945 6.965 1.00 55.21 H new ATOM 0 HB2 LEU A 30 15.295 -3.258 7.239 1.00 5.44 H new ATOM 0 HB3 LEU A 30 15.916 -2.520 5.776 1.00 5.44 H new ATOM 0 HG LEU A 30 17.258 -1.747 7.573 1.00 21.42 H new ATOM 0 HD11 LEU A 30 16.880 0.686 7.537 1.00 43.35 H new ATOM 0 HD12 LEU A 30 16.691 -0.037 5.921 1.00 43.35 H new ATOM 0 HD13 LEU A 30 15.253 0.418 6.866 1.00 43.35 H new ATOM 0 HD21 LEU A 30 16.333 -0.617 9.559 1.00 2.50 H new ATOM 0 HD22 LEU A 30 14.685 -0.936 8.967 1.00 2.50 H new ATOM 0 HD23 LEU A 30 15.747 -2.291 9.419 1.00 2.50 H new ATOM 448 N LEU A 31 13.614 -2.382 4.027 1.00 61.33 N ATOM 449 CA LEU A 31 13.522 -2.128 2.593 1.00 34.31 C ATOM 450 C LEU A 31 12.092 -1.777 2.193 1.00 21.24 C ATOM 451 O LEU A 31 11.745 -1.798 1.013 1.00 62.51 O ATOM 452 CB LEU A 31 13.997 -3.351 1.807 1.00 63.22 C ATOM 453 CG LEU A 31 15.280 -4.014 2.309 1.00 65.33 C ATOM 454 CD1 LEU A 31 15.561 -5.290 1.531 1.00 64.52 C ATOM 455 CD2 LEU A 31 16.455 -3.053 2.201 1.00 10.44 C ATOM 0 H LEU A 31 13.426 -3.347 4.297 1.00 61.33 H new ATOM 0 HA LEU A 31 14.165 -1.280 2.357 1.00 34.31 H new ATOM 0 HB2 LEU A 31 13.200 -4.095 1.815 1.00 63.22 H new ATOM 0 HB3 LEU A 31 14.147 -3.055 0.769 1.00 63.22 H new ATOM 0 HG LEU A 31 15.144 -4.274 3.359 1.00 65.33 H new ATOM 0 HD11 LEU A 31 16.478 -5.748 1.902 1.00 64.52 H new ATOM 0 HD12 LEU A 31 14.731 -5.985 1.659 1.00 64.52 H new ATOM 0 HD13 LEU A 31 15.676 -5.053 0.473 1.00 64.52 H new ATOM 0 HD21 LEU A 31 17.359 -3.542 2.563 1.00 10.44 H new ATOM 0 HD22 LEU A 31 16.592 -2.761 1.160 1.00 10.44 H new ATOM 0 HD23 LEU A 31 16.256 -2.166 2.803 1.00 10.44 H new ATOM 467 N GLN A 32 11.269 -1.453 3.185 1.00 54.31 N ATOM 468 CA GLN A 32 9.877 -1.095 2.936 1.00 61.33 C ATOM 469 C GLN A 32 9.601 0.344 3.358 1.00 52.14 C ATOM 470 O GLN A 32 8.471 0.696 3.698 1.00 20.42 O ATOM 471 CB GLN A 32 8.942 -2.047 3.684 1.00 62.01 C ATOM 472 CG GLN A 32 8.922 -3.455 3.111 1.00 31.13 C ATOM 473 CD GLN A 32 8.694 -3.472 1.613 1.00 73.52 C ATOM 474 OE1 GLN A 32 9.690 -3.935 0.867 1.00 3.00 O flip ATOM 475 NE2 GLN A 32 7.633 -3.074 1.130 1.00 22.42 N flip ATOM 0 H GLN A 32 11.541 -1.431 4.168 1.00 54.31 H new ATOM 0 HA GLN A 32 9.692 -1.182 1.865 1.00 61.33 H new ATOM 0 HB2 GLN A 32 9.245 -2.094 4.730 1.00 62.01 H new ATOM 0 HB3 GLN A 32 7.931 -1.641 3.663 1.00 62.01 H new ATOM 0 HG2 GLN A 32 9.867 -3.948 3.336 1.00 31.13 H new ATOM 0 HG3 GLN A 32 8.137 -4.031 3.601 1.00 31.13 H new ATOM 0 HE21 GLN A 32 6.894 -2.726 1.740 1.00 22.42 H new ATOM 0 HE22 GLN A 32 7.494 -3.092 0.120 1.00 22.42 H new ATOM 484 N TYR A 33 10.639 1.172 3.333 1.00 42.10 N ATOM 485 CA TYR A 33 10.509 2.573 3.716 1.00 71.03 C ATOM 486 C TYR A 33 9.428 3.265 2.891 1.00 72.21 C ATOM 487 O TYR A 33 8.833 4.250 3.328 1.00 44.42 O ATOM 488 CB TYR A 33 11.844 3.298 3.538 1.00 12.22 C ATOM 489 CG TYR A 33 12.520 3.007 2.218 1.00 41.25 C ATOM 490 CD1 TYR A 33 12.109 3.638 1.050 1.00 40.10 C ATOM 491 CD2 TYR A 33 13.571 2.102 2.138 1.00 62.23 C ATOM 492 CE1 TYR A 33 12.724 3.375 -0.159 1.00 35.42 C ATOM 493 CE2 TYR A 33 14.193 1.833 0.933 1.00 14.24 C ATOM 494 CZ TYR A 33 13.765 2.472 -0.212 1.00 31.30 C ATOM 495 OH TYR A 33 14.381 2.208 -1.414 1.00 34.51 O ATOM 0 H TYR A 33 11.580 0.897 3.051 1.00 42.10 H new ATOM 0 HA TYR A 33 10.220 2.611 4.766 1.00 71.03 H new ATOM 0 HB2 TYR A 33 11.679 4.372 3.623 1.00 12.22 H new ATOM 0 HB3 TYR A 33 12.513 3.013 4.350 1.00 12.22 H new ATOM 0 HD1 TYR A 33 11.295 4.346 1.088 1.00 40.10 H new ATOM 0 HD2 TYR A 33 13.908 1.600 3.033 1.00 62.23 H new ATOM 0 HE1 TYR A 33 12.391 3.874 -1.057 1.00 35.42 H new ATOM 0 HE2 TYR A 33 15.009 1.127 0.888 1.00 14.24 H new ATOM 0 HH TYR A 33 15.095 1.551 -1.278 1.00 34.51 H new ATOM 505 N ARG A 34 9.178 2.740 1.695 1.00 5.25 N ATOM 506 CA ARG A 34 8.170 3.306 0.808 1.00 12.40 C ATOM 507 C ARG A 34 6.784 3.232 1.443 1.00 41.25 C ATOM 508 O ARG A 34 5.910 4.046 1.144 1.00 35.24 O ATOM 509 CB ARG A 34 8.169 2.570 -0.533 1.00 14.21 C ATOM 510 CG ARG A 34 9.375 2.885 -1.402 1.00 3.22 C ATOM 511 CD ARG A 34 9.102 4.058 -2.330 1.00 43.23 C ATOM 512 NE ARG A 34 9.545 5.326 -1.756 1.00 22.33 N ATOM 513 CZ ARG A 34 9.117 6.512 -2.174 1.00 64.42 C ATOM 514 NH1 ARG A 34 8.240 6.592 -3.165 1.00 61.20 N ATOM 515 NH2 ARG A 34 9.567 7.621 -1.601 1.00 20.41 N ATOM 0 H ARG A 34 9.660 1.924 1.319 1.00 5.25 H new ATOM 0 HA ARG A 34 8.418 4.354 0.639 1.00 12.40 H new ATOM 0 HB2 ARG A 34 8.136 1.496 -0.348 1.00 14.21 H new ATOM 0 HB3 ARG A 34 7.261 2.828 -1.079 1.00 14.21 H new ATOM 0 HG2 ARG A 34 10.232 3.113 -0.768 1.00 3.22 H new ATOM 0 HG3 ARG A 34 9.639 2.007 -1.992 1.00 3.22 H new ATOM 0 HD2 ARG A 34 9.609 3.894 -3.281 1.00 43.23 H new ATOM 0 HD3 ARG A 34 8.034 4.110 -2.543 1.00 43.23 H new ATOM 0 HE ARG A 34 10.220 5.299 -0.992 1.00 22.33 H new ATOM 0 HH11 ARG A 34 7.892 5.742 -3.608 1.00 61.20 H new ATOM 0 HH12 ARG A 34 7.913 7.504 -3.484 1.00 61.20 H new ATOM 0 HH21 ARG A 34 10.242 7.563 -0.839 1.00 20.41 H new ATOM 0 HH22 ARG A 34 9.238 8.531 -1.923 1.00 20.41 H new ATOM 529 N ASP A 35 6.592 2.251 2.318 1.00 53.54 N ATOM 530 CA ASP A 35 5.313 2.071 2.995 1.00 72.12 C ATOM 531 C ASP A 35 5.401 2.517 4.451 1.00 41.21 C ATOM 532 O ASP A 35 4.890 1.847 5.348 1.00 51.33 O ATOM 533 CB ASP A 35 4.876 0.607 2.923 1.00 55.13 C ATOM 534 CG ASP A 35 5.283 -0.055 1.621 1.00 31.43 C ATOM 535 OD1 ASP A 35 5.116 0.576 0.556 1.00 25.43 O ATOM 536 OD2 ASP A 35 5.769 -1.205 1.668 1.00 51.42 O ATOM 0 H ASP A 35 7.305 1.569 2.575 1.00 53.54 H new ATOM 0 HA ASP A 35 4.572 2.689 2.489 1.00 72.12 H new ATOM 0 HB2 ASP A 35 5.313 0.059 3.758 1.00 55.13 H new ATOM 0 HB3 ASP A 35 3.793 0.548 3.034 1.00 55.13 H new ATOM 541 N ALA A 36 6.054 3.652 4.678 1.00 41.20 N ATOM 542 CA ALA A 36 6.209 4.188 6.025 1.00 54.34 C ATOM 543 C ALA A 36 4.862 4.287 6.734 1.00 44.10 C ATOM 544 O ALA A 36 4.635 3.669 7.774 1.00 11.33 O ATOM 545 CB ALA A 36 6.883 5.551 5.976 1.00 41.31 C ATOM 0 H ALA A 36 6.484 4.218 3.947 1.00 41.20 H new ATOM 0 HA ALA A 36 6.840 3.503 6.592 1.00 54.34 H new ATOM 0 HB1 ALA A 36 6.992 5.939 6.989 1.00 41.31 H new ATOM 0 HB2 ALA A 36 7.867 5.454 5.516 1.00 41.31 H new ATOM 0 HB3 ALA A 36 6.274 6.237 5.388 1.00 41.31 H new ATOM 551 N PRO A 37 3.948 5.083 6.161 1.00 75.14 N ATOM 552 CA PRO A 37 2.608 5.281 6.722 1.00 51.42 C ATOM 553 C PRO A 37 1.739 4.034 6.604 1.00 24.41 C ATOM 554 O PRO A 37 0.955 3.723 7.501 1.00 1.41 O ATOM 555 CB PRO A 37 2.032 6.416 5.871 1.00 14.24 C ATOM 556 CG PRO A 37 2.767 6.332 4.579 1.00 44.13 C ATOM 557 CD PRO A 37 4.150 5.850 4.920 1.00 62.20 C ATOM 0 HA PRO A 37 2.642 5.503 7.789 1.00 51.42 H new ATOM 0 HB2 PRO A 37 0.959 6.295 5.724 1.00 14.24 H new ATOM 0 HB3 PRO A 37 2.181 7.384 6.349 1.00 14.24 H new ATOM 0 HG2 PRO A 37 2.272 5.645 3.893 1.00 44.13 H new ATOM 0 HG3 PRO A 37 2.803 7.304 4.086 1.00 44.13 H new ATOM 0 HD2 PRO A 37 4.566 5.229 4.127 1.00 62.20 H new ATOM 0 HD3 PRO A 37 4.840 6.681 5.069 1.00 62.20 H new ATOM 565 N LYS A 38 1.884 3.320 5.493 1.00 42.34 N ATOM 566 CA LYS A 38 1.115 2.104 5.257 1.00 15.54 C ATOM 567 C LYS A 38 1.390 1.068 6.342 1.00 61.32 C ATOM 568 O LYS A 38 0.468 0.576 6.993 1.00 4.35 O ATOM 569 CB LYS A 38 1.450 1.522 3.883 1.00 62.33 C ATOM 570 CG LYS A 38 0.440 1.881 2.807 1.00 42.04 C ATOM 571 CD LYS A 38 -0.861 1.117 2.985 1.00 22.34 C ATOM 572 CE LYS A 38 -2.042 1.886 2.415 1.00 13.30 C ATOM 573 NZ LYS A 38 -2.502 2.961 3.338 1.00 31.41 N ATOM 0 H LYS A 38 2.528 3.563 4.741 1.00 42.34 H new ATOM 0 HA LYS A 38 0.056 2.362 5.286 1.00 15.54 H new ATOM 0 HB2 LYS A 38 2.435 1.877 3.578 1.00 62.33 H new ATOM 0 HB3 LYS A 38 1.513 0.437 3.963 1.00 62.33 H new ATOM 0 HG2 LYS A 38 0.241 2.952 2.837 1.00 42.04 H new ATOM 0 HG3 LYS A 38 0.860 1.662 1.825 1.00 42.04 H new ATOM 0 HD2 LYS A 38 -0.785 0.148 2.492 1.00 22.34 H new ATOM 0 HD3 LYS A 38 -1.029 0.924 4.045 1.00 22.34 H new ATOM 0 HE2 LYS A 38 -1.761 2.325 1.458 1.00 13.30 H new ATOM 0 HE3 LYS A 38 -2.864 1.197 2.221 1.00 13.30 H new ATOM 0 HZ1 LYS A 38 -3.308 3.462 2.913 1.00 31.41 H new ATOM 0 HZ2 LYS A 38 -2.794 2.540 4.243 1.00 31.41 H new ATOM 0 HZ3 LYS A 38 -1.725 3.633 3.503 1.00 31.41 H new ATOM 587 N VAL A 39 2.664 0.740 6.531 1.00 4.31 N ATOM 588 CA VAL A 39 3.061 -0.236 7.539 1.00 64.15 C ATOM 589 C VAL A 39 2.700 0.243 8.940 1.00 22.31 C ATOM 590 O VAL A 39 2.319 -0.551 9.799 1.00 21.54 O ATOM 591 CB VAL A 39 4.574 -0.521 7.479 1.00 11.30 C ATOM 592 CG1 VAL A 39 4.978 -1.492 8.578 1.00 44.51 C ATOM 593 CG2 VAL A 39 4.961 -1.061 6.110 1.00 14.44 C ATOM 0 H VAL A 39 3.439 1.136 5.999 1.00 4.31 H new ATOM 0 HA VAL A 39 2.517 -1.155 7.321 1.00 64.15 H new ATOM 0 HB VAL A 39 5.109 0.415 7.639 1.00 11.30 H new ATOM 0 HG11 VAL A 39 6.050 -1.682 8.520 1.00 44.51 H new ATOM 0 HG12 VAL A 39 4.738 -1.062 9.550 1.00 44.51 H new ATOM 0 HG13 VAL A 39 4.436 -2.430 8.452 1.00 44.51 H new ATOM 0 HG21 VAL A 39 6.033 -1.257 6.086 1.00 14.44 H new ATOM 0 HG22 VAL A 39 4.419 -1.987 5.917 1.00 14.44 H new ATOM 0 HG23 VAL A 39 4.709 -0.327 5.345 1.00 14.44 H new ATOM 603 N ALA A 40 2.822 1.547 9.164 1.00 44.13 N ATOM 604 CA ALA A 40 2.506 2.133 10.460 1.00 24.25 C ATOM 605 C ALA A 40 1.031 1.951 10.800 1.00 31.22 C ATOM 606 O ALA A 40 0.686 1.541 11.908 1.00 62.31 O ATOM 607 CB ALA A 40 2.876 3.609 10.477 1.00 33.31 C ATOM 0 H ALA A 40 3.138 2.218 8.464 1.00 44.13 H new ATOM 0 HA ALA A 40 3.093 1.614 11.218 1.00 24.25 H new ATOM 0 HB1 ALA A 40 2.634 4.033 11.451 1.00 33.31 H new ATOM 0 HB2 ALA A 40 3.944 3.719 10.288 1.00 33.31 H new ATOM 0 HB3 ALA A 40 2.315 4.134 9.703 1.00 33.31 H new ATOM 613 N GLU A 41 0.165 2.259 9.840 1.00 51.31 N ATOM 614 CA GLU A 41 -1.274 2.131 10.040 1.00 62.34 C ATOM 615 C GLU A 41 -1.668 0.669 10.228 1.00 34.34 C ATOM 616 O GLU A 41 -2.430 0.333 11.135 1.00 61.42 O ATOM 617 CB GLU A 41 -2.031 2.725 8.851 1.00 54.34 C ATOM 618 CG GLU A 41 -3.476 3.079 9.164 1.00 24.41 C ATOM 619 CD GLU A 41 -4.124 3.907 8.072 1.00 61.22 C ATOM 620 OE1 GLU A 41 -3.401 4.352 7.156 1.00 12.32 O ATOM 621 OE2 GLU A 41 -5.355 4.109 8.133 1.00 2.11 O ATOM 0 H GLU A 41 0.434 2.599 8.917 1.00 51.31 H new ATOM 0 HA GLU A 41 -1.540 2.681 10.943 1.00 62.34 H new ATOM 0 HB2 GLU A 41 -1.512 3.621 8.512 1.00 54.34 H new ATOM 0 HB3 GLU A 41 -2.011 2.013 8.026 1.00 54.34 H new ATOM 0 HG2 GLU A 41 -4.048 2.162 9.307 1.00 24.41 H new ATOM 0 HG3 GLU A 41 -3.516 3.629 10.104 1.00 24.41 H new ATOM 628 N MET A 42 -1.145 -0.196 9.365 1.00 3.52 N ATOM 629 CA MET A 42 -1.441 -1.622 9.437 1.00 55.51 C ATOM 630 C MET A 42 -0.940 -2.216 10.749 1.00 1.12 C ATOM 631 O MET A 42 -1.676 -2.914 11.446 1.00 11.25 O ATOM 632 CB MET A 42 -0.806 -2.357 8.255 1.00 54.51 C ATOM 633 CG MET A 42 -1.639 -3.522 7.746 1.00 23.20 C ATOM 634 SD MET A 42 -1.768 -4.860 8.948 1.00 63.44 S ATOM 635 CE MET A 42 -0.217 -5.713 8.673 1.00 62.15 C ATOM 0 H MET A 42 -0.514 0.066 8.608 1.00 3.52 H new ATOM 0 HA MET A 42 -2.523 -1.745 9.393 1.00 55.51 H new ATOM 0 HB2 MET A 42 -0.649 -1.650 7.440 1.00 54.51 H new ATOM 0 HB3 MET A 42 0.176 -2.725 8.552 1.00 54.51 H new ATOM 0 HG2 MET A 42 -2.638 -3.167 7.495 1.00 23.20 H new ATOM 0 HG3 MET A 42 -1.197 -3.906 6.827 1.00 23.20 H new ATOM 0 HE1 MET A 42 -0.350 -6.779 8.859 1.00 62.15 H new ATOM 0 HE2 MET A 42 0.104 -5.562 7.642 1.00 62.15 H new ATOM 0 HE3 MET A 42 0.540 -5.318 9.350 1.00 62.15 H new ATOM 645 N TRP A 43 0.316 -1.935 11.079 1.00 74.24 N ATOM 646 CA TRP A 43 0.915 -2.443 12.308 1.00 51.04 C ATOM 647 C TRP A 43 0.135 -1.971 13.529 1.00 14.53 C ATOM 648 O TRP A 43 -0.140 -2.749 14.443 1.00 60.24 O ATOM 649 CB TRP A 43 2.373 -1.992 12.412 1.00 32.25 C ATOM 650 CG TRP A 43 3.090 -2.573 13.593 1.00 4.44 C ATOM 651 CD1 TRP A 43 3.713 -3.786 13.659 1.00 71.42 C ATOM 652 CD2 TRP A 43 3.258 -1.964 14.879 1.00 55.05 C ATOM 653 NE1 TRP A 43 4.257 -3.969 14.907 1.00 31.13 N ATOM 654 CE2 TRP A 43 3.992 -2.865 15.674 1.00 62.12 C ATOM 655 CE3 TRP A 43 2.860 -0.745 15.434 1.00 1.02 C ATOM 656 CZ2 TRP A 43 4.335 -2.584 16.994 1.00 73.12 C ATOM 657 CZ3 TRP A 43 3.201 -0.468 16.744 1.00 15.34 C ATOM 658 CH2 TRP A 43 3.932 -1.383 17.512 1.00 24.32 C ATOM 0 H TRP A 43 0.939 -1.359 10.513 1.00 74.24 H new ATOM 0 HA TRP A 43 0.880 -3.532 12.278 1.00 51.04 H new ATOM 0 HB2 TRP A 43 2.900 -2.275 11.501 1.00 32.25 H new ATOM 0 HB3 TRP A 43 2.406 -0.904 12.475 1.00 32.25 H new ATOM 0 HD1 TRP A 43 3.770 -4.498 12.849 1.00 71.42 H new ATOM 0 HE1 TRP A 43 4.774 -4.793 15.213 1.00 31.13 H new ATOM 0 HE3 TRP A 43 2.296 -0.033 14.850 1.00 1.02 H new ATOM 0 HZ2 TRP A 43 4.899 -3.288 17.588 1.00 73.12 H new ATOM 0 HZ3 TRP A 43 2.898 0.471 17.184 1.00 15.34 H new ATOM 0 HH2 TRP A 43 4.183 -1.136 18.533 1.00 24.32 H new ATOM 669 N LYS A 44 -0.221 -0.690 13.540 1.00 23.33 N ATOM 670 CA LYS A 44 -0.971 -0.114 14.649 1.00 12.44 C ATOM 671 C LYS A 44 -2.316 -0.813 14.818 1.00 32.03 C ATOM 672 O LYS A 44 -2.596 -1.393 15.867 1.00 73.24 O ATOM 673 CB LYS A 44 -1.188 1.384 14.421 1.00 13.02 C ATOM 674 CG LYS A 44 -1.804 2.098 15.612 1.00 75.30 C ATOM 675 CD LYS A 44 -2.445 3.413 15.203 1.00 13.41 C ATOM 676 CE LYS A 44 -3.537 3.828 16.178 1.00 44.51 C ATOM 677 NZ LYS A 44 -4.084 5.176 15.857 1.00 22.21 N ATOM 0 H LYS A 44 -0.002 -0.032 12.793 1.00 23.33 H new ATOM 0 HA LYS A 44 -0.390 -0.257 15.560 1.00 12.44 H new ATOM 0 HB2 LYS A 44 -0.231 1.849 14.184 1.00 13.02 H new ATOM 0 HB3 LYS A 44 -1.833 1.521 13.553 1.00 13.02 H new ATOM 0 HG2 LYS A 44 -2.553 1.456 16.075 1.00 75.30 H new ATOM 0 HG3 LYS A 44 -1.036 2.284 16.363 1.00 75.30 H new ATOM 0 HD2 LYS A 44 -1.683 4.191 15.156 1.00 13.41 H new ATOM 0 HD3 LYS A 44 -2.866 3.318 14.202 1.00 13.41 H new ATOM 0 HE2 LYS A 44 -4.343 3.094 16.155 1.00 44.51 H new ATOM 0 HE3 LYS A 44 -3.137 3.830 17.192 1.00 44.51 H new ATOM 0 HZ1 LYS A 44 -4.825 5.422 16.544 1.00 22.21 H new ATOM 0 HZ2 LYS A 44 -3.321 5.881 15.904 1.00 22.21 H new ATOM 0 HZ3 LYS A 44 -4.489 5.167 14.899 1.00 22.21 H new ATOM 691 N GLU A 45 -3.143 -0.755 13.779 1.00 12.41 N ATOM 692 CA GLU A 45 -4.458 -1.384 13.814 1.00 52.30 C ATOM 693 C GLU A 45 -4.347 -2.855 14.203 1.00 73.25 C ATOM 694 O GLU A 45 -5.199 -3.386 14.916 1.00 72.14 O ATOM 695 CB GLU A 45 -5.146 -1.255 12.453 1.00 11.43 C ATOM 696 CG GLU A 45 -5.959 0.020 12.301 1.00 74.31 C ATOM 697 CD GLU A 45 -7.291 -0.048 13.024 1.00 44.11 C ATOM 698 OE1 GLU A 45 -7.317 -0.531 14.175 1.00 14.31 O ATOM 699 OE2 GLU A 45 -8.306 0.383 12.438 1.00 61.23 O ATOM 0 H GLU A 45 -2.926 -0.279 12.903 1.00 12.41 H new ATOM 0 HA GLU A 45 -5.058 -0.872 14.566 1.00 52.30 H new ATOM 0 HB2 GLU A 45 -4.390 -1.290 11.668 1.00 11.43 H new ATOM 0 HB3 GLU A 45 -5.801 -2.114 12.303 1.00 11.43 H new ATOM 0 HG2 GLU A 45 -5.383 0.862 12.686 1.00 74.31 H new ATOM 0 HG3 GLU A 45 -6.134 0.211 11.242 1.00 74.31 H new ATOM 706 N TYR A 46 -3.292 -3.508 13.728 1.00 33.11 N ATOM 707 CA TYR A 46 -3.071 -4.919 14.023 1.00 44.23 C ATOM 708 C TYR A 46 -2.729 -5.121 15.496 1.00 44.43 C ATOM 709 O TYR A 46 -3.182 -6.077 16.124 1.00 3.31 O ATOM 710 CB TYR A 46 -1.947 -5.474 13.146 1.00 42.00 C ATOM 711 CG TYR A 46 -1.471 -6.845 13.569 1.00 65.45 C ATOM 712 CD1 TYR A 46 -2.061 -7.995 13.059 1.00 20.21 C ATOM 713 CD2 TYR A 46 -0.429 -6.991 14.477 1.00 61.13 C ATOM 714 CE1 TYR A 46 -1.629 -9.250 13.443 1.00 34.01 C ATOM 715 CE2 TYR A 46 0.010 -8.242 14.865 1.00 22.02 C ATOM 716 CZ TYR A 46 -0.594 -9.368 14.346 1.00 25.31 C ATOM 717 OH TYR A 46 -0.160 -10.617 14.730 1.00 42.50 O ATOM 0 H TYR A 46 -2.577 -3.083 13.138 1.00 33.11 H new ATOM 0 HA TYR A 46 -3.993 -5.458 13.806 1.00 44.23 H new ATOM 0 HB2 TYR A 46 -2.293 -5.521 12.113 1.00 42.00 H new ATOM 0 HB3 TYR A 46 -1.104 -4.783 13.169 1.00 42.00 H new ATOM 0 HD1 TYR A 46 -2.871 -7.906 12.350 1.00 20.21 H new ATOM 0 HD2 TYR A 46 0.046 -6.111 14.886 1.00 61.13 H new ATOM 0 HE1 TYR A 46 -2.100 -10.134 13.038 1.00 34.01 H new ATOM 0 HE2 TYR A 46 0.822 -8.338 15.571 1.00 22.02 H new ATOM 0 HH TYR A 46 -0.537 -11.293 14.130 1.00 42.50 H new ATOM 727 N MET A 47 -1.926 -4.212 16.040 1.00 41.22 N ATOM 728 CA MET A 47 -1.524 -4.288 17.440 1.00 61.04 C ATOM 729 C MET A 47 -2.674 -3.889 18.358 1.00 13.32 C ATOM 730 O MET A 47 -2.699 -4.254 19.534 1.00 24.12 O ATOM 731 CB MET A 47 -0.315 -3.386 17.695 1.00 11.30 C ATOM 732 CG MET A 47 0.944 -3.837 16.972 1.00 54.20 C ATOM 733 SD MET A 47 1.842 -5.115 17.873 1.00 52.14 S ATOM 734 CE MET A 47 2.597 -4.144 19.175 1.00 60.23 C ATOM 0 H MET A 47 -1.541 -3.415 15.533 1.00 41.22 H new ATOM 0 HA MET A 47 -1.250 -5.320 17.658 1.00 61.04 H new ATOM 0 HB2 MET A 47 -0.558 -2.370 17.384 1.00 11.30 H new ATOM 0 HB3 MET A 47 -0.117 -3.353 18.766 1.00 11.30 H new ATOM 0 HG2 MET A 47 0.676 -4.214 15.985 1.00 54.20 H new ATOM 0 HG3 MET A 47 1.598 -2.978 16.819 1.00 54.20 H new ATOM 0 HE1 MET A 47 3.677 -4.290 19.158 1.00 60.23 H new ATOM 0 HE2 MET A 47 2.371 -3.089 19.020 1.00 60.23 H new ATOM 0 HE3 MET A 47 2.203 -4.461 20.141 1.00 60.23 H new ATOM 744 N LEU A 48 -3.625 -3.137 17.815 1.00 35.10 N ATOM 745 CA LEU A 48 -4.779 -2.688 18.586 1.00 14.23 C ATOM 746 C LEU A 48 -6.001 -3.552 18.291 1.00 15.51 C ATOM 747 O LEU A 48 -7.131 -3.062 18.276 1.00 1.14 O ATOM 748 CB LEU A 48 -5.088 -1.223 18.273 1.00 52.15 C ATOM 749 CG LEU A 48 -3.944 -0.233 18.495 1.00 61.24 C ATOM 750 CD1 LEU A 48 -4.310 1.137 17.947 1.00 43.45 C ATOM 751 CD2 LEU A 48 -3.596 -0.143 19.973 1.00 31.03 C ATOM 0 H LEU A 48 -3.620 -2.825 16.844 1.00 35.10 H new ATOM 0 HA LEU A 48 -4.537 -2.783 19.644 1.00 14.23 H new ATOM 0 HB2 LEU A 48 -5.405 -1.154 17.232 1.00 52.15 H new ATOM 0 HB3 LEU A 48 -5.935 -0.912 18.885 1.00 52.15 H new ATOM 0 HG LEU A 48 -3.067 -0.594 17.957 1.00 61.24 H new ATOM 0 HD11 LEU A 48 -3.484 1.828 18.114 1.00 43.45 H new ATOM 0 HD12 LEU A 48 -4.508 1.060 16.878 1.00 43.45 H new ATOM 0 HD13 LEU A 48 -5.201 1.506 18.456 1.00 43.45 H new ATOM 0 HD21 LEU A 48 -2.780 0.566 20.112 1.00 31.03 H new ATOM 0 HD22 LEU A 48 -4.469 0.194 20.532 1.00 31.03 H new ATOM 0 HD23 LEU A 48 -3.290 -1.124 20.335 1.00 31.03 H new ATOM 763 N ARG A 49 -5.768 -4.839 18.058 1.00 5.14 N ATOM 764 CA ARG A 49 -6.849 -5.771 17.765 1.00 73.12 C ATOM 765 C ARG A 49 -6.886 -6.901 18.789 1.00 34.24 C ATOM 766 O ARG A 49 -5.867 -7.286 19.363 1.00 11.31 O ATOM 767 CB ARG A 49 -6.685 -6.349 16.358 1.00 73.11 C ATOM 768 CG ARG A 49 -7.351 -5.515 15.275 1.00 23.04 C ATOM 769 CD ARG A 49 -6.813 -5.861 13.896 1.00 63.11 C ATOM 770 NE ARG A 49 -7.821 -5.682 12.854 1.00 22.05 N ATOM 771 CZ ARG A 49 -7.542 -5.670 11.556 1.00 62.22 C ATOM 772 NH1 ARG A 49 -6.292 -5.827 11.141 1.00 12.34 N ATOM 773 NH2 ARG A 49 -8.514 -5.502 10.669 1.00 71.14 N ATOM 0 H ARG A 49 -4.839 -5.260 18.067 1.00 5.14 H new ATOM 0 HA ARG A 49 -7.790 -5.224 17.819 1.00 73.12 H new ATOM 0 HB2 ARG A 49 -5.622 -6.439 16.133 1.00 73.11 H new ATOM 0 HB3 ARG A 49 -7.102 -7.356 16.337 1.00 73.11 H new ATOM 0 HG2 ARG A 49 -8.428 -5.680 15.298 1.00 23.04 H new ATOM 0 HG3 ARG A 49 -7.186 -4.457 15.476 1.00 23.04 H new ATOM 0 HD2 ARG A 49 -5.949 -5.234 13.676 1.00 63.11 H new ATOM 0 HD3 ARG A 49 -6.466 -6.894 13.891 1.00 63.11 H new ATOM 0 HE ARG A 49 -8.793 -5.559 13.139 1.00 22.05 H new ATOM 0 HH11 ARG A 49 -5.542 -5.957 11.820 1.00 12.34 H new ATOM 0 HH12 ARG A 49 -6.081 -5.817 10.143 1.00 12.34 H new ATOM 0 HH21 ARG A 49 -9.477 -5.382 10.984 1.00 71.14 H new ATOM 0 HH22 ARG A 49 -8.299 -5.493 9.672 1.00 71.14 H new ATOM 787 N PRO A 50 -8.089 -7.446 19.026 1.00 23.43 N ATOM 788 CA PRO A 50 -8.288 -8.540 19.982 1.00 3.22 C ATOM 789 C PRO A 50 -7.680 -9.851 19.497 1.00 24.45 C ATOM 790 O PRO A 50 -7.111 -10.610 20.282 1.00 20.52 O ATOM 791 CB PRO A 50 -9.811 -8.658 20.074 1.00 71.24 C ATOM 792 CG PRO A 50 -10.311 -8.120 18.778 1.00 73.03 C ATOM 793 CD PRO A 50 -9.347 -7.038 18.379 1.00 44.23 C ATOM 0 HA PRO A 50 -7.804 -8.339 20.938 1.00 3.22 H new ATOM 0 HB2 PRO A 50 -10.120 -9.693 20.219 1.00 71.24 H new ATOM 0 HB3 PRO A 50 -10.202 -8.088 20.917 1.00 71.24 H new ATOM 0 HG2 PRO A 50 -10.354 -8.903 18.021 1.00 73.03 H new ATOM 0 HG3 PRO A 50 -11.321 -7.723 18.884 1.00 73.03 H new ATOM 0 HD2 PRO A 50 -9.240 -6.975 17.296 1.00 44.23 H new ATOM 0 HD3 PRO A 50 -9.677 -6.058 18.724 1.00 44.23 H new ATOM 801 N SER A 51 -7.803 -10.112 18.200 1.00 42.32 N ATOM 802 CA SER A 51 -7.268 -11.334 17.611 1.00 1.12 C ATOM 803 C SER A 51 -5.812 -11.540 18.017 1.00 64.02 C ATOM 804 O SER A 51 -5.424 -12.625 18.451 1.00 44.30 O ATOM 805 CB SER A 51 -7.382 -11.283 16.086 1.00 30.04 C ATOM 806 OG SER A 51 -8.729 -11.425 15.671 1.00 74.12 O ATOM 0 H SER A 51 -8.269 -9.493 17.536 1.00 42.32 H new ATOM 0 HA SER A 51 -7.854 -12.174 17.984 1.00 1.12 H new ATOM 0 HB2 SER A 51 -6.983 -10.337 15.720 1.00 30.04 H new ATOM 0 HB3 SER A 51 -6.777 -12.076 15.646 1.00 30.04 H new ATOM 0 HG SER A 51 -8.776 -11.387 14.693 1.00 74.12 H new ATOM 812 N VAL A 52 -5.009 -10.490 17.872 1.00 72.21 N ATOM 813 CA VAL A 52 -3.596 -10.554 18.224 1.00 63.13 C ATOM 814 C VAL A 52 -3.412 -10.799 19.717 1.00 24.41 C ATOM 815 O VAL A 52 -3.930 -10.054 20.547 1.00 5.22 O ATOM 816 CB VAL A 52 -2.861 -9.258 17.833 1.00 10.11 C ATOM 817 CG1 VAL A 52 -1.376 -9.372 18.142 1.00 11.34 C ATOM 818 CG2 VAL A 52 -3.085 -8.942 16.362 1.00 1.31 C ATOM 0 H VAL A 52 -5.314 -9.585 17.513 1.00 72.21 H new ATOM 0 HA VAL A 52 -3.169 -11.388 17.667 1.00 63.13 H new ATOM 0 HB VAL A 52 -3.268 -8.437 18.424 1.00 10.11 H new ATOM 0 HG11 VAL A 52 -0.873 -8.447 17.859 1.00 11.34 H new ATOM 0 HG12 VAL A 52 -1.239 -9.548 19.209 1.00 11.34 H new ATOM 0 HG13 VAL A 52 -0.950 -10.203 17.580 1.00 11.34 H new ATOM 0 HG21 VAL A 52 -2.559 -8.023 16.103 1.00 1.31 H new ATOM 0 HG22 VAL A 52 -2.706 -9.762 15.752 1.00 1.31 H new ATOM 0 HG23 VAL A 52 -4.151 -8.814 16.176 1.00 1.31 H new ATOM 828 N ASN A 53 -2.669 -11.850 20.051 1.00 34.05 N ATOM 829 CA ASN A 53 -2.416 -12.194 21.446 1.00 74.31 C ATOM 830 C ASN A 53 -1.252 -11.381 22.004 1.00 34.34 C ATOM 831 O ASN A 53 -0.576 -10.659 21.271 1.00 15.54 O ATOM 832 CB ASN A 53 -2.119 -13.689 21.578 1.00 63.32 C ATOM 833 CG ASN A 53 -3.346 -14.547 21.336 1.00 42.24 C ATOM 834 OD1 ASN A 53 -3.545 -15.069 20.239 1.00 53.44 O ATOM 835 ND2 ASN A 53 -4.175 -14.696 22.362 1.00 52.21 N ATOM 0 H ASN A 53 -2.232 -12.477 19.376 1.00 34.05 H new ATOM 0 HA ASN A 53 -3.311 -11.956 22.021 1.00 74.31 H new ATOM 0 HB2 ASN A 53 -1.340 -13.966 20.868 1.00 63.32 H new ATOM 0 HB3 ASN A 53 -1.728 -13.892 22.575 1.00 63.32 H new ATOM 0 HD21 ASN A 53 -5.017 -15.262 22.259 1.00 52.21 H new ATOM 0 HD22 ASN A 53 -3.970 -14.245 23.253 1.00 52.21 H new ATOM 842 N THR A 54 -1.023 -11.505 23.308 1.00 10.21 N ATOM 843 CA THR A 54 0.058 -10.782 23.966 1.00 42.13 C ATOM 844 C THR A 54 1.401 -11.089 23.313 1.00 3.14 C ATOM 845 O THR A 54 2.176 -10.182 23.009 1.00 53.24 O ATOM 846 CB THR A 54 0.137 -11.130 25.464 1.00 14.22 C ATOM 847 OG1 THR A 54 -0.305 -12.475 25.679 1.00 53.14 O ATOM 848 CG2 THR A 54 -0.714 -10.174 26.287 1.00 50.01 C ATOM 0 H THR A 54 -1.572 -12.099 23.929 1.00 10.21 H new ATOM 0 HA THR A 54 -0.161 -9.720 23.859 1.00 42.13 H new ATOM 0 HB THR A 54 1.175 -11.034 25.782 1.00 14.22 H new ATOM 0 HG1 THR A 54 -0.250 -12.689 26.634 1.00 53.14 H new ATOM 0 HG21 THR A 54 -0.643 -10.439 27.342 1.00 50.01 H new ATOM 0 HG22 THR A 54 -0.357 -9.154 26.144 1.00 50.01 H new ATOM 0 HG23 THR A 54 -1.753 -10.243 25.965 1.00 50.01 H new ATOM 856 N ARG A 55 1.671 -12.373 23.101 1.00 2.13 N ATOM 857 CA ARG A 55 2.922 -12.799 22.485 1.00 32.02 C ATOM 858 C ARG A 55 3.171 -12.045 21.182 1.00 11.54 C ATOM 859 O ARG A 55 4.215 -11.416 21.008 1.00 53.43 O ATOM 860 CB ARG A 55 2.896 -14.305 22.218 1.00 62.12 C ATOM 861 CG ARG A 55 4.277 -14.918 22.054 1.00 23.21 C ATOM 862 CD ARG A 55 4.197 -16.419 21.823 1.00 53.04 C ATOM 863 NE ARG A 55 4.235 -17.169 23.075 1.00 11.22 N ATOM 864 CZ ARG A 55 4.303 -18.494 23.137 1.00 61.03 C ATOM 865 NH1 ARG A 55 4.341 -19.212 22.022 1.00 13.44 N ATOM 866 NH2 ARG A 55 4.334 -19.104 24.315 1.00 62.04 N ATOM 0 H ARG A 55 1.040 -13.136 23.347 1.00 2.13 H new ATOM 0 HA ARG A 55 3.734 -12.573 23.176 1.00 32.02 H new ATOM 0 HB2 ARG A 55 2.382 -14.803 23.041 1.00 62.12 H new ATOM 0 HB3 ARG A 55 2.314 -14.496 21.317 1.00 62.12 H new ATOM 0 HG2 ARG A 55 4.788 -14.446 21.215 1.00 23.21 H new ATOM 0 HG3 ARG A 55 4.873 -14.717 22.944 1.00 23.21 H new ATOM 0 HD2 ARG A 55 3.277 -16.655 21.287 1.00 53.04 H new ATOM 0 HD3 ARG A 55 5.025 -16.732 21.188 1.00 53.04 H new ATOM 0 HE ARG A 55 4.208 -16.647 23.951 1.00 11.22 H new ATOM 0 HH11 ARG A 55 4.318 -18.747 21.115 1.00 13.44 H new ATOM 0 HH12 ARG A 55 4.393 -20.229 22.072 1.00 13.44 H new ATOM 0 HH21 ARG A 55 4.306 -18.555 25.174 1.00 62.04 H new ATOM 0 HH22 ARG A 55 4.386 -20.122 24.361 1.00 62.04 H new ATOM 880 N ARG A 56 2.206 -12.113 20.271 1.00 13.34 N ATOM 881 CA ARG A 56 2.321 -11.438 18.984 1.00 0.22 C ATOM 882 C ARG A 56 2.618 -9.953 19.174 1.00 70.15 C ATOM 883 O ARG A 56 3.386 -9.360 18.415 1.00 75.51 O ATOM 884 CB ARG A 56 1.034 -11.612 18.176 1.00 62.53 C ATOM 885 CG ARG A 56 0.958 -12.935 17.430 1.00 42.42 C ATOM 886 CD ARG A 56 -0.473 -13.439 17.334 1.00 12.13 C ATOM 887 NE ARG A 56 -1.257 -12.680 16.363 1.00 31.42 N ATOM 888 CZ ARG A 56 -2.400 -13.113 15.843 1.00 52.11 C ATOM 889 NH1 ARG A 56 -2.890 -14.292 16.199 1.00 33.21 N ATOM 890 NH2 ARG A 56 -3.056 -12.365 14.965 1.00 41.14 N ATOM 0 H ARG A 56 1.336 -12.629 20.400 1.00 13.34 H new ATOM 0 HA ARG A 56 3.149 -11.890 18.438 1.00 0.22 H new ATOM 0 HB2 ARG A 56 0.179 -11.534 18.848 1.00 62.53 H new ATOM 0 HB3 ARG A 56 0.952 -10.795 17.459 1.00 62.53 H new ATOM 0 HG2 ARG A 56 1.370 -12.813 16.428 1.00 42.42 H new ATOM 0 HG3 ARG A 56 1.573 -13.677 17.939 1.00 42.42 H new ATOM 0 HD2 ARG A 56 -0.468 -14.492 17.052 1.00 12.13 H new ATOM 0 HD3 ARG A 56 -0.947 -13.373 18.313 1.00 12.13 H new ATOM 0 HE ARG A 56 -0.908 -11.768 16.068 1.00 31.42 H new ATOM 0 HH11 ARG A 56 -2.389 -14.870 16.874 1.00 33.21 H new ATOM 0 HH12 ARG A 56 -3.768 -14.622 15.798 1.00 33.21 H new ATOM 0 HH21 ARG A 56 -2.683 -11.457 14.689 1.00 41.14 H new ATOM 0 HH22 ARG A 56 -3.934 -12.698 14.566 1.00 41.14 H new ATOM 904 N LYS A 57 2.004 -9.357 20.190 1.00 23.33 N ATOM 905 CA LYS A 57 2.202 -7.942 20.481 1.00 23.31 C ATOM 906 C LYS A 57 3.628 -7.678 20.953 1.00 24.35 C ATOM 907 O LYS A 57 4.336 -6.843 20.389 1.00 52.14 O ATOM 908 CB LYS A 57 1.207 -7.475 21.545 1.00 14.01 C ATOM 909 CG LYS A 57 -0.240 -7.789 21.204 1.00 1.31 C ATOM 910 CD LYS A 57 -1.053 -6.521 21.001 1.00 4.14 C ATOM 911 CE LYS A 57 -2.535 -6.827 20.851 1.00 21.15 C ATOM 912 NZ LYS A 57 -3.355 -6.113 21.869 1.00 5.13 N ATOM 0 H LYS A 57 1.364 -9.832 20.827 1.00 23.33 H new ATOM 0 HA LYS A 57 2.032 -7.381 19.562 1.00 23.31 H new ATOM 0 HB2 LYS A 57 1.458 -7.945 22.496 1.00 14.01 H new ATOM 0 HB3 LYS A 57 1.314 -6.399 21.683 1.00 14.01 H new ATOM 0 HG2 LYS A 57 -0.278 -8.395 20.299 1.00 1.31 H new ATOM 0 HG3 LYS A 57 -0.683 -8.382 22.004 1.00 1.31 H new ATOM 0 HD2 LYS A 57 -0.903 -5.852 21.848 1.00 4.14 H new ATOM 0 HD3 LYS A 57 -0.697 -5.997 20.114 1.00 4.14 H new ATOM 0 HE2 LYS A 57 -2.866 -6.541 19.853 1.00 21.15 H new ATOM 0 HE3 LYS A 57 -2.695 -7.901 20.944 1.00 21.15 H new ATOM 0 HZ1 LYS A 57 -4.264 -6.604 21.989 1.00 5.13 H new ATOM 0 HZ2 LYS A 57 -2.847 -6.099 22.776 1.00 5.13 H new ATOM 0 HZ3 LYS A 57 -3.528 -5.137 21.554 1.00 5.13 H new ATOM 926 N LEU A 58 4.045 -8.396 21.991 1.00 44.32 N ATOM 927 CA LEU A 58 5.389 -8.240 22.538 1.00 14.03 C ATOM 928 C LEU A 58 6.440 -8.329 21.436 1.00 15.23 C ATOM 929 O LEU A 58 7.396 -7.553 21.411 1.00 14.43 O ATOM 930 CB LEU A 58 5.655 -9.308 23.600 1.00 30.50 C ATOM 931 CG LEU A 58 7.013 -9.237 24.299 1.00 41.52 C ATOM 932 CD1 LEU A 58 8.084 -9.909 23.454 1.00 3.12 C ATOM 933 CD2 LEU A 58 7.389 -7.790 24.587 1.00 34.32 C ATOM 0 H LEU A 58 3.473 -9.091 22.470 1.00 44.32 H new ATOM 0 HA LEU A 58 5.455 -7.254 22.998 1.00 14.03 H new ATOM 0 HB2 LEU A 58 4.875 -9.240 24.358 1.00 30.50 H new ATOM 0 HB3 LEU A 58 5.560 -10.288 23.132 1.00 30.50 H new ATOM 0 HG LEU A 58 6.940 -9.769 25.248 1.00 41.52 H new ATOM 0 HD11 LEU A 58 9.044 -9.849 23.967 1.00 3.12 H new ATOM 0 HD12 LEU A 58 7.821 -10.955 23.298 1.00 3.12 H new ATOM 0 HD13 LEU A 58 8.156 -9.405 22.490 1.00 3.12 H new ATOM 0 HD21 LEU A 58 8.358 -7.758 25.085 1.00 34.32 H new ATOM 0 HD22 LEU A 58 7.443 -7.235 23.651 1.00 34.32 H new ATOM 0 HD23 LEU A 58 6.635 -7.340 25.232 1.00 34.32 H new ATOM 945 N LEU A 59 6.255 -9.278 20.525 1.00 1.05 N ATOM 946 CA LEU A 59 7.186 -9.467 19.418 1.00 21.24 C ATOM 947 C LEU A 59 7.112 -8.300 18.439 1.00 73.42 C ATOM 948 O LEU A 59 8.136 -7.770 18.010 1.00 33.12 O ATOM 949 CB LEU A 59 6.884 -10.779 18.691 1.00 44.40 C ATOM 950 CG LEU A 59 7.052 -12.057 19.514 1.00 44.53 C ATOM 951 CD1 LEU A 59 6.749 -13.281 18.665 1.00 34.52 C ATOM 952 CD2 LEU A 59 8.459 -12.139 20.089 1.00 32.40 C ATOM 0 H LEU A 59 5.469 -9.928 20.531 1.00 1.05 H new ATOM 0 HA LEU A 59 8.195 -9.510 19.827 1.00 21.24 H new ATOM 0 HB2 LEU A 59 5.859 -10.740 18.323 1.00 44.40 H new ATOM 0 HB3 LEU A 59 7.533 -10.845 17.818 1.00 44.40 H new ATOM 0 HG LEU A 59 6.344 -12.030 20.342 1.00 44.53 H new ATOM 0 HD11 LEU A 59 6.874 -14.181 19.267 1.00 34.52 H new ATOM 0 HD12 LEU A 59 5.723 -13.227 18.302 1.00 34.52 H new ATOM 0 HD13 LEU A 59 7.433 -13.314 17.817 1.00 34.52 H new ATOM 0 HD21 LEU A 59 8.561 -13.054 20.672 1.00 32.40 H new ATOM 0 HD22 LEU A 59 9.185 -12.144 19.276 1.00 32.40 H new ATOM 0 HD23 LEU A 59 8.640 -11.278 20.732 1.00 32.40 H new ATOM 964 N GLY A 60 5.891 -7.904 18.090 1.00 44.10 N ATOM 965 CA GLY A 60 5.706 -6.801 17.165 1.00 12.13 C ATOM 966 C GLY A 60 6.440 -5.548 17.602 1.00 35.50 C ATOM 967 O GLY A 60 7.082 -4.881 16.790 1.00 24.42 O ATOM 0 H GLY A 60 5.028 -8.327 18.431 1.00 44.10 H new ATOM 0 HA2 GLY A 60 6.056 -7.097 16.176 1.00 12.13 H new ATOM 0 HA3 GLY A 60 4.642 -6.582 17.074 1.00 12.13 H new ATOM 971 N LEU A 61 6.343 -5.226 18.887 1.00 22.21 N ATOM 972 CA LEU A 61 7.002 -4.044 19.431 1.00 41.31 C ATOM 973 C LEU A 61 8.510 -4.109 19.208 1.00 34.52 C ATOM 974 O LEU A 61 9.128 -3.132 18.786 1.00 63.31 O ATOM 975 CB LEU A 61 6.701 -3.909 20.925 1.00 61.44 C ATOM 976 CG LEU A 61 6.779 -2.495 21.501 1.00 70.15 C ATOM 977 CD1 LEU A 61 5.518 -1.713 21.167 1.00 1.21 C ATOM 978 CD2 LEU A 61 6.996 -2.543 23.006 1.00 64.41 C ATOM 0 H LEU A 61 5.814 -5.767 19.572 1.00 22.21 H new ATOM 0 HA LEU A 61 6.614 -3.170 18.908 1.00 41.31 H new ATOM 0 HB2 LEU A 61 5.701 -4.300 21.110 1.00 61.44 H new ATOM 0 HB3 LEU A 61 7.398 -4.542 21.474 1.00 61.44 H new ATOM 0 HG LEU A 61 7.629 -1.985 21.048 1.00 70.15 H new ATOM 0 HD11 LEU A 61 5.591 -0.709 21.585 1.00 1.21 H new ATOM 0 HD12 LEU A 61 5.406 -1.648 20.085 1.00 1.21 H new ATOM 0 HD13 LEU A 61 4.652 -2.221 21.592 1.00 1.21 H new ATOM 0 HD21 LEU A 61 7.049 -1.528 23.399 1.00 64.41 H new ATOM 0 HD22 LEU A 61 6.167 -3.071 23.477 1.00 64.41 H new ATOM 0 HD23 LEU A 61 7.928 -3.065 23.223 1.00 64.41 H new ATOM 990 N TYR A 62 9.094 -5.268 19.493 1.00 43.31 N ATOM 991 CA TYR A 62 10.530 -5.461 19.324 1.00 34.20 C ATOM 992 C TYR A 62 10.920 -5.385 17.851 1.00 30.22 C ATOM 993 O TYR A 62 12.025 -4.960 17.510 1.00 14.13 O ATOM 994 CB TYR A 62 10.956 -6.810 19.907 1.00 13.42 C ATOM 995 CG TYR A 62 11.378 -6.736 21.357 1.00 13.03 C ATOM 996 CD1 TYR A 62 12.554 -6.096 21.728 1.00 53.54 C ATOM 997 CD2 TYR A 62 10.600 -7.306 22.357 1.00 35.32 C ATOM 998 CE1 TYR A 62 12.943 -6.027 23.051 1.00 3.31 C ATOM 999 CE2 TYR A 62 10.981 -7.241 23.684 1.00 74.04 C ATOM 1000 CZ TYR A 62 12.153 -6.601 24.025 1.00 4.33 C ATOM 1001 OH TYR A 62 12.537 -6.533 25.345 1.00 23.01 O ATOM 0 H TYR A 62 8.596 -6.087 19.842 1.00 43.31 H new ATOM 0 HA TYR A 62 11.044 -4.662 19.859 1.00 34.20 H new ATOM 0 HB2 TYR A 62 10.129 -7.514 19.813 1.00 13.42 H new ATOM 0 HB3 TYR A 62 11.782 -7.207 19.317 1.00 13.42 H new ATOM 0 HD1 TYR A 62 13.175 -5.645 20.968 1.00 53.54 H new ATOM 0 HD2 TYR A 62 9.681 -7.809 22.093 1.00 35.32 H new ATOM 0 HE1 TYR A 62 13.861 -5.526 23.322 1.00 3.31 H new ATOM 0 HE2 TYR A 62 10.364 -7.689 24.449 1.00 74.04 H new ATOM 0 HH TYR A 62 11.870 -6.985 25.903 1.00 23.01 H new ATOM 1011 N LEU A 63 10.005 -5.800 16.982 1.00 44.04 N ATOM 1012 CA LEU A 63 10.252 -5.779 15.544 1.00 73.12 C ATOM 1013 C LEU A 63 10.312 -4.347 15.022 1.00 13.14 C ATOM 1014 O LEU A 63 11.301 -3.938 14.415 1.00 20.04 O ATOM 1015 CB LEU A 63 9.159 -6.556 14.808 1.00 71.40 C ATOM 1016 CG LEU A 63 9.370 -6.752 13.306 1.00 13.11 C ATOM 1017 CD1 LEU A 63 10.508 -7.727 13.049 1.00 20.25 C ATOM 1018 CD2 LEU A 63 8.088 -7.240 12.647 1.00 50.23 C ATOM 0 H LEU A 63 9.086 -6.155 17.247 1.00 44.04 H new ATOM 0 HA LEU A 63 11.215 -6.254 15.359 1.00 73.12 H new ATOM 0 HB2 LEU A 63 9.064 -7.538 15.272 1.00 71.40 H new ATOM 0 HB3 LEU A 63 8.211 -6.039 14.957 1.00 71.40 H new ATOM 0 HG LEU A 63 9.637 -5.790 12.868 1.00 13.11 H new ATOM 0 HD11 LEU A 63 10.643 -7.854 11.975 1.00 20.25 H new ATOM 0 HD12 LEU A 63 11.427 -7.337 13.487 1.00 20.25 H new ATOM 0 HD13 LEU A 63 10.271 -8.690 13.501 1.00 20.25 H new ATOM 0 HD21 LEU A 63 8.256 -7.374 11.578 1.00 50.23 H new ATOM 0 HD22 LEU A 63 7.790 -8.191 13.090 1.00 50.23 H new ATOM 0 HD23 LEU A 63 7.298 -6.505 12.800 1.00 50.23 H new ATOM 1030 N MET A 64 9.247 -3.589 15.266 1.00 64.04 N ATOM 1031 CA MET A 64 9.181 -2.201 14.823 1.00 0.03 C ATOM 1032 C MET A 64 10.272 -1.366 15.486 1.00 22.43 C ATOM 1033 O MET A 64 10.765 -0.400 14.907 1.00 40.50 O ATOM 1034 CB MET A 64 7.806 -1.608 15.139 1.00 45.01 C ATOM 1035 CG MET A 64 7.643 -1.193 16.592 1.00 34.42 C ATOM 1036 SD MET A 64 8.010 0.551 16.862 1.00 10.15 S ATOM 1037 CE MET A 64 7.167 0.838 18.417 1.00 60.34 C ATOM 0 H MET A 64 8.420 -3.912 15.767 1.00 64.04 H new ATOM 0 HA MET A 64 9.339 -2.182 13.745 1.00 0.03 H new ATOM 0 HB2 MET A 64 7.638 -0.740 14.501 1.00 45.01 H new ATOM 0 HB3 MET A 64 7.038 -2.340 14.890 1.00 45.01 H new ATOM 0 HG2 MET A 64 6.622 -1.399 16.912 1.00 34.42 H new ATOM 0 HG3 MET A 64 8.301 -1.799 17.215 1.00 34.42 H new ATOM 0 HE1 MET A 64 7.302 1.877 18.718 1.00 60.34 H new ATOM 0 HE2 MET A 64 6.104 0.630 18.298 1.00 60.34 H new ATOM 0 HE3 MET A 64 7.582 0.182 19.182 1.00 60.34 H new ATOM 1047 N ASN A 65 10.644 -1.747 16.704 1.00 3.12 N ATOM 1048 CA ASN A 65 11.677 -1.032 17.446 1.00 32.41 C ATOM 1049 C ASN A 65 13.048 -1.247 16.813 1.00 43.40 C ATOM 1050 O ASN A 65 13.805 -0.297 16.608 1.00 54.43 O ATOM 1051 CB ASN A 65 11.698 -1.494 18.905 1.00 62.24 C ATOM 1052 CG ASN A 65 12.506 -0.568 19.793 1.00 44.04 C ATOM 1053 OD1 ASN A 65 12.652 0.619 19.500 1.00 5.05 O ATOM 1054 ND2 ASN A 65 13.036 -1.108 20.884 1.00 65.23 N ATOM 0 H ASN A 65 10.246 -2.546 17.198 1.00 3.12 H new ATOM 0 HA ASN A 65 11.444 0.032 17.412 1.00 32.41 H new ATOM 0 HB2 ASN A 65 10.676 -1.552 19.280 1.00 62.24 H new ATOM 0 HB3 ASN A 65 12.115 -2.500 18.959 1.00 62.24 H new ATOM 0 HD21 ASN A 65 13.590 -0.534 21.519 1.00 65.23 H new ATOM 0 HD22 ASN A 65 12.889 -2.097 21.087 1.00 65.23 H new ATOM 1061 N HIS A 66 13.362 -2.501 16.505 1.00 45.01 N ATOM 1062 CA HIS A 66 14.643 -2.840 15.894 1.00 74.43 C ATOM 1063 C HIS A 66 14.766 -2.214 14.508 1.00 71.31 C ATOM 1064 O HIS A 66 15.841 -1.765 14.112 1.00 4.51 O ATOM 1065 CB HIS A 66 14.799 -4.358 15.796 1.00 35.31 C ATOM 1066 CG HIS A 66 16.207 -4.801 15.545 1.00 3.34 C ATOM 1067 ND1 HIS A 66 17.296 -4.245 16.184 1.00 53.21 N ATOM 1068 CD2 HIS A 66 16.703 -5.753 14.721 1.00 74.20 C ATOM 1069 CE1 HIS A 66 18.400 -4.835 15.762 1.00 53.12 C ATOM 1070 NE2 HIS A 66 18.067 -5.754 14.874 1.00 63.51 N ATOM 0 H HIS A 66 12.748 -3.299 16.668 1.00 45.01 H new ATOM 0 HA HIS A 66 15.436 -2.441 16.526 1.00 74.43 H new ATOM 0 HB2 HIS A 66 14.444 -4.812 16.721 1.00 35.31 H new ATOM 0 HB3 HIS A 66 14.162 -4.729 14.994 1.00 35.31 H new ATOM 0 HD2 HIS A 66 16.132 -6.393 14.065 1.00 74.20 H new ATOM 0 HE1 HIS A 66 19.404 -4.605 16.088 1.00 53.12 H new ATOM 0 HE2 HIS A 66 18.718 -6.366 14.382 1.00 63.51 H new ATOM 1078 N VAL A 67 13.658 -2.189 13.774 1.00 33.52 N ATOM 1079 CA VAL A 67 13.642 -1.618 12.433 1.00 74.53 C ATOM 1080 C VAL A 67 13.871 -0.112 12.474 1.00 40.10 C ATOM 1081 O VAL A 67 14.760 0.410 11.801 1.00 54.53 O ATOM 1082 CB VAL A 67 12.308 -1.904 11.717 1.00 20.20 C ATOM 1083 CG1 VAL A 67 12.323 -1.329 10.309 1.00 3.42 C ATOM 1084 CG2 VAL A 67 12.029 -3.399 11.688 1.00 64.45 C ATOM 0 H VAL A 67 12.760 -2.558 14.086 1.00 33.52 H new ATOM 0 HA VAL A 67 14.452 -2.091 11.878 1.00 74.53 H new ATOM 0 HB VAL A 67 11.506 -1.418 12.273 1.00 20.20 H new ATOM 0 HG11 VAL A 67 11.373 -1.541 9.819 1.00 3.42 H new ATOM 0 HG12 VAL A 67 12.473 -0.251 10.358 1.00 3.42 H new ATOM 0 HG13 VAL A 67 13.134 -1.783 9.739 1.00 3.42 H new ATOM 0 HG21 VAL A 67 11.083 -3.583 11.179 1.00 64.45 H new ATOM 0 HG22 VAL A 67 12.832 -3.909 11.156 1.00 64.45 H new ATOM 0 HG23 VAL A 67 11.971 -3.778 12.708 1.00 64.45 H new ATOM 1094 N VAL A 68 13.064 0.583 13.270 1.00 72.44 N ATOM 1095 CA VAL A 68 13.179 2.030 13.401 1.00 43.13 C ATOM 1096 C VAL A 68 14.570 2.429 13.882 1.00 14.05 C ATOM 1097 O VAL A 68 15.154 3.394 13.391 1.00 14.40 O ATOM 1098 CB VAL A 68 12.129 2.591 14.378 1.00 71.23 C ATOM 1099 CG1 VAL A 68 12.329 4.085 14.577 1.00 52.51 C ATOM 1100 CG2 VAL A 68 10.724 2.295 13.876 1.00 34.30 C ATOM 0 H VAL A 68 12.323 0.166 13.834 1.00 72.44 H new ATOM 0 HA VAL A 68 13.005 2.452 12.411 1.00 43.13 H new ATOM 0 HB VAL A 68 12.257 2.100 15.343 1.00 71.23 H new ATOM 0 HG11 VAL A 68 11.578 4.463 15.270 1.00 52.51 H new ATOM 0 HG12 VAL A 68 13.323 4.268 14.984 1.00 52.51 H new ATOM 0 HG13 VAL A 68 12.229 4.596 13.619 1.00 52.51 H new ATOM 0 HG21 VAL A 68 9.994 2.698 14.578 1.00 34.30 H new ATOM 0 HG22 VAL A 68 10.582 2.757 12.899 1.00 34.30 H new ATOM 0 HG23 VAL A 68 10.588 1.217 13.790 1.00 34.30 H new ATOM 1110 N GLN A 69 15.094 1.679 14.847 1.00 54.05 N ATOM 1111 CA GLN A 69 16.416 1.955 15.395 1.00 41.10 C ATOM 1112 C GLN A 69 17.471 1.965 14.294 1.00 60.34 C ATOM 1113 O GLN A 69 18.314 2.860 14.237 1.00 33.21 O ATOM 1114 CB GLN A 69 16.779 0.915 16.456 1.00 72.41 C ATOM 1115 CG GLN A 69 16.403 1.330 17.869 1.00 3.21 C ATOM 1116 CD GLN A 69 17.078 0.479 18.927 1.00 70.25 C ATOM 1117 OE1 GLN A 69 18.237 0.090 18.780 1.00 20.42 O ATOM 1118 NE2 GLN A 69 16.354 0.185 20.000 1.00 24.44 N ATOM 0 H GLN A 69 14.623 0.876 15.265 1.00 54.05 H new ATOM 0 HA GLN A 69 16.391 2.942 15.857 1.00 41.10 H new ATOM 0 HB2 GLN A 69 16.280 -0.024 16.217 1.00 72.41 H new ATOM 0 HB3 GLN A 69 17.852 0.726 16.415 1.00 72.41 H new ATOM 0 HG2 GLN A 69 16.674 2.375 18.021 1.00 3.21 H new ATOM 0 HG3 GLN A 69 15.322 1.261 17.988 1.00 3.21 H new ATOM 0 HE21 GLN A 69 15.397 0.529 20.080 1.00 24.44 H new ATOM 0 HE22 GLN A 69 16.755 -0.385 20.745 1.00 24.44 H new ATOM 1127 N GLN A 70 17.418 0.963 13.421 1.00 13.42 N ATOM 1128 CA GLN A 70 18.370 0.857 12.322 1.00 20.02 C ATOM 1129 C GLN A 70 18.147 1.966 11.300 1.00 44.44 C ATOM 1130 O GLN A 70 19.086 2.417 10.644 1.00 62.33 O ATOM 1131 CB GLN A 70 18.249 -0.509 11.645 1.00 74.12 C ATOM 1132 CG GLN A 70 18.867 -1.643 12.447 1.00 53.01 C ATOM 1133 CD GLN A 70 20.376 -1.694 12.317 1.00 22.24 C ATOM 1134 OE1 GLN A 70 21.099 -1.610 13.311 1.00 43.45 O ATOM 1135 NE2 GLN A 70 20.861 -1.834 11.089 1.00 51.40 N ATOM 0 H GLN A 70 16.726 0.214 13.454 1.00 13.42 H new ATOM 0 HA GLN A 70 19.374 0.963 12.733 1.00 20.02 H new ATOM 0 HB2 GLN A 70 17.195 -0.728 11.474 1.00 74.12 H new ATOM 0 HB3 GLN A 70 18.728 -0.464 10.667 1.00 74.12 H new ATOM 0 HG2 GLN A 70 18.600 -1.527 13.498 1.00 53.01 H new ATOM 0 HG3 GLN A 70 18.445 -2.591 12.113 1.00 53.01 H new ATOM 0 HE21 GLN A 70 20.225 -1.900 10.294 1.00 51.40 H new ATOM 0 HE22 GLN A 70 21.869 -1.876 10.941 1.00 51.40 H new ATOM 1144 N ALA A 71 16.899 2.402 11.169 1.00 14.10 N ATOM 1145 CA ALA A 71 16.553 3.460 10.228 1.00 62.25 C ATOM 1146 C ALA A 71 17.465 4.670 10.403 1.00 75.24 C ATOM 1147 O ALA A 71 17.749 5.390 9.445 1.00 22.31 O ATOM 1148 CB ALA A 71 15.097 3.864 10.400 1.00 55.45 C ATOM 0 H ALA A 71 16.110 2.039 11.703 1.00 14.10 H new ATOM 0 HA ALA A 71 16.694 3.075 9.218 1.00 62.25 H new ATOM 0 HB1 ALA A 71 14.853 4.655 9.691 1.00 55.45 H new ATOM 0 HB2 ALA A 71 14.456 3.002 10.217 1.00 55.45 H new ATOM 0 HB3 ALA A 71 14.937 4.225 11.416 1.00 55.45 H new ATOM 1154 N LYS A 72 17.919 4.889 11.632 1.00 42.34 N ATOM 1155 CA LYS A 72 18.799 6.012 11.933 1.00 2.02 C ATOM 1156 C LYS A 72 20.085 5.930 11.117 1.00 41.23 C ATOM 1157 O LYS A 72 20.608 6.946 10.660 1.00 13.03 O ATOM 1158 CB LYS A 72 19.132 6.039 13.427 1.00 52.02 C ATOM 1159 CG LYS A 72 18.191 6.908 14.244 1.00 45.23 C ATOM 1160 CD LYS A 72 18.887 7.488 15.464 1.00 52.11 C ATOM 1161 CE LYS A 72 19.224 6.407 16.479 1.00 3.14 C ATOM 1162 NZ LYS A 72 20.465 6.727 17.239 1.00 54.22 N ATOM 0 H LYS A 72 17.692 4.304 12.436 1.00 42.34 H new ATOM 0 HA LYS A 72 18.278 6.931 11.666 1.00 2.02 H new ATOM 0 HB2 LYS A 72 19.103 5.021 13.816 1.00 52.02 H new ATOM 0 HB3 LYS A 72 20.152 6.401 13.557 1.00 52.02 H new ATOM 0 HG2 LYS A 72 17.810 7.718 13.622 1.00 45.23 H new ATOM 0 HG3 LYS A 72 17.331 6.317 14.561 1.00 45.23 H new ATOM 0 HD2 LYS A 72 19.800 7.997 15.156 1.00 52.11 H new ATOM 0 HD3 LYS A 72 18.246 8.237 15.928 1.00 52.11 H new ATOM 0 HE2 LYS A 72 18.393 6.290 17.174 1.00 3.14 H new ATOM 0 HE3 LYS A 72 19.348 5.453 15.966 1.00 3.14 H new ATOM 0 HZ1 LYS A 72 20.940 5.844 17.515 1.00 54.22 H new ATOM 0 HZ2 LYS A 72 21.102 7.291 16.641 1.00 54.22 H new ATOM 0 HZ3 LYS A 72 20.220 7.269 18.092 1.00 54.22 H new ATOM 1176 N GLY A 73 20.589 4.713 10.935 1.00 4.34 N ATOM 1177 CA GLY A 73 21.809 4.522 10.173 1.00 61.14 C ATOM 1178 C GLY A 73 21.558 4.481 8.678 1.00 31.43 C ATOM 1179 O GLY A 73 22.457 4.755 7.884 1.00 21.13 O ATOM 0 H GLY A 73 20.174 3.856 11.302 1.00 4.34 H new ATOM 0 HA2 GLY A 73 22.505 5.329 10.399 1.00 61.14 H new ATOM 0 HA3 GLY A 73 22.286 3.593 10.484 1.00 61.14 H new ATOM 1183 N GLN A 74 20.333 4.135 8.295 1.00 10.41 N ATOM 1184 CA GLN A 74 19.968 4.057 6.886 1.00 72.14 C ATOM 1185 C GLN A 74 19.446 5.399 6.383 1.00 60.01 C ATOM 1186 O GLN A 74 18.914 5.496 5.277 1.00 63.33 O ATOM 1187 CB GLN A 74 18.911 2.972 6.671 1.00 53.45 C ATOM 1188 CG GLN A 74 19.491 1.572 6.552 1.00 11.34 C ATOM 1189 CD GLN A 74 20.323 1.181 7.758 1.00 15.52 C ATOM 1190 OE1 GLN A 74 21.452 1.644 7.924 1.00 34.22 O ATOM 1191 NE2 GLN A 74 19.767 0.326 8.608 1.00 25.43 N ATOM 0 H GLN A 74 19.577 3.905 8.940 1.00 10.41 H new ATOM 0 HA GLN A 74 20.863 3.801 6.319 1.00 72.14 H new ATOM 0 HB2 GLN A 74 18.205 2.994 7.501 1.00 53.45 H new ATOM 0 HB3 GLN A 74 18.347 3.200 5.767 1.00 53.45 H new ATOM 0 HG2 GLN A 74 18.679 0.856 6.428 1.00 11.34 H new ATOM 0 HG3 GLN A 74 20.108 1.513 5.655 1.00 11.34 H new ATOM 0 HE21 GLN A 74 18.829 -0.032 8.430 1.00 25.43 H new ATOM 0 HE22 GLN A 74 20.278 0.027 9.439 1.00 25.43 H new ATOM 1200 N LYS A 75 19.601 6.433 7.203 1.00 40.03 N ATOM 1201 CA LYS A 75 19.147 7.771 6.842 1.00 32.21 C ATOM 1202 C LYS A 75 17.654 7.773 6.531 1.00 74.24 C ATOM 1203 O LYS A 75 17.224 8.314 5.511 1.00 34.34 O ATOM 1204 CB LYS A 75 19.931 8.290 5.635 1.00 61.11 C ATOM 1205 CG LYS A 75 21.433 8.094 5.755 1.00 15.32 C ATOM 1206 CD LYS A 75 21.984 8.762 7.004 1.00 55.21 C ATOM 1207 CE LYS A 75 23.469 9.059 6.868 1.00 41.01 C ATOM 1208 NZ LYS A 75 24.258 7.827 6.591 1.00 71.30 N ATOM 0 H LYS A 75 20.038 6.370 8.123 1.00 40.03 H new ATOM 0 HA LYS A 75 19.324 8.429 7.692 1.00 32.21 H new ATOM 0 HB2 LYS A 75 19.577 7.783 4.737 1.00 61.11 H new ATOM 0 HB3 LYS A 75 19.721 9.352 5.505 1.00 61.11 H new ATOM 0 HG2 LYS A 75 21.661 7.028 5.780 1.00 15.32 H new ATOM 0 HG3 LYS A 75 21.926 8.505 4.874 1.00 15.32 H new ATOM 0 HD2 LYS A 75 21.442 9.689 7.191 1.00 55.21 H new ATOM 0 HD3 LYS A 75 21.818 8.116 7.866 1.00 55.21 H new ATOM 0 HE2 LYS A 75 23.623 9.778 6.063 1.00 41.01 H new ATOM 0 HE3 LYS A 75 23.832 9.524 7.785 1.00 41.01 H new ATOM 0 HZ1 LYS A 75 25.273 8.039 6.673 1.00 71.30 H new ATOM 0 HZ2 LYS A 75 24.002 7.089 7.278 1.00 71.30 H new ATOM 0 HZ3 LYS A 75 24.051 7.491 5.629 1.00 71.30 H new ATOM 1222 N ILE A 76 16.869 7.166 7.415 1.00 54.43 N ATOM 1223 CA ILE A 76 15.424 7.101 7.234 1.00 13.24 C ATOM 1224 C ILE A 76 14.698 7.876 8.329 1.00 74.01 C ATOM 1225 O ILE A 76 14.972 7.698 9.516 1.00 64.31 O ATOM 1226 CB ILE A 76 14.922 5.645 7.232 1.00 13.24 C ATOM 1227 CG1 ILE A 76 15.866 4.758 6.418 1.00 54.53 C ATOM 1228 CG2 ILE A 76 13.507 5.573 6.677 1.00 43.44 C ATOM 1229 CD1 ILE A 76 16.042 5.217 4.987 1.00 14.41 C ATOM 0 H ILE A 76 17.209 6.713 8.263 1.00 54.43 H new ATOM 0 HA ILE A 76 15.206 7.553 6.266 1.00 13.24 H new ATOM 0 HB ILE A 76 14.907 5.280 8.259 1.00 13.24 H new ATOM 0 HG12 ILE A 76 16.840 4.734 6.906 1.00 54.53 H new ATOM 0 HG13 ILE A 76 15.484 3.737 6.419 1.00 54.53 H new ATOM 0 HG21 ILE A 76 13.166 4.538 6.682 1.00 43.44 H new ATOM 0 HG22 ILE A 76 12.843 6.177 7.295 1.00 43.44 H new ATOM 0 HG23 ILE A 76 13.497 5.953 5.655 1.00 43.44 H new ATOM 0 HD11 ILE A 76 16.724 4.542 4.470 1.00 14.41 H new ATOM 0 HD12 ILE A 76 15.076 5.214 4.482 1.00 14.41 H new ATOM 0 HD13 ILE A 76 16.453 6.226 4.977 1.00 14.41 H new ATOM 1241 N ILE A 77 13.769 8.735 7.922 1.00 60.43 N ATOM 1242 CA ILE A 77 13.001 9.534 8.868 1.00 2.30 C ATOM 1243 C ILE A 77 11.511 9.229 8.764 1.00 71.41 C ATOM 1244 O ILE A 77 10.773 9.350 9.741 1.00 1.23 O ATOM 1245 CB ILE A 77 13.222 11.041 8.641 1.00 53.55 C ATOM 1246 CG1 ILE A 77 14.718 11.359 8.595 1.00 13.15 C ATOM 1247 CG2 ILE A 77 12.536 11.848 9.733 1.00 20.02 C ATOM 1248 CD1 ILE A 77 15.457 10.968 9.856 1.00 14.32 C ATOM 0 H ILE A 77 13.530 8.895 6.943 1.00 60.43 H new ATOM 0 HA ILE A 77 13.354 9.269 9.864 1.00 2.30 H new ATOM 0 HB ILE A 77 12.782 11.317 7.683 1.00 53.55 H new ATOM 0 HG12 ILE A 77 15.165 10.842 7.746 1.00 13.15 H new ATOM 0 HG13 ILE A 77 14.849 12.427 8.423 1.00 13.15 H new ATOM 0 HG21 ILE A 77 12.702 12.911 9.558 1.00 20.02 H new ATOM 0 HG22 ILE A 77 11.466 11.641 9.721 1.00 20.02 H new ATOM 0 HG23 ILE A 77 12.948 11.571 10.703 1.00 20.02 H new ATOM 0 HD11 ILE A 77 16.512 11.222 9.753 1.00 14.32 H new ATOM 0 HD12 ILE A 77 15.036 11.505 10.706 1.00 14.32 H new ATOM 0 HD13 ILE A 77 15.357 9.895 10.019 1.00 14.32 H new ATOM 1260 N GLN A 78 11.076 8.830 7.573 1.00 60.40 N ATOM 1261 CA GLN A 78 9.673 8.505 7.342 1.00 44.12 C ATOM 1262 C GLN A 78 9.206 7.405 8.289 1.00 61.43 C ATOM 1263 O GLN A 78 8.035 7.352 8.666 1.00 24.11 O ATOM 1264 CB GLN A 78 9.461 8.070 5.891 1.00 62.12 C ATOM 1265 CG GLN A 78 8.115 8.487 5.321 1.00 0.32 C ATOM 1266 CD GLN A 78 8.013 9.984 5.102 1.00 71.24 C ATOM 1267 OE1 GLN A 78 7.103 10.637 5.612 1.00 13.13 O ATOM 1268 NE2 GLN A 78 8.949 10.536 4.339 1.00 61.34 N ATOM 0 H GLN A 78 11.674 8.724 6.754 1.00 60.40 H new ATOM 0 HA GLN A 78 9.082 9.400 7.535 1.00 44.12 H new ATOM 0 HB2 GLN A 78 10.254 8.493 5.274 1.00 62.12 H new ATOM 0 HB3 GLN A 78 9.552 6.986 5.829 1.00 62.12 H new ATOM 0 HG2 GLN A 78 7.951 7.973 4.374 1.00 0.32 H new ATOM 0 HG3 GLN A 78 7.323 8.168 5.999 1.00 0.32 H new ATOM 0 HE21 GLN A 78 9.686 9.957 3.936 1.00 61.34 H new ATOM 0 HE22 GLN A 78 8.931 11.539 4.156 1.00 61.34 H new ATOM 1277 N PHE A 79 10.129 6.527 8.669 1.00 74.22 N ATOM 1278 CA PHE A 79 9.811 5.426 9.571 1.00 73.01 C ATOM 1279 C PHE A 79 9.643 5.927 11.002 1.00 21.14 C ATOM 1280 O PHE A 79 8.696 5.554 11.694 1.00 22.41 O ATOM 1281 CB PHE A 79 10.908 4.361 9.516 1.00 32.14 C ATOM 1282 CG PHE A 79 10.514 3.133 8.746 1.00 51.43 C ATOM 1283 CD1 PHE A 79 9.344 2.455 9.048 1.00 23.03 C ATOM 1284 CD2 PHE A 79 11.313 2.658 7.718 1.00 10.14 C ATOM 1285 CE1 PHE A 79 8.980 1.325 8.341 1.00 20.21 C ATOM 1286 CE2 PHE A 79 10.954 1.529 7.007 1.00 34.43 C ATOM 1287 CZ PHE A 79 9.785 0.862 7.319 1.00 70.34 C ATOM 0 H PHE A 79 11.103 6.557 8.366 1.00 74.22 H new ATOM 0 HA PHE A 79 8.869 4.984 9.247 1.00 73.01 H new ATOM 0 HB2 PHE A 79 11.800 4.793 9.063 1.00 32.14 H new ATOM 0 HB3 PHE A 79 11.174 4.073 10.533 1.00 32.14 H new ATOM 0 HD1 PHE A 79 8.709 2.814 9.845 1.00 23.03 H new ATOM 0 HD2 PHE A 79 12.227 3.177 7.470 1.00 10.14 H new ATOM 0 HE1 PHE A 79 8.067 0.804 8.588 1.00 20.21 H new ATOM 0 HE2 PHE A 79 11.586 1.169 6.209 1.00 34.43 H new ATOM 0 HZ PHE A 79 9.501 -0.020 6.764 1.00 70.34 H new ATOM 1297 N GLN A 80 10.570 6.774 11.439 1.00 71.31 N ATOM 1298 CA GLN A 80 10.526 7.325 12.788 1.00 33.22 C ATOM 1299 C GLN A 80 9.200 8.033 13.044 1.00 55.34 C ATOM 1300 O GLN A 80 8.585 7.861 14.096 1.00 30.43 O ATOM 1301 CB GLN A 80 11.687 8.297 13.003 1.00 53.32 C ATOM 1302 CG GLN A 80 13.055 7.656 12.842 1.00 64.20 C ATOM 1303 CD GLN A 80 14.169 8.501 13.429 1.00 33.34 C ATOM 1304 OE1 GLN A 80 13.992 9.693 13.680 1.00 3.21 O ATOM 1305 NE2 GLN A 80 15.324 7.886 13.653 1.00 62.43 N ATOM 0 H GLN A 80 11.360 7.093 10.878 1.00 71.31 H new ATOM 0 HA GLN A 80 10.618 6.499 13.494 1.00 33.22 H new ATOM 0 HB2 GLN A 80 11.596 9.121 12.295 1.00 53.32 H new ATOM 0 HB3 GLN A 80 11.611 8.725 14.003 1.00 53.32 H new ATOM 0 HG2 GLN A 80 13.053 6.679 13.324 1.00 64.20 H new ATOM 0 HG3 GLN A 80 13.251 7.488 11.783 1.00 64.20 H new ATOM 0 HE21 GLN A 80 15.426 6.896 13.430 1.00 62.43 H new ATOM 0 HE22 GLN A 80 16.109 8.403 14.048 1.00 62.43 H new ATOM 1314 N ASP A 81 8.764 8.831 12.075 1.00 64.15 N ATOM 1315 CA ASP A 81 7.510 9.565 12.194 1.00 3.51 C ATOM 1316 C ASP A 81 6.316 8.623 12.082 1.00 11.22 C ATOM 1317 O ASP A 81 5.386 8.686 12.886 1.00 55.22 O ATOM 1318 CB ASP A 81 7.424 10.648 11.117 1.00 1.23 C ATOM 1319 CG ASP A 81 6.550 11.814 11.537 1.00 24.10 C ATOM 1320 OD1 ASP A 81 6.908 12.501 12.517 1.00 34.22 O ATOM 1321 OD2 ASP A 81 5.510 12.040 10.885 1.00 71.11 O ATOM 0 H ASP A 81 9.261 8.986 11.198 1.00 64.15 H new ATOM 0 HA ASP A 81 7.486 10.037 13.176 1.00 3.51 H new ATOM 0 HB2 ASP A 81 8.426 11.012 10.891 1.00 1.23 H new ATOM 0 HB3 ASP A 81 7.028 10.213 10.199 1.00 1.23 H new ATOM 1326 N SER A 82 6.348 7.751 11.080 1.00 65.12 N ATOM 1327 CA SER A 82 5.266 6.799 10.860 1.00 63.44 C ATOM 1328 C SER A 82 5.033 5.944 12.102 1.00 44.21 C ATOM 1329 O SER A 82 3.922 5.883 12.628 1.00 71.10 O ATOM 1330 CB SER A 82 5.584 5.901 9.662 1.00 51.42 C ATOM 1331 OG SER A 82 5.125 6.482 8.454 1.00 53.34 O ATOM 0 H SER A 82 7.112 7.684 10.407 1.00 65.12 H new ATOM 0 HA SER A 82 4.357 7.363 10.652 1.00 63.44 H new ATOM 0 HB2 SER A 82 6.660 5.735 9.604 1.00 51.42 H new ATOM 0 HB3 SER A 82 5.118 4.926 9.800 1.00 51.42 H new ATOM 0 HG SER A 82 5.729 7.207 8.189 1.00 53.34 H new ATOM 1337 N PHE A 83 6.090 5.286 12.566 1.00 63.41 N ATOM 1338 CA PHE A 83 6.002 4.433 13.746 1.00 43.12 C ATOM 1339 C PHE A 83 5.883 5.272 15.015 1.00 61.20 C ATOM 1340 O PHE A 83 5.401 4.797 16.043 1.00 42.33 O ATOM 1341 CB PHE A 83 7.229 3.523 13.836 1.00 72.21 C ATOM 1342 CG PHE A 83 7.080 2.239 13.070 1.00 44.54 C ATOM 1343 CD1 PHE A 83 5.973 1.428 13.259 1.00 42.31 C ATOM 1344 CD2 PHE A 83 8.048 1.845 12.160 1.00 72.33 C ATOM 1345 CE1 PHE A 83 5.835 0.247 12.556 1.00 73.44 C ATOM 1346 CE2 PHE A 83 7.915 0.664 11.453 1.00 15.21 C ATOM 1347 CZ PHE A 83 6.806 -0.135 11.651 1.00 71.33 C ATOM 0 H PHE A 83 7.017 5.327 12.143 1.00 63.41 H new ATOM 0 HA PHE A 83 5.108 3.817 13.653 1.00 43.12 H new ATOM 0 HB2 PHE A 83 8.099 4.062 13.461 1.00 72.21 H new ATOM 0 HB3 PHE A 83 7.424 3.292 14.883 1.00 72.21 H new ATOM 0 HD1 PHE A 83 5.209 1.722 13.964 1.00 42.31 H new ATOM 0 HD2 PHE A 83 8.916 2.467 12.001 1.00 72.33 H new ATOM 0 HE1 PHE A 83 4.968 -0.378 12.714 1.00 73.44 H new ATOM 0 HE2 PHE A 83 8.677 0.367 10.747 1.00 15.21 H new ATOM 0 HZ PHE A 83 6.698 -1.057 11.099 1.00 71.33 H new ATOM 1357 N GLY A 84 6.327 6.523 14.935 1.00 71.43 N ATOM 1358 CA GLY A 84 6.262 7.408 16.083 1.00 63.21 C ATOM 1359 C GLY A 84 4.863 7.935 16.330 1.00 11.41 C ATOM 1360 O GLY A 84 4.487 8.210 17.470 1.00 52.11 O ATOM 0 H GLY A 84 6.730 6.939 14.096 1.00 71.43 H new ATOM 0 HA2 GLY A 84 6.608 6.875 16.969 1.00 63.21 H new ATOM 0 HA3 GLY A 84 6.941 8.247 15.930 1.00 63.21 H new ATOM 1364 N LYS A 85 4.089 8.079 15.260 1.00 50.42 N ATOM 1365 CA LYS A 85 2.723 8.578 15.364 1.00 12.23 C ATOM 1366 C LYS A 85 1.763 7.459 15.755 1.00 23.32 C ATOM 1367 O LYS A 85 0.590 7.703 16.036 1.00 11.00 O ATOM 1368 CB LYS A 85 2.283 9.202 14.038 1.00 73.52 C ATOM 1369 CG LYS A 85 2.220 8.208 12.890 1.00 10.43 C ATOM 1370 CD LYS A 85 1.263 8.671 11.805 1.00 74.45 C ATOM 1371 CE LYS A 85 1.702 9.995 11.201 1.00 45.44 C ATOM 1372 NZ LYS A 85 0.741 10.483 10.173 1.00 63.21 N ATOM 0 H LYS A 85 4.385 7.857 14.309 1.00 50.42 H new ATOM 0 HA LYS A 85 2.700 9.341 16.142 1.00 12.23 H new ATOM 0 HB2 LYS A 85 1.301 9.657 14.168 1.00 73.52 H new ATOM 0 HB3 LYS A 85 2.974 10.004 13.776 1.00 73.52 H new ATOM 0 HG2 LYS A 85 3.216 8.076 12.466 1.00 10.43 H new ATOM 0 HG3 LYS A 85 1.902 7.236 13.266 1.00 10.43 H new ATOM 0 HD2 LYS A 85 1.205 7.914 11.022 1.00 74.45 H new ATOM 0 HD3 LYS A 85 0.261 8.775 12.222 1.00 74.45 H new ATOM 0 HE2 LYS A 85 1.798 10.740 11.991 1.00 45.44 H new ATOM 0 HE3 LYS A 85 2.688 9.879 10.750 1.00 45.44 H new ATOM 0 HZ1 LYS A 85 1.077 11.388 9.786 1.00 63.21 H new ATOM 0 HZ2 LYS A 85 0.668 9.784 9.406 1.00 63.21 H new ATOM 0 HZ3 LYS A 85 -0.194 10.618 10.608 1.00 63.21 H new ATOM 1386 N VAL A 86 2.270 6.230 15.773 1.00 63.02 N ATOM 1387 CA VAL A 86 1.459 5.073 16.132 1.00 11.20 C ATOM 1388 C VAL A 86 2.046 4.342 17.334 1.00 13.34 C ATOM 1389 O VAL A 86 1.429 3.427 17.879 1.00 11.20 O ATOM 1390 CB VAL A 86 1.336 4.087 14.955 1.00 33.25 C ATOM 1391 CG1 VAL A 86 0.776 4.788 13.727 1.00 35.32 C ATOM 1392 CG2 VAL A 86 2.684 3.453 14.649 1.00 20.41 C ATOM 0 H VAL A 86 3.239 6.010 15.543 1.00 63.02 H new ATOM 0 HA VAL A 86 0.468 5.448 16.387 1.00 11.20 H new ATOM 0 HB VAL A 86 0.643 3.295 15.238 1.00 33.25 H new ATOM 0 HG11 VAL A 86 0.696 4.075 12.906 1.00 35.32 H new ATOM 0 HG12 VAL A 86 -0.211 5.190 13.956 1.00 35.32 H new ATOM 0 HG13 VAL A 86 1.441 5.602 13.438 1.00 35.32 H new ATOM 0 HG21 VAL A 86 2.579 2.759 13.815 1.00 20.41 H new ATOM 0 HG22 VAL A 86 3.401 4.231 14.386 1.00 20.41 H new ATOM 0 HG23 VAL A 86 3.040 2.914 15.527 1.00 20.41 H new ATOM 1402 N ALA A 87 3.241 4.753 17.744 1.00 44.12 N ATOM 1403 CA ALA A 87 3.911 4.139 18.884 1.00 41.33 C ATOM 1404 C ALA A 87 3.227 4.519 20.192 1.00 13.24 C ATOM 1405 O ALA A 87 2.794 3.653 20.952 1.00 73.04 O ATOM 1406 CB ALA A 87 5.377 4.545 18.916 1.00 63.45 C ATOM 0 H ALA A 87 3.765 5.509 17.304 1.00 44.12 H new ATOM 0 HA ALA A 87 3.847 3.057 18.772 1.00 41.33 H new ATOM 0 HB1 ALA A 87 5.865 4.079 19.772 1.00 63.45 H new ATOM 0 HB2 ALA A 87 5.865 4.218 17.998 1.00 63.45 H new ATOM 0 HB3 ALA A 87 5.453 5.629 19.001 1.00 63.45 H new ATOM 1412 N ALA A 88 3.133 5.820 20.450 1.00 23.31 N ATOM 1413 CA ALA A 88 2.500 6.314 21.667 1.00 63.25 C ATOM 1414 C ALA A 88 1.093 5.747 21.822 1.00 2.24 C ATOM 1415 O ALA A 88 0.611 5.560 22.939 1.00 75.44 O ATOM 1416 CB ALA A 88 2.461 7.835 21.661 1.00 62.23 C ATOM 0 H ALA A 88 3.487 6.550 19.832 1.00 23.31 H new ATOM 0 HA ALA A 88 3.094 5.980 22.518 1.00 63.25 H new ATOM 0 HB1 ALA A 88 1.986 8.190 22.575 1.00 62.23 H new ATOM 0 HB2 ALA A 88 3.477 8.225 21.605 1.00 62.23 H new ATOM 0 HB3 ALA A 88 1.892 8.181 20.798 1.00 62.23 H new ATOM 1422 N GLU A 89 0.441 5.477 20.696 1.00 14.41 N ATOM 1423 CA GLU A 89 -0.912 4.934 20.709 1.00 33.54 C ATOM 1424 C GLU A 89 -0.898 3.448 21.058 1.00 60.14 C ATOM 1425 O GLU A 89 -1.555 3.014 22.004 1.00 3.33 O ATOM 1426 CB GLU A 89 -1.584 5.144 19.351 1.00 64.34 C ATOM 1427 CG GLU A 89 -3.100 5.198 19.423 1.00 14.41 C ATOM 1428 CD GLU A 89 -3.601 6.266 20.377 1.00 23.41 C ATOM 1429 OE1 GLU A 89 -2.877 7.261 20.587 1.00 40.32 O ATOM 1430 OE2 GLU A 89 -4.717 6.105 20.914 1.00 61.52 O ATOM 0 H GLU A 89 0.827 5.625 19.764 1.00 14.41 H new ATOM 0 HA GLU A 89 -1.481 5.464 21.473 1.00 33.54 H new ATOM 0 HB2 GLU A 89 -1.216 6.072 18.913 1.00 64.34 H new ATOM 0 HB3 GLU A 89 -1.289 4.337 18.681 1.00 64.34 H new ATOM 0 HG2 GLU A 89 -3.501 5.388 18.427 1.00 14.41 H new ATOM 0 HG3 GLU A 89 -3.480 4.226 19.739 1.00 14.41 H new ATOM 1437 N VAL A 90 -0.145 2.672 20.285 1.00 44.14 N ATOM 1438 CA VAL A 90 -0.044 1.235 20.510 1.00 5.25 C ATOM 1439 C VAL A 90 0.528 0.935 21.892 1.00 73.13 C ATOM 1440 O VAL A 90 -0.097 0.242 22.697 1.00 45.33 O ATOM 1441 CB VAL A 90 0.839 0.560 19.444 1.00 3.21 C ATOM 1442 CG1 VAL A 90 0.987 -0.925 19.735 1.00 30.53 C ATOM 1443 CG2 VAL A 90 0.262 0.785 18.055 1.00 73.32 C ATOM 0 H VAL A 90 0.404 3.015 19.497 1.00 44.14 H new ATOM 0 HA VAL A 90 -1.054 0.832 20.442 1.00 5.25 H new ATOM 0 HB VAL A 90 1.830 1.012 19.478 1.00 3.21 H new ATOM 0 HG11 VAL A 90 1.614 -1.385 18.971 1.00 30.53 H new ATOM 0 HG12 VAL A 90 1.449 -1.060 20.713 1.00 30.53 H new ATOM 0 HG13 VAL A 90 0.004 -1.397 19.730 1.00 30.53 H new ATOM 0 HG21 VAL A 90 0.898 0.301 17.314 1.00 73.32 H new ATOM 0 HG22 VAL A 90 -0.741 0.361 18.004 1.00 73.32 H new ATOM 0 HG23 VAL A 90 0.214 1.854 17.850 1.00 73.32 H new ATOM 1453 N LEU A 91 1.718 1.460 22.161 1.00 53.53 N ATOM 1454 CA LEU A 91 2.374 1.250 23.446 1.00 24.41 C ATOM 1455 C LEU A 91 1.432 1.577 24.600 1.00 55.15 C ATOM 1456 O LEU A 91 1.470 0.934 25.648 1.00 54.04 O ATOM 1457 CB LEU A 91 3.636 2.109 23.544 1.00 51.33 C ATOM 1458 CG LEU A 91 4.896 1.527 22.903 1.00 41.13 C ATOM 1459 CD1 LEU A 91 4.812 1.613 21.387 1.00 62.33 C ATOM 1460 CD2 LEU A 91 6.135 2.249 23.412 1.00 64.33 C ATOM 0 H LEU A 91 2.248 2.034 21.506 1.00 53.53 H new ATOM 0 HA LEU A 91 2.651 0.198 23.515 1.00 24.41 H new ATOM 0 HB2 LEU A 91 3.431 3.075 23.082 1.00 51.33 H new ATOM 0 HB3 LEU A 91 3.842 2.297 24.598 1.00 51.33 H new ATOM 0 HG LEU A 91 4.971 0.476 23.183 1.00 41.13 H new ATOM 0 HD11 LEU A 91 5.718 1.194 20.948 1.00 62.33 H new ATOM 0 HD12 LEU A 91 3.946 1.051 21.038 1.00 62.33 H new ATOM 0 HD13 LEU A 91 4.712 2.656 21.087 1.00 62.33 H new ATOM 0 HD21 LEU A 91 7.023 1.822 22.945 1.00 64.33 H new ATOM 0 HD22 LEU A 91 6.068 3.308 23.162 1.00 64.33 H new ATOM 0 HD23 LEU A 91 6.204 2.135 24.494 1.00 64.33 H new ATOM 1472 N GLY A 92 0.584 2.581 24.397 1.00 13.34 N ATOM 1473 CA GLY A 92 -0.359 2.975 25.428 1.00 2.33 C ATOM 1474 C GLY A 92 -1.467 1.959 25.620 1.00 61.22 C ATOM 1475 O GLY A 92 -1.937 1.746 26.738 1.00 44.13 O ATOM 0 H GLY A 92 0.533 3.128 23.538 1.00 13.34 H new ATOM 0 HA2 GLY A 92 0.173 3.110 26.370 1.00 2.33 H new ATOM 0 HA3 GLY A 92 -0.796 3.939 25.167 1.00 2.33 H new ATOM 1479 N ARG A 93 -1.887 1.331 24.527 1.00 61.44 N ATOM 1480 CA ARG A 93 -2.949 0.333 24.579 1.00 10.31 C ATOM 1481 C ARG A 93 -2.407 -1.014 25.048 1.00 51.12 C ATOM 1482 O ARG A 93 -2.903 -1.591 26.016 1.00 13.30 O ATOM 1483 CB ARG A 93 -3.604 0.181 23.205 1.00 44.52 C ATOM 1484 CG ARG A 93 -4.763 1.137 22.973 1.00 22.14 C ATOM 1485 CD ARG A 93 -6.054 0.601 23.571 1.00 33.10 C ATOM 1486 NE ARG A 93 -7.109 1.611 23.589 1.00 33.45 N ATOM 1487 CZ ARG A 93 -8.344 1.376 24.021 1.00 44.03 C ATOM 1488 NH1 ARG A 93 -8.676 0.173 24.467 1.00 21.31 N ATOM 1489 NH2 ARG A 93 -9.248 2.347 24.006 1.00 34.53 N ATOM 0 H ARG A 93 -1.508 1.495 23.594 1.00 61.44 H new ATOM 0 HA ARG A 93 -3.698 0.673 25.295 1.00 10.31 H new ATOM 0 HB2 ARG A 93 -2.851 0.342 22.433 1.00 44.52 H new ATOM 0 HB3 ARG A 93 -3.961 -0.843 23.093 1.00 44.52 H new ATOM 0 HG2 ARG A 93 -4.531 2.106 23.415 1.00 22.14 H new ATOM 0 HG3 ARG A 93 -4.895 1.298 21.903 1.00 22.14 H new ATOM 0 HD2 ARG A 93 -6.389 -0.263 22.996 1.00 33.10 H new ATOM 0 HD3 ARG A 93 -5.866 0.254 24.587 1.00 33.10 H new ATOM 0 HE ARG A 93 -6.886 2.547 23.252 1.00 33.45 H new ATOM 0 HH11 ARG A 93 -7.983 -0.575 24.479 1.00 21.31 H new ATOM 0 HH12 ARG A 93 -9.624 -0.004 24.798 1.00 21.31 H new ATOM 0 HH21 ARG A 93 -8.995 3.274 23.663 1.00 34.53 H new ATOM 0 HH22 ARG A 93 -10.196 2.167 24.337 1.00 34.53 H new ATOM 1503 N ILE A 94 -1.387 -1.509 24.355 1.00 75.24 N ATOM 1504 CA ILE A 94 -0.778 -2.788 24.700 1.00 15.53 C ATOM 1505 C ILE A 94 -0.317 -2.801 26.154 1.00 60.43 C ATOM 1506 O ILE A 94 -0.238 -3.857 26.780 1.00 31.13 O ATOM 1507 CB ILE A 94 0.422 -3.104 23.789 1.00 2.12 C ATOM 1508 CG1 ILE A 94 1.580 -2.149 24.085 1.00 44.20 C ATOM 1509 CG2 ILE A 94 0.015 -3.014 22.326 1.00 31.11 C ATOM 1510 CD1 ILE A 94 2.789 -2.373 23.203 1.00 54.32 C ATOM 0 H ILE A 94 -0.965 -1.044 23.551 1.00 75.24 H new ATOM 0 HA ILE A 94 -1.542 -3.552 24.556 1.00 15.53 H new ATOM 0 HB ILE A 94 0.754 -4.122 23.991 1.00 2.12 H new ATOM 0 HG12 ILE A 94 1.235 -1.123 23.960 1.00 44.20 H new ATOM 0 HG13 ILE A 94 1.876 -2.262 25.128 1.00 44.20 H new ATOM 0 HG21 ILE A 94 0.874 -3.240 21.695 1.00 31.11 H new ATOM 0 HG22 ILE A 94 -0.781 -3.731 22.125 1.00 31.11 H new ATOM 0 HG23 ILE A 94 -0.340 -2.007 22.108 1.00 31.11 H new ATOM 0 HD11 ILE A 94 3.570 -1.661 23.469 1.00 54.32 H new ATOM 0 HD12 ILE A 94 3.160 -3.388 23.345 1.00 54.32 H new ATOM 0 HD13 ILE A 94 2.509 -2.232 22.159 1.00 54.32 H new ATOM 1522 N ASN A 95 -0.015 -1.621 26.684 1.00 2.21 N ATOM 1523 CA ASN A 95 0.438 -1.497 28.065 1.00 52.40 C ATOM 1524 C ASN A 95 -0.706 -1.764 29.038 1.00 12.35 C ATOM 1525 O ASN A 95 -0.490 -2.258 30.145 1.00 44.44 O ATOM 1526 CB ASN A 95 1.016 -0.102 28.311 1.00 42.45 C ATOM 1527 CG ASN A 95 1.368 0.130 29.767 1.00 12.34 C ATOM 1528 OD1 ASN A 95 2.425 -0.290 30.237 1.00 63.32 O ATOM 1529 ND2 ASN A 95 0.480 0.803 30.490 1.00 33.54 N ATOM 0 H ASN A 95 -0.076 -0.737 26.179 1.00 2.21 H new ATOM 0 HA ASN A 95 1.217 -2.241 28.234 1.00 52.40 H new ATOM 0 HB2 ASN A 95 1.908 0.032 27.699 1.00 42.45 H new ATOM 0 HB3 ASN A 95 0.294 0.649 27.991 1.00 42.45 H new ATOM 0 HD21 ASN A 95 0.662 0.990 31.476 1.00 33.54 H new ATOM 0 HD22 ASN A 95 -0.384 1.133 30.059 1.00 33.54 H new ATOM 1536 N GLN A 96 -1.923 -1.434 28.618 1.00 50.13 N ATOM 1537 CA GLN A 96 -3.101 -1.638 29.453 1.00 61.23 C ATOM 1538 C GLN A 96 -3.569 -3.088 29.389 1.00 64.53 C ATOM 1539 O GLN A 96 -4.248 -3.571 30.294 1.00 62.31 O ATOM 1540 CB GLN A 96 -4.231 -0.706 29.014 1.00 51.42 C ATOM 1541 CG GLN A 96 -3.988 0.753 29.367 1.00 34.25 C ATOM 1542 CD GLN A 96 -5.249 1.591 29.286 1.00 70.22 C ATOM 1543 OE1 GLN A 96 -6.096 1.547 30.178 1.00 12.13 O ATOM 1544 NE2 GLN A 96 -5.380 2.361 28.212 1.00 60.42 N ATOM 0 H GLN A 96 -2.119 -1.024 27.705 1.00 50.13 H new ATOM 0 HA GLN A 96 -2.829 -1.408 30.483 1.00 61.23 H new ATOM 0 HB2 GLN A 96 -4.364 -0.793 27.936 1.00 51.42 H new ATOM 0 HB3 GLN A 96 -5.162 -1.033 29.478 1.00 51.42 H new ATOM 0 HG2 GLN A 96 -3.579 0.816 30.375 1.00 34.25 H new ATOM 0 HG3 GLN A 96 -3.238 1.166 28.693 1.00 34.25 H new ATOM 0 HE21 GLN A 96 -4.653 2.367 27.497 1.00 60.42 H new ATOM 0 HE22 GLN A 96 -6.208 2.947 28.102 1.00 60.42 H new ATOM 1553 N GLU A 97 -3.200 -3.777 28.313 1.00 74.03 N ATOM 1554 CA GLU A 97 -3.584 -5.172 28.131 1.00 31.02 C ATOM 1555 C GLU A 97 -2.482 -6.107 28.620 1.00 60.52 C ATOM 1556 O GLU A 97 -2.745 -7.246 29.007 1.00 31.20 O ATOM 1557 CB GLU A 97 -3.890 -5.452 26.658 1.00 34.35 C ATOM 1558 CG GLU A 97 -5.076 -4.668 26.123 1.00 13.53 C ATOM 1559 CD GLU A 97 -6.405 -5.313 26.466 1.00 52.42 C ATOM 1560 OE1 GLU A 97 -6.647 -5.575 27.662 1.00 13.24 O ATOM 1561 OE2 GLU A 97 -7.203 -5.555 25.536 1.00 14.12 O ATOM 0 H GLU A 97 -2.636 -3.392 27.555 1.00 74.03 H new ATOM 0 HA GLU A 97 -4.481 -5.356 28.722 1.00 31.02 H new ATOM 0 HB2 GLU A 97 -3.009 -5.215 26.061 1.00 34.35 H new ATOM 0 HB3 GLU A 97 -4.083 -6.517 26.532 1.00 34.35 H new ATOM 0 HG2 GLU A 97 -5.052 -3.657 26.530 1.00 13.53 H new ATOM 0 HG3 GLU A 97 -4.989 -4.578 25.040 1.00 13.53 H new ATOM 1568 N PHE A 98 -1.246 -5.619 28.598 1.00 14.41 N ATOM 1569 CA PHE A 98 -0.103 -6.410 29.037 1.00 72.40 C ATOM 1570 C PHE A 98 -0.117 -6.592 30.552 1.00 4.40 C ATOM 1571 O PHE A 98 -0.511 -5.702 31.306 1.00 54.44 O ATOM 1572 CB PHE A 98 1.203 -5.742 28.604 1.00 64.35 C ATOM 1573 CG PHE A 98 1.656 -6.146 27.230 1.00 62.54 C ATOM 1574 CD1 PHE A 98 0.735 -6.515 26.263 1.00 72.33 C ATOM 1575 CD2 PHE A 98 3.003 -6.157 26.905 1.00 40.02 C ATOM 1576 CE1 PHE A 98 1.149 -6.888 24.998 1.00 30.41 C ATOM 1577 CE2 PHE A 98 3.423 -6.529 25.642 1.00 42.35 C ATOM 1578 CZ PHE A 98 2.495 -6.894 24.687 1.00 54.13 C ATOM 0 H PHE A 98 -1.011 -4.679 28.280 1.00 14.41 H new ATOM 0 HA PHE A 98 -0.172 -7.393 28.570 1.00 72.40 H new ATOM 0 HB2 PHE A 98 1.075 -4.660 28.632 1.00 64.35 H new ATOM 0 HB3 PHE A 98 1.984 -5.989 29.323 1.00 64.35 H new ATOM 0 HD1 PHE A 98 -0.319 -6.511 26.500 1.00 72.33 H new ATOM 0 HD2 PHE A 98 3.733 -5.871 27.648 1.00 40.02 H new ATOM 0 HE1 PHE A 98 0.421 -7.174 24.254 1.00 30.41 H new ATOM 0 HE2 PHE A 98 4.476 -6.534 25.402 1.00 42.35 H new ATOM 0 HZ PHE A 98 2.821 -7.184 23.699 1.00 54.13 H new ATOM 1588 N PRO A 99 0.325 -7.773 31.010 1.00 14.51 N ATOM 1589 CA PRO A 99 0.374 -8.099 32.438 1.00 35.42 C ATOM 1590 C PRO A 99 1.442 -7.302 33.179 1.00 34.21 C ATOM 1591 O PRO A 99 2.232 -6.586 32.565 1.00 65.00 O ATOM 1592 CB PRO A 99 0.716 -9.591 32.449 1.00 21.31 C ATOM 1593 CG PRO A 99 1.427 -9.826 31.161 1.00 21.12 C ATOM 1594 CD PRO A 99 0.810 -8.879 30.169 1.00 21.50 C ATOM 0 HA PRO A 99 -0.561 -7.858 32.943 1.00 35.42 H new ATOM 0 HB2 PRO A 99 1.346 -9.847 33.301 1.00 21.31 H new ATOM 0 HB3 PRO A 99 -0.183 -10.203 32.522 1.00 21.31 H new ATOM 0 HG2 PRO A 99 2.496 -9.640 31.266 1.00 21.12 H new ATOM 0 HG3 PRO A 99 1.314 -10.860 30.836 1.00 21.12 H new ATOM 0 HD2 PRO A 99 1.538 -8.536 29.434 1.00 21.50 H new ATOM 0 HD3 PRO A 99 -0.003 -9.350 29.616 1.00 21.50 H new ATOM 1602 N ARG A 100 1.459 -7.432 34.502 1.00 40.33 N ATOM 1603 CA ARG A 100 2.430 -6.722 35.326 1.00 60.40 C ATOM 1604 C ARG A 100 3.851 -7.180 35.008 1.00 35.33 C ATOM 1605 O ARG A 100 4.816 -6.457 35.253 1.00 0.15 O ATOM 1606 CB ARG A 100 2.131 -6.945 36.810 1.00 72.04 C ATOM 1607 CG ARG A 100 0.731 -6.518 37.219 1.00 33.13 C ATOM 1608 CD ARG A 100 0.693 -6.047 38.665 1.00 54.45 C ATOM 1609 NE ARG A 100 1.277 -4.717 38.822 1.00 34.42 N ATOM 1610 CZ ARG A 100 1.028 -3.924 39.858 1.00 50.41 C ATOM 1611 NH1 ARG A 100 0.211 -4.323 40.823 1.00 71.34 N ATOM 1612 NH2 ARG A 100 1.598 -2.727 39.930 1.00 34.44 N ATOM 0 H ARG A 100 0.812 -8.022 35.025 1.00 40.33 H new ATOM 0 HA ARG A 100 2.351 -5.658 35.102 1.00 60.40 H new ATOM 0 HB2 ARG A 100 2.263 -8.001 37.044 1.00 72.04 H new ATOM 0 HB3 ARG A 100 2.859 -6.394 37.406 1.00 72.04 H new ATOM 0 HG2 ARG A 100 0.388 -5.716 36.565 1.00 33.13 H new ATOM 0 HG3 ARG A 100 0.042 -7.353 37.089 1.00 33.13 H new ATOM 0 HD2 ARG A 100 -0.339 -6.034 39.015 1.00 54.45 H new ATOM 0 HD3 ARG A 100 1.233 -6.757 39.292 1.00 54.45 H new ATOM 0 HE ARG A 100 1.910 -4.379 38.097 1.00 34.42 H new ATOM 0 HH11 ARG A 100 -0.229 -5.242 40.771 1.00 71.34 H new ATOM 0 HH12 ARG A 100 0.022 -3.711 41.617 1.00 71.34 H new ATOM 0 HH21 ARG A 100 2.227 -2.416 39.190 1.00 34.44 H new ATOM 0 HH22 ARG A 100 1.407 -2.118 40.726 1.00 34.44 H new ATOM 1626 N ASP A 101 3.970 -8.385 34.462 1.00 33.44 N ATOM 1627 CA ASP A 101 5.272 -8.940 34.111 1.00 72.05 C ATOM 1628 C ASP A 101 5.813 -8.293 32.839 1.00 13.35 C ATOM 1629 O ASP A 101 6.962 -7.851 32.795 1.00 32.34 O ATOM 1630 CB ASP A 101 5.171 -10.455 33.923 1.00 0.43 C ATOM 1631 CG ASP A 101 5.311 -11.210 35.230 1.00 33.22 C ATOM 1632 OD1 ASP A 101 4.660 -10.811 36.218 1.00 32.21 O ATOM 1633 OD2 ASP A 101 6.072 -12.200 35.265 1.00 12.04 O ATOM 0 H ASP A 101 3.181 -8.996 34.253 1.00 33.44 H new ATOM 0 HA ASP A 101 5.962 -8.728 34.928 1.00 72.05 H new ATOM 0 HB2 ASP A 101 4.212 -10.699 33.467 1.00 0.43 H new ATOM 0 HB3 ASP A 101 5.946 -10.785 33.231 1.00 0.43 H new ATOM 1638 N LEU A 102 4.978 -8.240 31.807 1.00 22.33 N ATOM 1639 CA LEU A 102 5.373 -7.648 30.534 1.00 55.21 C ATOM 1640 C LEU A 102 5.531 -6.136 30.663 1.00 62.25 C ATOM 1641 O LEU A 102 6.294 -5.515 29.921 1.00 34.54 O ATOM 1642 CB LEU A 102 4.338 -7.974 29.455 1.00 0.52 C ATOM 1643 CG LEU A 102 4.233 -9.444 29.048 1.00 43.43 C ATOM 1644 CD1 LEU A 102 3.274 -9.607 27.879 1.00 15.43 C ATOM 1645 CD2 LEU A 102 5.606 -9.998 28.694 1.00 34.25 C ATOM 0 H LEU A 102 4.024 -8.600 31.827 1.00 22.33 H new ATOM 0 HA LEU A 102 6.335 -8.072 30.246 1.00 55.21 H new ATOM 0 HB2 LEU A 102 3.360 -7.644 29.806 1.00 0.52 H new ATOM 0 HB3 LEU A 102 4.572 -7.388 28.566 1.00 0.52 H new ATOM 0 HG LEU A 102 3.842 -10.009 29.894 1.00 43.43 H new ATOM 0 HD11 LEU A 102 3.212 -10.660 27.603 1.00 15.43 H new ATOM 0 HD12 LEU A 102 2.286 -9.248 28.166 1.00 15.43 H new ATOM 0 HD13 LEU A 102 3.636 -9.030 27.028 1.00 15.43 H new ATOM 0 HD21 LEU A 102 5.513 -11.045 28.407 1.00 34.25 H new ATOM 0 HD22 LEU A 102 6.025 -9.430 27.863 1.00 34.25 H new ATOM 0 HD23 LEU A 102 6.265 -9.916 29.558 1.00 34.25 H new ATOM 1657 N LYS A 103 4.808 -5.549 31.610 1.00 74.22 N ATOM 1658 CA LYS A 103 4.870 -4.111 31.839 1.00 14.45 C ATOM 1659 C LYS A 103 6.314 -3.645 31.990 1.00 24.55 C ATOM 1660 O LYS A 103 6.715 -2.632 31.416 1.00 32.55 O ATOM 1661 CB LYS A 103 4.069 -3.738 33.090 1.00 64.14 C ATOM 1662 CG LYS A 103 2.567 -3.724 32.868 1.00 32.02 C ATOM 1663 CD LYS A 103 2.030 -2.306 32.778 1.00 14.54 C ATOM 1664 CE LYS A 103 1.801 -1.708 34.158 1.00 2.32 C ATOM 1665 NZ LYS A 103 2.976 -0.920 34.623 1.00 43.43 N ATOM 0 H LYS A 103 4.172 -6.048 32.232 1.00 74.22 H new ATOM 0 HA LYS A 103 4.435 -3.612 30.973 1.00 14.45 H new ATOM 0 HB2 LYS A 103 4.304 -4.445 33.886 1.00 64.14 H new ATOM 0 HB3 LYS A 103 4.386 -2.754 33.434 1.00 64.14 H new ATOM 0 HG2 LYS A 103 2.329 -4.263 31.951 1.00 32.02 H new ATOM 0 HG3 LYS A 103 2.073 -4.250 33.685 1.00 32.02 H new ATOM 0 HD2 LYS A 103 2.733 -1.684 32.223 1.00 14.54 H new ATOM 0 HD3 LYS A 103 1.094 -2.305 32.220 1.00 14.54 H new ATOM 0 HE2 LYS A 103 0.920 -1.067 34.134 1.00 2.32 H new ATOM 0 HE3 LYS A 103 1.595 -2.507 34.870 1.00 2.32 H new ATOM 0 HZ1 LYS A 103 2.663 -0.197 35.302 1.00 43.43 H new ATOM 0 HZ2 LYS A 103 3.659 -1.554 35.084 1.00 43.43 H new ATOM 0 HZ3 LYS A 103 3.428 -0.457 33.809 1.00 43.43 H new ATOM 1679 N LYS A 104 7.094 -4.392 32.765 1.00 33.42 N ATOM 1680 CA LYS A 104 8.495 -4.059 32.990 1.00 42.11 C ATOM 1681 C LYS A 104 9.286 -4.127 31.687 1.00 2.15 C ATOM 1682 O LYS A 104 10.030 -3.205 31.352 1.00 63.21 O ATOM 1683 CB LYS A 104 9.108 -5.009 34.021 1.00 31.22 C ATOM 1684 CG LYS A 104 8.622 -4.763 35.439 1.00 2.12 C ATOM 1685 CD LYS A 104 8.702 -6.024 36.283 1.00 73.22 C ATOM 1686 CE LYS A 104 8.458 -5.727 37.754 1.00 13.24 C ATOM 1687 NZ LYS A 104 7.017 -5.844 38.112 1.00 10.44 N ATOM 0 H LYS A 104 6.778 -5.233 33.248 1.00 33.42 H new ATOM 0 HA LYS A 104 8.543 -3.039 33.372 1.00 42.11 H new ATOM 0 HB2 LYS A 104 8.876 -6.036 33.739 1.00 31.22 H new ATOM 0 HB3 LYS A 104 10.193 -4.909 33.995 1.00 31.22 H new ATOM 0 HG2 LYS A 104 9.222 -3.978 35.899 1.00 2.12 H new ATOM 0 HG3 LYS A 104 7.593 -4.405 35.415 1.00 2.12 H new ATOM 0 HD2 LYS A 104 7.966 -6.747 35.930 1.00 73.22 H new ATOM 0 HD3 LYS A 104 9.683 -6.483 36.161 1.00 73.22 H new ATOM 0 HE2 LYS A 104 9.041 -6.416 38.365 1.00 13.24 H new ATOM 0 HE3 LYS A 104 8.809 -4.721 37.984 1.00 13.24 H new ATOM 0 HZ1 LYS A 104 6.892 -5.634 39.123 1.00 10.44 H new ATOM 0 HZ2 LYS A 104 6.463 -5.169 37.547 1.00 10.44 H new ATOM 0 HZ3 LYS A 104 6.688 -6.811 37.916 1.00 10.44 H new ATOM 1701 N LYS A 105 9.120 -5.224 30.956 1.00 12.40 N ATOM 1702 CA LYS A 105 9.816 -5.411 29.689 1.00 74.45 C ATOM 1703 C LYS A 105 9.483 -4.287 28.713 1.00 0.44 C ATOM 1704 O LYS A 105 10.298 -3.929 27.862 1.00 55.45 O ATOM 1705 CB LYS A 105 9.441 -6.762 29.073 1.00 45.30 C ATOM 1706 CG LYS A 105 9.732 -7.945 29.980 1.00 53.10 C ATOM 1707 CD LYS A 105 9.350 -9.260 29.321 1.00 51.32 C ATOM 1708 CE LYS A 105 9.624 -10.443 30.237 1.00 55.42 C ATOM 1709 NZ LYS A 105 11.009 -10.962 30.073 1.00 64.33 N ATOM 0 H LYS A 105 8.509 -5.997 31.220 1.00 12.40 H new ATOM 0 HA LYS A 105 10.888 -5.392 29.886 1.00 74.45 H new ATOM 0 HB2 LYS A 105 8.379 -6.757 28.825 1.00 45.30 H new ATOM 0 HB3 LYS A 105 9.986 -6.889 28.138 1.00 45.30 H new ATOM 0 HG2 LYS A 105 10.792 -7.958 30.233 1.00 53.10 H new ATOM 0 HG3 LYS A 105 9.182 -7.832 30.914 1.00 53.10 H new ATOM 0 HD2 LYS A 105 8.293 -9.241 29.055 1.00 51.32 H new ATOM 0 HD3 LYS A 105 9.910 -9.379 28.393 1.00 51.32 H new ATOM 0 HE2 LYS A 105 9.469 -10.143 31.273 1.00 55.42 H new ATOM 0 HE3 LYS A 105 8.910 -11.239 30.025 1.00 55.42 H new ATOM 0 HZ1 LYS A 105 11.156 -11.767 30.714 1.00 64.33 H new ATOM 0 HZ2 LYS A 105 11.150 -11.272 29.090 1.00 64.33 H new ATOM 0 HZ3 LYS A 105 11.691 -10.210 30.300 1.00 64.33 H new ATOM 1723 N LEU A 106 8.283 -3.732 28.844 1.00 20.02 N ATOM 1724 CA LEU A 106 7.843 -2.646 27.975 1.00 3.12 C ATOM 1725 C LEU A 106 8.402 -1.308 28.450 1.00 65.53 C ATOM 1726 O LEU A 106 8.939 -0.533 27.659 1.00 65.13 O ATOM 1727 CB LEU A 106 6.315 -2.587 27.933 1.00 3.22 C ATOM 1728 CG LEU A 106 5.709 -1.301 27.370 1.00 34.04 C ATOM 1729 CD1 LEU A 106 6.285 -0.996 25.997 1.00 52.35 C ATOM 1730 CD2 LEU A 106 4.192 -1.412 27.302 1.00 24.03 C ATOM 0 H LEU A 106 7.597 -4.016 29.544 1.00 20.02 H new ATOM 0 HA LEU A 106 8.221 -2.841 26.971 1.00 3.12 H new ATOM 0 HB2 LEU A 106 5.955 -3.426 27.337 1.00 3.22 H new ATOM 0 HB3 LEU A 106 5.938 -2.730 28.946 1.00 3.22 H new ATOM 0 HG LEU A 106 5.964 -0.479 28.039 1.00 34.04 H new ATOM 0 HD11 LEU A 106 5.842 -0.077 25.612 1.00 52.35 H new ATOM 0 HD12 LEU A 106 7.365 -0.873 26.075 1.00 52.35 H new ATOM 0 HD13 LEU A 106 6.062 -1.819 25.318 1.00 52.35 H new ATOM 0 HD21 LEU A 106 3.777 -0.488 26.899 1.00 24.03 H new ATOM 0 HD22 LEU A 106 3.917 -2.245 26.656 1.00 24.03 H new ATOM 0 HD23 LEU A 106 3.794 -1.582 28.303 1.00 24.03 H new ATOM 1742 N SER A 107 8.274 -1.046 29.746 1.00 4.14 N ATOM 1743 CA SER A 107 8.765 0.199 30.326 1.00 25.45 C ATOM 1744 C SER A 107 10.246 0.395 30.016 1.00 3.34 C ATOM 1745 O SER A 107 10.697 1.514 29.771 1.00 51.35 O ATOM 1746 CB SER A 107 8.545 0.202 31.840 1.00 10.24 C ATOM 1747 OG SER A 107 9.060 1.384 32.428 1.00 40.51 O ATOM 0 H SER A 107 7.835 -1.679 30.415 1.00 4.14 H new ATOM 0 HA SER A 107 8.206 1.023 29.883 1.00 25.45 H new ATOM 0 HB2 SER A 107 7.480 0.119 32.056 1.00 10.24 H new ATOM 0 HB3 SER A 107 9.029 -0.669 32.283 1.00 10.24 H new ATOM 0 HG SER A 107 8.906 1.362 33.396 1.00 40.51 H new ATOM 1753 N ARG A 108 10.998 -0.701 30.030 1.00 11.31 N ATOM 1754 CA ARG A 108 12.428 -0.650 29.752 1.00 41.12 C ATOM 1755 C ARG A 108 12.685 -0.377 28.273 1.00 52.23 C ATOM 1756 O ARG A 108 13.677 0.256 27.910 1.00 30.53 O ATOM 1757 CB ARG A 108 13.096 -1.963 30.162 1.00 22.44 C ATOM 1758 CG ARG A 108 12.601 -3.169 29.381 1.00 75.12 C ATOM 1759 CD ARG A 108 13.453 -4.399 29.653 1.00 10.54 C ATOM 1760 NE ARG A 108 14.852 -4.186 29.291 1.00 74.23 N ATOM 1761 CZ ARG A 108 15.831 -5.022 29.619 1.00 51.35 C ATOM 1762 NH1 ARG A 108 15.565 -6.120 30.312 1.00 3.03 N ATOM 1763 NH2 ARG A 108 17.079 -4.760 29.252 1.00 51.32 N ATOM 0 H ARG A 108 10.640 -1.635 30.231 1.00 11.31 H new ATOM 0 HA ARG A 108 12.857 0.165 30.334 1.00 41.12 H new ATOM 0 HB2 ARG A 108 14.174 -1.870 30.026 1.00 22.44 H new ATOM 0 HB3 ARG A 108 12.922 -2.133 31.225 1.00 22.44 H new ATOM 0 HG2 ARG A 108 11.565 -3.377 29.649 1.00 75.12 H new ATOM 0 HG3 ARG A 108 12.616 -2.944 28.315 1.00 75.12 H new ATOM 0 HD2 ARG A 108 13.387 -4.659 30.709 1.00 10.54 H new ATOM 0 HD3 ARG A 108 13.058 -5.245 29.091 1.00 10.54 H new ATOM 0 HE ARG A 108 15.090 -3.350 28.757 1.00 74.23 H new ATOM 0 HH11 ARG A 108 14.607 -6.325 30.595 1.00 3.03 H new ATOM 0 HH12 ARG A 108 16.319 -6.760 30.562 1.00 3.03 H new ATOM 0 HH21 ARG A 108 17.287 -3.916 28.718 1.00 51.32 H new ATOM 0 HH22 ARG A 108 17.830 -5.402 29.504 1.00 51.32 H new ATOM 1777 N VAL A 109 11.784 -0.858 27.422 1.00 31.42 N ATOM 1778 CA VAL A 109 11.912 -0.666 25.983 1.00 60.14 C ATOM 1779 C VAL A 109 11.461 0.731 25.573 1.00 42.34 C ATOM 1780 O VAL A 109 11.998 1.318 24.632 1.00 34.33 O ATOM 1781 CB VAL A 109 11.090 -1.709 25.202 1.00 40.43 C ATOM 1782 CG1 VAL A 109 11.090 -1.384 23.716 1.00 72.34 C ATOM 1783 CG2 VAL A 109 11.631 -3.108 25.450 1.00 25.33 C ATOM 0 H VAL A 109 10.957 -1.384 27.705 1.00 31.42 H new ATOM 0 HA VAL A 109 12.967 -0.790 25.740 1.00 60.14 H new ATOM 0 HB VAL A 109 10.060 -1.675 25.557 1.00 40.43 H new ATOM 0 HG11 VAL A 109 10.505 -2.131 23.180 1.00 72.34 H new ATOM 0 HG12 VAL A 109 10.651 -0.399 23.559 1.00 72.34 H new ATOM 0 HG13 VAL A 109 12.114 -1.389 23.342 1.00 72.34 H new ATOM 0 HG21 VAL A 109 11.038 -3.832 24.891 1.00 25.33 H new ATOM 0 HG22 VAL A 109 12.670 -3.160 25.123 1.00 25.33 H new ATOM 0 HG23 VAL A 109 11.573 -3.337 26.514 1.00 25.33 H new ATOM 1793 N VAL A 110 10.472 1.261 26.285 1.00 75.31 N ATOM 1794 CA VAL A 110 9.949 2.591 25.997 1.00 74.14 C ATOM 1795 C VAL A 110 10.994 3.665 26.276 1.00 31.24 C ATOM 1796 O VAL A 110 11.142 4.616 25.510 1.00 31.31 O ATOM 1797 CB VAL A 110 8.686 2.890 26.827 1.00 63.10 C ATOM 1798 CG1 VAL A 110 8.181 4.296 26.543 1.00 74.14 C ATOM 1799 CG2 VAL A 110 7.605 1.858 26.543 1.00 64.12 C ATOM 0 H VAL A 110 10.016 0.789 27.066 1.00 75.31 H new ATOM 0 HA VAL A 110 9.690 2.607 24.938 1.00 74.14 H new ATOM 0 HB VAL A 110 8.944 2.830 27.884 1.00 63.10 H new ATOM 0 HG11 VAL A 110 7.288 4.489 27.138 1.00 74.14 H new ATOM 0 HG12 VAL A 110 8.954 5.020 26.803 1.00 74.14 H new ATOM 0 HG13 VAL A 110 7.938 4.388 25.484 1.00 74.14 H new ATOM 0 HG21 VAL A 110 6.720 2.085 27.138 1.00 64.12 H new ATOM 0 HG22 VAL A 110 7.347 1.883 25.484 1.00 64.12 H new ATOM 0 HG23 VAL A 110 7.972 0.865 26.803 1.00 64.12 H new ATOM 1809 N ASN A 111 11.717 3.505 27.380 1.00 44.41 N ATOM 1810 CA ASN A 111 12.750 4.462 27.762 1.00 70.14 C ATOM 1811 C ASN A 111 13.935 4.394 26.804 1.00 65.23 C ATOM 1812 O ASN A 111 14.553 5.412 26.491 1.00 0.21 O ATOM 1813 CB ASN A 111 13.220 4.193 29.193 1.00 61.45 C ATOM 1814 CG ASN A 111 14.562 3.487 29.237 1.00 34.22 C ATOM 1815 OD1 ASN A 111 15.602 4.091 28.978 1.00 4.22 O ATOM 1816 ND2 ASN A 111 14.543 2.201 29.567 1.00 74.53 N ATOM 0 H ASN A 111 11.607 2.723 28.025 1.00 44.41 H new ATOM 0 HA ASN A 111 12.321 5.463 27.710 1.00 70.14 H new ATOM 0 HB2 ASN A 111 13.291 5.137 29.733 1.00 61.45 H new ATOM 0 HB3 ASN A 111 12.476 3.586 29.709 1.00 61.45 H new ATOM 0 HD21 ASN A 111 15.415 1.674 29.614 1.00 74.53 H new ATOM 0 HD22 ASN A 111 13.657 1.741 29.774 1.00 74.53 H new ATOM 1823 N ILE A 112 14.247 3.188 26.341 1.00 32.31 N ATOM 1824 CA ILE A 112 15.357 2.987 25.418 1.00 54.23 C ATOM 1825 C ILE A 112 15.272 3.951 24.239 1.00 72.11 C ATOM 1826 O ILE A 112 16.292 4.361 23.683 1.00 31.42 O ATOM 1827 CB ILE A 112 15.391 1.543 24.884 1.00 21.11 C ATOM 1828 CG1 ILE A 112 15.946 0.595 25.950 1.00 52.52 C ATOM 1829 CG2 ILE A 112 16.226 1.467 23.614 1.00 14.33 C ATOM 1830 CD1 ILE A 112 15.538 -0.847 25.747 1.00 64.11 C ATOM 0 H ILE A 112 13.746 2.335 26.590 1.00 32.31 H new ATOM 0 HA ILE A 112 16.272 3.180 25.978 1.00 54.23 H new ATOM 0 HB ILE A 112 14.373 1.236 24.645 1.00 21.11 H new ATOM 0 HG12 ILE A 112 17.034 0.660 25.951 1.00 52.52 H new ATOM 0 HG13 ILE A 112 15.606 0.926 26.931 1.00 52.52 H new ATOM 0 HG21 ILE A 112 16.240 0.440 23.249 1.00 14.33 H new ATOM 0 HG22 ILE A 112 15.792 2.116 22.854 1.00 14.33 H new ATOM 0 HG23 ILE A 112 17.245 1.790 23.828 1.00 14.33 H new ATOM 0 HD11 ILE A 112 15.967 -1.461 26.539 1.00 64.11 H new ATOM 0 HD12 ILE A 112 14.451 -0.925 25.776 1.00 64.11 H new ATOM 0 HD13 ILE A 112 15.901 -1.195 24.780 1.00 64.11 H new ATOM 1842 N LEU A 113 14.050 4.311 23.863 1.00 74.20 N ATOM 1843 CA LEU A 113 13.831 5.229 22.751 1.00 74.14 C ATOM 1844 C LEU A 113 14.639 6.509 22.934 1.00 41.20 C ATOM 1845 O LEU A 113 15.216 7.034 21.981 1.00 22.14 O ATOM 1846 CB LEU A 113 12.343 5.565 22.626 1.00 24.31 C ATOM 1847 CG LEU A 113 11.492 4.561 21.848 1.00 54.33 C ATOM 1848 CD1 LEU A 113 11.907 4.530 20.385 1.00 22.31 C ATOM 1849 CD2 LEU A 113 11.602 3.175 22.466 1.00 45.14 C ATOM 0 H LEU A 113 13.196 3.981 24.312 1.00 74.20 H new ATOM 0 HA LEU A 113 14.165 4.738 21.837 1.00 74.14 H new ATOM 0 HB2 LEU A 113 11.928 5.663 23.629 1.00 24.31 H new ATOM 0 HB3 LEU A 113 12.250 6.539 22.146 1.00 24.31 H new ATOM 0 HG LEU A 113 10.451 4.878 21.902 1.00 54.33 H new ATOM 0 HD11 LEU A 113 11.290 3.810 19.847 1.00 22.31 H new ATOM 0 HD12 LEU A 113 11.774 5.520 19.948 1.00 22.31 H new ATOM 0 HD13 LEU A 113 12.955 4.238 20.310 1.00 22.31 H new ATOM 0 HD21 LEU A 113 10.990 2.474 21.899 1.00 45.14 H new ATOM 0 HD22 LEU A 113 12.642 2.848 22.444 1.00 45.14 H new ATOM 0 HD23 LEU A 113 11.254 3.208 23.498 1.00 45.14 H new ATOM 1861 N LYS A 114 14.678 7.007 24.165 1.00 23.34 N ATOM 1862 CA LYS A 114 15.419 8.224 24.476 1.00 32.32 C ATOM 1863 C LYS A 114 16.923 7.979 24.405 1.00 33.31 C ATOM 1864 O LYS A 114 17.692 8.879 24.072 1.00 52.44 O ATOM 1865 CB LYS A 114 15.040 8.734 25.868 1.00 12.42 C ATOM 1866 CG LYS A 114 15.893 8.154 26.982 1.00 22.43 C ATOM 1867 CD LYS A 114 15.244 8.350 28.342 1.00 31.40 C ATOM 1868 CE LYS A 114 14.074 7.399 28.543 1.00 33.12 C ATOM 1869 NZ LYS A 114 13.345 7.677 29.811 1.00 15.44 N ATOM 0 H LYS A 114 14.205 6.586 24.965 1.00 23.34 H new ATOM 0 HA LYS A 114 15.157 8.979 23.735 1.00 32.32 H new ATOM 0 HB2 LYS A 114 15.127 9.820 25.884 1.00 12.42 H new ATOM 0 HB3 LYS A 114 13.994 8.495 26.061 1.00 12.42 H new ATOM 0 HG2 LYS A 114 16.052 7.090 26.804 1.00 22.43 H new ATOM 0 HG3 LYS A 114 16.874 8.628 26.975 1.00 22.43 H new ATOM 0 HD2 LYS A 114 15.984 8.189 29.126 1.00 31.40 H new ATOM 0 HD3 LYS A 114 14.898 9.379 28.436 1.00 31.40 H new ATOM 0 HE2 LYS A 114 13.386 7.487 27.702 1.00 33.12 H new ATOM 0 HE3 LYS A 114 14.438 6.372 28.551 1.00 33.12 H new ATOM 0 HZ1 LYS A 114 12.454 7.140 29.824 1.00 15.44 H new ATOM 0 HZ2 LYS A 114 13.933 7.391 30.620 1.00 15.44 H new ATOM 0 HZ3 LYS A 114 13.137 8.694 29.876 1.00 15.44 H new ATOM 1883 N GLU A 115 17.334 6.754 24.719 1.00 12.15 N ATOM 1884 CA GLU A 115 18.746 6.392 24.690 1.00 0.20 C ATOM 1885 C GLU A 115 19.327 6.581 23.292 1.00 41.33 C ATOM 1886 O GLU A 115 20.462 7.032 23.135 1.00 1.05 O ATOM 1887 CB GLU A 115 18.933 4.942 25.140 1.00 21.30 C ATOM 1888 CG GLU A 115 18.343 4.648 26.509 1.00 4.44 C ATOM 1889 CD GLU A 115 18.573 3.216 26.949 1.00 64.52 C ATOM 1890 OE1 GLU A 115 18.731 2.344 26.068 1.00 35.45 O ATOM 1891 OE2 GLU A 115 18.596 2.966 28.172 1.00 21.20 O ATOM 0 H GLU A 115 16.710 5.997 24.996 1.00 12.15 H new ATOM 0 HA GLU A 115 19.278 7.050 25.378 1.00 0.20 H new ATOM 0 HB2 GLU A 115 18.473 4.281 24.406 1.00 21.30 H new ATOM 0 HB3 GLU A 115 19.998 4.710 25.155 1.00 21.30 H new ATOM 0 HG2 GLU A 115 18.782 5.324 27.242 1.00 4.44 H new ATOM 0 HG3 GLU A 115 17.272 4.851 26.490 1.00 4.44 H new ATOM 1898 N ARG A 116 18.541 6.233 22.279 1.00 72.05 N ATOM 1899 CA ARG A 116 18.977 6.362 20.893 1.00 0.34 C ATOM 1900 C ARG A 116 18.410 7.630 20.261 1.00 75.53 C ATOM 1901 O ARG A 116 18.784 8.002 19.150 1.00 62.33 O ATOM 1902 CB ARG A 116 18.545 5.138 20.084 1.00 24.00 C ATOM 1903 CG ARG A 116 18.790 3.819 20.798 1.00 61.30 C ATOM 1904 CD ARG A 116 20.262 3.630 21.131 1.00 52.01 C ATOM 1905 NE ARG A 116 21.114 3.799 19.957 1.00 24.52 N ATOM 1906 CZ ARG A 116 22.414 4.064 20.025 1.00 2.31 C ATOM 1907 NH1 ARG A 116 23.008 4.191 21.204 1.00 73.31 N ATOM 1908 NH2 ARG A 116 23.123 4.204 18.912 1.00 21.31 N ATOM 0 H ARG A 116 17.599 5.859 22.391 1.00 72.05 H new ATOM 0 HA ARG A 116 20.065 6.428 20.885 1.00 0.34 H new ATOM 0 HB2 ARG A 116 17.484 5.223 19.850 1.00 24.00 H new ATOM 0 HB3 ARG A 116 19.081 5.133 19.135 1.00 24.00 H new ATOM 0 HG2 ARG A 116 18.201 3.786 21.715 1.00 61.30 H new ATOM 0 HG3 ARG A 116 18.449 2.996 20.170 1.00 61.30 H new ATOM 0 HD2 ARG A 116 20.555 4.347 21.898 1.00 52.01 H new ATOM 0 HD3 ARG A 116 20.414 2.635 21.549 1.00 52.01 H new ATOM 0 HE ARG A 116 20.688 3.709 19.035 1.00 24.52 H new ATOM 0 HH11 ARG A 116 22.467 4.085 22.062 1.00 73.31 H new ATOM 0 HH12 ARG A 116 24.006 4.394 21.253 1.00 73.31 H new ATOM 0 HH21 ARG A 116 22.670 4.108 18.003 1.00 21.31 H new ATOM 0 HH22 ARG A 116 24.121 4.407 18.965 1.00 21.31 H new ATOM 1922 N ASN A 117 17.503 8.287 20.977 1.00 41.35 N ATOM 1923 CA ASN A 117 16.883 9.512 20.485 1.00 51.23 C ATOM 1924 C ASN A 117 16.068 9.241 19.224 1.00 72.11 C ATOM 1925 O ASN A 117 16.035 10.061 18.305 1.00 22.45 O ATOM 1926 CB ASN A 117 17.951 10.570 20.197 1.00 32.45 C ATOM 1927 CG ASN A 117 17.368 11.966 20.090 1.00 61.51 C ATOM 1928 OD1 ASN A 117 16.254 12.222 20.546 1.00 74.24 O ATOM 1929 ND2 ASN A 117 18.122 12.876 19.484 1.00 33.04 N ATOM 0 H ASN A 117 17.181 7.992 21.899 1.00 41.35 H new ATOM 0 HA ASN A 117 16.211 9.885 21.258 1.00 51.23 H new ATOM 0 HB2 ASN A 117 18.700 10.552 20.989 1.00 32.45 H new ATOM 0 HB3 ASN A 117 18.464 10.321 19.268 1.00 32.45 H new ATOM 0 HD21 ASN A 117 17.783 13.833 19.381 1.00 33.04 H new ATOM 0 HD22 ASN A 117 19.040 12.618 19.121 1.00 33.04 H new ATOM 1936 N ILE A 118 15.411 8.086 19.188 1.00 41.44 N ATOM 1937 CA ILE A 118 14.595 7.708 18.041 1.00 51.23 C ATOM 1938 C ILE A 118 13.523 8.756 17.759 1.00 23.11 C ATOM 1939 O ILE A 118 13.604 9.493 16.777 1.00 51.54 O ATOM 1940 CB ILE A 118 13.917 6.342 18.258 1.00 0.51 C ATOM 1941 CG1 ILE A 118 14.967 5.267 18.545 1.00 42.24 C ATOM 1942 CG2 ILE A 118 13.083 5.966 17.043 1.00 61.43 C ATOM 1943 CD1 ILE A 118 15.874 4.980 17.369 1.00 61.24 C ATOM 0 H ILE A 118 15.428 7.397 19.940 1.00 41.44 H new ATOM 0 HA ILE A 118 15.267 7.639 17.185 1.00 51.23 H new ATOM 0 HB ILE A 118 13.254 6.414 19.120 1.00 0.51 H new ATOM 0 HG12 ILE A 118 15.574 5.581 19.394 1.00 42.24 H new ATOM 0 HG13 ILE A 118 14.462 4.346 18.838 1.00 42.24 H new ATOM 0 HG21 ILE A 118 12.610 4.998 17.211 1.00 61.43 H new ATOM 0 HG22 ILE A 118 12.315 6.722 16.881 1.00 61.43 H new ATOM 0 HG23 ILE A 118 13.726 5.908 16.164 1.00 61.43 H new ATOM 0 HD11 ILE A 118 16.593 4.208 17.644 1.00 61.24 H new ATOM 0 HD12 ILE A 118 15.277 4.635 16.525 1.00 61.24 H new ATOM 0 HD13 ILE A 118 16.406 5.889 17.090 1.00 61.24 H new ATOM 1955 N PHE A 119 12.521 8.817 18.629 1.00 15.30 N ATOM 1956 CA PHE A 119 11.432 9.776 18.475 1.00 64.31 C ATOM 1957 C PHE A 119 11.757 11.086 19.187 1.00 74.22 C ATOM 1958 O PHE A 119 12.669 11.148 20.011 1.00 32.41 O ATOM 1959 CB PHE A 119 10.129 9.192 19.025 1.00 40.53 C ATOM 1960 CG PHE A 119 9.814 7.824 18.493 1.00 34.51 C ATOM 1961 CD1 PHE A 119 9.784 7.586 17.128 1.00 21.24 C ATOM 1962 CD2 PHE A 119 9.547 6.774 19.358 1.00 3.40 C ATOM 1963 CE1 PHE A 119 9.493 6.327 16.637 1.00 44.33 C ATOM 1964 CE2 PHE A 119 9.256 5.514 18.872 1.00 24.52 C ATOM 1965 CZ PHE A 119 9.230 5.290 17.510 1.00 64.44 C ATOM 0 H PHE A 119 12.440 8.214 19.448 1.00 15.30 H new ATOM 0 HA PHE A 119 11.309 9.982 17.412 1.00 64.31 H new ATOM 0 HB2 PHE A 119 10.192 9.145 20.112 1.00 40.53 H new ATOM 0 HB3 PHE A 119 9.307 9.866 18.782 1.00 40.53 H new ATOM 0 HD1 PHE A 119 9.990 8.393 16.440 1.00 21.24 H new ATOM 0 HD2 PHE A 119 9.567 6.943 20.424 1.00 3.40 H new ATOM 0 HE1 PHE A 119 9.471 6.155 15.571 1.00 44.33 H new ATOM 0 HE2 PHE A 119 9.049 4.705 19.557 1.00 24.52 H new ATOM 0 HZ PHE A 119 9.004 4.305 17.128 1.00 64.44 H new ATOM 1975 N SER A 120 11.003 12.131 18.862 1.00 41.45 N ATOM 1976 CA SER A 120 11.212 13.442 19.466 1.00 62.12 C ATOM 1977 C SER A 120 10.438 13.566 20.775 1.00 43.33 C ATOM 1978 O SER A 120 9.757 12.632 21.199 1.00 45.23 O ATOM 1979 CB SER A 120 10.783 14.547 18.499 1.00 14.11 C ATOM 1980 OG SER A 120 11.840 14.898 17.624 1.00 41.53 O ATOM 0 H SER A 120 10.242 12.096 18.184 1.00 41.45 H new ATOM 0 HA SER A 120 12.275 13.551 19.681 1.00 62.12 H new ATOM 0 HB2 SER A 120 9.923 14.213 17.919 1.00 14.11 H new ATOM 0 HB3 SER A 120 10.467 15.425 19.062 1.00 14.11 H new ATOM 0 HG SER A 120 11.540 15.605 17.015 1.00 41.53 H new ATOM 1986 N LYS A 121 10.548 14.727 21.411 1.00 10.44 N ATOM 1987 CA LYS A 121 9.859 14.978 22.672 1.00 72.43 C ATOM 1988 C LYS A 121 8.346 14.960 22.477 1.00 10.33 C ATOM 1989 O LYS A 121 7.607 14.480 23.336 1.00 30.11 O ATOM 1990 CB LYS A 121 10.293 16.324 23.256 1.00 62.32 C ATOM 1991 CG LYS A 121 10.263 16.366 24.774 1.00 41.22 C ATOM 1992 CD LYS A 121 11.487 15.695 25.375 1.00 74.12 C ATOM 1993 CE LYS A 121 12.654 16.664 25.490 1.00 35.34 C ATOM 1994 NZ LYS A 121 12.359 17.777 26.434 1.00 13.13 N ATOM 0 H LYS A 121 11.108 15.510 21.074 1.00 10.44 H new ATOM 0 HA LYS A 121 10.128 14.184 23.369 1.00 72.43 H new ATOM 0 HB2 LYS A 121 11.303 16.550 22.914 1.00 62.32 H new ATOM 0 HB3 LYS A 121 9.642 17.107 22.866 1.00 62.32 H new ATOM 0 HG2 LYS A 121 10.214 17.402 25.109 1.00 41.22 H new ATOM 0 HG3 LYS A 121 9.362 15.871 25.135 1.00 41.22 H new ATOM 0 HD2 LYS A 121 11.240 15.302 26.361 1.00 74.12 H new ATOM 0 HD3 LYS A 121 11.778 14.845 24.757 1.00 74.12 H new ATOM 0 HE2 LYS A 121 13.540 16.127 25.827 1.00 35.34 H new ATOM 0 HE3 LYS A 121 12.885 17.073 24.506 1.00 35.34 H new ATOM 0 HZ1 LYS A 121 13.082 17.799 27.182 1.00 13.13 H new ATOM 0 HZ2 LYS A 121 12.366 18.680 25.919 1.00 13.13 H new ATOM 0 HZ3 LYS A 121 11.423 17.630 26.862 1.00 13.13 H new ATOM 2008 N GLN A 122 7.894 15.486 21.344 1.00 75.05 N ATOM 2009 CA GLN A 122 6.469 15.529 21.037 1.00 15.54 C ATOM 2010 C GLN A 122 5.865 14.129 21.053 1.00 23.25 C ATOM 2011 O GLN A 122 4.740 13.931 21.512 1.00 10.51 O ATOM 2012 CB GLN A 122 6.238 16.181 19.673 1.00 42.31 C ATOM 2013 CG GLN A 122 6.466 17.684 19.670 1.00 11.34 C ATOM 2014 CD GLN A 122 5.883 18.361 18.445 1.00 24.31 C ATOM 2015 OE1 GLN A 122 5.989 17.849 17.330 1.00 1.11 O ATOM 2016 NE2 GLN A 122 5.263 19.518 18.646 1.00 65.22 N ATOM 0 H GLN A 122 8.493 15.888 20.623 1.00 75.05 H new ATOM 0 HA GLN A 122 5.977 16.126 21.805 1.00 15.54 H new ATOM 0 HB2 GLN A 122 6.902 15.720 18.942 1.00 42.31 H new ATOM 0 HB3 GLN A 122 5.217 15.976 19.350 1.00 42.31 H new ATOM 0 HG2 GLN A 122 6.021 18.117 20.566 1.00 11.34 H new ATOM 0 HG3 GLN A 122 7.536 17.885 19.717 1.00 11.34 H new ATOM 0 HE21 GLN A 122 5.199 19.905 19.587 1.00 65.22 H new ATOM 0 HE22 GLN A 122 4.851 20.019 17.859 1.00 65.22 H new ATOM 2025 N VAL A 123 6.621 13.158 20.549 1.00 1.52 N ATOM 2026 CA VAL A 123 6.161 11.775 20.506 1.00 4.52 C ATOM 2027 C VAL A 123 6.309 11.105 21.867 1.00 34.24 C ATOM 2028 O VAL A 123 5.371 10.487 22.372 1.00 60.54 O ATOM 2029 CB VAL A 123 6.938 10.958 19.457 1.00 40.32 C ATOM 2030 CG1 VAL A 123 6.296 9.593 19.261 1.00 41.33 C ATOM 2031 CG2 VAL A 123 7.012 11.716 18.140 1.00 52.11 C ATOM 0 H VAL A 123 7.555 13.304 20.165 1.00 1.52 H new ATOM 0 HA VAL A 123 5.107 11.800 20.229 1.00 4.52 H new ATOM 0 HB VAL A 123 7.955 10.806 19.820 1.00 40.32 H new ATOM 0 HG11 VAL A 123 6.859 9.030 18.516 1.00 41.33 H new ATOM 0 HG12 VAL A 123 6.300 9.050 20.206 1.00 41.33 H new ATOM 0 HG13 VAL A 123 5.269 9.720 18.920 1.00 41.33 H new ATOM 0 HG21 VAL A 123 7.564 11.124 17.410 1.00 52.11 H new ATOM 0 HG22 VAL A 123 6.004 11.900 17.769 1.00 52.11 H new ATOM 0 HG23 VAL A 123 7.521 12.667 18.296 1.00 52.11 H new ATOM 2041 N VAL A 124 7.492 11.232 22.459 1.00 64.45 N ATOM 2042 CA VAL A 124 7.763 10.639 23.763 1.00 11.20 C ATOM 2043 C VAL A 124 6.750 11.109 24.801 1.00 53.13 C ATOM 2044 O VAL A 124 6.214 10.309 25.566 1.00 34.01 O ATOM 2045 CB VAL A 124 9.181 10.985 24.253 1.00 4.23 C ATOM 2046 CG1 VAL A 124 9.427 10.399 25.635 1.00 13.03 C ATOM 2047 CG2 VAL A 124 10.223 10.489 23.262 1.00 21.21 C ATOM 0 H VAL A 124 8.279 11.741 22.056 1.00 64.45 H new ATOM 0 HA VAL A 124 7.682 9.559 23.643 1.00 11.20 H new ATOM 0 HB VAL A 124 9.267 12.069 24.324 1.00 4.23 H new ATOM 0 HG11 VAL A 124 10.434 10.654 25.964 1.00 13.03 H new ATOM 0 HG12 VAL A 124 8.701 10.808 26.338 1.00 13.03 H new ATOM 0 HG13 VAL A 124 9.322 9.315 25.594 1.00 13.03 H new ATOM 0 HG21 VAL A 124 11.219 10.742 23.624 1.00 21.21 H new ATOM 0 HG22 VAL A 124 10.139 9.407 23.157 1.00 21.21 H new ATOM 0 HG23 VAL A 124 10.058 10.962 22.294 1.00 21.21 H new ATOM 2057 N ASN A 125 6.492 12.413 24.820 1.00 74.32 N ATOM 2058 CA ASN A 125 5.542 12.990 25.764 1.00 10.11 C ATOM 2059 C ASN A 125 4.177 12.320 25.642 1.00 61.54 C ATOM 2060 O ASN A 125 3.425 12.237 26.613 1.00 23.41 O ATOM 2061 CB ASN A 125 5.406 14.496 25.527 1.00 62.53 C ATOM 2062 CG ASN A 125 6.341 15.306 26.404 1.00 33.22 C ATOM 2063 OD1 ASN A 125 7.593 14.873 26.492 1.00 1.12 O flip ATOM 2064 ND2 ASN A 125 5.941 16.309 26.995 1.00 30.14 N flip ATOM 0 H ASN A 125 6.927 13.089 24.193 1.00 74.32 H new ATOM 0 HA ASN A 125 5.921 12.820 26.772 1.00 10.11 H new ATOM 0 HB2 ASN A 125 5.613 14.716 24.480 1.00 62.53 H new ATOM 0 HB3 ASN A 125 4.377 14.800 25.720 1.00 62.53 H new ATOM 0 HD21 ASN A 125 4.970 16.605 26.898 1.00 30.14 H new ATOM 0 HD22 ASN A 125 6.581 16.844 27.582 1.00 30.14 H new ATOM 2071 N ASP A 126 3.864 11.842 24.442 1.00 2.20 N ATOM 2072 CA ASP A 126 2.591 11.177 24.192 1.00 13.01 C ATOM 2073 C ASP A 126 2.588 9.769 24.780 1.00 4.41 C ATOM 2074 O ASP A 126 1.554 9.277 25.232 1.00 22.11 O ATOM 2075 CB ASP A 126 2.309 11.116 22.690 1.00 11.21 C ATOM 2076 CG ASP A 126 0.848 10.851 22.385 1.00 33.25 C ATOM 2077 OD1 ASP A 126 0.234 10.025 23.094 1.00 50.21 O ATOM 2078 OD2 ASP A 126 0.318 11.469 21.439 1.00 15.42 O ATOM 0 H ASP A 126 4.475 11.903 23.627 1.00 2.20 H new ATOM 0 HA ASP A 126 1.806 11.756 24.678 1.00 13.01 H new ATOM 0 HB2 ASP A 126 2.608 12.057 22.229 1.00 11.21 H new ATOM 0 HB3 ASP A 126 2.919 10.332 22.240 1.00 11.21 H new ATOM 2083 N ILE A 127 3.752 9.127 24.769 1.00 14.34 N ATOM 2084 CA ILE A 127 3.883 7.777 25.302 1.00 70.35 C ATOM 2085 C ILE A 127 3.676 7.758 26.812 1.00 13.42 C ATOM 2086 O ILE A 127 2.981 6.892 27.342 1.00 13.42 O ATOM 2087 CB ILE A 127 5.263 7.175 24.977 1.00 42.43 C ATOM 2088 CG1 ILE A 127 5.483 7.136 23.463 1.00 3.41 C ATOM 2089 CG2 ILE A 127 5.387 5.781 25.572 1.00 75.45 C ATOM 2090 CD1 ILE A 127 6.942 7.095 23.066 1.00 62.25 C ATOM 0 H ILE A 127 4.617 9.520 24.397 1.00 14.34 H new ATOM 0 HA ILE A 127 3.110 7.174 24.825 1.00 70.35 H new ATOM 0 HB ILE A 127 6.032 7.807 25.421 1.00 42.43 H new ATOM 0 HG12 ILE A 127 4.978 6.261 23.053 1.00 3.41 H new ATOM 0 HG13 ILE A 127 5.017 8.013 23.013 1.00 3.41 H new ATOM 0 HG21 ILE A 127 6.368 5.369 25.333 1.00 75.45 H new ATOM 0 HG22 ILE A 127 5.270 5.836 26.654 1.00 75.45 H new ATOM 0 HG23 ILE A 127 4.612 5.137 25.155 1.00 75.45 H new ATOM 0 HD11 ILE A 127 7.023 7.069 21.979 1.00 62.25 H new ATOM 0 HD12 ILE A 127 7.448 7.983 23.446 1.00 62.25 H new ATOM 0 HD13 ILE A 127 7.409 6.204 23.486 1.00 62.25 H new ATOM 2102 N GLU A 128 4.282 8.721 27.499 1.00 5.40 N ATOM 2103 CA GLU A 128 4.163 8.816 28.949 1.00 21.12 C ATOM 2104 C GLU A 128 2.715 9.067 29.361 1.00 62.13 C ATOM 2105 O GLU A 128 2.141 8.310 30.143 1.00 30.42 O ATOM 2106 CB GLU A 128 5.058 9.935 29.485 1.00 4.01 C ATOM 2107 CG GLU A 128 6.511 9.810 29.057 1.00 51.21 C ATOM 2108 CD GLU A 128 7.408 10.828 29.734 1.00 63.11 C ATOM 2109 OE1 GLU A 128 7.883 10.549 30.855 1.00 72.23 O ATOM 2110 OE2 GLU A 128 7.636 11.904 29.142 1.00 70.20 O ATOM 0 H GLU A 128 4.860 9.446 27.075 1.00 5.40 H new ATOM 0 HA GLU A 128 4.485 7.867 29.377 1.00 21.12 H new ATOM 0 HB2 GLU A 128 4.669 10.895 29.144 1.00 4.01 H new ATOM 0 HB3 GLU A 128 5.008 9.939 30.574 1.00 4.01 H new ATOM 0 HG2 GLU A 128 6.869 8.806 29.287 1.00 51.21 H new ATOM 0 HG3 GLU A 128 6.579 9.933 27.976 1.00 51.21 H new ATOM 2117 N ARG A 129 2.132 10.136 28.828 1.00 33.41 N ATOM 2118 CA ARG A 129 0.752 10.488 29.141 1.00 40.23 C ATOM 2119 C ARG A 129 -0.187 9.323 28.846 1.00 73.54 C ATOM 2120 O ARG A 129 -1.175 9.115 29.550 1.00 75.04 O ATOM 2121 CB ARG A 129 0.323 11.718 28.339 1.00 43.34 C ATOM 2122 CG ARG A 129 0.261 11.476 26.839 1.00 10.33 C ATOM 2123 CD ARG A 129 -0.156 12.732 26.089 1.00 35.43 C ATOM 2124 NE ARG A 129 -1.492 13.180 26.474 1.00 40.31 N ATOM 2125 CZ ARG A 129 -2.095 14.236 25.938 1.00 31.25 C ATOM 2126 NH1 ARG A 129 -1.485 14.947 25.000 1.00 11.05 N ATOM 2127 NH2 ARG A 129 -3.311 14.581 26.341 1.00 54.40 N ATOM 0 H ARG A 129 2.593 10.773 28.178 1.00 33.41 H new ATOM 0 HA ARG A 129 0.695 10.718 30.205 1.00 40.23 H new ATOM 0 HB2 ARG A 129 -0.657 12.044 28.687 1.00 43.34 H new ATOM 0 HB3 ARG A 129 1.019 12.532 28.539 1.00 43.34 H new ATOM 0 HG2 ARG A 129 1.236 11.145 26.482 1.00 10.33 H new ATOM 0 HG3 ARG A 129 -0.445 10.673 26.628 1.00 10.33 H new ATOM 0 HD2 ARG A 129 0.564 13.527 26.285 1.00 35.43 H new ATOM 0 HD3 ARG A 129 -0.133 12.538 25.017 1.00 35.43 H new ATOM 0 HE ARG A 129 -1.989 12.654 27.193 1.00 40.31 H new ATOM 0 HH11 ARG A 129 -0.550 14.684 24.688 1.00 11.05 H new ATOM 0 HH12 ARG A 129 -1.950 15.757 24.590 1.00 11.05 H new ATOM 0 HH21 ARG A 129 -3.783 14.036 27.062 1.00 54.40 H new ATOM 0 HH22 ARG A 129 -3.774 15.392 25.930 1.00 54.40 H new ATOM 2141 N SER A 130 0.128 8.565 27.800 1.00 41.22 N ATOM 2142 CA SER A 130 -0.690 7.423 27.409 1.00 43.04 C ATOM 2143 C SER A 130 -0.829 6.434 28.562 1.00 64.11 C ATOM 2144 O SER A 130 -1.926 5.963 28.863 1.00 53.12 O ATOM 2145 CB SER A 130 -0.079 6.724 26.193 1.00 64.22 C ATOM 2146 OG SER A 130 -0.616 7.236 24.986 1.00 14.20 O ATOM 0 H SER A 130 0.944 8.721 27.208 1.00 41.22 H new ATOM 0 HA SER A 130 -1.682 7.791 27.147 1.00 43.04 H new ATOM 0 HB2 SER A 130 1.003 6.858 26.199 1.00 64.22 H new ATOM 0 HB3 SER A 130 -0.268 5.652 26.253 1.00 64.22 H new ATOM 0 HG SER A 130 -0.112 8.031 24.715 1.00 14.20 H new ATOM 2152 N LEU A 131 0.292 6.123 29.204 1.00 12.12 N ATOM 2153 CA LEU A 131 0.297 5.190 30.325 1.00 22.34 C ATOM 2154 C LEU A 131 -0.294 5.835 31.574 1.00 14.43 C ATOM 2155 O LEU A 131 -1.000 5.186 32.345 1.00 15.44 O ATOM 2156 CB LEU A 131 1.722 4.713 30.610 1.00 23.54 C ATOM 2157 CG LEU A 131 2.533 4.258 29.397 1.00 62.55 C ATOM 2158 CD1 LEU A 131 3.958 3.914 29.804 1.00 14.42 C ATOM 2159 CD2 LEU A 131 1.866 3.065 28.726 1.00 4.13 C ATOM 0 H LEU A 131 1.208 6.503 28.967 1.00 12.12 H new ATOM 0 HA LEU A 131 -0.320 4.333 30.055 1.00 22.34 H new ATOM 0 HB2 LEU A 131 2.263 5.522 31.101 1.00 23.54 H new ATOM 0 HB3 LEU A 131 1.672 3.887 31.319 1.00 23.54 H new ATOM 0 HG LEU A 131 2.570 5.079 28.681 1.00 62.55 H new ATOM 0 HD11 LEU A 131 4.519 3.592 28.927 1.00 14.42 H new ATOM 0 HD12 LEU A 131 4.435 4.793 30.238 1.00 14.42 H new ATOM 0 HD13 LEU A 131 3.942 3.110 30.540 1.00 14.42 H new ATOM 0 HD21 LEU A 131 2.457 2.755 27.864 1.00 4.13 H new ATOM 0 HD22 LEU A 131 1.797 2.240 29.435 1.00 4.13 H new ATOM 0 HD23 LEU A 131 0.865 3.345 28.397 1.00 4.13 H new