USER MOD reduce.3.24.130724 H: found=0, std=0, add=893, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 896 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 42 GLN : amide:sc= 0.0145 X(o=0.032,f=0) USER MOD Set 1.2: B 203 GLN :FLIP amide:sc= 0.0179 X(o=0,f=0.032) USER MOD Single : A 1 GLU N :NH3+ -178:sc= -0.0948 (180deg=-0.103) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= 0.997 K(o=1,f=0) USER MOD Single : A 9 ASN : amide:sc=-0.00904 K(o=-0.009,f=-0.83) USER MOD Single : A 12 SER OG : rot -33:sc= 0.101 USER MOD Single : A 13 TYR OH : rot 180:sc= -0.0627 USER MOD Single : A 15 ASN : amide:sc= -0.0569 K(o=-0.057,f=-0.64) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ -178:sc= 0.974 (180deg=0.943) USER MOD Single : A 19 THR OG1 : rot 72:sc= 0.786 USER MOD Single : A 24 HIS : no HD1:sc= -0.0896 X(o=-0.09,f=-0.09) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 36 HIS : no HD1:sc= -1.74 X(o=-1.7,f=-1.4) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 TYR OH : rot 130:sc= 0 USER MOD Single : A 39 GLN : amide:sc= 0.516 K(o=0.52,f=-0.31) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 HIS : no HE2:sc= 0.0114 X(o=0.011,f=-0.14) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 MET CE :methyl -155:sc= -2.53 (180deg=-4.56!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= 0.16 X(o=0.16,f=-0.017) USER MOD Single : A 69 GLN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 84 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0252) USER MOD Single : B 200 MET CE :methyl 174:sc= 0 (180deg=-0.0415) USER MOD Single : B 201 ASN : amide:sc= -0.0454 X(o=-0.045,f=-0.0037) USER MOD Single : B 204 MET CE :methyl 179:sc= 0 (180deg=-0.00109) USER MOD Single : B 211 TYR OH : rot 180:sc= 0 USER MOD Single : B 221 HIS : no HE2:sc= 1.15 K(o=1.2,f=-5.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 1 36.168 55.817 40.692 1.00 0.00 N ATOM 2 CA GLU A 1 37.104 54.858 40.062 1.00 0.00 C ATOM 3 C GLU A 1 36.450 53.597 39.613 1.00 0.00 C ATOM 4 O GLU A 1 37.062 52.785 38.919 1.00 0.00 O ATOM 5 CB GLU A 1 38.288 54.608 41.012 1.00 0.00 C ATOM 6 CG GLU A 1 39.576 54.149 40.326 1.00 0.00 C ATOM 7 CD GLU A 1 40.715 53.859 41.292 1.00 0.00 C ATOM 8 OE1 GLU A 1 40.818 54.538 42.348 1.00 0.00 O ATOM 9 OE2 GLU A 1 41.529 52.944 40.999 1.00 0.00 O ATOM 0 H1 GLU A 1 36.681 56.684 40.950 1.00 0.00 H new ATOM 0 H2 GLU A 1 35.407 56.051 40.022 1.00 0.00 H new ATOM 0 H3 GLU A 1 35.757 55.391 41.547 1.00 0.00 H new ATOM 0 HA GLU A 1 37.478 55.306 39.142 1.00 0.00 H new ATOM 0 HB2 GLU A 1 38.494 55.526 41.563 1.00 0.00 H new ATOM 0 HB3 GLU A 1 37.995 53.856 41.744 1.00 0.00 H new ATOM 0 HG2 GLU A 1 39.367 53.251 39.745 1.00 0.00 H new ATOM 0 HG3 GLU A 1 39.896 54.917 39.622 1.00 0.00 H new ATOM 18 N SER A 2 35.168 53.387 39.964 1.00 0.00 N ATOM 19 CA SER A 2 34.294 52.362 39.486 1.00 0.00 C ATOM 20 C SER A 2 34.567 51.003 40.033 1.00 0.00 C ATOM 21 O SER A 2 35.711 50.577 40.184 1.00 0.00 O ATOM 22 CB SER A 2 34.126 52.298 37.959 1.00 0.00 C ATOM 23 OG SER A 2 33.798 53.572 37.424 1.00 0.00 O ATOM 0 H SER A 2 34.704 53.990 40.643 1.00 0.00 H new ATOM 0 HA SER A 2 33.338 52.692 39.893 1.00 0.00 H new ATOM 0 HB2 SER A 2 35.048 51.936 37.504 1.00 0.00 H new ATOM 0 HB3 SER A 2 33.344 51.582 37.706 1.00 0.00 H new ATOM 0 HG SER A 2 33.699 53.503 36.452 1.00 0.00 H new ATOM 29 N ASP A 3 33.510 50.237 40.357 1.00 0.00 N ATOM 30 CA ASP A 3 33.643 48.893 40.826 1.00 0.00 C ATOM 31 C ASP A 3 33.616 47.956 39.667 1.00 0.00 C ATOM 32 O ASP A 3 32.606 47.804 38.982 1.00 0.00 O ATOM 33 CB ASP A 3 32.534 48.538 41.830 1.00 0.00 C ATOM 34 CG ASP A 3 32.824 49.095 43.216 1.00 0.00 C ATOM 35 OD1 ASP A 3 33.815 48.639 43.847 1.00 0.00 O ATOM 36 OD2 ASP A 3 32.013 49.911 43.731 1.00 0.00 O ATOM 0 H ASP A 3 32.544 50.558 40.292 1.00 0.00 H new ATOM 0 HA ASP A 3 34.597 48.801 41.345 1.00 0.00 H new ATOM 0 HB2 ASP A 3 31.582 48.930 41.473 1.00 0.00 H new ATOM 0 HB3 ASP A 3 32.430 47.455 41.888 1.00 0.00 H new ATOM 41 N SER A 4 34.758 47.297 39.403 1.00 0.00 N ATOM 42 CA SER A 4 34.975 46.446 38.275 1.00 0.00 C ATOM 43 C SER A 4 35.597 45.168 38.718 1.00 0.00 C ATOM 44 O SER A 4 36.403 44.546 38.027 1.00 0.00 O ATOM 45 CB SER A 4 35.963 47.075 37.278 1.00 0.00 C ATOM 46 OG SER A 4 35.456 48.271 36.705 1.00 0.00 O ATOM 0 H SER A 4 35.575 47.362 40.011 1.00 0.00 H new ATOM 0 HA SER A 4 34.003 46.290 37.806 1.00 0.00 H new ATOM 0 HB2 SER A 4 36.904 47.287 37.786 1.00 0.00 H new ATOM 0 HB3 SER A 4 36.183 46.359 36.486 1.00 0.00 H new ATOM 0 HG SER A 4 36.115 48.639 36.079 1.00 0.00 H new ATOM 52 N VAL A 5 35.217 44.711 39.925 1.00 0.00 N ATOM 53 CA VAL A 5 35.647 43.531 40.608 1.00 0.00 C ATOM 54 C VAL A 5 35.419 42.298 39.803 1.00 0.00 C ATOM 55 O VAL A 5 36.325 41.519 39.509 1.00 0.00 O ATOM 56 CB VAL A 5 34.901 43.359 41.897 1.00 0.00 C ATOM 57 CG1 VAL A 5 35.450 42.149 42.674 1.00 0.00 C ATOM 58 CG2 VAL A 5 35.005 44.654 42.721 1.00 0.00 C ATOM 0 H VAL A 5 34.534 45.227 40.479 1.00 0.00 H new ATOM 0 HA VAL A 5 36.714 43.662 40.786 1.00 0.00 H new ATOM 0 HB VAL A 5 33.849 43.164 41.691 1.00 0.00 H new ATOM 0 HG11 VAL A 5 34.899 42.036 43.608 1.00 0.00 H new ATOM 0 HG12 VAL A 5 35.334 41.247 42.073 1.00 0.00 H new ATOM 0 HG13 VAL A 5 36.506 42.306 42.893 1.00 0.00 H new ATOM 0 HG21 VAL A 5 34.464 44.533 43.659 1.00 0.00 H new ATOM 0 HG22 VAL A 5 36.053 44.868 42.932 1.00 0.00 H new ATOM 0 HG23 VAL A 5 34.572 45.480 42.157 1.00 0.00 H new ATOM 68 N GLU A 6 34.160 42.079 39.384 1.00 0.00 N ATOM 69 CA GLU A 6 33.774 40.851 38.762 1.00 0.00 C ATOM 70 C GLU A 6 34.225 40.762 37.345 1.00 0.00 C ATOM 71 O GLU A 6 34.436 39.689 36.782 1.00 0.00 O ATOM 72 CB GLU A 6 32.259 40.640 38.922 1.00 0.00 C ATOM 73 CG GLU A 6 31.382 41.519 38.027 1.00 0.00 C ATOM 74 CD GLU A 6 29.942 41.526 38.521 1.00 0.00 C ATOM 75 OE1 GLU A 6 29.366 40.425 38.735 1.00 0.00 O ATOM 76 OE2 GLU A 6 29.374 42.620 38.780 1.00 0.00 O ATOM 0 H GLU A 6 33.404 42.758 39.477 1.00 0.00 H new ATOM 0 HA GLU A 6 34.284 40.033 39.271 1.00 0.00 H new ATOM 0 HB2 GLU A 6 32.030 39.595 38.715 1.00 0.00 H new ATOM 0 HB3 GLU A 6 31.990 40.825 39.962 1.00 0.00 H new ATOM 0 HG2 GLU A 6 31.772 42.537 38.015 1.00 0.00 H new ATOM 0 HG3 GLU A 6 31.418 41.152 37.001 1.00 0.00 H new ATOM 83 N PHE A 7 34.518 41.940 36.764 1.00 0.00 N ATOM 84 CA PHE A 7 35.233 42.059 35.531 1.00 0.00 C ATOM 85 C PHE A 7 36.609 41.498 35.637 1.00 0.00 C ATOM 86 O PHE A 7 37.032 40.767 34.743 1.00 0.00 O ATOM 87 CB PHE A 7 35.235 43.525 35.067 1.00 0.00 C ATOM 88 CG PHE A 7 35.448 43.641 33.597 1.00 0.00 C ATOM 89 CD1 PHE A 7 34.514 43.133 32.726 1.00 0.00 C ATOM 90 CD2 PHE A 7 36.571 44.252 33.092 1.00 0.00 C ATOM 91 CE1 PHE A 7 34.685 43.248 31.366 1.00 0.00 C ATOM 92 CE2 PHE A 7 36.758 44.361 31.733 1.00 0.00 C ATOM 93 CZ PHE A 7 35.812 43.861 30.870 1.00 0.00 C ATOM 0 H PHE A 7 34.249 42.838 37.165 1.00 0.00 H new ATOM 0 HA PHE A 7 34.722 41.466 34.772 1.00 0.00 H new ATOM 0 HB2 PHE A 7 34.287 43.992 35.335 1.00 0.00 H new ATOM 0 HB3 PHE A 7 36.019 44.071 35.592 1.00 0.00 H new ATOM 0 HD1 PHE A 7 33.636 42.638 33.114 1.00 0.00 H new ATOM 0 HD2 PHE A 7 37.313 44.650 33.768 1.00 0.00 H new ATOM 0 HE1 PHE A 7 33.938 42.859 30.691 1.00 0.00 H new ATOM 0 HE2 PHE A 7 37.646 44.838 31.345 1.00 0.00 H new ATOM 0 HZ PHE A 7 35.954 43.949 29.803 1.00 0.00 H new ATOM 103 N ASN A 8 37.313 41.732 36.758 1.00 0.00 N ATOM 104 CA ASN A 8 38.627 41.270 37.079 1.00 0.00 C ATOM 105 C ASN A 8 38.633 39.845 37.512 1.00 0.00 C ATOM 106 O ASN A 8 39.604 39.126 37.277 1.00 0.00 O ATOM 107 CB ASN A 8 39.284 42.149 38.158 1.00 0.00 C ATOM 108 CG ASN A 8 39.949 43.369 37.536 1.00 0.00 C ATOM 109 OD1 ASN A 8 41.147 43.354 37.256 1.00 0.00 O ATOM 110 ND2 ASN A 8 39.181 44.470 37.321 1.00 0.00 N ATOM 0 H ASN A 8 36.923 42.299 37.510 1.00 0.00 H new ATOM 0 HA ASN A 8 39.211 41.345 36.162 1.00 0.00 H new ATOM 0 HB2 ASN A 8 38.532 42.468 38.880 1.00 0.00 H new ATOM 0 HB3 ASN A 8 40.024 41.566 38.706 1.00 0.00 H new ATOM 0 HD21 ASN A 8 39.596 45.310 36.918 1.00 0.00 H new ATOM 0 HD22 ASN A 8 38.190 44.456 37.562 1.00 0.00 H new ATOM 117 N ASN A 9 37.539 39.343 38.112 1.00 0.00 N ATOM 118 CA ASN A 9 37.316 37.955 38.379 1.00 0.00 C ATOM 119 C ASN A 9 37.225 37.153 37.128 1.00 0.00 C ATOM 120 O ASN A 9 37.641 35.996 37.077 1.00 0.00 O ATOM 121 CB ASN A 9 36.036 37.680 39.185 1.00 0.00 C ATOM 122 CG ASN A 9 36.090 38.274 40.586 1.00 0.00 C ATOM 123 OD1 ASN A 9 37.131 38.692 41.091 1.00 0.00 O ATOM 124 ND2 ASN A 9 34.914 38.305 41.266 1.00 0.00 N ATOM 0 H ASN A 9 36.771 39.935 38.427 1.00 0.00 H new ATOM 0 HA ASN A 9 38.183 37.658 38.970 1.00 0.00 H new ATOM 0 HB2 ASN A 9 35.179 38.092 38.652 1.00 0.00 H new ATOM 0 HB3 ASN A 9 35.879 36.604 39.256 1.00 0.00 H new ATOM 0 HD21 ASN A 9 34.883 38.680 42.214 1.00 0.00 H new ATOM 0 HD22 ASN A 9 34.062 37.953 40.828 1.00 0.00 H new ATOM 131 N ALA A 10 36.703 37.744 36.039 1.00 0.00 N ATOM 132 CA ALA A 10 36.739 37.152 34.738 1.00 0.00 C ATOM 133 C ALA A 10 38.112 37.115 34.160 1.00 0.00 C ATOM 134 O ALA A 10 38.534 36.085 33.639 1.00 0.00 O ATOM 135 CB ALA A 10 35.711 37.823 33.811 1.00 0.00 C ATOM 0 H ALA A 10 36.245 38.655 36.063 1.00 0.00 H new ATOM 0 HA ALA A 10 36.450 36.106 34.840 1.00 0.00 H new ATOM 0 HB1 ALA A 10 35.753 37.359 32.825 1.00 0.00 H new ATOM 0 HB2 ALA A 10 34.711 37.701 34.227 1.00 0.00 H new ATOM 0 HB3 ALA A 10 35.940 38.885 33.722 1.00 0.00 H new ATOM 141 N ILE A 11 38.897 38.199 34.291 1.00 0.00 N ATOM 142 CA ILE A 11 40.248 38.302 33.833 1.00 0.00 C ATOM 143 C ILE A 11 41.150 37.260 34.399 1.00 0.00 C ATOM 144 O ILE A 11 41.890 36.602 33.669 1.00 0.00 O ATOM 145 CB ILE A 11 40.896 39.613 34.169 1.00 0.00 C ATOM 146 CG1 ILE A 11 40.059 40.823 33.722 1.00 0.00 C ATOM 147 CG2 ILE A 11 42.278 39.766 33.511 1.00 0.00 C ATOM 148 CD1 ILE A 11 39.537 40.754 32.287 1.00 0.00 C ATOM 0 H ILE A 11 38.569 39.053 34.743 1.00 0.00 H new ATOM 0 HA ILE A 11 40.140 38.183 32.755 1.00 0.00 H new ATOM 0 HB ILE A 11 40.986 39.598 35.255 1.00 0.00 H new ATOM 0 HG12 ILE A 11 39.209 40.927 34.397 1.00 0.00 H new ATOM 0 HG13 ILE A 11 40.664 41.723 33.830 1.00 0.00 H new ATOM 0 HG21 ILE A 11 42.706 40.730 33.784 1.00 0.00 H new ATOM 0 HG22 ILE A 11 42.935 38.967 33.854 1.00 0.00 H new ATOM 0 HG23 ILE A 11 42.173 39.709 32.428 1.00 0.00 H new ATOM 0 HD11 ILE A 11 38.959 41.652 32.066 1.00 0.00 H new ATOM 0 HD12 ILE A 11 40.378 40.685 31.597 1.00 0.00 H new ATOM 0 HD13 ILE A 11 38.901 39.876 32.173 1.00 0.00 H new ATOM 160 N SER A 12 41.097 37.082 35.731 1.00 0.00 N ATOM 161 CA SER A 12 41.908 36.151 36.451 1.00 0.00 C ATOM 162 C SER A 12 41.797 34.754 35.945 1.00 0.00 C ATOM 163 O SER A 12 42.794 34.038 35.861 1.00 0.00 O ATOM 164 CB SER A 12 41.719 36.170 37.978 1.00 0.00 C ATOM 165 OG SER A 12 40.438 35.723 38.399 1.00 0.00 O ATOM 0 H SER A 12 40.462 37.609 36.331 1.00 0.00 H new ATOM 0 HA SER A 12 42.917 36.512 36.254 1.00 0.00 H new ATOM 0 HB2 SER A 12 42.483 35.543 38.438 1.00 0.00 H new ATOM 0 HB3 SER A 12 41.878 37.185 38.343 1.00 0.00 H new ATOM 0 HG SER A 12 39.768 35.969 37.727 1.00 0.00 H new ATOM 171 N TYR A 13 40.594 34.343 35.505 1.00 0.00 N ATOM 172 CA TYR A 13 40.349 33.039 34.973 1.00 0.00 C ATOM 173 C TYR A 13 41.013 32.837 33.655 1.00 0.00 C ATOM 174 O TYR A 13 41.807 31.912 33.489 1.00 0.00 O ATOM 175 CB TYR A 13 38.833 32.798 34.897 1.00 0.00 C ATOM 176 CG TYR A 13 38.510 31.376 34.592 1.00 0.00 C ATOM 177 CD1 TYR A 13 39.039 30.356 35.348 1.00 0.00 C ATOM 178 CD2 TYR A 13 37.700 31.071 33.524 1.00 0.00 C ATOM 179 CE1 TYR A 13 38.750 29.046 35.048 1.00 0.00 C ATOM 180 CE2 TYR A 13 37.429 29.761 33.207 1.00 0.00 C ATOM 181 CZ TYR A 13 37.952 28.745 33.970 1.00 0.00 C ATOM 182 OH TYR A 13 37.745 27.393 33.622 1.00 0.00 O ATOM 0 H TYR A 13 39.765 34.938 35.520 1.00 0.00 H new ATOM 0 HA TYR A 13 40.789 32.300 35.643 1.00 0.00 H new ATOM 0 HB2 TYR A 13 38.373 33.079 35.844 1.00 0.00 H new ATOM 0 HB3 TYR A 13 38.401 33.441 34.130 1.00 0.00 H new ATOM 0 HD1 TYR A 13 39.685 30.586 36.182 1.00 0.00 H new ATOM 0 HD2 TYR A 13 37.274 31.866 32.930 1.00 0.00 H new ATOM 0 HE1 TYR A 13 39.151 28.252 35.660 1.00 0.00 H new ATOM 0 HE2 TYR A 13 36.804 29.530 32.357 1.00 0.00 H new ATOM 0 HH TYR A 13 37.157 27.343 32.839 1.00 0.00 H new ATOM 192 N VAL A 14 40.764 33.715 32.665 1.00 0.00 N ATOM 193 CA VAL A 14 41.368 33.675 31.370 1.00 0.00 C ATOM 194 C VAL A 14 42.853 33.788 31.425 1.00 0.00 C ATOM 195 O VAL A 14 43.575 33.075 30.730 1.00 0.00 O ATOM 196 CB VAL A 14 40.832 34.742 30.462 1.00 0.00 C ATOM 197 CG1 VAL A 14 41.157 34.375 29.005 1.00 0.00 C ATOM 198 CG2 VAL A 14 39.301 34.843 30.573 1.00 0.00 C ATOM 0 H VAL A 14 40.110 34.490 32.774 1.00 0.00 H new ATOM 0 HA VAL A 14 41.108 32.697 30.965 1.00 0.00 H new ATOM 0 HB VAL A 14 41.288 35.689 30.751 1.00 0.00 H new ATOM 0 HG11 VAL A 14 40.770 35.147 28.340 1.00 0.00 H new ATOM 0 HG12 VAL A 14 42.237 34.298 28.881 1.00 0.00 H new ATOM 0 HG13 VAL A 14 40.695 33.419 28.759 1.00 0.00 H new ATOM 0 HG21 VAL A 14 38.938 35.624 29.905 1.00 0.00 H new ATOM 0 HG22 VAL A 14 38.852 33.890 30.294 1.00 0.00 H new ATOM 0 HG23 VAL A 14 39.026 35.087 31.599 1.00 0.00 H new ATOM 208 N ASN A 15 43.384 34.655 32.306 1.00 0.00 N ATOM 209 CA ASN A 15 44.785 34.715 32.587 1.00 0.00 C ATOM 210 C ASN A 15 45.375 33.447 33.104 1.00 0.00 C ATOM 211 O ASN A 15 46.394 33.003 32.578 1.00 0.00 O ATOM 212 CB ASN A 15 45.096 35.861 33.564 1.00 0.00 C ATOM 213 CG ASN A 15 46.530 36.365 33.470 1.00 0.00 C ATOM 214 OD1 ASN A 15 46.816 37.343 32.782 1.00 0.00 O ATOM 215 ND2 ASN A 15 47.480 35.700 34.181 1.00 0.00 N ATOM 0 H ASN A 15 42.829 35.328 32.834 1.00 0.00 H new ATOM 0 HA ASN A 15 45.255 34.896 31.620 1.00 0.00 H new ATOM 0 HB2 ASN A 15 44.414 36.689 33.369 1.00 0.00 H new ATOM 0 HB3 ASN A 15 44.904 35.522 34.582 1.00 0.00 H new ATOM 0 HD21 ASN A 15 48.451 36.011 34.150 1.00 0.00 H new ATOM 0 HD22 ASN A 15 47.221 34.891 34.746 1.00 0.00 H new ATOM 222 N LYS A 16 44.792 32.783 34.118 1.00 0.00 N ATOM 223 CA LYS A 16 45.254 31.517 34.596 1.00 0.00 C ATOM 224 C LYS A 16 45.275 30.451 33.554 1.00 0.00 C ATOM 225 O LYS A 16 46.214 29.661 33.465 1.00 0.00 O ATOM 226 CB LYS A 16 44.399 30.989 35.760 1.00 0.00 C ATOM 227 CG LYS A 16 44.656 31.675 37.104 1.00 0.00 C ATOM 228 CD LYS A 16 43.811 31.076 38.229 1.00 0.00 C ATOM 229 CE LYS A 16 44.271 29.674 38.631 1.00 0.00 C ATOM 230 NZ LYS A 16 43.408 29.089 39.683 1.00 0.00 N ATOM 0 H LYS A 16 43.977 33.136 34.619 1.00 0.00 H new ATOM 0 HA LYS A 16 46.274 31.721 34.922 1.00 0.00 H new ATOM 0 HB2 LYS A 16 43.346 31.107 35.503 1.00 0.00 H new ATOM 0 HB3 LYS A 16 44.582 29.920 35.872 1.00 0.00 H new ATOM 0 HG2 LYS A 16 45.712 31.587 37.359 1.00 0.00 H new ATOM 0 HG3 LYS A 16 44.437 32.739 37.015 1.00 0.00 H new ATOM 0 HD2 LYS A 16 43.855 31.731 39.099 1.00 0.00 H new ATOM 0 HD3 LYS A 16 42.769 31.035 37.913 1.00 0.00 H new ATOM 0 HE2 LYS A 16 44.266 29.025 37.755 1.00 0.00 H new ATOM 0 HE3 LYS A 16 45.300 29.718 38.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 43.754 28.139 39.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 43.433 29.694 40.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 42.431 29.023 39.333 1.00 0.00 H new ATOM 244 N ILE A 17 44.243 30.421 32.692 1.00 0.00 N ATOM 245 CA ILE A 17 44.131 29.568 31.550 1.00 0.00 C ATOM 246 C ILE A 17 45.257 29.778 30.597 1.00 0.00 C ATOM 247 O ILE A 17 45.903 28.817 30.184 1.00 0.00 O ATOM 248 CB ILE A 17 42.799 29.791 30.898 1.00 0.00 C ATOM 249 CG1 ILE A 17 41.698 29.176 31.779 1.00 0.00 C ATOM 250 CG2 ILE A 17 42.732 29.209 29.475 1.00 0.00 C ATOM 251 CD1 ILE A 17 40.281 29.529 31.328 1.00 0.00 C ATOM 0 H ILE A 17 43.434 31.033 32.801 1.00 0.00 H new ATOM 0 HA ILE A 17 44.195 28.529 31.873 1.00 0.00 H new ATOM 0 HB ILE A 17 42.649 30.866 30.802 1.00 0.00 H new ATOM 0 HG12 ILE A 17 41.810 28.092 31.781 1.00 0.00 H new ATOM 0 HG13 ILE A 17 41.837 29.512 32.806 1.00 0.00 H new ATOM 0 HG21 ILE A 17 41.746 29.399 29.050 1.00 0.00 H new ATOM 0 HG22 ILE A 17 43.492 29.681 28.853 1.00 0.00 H new ATOM 0 HG23 ILE A 17 42.910 28.134 29.513 1.00 0.00 H new ATOM 0 HD11 ILE A 17 39.559 29.060 31.997 1.00 0.00 H new ATOM 0 HD12 ILE A 17 40.150 30.611 31.354 1.00 0.00 H new ATOM 0 HD13 ILE A 17 40.122 29.168 30.312 1.00 0.00 H new ATOM 263 N LYS A 18 45.552 31.042 30.244 1.00 0.00 N ATOM 264 CA LYS A 18 46.609 31.420 29.358 1.00 0.00 C ATOM 265 C LYS A 18 47.968 31.102 29.880 1.00 0.00 C ATOM 266 O LYS A 18 48.817 30.614 29.135 1.00 0.00 O ATOM 267 CB LYS A 18 46.432 32.869 28.872 1.00 0.00 C ATOM 268 CG LYS A 18 47.329 33.970 29.442 1.00 0.00 C ATOM 269 CD LYS A 18 47.047 35.288 28.719 1.00 0.00 C ATOM 270 CE LYS A 18 47.450 36.554 29.478 1.00 0.00 C ATOM 271 NZ LYS A 18 48.895 36.568 29.797 1.00 0.00 N ATOM 0 H LYS A 18 45.025 31.842 30.595 1.00 0.00 H new ATOM 0 HA LYS A 18 46.531 30.791 28.471 1.00 0.00 H new ATOM 0 HB2 LYS A 18 46.563 32.869 27.790 1.00 0.00 H new ATOM 0 HB3 LYS A 18 45.399 33.155 29.068 1.00 0.00 H new ATOM 0 HG2 LYS A 18 47.147 34.084 30.511 1.00 0.00 H new ATOM 0 HG3 LYS A 18 48.377 33.696 29.324 1.00 0.00 H new ATOM 0 HD2 LYS A 18 47.570 35.277 27.763 1.00 0.00 H new ATOM 0 HD3 LYS A 18 45.981 35.341 28.499 1.00 0.00 H new ATOM 0 HE2 LYS A 18 47.201 37.431 28.880 1.00 0.00 H new ATOM 0 HE3 LYS A 18 46.874 36.624 30.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 49.122 37.425 30.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 49.134 35.727 30.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 49.445 36.562 28.915 1.00 0.00 H new ATOM 285 N THR A 19 48.220 31.285 31.188 1.00 0.00 N ATOM 286 CA THR A 19 49.424 30.901 31.857 1.00 0.00 C ATOM 287 C THR A 19 49.688 29.435 31.835 1.00 0.00 C ATOM 288 O THR A 19 50.824 28.998 31.658 1.00 0.00 O ATOM 289 CB THR A 19 49.423 31.329 33.295 1.00 0.00 C ATOM 290 OG1 THR A 19 49.117 32.708 33.434 1.00 0.00 O ATOM 291 CG2 THR A 19 50.823 31.178 33.913 1.00 0.00 C ATOM 0 H THR A 19 47.545 31.726 31.813 1.00 0.00 H new ATOM 0 HA THR A 19 50.209 31.408 31.296 1.00 0.00 H new ATOM 0 HB THR A 19 48.680 30.700 33.785 1.00 0.00 H new ATOM 0 HG1 THR A 19 48.167 32.853 33.244 1.00 0.00 H new ATOM 0 HG21 THR A 19 50.797 31.495 34.956 1.00 0.00 H new ATOM 0 HG22 THR A 19 51.134 30.135 33.858 1.00 0.00 H new ATOM 0 HG23 THR A 19 51.532 31.797 33.364 1.00 0.00 H new ATOM 299 N ARG A 20 48.665 28.576 31.998 1.00 0.00 N ATOM 300 CA ARG A 20 48.839 27.169 31.807 1.00 0.00 C ATOM 301 C ARG A 20 49.005 26.778 30.379 1.00 0.00 C ATOM 302 O ARG A 20 49.864 25.965 30.040 1.00 0.00 O ATOM 303 CB ARG A 20 47.645 26.409 32.409 1.00 0.00 C ATOM 304 CG ARG A 20 47.688 26.206 33.924 1.00 0.00 C ATOM 305 CD ARG A 20 48.770 25.229 34.390 1.00 0.00 C ATOM 306 NE ARG A 20 48.341 24.717 35.721 1.00 0.00 N ATOM 307 CZ ARG A 20 49.145 24.057 36.605 1.00 0.00 C ATOM 308 NH1 ARG A 20 50.482 23.859 36.413 1.00 0.00 N ATOM 309 NH2 ARG A 20 48.585 23.534 37.734 1.00 0.00 N ATOM 0 H ARG A 20 47.720 28.855 32.261 1.00 0.00 H new ATOM 0 HA ARG A 20 49.764 26.902 32.317 1.00 0.00 H new ATOM 0 HB2 ARG A 20 46.731 26.947 32.158 1.00 0.00 H new ATOM 0 HB3 ARG A 20 47.581 25.432 31.931 1.00 0.00 H new ATOM 0 HG2 ARG A 20 47.852 27.170 34.405 1.00 0.00 H new ATOM 0 HG3 ARG A 20 46.716 25.843 34.260 1.00 0.00 H new ATOM 0 HD2 ARG A 20 48.884 24.411 33.679 1.00 0.00 H new ATOM 0 HD3 ARG A 20 49.737 25.727 34.460 1.00 0.00 H new ATOM 0 HE ARG A 20 47.370 24.872 35.993 1.00 0.00 H new ATOM 0 HH11 ARG A 20 50.934 24.213 35.570 1.00 0.00 H new ATOM 0 HH12 ARG A 20 51.029 23.357 37.113 1.00 0.00 H new ATOM 0 HH21 ARG A 20 47.585 23.640 37.903 1.00 0.00 H new ATOM 0 HH22 ARG A 20 49.167 23.037 38.409 1.00 0.00 H new ATOM 323 N PHE A 21 48.208 27.338 29.451 1.00 0.00 N ATOM 324 CA PHE A 21 48.255 27.001 28.062 1.00 0.00 C ATOM 325 C PHE A 21 49.281 27.754 27.286 1.00 0.00 C ATOM 326 O PHE A 21 49.042 28.213 26.170 1.00 0.00 O ATOM 327 CB PHE A 21 46.883 27.185 27.393 1.00 0.00 C ATOM 328 CG PHE A 21 45.846 26.218 27.854 1.00 0.00 C ATOM 329 CD1 PHE A 21 46.103 24.903 28.163 1.00 0.00 C ATOM 330 CD2 PHE A 21 44.544 26.658 27.883 1.00 0.00 C ATOM 331 CE1 PHE A 21 45.089 24.045 28.517 1.00 0.00 C ATOM 332 CE2 PHE A 21 43.521 25.811 28.240 1.00 0.00 C ATOM 333 CZ PHE A 21 43.791 24.500 28.560 1.00 0.00 C ATOM 0 H PHE A 21 47.509 28.047 29.674 1.00 0.00 H new ATOM 0 HA PHE A 21 48.544 25.950 28.043 1.00 0.00 H new ATOM 0 HB2 PHE A 21 46.530 28.198 27.585 1.00 0.00 H new ATOM 0 HB3 PHE A 21 47.001 27.088 26.314 1.00 0.00 H new ATOM 0 HD1 PHE A 21 47.119 24.538 28.127 1.00 0.00 H new ATOM 0 HD2 PHE A 21 44.322 27.682 27.622 1.00 0.00 H new ATOM 0 HE1 PHE A 21 45.310 23.016 28.761 1.00 0.00 H new ATOM 0 HE2 PHE A 21 42.505 26.175 28.269 1.00 0.00 H new ATOM 0 HZ PHE A 21 42.990 23.833 28.843 1.00 0.00 H new ATOM 343 N LEU A 22 50.521 27.825 27.804 1.00 0.00 N ATOM 344 CA LEU A 22 51.662 28.281 27.072 1.00 0.00 C ATOM 345 C LEU A 22 52.217 27.172 26.245 1.00 0.00 C ATOM 346 O LEU A 22 52.592 27.336 25.085 1.00 0.00 O ATOM 347 CB LEU A 22 52.741 28.876 27.992 1.00 0.00 C ATOM 348 CG LEU A 22 52.194 30.073 28.787 1.00 0.00 C ATOM 349 CD1 LEU A 22 53.242 30.483 29.835 1.00 0.00 C ATOM 350 CD2 LEU A 22 51.794 31.300 27.952 1.00 0.00 C ATOM 0 H LEU A 22 50.736 27.556 28.764 1.00 0.00 H new ATOM 0 HA LEU A 22 51.334 29.084 26.412 1.00 0.00 H new ATOM 0 HB2 LEU A 22 53.098 28.111 28.681 1.00 0.00 H new ATOM 0 HB3 LEU A 22 53.597 29.192 27.396 1.00 0.00 H new ATOM 0 HG LEU A 22 51.264 29.730 29.240 1.00 0.00 H new ATOM 0 HD11 LEU A 22 52.870 31.332 30.409 1.00 0.00 H new ATOM 0 HD12 LEU A 22 53.431 29.646 30.507 1.00 0.00 H new ATOM 0 HD13 LEU A 22 54.168 30.762 29.333 1.00 0.00 H new ATOM 0 HD21 LEU A 22 51.422 32.084 28.612 1.00 0.00 H new ATOM 0 HD22 LEU A 22 52.663 31.667 27.406 1.00 0.00 H new ATOM 0 HD23 LEU A 22 51.013 31.020 27.245 1.00 0.00 H new ATOM 362 N ASP A 23 52.211 25.959 26.824 1.00 0.00 N ATOM 363 CA ASP A 23 52.571 24.739 26.171 1.00 0.00 C ATOM 364 C ASP A 23 51.499 24.214 25.281 1.00 0.00 C ATOM 365 O ASP A 23 51.695 23.223 24.579 1.00 0.00 O ATOM 366 CB ASP A 23 52.953 23.680 27.220 1.00 0.00 C ATOM 367 CG ASP A 23 54.223 24.069 27.963 1.00 0.00 C ATOM 368 OD1 ASP A 23 54.168 24.940 28.872 1.00 0.00 O ATOM 369 OD2 ASP A 23 55.296 23.479 27.667 1.00 0.00 O ATOM 0 H ASP A 23 51.941 25.822 27.798 1.00 0.00 H new ATOM 0 HA ASP A 23 53.426 24.961 25.532 1.00 0.00 H new ATOM 0 HB2 ASP A 23 52.136 23.559 27.931 1.00 0.00 H new ATOM 0 HB3 ASP A 23 53.096 22.716 26.731 1.00 0.00 H new ATOM 374 N HIS A 24 50.312 24.847 25.247 1.00 0.00 N ATOM 375 CA HIS A 24 49.227 24.461 24.397 1.00 0.00 C ATOM 376 C HIS A 24 48.536 25.665 23.860 1.00 0.00 C ATOM 377 O HIS A 24 47.391 25.900 24.245 1.00 0.00 O ATOM 378 CB HIS A 24 48.216 23.561 25.128 1.00 0.00 C ATOM 379 CG HIS A 24 48.836 22.288 25.621 1.00 0.00 C ATOM 380 ND1 HIS A 24 49.156 22.064 26.934 1.00 0.00 N ATOM 381 CD2 HIS A 24 49.263 21.202 24.922 1.00 0.00 C ATOM 382 CE1 HIS A 24 49.748 20.889 27.036 1.00 0.00 C ATOM 383 NE2 HIS A 24 49.830 20.352 25.834 1.00 0.00 N ATOM 0 H HIS A 24 50.100 25.656 25.831 1.00 0.00 H new ATOM 0 HA HIS A 24 49.650 23.887 23.573 1.00 0.00 H new ATOM 0 HB2 HIS A 24 47.792 24.106 25.971 1.00 0.00 H new ATOM 0 HB3 HIS A 24 47.392 23.324 24.455 1.00 0.00 H new ATOM 0 HD2 HIS A 24 49.173 21.042 23.858 1.00 0.00 H new ATOM 0 HE1 HIS A 24 50.106 20.441 27.951 1.00 0.00 H new ATOM 0 HE2 HIS A 24 50.249 19.447 25.618 1.00 0.00 H new ATOM 392 N PRO A 25 49.065 26.475 22.992 1.00 0.00 N ATOM 393 CA PRO A 25 48.467 27.729 22.640 1.00 0.00 C ATOM 394 C PRO A 25 47.286 27.591 21.742 1.00 0.00 C ATOM 395 O PRO A 25 46.607 28.582 21.470 1.00 0.00 O ATOM 396 CB PRO A 25 49.596 28.485 21.942 1.00 0.00 C ATOM 397 CG PRO A 25 50.439 27.378 21.290 1.00 0.00 C ATOM 398 CD PRO A 25 50.347 26.259 22.338 1.00 0.00 C ATOM 0 HA PRO A 25 48.074 28.240 23.519 1.00 0.00 H new ATOM 0 HB2 PRO A 25 49.209 29.182 21.199 1.00 0.00 H new ATOM 0 HB3 PRO A 25 50.183 29.068 22.651 1.00 0.00 H new ATOM 0 HG2 PRO A 25 50.035 27.070 20.326 1.00 0.00 H new ATOM 0 HG3 PRO A 25 51.468 27.694 21.118 1.00 0.00 H new ATOM 0 HD2 PRO A 25 50.394 25.275 21.872 1.00 0.00 H new ATOM 0 HD3 PRO A 25 51.170 26.314 23.050 1.00 0.00 H new ATOM 406 N GLU A 26 46.967 26.370 21.279 1.00 0.00 N ATOM 407 CA GLU A 26 45.908 26.090 20.359 1.00 0.00 C ATOM 408 C GLU A 26 44.584 26.062 21.040 1.00 0.00 C ATOM 409 O GLU A 26 43.535 26.233 20.420 1.00 0.00 O ATOM 410 CB GLU A 26 46.179 24.799 19.567 1.00 0.00 C ATOM 411 CG GLU A 26 46.167 23.500 20.376 1.00 0.00 C ATOM 412 CD GLU A 26 46.585 22.289 19.554 1.00 0.00 C ATOM 413 OE1 GLU A 26 46.437 22.300 18.303 1.00 0.00 O ATOM 414 OE2 GLU A 26 47.097 21.311 20.161 1.00 0.00 O ATOM 0 H GLU A 26 47.476 25.532 21.562 1.00 0.00 H new ATOM 0 HA GLU A 26 45.874 26.906 19.637 1.00 0.00 H new ATOM 0 HB2 GLU A 26 45.433 24.718 18.776 1.00 0.00 H new ATOM 0 HB3 GLU A 26 47.150 24.892 19.081 1.00 0.00 H new ATOM 0 HG2 GLU A 26 46.837 23.603 21.230 1.00 0.00 H new ATOM 0 HG3 GLU A 26 45.166 23.335 20.775 1.00 0.00 H new ATOM 421 N ILE A 27 44.563 25.888 22.374 1.00 0.00 N ATOM 422 CA ILE A 27 43.368 25.892 23.159 1.00 0.00 C ATOM 423 C ILE A 27 42.761 27.253 23.167 1.00 0.00 C ATOM 424 O ILE A 27 41.541 27.405 23.155 1.00 0.00 O ATOM 425 CB ILE A 27 43.543 25.447 24.580 1.00 0.00 C ATOM 426 CG1 ILE A 27 44.585 24.354 24.876 1.00 0.00 C ATOM 427 CG2 ILE A 27 42.189 24.912 25.075 1.00 0.00 C ATOM 428 CD1 ILE A 27 44.740 23.260 23.821 1.00 0.00 C ATOM 0 H ILE A 27 45.408 25.739 22.925 1.00 0.00 H new ATOM 0 HA ILE A 27 42.718 25.161 22.678 1.00 0.00 H new ATOM 0 HB ILE A 27 43.917 26.337 25.087 1.00 0.00 H new ATOM 0 HG12 ILE A 27 45.554 24.834 25.015 1.00 0.00 H new ATOM 0 HG13 ILE A 27 44.325 23.881 25.823 1.00 0.00 H new ATOM 0 HG21 ILE A 27 42.285 24.580 26.109 1.00 0.00 H new ATOM 0 HG22 ILE A 27 41.442 25.703 25.016 1.00 0.00 H new ATOM 0 HG23 ILE A 27 41.879 24.073 24.452 1.00 0.00 H new ATOM 0 HD11 ILE A 27 45.502 22.550 24.142 1.00 0.00 H new ATOM 0 HD12 ILE A 27 43.790 22.740 23.693 1.00 0.00 H new ATOM 0 HD13 ILE A 27 45.039 23.708 22.873 1.00 0.00 H new ATOM 440 N TYR A 28 43.596 28.307 23.123 1.00 0.00 N ATOM 441 CA TYR A 28 43.197 29.681 23.134 1.00 0.00 C ATOM 442 C TYR A 28 42.413 30.085 21.933 1.00 0.00 C ATOM 443 O TYR A 28 41.665 31.061 21.954 1.00 0.00 O ATOM 444 CB TYR A 28 44.425 30.584 23.338 1.00 0.00 C ATOM 445 CG TYR A 28 44.058 31.834 24.062 1.00 0.00 C ATOM 446 CD1 TYR A 28 44.069 31.859 25.437 1.00 0.00 C ATOM 447 CD2 TYR A 28 43.686 32.967 23.377 1.00 0.00 C ATOM 448 CE1 TYR A 28 43.711 32.998 26.118 1.00 0.00 C ATOM 449 CE2 TYR A 28 43.322 34.110 24.049 1.00 0.00 C ATOM 450 CZ TYR A 28 43.341 34.127 25.424 1.00 0.00 C ATOM 451 OH TYR A 28 43.012 35.307 26.123 1.00 0.00 O ATOM 0 H TYR A 28 44.609 28.193 23.077 1.00 0.00 H new ATOM 0 HA TYR A 28 42.516 29.807 23.976 1.00 0.00 H new ATOM 0 HB2 TYR A 28 45.187 30.045 23.900 1.00 0.00 H new ATOM 0 HB3 TYR A 28 44.860 30.835 22.371 1.00 0.00 H new ATOM 0 HD1 TYR A 28 44.361 30.976 25.986 1.00 0.00 H new ATOM 0 HD2 TYR A 28 43.680 32.959 22.297 1.00 0.00 H new ATOM 0 HE1 TYR A 28 43.720 33.007 27.198 1.00 0.00 H new ATOM 0 HE2 TYR A 28 43.023 34.990 23.500 1.00 0.00 H new ATOM 0 HH TYR A 28 42.774 36.011 25.484 1.00 0.00 H new ATOM 461 N ARG A 29 42.484 29.331 20.820 1.00 0.00 N ATOM 462 CA ARG A 29 41.518 29.442 19.771 1.00 0.00 C ATOM 463 C ARG A 29 40.235 28.772 20.127 1.00 0.00 C ATOM 464 O ARG A 29 39.186 29.408 20.206 1.00 0.00 O ATOM 465 CB ARG A 29 42.085 28.861 18.465 1.00 0.00 C ATOM 466 CG ARG A 29 42.021 29.814 17.270 1.00 0.00 C ATOM 467 CD ARG A 29 40.621 30.258 16.842 1.00 0.00 C ATOM 468 NE ARG A 29 40.750 30.811 15.464 1.00 0.00 N ATOM 469 CZ ARG A 29 40.200 31.966 14.989 1.00 0.00 C ATOM 470 NH1 ARG A 29 39.439 32.816 15.738 1.00 0.00 N ATOM 471 NH2 ARG A 29 40.423 32.266 13.676 1.00 0.00 N ATOM 0 H ARG A 29 43.215 28.641 20.647 1.00 0.00 H new ATOM 0 HA ARG A 29 41.303 30.501 19.627 1.00 0.00 H new ATOM 0 HB2 ARG A 29 43.123 28.574 18.630 1.00 0.00 H new ATOM 0 HB3 ARG A 29 41.538 27.951 18.218 1.00 0.00 H new ATOM 0 HG2 ARG A 29 42.606 30.703 17.507 1.00 0.00 H new ATOM 0 HG3 ARG A 29 42.504 29.332 16.420 1.00 0.00 H new ATOM 0 HD2 ARG A 29 39.927 29.418 16.859 1.00 0.00 H new ATOM 0 HD3 ARG A 29 40.228 31.010 17.526 1.00 0.00 H new ATOM 0 HE ARG A 29 41.309 30.268 14.806 1.00 0.00 H new ATOM 0 HH11 ARG A 29 39.251 32.603 16.718 1.00 0.00 H new ATOM 0 HH12 ARG A 29 39.058 33.664 15.318 1.00 0.00 H new ATOM 0 HH21 ARG A 29 40.980 31.638 13.097 1.00 0.00 H new ATOM 0 HH22 ARG A 29 40.033 33.118 13.274 1.00 0.00 H new ATOM 485 N SER A 30 40.250 27.452 20.390 1.00 0.00 N ATOM 486 CA SER A 30 39.084 26.627 20.344 1.00 0.00 C ATOM 487 C SER A 30 38.220 26.714 21.555 1.00 0.00 C ATOM 488 O SER A 30 37.004 26.536 21.491 1.00 0.00 O ATOM 489 CB SER A 30 39.488 25.176 20.029 1.00 0.00 C ATOM 490 OG SER A 30 38.401 24.418 19.519 1.00 0.00 O ATOM 0 H SER A 30 41.098 26.945 20.642 1.00 0.00 H new ATOM 0 HA SER A 30 38.458 27.013 19.540 1.00 0.00 H new ATOM 0 HB2 SER A 30 40.301 25.176 19.304 1.00 0.00 H new ATOM 0 HB3 SER A 30 39.868 24.701 20.934 1.00 0.00 H new ATOM 0 HG SER A 30 38.700 23.504 19.331 1.00 0.00 H new ATOM 496 N PHE A 31 38.791 27.074 22.718 1.00 0.00 N ATOM 497 CA PHE A 31 38.083 27.392 23.920 1.00 0.00 C ATOM 498 C PHE A 31 37.032 28.438 23.767 1.00 0.00 C ATOM 499 O PHE A 31 35.866 28.237 24.101 1.00 0.00 O ATOM 500 CB PHE A 31 39.145 27.828 24.944 1.00 0.00 C ATOM 501 CG PHE A 31 38.660 28.330 26.261 1.00 0.00 C ATOM 502 CD1 PHE A 31 37.640 27.700 26.932 1.00 0.00 C ATOM 503 CD2 PHE A 31 39.255 29.435 26.823 1.00 0.00 C ATOM 504 CE1 PHE A 31 37.187 28.186 28.135 1.00 0.00 C ATOM 505 CE2 PHE A 31 38.815 29.923 28.031 1.00 0.00 C ATOM 506 CZ PHE A 31 37.786 29.293 28.690 1.00 0.00 C ATOM 0 H PHE A 31 39.803 27.147 22.826 1.00 0.00 H new ATOM 0 HA PHE A 31 37.528 26.510 24.240 1.00 0.00 H new ATOM 0 HB2 PHE A 31 39.804 26.980 25.128 1.00 0.00 H new ATOM 0 HB3 PHE A 31 39.752 28.610 24.488 1.00 0.00 H new ATOM 0 HD1 PHE A 31 37.190 26.814 26.510 1.00 0.00 H new ATOM 0 HD2 PHE A 31 40.073 29.922 26.313 1.00 0.00 H new ATOM 0 HE1 PHE A 31 36.365 27.702 28.642 1.00 0.00 H new ATOM 0 HE2 PHE A 31 39.277 30.799 28.461 1.00 0.00 H new ATOM 0 HZ PHE A 31 37.447 29.668 29.645 1.00 0.00 H new ATOM 516 N LEU A 32 37.410 29.616 23.241 1.00 0.00 N ATOM 517 CA LEU A 32 36.561 30.761 23.133 1.00 0.00 C ATOM 518 C LEU A 32 35.501 30.575 22.101 1.00 0.00 C ATOM 519 O LEU A 32 34.366 31.027 22.244 1.00 0.00 O ATOM 520 CB LEU A 32 37.341 32.011 22.693 1.00 0.00 C ATOM 521 CG LEU A 32 38.741 32.145 23.316 1.00 0.00 C ATOM 522 CD1 LEU A 32 39.525 33.125 22.426 1.00 0.00 C ATOM 523 CD2 LEU A 32 38.714 32.572 24.793 1.00 0.00 C ATOM 0 H LEU A 32 38.348 29.777 22.875 1.00 0.00 H new ATOM 0 HA LEU A 32 36.131 30.885 24.127 1.00 0.00 H new ATOM 0 HB2 LEU A 32 37.441 31.998 21.608 1.00 0.00 H new ATOM 0 HB3 LEU A 32 36.758 32.896 22.949 1.00 0.00 H new ATOM 0 HG LEU A 32 39.232 31.172 23.343 1.00 0.00 H new ATOM 0 HD11 LEU A 32 40.530 33.256 22.826 1.00 0.00 H new ATOM 0 HD12 LEU A 32 39.587 32.727 21.413 1.00 0.00 H new ATOM 0 HD13 LEU A 32 39.014 34.088 22.407 1.00 0.00 H new ATOM 0 HD21 LEU A 32 39.734 32.647 25.169 1.00 0.00 H new ATOM 0 HD22 LEU A 32 38.222 33.541 24.883 1.00 0.00 H new ATOM 0 HD23 LEU A 32 38.166 31.831 25.376 1.00 0.00 H new ATOM 535 N GLU A 33 35.872 29.907 20.995 1.00 0.00 N ATOM 536 CA GLU A 33 34.992 29.417 19.981 1.00 0.00 C ATOM 537 C GLU A 33 33.771 28.717 20.471 1.00 0.00 C ATOM 538 O GLU A 33 32.663 29.024 20.035 1.00 0.00 O ATOM 539 CB GLU A 33 35.724 28.509 18.978 1.00 0.00 C ATOM 540 CG GLU A 33 36.771 29.216 18.115 1.00 0.00 C ATOM 541 CD GLU A 33 36.163 30.095 17.031 1.00 0.00 C ATOM 542 OE1 GLU A 33 35.617 31.184 17.352 1.00 0.00 O ATOM 543 OE2 GLU A 33 36.229 29.708 15.833 1.00 0.00 O ATOM 0 H GLU A 33 36.850 29.696 20.797 1.00 0.00 H new ATOM 0 HA GLU A 33 34.646 30.327 19.491 1.00 0.00 H new ATOM 0 HB2 GLU A 33 36.211 27.703 19.528 1.00 0.00 H new ATOM 0 HB3 GLU A 33 34.986 28.047 18.323 1.00 0.00 H new ATOM 0 HG2 GLU A 33 37.407 29.828 18.755 1.00 0.00 H new ATOM 0 HG3 GLU A 33 37.413 28.468 17.649 1.00 0.00 H new ATOM 550 N ILE A 34 33.890 27.793 21.442 1.00 0.00 N ATOM 551 CA ILE A 34 32.793 27.134 22.078 1.00 0.00 C ATOM 552 C ILE A 34 31.924 28.085 22.827 1.00 0.00 C ATOM 553 O ILE A 34 30.703 28.052 22.687 1.00 0.00 O ATOM 554 CB ILE A 34 33.301 25.997 22.917 1.00 0.00 C ATOM 555 CG1 ILE A 34 34.004 24.947 22.040 1.00 0.00 C ATOM 556 CG2 ILE A 34 32.146 25.351 23.699 1.00 0.00 C ATOM 557 CD1 ILE A 34 34.837 23.938 22.828 1.00 0.00 C ATOM 0 H ILE A 34 34.796 27.492 21.800 1.00 0.00 H new ATOM 0 HA ILE A 34 32.144 26.709 21.313 1.00 0.00 H new ATOM 0 HB ILE A 34 34.026 26.393 23.628 1.00 0.00 H new ATOM 0 HG12 ILE A 34 33.253 24.410 21.461 1.00 0.00 H new ATOM 0 HG13 ILE A 34 34.650 25.458 21.326 1.00 0.00 H new ATOM 0 HG21 ILE A 34 32.530 24.529 24.302 1.00 0.00 H new ATOM 0 HG22 ILE A 34 31.687 26.095 24.350 1.00 0.00 H new ATOM 0 HG23 ILE A 34 31.401 24.971 23.000 1.00 0.00 H new ATOM 0 HD11 ILE A 34 35.300 23.232 22.139 1.00 0.00 H new ATOM 0 HD12 ILE A 34 35.613 24.463 23.386 1.00 0.00 H new ATOM 0 HD13 ILE A 34 34.193 23.398 23.523 1.00 0.00 H new ATOM 569 N LEU A 35 32.477 29.036 23.601 1.00 0.00 N ATOM 570 CA LEU A 35 31.711 30.048 24.259 1.00 0.00 C ATOM 571 C LEU A 35 30.970 30.955 23.336 1.00 0.00 C ATOM 572 O LEU A 35 29.823 31.330 23.575 1.00 0.00 O ATOM 573 CB LEU A 35 32.612 30.914 25.155 1.00 0.00 C ATOM 574 CG LEU A 35 33.679 30.204 26.005 1.00 0.00 C ATOM 575 CD1 LEU A 35 33.939 31.033 27.274 1.00 0.00 C ATOM 576 CD2 LEU A 35 33.395 28.814 26.602 1.00 0.00 C ATOM 0 H LEU A 35 33.480 29.103 23.773 1.00 0.00 H new ATOM 0 HA LEU A 35 30.973 29.501 24.845 1.00 0.00 H new ATOM 0 HB2 LEU A 35 33.120 31.638 24.518 1.00 0.00 H new ATOM 0 HB3 LEU A 35 31.969 31.479 25.830 1.00 0.00 H new ATOM 0 HG LEU A 35 34.473 30.095 25.266 1.00 0.00 H new ATOM 0 HD11 LEU A 35 34.695 30.538 27.884 1.00 0.00 H new ATOM 0 HD12 LEU A 35 34.292 32.026 26.994 1.00 0.00 H new ATOM 0 HD13 LEU A 35 33.015 31.124 27.845 1.00 0.00 H new ATOM 0 HD21 LEU A 35 34.263 28.477 27.168 1.00 0.00 H new ATOM 0 HD22 LEU A 35 32.531 28.872 27.263 1.00 0.00 H new ATOM 0 HD23 LEU A 35 33.190 28.108 25.798 1.00 0.00 H new ATOM 588 N HIS A 36 31.593 31.324 22.203 1.00 0.00 N ATOM 589 CA HIS A 36 30.998 32.104 21.162 1.00 0.00 C ATOM 590 C HIS A 36 29.815 31.437 20.547 1.00 0.00 C ATOM 591 O HIS A 36 28.854 32.113 20.186 1.00 0.00 O ATOM 592 CB HIS A 36 31.959 32.386 19.996 1.00 0.00 C ATOM 593 CG HIS A 36 33.127 33.287 20.276 1.00 0.00 C ATOM 594 ND1 HIS A 36 32.978 34.636 20.458 1.00 0.00 N ATOM 595 CD2 HIS A 36 34.462 33.055 20.166 1.00 0.00 C ATOM 596 CE1 HIS A 36 34.170 35.205 20.468 1.00 0.00 C ATOM 597 NE2 HIS A 36 35.085 34.268 20.303 1.00 0.00 N ATOM 0 H HIS A 36 32.559 31.066 22.003 1.00 0.00 H new ATOM 0 HA HIS A 36 30.715 33.027 21.668 1.00 0.00 H new ATOM 0 HB2 HIS A 36 32.346 31.432 19.638 1.00 0.00 H new ATOM 0 HB3 HIS A 36 31.383 32.823 19.180 1.00 0.00 H new ATOM 0 HD2 HIS A 36 34.939 32.100 20.002 1.00 0.00 H new ATOM 0 HE1 HIS A 36 34.364 36.260 20.591 1.00 0.00 H new ATOM 0 HE2 HIS A 36 36.093 34.422 20.281 1.00 0.00 H new ATOM 606 N THR A 37 29.799 30.097 20.445 1.00 0.00 N ATOM 607 CA THR A 37 28.684 29.320 19.998 1.00 0.00 C ATOM 608 C THR A 37 27.427 29.548 20.764 1.00 0.00 C ATOM 609 O THR A 37 26.325 29.458 20.225 1.00 0.00 O ATOM 610 CB THR A 37 29.037 27.874 19.815 1.00 0.00 C ATOM 611 OG1 THR A 37 29.153 27.588 18.429 1.00 0.00 O ATOM 612 CG2 THR A 37 28.038 26.861 20.398 1.00 0.00 C ATOM 0 H THR A 37 30.607 29.524 20.687 1.00 0.00 H new ATOM 0 HA THR A 37 28.443 29.698 19.004 1.00 0.00 H new ATOM 0 HB THR A 37 29.970 27.753 20.366 1.00 0.00 H new ATOM 0 HG1 THR A 37 29.385 26.644 18.308 1.00 0.00 H new ATOM 0 HG21 THR A 37 28.394 25.848 20.208 1.00 0.00 H new ATOM 0 HG22 THR A 37 27.946 27.018 21.473 1.00 0.00 H new ATOM 0 HG23 THR A 37 27.064 26.998 19.927 1.00 0.00 H new ATOM 620 N TYR A 38 27.528 29.964 22.040 1.00 0.00 N ATOM 621 CA TYR A 38 26.426 30.546 22.740 1.00 0.00 C ATOM 622 C TYR A 38 26.213 31.983 22.408 1.00 0.00 C ATOM 623 O TYR A 38 25.138 32.370 21.954 1.00 0.00 O ATOM 624 CB TYR A 38 26.502 30.217 24.240 1.00 0.00 C ATOM 625 CG TYR A 38 26.407 31.315 25.242 1.00 0.00 C ATOM 626 CD1 TYR A 38 25.198 31.900 25.537 1.00 0.00 C ATOM 627 CD2 TYR A 38 27.552 31.764 25.855 1.00 0.00 C ATOM 628 CE1 TYR A 38 25.131 32.922 26.454 1.00 0.00 C ATOM 629 CE2 TYR A 38 27.490 32.829 26.722 1.00 0.00 C ATOM 630 CZ TYR A 38 26.278 33.389 27.052 1.00 0.00 C ATOM 631 OH TYR A 38 26.281 34.421 28.014 1.00 0.00 O ATOM 0 H TYR A 38 28.383 29.896 22.591 1.00 0.00 H new ATOM 0 HA TYR A 38 25.507 30.081 22.383 1.00 0.00 H new ATOM 0 HB2 TYR A 38 25.704 29.507 24.458 1.00 0.00 H new ATOM 0 HB3 TYR A 38 27.446 29.699 24.412 1.00 0.00 H new ATOM 0 HD1 TYR A 38 24.299 31.556 25.047 1.00 0.00 H new ATOM 0 HD2 TYR A 38 28.498 31.282 25.656 1.00 0.00 H new ATOM 0 HE1 TYR A 38 24.176 33.359 26.705 1.00 0.00 H new ATOM 0 HE2 TYR A 38 28.399 33.229 27.147 1.00 0.00 H new ATOM 0 HH TYR A 38 26.798 34.137 28.796 1.00 0.00 H new ATOM 641 N GLN A 39 27.220 32.841 22.653 1.00 0.00 N ATOM 642 CA GLN A 39 27.033 34.254 22.774 1.00 0.00 C ATOM 643 C GLN A 39 26.862 35.008 21.501 1.00 0.00 C ATOM 644 O GLN A 39 26.384 36.142 21.503 1.00 0.00 O ATOM 645 CB GLN A 39 28.019 34.844 23.796 1.00 0.00 C ATOM 646 CG GLN A 39 29.370 35.395 23.334 1.00 0.00 C ATOM 647 CD GLN A 39 29.472 36.913 23.345 1.00 0.00 C ATOM 648 OE1 GLN A 39 30.351 37.477 23.994 1.00 0.00 O ATOM 649 NE2 GLN A 39 28.552 37.617 22.632 1.00 0.00 N ATOM 0 H GLN A 39 28.189 32.545 22.770 1.00 0.00 H new ATOM 0 HA GLN A 39 26.037 34.402 23.191 1.00 0.00 H new ATOM 0 HB2 GLN A 39 27.502 35.651 24.315 1.00 0.00 H new ATOM 0 HB3 GLN A 39 28.222 34.068 24.534 1.00 0.00 H new ATOM 0 HG2 GLN A 39 30.152 34.987 23.974 1.00 0.00 H new ATOM 0 HG3 GLN A 39 29.567 35.038 22.323 1.00 0.00 H new ATOM 0 HE21 GLN A 39 27.833 37.125 22.102 1.00 0.00 H new ATOM 0 HE22 GLN A 39 28.581 38.637 22.628 1.00 0.00 H new ATOM 658 N LYS A 40 27.213 34.400 20.353 1.00 0.00 N ATOM 659 CA LYS A 40 27.123 34.868 19.004 1.00 0.00 C ATOM 660 C LYS A 40 25.922 35.655 18.607 1.00 0.00 C ATOM 661 O LYS A 40 25.986 36.634 17.864 1.00 0.00 O ATOM 662 CB LYS A 40 27.142 33.654 18.060 1.00 0.00 C ATOM 663 CG LYS A 40 26.132 32.533 18.309 1.00 0.00 C ATOM 664 CD LYS A 40 26.424 31.287 17.471 1.00 0.00 C ATOM 665 CE LYS A 40 26.248 31.469 15.962 1.00 0.00 C ATOM 666 NZ LYS A 40 26.674 30.241 15.252 1.00 0.00 N ATOM 0 H LYS A 40 27.610 33.461 20.379 1.00 0.00 H new ATOM 0 HA LYS A 40 27.970 35.550 18.931 1.00 0.00 H new ATOM 0 HB2 LYS A 40 26.991 34.019 17.044 1.00 0.00 H new ATOM 0 HB3 LYS A 40 28.140 33.218 18.097 1.00 0.00 H new ATOM 0 HG2 LYS A 40 26.142 32.267 19.366 1.00 0.00 H new ATOM 0 HG3 LYS A 40 25.129 32.894 18.081 1.00 0.00 H new ATOM 0 HD2 LYS A 40 27.448 30.967 17.667 1.00 0.00 H new ATOM 0 HD3 LYS A 40 25.769 30.482 17.804 1.00 0.00 H new ATOM 0 HE2 LYS A 40 25.205 31.689 15.733 1.00 0.00 H new ATOM 0 HE3 LYS A 40 26.836 32.320 15.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 26.552 30.372 14.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 27.675 30.050 15.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 26.095 29.438 15.570 1.00 0.00 H new ATOM 680 N GLU A 41 24.760 35.219 19.126 1.00 0.00 N ATOM 681 CA GLU A 41 23.458 35.795 18.995 1.00 0.00 C ATOM 682 C GLU A 41 23.356 37.243 19.335 1.00 0.00 C ATOM 683 O GLU A 41 22.544 37.970 18.765 1.00 0.00 O ATOM 684 CB GLU A 41 22.449 34.959 19.800 1.00 0.00 C ATOM 685 CG GLU A 41 22.553 34.995 21.326 1.00 0.00 C ATOM 686 CD GLU A 41 21.555 35.965 21.942 1.00 0.00 C ATOM 687 OE1 GLU A 41 20.328 35.775 21.726 1.00 0.00 O ATOM 688 OE2 GLU A 41 21.992 36.921 22.638 1.00 0.00 O ATOM 0 H GLU A 41 24.733 34.374 19.697 1.00 0.00 H new ATOM 0 HA GLU A 41 23.223 35.764 17.931 1.00 0.00 H new ATOM 0 HB2 GLU A 41 21.447 35.286 19.524 1.00 0.00 H new ATOM 0 HB3 GLU A 41 22.544 33.921 19.482 1.00 0.00 H new ATOM 0 HG2 GLU A 41 22.381 33.995 21.725 1.00 0.00 H new ATOM 0 HG3 GLU A 41 23.564 35.283 21.614 1.00 0.00 H new ATOM 695 N GLN A 42 24.223 37.738 20.237 1.00 0.00 N ATOM 696 CA GLN A 42 24.224 39.089 20.704 1.00 0.00 C ATOM 697 C GLN A 42 24.897 40.057 19.792 1.00 0.00 C ATOM 698 O GLN A 42 24.611 41.252 19.824 1.00 0.00 O ATOM 699 CB GLN A 42 24.809 39.127 22.126 1.00 0.00 C ATOM 700 CG GLN A 42 24.456 40.391 22.911 1.00 0.00 C ATOM 701 CD GLN A 42 24.638 40.183 24.408 1.00 0.00 C ATOM 702 OE1 GLN A 42 23.701 40.306 25.195 1.00 0.00 O ATOM 703 NE2 GLN A 42 25.887 39.842 24.823 1.00 0.00 N ATOM 0 H GLN A 42 24.957 37.169 20.660 1.00 0.00 H new ATOM 0 HA GLN A 42 23.188 39.427 20.722 1.00 0.00 H new ATOM 0 HB2 GLN A 42 24.452 38.258 22.678 1.00 0.00 H new ATOM 0 HB3 GLN A 42 25.894 39.042 22.064 1.00 0.00 H new ATOM 0 HG2 GLN A 42 25.085 41.216 22.577 1.00 0.00 H new ATOM 0 HG3 GLN A 42 23.424 40.674 22.704 1.00 0.00 H new ATOM 0 HE21 GLN A 42 26.642 39.748 24.144 1.00 0.00 H new ATOM 0 HE22 GLN A 42 26.069 39.680 25.813 1.00 0.00 H new ATOM 712 N LEU A 43 25.792 39.592 18.902 1.00 0.00 N ATOM 713 CA LEU A 43 26.611 40.411 18.063 1.00 0.00 C ATOM 714 C LEU A 43 25.864 41.297 17.127 1.00 0.00 C ATOM 715 O LEU A 43 26.152 42.487 17.013 1.00 0.00 O ATOM 716 CB LEU A 43 27.605 39.566 17.249 1.00 0.00 C ATOM 717 CG LEU A 43 28.600 38.732 18.075 1.00 0.00 C ATOM 718 CD1 LEU A 43 29.472 37.898 17.121 1.00 0.00 C ATOM 719 CD2 LEU A 43 29.493 39.588 18.989 1.00 0.00 C ATOM 0 H LEU A 43 25.952 38.595 18.761 1.00 0.00 H new ATOM 0 HA LEU A 43 27.136 41.059 18.765 1.00 0.00 H new ATOM 0 HB2 LEU A 43 27.040 38.892 16.606 1.00 0.00 H new ATOM 0 HB3 LEU A 43 28.170 40.231 16.596 1.00 0.00 H new ATOM 0 HG LEU A 43 28.017 38.084 18.730 1.00 0.00 H new ATOM 0 HD11 LEU A 43 30.180 37.304 17.700 1.00 0.00 H new ATOM 0 HD12 LEU A 43 28.837 37.235 16.534 1.00 0.00 H new ATOM 0 HD13 LEU A 43 30.018 38.563 16.452 1.00 0.00 H new ATOM 0 HD21 LEU A 43 30.172 38.941 19.544 1.00 0.00 H new ATOM 0 HD22 LEU A 43 30.071 40.286 18.383 1.00 0.00 H new ATOM 0 HD23 LEU A 43 28.870 40.145 19.688 1.00 0.00 H new ATOM 731 N HIS A 44 24.841 40.771 16.429 1.00 0.00 N ATOM 732 CA HIS A 44 23.868 41.581 15.763 1.00 0.00 C ATOM 733 C HIS A 44 22.501 41.255 16.256 1.00 0.00 C ATOM 734 O HIS A 44 21.616 40.849 15.503 1.00 0.00 O ATOM 735 CB HIS A 44 23.965 41.595 14.229 1.00 0.00 C ATOM 736 CG HIS A 44 24.098 40.306 13.473 1.00 0.00 C ATOM 737 ND1 HIS A 44 23.400 39.162 13.760 1.00 0.00 N ATOM 738 CD2 HIS A 44 24.840 40.036 12.366 1.00 0.00 C ATOM 739 CE1 HIS A 44 23.693 38.238 12.865 1.00 0.00 C ATOM 740 NE2 HIS A 44 24.569 38.741 12.015 1.00 0.00 N ATOM 0 H HIS A 44 24.687 39.768 16.325 1.00 0.00 H new ATOM 0 HA HIS A 44 24.100 42.612 16.031 1.00 0.00 H new ATOM 0 HB2 HIS A 44 23.076 42.101 13.853 1.00 0.00 H new ATOM 0 HB3 HIS A 44 24.821 42.216 13.964 1.00 0.00 H new ATOM 0 HD1 HIS A 44 22.756 39.044 14.542 1.00 0.00 H new ATOM 0 HD2 HIS A 44 25.513 40.713 11.861 1.00 0.00 H new ATOM 0 HE1 HIS A 44 23.285 37.239 12.833 1.00 0.00 H new ATOM 749 N THR A 45 22.264 41.443 17.566 1.00 0.00 N ATOM 750 CA THR A 45 20.965 41.319 18.150 1.00 0.00 C ATOM 751 C THR A 45 20.166 42.560 17.942 1.00 0.00 C ATOM 752 O THR A 45 20.693 43.670 17.896 1.00 0.00 O ATOM 753 CB THR A 45 20.975 40.925 19.597 1.00 0.00 C ATOM 754 OG1 THR A 45 19.689 40.552 20.070 1.00 0.00 O ATOM 755 CG2 THR A 45 21.494 42.042 20.518 1.00 0.00 C ATOM 0 H THR A 45 22.993 41.687 18.236 1.00 0.00 H new ATOM 0 HA THR A 45 20.487 40.492 17.625 1.00 0.00 H new ATOM 0 HB THR A 45 21.651 40.071 19.636 1.00 0.00 H new ATOM 0 HG1 THR A 45 19.748 40.303 21.016 1.00 0.00 H new ATOM 0 HG21 THR A 45 21.478 41.698 21.552 1.00 0.00 H new ATOM 0 HG22 THR A 45 22.515 42.300 20.237 1.00 0.00 H new ATOM 0 HG23 THR A 45 20.857 42.921 20.418 1.00 0.00 H new ATOM 763 N LYS A 46 18.843 42.394 17.766 1.00 0.00 N ATOM 764 CA LYS A 46 17.904 43.458 17.588 1.00 0.00 C ATOM 765 C LYS A 46 16.765 43.192 18.512 1.00 0.00 C ATOM 766 O LYS A 46 16.914 43.247 19.731 1.00 0.00 O ATOM 767 CB LYS A 46 17.465 43.559 16.117 1.00 0.00 C ATOM 768 CG LYS A 46 18.594 44.006 15.186 1.00 0.00 C ATOM 769 CD LYS A 46 18.256 43.975 13.693 1.00 0.00 C ATOM 770 CE LYS A 46 17.954 42.570 13.172 1.00 0.00 C ATOM 771 NZ LYS A 46 18.537 42.331 11.834 1.00 0.00 N ATOM 0 H LYS A 46 18.407 41.472 17.747 1.00 0.00 H new ATOM 0 HA LYS A 46 18.347 44.425 17.827 1.00 0.00 H new ATOM 0 HB2 LYS A 46 17.092 42.589 15.787 1.00 0.00 H new ATOM 0 HB3 LYS A 46 16.636 44.263 16.038 1.00 0.00 H new ATOM 0 HG2 LYS A 46 18.886 45.021 15.456 1.00 0.00 H new ATOM 0 HG3 LYS A 46 19.461 43.369 15.360 1.00 0.00 H new ATOM 0 HD2 LYS A 46 17.394 44.617 13.509 1.00 0.00 H new ATOM 0 HD3 LYS A 46 19.090 44.393 13.130 1.00 0.00 H new ATOM 0 HE2 LYS A 46 18.345 41.833 13.873 1.00 0.00 H new ATOM 0 HE3 LYS A 46 16.875 42.426 13.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 18.306 41.366 11.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 18.145 43.017 11.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 19.570 42.442 11.881 1.00 0.00 H new ATOM 785 N GLY A 47 15.579 42.847 17.979 1.00 0.00 N ATOM 786 CA GLY A 47 14.397 42.596 18.744 1.00 0.00 C ATOM 787 C GLY A 47 14.103 41.146 18.916 1.00 0.00 C ATOM 788 O GLY A 47 12.947 40.740 19.024 1.00 0.00 O ATOM 0 H GLY A 47 15.438 42.739 16.975 1.00 0.00 H new ATOM 0 HA2 GLY A 47 14.504 43.057 19.726 1.00 0.00 H new ATOM 0 HA3 GLY A 47 13.548 43.076 18.257 1.00 0.00 H new ATOM 792 N ARG A 48 15.152 40.305 18.970 1.00 0.00 N ATOM 793 CA ARG A 48 15.027 38.906 19.235 1.00 0.00 C ATOM 794 C ARG A 48 14.985 38.672 20.707 1.00 0.00 C ATOM 795 O ARG A 48 15.541 39.475 21.454 1.00 0.00 O ATOM 796 CB ARG A 48 16.173 38.092 18.612 1.00 0.00 C ATOM 797 CG ARG A 48 17.572 38.458 19.113 1.00 0.00 C ATOM 798 CD ARG A 48 18.627 37.360 18.974 1.00 0.00 C ATOM 799 NE ARG A 48 18.944 37.162 17.532 1.00 0.00 N ATOM 800 CZ ARG A 48 19.447 35.992 17.041 1.00 0.00 C ATOM 801 NH1 ARG A 48 19.544 34.879 17.825 1.00 0.00 N ATOM 802 NH2 ARG A 48 19.890 35.948 15.750 1.00 0.00 N ATOM 0 H ARG A 48 16.115 40.608 18.825 1.00 0.00 H new ATOM 0 HA ARG A 48 14.097 38.568 18.777 1.00 0.00 H new ATOM 0 HB2 ARG A 48 15.997 37.035 18.810 1.00 0.00 H new ATOM 0 HB3 ARG A 48 16.145 38.222 17.530 1.00 0.00 H new ATOM 0 HG2 ARG A 48 17.915 39.339 18.570 1.00 0.00 H new ATOM 0 HG3 ARG A 48 17.501 38.739 20.164 1.00 0.00 H new ATOM 0 HD2 ARG A 48 19.528 37.634 19.522 1.00 0.00 H new ATOM 0 HD3 ARG A 48 18.260 36.430 19.409 1.00 0.00 H new ATOM 0 HE ARG A 48 18.778 37.933 16.885 1.00 0.00 H new ATOM 0 HH11 ARG A 48 19.238 34.912 18.797 1.00 0.00 H new ATOM 0 HH12 ARG A 48 19.923 34.014 17.439 1.00 0.00 H new ATOM 0 HH21 ARG A 48 19.843 36.783 15.166 1.00 0.00 H new ATOM 0 HH22 ARG A 48 20.268 35.080 15.370 1.00 0.00 H new ATOM 816 N PRO A 49 14.401 37.627 21.213 1.00 0.00 N ATOM 817 CA PRO A 49 14.678 37.175 22.546 1.00 0.00 C ATOM 818 C PRO A 49 16.015 36.524 22.623 1.00 0.00 C ATOM 819 O PRO A 49 16.647 36.267 21.600 1.00 0.00 O ATOM 820 CB PRO A 49 13.541 36.193 22.821 1.00 0.00 C ATOM 821 CG PRO A 49 13.287 35.546 21.450 1.00 0.00 C ATOM 822 CD PRO A 49 13.517 36.724 20.490 1.00 0.00 C ATOM 0 HA PRO A 49 14.720 37.980 23.280 1.00 0.00 H new ATOM 0 HB2 PRO A 49 13.823 35.452 23.569 1.00 0.00 H new ATOM 0 HB3 PRO A 49 12.653 36.702 23.196 1.00 0.00 H new ATOM 0 HG2 PRO A 49 13.973 34.722 21.255 1.00 0.00 H new ATOM 0 HG3 PRO A 49 12.276 35.146 21.369 1.00 0.00 H new ATOM 0 HD2 PRO A 49 13.970 36.391 19.556 1.00 0.00 H new ATOM 0 HD3 PRO A 49 12.578 37.213 20.232 1.00 0.00 H new ATOM 830 N PHE A 50 16.505 36.245 23.845 1.00 0.00 N ATOM 831 CA PHE A 50 17.760 35.600 24.073 1.00 0.00 C ATOM 832 C PHE A 50 17.706 34.152 23.730 1.00 0.00 C ATOM 833 O PHE A 50 16.764 33.436 24.067 1.00 0.00 O ATOM 834 CB PHE A 50 18.179 35.840 25.533 1.00 0.00 C ATOM 835 CG PHE A 50 19.314 35.024 26.048 1.00 0.00 C ATOM 836 CD1 PHE A 50 20.614 35.457 25.934 1.00 0.00 C ATOM 837 CD2 PHE A 50 19.058 33.830 26.678 1.00 0.00 C ATOM 838 CE1 PHE A 50 21.643 34.715 26.464 1.00 0.00 C ATOM 839 CE2 PHE A 50 20.084 33.074 27.194 1.00 0.00 C ATOM 840 CZ PHE A 50 21.380 33.523 27.096 1.00 0.00 C ATOM 0 H PHE A 50 16.008 36.477 24.705 1.00 0.00 H new ATOM 0 HA PHE A 50 18.515 36.030 23.415 1.00 0.00 H new ATOM 0 HB2 PHE A 50 18.440 36.893 25.643 1.00 0.00 H new ATOM 0 HB3 PHE A 50 17.313 35.658 26.169 1.00 0.00 H new ATOM 0 HD1 PHE A 50 20.828 36.385 25.425 1.00 0.00 H new ATOM 0 HD2 PHE A 50 18.040 33.482 26.769 1.00 0.00 H new ATOM 0 HE1 PHE A 50 22.660 35.069 26.384 1.00 0.00 H new ATOM 0 HE2 PHE A 50 19.873 32.130 27.675 1.00 0.00 H new ATOM 0 HZ PHE A 50 22.188 32.941 27.514 1.00 0.00 H new ATOM 850 N ARG A 51 18.752 33.676 23.031 1.00 0.00 N ATOM 851 CA ARG A 51 18.894 32.306 22.647 1.00 0.00 C ATOM 852 C ARG A 51 19.816 31.547 23.539 1.00 0.00 C ATOM 853 O ARG A 51 19.426 31.141 24.632 1.00 0.00 O ATOM 854 CB ARG A 51 19.238 32.188 21.153 1.00 0.00 C ATOM 855 CG ARG A 51 18.055 32.513 20.239 1.00 0.00 C ATOM 856 CD ARG A 51 17.223 31.325 19.750 1.00 0.00 C ATOM 857 NE ARG A 51 16.668 30.568 20.907 1.00 0.00 N ATOM 858 CZ ARG A 51 15.558 30.912 21.625 1.00 0.00 C ATOM 859 NH1 ARG A 51 14.720 31.925 21.260 1.00 0.00 N ATOM 860 NH2 ARG A 51 15.264 30.210 22.758 1.00 0.00 N ATOM 0 H ARG A 51 19.525 34.265 22.723 1.00 0.00 H new ATOM 0 HA ARG A 51 17.927 31.822 22.783 1.00 0.00 H new ATOM 0 HB2 ARG A 51 20.064 32.861 20.922 1.00 0.00 H new ATOM 0 HB3 ARG A 51 19.584 31.176 20.944 1.00 0.00 H new ATOM 0 HG2 ARG A 51 17.393 33.198 20.769 1.00 0.00 H new ATOM 0 HG3 ARG A 51 18.434 33.046 19.367 1.00 0.00 H new ATOM 0 HD2 ARG A 51 16.411 31.679 19.115 1.00 0.00 H new ATOM 0 HD3 ARG A 51 17.841 30.667 19.139 1.00 0.00 H new ATOM 0 HE ARG A 51 17.159 29.719 21.187 1.00 0.00 H new ATOM 0 HH11 ARG A 51 14.910 32.465 20.416 1.00 0.00 H new ATOM 0 HH12 ARG A 51 13.903 32.142 21.831 1.00 0.00 H new ATOM 0 HH21 ARG A 51 15.869 29.444 23.055 1.00 0.00 H new ATOM 0 HH22 ARG A 51 14.440 30.451 23.308 1.00 0.00 H new ATOM 874 N GLY A 52 21.053 31.236 23.114 1.00 0.00 N ATOM 875 CA GLY A 52 21.878 30.304 23.820 1.00 0.00 C ATOM 876 C GLY A 52 21.353 28.914 23.707 1.00 0.00 C ATOM 877 O GLY A 52 20.660 28.550 22.758 1.00 0.00 O ATOM 0 H GLY A 52 21.484 31.631 22.278 1.00 0.00 H new ATOM 0 HA2 GLY A 52 22.893 30.344 23.425 1.00 0.00 H new ATOM 0 HA3 GLY A 52 21.933 30.589 24.871 1.00 0.00 H new ATOM 881 N MET A 53 21.696 28.060 24.689 1.00 0.00 N ATOM 882 CA MET A 53 21.534 26.647 24.540 1.00 0.00 C ATOM 883 C MET A 53 21.436 26.016 25.887 1.00 0.00 C ATOM 884 O MET A 53 20.794 26.537 26.797 1.00 0.00 O ATOM 885 CB MET A 53 22.710 26.171 23.670 1.00 0.00 C ATOM 886 CG MET A 53 24.110 26.387 24.249 1.00 0.00 C ATOM 887 SD MET A 53 25.370 26.688 22.974 1.00 0.00 S ATOM 888 CE MET A 53 26.530 27.002 24.337 1.00 0.00 C ATOM 0 H MET A 53 22.086 28.349 25.586 1.00 0.00 H new ATOM 0 HA MET A 53 20.611 26.357 24.037 1.00 0.00 H new ATOM 0 HB2 MET A 53 22.581 25.107 23.473 1.00 0.00 H new ATOM 0 HB3 MET A 53 22.654 26.682 22.709 1.00 0.00 H new ATOM 0 HG2 MET A 53 24.086 27.234 24.935 1.00 0.00 H new ATOM 0 HG3 MET A 53 24.394 25.512 24.833 1.00 0.00 H new ATOM 0 HE1 MET A 53 27.335 27.649 23.988 1.00 0.00 H new ATOM 0 HE2 MET A 53 26.003 27.488 25.158 1.00 0.00 H new ATOM 0 HE3 MET A 53 26.949 26.057 24.683 1.00 0.00 H new ATOM 898 N SER A 54 22.097 24.859 26.067 1.00 0.00 N ATOM 899 CA SER A 54 22.397 24.335 27.364 1.00 0.00 C ATOM 900 C SER A 54 23.686 24.918 27.829 1.00 0.00 C ATOM 901 O SER A 54 24.726 24.736 27.196 1.00 0.00 O ATOM 902 CB SER A 54 22.590 22.809 27.355 1.00 0.00 C ATOM 903 OG SER A 54 21.363 22.136 27.118 1.00 0.00 O ATOM 0 H SER A 54 22.429 24.276 25.299 1.00 0.00 H new ATOM 0 HA SER A 54 21.556 24.587 28.010 1.00 0.00 H new ATOM 0 HB2 SER A 54 23.312 22.536 26.585 1.00 0.00 H new ATOM 0 HB3 SER A 54 23.005 22.487 28.310 1.00 0.00 H new ATOM 0 HG SER A 54 21.516 21.168 27.116 1.00 0.00 H new ATOM 909 N GLU A 55 23.710 25.604 28.985 1.00 0.00 N ATOM 910 CA GLU A 55 24.900 26.100 29.603 1.00 0.00 C ATOM 911 C GLU A 55 25.873 25.018 29.928 1.00 0.00 C ATOM 912 O GLU A 55 27.090 25.193 29.894 1.00 0.00 O ATOM 913 CB GLU A 55 24.566 26.883 30.884 1.00 0.00 C ATOM 914 CG GLU A 55 23.917 28.248 30.647 1.00 0.00 C ATOM 915 CD GLU A 55 22.492 28.174 30.118 1.00 0.00 C ATOM 916 OE1 GLU A 55 21.738 27.246 30.514 1.00 0.00 O ATOM 917 OE2 GLU A 55 22.116 29.066 29.311 1.00 0.00 O ATOM 0 H GLU A 55 22.864 25.822 29.512 1.00 0.00 H new ATOM 0 HA GLU A 55 25.367 26.763 28.875 1.00 0.00 H new ATOM 0 HB2 GLU A 55 23.898 26.280 31.499 1.00 0.00 H new ATOM 0 HB3 GLU A 55 25.483 27.026 31.456 1.00 0.00 H new ATOM 0 HG2 GLU A 55 23.917 28.806 31.583 1.00 0.00 H new ATOM 0 HG3 GLU A 55 24.527 28.811 29.940 1.00 0.00 H new ATOM 924 N GLU A 56 25.356 23.800 30.163 1.00 0.00 N ATOM 925 CA GLU A 56 26.111 22.589 30.267 1.00 0.00 C ATOM 926 C GLU A 56 26.935 22.231 29.078 1.00 0.00 C ATOM 927 O GLU A 56 27.959 21.569 29.233 1.00 0.00 O ATOM 928 CB GLU A 56 25.166 21.407 30.541 1.00 0.00 C ATOM 929 CG GLU A 56 24.180 21.658 31.683 1.00 0.00 C ATOM 930 CD GLU A 56 23.353 20.416 31.987 1.00 0.00 C ATOM 931 OE1 GLU A 56 22.732 19.847 31.051 1.00 0.00 O ATOM 932 OE2 GLU A 56 23.314 20.008 33.179 1.00 0.00 O ATOM 0 H GLU A 56 24.355 23.651 30.288 1.00 0.00 H new ATOM 0 HA GLU A 56 26.806 22.781 31.084 1.00 0.00 H new ATOM 0 HB2 GLU A 56 24.606 21.183 29.633 1.00 0.00 H new ATOM 0 HB3 GLU A 56 25.761 20.524 30.775 1.00 0.00 H new ATOM 0 HG2 GLU A 56 24.726 21.961 32.577 1.00 0.00 H new ATOM 0 HG3 GLU A 56 23.518 22.482 31.419 1.00 0.00 H new ATOM 939 N GLU A 57 26.564 22.615 27.844 1.00 0.00 N ATOM 940 CA GLU A 57 27.201 22.100 26.672 1.00 0.00 C ATOM 941 C GLU A 57 28.447 22.870 26.397 1.00 0.00 C ATOM 942 O GLU A 57 29.463 22.347 25.942 1.00 0.00 O ATOM 943 CB GLU A 57 26.334 21.988 25.406 1.00 0.00 C ATOM 944 CG GLU A 57 26.512 23.081 24.351 1.00 0.00 C ATOM 945 CD GLU A 57 25.736 22.773 23.078 1.00 0.00 C ATOM 946 OE1 GLU A 57 24.488 22.603 23.116 1.00 0.00 O ATOM 947 OE2 GLU A 57 26.380 22.658 22.001 1.00 0.00 O ATOM 0 H GLU A 57 25.819 23.286 27.657 1.00 0.00 H new ATOM 0 HA GLU A 57 27.424 21.061 26.915 1.00 0.00 H new ATOM 0 HB2 GLU A 57 26.540 21.026 24.937 1.00 0.00 H new ATOM 0 HB3 GLU A 57 25.287 21.977 25.711 1.00 0.00 H new ATOM 0 HG2 GLU A 57 26.178 24.036 24.758 1.00 0.00 H new ATOM 0 HG3 GLU A 57 27.571 23.188 24.114 1.00 0.00 H new ATOM 954 N VAL A 58 28.401 24.178 26.705 1.00 0.00 N ATOM 955 CA VAL A 58 29.495 25.079 26.518 1.00 0.00 C ATOM 956 C VAL A 58 30.645 24.657 27.366 1.00 0.00 C ATOM 957 O VAL A 58 31.796 24.554 26.944 1.00 0.00 O ATOM 958 CB VAL A 58 29.011 26.491 26.669 1.00 0.00 C ATOM 959 CG1 VAL A 58 29.195 27.123 28.060 1.00 0.00 C ATOM 960 CG2 VAL A 58 29.734 27.366 25.632 1.00 0.00 C ATOM 0 H VAL A 58 27.572 24.624 27.098 1.00 0.00 H new ATOM 0 HA VAL A 58 29.895 25.044 25.505 1.00 0.00 H new ATOM 0 HB VAL A 58 27.933 26.445 26.517 1.00 0.00 H new ATOM 0 HG11 VAL A 58 28.810 28.143 28.050 1.00 0.00 H new ATOM 0 HG12 VAL A 58 28.651 26.537 28.801 1.00 0.00 H new ATOM 0 HG13 VAL A 58 30.255 27.138 28.316 1.00 0.00 H new ATOM 0 HG21 VAL A 58 29.395 28.398 25.726 1.00 0.00 H new ATOM 0 HG22 VAL A 58 30.809 27.320 25.804 1.00 0.00 H new ATOM 0 HG23 VAL A 58 29.511 27.001 24.629 1.00 0.00 H new ATOM 970 N PHE A 59 30.297 24.270 28.607 1.00 0.00 N ATOM 971 CA PHE A 59 31.098 23.587 29.575 1.00 0.00 C ATOM 972 C PHE A 59 31.589 22.259 29.108 1.00 0.00 C ATOM 973 O PHE A 59 32.791 22.000 29.138 1.00 0.00 O ATOM 974 CB PHE A 59 30.232 23.500 30.843 1.00 0.00 C ATOM 975 CG PHE A 59 30.809 22.791 32.021 1.00 0.00 C ATOM 976 CD1 PHE A 59 31.493 23.486 32.989 1.00 0.00 C ATOM 977 CD2 PHE A 59 30.559 21.453 32.211 1.00 0.00 C ATOM 978 CE1 PHE A 59 31.937 22.855 34.128 1.00 0.00 C ATOM 979 CE2 PHE A 59 30.994 20.813 33.348 1.00 0.00 C ATOM 980 CZ PHE A 59 31.689 21.515 34.304 1.00 0.00 C ATOM 0 H PHE A 59 29.360 24.456 28.965 1.00 0.00 H new ATOM 0 HA PHE A 59 32.021 24.133 29.768 1.00 0.00 H new ATOM 0 HB2 PHE A 59 29.982 24.515 31.150 1.00 0.00 H new ATOM 0 HB3 PHE A 59 29.296 23.007 30.579 1.00 0.00 H new ATOM 0 HD1 PHE A 59 31.684 24.540 32.854 1.00 0.00 H new ATOM 0 HD2 PHE A 59 30.016 20.899 31.460 1.00 0.00 H new ATOM 0 HE1 PHE A 59 32.478 23.410 34.880 1.00 0.00 H new ATOM 0 HE2 PHE A 59 30.790 19.762 33.489 1.00 0.00 H new ATOM 0 HZ PHE A 59 32.040 21.013 35.194 1.00 0.00 H new ATOM 990 N THR A 60 30.704 21.367 28.628 1.00 0.00 N ATOM 991 CA THR A 60 31.008 20.050 28.160 1.00 0.00 C ATOM 992 C THR A 60 32.037 19.979 27.084 1.00 0.00 C ATOM 993 O THR A 60 32.948 19.155 27.122 1.00 0.00 O ATOM 994 CB THR A 60 29.794 19.231 27.834 1.00 0.00 C ATOM 995 OG1 THR A 60 29.889 17.931 28.396 1.00 0.00 O ATOM 996 CG2 THR A 60 29.501 19.028 26.338 1.00 0.00 C ATOM 0 H THR A 60 29.709 21.581 28.563 1.00 0.00 H new ATOM 0 HA THR A 60 31.478 19.586 29.027 1.00 0.00 H new ATOM 0 HB THR A 60 28.984 19.824 28.259 1.00 0.00 H new ATOM 0 HG1 THR A 60 29.085 17.418 28.171 1.00 0.00 H new ATOM 0 HG21 THR A 60 28.602 18.422 26.222 1.00 0.00 H new ATOM 0 HG22 THR A 60 29.349 19.997 25.862 1.00 0.00 H new ATOM 0 HG23 THR A 60 30.343 18.521 25.868 1.00 0.00 H new ATOM 1004 N GLU A 61 31.960 20.869 26.079 1.00 0.00 N ATOM 1005 CA GLU A 61 32.891 20.863 24.994 1.00 0.00 C ATOM 1006 C GLU A 61 34.237 21.369 25.383 1.00 0.00 C ATOM 1007 O GLU A 61 35.231 20.709 25.087 1.00 0.00 O ATOM 1008 CB GLU A 61 32.300 21.452 23.702 1.00 0.00 C ATOM 1009 CG GLU A 61 31.025 20.714 23.287 1.00 0.00 C ATOM 1010 CD GLU A 61 30.943 20.473 21.787 1.00 0.00 C ATOM 1011 OE1 GLU A 61 31.738 19.645 21.267 1.00 0.00 O ATOM 1012 OE2 GLU A 61 30.076 21.078 21.101 1.00 0.00 O ATOM 0 H GLU A 61 31.248 21.597 26.018 1.00 0.00 H new ATOM 0 HA GLU A 61 33.080 19.821 24.736 1.00 0.00 H new ATOM 0 HB2 GLU A 61 32.079 22.509 23.849 1.00 0.00 H new ATOM 0 HB3 GLU A 61 33.036 21.389 22.901 1.00 0.00 H new ATOM 0 HG2 GLU A 61 30.979 19.757 23.807 1.00 0.00 H new ATOM 0 HG3 GLU A 61 30.157 21.291 23.605 1.00 0.00 H new ATOM 1019 N VAL A 62 34.334 22.467 26.154 1.00 0.00 N ATOM 1020 CA VAL A 62 35.531 22.988 26.738 1.00 0.00 C ATOM 1021 C VAL A 62 36.282 22.012 27.576 1.00 0.00 C ATOM 1022 O VAL A 62 37.510 22.002 27.654 1.00 0.00 O ATOM 1023 CB VAL A 62 35.158 24.158 27.600 1.00 0.00 C ATOM 1024 CG1 VAL A 62 36.260 24.630 28.561 1.00 0.00 C ATOM 1025 CG2 VAL A 62 34.813 25.313 26.644 1.00 0.00 C ATOM 0 H VAL A 62 33.516 23.031 26.385 1.00 0.00 H new ATOM 0 HA VAL A 62 36.189 23.259 25.913 1.00 0.00 H new ATOM 0 HB VAL A 62 34.330 23.847 28.237 1.00 0.00 H new ATOM 0 HG11 VAL A 62 35.898 25.479 29.141 1.00 0.00 H new ATOM 0 HG12 VAL A 62 36.527 23.817 29.236 1.00 0.00 H new ATOM 0 HG13 VAL A 62 37.138 24.930 27.989 1.00 0.00 H new ATOM 0 HG21 VAL A 62 34.533 26.193 27.223 1.00 0.00 H new ATOM 0 HG22 VAL A 62 35.680 25.546 26.026 1.00 0.00 H new ATOM 0 HG23 VAL A 62 33.980 25.020 26.005 1.00 0.00 H new ATOM 1035 N ALA A 63 35.540 21.103 28.233 1.00 0.00 N ATOM 1036 CA ALA A 63 36.054 20.160 29.178 1.00 0.00 C ATOM 1037 C ALA A 63 36.980 19.185 28.535 1.00 0.00 C ATOM 1038 O ALA A 63 37.960 18.762 29.145 1.00 0.00 O ATOM 1039 CB ALA A 63 34.928 19.373 29.868 1.00 0.00 C ATOM 0 H ALA A 63 34.532 21.022 28.099 1.00 0.00 H new ATOM 0 HA ALA A 63 36.597 20.745 29.920 1.00 0.00 H new ATOM 0 HB1 ALA A 63 35.359 18.667 30.578 1.00 0.00 H new ATOM 0 HB2 ALA A 63 34.272 20.064 30.397 1.00 0.00 H new ATOM 0 HB3 ALA A 63 34.353 18.828 29.119 1.00 0.00 H new ATOM 1045 N ASN A 64 36.751 18.837 27.256 1.00 0.00 N ATOM 1046 CA ASN A 64 37.621 17.913 26.597 1.00 0.00 C ATOM 1047 C ASN A 64 38.946 18.517 26.280 1.00 0.00 C ATOM 1048 O ASN A 64 39.958 17.823 26.198 1.00 0.00 O ATOM 1049 CB ASN A 64 37.131 17.349 25.253 1.00 0.00 C ATOM 1050 CG ASN A 64 35.660 16.973 25.346 1.00 0.00 C ATOM 1051 OD1 ASN A 64 35.255 15.935 25.867 1.00 0.00 O ATOM 1052 ND2 ASN A 64 34.839 17.927 24.828 1.00 0.00 N ATOM 0 H ASN A 64 35.980 19.187 26.688 1.00 0.00 H new ATOM 0 HA ASN A 64 37.666 17.109 27.332 1.00 0.00 H new ATOM 0 HB2 ASN A 64 37.276 18.089 24.466 1.00 0.00 H new ATOM 0 HB3 ASN A 64 37.721 16.474 24.981 1.00 0.00 H new ATOM 0 HD21 ASN A 64 33.827 17.801 24.860 1.00 0.00 H new ATOM 0 HD22 ASN A 64 35.235 18.768 24.408 1.00 0.00 H new ATOM 1059 N LEU A 65 38.966 19.846 26.083 1.00 0.00 N ATOM 1060 CA LEU A 65 40.140 20.613 25.800 1.00 0.00 C ATOM 1061 C LEU A 65 40.992 20.700 27.019 1.00 0.00 C ATOM 1062 O LEU A 65 42.216 20.577 26.988 1.00 0.00 O ATOM 1063 CB LEU A 65 39.829 22.035 25.303 1.00 0.00 C ATOM 1064 CG LEU A 65 39.161 22.158 23.923 1.00 0.00 C ATOM 1065 CD1 LEU A 65 37.719 21.625 23.941 1.00 0.00 C ATOM 1066 CD2 LEU A 65 39.149 23.619 23.443 1.00 0.00 C ATOM 0 H LEU A 65 38.121 20.415 26.123 1.00 0.00 H new ATOM 0 HA LEU A 65 40.663 20.095 24.996 1.00 0.00 H new ATOM 0 HB2 LEU A 65 39.183 22.517 26.037 1.00 0.00 H new ATOM 0 HB3 LEU A 65 40.762 22.598 25.280 1.00 0.00 H new ATOM 0 HG LEU A 65 39.751 21.554 23.234 1.00 0.00 H new ATOM 0 HD11 LEU A 65 37.280 21.729 22.949 1.00 0.00 H new ATOM 0 HD12 LEU A 65 37.723 20.573 24.228 1.00 0.00 H new ATOM 0 HD13 LEU A 65 37.130 22.194 24.660 1.00 0.00 H new ATOM 0 HD21 LEU A 65 38.671 23.677 22.465 1.00 0.00 H new ATOM 0 HD22 LEU A 65 38.595 24.231 24.154 1.00 0.00 H new ATOM 0 HD23 LEU A 65 40.173 23.986 23.369 1.00 0.00 H new ATOM 1078 N PHE A 66 40.339 20.913 28.175 1.00 0.00 N ATOM 1079 CA PHE A 66 40.945 21.306 29.410 1.00 0.00 C ATOM 1080 C PHE A 66 41.291 20.128 30.255 1.00 0.00 C ATOM 1081 O PHE A 66 42.094 20.227 31.181 1.00 0.00 O ATOM 1082 CB PHE A 66 40.002 22.208 30.223 1.00 0.00 C ATOM 1083 CG PHE A 66 39.975 23.638 29.807 1.00 0.00 C ATOM 1084 CD1 PHE A 66 40.149 24.060 28.509 1.00 0.00 C ATOM 1085 CD2 PHE A 66 39.748 24.590 30.772 1.00 0.00 C ATOM 1086 CE1 PHE A 66 40.104 25.392 28.174 1.00 0.00 C ATOM 1087 CE2 PHE A 66 39.711 25.930 30.461 1.00 0.00 C ATOM 1088 CZ PHE A 66 39.897 26.329 29.158 1.00 0.00 C ATOM 0 H PHE A 66 39.328 20.804 28.252 1.00 0.00 H new ATOM 0 HA PHE A 66 41.854 21.847 29.147 1.00 0.00 H new ATOM 0 HB2 PHE A 66 38.991 21.807 30.152 1.00 0.00 H new ATOM 0 HB3 PHE A 66 40.292 22.157 31.272 1.00 0.00 H new ATOM 0 HD1 PHE A 66 40.325 23.327 27.735 1.00 0.00 H new ATOM 0 HD2 PHE A 66 39.596 24.280 31.795 1.00 0.00 H new ATOM 0 HE1 PHE A 66 40.230 25.700 27.147 1.00 0.00 H new ATOM 0 HE2 PHE A 66 39.537 26.663 31.235 1.00 0.00 H new ATOM 0 HZ PHE A 66 39.880 27.379 28.908 1.00 0.00 H new ATOM 1098 N ARG A 67 40.671 18.976 29.946 1.00 0.00 N ATOM 1099 CA ARG A 67 40.725 17.697 30.583 1.00 0.00 C ATOM 1100 C ARG A 67 42.045 17.305 31.152 1.00 0.00 C ATOM 1101 O ARG A 67 43.074 17.309 30.478 1.00 0.00 O ATOM 1102 CB ARG A 67 40.250 16.631 29.581 1.00 0.00 C ATOM 1103 CG ARG A 67 39.116 15.708 30.032 1.00 0.00 C ATOM 1104 CD ARG A 67 39.369 14.871 31.287 1.00 0.00 C ATOM 1105 NE ARG A 67 40.649 14.130 31.109 1.00 0.00 N ATOM 1106 CZ ARG A 67 41.168 13.266 32.029 1.00 0.00 C ATOM 1107 NH1 ARG A 67 40.452 12.776 33.084 1.00 0.00 N ATOM 1108 NH2 ARG A 67 42.465 12.855 31.913 1.00 0.00 N ATOM 0 H ARG A 67 40.048 18.942 29.139 1.00 0.00 H new ATOM 0 HA ARG A 67 40.070 17.772 31.451 1.00 0.00 H new ATOM 0 HB2 ARG A 67 39.931 17.140 28.671 1.00 0.00 H new ATOM 0 HB3 ARG A 67 41.106 16.011 29.316 1.00 0.00 H new ATOM 0 HG2 ARG A 67 38.229 16.318 30.203 1.00 0.00 H new ATOM 0 HG3 ARG A 67 38.883 15.029 29.212 1.00 0.00 H new ATOM 0 HD2 ARG A 67 39.422 15.513 32.166 1.00 0.00 H new ATOM 0 HD3 ARG A 67 38.547 14.174 31.450 1.00 0.00 H new ATOM 0 HE ARG A 67 41.170 14.278 30.245 1.00 0.00 H new ATOM 0 HH11 ARG A 67 39.479 13.054 33.213 1.00 0.00 H new ATOM 0 HH12 ARG A 67 40.890 12.132 33.743 1.00 0.00 H new ATOM 0 HH21 ARG A 67 43.040 13.194 31.142 1.00 0.00 H new ATOM 0 HH22 ARG A 67 42.859 12.209 32.598 1.00 0.00 H new ATOM 1122 N GLY A 68 42.044 16.979 32.457 1.00 0.00 N ATOM 1123 CA GLY A 68 43.214 16.871 33.272 1.00 0.00 C ATOM 1124 C GLY A 68 43.116 17.882 34.362 1.00 0.00 C ATOM 1125 O GLY A 68 43.297 17.569 35.537 1.00 0.00 O ATOM 0 H GLY A 68 41.184 16.781 32.969 1.00 0.00 H new ATOM 0 HA2 GLY A 68 43.295 15.868 33.690 1.00 0.00 H new ATOM 0 HA3 GLY A 68 44.110 17.041 32.675 1.00 0.00 H new ATOM 1129 N GLN A 69 42.811 19.143 34.006 1.00 0.00 N ATOM 1130 CA GLN A 69 42.719 20.230 34.930 1.00 0.00 C ATOM 1131 C GLN A 69 41.319 20.458 35.387 1.00 0.00 C ATOM 1132 O GLN A 69 40.493 21.027 34.675 1.00 0.00 O ATOM 1133 CB GLN A 69 43.226 21.539 34.303 1.00 0.00 C ATOM 1134 CG GLN A 69 44.622 21.414 33.689 1.00 0.00 C ATOM 1135 CD GLN A 69 45.093 22.750 33.131 1.00 0.00 C ATOM 1136 OE1 GLN A 69 46.046 23.342 33.636 1.00 0.00 O ATOM 1137 NE2 GLN A 69 44.431 23.240 32.049 1.00 0.00 N ATOM 0 H GLN A 69 42.622 19.415 33.041 1.00 0.00 H new ATOM 0 HA GLN A 69 43.340 19.952 35.781 1.00 0.00 H new ATOM 0 HB2 GLN A 69 42.525 21.860 33.533 1.00 0.00 H new ATOM 0 HB3 GLN A 69 43.240 22.318 35.066 1.00 0.00 H new ATOM 0 HG2 GLN A 69 45.325 21.063 34.444 1.00 0.00 H new ATOM 0 HG3 GLN A 69 44.608 20.668 32.894 1.00 0.00 H new ATOM 0 HE21 GLN A 69 43.645 22.723 31.655 1.00 0.00 H new ATOM 0 HE22 GLN A 69 44.721 24.124 31.631 1.00 0.00 H new ATOM 1146 N GLU A 70 40.970 20.012 36.606 1.00 0.00 N ATOM 1147 CA GLU A 70 39.692 20.244 37.205 1.00 0.00 C ATOM 1148 C GLU A 70 39.577 21.581 37.850 1.00 0.00 C ATOM 1149 O GLU A 70 38.479 22.121 37.981 1.00 0.00 O ATOM 1150 CB GLU A 70 39.378 19.169 38.259 1.00 0.00 C ATOM 1151 CG GLU A 70 39.113 17.777 37.682 1.00 0.00 C ATOM 1152 CD GLU A 70 37.722 17.636 37.078 1.00 0.00 C ATOM 1153 OE1 GLU A 70 37.516 17.996 35.889 1.00 0.00 O ATOM 1154 OE2 GLU A 70 36.827 17.099 37.783 1.00 0.00 O ATOM 0 H GLU A 70 41.600 19.470 37.197 1.00 0.00 H new ATOM 0 HA GLU A 70 38.975 20.201 36.385 1.00 0.00 H new ATOM 0 HB2 GLU A 70 40.213 19.107 38.957 1.00 0.00 H new ATOM 0 HB3 GLU A 70 38.506 19.483 38.832 1.00 0.00 H new ATOM 0 HG2 GLU A 70 39.859 17.559 36.917 1.00 0.00 H new ATOM 0 HG3 GLU A 70 39.238 17.034 38.470 1.00 0.00 H new ATOM 1161 N ASP A 71 40.693 22.185 38.297 1.00 0.00 N ATOM 1162 CA ASP A 71 40.725 23.333 39.150 1.00 0.00 C ATOM 1163 C ASP A 71 40.244 24.583 38.498 1.00 0.00 C ATOM 1164 O ASP A 71 39.772 25.518 39.143 1.00 0.00 O ATOM 1165 CB ASP A 71 42.118 23.471 39.786 1.00 0.00 C ATOM 1166 CG ASP A 71 43.245 23.736 38.797 1.00 0.00 C ATOM 1167 OD1 ASP A 71 43.405 22.963 37.814 1.00 0.00 O ATOM 1168 OD2 ASP A 71 44.019 24.700 39.035 1.00 0.00 O ATOM 0 H ASP A 71 41.625 21.853 38.049 1.00 0.00 H new ATOM 0 HA ASP A 71 40.002 23.170 39.950 1.00 0.00 H new ATOM 0 HB2 ASP A 71 42.092 24.283 40.513 1.00 0.00 H new ATOM 0 HB3 ASP A 71 42.343 22.558 40.337 1.00 0.00 H new ATOM 1173 N LEU A 72 40.288 24.615 37.154 1.00 0.00 N ATOM 1174 CA LEU A 72 39.685 25.625 36.342 1.00 0.00 C ATOM 1175 C LEU A 72 38.203 25.493 36.275 1.00 0.00 C ATOM 1176 O LEU A 72 37.480 26.399 36.685 1.00 0.00 O ATOM 1177 CB LEU A 72 40.336 25.592 34.949 1.00 0.00 C ATOM 1178 CG LEU A 72 41.866 25.753 34.941 1.00 0.00 C ATOM 1179 CD1 LEU A 72 42.376 25.591 33.500 1.00 0.00 C ATOM 1180 CD2 LEU A 72 42.357 27.102 35.492 1.00 0.00 C ATOM 0 H LEU A 72 40.768 23.900 36.607 1.00 0.00 H new ATOM 0 HA LEU A 72 39.864 26.599 36.798 1.00 0.00 H new ATOM 0 HB2 LEU A 72 40.083 24.647 34.469 1.00 0.00 H new ATOM 0 HB3 LEU A 72 39.899 26.385 34.342 1.00 0.00 H new ATOM 0 HG LEU A 72 42.262 24.983 35.603 1.00 0.00 H new ATOM 0 HD11 LEU A 72 43.460 25.703 33.483 1.00 0.00 H new ATOM 0 HD12 LEU A 72 42.108 24.602 33.128 1.00 0.00 H new ATOM 0 HD13 LEU A 72 41.922 26.352 32.866 1.00 0.00 H new ATOM 0 HD21 LEU A 72 43.446 27.137 35.452 1.00 0.00 H new ATOM 0 HD22 LEU A 72 41.946 27.912 34.890 1.00 0.00 H new ATOM 0 HD23 LEU A 72 42.028 27.215 36.525 1.00 0.00 H new ATOM 1192 N LEU A 73 37.658 24.343 35.840 1.00 0.00 N ATOM 1193 CA LEU A 73 36.261 24.081 35.678 1.00 0.00 C ATOM 1194 C LEU A 73 35.490 24.162 36.951 1.00 0.00 C ATOM 1195 O LEU A 73 34.281 24.382 36.984 1.00 0.00 O ATOM 1196 CB LEU A 73 35.969 22.680 35.112 1.00 0.00 C ATOM 1197 CG LEU A 73 36.289 22.434 33.628 1.00 0.00 C ATOM 1198 CD1 LEU A 73 35.498 23.337 32.667 1.00 0.00 C ATOM 1199 CD2 LEU A 73 37.802 22.496 33.358 1.00 0.00 C ATOM 0 H LEU A 73 38.234 23.541 35.584 1.00 0.00 H new ATOM 0 HA LEU A 73 35.949 24.861 34.983 1.00 0.00 H new ATOM 0 HB2 LEU A 73 36.530 21.955 35.702 1.00 0.00 H new ATOM 0 HB3 LEU A 73 34.911 22.468 35.268 1.00 0.00 H new ATOM 0 HG LEU A 73 35.952 21.419 33.416 1.00 0.00 H new ATOM 0 HD11 LEU A 73 35.776 23.106 31.639 1.00 0.00 H new ATOM 0 HD12 LEU A 73 34.430 23.164 32.801 1.00 0.00 H new ATOM 0 HD13 LEU A 73 35.726 24.382 32.879 1.00 0.00 H new ATOM 0 HD21 LEU A 73 37.990 22.318 32.299 1.00 0.00 H new ATOM 0 HD22 LEU A 73 38.181 23.480 33.633 1.00 0.00 H new ATOM 0 HD23 LEU A 73 38.309 21.734 33.950 1.00 0.00 H new ATOM 1211 N SER A 74 36.213 23.990 38.072 1.00 0.00 N ATOM 1212 CA SER A 74 35.791 24.096 39.434 1.00 0.00 C ATOM 1213 C SER A 74 35.225 25.439 39.742 1.00 0.00 C ATOM 1214 O SER A 74 34.091 25.585 40.196 1.00 0.00 O ATOM 1215 CB SER A 74 36.991 23.822 40.357 1.00 0.00 C ATOM 1216 OG SER A 74 36.646 23.697 41.728 1.00 0.00 O ATOM 0 H SER A 74 37.203 23.750 38.014 1.00 0.00 H new ATOM 0 HA SER A 74 35.004 23.361 39.599 1.00 0.00 H new ATOM 0 HB2 SER A 74 37.485 22.906 40.032 1.00 0.00 H new ATOM 0 HB3 SER A 74 37.714 24.631 40.247 1.00 0.00 H new ATOM 0 HG SER A 74 37.454 23.523 42.254 1.00 0.00 H new ATOM 1222 N GLU A 75 36.015 26.488 39.453 1.00 0.00 N ATOM 1223 CA GLU A 75 35.671 27.867 39.606 1.00 0.00 C ATOM 1224 C GLU A 75 34.844 28.402 38.487 1.00 0.00 C ATOM 1225 O GLU A 75 34.077 29.337 38.707 1.00 0.00 O ATOM 1226 CB GLU A 75 36.946 28.704 39.800 1.00 0.00 C ATOM 1227 CG GLU A 75 37.599 28.467 41.163 1.00 0.00 C ATOM 1228 CD GLU A 75 38.782 29.393 41.409 1.00 0.00 C ATOM 1229 OE1 GLU A 75 38.620 30.639 41.308 1.00 0.00 O ATOM 1230 OE2 GLU A 75 39.890 28.885 41.726 1.00 0.00 O ATOM 0 H GLU A 75 36.959 26.363 39.087 1.00 0.00 H new ATOM 0 HA GLU A 75 35.045 27.942 40.495 1.00 0.00 H new ATOM 0 HB2 GLU A 75 37.659 28.462 39.012 1.00 0.00 H new ATOM 0 HB3 GLU A 75 36.702 29.761 39.696 1.00 0.00 H new ATOM 0 HG2 GLU A 75 36.857 28.613 41.948 1.00 0.00 H new ATOM 0 HG3 GLU A 75 37.932 27.431 41.228 1.00 0.00 H new ATOM 1237 N PHE A 76 34.900 27.783 37.293 1.00 0.00 N ATOM 1238 CA PHE A 76 34.148 28.151 36.133 1.00 0.00 C ATOM 1239 C PHE A 76 32.672 28.154 36.329 1.00 0.00 C ATOM 1240 O PHE A 76 31.921 28.866 35.664 1.00 0.00 O ATOM 1241 CB PHE A 76 34.527 27.186 34.996 1.00 0.00 C ATOM 1242 CG PHE A 76 34.141 27.586 33.614 1.00 0.00 C ATOM 1243 CD1 PHE A 76 34.305 28.871 33.153 1.00 0.00 C ATOM 1244 CD2 PHE A 76 33.696 26.624 32.739 1.00 0.00 C ATOM 1245 CE1 PHE A 76 34.029 29.193 31.844 1.00 0.00 C ATOM 1246 CE2 PHE A 76 33.409 26.932 31.430 1.00 0.00 C ATOM 1247 CZ PHE A 76 33.587 28.220 30.980 1.00 0.00 C ATOM 0 H PHE A 76 35.506 26.979 37.129 1.00 0.00 H new ATOM 0 HA PHE A 76 34.405 29.183 35.895 1.00 0.00 H new ATOM 0 HB2 PHE A 76 35.607 27.044 35.018 1.00 0.00 H new ATOM 0 HB3 PHE A 76 34.073 26.218 35.208 1.00 0.00 H new ATOM 0 HD1 PHE A 76 34.655 29.638 33.828 1.00 0.00 H new ATOM 0 HD2 PHE A 76 33.570 25.609 33.085 1.00 0.00 H new ATOM 0 HE1 PHE A 76 34.159 30.207 31.497 1.00 0.00 H new ATOM 0 HE2 PHE A 76 33.046 26.167 30.759 1.00 0.00 H new ATOM 0 HZ PHE A 76 33.380 28.466 29.949 1.00 0.00 H new ATOM 1257 N GLY A 77 32.204 27.402 37.341 1.00 0.00 N ATOM 1258 CA GLY A 77 30.864 27.363 37.839 1.00 0.00 C ATOM 1259 C GLY A 77 30.309 28.670 38.288 1.00 0.00 C ATOM 1260 O GLY A 77 29.090 28.800 38.398 1.00 0.00 O ATOM 0 H GLY A 77 32.817 26.768 37.853 1.00 0.00 H new ATOM 0 HA2 GLY A 77 30.217 26.962 37.059 1.00 0.00 H new ATOM 0 HA3 GLY A 77 30.826 26.665 38.675 1.00 0.00 H new ATOM 1264 N GLN A 78 31.141 29.682 38.589 1.00 0.00 N ATOM 1265 CA GLN A 78 30.660 30.999 38.875 1.00 0.00 C ATOM 1266 C GLN A 78 30.001 31.720 37.751 1.00 0.00 C ATOM 1267 O GLN A 78 29.121 32.551 37.966 1.00 0.00 O ATOM 1268 CB GLN A 78 31.780 31.894 39.431 1.00 0.00 C ATOM 1269 CG GLN A 78 32.861 32.321 38.436 1.00 0.00 C ATOM 1270 CD GLN A 78 33.984 33.050 39.159 1.00 0.00 C ATOM 1271 OE1 GLN A 78 33.756 33.860 40.057 1.00 0.00 O ATOM 1272 NE2 GLN A 78 35.249 32.765 38.751 1.00 0.00 N ATOM 0 H GLN A 78 32.156 29.587 38.635 1.00 0.00 H new ATOM 0 HA GLN A 78 29.882 30.817 39.617 1.00 0.00 H new ATOM 0 HB2 GLN A 78 31.325 32.792 39.849 1.00 0.00 H new ATOM 0 HB3 GLN A 78 32.262 31.368 40.255 1.00 0.00 H new ATOM 0 HG2 GLN A 78 33.258 31.446 37.922 1.00 0.00 H new ATOM 0 HG3 GLN A 78 32.428 32.969 37.674 1.00 0.00 H new ATOM 0 HE21 GLN A 78 35.404 32.088 38.004 1.00 0.00 H new ATOM 0 HE22 GLN A 78 36.044 33.228 39.192 1.00 0.00 H new ATOM 1281 N PHE A 79 30.393 31.436 36.495 1.00 0.00 N ATOM 1282 CA PHE A 79 29.831 32.034 35.325 1.00 0.00 C ATOM 1283 C PHE A 79 28.580 31.341 34.907 1.00 0.00 C ATOM 1284 O PHE A 79 27.732 31.893 34.207 1.00 0.00 O ATOM 1285 CB PHE A 79 30.805 31.982 34.135 1.00 0.00 C ATOM 1286 CG PHE A 79 32.074 32.690 34.458 1.00 0.00 C ATOM 1287 CD1 PHE A 79 32.150 34.063 34.440 1.00 0.00 C ATOM 1288 CD2 PHE A 79 33.192 31.962 34.797 1.00 0.00 C ATOM 1289 CE1 PHE A 79 33.321 34.704 34.768 1.00 0.00 C ATOM 1290 CE2 PHE A 79 34.365 32.595 35.133 1.00 0.00 C ATOM 1291 CZ PHE A 79 34.425 33.969 35.132 1.00 0.00 C ATOM 0 H PHE A 79 31.131 30.763 36.288 1.00 0.00 H new ATOM 0 HA PHE A 79 29.620 33.070 35.591 1.00 0.00 H new ATOM 0 HB2 PHE A 79 31.018 30.944 33.879 1.00 0.00 H new ATOM 0 HB3 PHE A 79 30.342 32.438 33.260 1.00 0.00 H new ATOM 0 HD1 PHE A 79 31.281 34.643 34.166 1.00 0.00 H new ATOM 0 HD2 PHE A 79 33.147 30.883 34.799 1.00 0.00 H new ATOM 0 HE1 PHE A 79 33.374 35.782 34.740 1.00 0.00 H new ATOM 0 HE2 PHE A 79 35.237 32.015 35.397 1.00 0.00 H new ATOM 0 HZ PHE A 79 35.338 34.470 35.417 1.00 0.00 H new ATOM 1301 N LEU A 80 28.429 30.067 35.312 1.00 0.00 N ATOM 1302 CA LEU A 80 27.319 29.239 34.955 1.00 0.00 C ATOM 1303 C LEU A 80 26.258 29.256 36.001 1.00 0.00 C ATOM 1304 O LEU A 80 26.531 29.675 37.124 1.00 0.00 O ATOM 1305 CB LEU A 80 27.823 27.820 34.644 1.00 0.00 C ATOM 1306 CG LEU A 80 28.829 27.795 33.480 1.00 0.00 C ATOM 1307 CD1 LEU A 80 29.231 26.333 33.226 1.00 0.00 C ATOM 1308 CD2 LEU A 80 28.290 28.399 32.172 1.00 0.00 C ATOM 0 H LEU A 80 29.106 29.596 35.911 1.00 0.00 H new ATOM 0 HA LEU A 80 26.849 29.638 34.056 1.00 0.00 H new ATOM 0 HB2 LEU A 80 28.292 27.401 35.534 1.00 0.00 H new ATOM 0 HB3 LEU A 80 26.974 27.181 34.400 1.00 0.00 H new ATOM 0 HG LEU A 80 29.676 28.414 33.776 1.00 0.00 H new ATOM 0 HD11 LEU A 80 29.945 26.290 32.404 1.00 0.00 H new ATOM 0 HD12 LEU A 80 29.688 25.920 34.125 1.00 0.00 H new ATOM 0 HD13 LEU A 80 28.346 25.752 32.969 1.00 0.00 H new ATOM 0 HD21 LEU A 80 29.059 28.343 31.402 1.00 0.00 H new ATOM 0 HD22 LEU A 80 27.411 27.841 31.849 1.00 0.00 H new ATOM 0 HD23 LEU A 80 28.017 29.441 32.338 1.00 0.00 H new ATOM 1320 N PRO A 81 25.038 28.869 35.769 1.00 0.00 N ATOM 1321 CA PRO A 81 24.006 28.993 36.756 1.00 0.00 C ATOM 1322 C PRO A 81 24.125 28.031 37.888 1.00 0.00 C ATOM 1323 O PRO A 81 24.816 27.020 37.764 1.00 0.00 O ATOM 1324 CB PRO A 81 22.708 28.700 36.007 1.00 0.00 C ATOM 1325 CG PRO A 81 23.036 28.988 34.532 1.00 0.00 C ATOM 1326 CD PRO A 81 24.507 28.550 34.453 1.00 0.00 C ATOM 0 HA PRO A 81 24.060 29.984 37.206 1.00 0.00 H new ATOM 0 HB2 PRO A 81 22.394 27.666 36.148 1.00 0.00 H new ATOM 0 HB3 PRO A 81 21.894 29.332 36.363 1.00 0.00 H new ATOM 0 HG2 PRO A 81 22.402 28.419 33.852 1.00 0.00 H new ATOM 0 HG3 PRO A 81 22.908 30.041 34.281 1.00 0.00 H new ATOM 0 HD2 PRO A 81 24.596 27.486 34.233 1.00 0.00 H new ATOM 0 HD3 PRO A 81 25.041 29.083 33.667 1.00 0.00 H new ATOM 1334 N GLU A 82 23.449 28.282 39.023 1.00 0.00 N ATOM 1335 CA GLU A 82 23.237 27.272 40.011 1.00 0.00 C ATOM 1336 C GLU A 82 21.956 26.543 39.791 1.00 0.00 C ATOM 1337 O GLU A 82 21.882 25.324 39.938 1.00 0.00 O ATOM 1338 CB GLU A 82 23.360 27.786 41.455 1.00 0.00 C ATOM 1339 CG GLU A 82 22.302 28.766 41.967 1.00 0.00 C ATOM 1340 CD GLU A 82 22.500 29.014 43.455 1.00 0.00 C ATOM 1341 OE1 GLU A 82 22.354 28.040 44.241 1.00 0.00 O ATOM 1342 OE2 GLU A 82 22.792 30.169 43.864 1.00 0.00 O ATOM 0 H GLU A 82 23.047 29.190 39.257 1.00 0.00 H new ATOM 0 HA GLU A 82 24.052 26.559 39.882 1.00 0.00 H new ATOM 0 HB2 GLU A 82 23.360 26.920 42.117 1.00 0.00 H new ATOM 0 HB3 GLU A 82 24.334 28.265 41.556 1.00 0.00 H new ATOM 0 HG2 GLU A 82 22.371 29.707 41.421 1.00 0.00 H new ATOM 0 HG3 GLU A 82 21.305 28.365 41.786 1.00 0.00 H new ATOM 1349 N ALA A 83 20.890 27.257 39.389 1.00 0.00 N ATOM 1350 CA ALA A 83 19.621 26.686 39.060 1.00 0.00 C ATOM 1351 C ALA A 83 19.042 27.616 38.051 1.00 0.00 C ATOM 1352 O ALA A 83 19.694 27.914 37.051 1.00 0.00 O ATOM 1353 CB ALA A 83 18.747 26.544 40.319 1.00 0.00 C ATOM 0 H ALA A 83 20.913 28.272 39.289 1.00 0.00 H new ATOM 0 HA ALA A 83 19.696 25.676 38.658 1.00 0.00 H new ATOM 0 HB1 ALA A 83 17.786 26.108 40.047 1.00 0.00 H new ATOM 0 HB2 ALA A 83 19.249 25.897 41.039 1.00 0.00 H new ATOM 0 HB3 ALA A 83 18.587 27.526 40.763 1.00 0.00 H new ATOM 1359 N LYS A 84 17.837 28.163 38.295 1.00 0.00 N ATOM 1360 CA LYS A 84 17.427 29.413 37.736 1.00 0.00 C ATOM 1361 C LYS A 84 17.109 30.327 38.870 1.00 0.00 C ATOM 1362 O LYS A 84 17.929 31.143 39.288 1.00 0.00 O ATOM 1363 CB LYS A 84 16.213 29.316 36.797 1.00 0.00 C ATOM 1364 CG LYS A 84 16.473 28.831 35.370 1.00 0.00 C ATOM 1365 CD LYS A 84 16.756 27.332 35.238 1.00 0.00 C ATOM 1366 CE LYS A 84 16.591 26.780 33.821 1.00 0.00 C ATOM 1367 NZ LYS A 84 15.160 26.676 33.458 1.00 0.00 N ATOM 0 H LYS A 84 17.134 27.728 38.892 1.00 0.00 H new ATOM 0 HA LYS A 84 18.245 29.784 37.118 1.00 0.00 H new ATOM 0 HB2 LYS A 84 15.484 28.647 37.254 1.00 0.00 H new ATOM 0 HB3 LYS A 84 15.750 30.301 36.740 1.00 0.00 H new ATOM 0 HG2 LYS A 84 15.608 29.078 34.755 1.00 0.00 H new ATOM 0 HG3 LYS A 84 17.321 29.383 34.963 1.00 0.00 H new ATOM 0 HD2 LYS A 84 17.774 27.136 35.575 1.00 0.00 H new ATOM 0 HD3 LYS A 84 16.089 26.788 35.907 1.00 0.00 H new ATOM 0 HE2 LYS A 84 17.104 27.429 33.111 1.00 0.00 H new ATOM 0 HE3 LYS A 84 17.060 25.799 33.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 15.070 26.221 32.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 14.661 26.107 34.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 14.741 27.627 33.420 1.00 0.00 H new ATOM 1381 N ARG A 85 15.888 30.210 39.421 1.00 0.00 N ATOM 1382 CA ARG A 85 15.468 30.869 40.619 1.00 0.00 C ATOM 1383 C ARG A 85 15.703 29.965 41.821 1.00 0.00 C ATOM 1384 O ARG A 85 16.452 30.370 42.749 1.00 0.00 O ATOM 1385 CB ARG A 85 13.995 31.309 40.572 1.00 0.00 C ATOM 1386 CG ARG A 85 13.722 32.341 39.477 1.00 0.00 C ATOM 1387 CD ARG A 85 12.588 33.298 39.853 1.00 0.00 C ATOM 1388 NE ARG A 85 12.378 34.251 38.727 1.00 0.00 N ATOM 1389 CZ ARG A 85 13.142 35.358 38.497 1.00 0.00 C ATOM 1390 NH1 ARG A 85 14.182 35.711 39.307 1.00 0.00 N ATOM 1391 NH2 ARG A 85 12.879 36.136 37.407 1.00 0.00 N ATOM 1392 OXT ARG A 85 15.148 28.835 41.862 1.00 0.00 O ATOM 0 H ARG A 85 15.158 29.627 39.011 1.00 0.00 H new ATOM 0 HA ARG A 85 16.068 31.774 40.711 1.00 0.00 H new ATOM 0 HB2 ARG A 85 13.364 30.435 40.408 1.00 0.00 H new ATOM 0 HB3 ARG A 85 13.714 31.728 41.538 1.00 0.00 H new ATOM 0 HG2 ARG A 85 14.630 32.913 39.285 1.00 0.00 H new ATOM 0 HG3 ARG A 85 13.468 31.826 38.550 1.00 0.00 H new ATOM 0 HD2 ARG A 85 11.673 32.740 40.053 1.00 0.00 H new ATOM 0 HD3 ARG A 85 12.837 33.840 40.766 1.00 0.00 H new ATOM 0 HE ARG A 85 11.610 34.063 38.083 1.00 0.00 H new ATOM 0 HH11 ARG A 85 14.413 35.139 40.119 1.00 0.00 H new ATOM 0 HH12 ARG A 85 14.729 36.547 39.100 1.00 0.00 H new ATOM 0 HH21 ARG A 85 12.118 35.888 36.775 1.00 0.00 H new ATOM 0 HH22 ARG A 85 13.443 36.966 37.225 1.00 0.00 H new TER 1406 ARG A 85 ATOM 1407 N VAL B 198 26.925 44.087 32.885 1.00 0.00 N ATOM 1408 CA VAL B 198 28.165 43.294 33.037 1.00 0.00 C ATOM 1409 C VAL B 198 28.080 42.304 34.147 1.00 0.00 C ATOM 1410 O VAL B 198 28.789 42.353 35.151 1.00 0.00 O ATOM 1411 CB VAL B 198 29.335 44.234 33.027 1.00 0.00 C ATOM 1412 CG1 VAL B 198 29.351 45.228 34.200 1.00 0.00 C ATOM 1413 CG2 VAL B 198 30.668 43.475 32.921 1.00 0.00 C ATOM 0 HA VAL B 198 28.319 42.629 32.187 1.00 0.00 H new ATOM 0 HB VAL B 198 29.210 44.840 32.130 1.00 0.00 H new ATOM 0 HG11 VAL B 198 30.227 45.871 34.120 1.00 0.00 H new ATOM 0 HG12 VAL B 198 28.449 45.839 34.172 1.00 0.00 H new ATOM 0 HG13 VAL B 198 29.388 44.680 35.141 1.00 0.00 H new ATOM 0 HG21 VAL B 198 31.493 44.187 32.916 1.00 0.00 H new ATOM 0 HG22 VAL B 198 30.773 42.803 33.773 1.00 0.00 H new ATOM 0 HG23 VAL B 198 30.684 42.895 31.998 1.00 0.00 H new ATOM 1425 N ARG B 199 27.165 41.326 34.027 1.00 0.00 N ATOM 1426 CA ARG B 199 26.964 40.269 34.969 1.00 0.00 C ATOM 1427 C ARG B 199 27.880 39.121 34.711 1.00 0.00 C ATOM 1428 O ARG B 199 28.413 38.971 33.614 1.00 0.00 O ATOM 1429 CB ARG B 199 25.530 39.723 34.857 1.00 0.00 C ATOM 1430 CG ARG B 199 24.394 40.710 35.132 1.00 0.00 C ATOM 1431 CD ARG B 199 23.689 40.545 36.480 1.00 0.00 C ATOM 1432 NE ARG B 199 24.605 41.054 37.539 1.00 0.00 N ATOM 1433 CZ ARG B 199 24.347 40.976 38.877 1.00 0.00 C ATOM 1434 NH1 ARG B 199 23.246 40.366 39.405 1.00 0.00 N ATOM 1435 NH2 ARG B 199 25.250 41.528 39.739 1.00 0.00 N ATOM 0 H ARG B 199 26.531 41.270 33.230 1.00 0.00 H new ATOM 0 HA ARG B 199 27.157 40.690 35.956 1.00 0.00 H new ATOM 0 HB2 ARG B 199 25.396 39.322 33.852 1.00 0.00 H new ATOM 0 HB3 ARG B 199 25.429 38.887 35.550 1.00 0.00 H new ATOM 0 HG2 ARG B 199 24.793 41.722 35.072 1.00 0.00 H new ATOM 0 HG3 ARG B 199 23.652 40.613 34.339 1.00 0.00 H new ATOM 0 HD2 ARG B 199 22.750 41.098 36.490 1.00 0.00 H new ATOM 0 HD3 ARG B 199 23.445 39.498 36.657 1.00 0.00 H new ATOM 0 HE ARG B 199 25.480 41.488 37.246 1.00 0.00 H new ATOM 0 HH11 ARG B 199 22.558 39.934 38.789 1.00 0.00 H new ATOM 0 HH12 ARG B 199 23.112 40.342 40.416 1.00 0.00 H new ATOM 0 HH21 ARG B 199 26.089 41.982 39.377 1.00 0.00 H new ATOM 0 HH22 ARG B 199 25.086 41.486 40.745 1.00 0.00 H new ATOM 1449 N MET B 200 28.073 38.223 35.694 1.00 0.00 N ATOM 1450 CA MET B 200 28.870 37.045 35.560 1.00 0.00 C ATOM 1451 C MET B 200 28.214 35.964 34.770 1.00 0.00 C ATOM 1452 O MET B 200 27.755 34.950 35.297 1.00 0.00 O ATOM 1453 CB MET B 200 29.310 36.484 36.922 1.00 0.00 C ATOM 1454 CG MET B 200 30.353 37.353 37.628 1.00 0.00 C ATOM 1455 SD MET B 200 31.991 37.321 36.838 1.00 0.00 S ATOM 1456 CE MET B 200 32.786 36.163 37.988 1.00 0.00 C ATOM 0 H MET B 200 27.656 38.323 36.620 1.00 0.00 H new ATOM 0 HA MET B 200 29.749 37.373 35.004 1.00 0.00 H new ATOM 0 HB2 MET B 200 28.436 36.384 37.565 1.00 0.00 H new ATOM 0 HB3 MET B 200 29.718 35.483 36.780 1.00 0.00 H new ATOM 0 HG2 MET B 200 29.995 38.382 37.658 1.00 0.00 H new ATOM 0 HG3 MET B 200 30.451 37.019 38.661 1.00 0.00 H new ATOM 0 HE1 MET B 200 33.783 35.916 37.624 1.00 0.00 H new ATOM 0 HE2 MET B 200 32.863 36.623 38.973 1.00 0.00 H new ATOM 0 HE3 MET B 200 32.190 35.253 38.058 1.00 0.00 H new ATOM 1466 N ASN B 201 28.181 36.127 33.437 1.00 0.00 N ATOM 1467 CA ASN B 201 27.790 35.126 32.493 1.00 0.00 C ATOM 1468 C ASN B 201 29.002 34.727 31.724 1.00 0.00 C ATOM 1469 O ASN B 201 30.072 35.311 31.885 1.00 0.00 O ATOM 1470 CB ASN B 201 26.695 35.646 31.546 1.00 0.00 C ATOM 1471 CG ASN B 201 25.494 36.189 32.306 1.00 0.00 C ATOM 1472 OD1 ASN B 201 25.034 37.309 32.088 1.00 0.00 O ATOM 1473 ND2 ASN B 201 24.921 35.366 33.225 1.00 0.00 N ATOM 0 H ASN B 201 28.442 37.007 32.992 1.00 0.00 H new ATOM 0 HA ASN B 201 27.372 34.268 33.019 1.00 0.00 H new ATOM 0 HB2 ASN B 201 27.107 36.431 30.911 1.00 0.00 H new ATOM 0 HB3 ASN B 201 26.373 34.840 30.887 1.00 0.00 H new ATOM 0 HD21 ASN B 201 24.099 35.675 33.744 1.00 0.00 H new ATOM 0 HD22 ASN B 201 25.313 34.440 33.395 1.00 0.00 H new ATOM 1480 N ILE B 202 28.912 33.734 30.821 1.00 0.00 N ATOM 1481 CA ILE B 202 30.004 33.272 30.023 1.00 0.00 C ATOM 1482 C ILE B 202 30.550 34.312 29.106 1.00 0.00 C ATOM 1483 O ILE B 202 31.745 34.333 28.816 1.00 0.00 O ATOM 1484 CB ILE B 202 29.654 31.998 29.314 1.00 0.00 C ATOM 1485 CG1 ILE B 202 29.721 30.803 30.282 1.00 0.00 C ATOM 1486 CG2 ILE B 202 30.484 31.741 28.045 1.00 0.00 C ATOM 1487 CD1 ILE B 202 31.121 30.289 30.617 1.00 0.00 C ATOM 0 H ILE B 202 28.042 33.233 30.640 1.00 0.00 H new ATOM 0 HA ILE B 202 30.821 33.050 30.709 1.00 0.00 H new ATOM 0 HB ILE B 202 28.628 32.116 28.966 1.00 0.00 H new ATOM 0 HG12 ILE B 202 29.227 31.086 31.212 1.00 0.00 H new ATOM 0 HG13 ILE B 202 29.147 29.981 29.854 1.00 0.00 H new ATOM 0 HG21 ILE B 202 30.171 30.801 27.590 1.00 0.00 H new ATOM 0 HG22 ILE B 202 30.329 32.556 27.338 1.00 0.00 H new ATOM 0 HG23 ILE B 202 31.541 31.684 28.307 1.00 0.00 H new ATOM 0 HD11 ILE B 202 31.045 29.448 31.306 1.00 0.00 H new ATOM 0 HD12 ILE B 202 31.618 29.965 29.703 1.00 0.00 H new ATOM 0 HD13 ILE B 202 31.700 31.087 31.082 1.00 0.00 H new ATOM 1499 N GLN B 203 29.708 35.269 28.674 1.00 0.00 N ATOM 1500 CA GLN B 203 30.048 36.453 27.949 1.00 0.00 C ATOM 1501 C GLN B 203 31.279 37.161 28.400 1.00 0.00 C ATOM 1502 O GLN B 203 32.094 37.602 27.590 1.00 0.00 O ATOM 1503 CB GLN B 203 28.873 37.444 28.019 1.00 0.00 C ATOM 1504 CG GLN B 203 28.945 38.563 26.980 1.00 0.00 C ATOM 1505 CD GLN B 203 28.187 39.823 27.374 1.00 0.00 C ATOM 1506 OE1 GLN B 203 26.942 39.687 27.902 1.00 0.00 O flip ATOM 1507 NE2 GLN B 203 28.698 40.928 27.194 1.00 0.00 N flip ATOM 0 H GLN B 203 28.705 35.206 28.848 1.00 0.00 H new ATOM 0 HA GLN B 203 30.256 36.108 26.936 1.00 0.00 H new ATOM 0 HB2 GLN B 203 27.940 36.897 27.885 1.00 0.00 H new ATOM 0 HB3 GLN B 203 28.843 37.887 29.014 1.00 0.00 H new ATOM 0 HG2 GLN B 203 29.991 38.819 26.809 1.00 0.00 H new ATOM 0 HG3 GLN B 203 28.548 38.193 26.035 1.00 0.00 H new ATOM 0 HE21 GLN B 203 29.634 40.998 26.796 1.00 0.00 H new ATOM 0 HE22 GLN B 203 28.185 41.774 27.443 1.00 0.00 H new ATOM 1516 N MET B 204 31.487 37.249 29.726 1.00 0.00 N ATOM 1517 CA MET B 204 32.596 37.870 30.382 1.00 0.00 C ATOM 1518 C MET B 204 33.937 37.437 29.898 1.00 0.00 C ATOM 1519 O MET B 204 34.825 38.257 29.671 1.00 0.00 O ATOM 1520 CB MET B 204 32.528 37.608 31.896 1.00 0.00 C ATOM 1521 CG MET B 204 31.332 38.289 32.564 1.00 0.00 C ATOM 1522 SD MET B 204 31.488 40.099 32.639 1.00 0.00 S ATOM 1523 CE MET B 204 32.041 40.133 34.368 1.00 0.00 C ATOM 0 H MET B 204 30.824 36.853 30.392 1.00 0.00 H new ATOM 0 HA MET B 204 32.501 38.929 30.144 1.00 0.00 H new ATOM 0 HB2 MET B 204 32.473 36.534 32.072 1.00 0.00 H new ATOM 0 HB3 MET B 204 33.448 37.961 32.362 1.00 0.00 H new ATOM 0 HG2 MET B 204 30.424 38.031 32.018 1.00 0.00 H new ATOM 0 HG3 MET B 204 31.218 37.898 33.575 1.00 0.00 H new ATOM 0 HE1 MET B 204 32.231 41.163 34.669 1.00 0.00 H new ATOM 0 HE2 MET B 204 31.268 39.705 35.006 1.00 0.00 H new ATOM 0 HE3 MET B 204 32.957 39.551 34.469 1.00 0.00 H new ATOM 1533 N LEU B 205 34.137 36.127 29.667 1.00 0.00 N ATOM 1534 CA LEU B 205 35.337 35.579 29.115 1.00 0.00 C ATOM 1535 C LEU B 205 35.725 36.115 27.780 1.00 0.00 C ATOM 1536 O LEU B 205 36.906 36.258 27.469 1.00 0.00 O ATOM 1537 CB LEU B 205 35.282 34.044 29.055 1.00 0.00 C ATOM 1538 CG LEU B 205 35.658 33.356 30.379 1.00 0.00 C ATOM 1539 CD1 LEU B 205 34.616 33.495 31.501 1.00 0.00 C ATOM 1540 CD2 LEU B 205 36.009 31.886 30.091 1.00 0.00 C ATOM 0 H LEU B 205 33.432 35.420 29.874 1.00 0.00 H new ATOM 0 HA LEU B 205 36.113 35.902 29.809 1.00 0.00 H new ATOM 0 HB2 LEU B 205 34.276 33.737 28.770 1.00 0.00 H new ATOM 0 HB3 LEU B 205 35.955 33.696 28.272 1.00 0.00 H new ATOM 0 HG LEU B 205 36.527 33.879 30.777 1.00 0.00 H new ATOM 0 HD11 LEU B 205 34.970 32.978 32.393 1.00 0.00 H new ATOM 0 HD12 LEU B 205 34.465 34.550 31.729 1.00 0.00 H new ATOM 0 HD13 LEU B 205 33.672 33.056 31.178 1.00 0.00 H new ATOM 0 HD21 LEU B 205 36.278 31.387 31.022 1.00 0.00 H new ATOM 0 HD22 LEU B 205 35.148 31.387 29.647 1.00 0.00 H new ATOM 0 HD23 LEU B 205 36.851 31.842 29.400 1.00 0.00 H new ATOM 1552 N LEU B 206 34.737 36.428 26.922 1.00 0.00 N ATOM 1553 CA LEU B 206 34.996 36.838 25.577 1.00 0.00 C ATOM 1554 C LEU B 206 35.364 38.282 25.556 1.00 0.00 C ATOM 1555 O LEU B 206 35.992 38.778 24.623 1.00 0.00 O ATOM 1556 CB LEU B 206 33.869 36.315 24.671 1.00 0.00 C ATOM 1557 CG LEU B 206 33.541 34.840 24.958 1.00 0.00 C ATOM 1558 CD1 LEU B 206 32.601 34.233 23.904 1.00 0.00 C ATOM 1559 CD2 LEU B 206 34.790 33.959 25.124 1.00 0.00 C ATOM 0 H LEU B 206 33.747 36.396 27.165 1.00 0.00 H new ATOM 0 HA LEU B 206 35.880 36.385 25.130 1.00 0.00 H new ATOM 0 HB2 LEU B 206 32.975 36.921 24.817 1.00 0.00 H new ATOM 0 HB3 LEU B 206 34.162 36.425 23.627 1.00 0.00 H new ATOM 0 HG LEU B 206 33.022 34.851 25.916 1.00 0.00 H new ATOM 0 HD11 LEU B 206 32.401 33.191 24.152 1.00 0.00 H new ATOM 0 HD12 LEU B 206 31.664 34.789 23.889 1.00 0.00 H new ATOM 0 HD13 LEU B 206 33.071 34.288 22.922 1.00 0.00 H new ATOM 0 HD21 LEU B 206 34.486 32.931 25.324 1.00 0.00 H new ATOM 0 HD22 LEU B 206 35.382 33.991 24.209 1.00 0.00 H new ATOM 0 HD23 LEU B 206 35.388 34.329 25.956 1.00 0.00 H new ATOM 1571 N GLU B 207 35.006 39.008 26.630 1.00 0.00 N ATOM 1572 CA GLU B 207 35.426 40.354 26.865 1.00 0.00 C ATOM 1573 C GLU B 207 36.802 40.376 27.439 1.00 0.00 C ATOM 1574 O GLU B 207 37.687 41.078 26.952 1.00 0.00 O ATOM 1575 CB GLU B 207 34.458 41.101 27.799 1.00 0.00 C ATOM 1576 CG GLU B 207 32.987 41.080 27.375 1.00 0.00 C ATOM 1577 CD GLU B 207 32.679 41.932 26.152 1.00 0.00 C ATOM 1578 OE1 GLU B 207 32.504 43.170 26.307 1.00 0.00 O ATOM 1579 OE2 GLU B 207 32.543 41.367 25.034 1.00 0.00 O ATOM 0 H GLU B 207 34.400 38.642 27.364 1.00 0.00 H new ATOM 0 HA GLU B 207 35.426 40.867 25.903 1.00 0.00 H new ATOM 0 HB2 GLU B 207 34.537 40.669 28.797 1.00 0.00 H new ATOM 0 HB3 GLU B 207 34.782 42.139 27.875 1.00 0.00 H new ATOM 0 HG2 GLU B 207 32.694 40.050 27.170 1.00 0.00 H new ATOM 0 HG3 GLU B 207 32.375 41.426 28.208 1.00 0.00 H new ATOM 1586 N ALA B 208 37.027 39.575 28.494 1.00 0.00 N ATOM 1587 CA ALA B 208 38.256 39.368 29.197 1.00 0.00 C ATOM 1588 C ALA B 208 39.385 38.895 28.347 1.00 0.00 C ATOM 1589 O ALA B 208 40.502 39.397 28.455 1.00 0.00 O ATOM 1590 CB ALA B 208 38.036 38.347 30.326 1.00 0.00 C ATOM 0 H ALA B 208 36.272 39.017 28.894 1.00 0.00 H new ATOM 0 HA ALA B 208 38.542 40.347 29.581 1.00 0.00 H new ATOM 0 HB1 ALA B 208 38.972 38.189 30.861 1.00 0.00 H new ATOM 0 HB2 ALA B 208 37.282 38.725 31.017 1.00 0.00 H new ATOM 0 HB3 ALA B 208 37.697 37.402 29.901 1.00 0.00 H new ATOM 1596 N ALA B 209 39.136 37.938 27.437 1.00 0.00 N ATOM 1597 CA ALA B 209 40.084 37.446 26.486 1.00 0.00 C ATOM 1598 C ALA B 209 40.589 38.508 25.570 1.00 0.00 C ATOM 1599 O ALA B 209 41.790 38.613 25.324 1.00 0.00 O ATOM 1600 CB ALA B 209 39.474 36.294 25.669 1.00 0.00 C ATOM 0 H ALA B 209 38.226 37.484 27.360 1.00 0.00 H new ATOM 0 HA ALA B 209 40.939 37.081 27.056 1.00 0.00 H new ATOM 0 HB1 ALA B 209 40.207 35.930 24.949 1.00 0.00 H new ATOM 0 HB2 ALA B 209 39.190 35.483 26.340 1.00 0.00 H new ATOM 0 HB3 ALA B 209 38.592 36.652 25.138 1.00 0.00 H new ATOM 1606 N ASP B 210 39.699 39.382 25.067 1.00 0.00 N ATOM 1607 CA ASP B 210 40.040 40.448 24.176 1.00 0.00 C ATOM 1608 C ASP B 210 40.764 41.553 24.864 1.00 0.00 C ATOM 1609 O ASP B 210 41.673 42.177 24.319 1.00 0.00 O ATOM 1610 CB ASP B 210 38.732 40.928 23.523 1.00 0.00 C ATOM 1611 CG ASP B 210 38.990 41.724 22.251 1.00 0.00 C ATOM 1612 OD1 ASP B 210 39.528 41.144 21.271 1.00 0.00 O ATOM 1613 OD2 ASP B 210 38.620 42.928 22.216 1.00 0.00 O ATOM 0 H ASP B 210 38.704 39.345 25.289 1.00 0.00 H new ATOM 0 HA ASP B 210 40.734 40.092 23.415 1.00 0.00 H new ATOM 0 HB2 ASP B 210 38.105 40.067 23.291 1.00 0.00 H new ATOM 0 HB3 ASP B 210 38.178 41.545 24.231 1.00 0.00 H new ATOM 1618 N TYR B 211 40.410 41.827 26.132 1.00 0.00 N ATOM 1619 CA TYR B 211 41.090 42.708 27.030 1.00 0.00 C ATOM 1620 C TYR B 211 42.494 42.271 27.275 1.00 0.00 C ATOM 1621 O TYR B 211 43.436 43.052 27.139 1.00 0.00 O ATOM 1622 CB TYR B 211 40.239 42.807 28.306 1.00 0.00 C ATOM 1623 CG TYR B 211 40.889 43.413 29.502 1.00 0.00 C ATOM 1624 CD1 TYR B 211 41.564 42.598 30.380 1.00 0.00 C ATOM 1625 CD2 TYR B 211 40.761 44.751 29.794 1.00 0.00 C ATOM 1626 CE1 TYR B 211 42.076 43.100 31.554 1.00 0.00 C ATOM 1627 CE2 TYR B 211 41.264 45.259 30.969 1.00 0.00 C ATOM 1628 CZ TYR B 211 41.911 44.431 31.856 1.00 0.00 C ATOM 1629 OH TYR B 211 42.396 44.923 33.087 1.00 0.00 O ATOM 0 H TYR B 211 39.588 41.401 26.560 1.00 0.00 H new ATOM 0 HA TYR B 211 41.193 43.703 26.598 1.00 0.00 H new ATOM 0 HB2 TYR B 211 39.346 43.387 28.074 1.00 0.00 H new ATOM 0 HB3 TYR B 211 39.907 41.803 28.572 1.00 0.00 H new ATOM 0 HD1 TYR B 211 41.694 41.552 30.145 1.00 0.00 H new ATOM 0 HD2 TYR B 211 40.262 45.407 29.096 1.00 0.00 H new ATOM 0 HE1 TYR B 211 42.606 42.451 32.236 1.00 0.00 H new ATOM 0 HE2 TYR B 211 41.151 46.309 31.195 1.00 0.00 H new ATOM 0 HH TYR B 211 42.205 45.882 33.154 1.00 0.00 H new ATOM 1639 N LEU B 212 42.715 40.988 27.612 1.00 0.00 N ATOM 1640 CA LEU B 212 44.010 40.443 27.876 1.00 0.00 C ATOM 1641 C LEU B 212 44.896 40.336 26.682 1.00 0.00 C ATOM 1642 O LEU B 212 46.118 40.372 26.815 1.00 0.00 O ATOM 1643 CB LEU B 212 43.887 39.092 28.602 1.00 0.00 C ATOM 1644 CG LEU B 212 43.842 39.186 30.136 1.00 0.00 C ATOM 1645 CD1 LEU B 212 43.479 37.800 30.693 1.00 0.00 C ATOM 1646 CD2 LEU B 212 45.151 39.698 30.760 1.00 0.00 C ATOM 0 H LEU B 212 41.963 40.305 27.704 1.00 0.00 H new ATOM 0 HA LEU B 212 44.506 41.163 28.527 1.00 0.00 H new ATOM 0 HB2 LEU B 212 42.983 38.591 28.256 1.00 0.00 H new ATOM 0 HB3 LEU B 212 44.730 38.463 28.315 1.00 0.00 H new ATOM 0 HG LEU B 212 43.087 39.924 30.405 1.00 0.00 H new ATOM 0 HD11 LEU B 212 43.441 37.844 31.781 1.00 0.00 H new ATOM 0 HD12 LEU B 212 42.505 37.497 30.308 1.00 0.00 H new ATOM 0 HD13 LEU B 212 44.233 37.075 30.385 1.00 0.00 H new ATOM 0 HD21 LEU B 212 45.046 39.738 31.844 1.00 0.00 H new ATOM 0 HD22 LEU B 212 45.967 39.023 30.499 1.00 0.00 H new ATOM 0 HD23 LEU B 212 45.370 40.696 30.379 1.00 0.00 H new ATOM 1658 N GLU B 213 44.357 40.254 25.452 1.00 0.00 N ATOM 1659 CA GLU B 213 45.126 40.420 24.258 1.00 0.00 C ATOM 1660 C GLU B 213 45.716 41.782 24.123 1.00 0.00 C ATOM 1661 O GLU B 213 46.906 41.938 23.853 1.00 0.00 O ATOM 1662 CB GLU B 213 44.342 40.094 22.975 1.00 0.00 C ATOM 1663 CG GLU B 213 44.098 38.595 22.790 1.00 0.00 C ATOM 1664 CD GLU B 213 43.807 38.266 21.332 1.00 0.00 C ATOM 1665 OE1 GLU B 213 42.674 38.532 20.850 1.00 0.00 O ATOM 1666 OE2 GLU B 213 44.721 37.741 20.642 1.00 0.00 O ATOM 0 H GLU B 213 43.368 40.069 25.284 1.00 0.00 H new ATOM 0 HA GLU B 213 45.932 39.695 24.369 1.00 0.00 H new ATOM 0 HB2 GLU B 213 43.384 40.613 22.999 1.00 0.00 H new ATOM 0 HB3 GLU B 213 44.890 40.477 22.114 1.00 0.00 H new ATOM 0 HG2 GLU B 213 44.972 38.036 23.125 1.00 0.00 H new ATOM 0 HG3 GLU B 213 43.260 38.280 23.412 1.00 0.00 H new ATOM 1673 N ARG B 214 44.912 42.834 24.353 1.00 0.00 N ATOM 1674 CA ARG B 214 45.365 44.190 24.366 1.00 0.00 C ATOM 1675 C ARG B 214 46.323 44.491 25.468 1.00 0.00 C ATOM 1676 O ARG B 214 47.301 45.214 25.285 1.00 0.00 O ATOM 1677 CB ARG B 214 44.193 45.184 24.442 1.00 0.00 C ATOM 1678 CG ARG B 214 43.374 45.269 23.154 1.00 0.00 C ATOM 1679 CD ARG B 214 42.526 46.542 23.092 1.00 0.00 C ATOM 1680 NE ARG B 214 41.913 46.640 21.738 1.00 0.00 N ATOM 1681 CZ ARG B 214 40.619 47.014 21.516 1.00 0.00 C ATOM 1682 NH1 ARG B 214 39.642 46.857 22.456 1.00 0.00 N ATOM 1683 NH2 ARG B 214 40.270 47.514 20.295 1.00 0.00 N ATOM 0 H ARG B 214 43.913 42.738 24.536 1.00 0.00 H new ATOM 0 HA ARG B 214 45.894 44.312 23.421 1.00 0.00 H new ATOM 0 HB2 ARG B 214 43.535 44.895 25.262 1.00 0.00 H new ATOM 0 HB3 ARG B 214 44.583 46.174 24.680 1.00 0.00 H new ATOM 0 HG2 ARG B 214 44.045 45.239 22.296 1.00 0.00 H new ATOM 0 HG3 ARG B 214 42.724 44.397 23.080 1.00 0.00 H new ATOM 0 HD2 ARG B 214 41.750 46.517 23.857 1.00 0.00 H new ATOM 0 HD3 ARG B 214 43.143 47.418 23.292 1.00 0.00 H new ATOM 0 HE ARG B 214 42.494 46.415 20.930 1.00 0.00 H new ATOM 0 HH11 ARG B 214 39.868 46.448 23.363 1.00 0.00 H new ATOM 0 HH12 ARG B 214 38.686 47.149 22.252 1.00 0.00 H new ATOM 0 HH21 ARG B 214 40.973 47.605 19.561 1.00 0.00 H new ATOM 0 HH22 ARG B 214 39.307 47.797 20.116 1.00 0.00 H new ATOM 1697 N ARG B 215 46.093 43.939 26.673 1.00 0.00 N ATOM 1698 CA ARG B 215 46.932 44.139 27.813 1.00 0.00 C ATOM 1699 C ARG B 215 48.281 43.508 27.739 1.00 0.00 C ATOM 1700 O ARG B 215 49.247 44.017 28.303 1.00 0.00 O ATOM 1701 CB ARG B 215 46.193 43.768 29.110 1.00 0.00 C ATOM 1702 CG ARG B 215 46.501 44.809 30.187 1.00 0.00 C ATOM 1703 CD ARG B 215 45.748 44.659 31.510 1.00 0.00 C ATOM 1704 NE ARG B 215 46.162 45.855 32.299 1.00 0.00 N ATOM 1705 CZ ARG B 215 46.809 45.801 33.499 1.00 0.00 C ATOM 1706 NH1 ARG B 215 46.697 44.738 34.346 1.00 0.00 N ATOM 1707 NH2 ARG B 215 47.613 46.842 33.863 1.00 0.00 N ATOM 0 H ARG B 215 45.295 43.332 26.860 1.00 0.00 H new ATOM 0 HA ARG B 215 47.148 45.207 27.818 1.00 0.00 H new ATOM 0 HB2 ARG B 215 45.119 43.723 28.929 1.00 0.00 H new ATOM 0 HB3 ARG B 215 46.501 42.778 29.447 1.00 0.00 H new ATOM 0 HG2 ARG B 215 47.570 44.778 30.397 1.00 0.00 H new ATOM 0 HG3 ARG B 215 46.284 45.797 29.780 1.00 0.00 H new ATOM 0 HD2 ARG B 215 44.669 44.637 31.355 1.00 0.00 H new ATOM 0 HD3 ARG B 215 46.016 43.733 32.019 1.00 0.00 H new ATOM 0 HE ARG B 215 45.947 46.775 31.916 1.00 0.00 H new ATOM 0 HH11 ARG B 215 46.112 43.942 34.091 1.00 0.00 H new ATOM 0 HH12 ARG B 215 47.198 44.739 35.234 1.00 0.00 H new ATOM 0 HH21 ARG B 215 47.722 47.643 33.242 1.00 0.00 H new ATOM 0 HH22 ARG B 215 48.104 46.819 34.757 1.00 0.00 H new ATOM 1721 N GLU B 216 48.439 42.399 26.993 1.00 0.00 N ATOM 1722 CA GLU B 216 49.726 41.852 26.698 1.00 0.00 C ATOM 1723 C GLU B 216 50.533 42.691 25.768 1.00 0.00 C ATOM 1724 O GLU B 216 51.760 42.694 25.850 1.00 0.00 O ATOM 1725 CB GLU B 216 49.679 40.404 26.185 1.00 0.00 C ATOM 1726 CG GLU B 216 49.392 39.403 27.306 1.00 0.00 C ATOM 1727 CD GLU B 216 49.677 37.967 26.892 1.00 0.00 C ATOM 1728 OE1 GLU B 216 49.060 37.476 25.910 1.00 0.00 O ATOM 1729 OE2 GLU B 216 50.475 37.289 27.594 1.00 0.00 O ATOM 0 H GLU B 216 47.662 41.875 26.589 1.00 0.00 H new ATOM 0 HA GLU B 216 50.228 41.847 27.666 1.00 0.00 H new ATOM 0 HB2 GLU B 216 48.910 40.317 25.417 1.00 0.00 H new ATOM 0 HB3 GLU B 216 50.630 40.156 25.714 1.00 0.00 H new ATOM 0 HG2 GLU B 216 49.998 39.654 28.177 1.00 0.00 H new ATOM 0 HG3 GLU B 216 48.348 39.490 27.608 1.00 0.00 H new ATOM 1736 N ARG B 217 49.910 43.501 24.892 1.00 0.00 N ATOM 1737 CA ARG B 217 50.597 44.409 24.028 1.00 0.00 C ATOM 1738 C ARG B 217 51.306 45.493 24.765 1.00 0.00 C ATOM 1739 O ARG B 217 52.337 46.000 24.326 1.00 0.00 O ATOM 1740 CB ARG B 217 49.672 44.896 22.900 1.00 0.00 C ATOM 1741 CG ARG B 217 49.284 46.373 22.816 1.00 0.00 C ATOM 1742 CD ARG B 217 50.265 47.330 22.137 1.00 0.00 C ATOM 1743 NE ARG B 217 50.426 46.895 20.722 1.00 0.00 N ATOM 1744 CZ ARG B 217 50.921 47.673 19.716 1.00 0.00 C ATOM 1745 NH1 ARG B 217 51.407 48.930 19.929 1.00 0.00 N ATOM 1746 NH2 ARG B 217 50.915 47.153 18.454 1.00 0.00 N ATOM 0 H ARG B 217 48.896 43.524 24.782 1.00 0.00 H new ATOM 0 HA ARG B 217 51.405 43.864 23.541 1.00 0.00 H new ATOM 0 HB2 ARG B 217 50.145 44.630 21.955 1.00 0.00 H new ATOM 0 HB3 ARG B 217 48.748 44.321 22.967 1.00 0.00 H new ATOM 0 HG2 ARG B 217 48.332 46.440 22.289 1.00 0.00 H new ATOM 0 HG3 ARG B 217 49.113 46.733 23.831 1.00 0.00 H new ATOM 0 HD2 ARG B 217 49.892 48.353 22.181 1.00 0.00 H new ATOM 0 HD3 ARG B 217 51.226 47.319 22.651 1.00 0.00 H new ATOM 0 HE ARG B 217 50.145 45.943 20.487 1.00 0.00 H new ATOM 0 HH11 ARG B 217 51.410 49.323 20.870 1.00 0.00 H new ATOM 0 HH12 ARG B 217 51.768 49.477 19.147 1.00 0.00 H new ATOM 0 HH21 ARG B 217 50.549 46.215 18.291 1.00 0.00 H new ATOM 0 HH22 ARG B 217 51.276 47.702 17.674 1.00 0.00 H new ATOM 1760 N GLU B 218 50.840 45.855 25.974 1.00 0.00 N ATOM 1761 CA GLU B 218 51.545 46.732 26.855 1.00 0.00 C ATOM 1762 C GLU B 218 52.802 46.144 27.396 1.00 0.00 C ATOM 1763 O GLU B 218 53.822 46.821 27.519 1.00 0.00 O ATOM 1764 CB GLU B 218 50.663 47.222 28.018 1.00 0.00 C ATOM 1765 CG GLU B 218 49.394 47.895 27.494 1.00 0.00 C ATOM 1766 CD GLU B 218 48.748 48.822 28.513 1.00 0.00 C ATOM 1767 OE1 GLU B 218 49.230 49.977 28.661 1.00 0.00 O ATOM 1768 OE2 GLU B 218 47.735 48.427 29.150 1.00 0.00 O ATOM 0 H GLU B 218 49.949 45.529 26.348 1.00 0.00 H new ATOM 0 HA GLU B 218 51.820 47.585 26.234 1.00 0.00 H new ATOM 0 HB2 GLU B 218 50.396 46.380 28.657 1.00 0.00 H new ATOM 0 HB3 GLU B 218 51.224 47.924 28.634 1.00 0.00 H new ATOM 0 HG2 GLU B 218 49.635 48.463 26.596 1.00 0.00 H new ATOM 0 HG3 GLU B 218 48.676 47.128 27.203 1.00 0.00 H new ATOM 1775 N ALA B 219 52.814 44.829 27.679 1.00 0.00 N ATOM 1776 CA ALA B 219 53.970 44.088 28.078 1.00 0.00 C ATOM 1777 C ALA B 219 54.974 43.932 26.987 1.00 0.00 C ATOM 1778 O ALA B 219 56.147 43.655 27.235 1.00 0.00 O ATOM 1779 CB ALA B 219 53.556 42.717 28.636 1.00 0.00 C ATOM 0 H ALA B 219 51.974 44.253 27.627 1.00 0.00 H new ATOM 0 HA ALA B 219 54.459 44.667 28.862 1.00 0.00 H new ATOM 0 HB1 ALA B 219 54.445 42.163 28.936 1.00 0.00 H new ATOM 0 HB2 ALA B 219 52.907 42.857 29.500 1.00 0.00 H new ATOM 0 HB3 ALA B 219 53.022 42.158 27.868 1.00 0.00 H new ATOM 1785 N GLU B 220 54.561 44.119 25.721 1.00 0.00 N ATOM 1786 CA GLU B 220 55.431 44.047 24.588 1.00 0.00 C ATOM 1787 C GLU B 220 56.331 45.224 24.430 1.00 0.00 C ATOM 1788 O GLU B 220 57.337 45.130 23.728 1.00 0.00 O ATOM 1789 CB GLU B 220 54.682 43.810 23.266 1.00 0.00 C ATOM 1790 CG GLU B 220 54.016 42.434 23.180 1.00 0.00 C ATOM 1791 CD GLU B 220 53.308 42.175 21.858 1.00 0.00 C ATOM 1792 OE1 GLU B 220 53.341 43.035 20.937 1.00 0.00 O ATOM 1793 OE2 GLU B 220 52.699 41.081 21.712 1.00 0.00 O ATOM 0 H GLU B 220 53.592 44.327 25.478 1.00 0.00 H new ATOM 0 HA GLU B 220 56.053 43.179 24.808 1.00 0.00 H new ATOM 0 HB2 GLU B 220 53.921 44.581 23.145 1.00 0.00 H new ATOM 0 HB3 GLU B 220 55.381 43.919 22.437 1.00 0.00 H new ATOM 0 HG2 GLU B 220 54.773 41.664 23.333 1.00 0.00 H new ATOM 0 HG3 GLU B 220 53.295 42.338 23.992 1.00 0.00 H new ATOM 1800 N HIS B 221 56.057 46.375 25.069 1.00 0.00 N ATOM 1801 CA HIS B 221 56.874 47.535 24.890 1.00 0.00 C ATOM 1802 C HIS B 221 58.173 47.565 25.683 1.00 0.00 C ATOM 1803 O HIS B 221 58.951 48.533 25.473 1.00 0.00 O ATOM 1804 CB HIS B 221 56.133 48.871 25.074 1.00 0.00 C ATOM 1805 CG HIS B 221 56.121 49.482 26.443 1.00 0.00 C ATOM 1806 ND1 HIS B 221 55.400 48.966 27.488 1.00 0.00 N ATOM 1807 CD2 HIS B 221 56.685 50.634 26.896 1.00 0.00 C ATOM 1808 CE1 HIS B 221 55.507 49.770 28.529 1.00 0.00 C ATOM 1809 NE2 HIS B 221 56.273 50.790 28.193 1.00 0.00 N ATOM 1810 OXT HIS B 221 58.463 46.660 26.510 1.00 0.00 O ATOM 0 H HIS B 221 55.272 46.503 25.708 1.00 0.00 H new ATOM 0 HA HIS B 221 57.148 47.430 23.840 1.00 0.00 H new ATOM 0 HB2 HIS B 221 56.573 49.595 24.388 1.00 0.00 H new ATOM 0 HB3 HIS B 221 55.098 48.726 24.763 1.00 0.00 H new ATOM 0 HD1 HIS B 221 54.865 48.098 27.465 1.00 0.00 H new ATOM 0 HD2 HIS B 221 57.332 51.297 26.341 1.00 0.00 H new ATOM 0 HE1 HIS B 221 55.045 49.618 29.493 1.00 0.00 H new TER 1819 HIS B 221