Browse entries in the PDBbind-CN Database
HEADER 5UR6_COMPLEX COMPND 5UR6_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 146 PRO SER GLU LEU THR PRO GLU GLU ARG SER GLU LEU LYS SEQRES 2 A 146 ASN SER ILE ALA GLU PHE HIS THR TYR GLN LEU ASP PRO SEQRES 3 A 146 GLY SER CYS SER SER LEU HIS ALA GLN ARG ILE HIS ALA SEQRES 4 A 146 PRO PRO GLU LEU VAL TRP SER ILE VAL ARG ARG PHE ASP SEQRES 5 A 146 LYS PRO GLN THR TYR LYS HIS PHE ILE LYS SER CYS SER SEQRES 6 A 146 VAL GLU GLN ASN PHE GLU MET ARG VAL GLY CYS THR ARG SEQRES 7 A 146 ASP VAL ILE VAL ILE SER GLY LEU PRO ALA ASN THR SER SEQRES 8 A 146 THR GLU ARG LEU ASP ILE LEU ASP ASP GLU ARG ARG VAL SEQRES 9 A 146 THR GLY PHE SER ILE ILE GLY GLY GLU HIS ARG LEU THR SEQRES 10 A 146 ASN TYR LYS SER VAL THR THR VAL HIS ARG PHE GLU LYS SEQRES 11 A 146 GLU ASN ARG ILE TRP THR VAL VAL LEU GLU SER TYR VAL SEQRES 12 A 146 VAL ASP MET SEQRES 1 A 27 ASP THR ARG MET PHE ALA ASP THR VAL VAL LYS LEU ASN SEQRES 2 A 27 LEU GLN LYS LEU ALA THR VAL ALA GLU ALA MET ALA ARG SEQRES 3 A 27 ASN SEQRES 1 B 146 PRO SER GLU LEU THR PRO GLU GLU ARG SER GLU LEU LYS SEQRES 2 B 146 ASN SER ILE ALA GLU PHE HIS THR TYR GLN LEU ASP PRO SEQRES 3 B 146 GLY SER CYS SER SER LEU HIS ALA GLN ARG ILE HIS ALA SEQRES 4 B 146 PRO PRO GLU LEU VAL TRP SER ILE VAL ARG ARG PHE ASP SEQRES 5 B 146 LYS PRO GLN THR TYR LYS HIS PHE ILE LYS SER CYS SER SEQRES 6 B 146 VAL GLU GLN ASN PHE GLU MET ARG VAL GLY CYS THR ARG SEQRES 7 B 146 ASP VAL ILE VAL ILE SER GLY LEU PRO ALA ASN THR SER SEQRES 8 B 146 THR GLU ARG LEU ASP ILE LEU ASP ASP GLU ARG ARG VAL SEQRES 9 B 146 THR GLY PHE SER ILE ILE GLY GLY GLU HIS ARG LEU THR SEQRES 10 B 146 ASN TYR LYS SER VAL THR THR VAL HIS ARG PHE GLU LYS SEQRES 11 B 146 GLU ASN ARG ILE TRP THR VAL VAL LEU GLU SER TYR VAL SEQRES 12 B 146 VAL ASP MET SEQRES 1 B 27 ASP THR ARG MET PHE ALA ASP THR VAL VAL LYS LEU ASN SEQRES 2 B 27 LEU GLN LYS LEU ALA THR VAL ALA GLU ALA MET ALA ARG SEQRES 3 B 27 ASN HET UNN A 640 41 ATOM 1 N PRO A 2 102.721 3.919 17.110 1.00 67.34 N ATOM 2 CA PRO A 2 101.716 3.224 16.297 1.00 65.17 C ATOM 3 C PRO A 2 102.285 1.966 15.646 1.00 67.74 C ATOM 4 O PRO A 2 103.180 2.072 14.806 1.00 67.33 O ATOM 5 CB PRO A 2 101.334 4.265 15.238 1.00 59.55 C ATOM 6 CG PRO A 2 101.770 5.581 15.801 1.00 59.17 C ATOM 7 CD PRO A 2 102.992 5.277 16.610 1.00 64.50 C ATOM 8 HN2 PRO A 2 103.605 3.372 17.092 1.00 0.00 H ATOM 9 HN1 PRO A 2 102.375 3.984 18.089 1.00 0.00 H ATOM 10 N SER A 3 101.761 0.797 16.022 1.00 67.21 N ATOM 11 CA SER A 3 102.332 -0.482 15.614 1.00 70.15 C ATOM 12 C SER A 3 101.992 -0.880 14.181 1.00 73.37 C ATOM 13 O SER A 3 102.458 -1.931 13.726 1.00 82.86 O ATOM 14 CB SER A 3 101.873 -1.586 16.570 1.00 72.58 C ATOM 15 OG SER A 3 102.405 -1.382 17.867 1.00 78.05 O ATOM 16 HG SER A 3 102.096 -2.106 18.467 1.00 0.00 H ATOM 17 H SER A 3 100.915 0.798 16.627 1.00 0.00 H ATOM 18 N GLU A 4 101.197 -0.089 13.462 1.00 61.78 N ATOM 19 CA GLU A 4 100.876 -0.399 12.075 1.00 54.63 C ATOM 20 C GLU A 4 101.862 0.221 11.091 1.00 42.12 C ATOM 21 O GLU A 4 102.026 -0.305 9.981 1.00 40.49 O ATOM 22 CB GLU A 4 99.448 0.065 11.755 1.00 54.73 C ATOM 23 CG GLU A 4 99.010 -0.110 10.300 1.00 62.42 C ATOM 24 CD GLU A 4 98.577 -1.525 9.953 1.00 70.97 C ATOM 25 OE1 GLU A 4 98.763 -2.437 10.786 1.00 78.99 O ATOM 26 OE2 GLU A 4 98.040 -1.723 8.841 1.00 70.83 O ATOM 27 H GLU A 4 100.798 0.766 13.899 1.00 0.00 H ATOM 28 N LEU A 5 102.541 1.292 11.486 1.00 35.33 N ATOM 29 CA LEU A 5 103.473 1.988 10.605 1.00 33.08 C ATOM 30 C LEU A 5 104.716 1.143 10.338 1.00 36.18 C ATOM 31 O LEU A 5 105.201 0.427 11.218 1.00 34.95 O ATOM 32 CB LEU A 5 103.891 3.322 11.223 1.00 32.17 C ATOM 33 CG LEU A 5 102.833 4.393 11.508 1.00 33.66 C ATOM 34 CD1 LEU A 5 103.395 5.495 12.408 1.00 36.19 C ATOM 35 CD2 LEU A 5 102.330 4.998 10.217 1.00 36.37 C ATOM 36 H LEU A 5 102.404 1.646 12.454 1.00 0.00 H ATOM 37 N THR A 6 105.236 1.237 9.114 1.00 28.20 N ATOM 38 CA THR A 6 106.513 0.625 8.792 1.00 30.34 C ATOM 39 C THR A 6 107.633 1.413 9.459 1.00 29.58 C ATOM 40 O THR A 6 107.435 2.558 9.866 1.00 26.82 O ATOM 41 CB THR A 6 106.752 0.617 7.287 1.00 29.82 C ATOM 42 OG1 THR A 6 106.874 1.970 6.836 1.00 26.59 O ATOM 43 CG2 THR A 6 105.610 -0.058 6.563 1.00 31.74 C ATOM 44 HG1 THR A 6 107.030 1.978 5.858 1.00 0.00 H ATOM 45 H THR A 6 104.718 1.757 8.377 1.00 0.00 H ATOM 46 N PRO A 7 108.828 0.826 9.569 1.00 32.43 N ATOM 47 CA PRO A 7 109.969 1.609 10.071 1.00 32.12 C ATOM 48 C PRO A 7 110.218 2.887 9.285 1.00 29.00 C ATOM 49 O PRO A 7 110.512 3.928 9.884 1.00 27.43 O ATOM 50 CB PRO A 7 111.138 0.622 9.952 1.00 36.44 C ATOM 51 CG PRO A 7 110.503 -0.722 10.091 1.00 39.53 C ATOM 52 CD PRO A 7 109.169 -0.602 9.399 1.00 36.81 C ATOM 53 N GLU A 8 110.093 2.837 7.958 1.00 31.92 N ATOM 54 CA GLU A 8 110.287 4.027 7.135 1.00 30.77 C ATOM 55 C GLU A 8 109.212 5.072 7.406 1.00 25.86 C ATOM 56 O GLU A 8 109.507 6.268 7.478 1.00 25.05 O ATOM 57 CB GLU A 8 110.297 3.632 5.658 1.00 43.01 C ATOM 58 CG GLU A 8 110.906 4.654 4.714 1.00 59.33 C ATOM 59 CD GLU A 8 111.271 4.045 3.367 1.00 73.05 C ATOM 60 OE1 GLU A 8 111.241 2.801 3.249 1.00 76.79 O ATOM 61 OE2 GLU A 8 111.586 4.807 2.428 1.00 77.53 O ATOM 62 H GLU A 8 109.853 1.934 7.501 1.00 0.00 H ATOM 63 N GLU A 9 107.959 4.644 7.547 1.00 22.48 N ATOM 64 CA GLU A 9 106.903 5.593 7.881 1.00 20.03 C ATOM 65 C GLU A 9 107.146 6.228 9.245 1.00 21.83 C ATOM 66 O GLU A 9 107.006 7.444 9.400 1.00 21.37 O ATOM 67 CB GLU A 9 105.537 4.902 7.837 1.00 20.21 C ATOM 68 CG GLU A 9 105.001 4.693 6.433 1.00 20.90 C ATOM 69 CD GLU A 9 103.867 3.703 6.396 1.00 22.06 C ATOM 70 OE1 GLU A 9 103.674 2.988 7.402 1.00 25.50 O ATOM 71 OE2 GLU A 9 103.181 3.624 5.354 1.00 21.65 O ATOM 72 H GLU A 9 107.734 3.637 7.419 1.00 0.00 H ATOM 73 N ARG A 10 107.538 5.430 10.244 1.00 21.82 N ATOM 74 CA ARG A 10 107.812 6.003 11.561 1.00 20.97 C ATOM 75 C ARG A 10 108.954 7.001 11.492 1.00 20.49 C ATOM 76 O ARG A 10 108.893 8.069 12.114 1.00 24.12 O ATOM 77 CB ARG A 10 108.132 4.900 12.572 1.00 31.49 C ATOM 78 CG ARG A 10 106.984 3.946 12.842 1.00 37.25 C ATOM 79 CD ARG A 10 107.182 3.210 14.155 1.00 45.75 C ATOM 80 NE ARG A 10 108.528 2.656 14.278 1.00 54.33 N ATOM 81 CZ ARG A 10 108.884 1.451 13.843 1.00 62.38 C ATOM 82 NH1 ARG A 10 107.992 0.668 13.251 1.00 64.89 N ATOM 83 NH2 ARG A 10 110.134 1.028 14.000 1.00 63.83 N ATOM 84 HE ARG A 10 109.255 3.242 14.736 1.00 0.00 H ATOM 85 HH12 ARG A 10 108.272 -0.274 12.911 1.00 0.00 H ATOM 86 HH11 ARG A 10 107.013 0.996 13.127 1.00 0.00 H ATOM 87 HH22 ARG A 10 110.411 0.085 13.659 1.00 0.00 H ATOM 88 HH21 ARG A 10 110.836 1.640 14.464 1.00 0.00 H ATOM 89 H ARG A 10 107.647 4.408 10.085 1.00 0.00 H ATOM 90 N SER A 11 109.998 6.680 10.726 1.00 23.48 N ATOM 91 CA SER A 11 111.126 7.599 10.593 1.00 24.65 C ATOM 92 C SER A 11 110.695 8.919 9.965 1.00 24.21 C ATOM 93 O SER A 11 111.086 9.998 10.435 1.00 25.73 O ATOM 94 CB SER A 11 112.231 6.952 9.762 1.00 31.86 C ATOM 95 OG SER A 11 113.304 7.851 9.557 1.00 37.65 O ATOM 96 HG SER A 11 112.974 8.653 9.079 1.00 0.00 H ATOM 97 H SER A 11 110.009 5.771 10.221 1.00 0.00 H ATOM 98 N GLU A 12 109.901 8.859 8.896 1.00 22.14 N ATOM 99 CA GLU A 12 109.490 10.087 8.224 1.00 19.22 C ATOM 100 C GLU A 12 108.469 10.875 9.026 1.00 19.94 C ATOM 101 O GLU A 12 108.265 12.058 8.738 1.00 24.00 O ATOM 102 CB GLU A 12 108.924 9.790 6.835 1.00 22.67 C ATOM 103 CG GLU A 12 109.958 9.252 5.864 1.00 28.12 C ATOM 104 CD GLU A 12 109.396 9.021 4.474 1.00 41.39 C ATOM 105 OE1 GLU A 12 108.520 9.803 4.043 1.00 38.23 O ATOM 106 OE2 GLU A 12 109.832 8.057 3.811 1.00 41.70 O ATOM 107 H GLU A 12 109.575 7.937 8.541 1.00 0.00 H ATOM 108 N LEU A 13 107.804 10.251 9.998 1.00 19.95 N ATOM 109 CA LEU A 13 106.789 10.937 10.789 1.00 15.04 C ATOM 110 C LEU A 13 107.295 11.417 12.139 1.00 19.66 C ATOM 111 O LEU A 13 106.544 12.086 12.857 1.00 19.70 O ATOM 112 CB LEU A 13 105.568 10.034 10.994 1.00 16.67 C ATOM 113 CG LEU A 13 104.799 9.708 9.715 1.00 21.74 C ATOM 114 CD1 LEU A 13 103.798 8.585 9.965 1.00 21.40 C ATOM 115 CD2 LEU A 13 104.099 10.958 9.191 1.00 26.68 C ATOM 116 H LEU A 13 108.014 9.252 10.197 1.00 0.00 H ATOM 117 N LYS A 14 108.539 11.099 12.503 1.00 18.78 N ATOM 118 CA LYS A 14 109.076 11.513 13.795 1.00 18.93 C ATOM 119 C LYS A 14 108.913 13.011 14.010 1.00 20.26 C ATOM 120 O LYS A 14 108.483 13.454 15.082 1.00 20.54 O ATOM 121 CB LYS A 14 110.552 11.124 13.895 1.00 25.26 C ATOM 122 CG LYS A 14 110.802 9.731 14.444 1.00 39.18 C ATOM 123 CD LYS A 14 112.253 9.565 14.885 1.00 44.50 C ATOM 124 CE LYS A 14 112.446 8.267 15.660 1.00 53.80 C ATOM 125 NZ LYS A 14 113.800 8.170 16.282 1.00 53.13 N ATOM 126 HZ1 LYS A 14 114.526 8.211 15.538 1.00 0.00 H ATOM 127 HZ2 LYS A 14 113.934 8.962 16.943 1.00 0.00 H ATOM 128 HZ3 LYS A 14 113.880 7.270 16.797 1.00 0.00 H ATOM 129 H LYS A 14 109.136 10.547 11.855 1.00 0.00 H ATOM 130 N ASN A 15 109.268 13.804 12.995 1.00 17.17 N ATOM 131 CA ASN A 15 109.131 15.257 13.090 1.00 15.37 C ATOM 132 C ASN A 15 107.688 15.653 13.385 1.00 19.48 C ATOM 133 O ASN A 15 107.419 16.405 14.327 1.00 18.78 O ATOM 134 CB ASN A 15 109.618 15.907 11.792 1.00 16.58 C ATOM 135 CG ASN A 15 111.118 16.183 11.785 1.00 20.37 C ATOM 136 OD1 ASN A 15 111.730 16.385 12.835 1.00 24.78 O ATOM 137 ND2 ASN A 15 111.715 16.205 10.591 1.00 20.71 N ATOM 138 HD22 ASN A 15 111.160 16.029 9.729 1.00 0.00 H ATOM 139 HD21 ASN A 15 112.735 16.398 10.523 1.00 0.00 H ATOM 140 H ASN A 15 109.648 13.381 12.124 1.00 0.00 H ATOM 141 N SER A 16 106.737 15.132 12.602 1.00 16.60 N ATOM 142 CA SER A 16 105.341 15.520 12.790 1.00 16.36 C ATOM 143 C SER A 16 104.818 15.113 14.165 1.00 18.89 C ATOM 144 O SER A 16 103.993 15.820 14.761 1.00 19.08 O ATOM 145 CB SER A 16 104.471 14.896 11.698 1.00 14.92 C ATOM 146 OG SER A 16 104.728 15.473 10.438 1.00 18.19 O ATOM 147 HG SER A 16 105.679 15.333 10.200 1.00 0.00 H ATOM 148 H SER A 16 106.991 14.450 11.859 1.00 0.00 H ATOM 149 N ILE A 17 105.251 13.960 14.672 1.00 15.02 N ATOM 150 CA ILE A 17 104.798 13.537 15.990 1.00 18.44 C ATOM 151 C ILE A 17 105.304 14.502 17.052 1.00 23.74 C ATOM 152 O ILE A 17 104.554 14.904 17.951 1.00 23.57 O ATOM 153 CB ILE A 17 105.238 12.085 16.267 1.00 21.09 C ATOM 154 CG1 ILE A 17 104.446 11.142 15.358 1.00 20.47 C ATOM 155 CG2 ILE A 17 105.058 11.744 17.752 1.00 22.09 C ATOM 156 CD1 ILE A 17 104.999 9.749 15.252 1.00 20.60 C ATOM 157 H ILE A 17 105.909 13.365 14.130 1.00 0.00 H ATOM 158 N ALA A 18 106.573 14.910 16.946 1.00 18.20 N ATOM 159 CA ALA A 18 107.136 15.867 17.898 1.00 20.15 C ATOM 160 C ALA A 18 106.465 17.226 17.775 1.00 23.05 C ATOM 161 O ALA A 18 106.262 17.923 18.781 1.00 24.33 O ATOM 162 CB ALA A 18 108.644 15.998 17.680 1.00 20.27 C ATOM 163 H ALA A 18 107.168 14.542 16.176 1.00 0.00 H ATOM 164 N GLU A 19 106.110 17.614 16.549 1.00 19.40 N ATOM 165 CA GLU A 19 105.606 18.955 16.282 1.00 17.51 C ATOM 166 C GLU A 19 104.152 19.117 16.701 1.00 20.76 C ATOM 167 O GLU A 19 103.780 20.155 17.264 1.00 25.94 O ATOM 168 CB GLU A 19 105.765 19.280 14.789 1.00 19.31 C ATOM 169 CG GLU A 19 107.219 19.446 14.370 1.00 17.28 C ATOM 170 CD GLU A 19 107.463 19.214 12.886 1.00 18.98 C ATOM 171 OE1 GLU A 19 106.556 18.724 12.183 1.00 17.95 O ATOM 172 OE2 GLU A 19 108.578 19.522 12.410 1.00 19.92 O ATOM 173 H GLU A 19 106.195 16.940 15.761 1.00 0.00 H ATOM 174 N PHE A 20 103.308 18.105 16.453 1.00 18.07 N ATOM 175 CA PHE A 20 101.877 18.285 16.608 1.00 17.84 C ATOM 176 C PHE A 20 101.210 17.332 17.592 1.00 19.81 C ATOM 177 O PHE A 20 100.035 17.550 17.921 1.00 20.79 O ATOM 178 CB PHE A 20 101.180 18.152 15.245 1.00 19.64 C ATOM 179 CG PHE A 20 101.803 19.001 14.164 1.00 18.94 C ATOM 180 CD1 PHE A 20 101.689 20.384 14.202 1.00 22.64 C ATOM 181 CD2 PHE A 20 102.496 18.408 13.108 1.00 18.64 C ATOM 182 CE1 PHE A 20 102.261 21.167 13.210 1.00 21.84 C ATOM 183 CE2 PHE A 20 103.070 19.177 12.113 1.00 19.87 C ATOM 184 CZ PHE A 20 102.958 20.559 12.161 1.00 18.89 C ATOM 185 H PHE A 20 103.682 17.184 16.147 1.00 0.00 H ATOM 186 N HIS A 21 101.897 16.279 18.045 1.00 22.60 N ATOM 187 CA HIS A 21 101.238 15.203 18.779 1.00 23.42 C ATOM 188 C HIS A 21 101.902 14.902 20.116 1.00 24.17 C ATOM 189 O HIS A 21 101.773 13.785 20.622 1.00 26.11 O ATOM 190 CB HIS A 21 101.181 13.933 17.923 1.00 20.13 C ATOM 191 CG HIS A 21 100.352 14.081 16.690 1.00 19.29 C ATOM 192 ND1 HIS A 21 98.968 14.074 16.712 1.00 18.88 N ATOM 193 CD2 HIS A 21 100.702 14.260 15.394 1.00 17.32 C ATOM 194 CE1 HIS A 21 98.509 14.249 15.490 1.00 17.55 C ATOM 195 NE2 HIS A 21 99.543 14.349 14.665 1.00 17.15 N ATOM 196 H HIS A 21 102.921 16.225 17.871 1.00 0.00 H ATOM 197 N THR A 22 102.604 15.867 20.702 1.00 26.24 N ATOM 198 CA THR A 22 103.251 15.707 21.998 1.00 28.40 C ATOM 199 C THR A 22 102.607 16.667 22.988 1.00 31.00 C ATOM 200 O THR A 22 102.422 17.847 22.675 1.00 39.66 O ATOM 201 CB THR A 22 104.757 15.966 21.881 1.00 32.08 C ATOM 202 OG1 THR A 22 105.306 15.085 20.889 1.00 31.24 O ATOM 203 CG2 THR A 22 105.451 15.720 23.208 1.00 31.65 C ATOM 204 HG1 THR A 22 104.868 15.257 20.018 1.00 0.00 H ATOM 205 H THR A 22 102.696 16.780 20.212 1.00 0.00 H ATOM 206 N TYR A 23 102.270 16.168 24.172 1.00 32.45 N ATOM 207 CA TYR A 23 101.485 16.934 25.131 1.00 35.02 C ATOM 208 C TYR A 23 102.218 17.113 26.451 1.00 47.31 C ATOM 209 O TYR A 23 102.954 16.225 26.885 1.00 42.46 O ATOM 210 CB TYR A 23 100.144 16.247 25.386 1.00 38.54 C ATOM 211 CG TYR A 23 99.317 16.070 24.134 1.00 35.51 C ATOM 212 CD1 TYR A 23 98.458 17.074 23.712 1.00 40.05 C ATOM 213 CD2 TYR A 23 99.401 14.910 23.369 1.00 32.30 C ATOM 214 CE1 TYR A 23 97.700 16.932 22.574 1.00 41.78 C ATOM 215 CE2 TYR A 23 98.641 14.755 22.218 1.00 29.91 C ATOM 216 CZ TYR A 23 97.793 15.775 21.830 1.00 33.04 C ATOM 217 OH TYR A 23 97.024 15.664 20.701 1.00 29.56 O ATOM 218 HH TYR A 23 97.612 15.541 19.914 1.00 0.00 H ATOM 219 H TYR A 23 102.574 15.205 24.421 1.00 0.00 H ATOM 220 N GLN A 24 102.015 18.285 27.064 1.00 46.72 N ATOM 221 CA GLN A 24 102.298 18.533 28.477 1.00 54.68 C ATOM 222 C GLN A 24 101.037 18.155 29.242 1.00 55.16 C ATOM 223 O GLN A 24 100.086 18.938 29.321 1.00 61.34 O ATOM 224 CB GLN A 24 102.680 19.993 28.706 1.00 52.56 C ATOM 225 CG GLN A 24 102.653 20.453 30.159 1.00 59.01 C ATOM 226 CD GLN A 24 103.828 19.942 30.956 1.00 64.04 C ATOM 227 OE1 GLN A 24 104.929 19.790 30.429 1.00 67.29 O ATOM 228 NE2 GLN A 24 103.603 19.674 32.239 1.00 71.54 N ATOM 229 HE22 GLN A 24 102.655 19.818 32.642 1.00 0.00 H ATOM 230 HE21 GLN A 24 104.375 19.321 32.840 1.00 0.00 H ATOM 231 H GLN A 24 101.631 19.070 26.499 1.00 0.00 H ATOM 232 N LEU A 25 101.016 16.942 29.785 1.00 47.37 N ATOM 233 CA LEU A 25 99.796 16.389 30.361 1.00 52.93 C ATOM 234 C LEU A 25 99.353 17.189 31.583 1.00 58.86 C ATOM 235 O LEU A 25 100.121 17.366 32.534 1.00 60.52 O ATOM 236 CB LEU A 25 100.012 14.923 30.727 1.00 57.83 C ATOM 237 CG LEU A 25 100.164 13.966 29.543 1.00 56.07 C ATOM 238 CD1 LEU A 25 100.230 12.522 30.010 1.00 56.31 C ATOM 239 CD2 LEU A 25 99.022 14.157 28.559 1.00 56.07 C ATOM 240 H LEU A 25 101.888 16.375 29.799 1.00 0.00 H ATOM 241 N ASP A 26 98.113 17.676 31.550 1.00 55.30 N ATOM 242 CA ASP A 26 97.510 18.303 32.713 1.00 64.44 C ATOM 243 C ASP A 26 97.218 17.250 33.781 1.00 61.09 C ATOM 244 O ASP A 26 97.144 16.055 33.483 1.00 60.61 O ATOM 245 CB ASP A 26 96.223 19.026 32.320 1.00 69.09 C ATOM 246 CG ASP A 26 96.483 20.327 31.584 1.00 74.95 C ATOM 247 OD1 ASP A 26 97.514 20.975 31.863 1.00 79.00 O ATOM 248 OD2 ASP A 26 95.654 20.703 30.730 1.00 76.79 O ATOM 249 H ASP A 26 97.564 17.605 30.670 1.00 0.00 H ATOM 250 N PRO A 27 97.059 17.672 35.048 1.00 62.87 N ATOM 251 CA PRO A 27 96.772 16.704 36.118 1.00 61.96 C ATOM 252 C PRO A 27 95.585 15.787 35.836 1.00 67.96 C ATOM 253 O PRO A 27 94.471 16.252 35.569 1.00 70.18 O ATOM 254 CB PRO A 27 96.509 17.606 37.330 1.00 65.60 C ATOM 255 CG PRO A 27 97.373 18.796 37.077 1.00 66.73 C ATOM 256 CD PRO A 27 97.342 19.016 35.585 1.00 62.84 C ATOM 257 N GLY A 28 95.835 14.474 35.870 1.00 64.14 N ATOM 258 CA GLY A 28 94.800 13.455 35.801 1.00 56.22 C ATOM 259 C GLY A 28 94.265 13.167 34.412 1.00 52.49 C ATOM 260 O GLY A 28 93.070 13.331 34.160 1.00 52.65 O ATOM 261 H GLY A 28 96.825 14.164 35.950 1.00 0.00 H ATOM 262 N SER A 29 95.121 12.695 33.512 1.00 49.38 N ATOM 263 CA SER A 29 94.763 12.672 32.103 1.00 47.91 C ATOM 264 C SER A 29 95.123 11.327 31.488 1.00 50.12 C ATOM 265 O SER A 29 95.489 10.364 32.169 1.00 58.41 O ATOM 266 CB SER A 29 95.442 13.826 31.358 1.00 45.18 C ATOM 267 OG SER A 29 94.849 15.050 31.727 1.00 50.88 O ATOM 268 HG SER A 29 94.952 15.185 32.702 1.00 0.00 H ATOM 269 H SER A 29 96.050 12.341 33.816 1.00 0.00 H ATOM 270 N CYS A 30 95.031 11.295 30.166 1.00 44.54 N ATOM 271 CA CYS A 30 95.038 10.083 29.369 1.00 39.32 C ATOM 272 C CYS A 30 95.218 10.531 27.928 1.00 35.78 C ATOM 273 O CYS A 30 94.459 11.377 27.449 1.00 37.62 O ATOM 274 CB CYS A 30 93.733 9.310 29.573 1.00 52.22 C ATOM 275 SG CYS A 30 93.399 7.956 28.439 1.00 69.16 S ATOM 276 H CYS A 30 94.948 12.203 29.665 1.00 0.00 H ATOM 277 N SER A 31 96.235 10.019 27.243 1.00 33.16 N ATOM 278 CA SER A 31 96.497 10.440 25.875 1.00 30.71 C ATOM 279 C SER A 31 96.987 9.261 25.053 1.00 33.82 C ATOM 280 O SER A 31 97.627 8.342 25.571 1.00 35.74 O ATOM 281 CB SER A 31 97.527 11.571 25.817 1.00 32.23 C ATOM 282 OG SER A 31 97.879 11.872 24.481 1.00 35.78 O ATOM 283 HG SER A 31 97.071 12.154 23.983 1.00 0.00 H ATOM 284 H SER A 31 96.851 9.310 27.690 1.00 0.00 H ATOM 285 N SER A 32 96.689 9.305 23.755 1.00 26.46 N ATOM 286 CA SER A 32 97.092 8.237 22.857 1.00 24.62 C ATOM 287 C SER A 32 97.226 8.789 21.449 1.00 22.59 C ATOM 288 O SER A 32 96.566 9.770 21.086 1.00 22.56 O ATOM 289 CB SER A 32 96.092 7.073 22.879 1.00 33.91 C ATOM 290 OG SER A 32 96.052 6.482 24.169 1.00 38.64 O ATOM 291 HG SER A 32 95.773 7.161 24.833 1.00 0.00 H ATOM 292 H SER A 32 96.159 10.117 23.379 1.00 0.00 H ATOM 293 N LEU A 33 98.079 8.138 20.658 1.00 21.16 N ATOM 294 CA LEU A 33 98.303 8.464 19.256 1.00 20.12 C ATOM 295 C LEU A 33 97.932 7.250 18.417 1.00 19.85 C ATOM 296 O LEU A 33 98.308 6.124 18.764 1.00 21.38 O ATOM 297 CB LEU A 33 99.772 8.843 19.013 1.00 20.35 C ATOM 298 CG LEU A 33 100.219 9.026 17.561 1.00 19.28 C ATOM 299 CD1 LEU A 33 99.574 10.259 16.972 1.00 18.01 C ATOM 300 CD2 LEU A 33 101.732 9.143 17.491 1.00 24.75 C ATOM 301 H LEU A 33 98.618 7.348 21.067 1.00 0.00 H ATOM 302 N HIS A 34 97.171 7.472 17.342 1.00 19.58 N ATOM 303 CA HIS A 34 96.761 6.423 16.415 1.00 19.11 C ATOM 304 C HIS A 34 97.143 6.803 14.994 1.00 19.53 C ATOM 305 O HIS A 34 97.152 7.980 14.637 1.00 19.11 O ATOM 306 CB HIS A 34 95.252 6.182 16.492 1.00 19.37 C ATOM 307 CG HIS A 34 94.804 5.692 17.828 1.00 23.73 C ATOM 308 ND1 HIS A 34 94.750 4.352 18.143 1.00 33.83 N ATOM 309 CD2 HIS A 34 94.443 6.358 18.949 1.00 28.77 C ATOM 310 CE1 HIS A 34 94.350 4.213 19.394 1.00 33.44 C ATOM 311 NE2 HIS A 34 94.154 5.415 19.905 1.00 34.41 N ATOM 312 H HIS A 34 96.854 8.445 17.156 1.00 0.00 H ATOM 313 N ALA A 35 97.456 5.792 14.181 1.00 17.96 N ATOM 314 CA ALA A 35 97.845 6.012 12.795 1.00 15.19 C ATOM 315 C ALA A 35 96.960 5.192 11.878 1.00 15.74 C ATOM 316 O ALA A 35 96.481 4.118 12.260 1.00 19.42 O ATOM 317 CB ALA A 35 99.311 5.627 12.547 1.00 17.48 C ATOM 318 H ALA A 35 97.421 4.819 14.548 1.00 0.00 H ATOM 319 N GLN A 36 96.757 5.701 10.665 1.00 15.27 N ATOM 320 CA GLN A 36 95.989 4.983 9.649 1.00 17.29 C ATOM 321 C GLN A 36 96.626 5.211 8.288 1.00 14.20 C ATOM 322 O GLN A 36 96.732 6.352 7.833 1.00 17.11 O ATOM 323 CB GLN A 36 94.529 5.443 9.640 1.00 16.52 C ATOM 324 CG GLN A 36 93.666 4.818 8.528 1.00 16.40 C ATOM 325 CD GLN A 36 93.349 3.354 8.797 1.00 22.89 C ATOM 326 OE1 GLN A 36 92.886 2.999 9.879 1.00 23.82 O ATOM 327 NE2 GLN A 36 93.584 2.501 7.806 1.00 22.40 N ATOM 328 HE22 GLN A 36 93.977 2.845 6.906 1.00 0.00 H ATOM 329 HE21 GLN A 36 93.375 1.490 7.930 1.00 0.00 H ATOM 330 H GLN A 36 97.155 6.634 10.434 1.00 0.00 H ATOM 331 N ARG A 37 97.032 4.121 7.636 1.00 15.60 N ATOM 332 CA ARG A 37 97.484 4.199 6.253 1.00 14.84 C ATOM 333 C ARG A 37 96.278 4.235 5.331 1.00 14.84 C ATOM 334 O ARG A 37 95.317 3.484 5.522 1.00 15.29 O ATOM 335 CB ARG A 37 98.374 3.004 5.891 1.00 15.44 C ATOM 336 CG ARG A 37 99.072 3.168 4.532 1.00 15.26 C ATOM 337 CD ARG A 37 100.077 2.046 4.261 1.00 17.10 C ATOM 338 NE ARG A 37 101.046 1.880 5.346 1.00 17.24 N ATOM 339 CZ ARG A 37 101.044 0.867 6.205 1.00 18.94 C ATOM 340 NH1 ARG A 37 100.154 -0.121 6.092 1.00 28.19 N ATOM 341 NH2 ARG A 37 101.952 0.817 7.174 1.00 22.65 N ATOM 342 HE ARG A 37 101.785 2.604 5.451 1.00 0.00 H ATOM 343 HH12 ARG A 37 100.163 -0.909 6.771 1.00 0.00 H ATOM 344 HH11 ARG A 37 99.452 -0.103 5.325 1.00 0.00 H ATOM 345 HH22 ARG A 37 101.951 0.024 7.847 1.00 0.00 H ATOM 346 HH21 ARG A 37 102.663 1.571 7.259 1.00 0.00 H ATOM 347 H ARG A 37 97.026 3.201 8.122 1.00 0.00 H ATOM 348 N ILE A 38 96.323 5.125 4.337 1.00 13.53 N ATOM 349 CA ILE A 38 95.219 5.301 3.401 1.00 12.63 C ATOM 350 C ILE A 38 95.780 5.300 1.991 1.00 14.73 C ATOM 351 O ILE A 38 96.700 6.068 1.679 1.00 16.06 O ATOM 352 CB ILE A 38 94.428 6.596 3.666 1.00 13.32 C ATOM 353 CG1 ILE A 38 93.946 6.617 5.118 1.00 14.97 C ATOM 354 CG2 ILE A 38 93.256 6.722 2.697 1.00 15.11 C ATOM 355 CD1 ILE A 38 93.070 7.809 5.447 1.00 15.93 C ATOM 356 H ILE A 38 97.174 5.712 4.227 1.00 0.00 H ATOM 357 N HIS A 39 95.223 4.450 1.135 1.00 14.15 N ATOM 358 CA HIS A 39 95.737 4.294 -0.219 1.00 15.50 C ATOM 359 C HIS A 39 94.970 5.231 -1.147 1.00 17.90 C ATOM 360 O HIS A 39 94.178 4.834 -2.000 1.00 17.95 O ATOM 361 CB HIS A 39 95.661 2.833 -0.634 1.00 15.99 C ATOM 362 CG HIS A 39 96.402 1.948 0.317 1.00 17.96 C ATOM 363 ND1 HIS A 39 97.777 1.901 0.351 1.00 21.68 N ATOM 364 CD2 HIS A 39 95.968 1.151 1.321 1.00 19.26 C ATOM 365 CE1 HIS A 39 98.162 1.079 1.313 1.00 20.11 C ATOM 366 NE2 HIS A 39 97.085 0.618 1.920 1.00 21.86 N ATOM 367 H HIS A 39 94.404 3.885 1.438 1.00 0.00 H ATOM 368 N ALA A 40 95.233 6.517 -0.935 1.00 17.22 N ATOM 369 CA ALA A 40 94.612 7.599 -1.684 1.00 14.80 C ATOM 370 C ALA A 40 95.519 8.811 -1.576 1.00 15.58 C ATOM 371 O ALA A 40 96.386 8.862 -0.693 1.00 16.80 O ATOM 372 CB ALA A 40 93.213 7.920 -1.129 1.00 17.66 C ATOM 373 H ALA A 40 95.920 6.763 -0.194 1.00 0.00 H ATOM 374 N PRO A 41 95.351 9.811 -2.437 1.00 14.92 N ATOM 375 CA PRO A 41 96.233 10.977 -2.384 1.00 16.64 C ATOM 376 C PRO A 41 95.980 11.802 -1.130 1.00 16.00 C ATOM 377 O PRO A 41 94.833 11.948 -0.688 1.00 14.86 O ATOM 378 CB PRO A 41 95.859 11.767 -3.649 1.00 19.98 C ATOM 379 CG PRO A 41 95.171 10.796 -4.528 1.00 21.90 C ATOM 380 CD PRO A 41 94.467 9.849 -3.617 1.00 17.59 C ATOM 381 N PRO A 42 97.028 12.358 -0.528 1.00 15.01 N ATOM 382 CA PRO A 42 96.814 13.140 0.697 1.00 14.83 C ATOM 383 C PRO A 42 95.934 14.361 0.505 1.00 16.04 C ATOM 384 O PRO A 42 95.237 14.755 1.453 1.00 16.46 O ATOM 385 CB PRO A 42 98.241 13.520 1.134 1.00 20.25 C ATOM 386 CG PRO A 42 99.078 13.354 -0.070 1.00 19.43 C ATOM 387 CD PRO A 42 98.454 12.243 -0.879 1.00 18.70 C ATOM 388 N GLU A 43 95.929 14.970 -0.686 1.00 16.17 N ATOM 389 CA GLU A 43 95.052 16.123 -0.873 1.00 20.50 C ATOM 390 C GLU A 43 93.593 15.708 -0.780 1.00 17.88 C ATOM 391 O GLU A 43 92.764 16.462 -0.259 1.00 17.34 O ATOM 392 CB GLU A 43 95.335 16.809 -2.211 1.00 22.92 C ATOM 393 CG GLU A 43 95.196 15.924 -3.434 1.00 37.98 C ATOM 394 CD GLU A 43 96.508 15.274 -3.853 1.00 48.95 C ATOM 395 OE1 GLU A 43 97.359 15.001 -2.975 1.00 36.81 O ATOM 396 OE2 GLU A 43 96.684 15.040 -5.070 1.00 52.78 O ATOM 397 H GLU A 43 96.535 14.631 -1.460 1.00 0.00 H ATOM 398 N LEU A 44 93.274 14.493 -1.240 1.00 14.85 N ATOM 399 CA LEU A 44 91.906 13.997 -1.142 1.00 16.41 C ATOM 400 C LEU A 44 91.544 13.708 0.309 1.00 16.16 C ATOM 401 O LEU A 44 90.482 14.119 0.795 1.00 16.52 O ATOM 402 CB LEU A 44 91.753 12.737 -2.003 1.00 17.47 C ATOM 403 CG LEU A 44 90.395 12.032 -2.007 1.00 18.57 C ATOM 404 CD1 LEU A 44 89.270 12.992 -2.333 1.00 23.47 C ATOM 405 CD2 LEU A 44 90.432 10.905 -3.026 1.00 23.47 C ATOM 406 H LEU A 44 94.008 13.896 -1.672 1.00 0.00 H ATOM 407 N VAL A 45 92.438 13.021 1.021 1.00 13.79 N ATOM 408 CA VAL A 45 92.207 12.713 2.430 1.00 13.10 C ATOM 409 C VAL A 45 91.984 13.992 3.221 1.00 13.32 C ATOM 410 O VAL A 45 91.037 14.096 4.010 1.00 15.79 O ATOM 411 CB VAL A 45 93.382 11.902 2.998 1.00 12.97 C ATOM 412 CG1 VAL A 45 93.167 11.689 4.498 1.00 16.36 C ATOM 413 CG2 VAL A 45 93.491 10.557 2.281 1.00 15.89 C ATOM 414 H VAL A 45 93.315 12.699 0.565 1.00 0.00 H ATOM 415 N TRP A 46 92.815 15.008 2.972 1.00 13.83 N ATOM 416 CA TRP A 46 92.671 16.269 3.688 1.00 14.23 C ATOM 417 C TRP A 46 91.338 16.942 3.369 1.00 15.23 C ATOM 418 O TRP A 46 90.681 17.489 4.266 1.00 16.04 O ATOM 419 CB TRP A 46 93.846 17.189 3.340 1.00 14.94 C ATOM 420 CG TRP A 46 93.748 18.524 4.010 1.00 15.54 C ATOM 421 CD1 TRP A 46 93.550 19.734 3.405 1.00 16.38 C ATOM 422 CD2 TRP A 46 93.783 18.784 5.425 1.00 17.26 C ATOM 423 NE1 TRP A 46 93.479 20.730 4.352 1.00 17.58 N ATOM 424 CE2 TRP A 46 93.625 20.176 5.596 1.00 17.05 C ATOM 425 CE3 TRP A 46 93.950 17.977 6.557 1.00 15.28 C ATOM 426 CZ2 TRP A 46 93.616 20.780 6.850 1.00 18.12 C ATOM 427 CZ3 TRP A 46 93.937 18.578 7.809 1.00 15.36 C ATOM 428 CH2 TRP A 46 93.776 19.968 7.943 1.00 16.73 C ATOM 429 HE1 TRP A 46 93.337 21.741 4.155 1.00 0.00 H ATOM 430 H TRP A 46 93.568 14.898 2.264 1.00 0.00 H ATOM 431 N SER A 47 90.913 16.907 2.101 1.00 14.75 N ATOM 432 CA SER A 47 89.659 17.569 1.739 1.00 15.41 C ATOM 433 C SER A 47 88.476 16.981 2.504 1.00 16.31 C ATOM 434 O SER A 47 87.479 17.677 2.741 1.00 17.08 O ATOM 435 CB SER A 47 89.428 17.466 0.230 1.00 18.40 C ATOM 436 OG SER A 47 89.098 16.139 -0.142 1.00 22.90 O ATOM 437 HG SER A 47 89.840 15.533 0.109 1.00 0.00 H ATOM 438 H SER A 47 91.471 16.412 1.376 1.00 0.00 H ATOM 439 N ILE A 48 88.570 15.713 2.898 1.00 15.17 N ATOM 440 CA ILE A 48 87.493 15.077 3.653 1.00 13.72 C ATOM 441 C ILE A 48 87.565 15.460 5.122 1.00 16.23 C ATOM 442 O ILE A 48 86.590 15.943 5.713 1.00 18.51 O ATOM 443 CB ILE A 48 87.552 13.547 3.492 1.00 15.84 C ATOM 444 CG1 ILE A 48 87.385 13.125 2.029 1.00 17.36 C ATOM 445 CG2 ILE A 48 86.490 12.904 4.358 1.00 16.40 C ATOM 446 CD1 ILE A 48 87.947 11.720 1.782 1.00 18.90 C ATOM 447 H ILE A 48 89.424 15.166 2.665 1.00 0.00 H ATOM 448 N VAL A 49 88.729 15.255 5.740 1.00 13.75 N ATOM 449 CA VAL A 49 88.814 15.350 7.190 1.00 16.53 C ATOM 450 C VAL A 49 88.805 16.801 7.667 1.00 16.07 C ATOM 451 O VAL A 49 88.503 17.060 8.839 1.00 19.61 O ATOM 452 CB VAL A 49 90.054 14.564 7.654 1.00 21.91 C ATOM 453 CG1 VAL A 49 91.341 15.366 7.432 1.00 18.11 C ATOM 454 CG2 VAL A 49 89.896 14.109 9.095 1.00 25.68 C ATOM 455 H VAL A 49 89.578 15.027 5.184 1.00 0.00 H ATOM 456 N ARG A 50 89.111 17.764 6.793 1.00 14.54 N ATOM 457 CA ARG A 50 89.100 19.157 7.227 1.00 14.96 C ATOM 458 C ARG A 50 87.691 19.710 7.402 1.00 19.14 C ATOM 459 O ARG A 50 87.544 20.816 7.919 1.00 20.87 O ATOM 460 CB ARG A 50 89.856 20.044 6.225 1.00 16.94 C ATOM 461 CG ARG A 50 89.140 20.184 4.866 1.00 18.84 C ATOM 462 CD ARG A 50 89.926 21.032 3.849 1.00 19.20 C ATOM 463 NE ARG A 50 90.051 22.437 4.236 1.00 17.79 N ATOM 464 CZ ARG A 50 89.096 23.343 4.047 1.00 22.95 C ATOM 465 NH1 ARG A 50 87.943 22.974 3.491 1.00 20.44 N ATOM 466 NH2 ARG A 50 89.284 24.609 4.417 1.00 20.85 N ATOM 467 HE ARG A 50 90.937 22.745 4.685 1.00 0.00 H ATOM 468 HH12 ARG A 50 87.191 23.676 3.339 1.00 0.00 H ATOM 469 HH11 ARG A 50 87.795 21.984 3.208 1.00 0.00 H ATOM 470 HH22 ARG A 50 88.533 25.312 4.266 1.00 0.00 H ATOM 471 HH21 ARG A 50 90.182 24.894 4.857 1.00 0.00 H ATOM 472 H ARG A 50 89.355 17.523 5.811 1.00 0.00 H ATOM 473 N ARG A 51 86.658 18.981 6.981 1.00 18.01 N ATOM 474 CA ARG A 51 85.296 19.514 7.017 1.00 20.81 C ATOM 475 C ARG A 51 84.739 19.352 8.425 1.00 17.03 C ATOM 476 O ARG A 51 84.054 18.378 8.750 1.00 17.19 O ATOM 477 CB ARG A 51 84.423 18.823 5.978 1.00 19.22 C ATOM 478 CG ARG A 51 84.670 19.332 4.564 1.00 20.02 C ATOM 479 CD ARG A 51 84.370 20.832 4.410 1.00 27.78 C ATOM 480 NE ARG A 51 82.974 21.186 4.683 1.00 28.11 N ATOM 481 CZ ARG A 51 82.004 21.194 3.771 1.00 33.60 C ATOM 482 NH1 ARG A 51 82.265 20.869 2.510 1.00 34.80 N ATOM 483 NH2 ARG A 51 80.767 21.538 4.115 1.00 31.84 N ATOM 484 HE ARG A 51 82.724 21.449 5.657 1.00 0.00 H ATOM 485 HH12 ARG A 51 81.503 20.877 1.802 1.00 0.00 H ATOM 486 HH11 ARG A 51 83.232 20.606 2.230 1.00 0.00 H ATOM 487 HH22 ARG A 51 80.011 21.543 3.401 1.00 0.00 H ATOM 488 HH21 ARG A 51 80.555 21.802 5.098 1.00 0.00 H ATOM 489 H ARG A 51 86.822 18.019 6.622 1.00 0.00 H ATOM 490 N PHE A 52 85.048 20.343 9.265 1.00 15.94 N ATOM 491 CA PHE A 52 84.615 20.353 10.658 1.00 16.16 C ATOM 492 C PHE A 52 83.100 20.276 10.774 1.00 16.70 C ATOM 493 O PHE A 52 82.579 19.719 11.751 1.00 17.52 O ATOM 494 CB PHE A 52 85.152 21.622 11.335 1.00 16.49 C ATOM 495 CG PHE A 52 84.728 21.792 12.770 1.00 17.54 C ATOM 496 CD1 PHE A 52 85.364 21.084 13.785 1.00 19.56 C ATOM 497 CD2 PHE A 52 83.724 22.678 13.108 1.00 18.44 C ATOM 498 CE1 PHE A 52 84.982 21.248 15.104 1.00 18.25 C ATOM 499 CE2 PHE A 52 83.347 22.851 14.432 1.00 19.68 C ATOM 500 CZ PHE A 52 83.980 22.133 15.423 1.00 19.51 C ATOM 501 H PHE A 52 85.619 21.138 8.913 1.00 0.00 H ATOM 502 N ASP A 53 82.371 20.815 9.787 1.00 16.89 N ATOM 503 CA ASP A 53 80.922 20.827 9.893 1.00 17.15 C ATOM 504 C ASP A 53 80.278 19.498 9.519 1.00 18.16 C ATOM 505 O ASP A 53 79.076 19.331 9.751 1.00 19.54 O ATOM 506 CB ASP A 53 80.332 21.949 9.023 1.00 18.26 C ATOM 507 CG ASP A 53 80.880 21.961 7.598 1.00 22.26 C ATOM 508 OD1 ASP A 53 82.023 21.511 7.360 1.00 24.05 O ATOM 509 OD2 ASP A 53 80.160 22.464 6.707 1.00 27.40 O ATOM 510 H ASP A 53 82.839 21.221 8.952 1.00 0.00 H ATOM 511 N LYS A 54 81.038 18.539 8.982 1.00 17.41 N ATOM 512 CA LYS A 54 80.458 17.292 8.475 1.00 17.14 C ATOM 513 C LYS A 54 81.179 16.051 9.007 1.00 16.65 C ATOM 514 O LYS A 54 81.562 15.170 8.239 1.00 19.10 O ATOM 515 CB LYS A 54 80.479 17.297 6.949 1.00 19.66 C ATOM 516 CG LYS A 54 79.652 18.414 6.323 1.00 26.13 C ATOM 517 CD LYS A 54 79.893 18.513 4.819 1.00 43.84 C ATOM 518 CE LYS A 54 79.440 17.270 4.069 1.00 52.27 C ATOM 519 NZ LYS A 54 79.710 17.374 2.605 1.00 48.96 N ATOM 520 HZ1 LYS A 54 79.200 18.193 2.217 1.00 0.00 H ATOM 521 HZ2 LYS A 54 80.731 17.495 2.450 1.00 0.00 H ATOM 522 HZ3 LYS A 54 79.386 16.506 2.132 1.00 0.00 H ATOM 523 H LYS A 54 82.067 18.681 8.922 1.00 0.00 H ATOM 524 N PRO A 55 81.341 15.925 10.329 1.00 14.72 N ATOM 525 CA PRO A 55 82.072 14.761 10.846 1.00 14.16 C ATOM 526 C PRO A 55 81.377 13.455 10.558 1.00 16.11 C ATOM 527 O PRO A 55 82.045 12.423 10.488 1.00 16.28 O ATOM 528 CB PRO A 55 82.152 15.037 12.352 1.00 16.58 C ATOM 529 CG PRO A 55 80.941 15.870 12.633 1.00 18.14 C ATOM 530 CD PRO A 55 80.822 16.765 11.423 1.00 18.11 C ATOM 531 N GLN A 56 80.064 13.475 10.361 1.00 15.96 N ATOM 532 CA GLN A 56 79.352 12.240 10.101 1.00 17.57 C ATOM 533 C GLN A 56 79.758 11.614 8.777 1.00 18.46 C ATOM 534 O GLN A 56 79.474 10.429 8.563 1.00 19.41 O ATOM 535 CB GLN A 56 77.843 12.495 10.147 1.00 20.19 C ATOM 536 CG GLN A 56 77.272 13.326 8.990 1.00 21.53 C ATOM 537 CD GLN A 56 77.423 14.829 9.180 1.00 26.62 C ATOM 538 OE1 GLN A 56 78.150 15.296 10.054 1.00 20.80 O ATOM 539 NE2 GLN A 56 76.725 15.595 8.351 1.00 30.50 N ATOM 540 HE22 GLN A 56 76.121 15.160 7.625 1.00 0.00 H ATOM 541 HE21 GLN A 56 76.782 16.631 8.428 1.00 0.00 H ATOM 542 H GLN A 56 79.547 14.377 10.393 1.00 0.00 H ATOM 543 N THR A 57 80.429 12.363 7.896 1.00 17.23 N ATOM 544 CA THR A 57 80.842 11.791 6.620 1.00 16.25 C ATOM 545 C THR A 57 82.136 11.004 6.719 1.00 14.04 C ATOM 546 O THR A 57 82.492 10.310 5.758 1.00 16.42 O ATOM 547 CB THR A 57 80.978 12.884 5.556 1.00 16.44 C ATOM 548 OG1 THR A 57 82.000 13.824 5.926 1.00 17.41 O ATOM 549 CG2 THR A 57 79.643 13.616 5.379 1.00 17.03 C ATOM 550 HG1 THR A 57 81.763 14.244 6.790 1.00 0.00 H ATOM 551 H THR A 57 80.656 13.353 8.121 1.00 0.00 H ATOM 552 N TYR A 58 82.848 11.078 7.854 1.00 14.70 N ATOM 553 CA TYR A 58 84.060 10.286 7.997 1.00 17.60 C ATOM 554 C TYR A 58 84.176 9.692 9.391 1.00 20.50 C ATOM 555 O TYR A 58 85.244 9.188 9.741 1.00 17.77 O ATOM 556 CB TYR A 58 85.322 11.107 7.654 1.00 15.12 C ATOM 557 CG TYR A 58 85.409 12.472 8.322 1.00 14.99 C ATOM 558 CD1 TYR A 58 84.759 13.572 7.775 1.00 17.26 C ATOM 559 CD2 TYR A 58 86.138 12.653 9.490 1.00 21.31 C ATOM 560 CE1 TYR A 58 84.827 14.821 8.381 1.00 24.67 C ATOM 561 CE2 TYR A 58 86.215 13.901 10.105 1.00 24.02 C ATOM 562 CZ TYR A 58 85.553 14.978 9.545 1.00 32.26 C ATOM 563 OH TYR A 58 85.617 16.223 10.148 1.00 35.02 O ATOM 564 HH TYR A 58 85.090 16.873 9.618 1.00 0.00 H ATOM 565 H TYR A 58 82.535 11.698 8.628 1.00 0.00 H ATOM 566 N LYS A 59 83.106 9.708 10.185 1.00 15.01 N ATOM 567 CA LYS A 59 83.130 9.132 11.518 1.00 14.75 C ATOM 568 C LYS A 59 81.880 8.299 11.724 1.00 16.03 C ATOM 569 O LYS A 59 80.844 8.533 11.095 1.00 16.05 O ATOM 570 CB LYS A 59 83.183 10.197 12.630 1.00 15.89 C ATOM 571 CG LYS A 59 84.392 11.115 12.583 1.00 15.23 C ATOM 572 CD LYS A 59 84.488 11.937 13.854 1.00 16.36 C ATOM 573 CE LYS A 59 85.607 12.962 13.733 1.00 21.59 C ATOM 574 NZ LYS A 59 86.920 12.277 13.517 1.00 27.08 N ATOM 575 HZ1 LYS A 59 87.119 11.650 14.323 1.00 0.00 H ATOM 576 HZ2 LYS A 59 86.877 11.716 12.642 1.00 0.00 H ATOM 577 HZ3 LYS A 59 87.673 12.990 13.437 1.00 0.00 H ATOM 578 H LYS A 59 82.228 10.146 9.840 1.00 0.00 H ATOM 579 N HIS A 60 81.998 7.334 12.624 1.00 16.39 N ATOM 580 CA HIS A 60 80.883 6.522 13.073 1.00 16.74 C ATOM 581 C HIS A 60 80.123 7.234 14.190 1.00 17.44 C ATOM 582 O HIS A 60 80.564 8.250 14.737 1.00 18.25 O ATOM 583 CB HIS A 60 81.379 5.186 13.620 1.00 15.59 C ATOM 584 CG HIS A 60 81.972 4.267 12.602 1.00 16.73 C ATOM 585 ND1 HIS A 60 81.207 3.412 11.837 1.00 20.64 N ATOM 586 CD2 HIS A 60 83.262 4.002 12.288 1.00 21.50 C ATOM 587 CE1 HIS A 60 82.000 2.690 11.063 1.00 22.44 C ATOM 588 NE2 HIS A 60 83.252 3.016 11.331 1.00 19.89 N ATOM 589 H HIS A 60 82.938 7.149 13.029 1.00 0.00 H ATOM 590 N PHE A 61 78.972 6.655 14.547 1.00 17.14 N ATOM 591 CA PHE A 61 78.222 6.915 15.778 1.00 20.66 C ATOM 592 C PHE A 61 77.519 8.264 15.834 1.00 19.28 C ATOM 593 O PHE A 61 77.022 8.635 16.907 1.00 19.64 O ATOM 594 CB PHE A 61 79.111 6.788 17.024 1.00 20.78 C ATOM 595 CG PHE A 61 79.976 5.562 17.024 1.00 20.18 C ATOM 596 CD1 PHE A 61 79.413 4.303 16.927 1.00 20.08 C ATOM 597 CD2 PHE A 61 81.359 5.670 17.100 1.00 22.62 C ATOM 598 CE1 PHE A 61 80.208 3.167 16.933 1.00 21.69 C ATOM 599 CE2 PHE A 61 82.156 4.540 17.103 1.00 22.04 C ATOM 600 CZ PHE A 61 81.572 3.281 17.018 1.00 22.90 C ATOM 601 H PHE A 61 78.572 5.955 13.890 1.00 0.00 H ATOM 602 N ILE A 62 77.421 9.000 14.731 1.00 17.71 N ATOM 603 CA ILE A 62 76.842 10.341 14.760 1.00 17.86 C ATOM 604 C ILE A 62 75.449 10.281 14.144 1.00 20.42 C ATOM 605 O ILE A 62 75.295 9.988 12.954 1.00 23.25 O ATOM 606 CB ILE A 62 77.732 11.362 14.040 1.00 15.94 C ATOM 607 CG1 ILE A 62 79.058 11.519 14.793 1.00 15.50 C ATOM 608 CG2 ILE A 62 77.010 12.691 13.921 1.00 19.93 C ATOM 609 CD1 ILE A 62 80.076 12.356 14.060 1.00 18.79 C ATOM 610 H ILE A 62 77.764 8.613 13.829 1.00 0.00 H ATOM 611 N LYS A 63 74.432 10.574 14.957 1.00 19.16 N ATOM 612 CA LYS A 63 73.070 10.646 14.439 1.00 22.44 C ATOM 613 C LYS A 63 72.871 11.910 13.611 1.00 24.09 C ATOM 614 O LYS A 63 72.264 11.871 12.532 1.00 26.29 O ATOM 615 CB LYS A 63 72.077 10.594 15.601 1.00 23.94 C ATOM 616 CG LYS A 63 70.616 10.550 15.171 1.00 28.46 C ATOM 617 CD LYS A 63 69.708 10.694 16.375 1.00 32.50 C ATOM 618 CE LYS A 63 68.242 10.627 15.984 1.00 46.99 C ATOM 619 NZ LYS A 63 67.879 9.281 15.476 1.00 57.61 N ATOM 620 HZ1 LYS A 63 68.455 9.061 14.639 1.00 0.00 H ATOM 621 HZ2 LYS A 63 68.057 8.573 16.217 1.00 0.00 H ATOM 622 HZ3 LYS A 63 66.872 9.269 15.218 1.00 0.00 H ATOM 623 H LYS A 63 74.611 10.752 15.966 1.00 0.00 H ATOM 624 N SER A 64 73.383 13.038 14.095 1.00 23.60 N ATOM 625 CA SER A 64 73.270 14.286 13.356 1.00 25.74 C ATOM 626 C SER A 64 74.327 15.253 13.865 1.00 24.13 C ATOM 627 O SER A 64 74.799 15.144 15.003 1.00 22.54 O ATOM 628 CB SER A 64 71.869 14.901 13.484 1.00 29.65 C ATOM 629 OG SER A 64 71.623 15.341 14.810 1.00 28.83 O ATOM 630 HG SER A 64 70.715 15.732 14.864 1.00 0.00 H ATOM 631 H SER A 64 73.870 13.028 15.014 1.00 0.00 H ATOM 632 N CYS A 65 74.699 16.197 13.004 1.00 20.04 N ATOM 633 CA CYS A 65 75.621 17.257 13.382 1.00 20.61 C ATOM 634 C CYS A 65 75.095 18.561 12.816 1.00 22.30 C ATOM 635 O CYS A 65 74.897 18.671 11.600 1.00 26.91 O ATOM 636 CB CYS A 65 77.033 16.989 12.866 1.00 19.01 C ATOM 637 SG CYS A 65 78.193 18.275 13.376 1.00 20.28 S ATOM 638 H CYS A 65 74.321 16.176 12.035 1.00 0.00 H ATOM 639 N SER A 66 74.846 19.527 13.694 1.00 22.29 N ATOM 640 CA SER A 66 74.305 20.819 13.312 1.00 23.11 C ATOM 641 C SER A 66 75.338 21.913 13.536 1.00 22.66 C ATOM 642 O SER A 66 76.138 21.855 14.473 1.00 22.95 O ATOM 643 CB SER A 66 73.043 21.148 14.115 1.00 25.73 C ATOM 644 OG SER A 66 72.112 20.084 14.029 1.00 37.64 O ATOM 645 HG SER A 66 72.521 19.259 14.393 1.00 0.00 H ATOM 646 H SER A 66 75.048 19.350 14.699 1.00 0.00 H ATOM 647 N VAL A 67 75.301 22.917 12.659 1.00 24.87 N ATOM 648 CA VAL A 67 76.066 24.141 12.828 1.00 24.81 C ATOM 649 C VAL A 67 75.116 25.311 12.616 1.00 28.61 C ATOM 650 O VAL A 67 74.027 25.167 12.050 1.00 30.52 O ATOM 651 CB VAL A 67 77.273 24.228 11.867 1.00 23.35 C ATOM 652 CG1 VAL A 67 78.286 23.128 12.181 1.00 19.87 C ATOM 653 CG2 VAL A 67 76.815 24.164 10.413 1.00 26.00 C ATOM 654 H VAL A 67 74.698 22.820 11.817 1.00 0.00 H ATOM 655 N GLU A 68 75.537 26.483 13.080 1.00 29.95 N ATOM 656 CA GLU A 68 74.659 27.642 13.025 1.00 33.94 C ATOM 657 C GLU A 68 74.420 28.090 11.585 1.00 39.71 C ATOM 658 O GLU A 68 75.178 27.766 10.666 1.00 35.21 O ATOM 659 CB GLU A 68 75.240 28.802 13.831 1.00 38.17 C ATOM 660 CG GLU A 68 76.525 29.361 13.258 1.00 39.74 C ATOM 661 CD GLU A 68 76.968 30.625 13.969 1.00 49.54 C ATOM 662 OE1 GLU A 68 76.351 30.977 14.996 1.00 49.26 O ATOM 663 OE2 GLU A 68 77.930 31.267 13.499 1.00 49.13 O ATOM 664 H GLU A 68 76.492 26.572 13.482 1.00 0.00 H ATOM 665 N GLN A 69 73.340 28.846 11.400 1.00 39.65 N ATOM 666 CA GLN A 69 73.068 29.459 10.106 1.00 42.33 C ATOM 667 C GLN A 69 74.205 30.396 9.725 1.00 44.43 C ATOM 668 O GLN A 69 74.790 31.065 10.581 1.00 51.66 O ATOM 669 CB GLN A 69 71.749 30.231 10.143 1.00 49.67 C ATOM 670 CG GLN A 69 70.517 29.372 10.367 1.00 57.01 C ATOM 671 CD GLN A 69 69.236 30.187 10.337 1.00 70.95 C ATOM 672 OE1 GLN A 69 69.253 31.399 10.561 1.00 79.52 O ATOM 673 NE2 GLN A 69 68.118 29.527 10.051 1.00 71.78 N ATOM 674 HE22 GLN A 69 68.150 28.504 9.869 1.00 0.00 H ATOM 675 HE21 GLN A 69 67.211 30.034 10.009 1.00 0.00 H ATOM 676 H GLN A 69 72.681 29.001 12.190 1.00 0.00 H ATOM 677 N ASN A 70 74.507 30.450 8.426 1.00 46.88 N ATOM 678 CA ASN A 70 75.630 31.235 7.909 1.00 50.33 C ATOM 679 C ASN A 70 76.932 30.814 8.583 1.00 46.85 C ATOM 680 O ASN A 70 77.754 31.644 8.978 1.00 47.87 O ATOM 681 CB ASN A 70 75.389 32.739 8.065 1.00 52.28 C ATOM 682 CG ASN A 70 74.201 33.221 7.262 1.00 59.27 C ATOM 683 OD1 ASN A 70 73.924 32.710 6.177 1.00 61.68 O ATOM 684 ND2 ASN A 70 73.488 34.204 7.793 1.00 66.72 N ATOM 685 HD22 ASN A 70 73.760 34.605 8.713 1.00 0.00 H ATOM 686 HD21 ASN A 70 72.657 34.574 7.290 1.00 0.00 H ATOM 687 H ASN A 70 73.922 29.913 7.754 1.00 0.00 H ATOM 688 N PHE A 71 77.095 29.505 8.737 1.00 40.38 N ATOM 689 CA PHE A 71 78.305 28.941 9.313 1.00 37.40 C ATOM 690 C PHE A 71 79.525 29.334 8.491 1.00 36.55 C ATOM 691 O PHE A 71 79.480 29.373 7.259 1.00 39.48 O ATOM 692 CB PHE A 71 78.160 27.420 9.381 1.00 36.70 C ATOM 693 CG PHE A 71 79.401 26.690 9.811 1.00 31.41 C ATOM 694 CD1 PHE A 71 79.715 26.554 11.153 1.00 24.42 C ATOM 695 CD2 PHE A 71 80.232 26.101 8.868 1.00 26.83 C ATOM 696 CE1 PHE A 71 80.841 25.857 11.550 1.00 24.06 C ATOM 697 CE2 PHE A 71 81.361 25.415 9.256 1.00 23.19 C ATOM 698 CZ PHE A 71 81.667 25.284 10.592 1.00 24.36 C ATOM 699 H PHE A 71 76.334 28.864 8.436 1.00 0.00 H ATOM 700 N GLU A 72 80.611 29.657 9.189 1.00 35.12 N ATOM 701 CA GLU A 72 81.899 29.948 8.571 1.00 33.06 C ATOM 702 C GLU A 72 82.949 29.125 9.296 1.00 31.91 C ATOM 703 O GLU A 72 83.090 29.234 10.519 1.00 29.37 O ATOM 704 CB GLU A 72 82.236 31.441 8.644 1.00 35.91 C ATOM 705 CG GLU A 72 81.331 32.330 7.820 1.00 50.73 C ATOM 706 CD GLU A 72 81.707 33.795 7.933 1.00 62.46 C ATOM 707 OE1 GLU A 72 82.755 34.098 8.547 1.00 65.17 O ATOM 708 OE2 GLU A 72 80.956 34.644 7.411 1.00 69.11 O ATOM 709 H GLU A 72 80.537 29.704 10.225 1.00 0.00 H ATOM 710 N MET A 73 83.668 28.286 8.559 1.00 27.16 N ATOM 711 CA MET A 73 84.629 27.393 9.203 1.00 22.28 C ATOM 712 C MET A 73 85.908 28.161 9.505 1.00 28.21 C ATOM 713 O MET A 73 86.734 28.398 8.621 1.00 35.91 O ATOM 714 CB MET A 73 84.916 26.173 8.337 1.00 30.49 C ATOM 715 CG MET A 73 85.664 25.115 9.109 1.00 25.55 C ATOM 716 SD MET A 73 85.788 23.583 8.195 1.00 30.39 S ATOM 717 CE MET A 73 86.930 24.009 6.880 1.00 23.38 C ATOM 718 H MET A 73 83.547 28.265 7.526 1.00 0.00 H ATOM 719 N ARG A 74 86.062 28.548 10.769 1.00 23.97 N ATOM 720 CA ARG A 74 87.230 29.263 11.256 1.00 22.31 C ATOM 721 C ARG A 74 87.404 28.879 12.717 1.00 22.60 C ATOM 722 O ARG A 74 86.467 28.409 13.363 1.00 22.65 O ATOM 723 CB ARG A 74 87.070 30.777 11.101 1.00 27.96 C ATOM 724 CG ARG A 74 85.887 31.345 11.869 1.00 35.38 C ATOM 725 CD ARG A 74 85.699 32.830 11.577 1.00 47.65 C ATOM 726 NE ARG A 74 86.937 33.583 11.755 1.00 57.57 N ATOM 727 CZ ARG A 74 87.103 34.849 11.385 1.00 68.96 C ATOM 728 NH1 ARG A 74 86.107 35.513 10.812 1.00 72.35 N ATOM 729 NH2 ARG A 74 88.268 35.453 11.586 1.00 70.69 N ATOM 730 HE ARG A 74 87.742 33.097 12.200 1.00 0.00 H ATOM 731 HH12 ARG A 74 86.240 36.503 10.524 1.00 0.00 H ATOM 732 HH11 ARG A 74 85.193 35.043 10.651 1.00 0.00 H ATOM 733 HH22 ARG A 74 88.397 36.443 11.296 1.00 0.00 H ATOM 734 HH21 ARG A 74 89.052 34.936 12.033 1.00 0.00 H ATOM 735 H ARG A 74 85.304 28.326 11.446 1.00 0.00 H ATOM 736 N VAL A 75 88.611 29.094 13.241 1.00 22.12 N ATOM 737 CA VAL A 75 88.874 28.737 14.632 1.00 20.15 C ATOM 738 C VAL A 75 87.857 29.430 15.531 1.00 20.87 C ATOM 739 O VAL A 75 87.577 30.628 15.383 1.00 24.40 O ATOM 740 CB VAL A 75 90.315 29.110 15.013 1.00 22.03 C ATOM 741 CG1 VAL A 75 90.511 29.043 16.525 1.00 24.39 C ATOM 742 CG2 VAL A 75 91.292 28.174 14.306 1.00 25.07 C ATOM 743 H VAL A 75 89.364 29.515 12.660 1.00 0.00 H ATOM 744 N GLY A 76 87.280 28.661 16.458 1.00 19.31 N ATOM 745 CA GLY A 76 86.266 29.146 17.351 1.00 19.75 C ATOM 746 C GLY A 76 84.850 28.785 16.951 1.00 20.50 C ATOM 747 O GLY A 76 83.930 28.945 17.771 1.00 22.49 O ATOM 748 H GLY A 76 87.578 27.668 16.536 1.00 0.00 H ATOM 749 N CYS A 77 84.642 28.358 15.710 1.00 20.08 N ATOM 750 CA CYS A 77 83.310 27.927 15.324 1.00 20.78 C ATOM 751 C CYS A 77 82.988 26.628 16.045 1.00 19.66 C ATOM 752 O CYS A 77 83.880 25.929 16.529 1.00 19.57 O ATOM 753 CB CYS A 77 83.203 27.762 13.804 1.00 21.10 C ATOM 754 SG CYS A 77 84.060 26.327 13.103 1.00 21.89 S ATOM 755 H CYS A 77 85.423 28.333 15.024 1.00 0.00 H ATOM 756 N THR A 78 81.702 26.314 16.146 1.00 18.74 N ATOM 757 CA THR A 78 81.298 25.149 16.914 1.00 17.82 C ATOM 758 C THR A 78 80.345 24.271 16.119 1.00 19.60 C ATOM 759 O THR A 78 79.748 24.691 15.125 1.00 20.45 O ATOM 760 CB THR A 78 80.637 25.545 18.242 1.00 18.29 C ATOM 761 OG1 THR A 78 79.462 26.330 17.991 1.00 23.77 O ATOM 762 CG2 THR A 78 81.595 26.364 19.068 1.00 20.38 C ATOM 763 HG1 THR A 78 78.821 25.800 17.453 1.00 0.00 H ATOM 764 H THR A 78 80.984 26.902 15.676 1.00 0.00 H ATOM 765 N ARG A 79 80.201 23.037 16.594 1.00 18.00 N ATOM 766 CA ARG A 79 79.248 22.096 16.029 1.00 15.94 C ATOM 767 C ARG A 79 78.537 21.383 17.167 1.00 21.24 C ATOM 768 O ARG A 79 79.123 21.151 18.224 1.00 17.41 O ATOM 769 CB ARG A 79 79.939 21.088 15.093 1.00 18.29 C ATOM 770 CG ARG A 79 80.877 20.112 15.782 1.00 16.20 C ATOM 771 CD ARG A 79 81.753 19.371 14.786 1.00 15.94 C ATOM 772 NE ARG A 79 82.641 18.429 15.464 1.00 16.39 N ATOM 773 CZ ARG A 79 83.673 17.829 14.883 1.00 16.58 C ATOM 774 NH1 ARG A 79 83.953 18.056 13.602 1.00 16.45 N ATOM 775 NH2 ARG A 79 84.428 16.995 15.584 1.00 19.95 N ATOM 776 HE ARG A 79 82.453 18.215 16.464 1.00 0.00 H ATOM 777 HH12 ARG A 79 84.763 17.582 13.155 1.00 0.00 H ATOM 778 HH11 ARG A 79 83.361 18.708 13.048 1.00 0.00 H ATOM 779 HH22 ARG A 79 85.238 16.523 15.133 1.00 0.00 H ATOM 780 HH21 ARG A 79 84.211 16.813 16.585 1.00 0.00 H ATOM 781 H ARG A 79 80.790 22.735 17.396 1.00 0.00 H ATOM 782 N ASP A 80 77.259 21.053 16.949 1.00 20.84 N ATOM 783 CA ASP A 80 76.442 20.334 17.928 1.00 20.91 C ATOM 784 C ASP A 80 76.190 18.927 17.403 1.00 21.22 C ATOM 785 O ASP A 80 75.431 18.747 16.442 1.00 22.41 O ATOM 786 CB ASP A 80 75.113 21.046 18.172 1.00 20.32 C ATOM 787 CG ASP A 80 75.278 22.411 18.787 1.00 32.91 C ATOM 788 OD1 ASP A 80 76.245 22.619 19.545 1.00 30.93 O ATOM 789 OD2 ASP A 80 74.412 23.275 18.525 1.00 36.97 O ATOM 790 H ASP A 80 76.826 21.320 16.042 1.00 0.00 H ATOM 791 N VAL A 81 76.789 17.928 18.058 1.00 19.05 N ATOM 792 CA VAL A 81 76.683 16.527 17.654 1.00 17.43 C ATOM 793 C VAL A 81 75.651 15.832 18.519 1.00 19.74 C ATOM 794 O VAL A 81 75.627 16.007 19.746 1.00 21.77 O ATOM 795 CB VAL A 81 78.052 15.828 17.773 1.00 19.45 C ATOM 796 CG1 VAL A 81 77.945 14.334 17.477 1.00 21.45 C ATOM 797 CG2 VAL A 81 79.080 16.487 16.858 1.00 21.76 C ATOM 798 H VAL A 81 77.359 18.159 18.897 1.00 0.00 H ATOM 799 N ILE A 82 74.798 15.034 17.888 1.00 20.04 N ATOM 800 CA ILE A 82 73.915 14.116 18.594 1.00 22.03 C ATOM 801 C ILE A 82 74.388 12.706 18.275 1.00 25.69 C ATOM 802 O ILE A 82 74.501 12.333 17.102 1.00 23.17 O ATOM 803 CB ILE A 82 72.448 14.320 18.198 1.00 24.76 C ATOM 804 CG1 ILE A 82 71.992 15.726 18.605 1.00 26.35 C ATOM 805 CG2 ILE A 82 71.584 13.234 18.834 1.00 22.16 C ATOM 806 CD1 ILE A 82 70.598 16.085 18.133 1.00 25.92 C ATOM 807 H ILE A 82 74.759 15.066 16.849 1.00 0.00 H ATOM 808 N VAL A 83 74.686 11.941 19.313 1.00 22.11 N ATOM 809 CA VAL A 83 75.222 10.592 19.168 1.00 21.88 C ATOM 810 C VAL A 83 74.077 9.608 18.974 1.00 22.95 C ATOM 811 O VAL A 83 72.970 9.799 19.493 1.00 26.14 O ATOM 812 CB VAL A 83 76.073 10.244 20.408 1.00 26.11 C ATOM 813 CG1 VAL A 83 76.682 8.863 20.292 1.00 28.61 C ATOM 814 CG2 VAL A 83 77.168 11.290 20.584 1.00 25.63 C ATOM 815 H VAL A 83 74.532 12.317 20.270 1.00 0.00 H ATOM 816 N ILE A 84 74.339 8.549 18.200 1.00 21.13 N ATOM 817 CA ILE A 84 73.342 7.491 18.057 1.00 24.57 C ATOM 818 C ILE A 84 73.096 6.839 19.420 1.00 29.42 C ATOM 819 O ILE A 84 73.920 6.916 20.339 1.00 30.58 O ATOM 820 CB ILE A 84 73.769 6.439 17.020 1.00 26.69 C ATOM 821 CG1 ILE A 84 75.076 5.769 17.446 1.00 30.22 C ATOM 822 CG2 ILE A 84 73.884 7.070 15.636 1.00 26.53 C ATOM 823 CD1 ILE A 84 75.425 4.525 16.642 1.00 33.42 C ATOM 824 H ILE A 84 75.249 8.479 17.702 1.00 0.00 H ATOM 825 N SER A 85 71.943 6.191 19.548 1.00 29.65 N ATOM 826 CA SER A 85 71.581 5.611 20.829 1.00 33.12 C ATOM 827 C SER A 85 72.465 4.408 21.151 1.00 31.05 C ATOM 828 O SER A 85 73.082 3.797 20.273 1.00 34.03 O ATOM 829 CB SER A 85 70.107 5.201 20.832 1.00 37.59 C ATOM 830 OG SER A 85 69.820 4.350 19.737 1.00 46.62 O ATOM 831 HG SER A 85 70.018 4.824 18.891 1.00 0.00 H ATOM 832 H SER A 85 71.302 6.100 18.734 1.00 0.00 H ATOM 833 N GLY A 86 72.524 4.075 22.439 1.00 35.03 N ATOM 834 CA GLY A 86 73.210 2.877 22.882 1.00 36.67 C ATOM 835 C GLY A 86 74.675 3.040 23.214 1.00 36.81 C ATOM 836 O GLY A 86 75.378 2.030 23.332 1.00 39.93 O ATOM 837 H GLY A 86 72.067 4.689 23.144 1.00 0.00 H ATOM 838 N LEU A 87 75.156 4.273 23.386 1.00 30.47 N ATOM 839 CA LEU A 87 76.560 4.559 23.673 1.00 31.29 C ATOM 840 C LEU A 87 76.680 5.337 24.981 1.00 31.83 C ATOM 841 O LEU A 87 75.665 5.812 25.508 1.00 33.12 O ATOM 842 CB LEU A 87 77.189 5.335 22.515 1.00 30.46 C ATOM 843 CG LEU A 87 77.191 4.577 21.186 1.00 33.86 C ATOM 844 CD1 LEU A 87 77.778 5.433 20.099 1.00 30.84 C ATOM 845 CD2 LEU A 87 77.966 3.286 21.307 1.00 36.22 C ATOM 846 H LEU A 87 74.496 5.073 23.312 1.00 0.00 H ATOM 847 N PRO A 88 77.893 5.477 25.556 1.00 39.76 N ATOM 848 CA PRO A 88 78.016 6.219 26.819 1.00 41.83 C ATOM 849 C PRO A 88 78.052 7.721 26.612 1.00 36.64 C ATOM 850 O PRO A 88 78.760 8.435 27.327 1.00 46.46 O ATOM 851 CB PRO A 88 79.338 5.705 27.402 1.00 46.54 C ATOM 852 CG PRO A 88 80.129 5.298 26.220 1.00 44.82 C ATOM 853 CD PRO A 88 79.131 4.739 25.240 1.00 43.61 C ATOM 854 N ALA A 89 77.296 8.208 25.632 1.00 33.42 N ATOM 855 CA ALA A 89 77.275 9.626 25.309 1.00 31.11 C ATOM 856 C ALA A 89 75.994 9.935 24.553 1.00 34.08 C ATOM 857 O ALA A 89 75.515 9.108 23.774 1.00 34.95 O ATOM 858 CB ALA A 89 78.490 10.029 24.470 1.00 28.65 C ATOM 859 H ALA A 89 76.703 7.556 25.081 1.00 0.00 H ATOM 860 N ASN A 90 75.445 11.127 24.783 1.00 30.88 N ATOM 861 CA ASN A 90 74.220 11.530 24.108 1.00 25.04 C ATOM 862 C ASN A 90 74.428 12.719 23.189 1.00 24.72 C ATOM 863 O ASN A 90 73.947 12.705 22.049 1.00 27.22 O ATOM 864 CB ASN A 90 73.121 11.854 25.131 1.00 25.96 C ATOM 865 CG ASN A 90 72.685 10.637 25.926 1.00 36.12 C ATOM 866 OD1 ASN A 90 72.728 9.502 25.437 1.00 38.38 O ATOM 867 ND2 ASN A 90 72.256 10.868 27.158 1.00 40.63 N ATOM 868 HD22 ASN A 90 72.237 11.840 27.528 1.00 0.00 H ATOM 869 HD21 ASN A 90 71.938 10.078 27.755 1.00 0.00 H ATOM 870 H ASN A 90 75.898 11.779 25.455 1.00 0.00 H ATOM 871 N THR A 91 75.130 13.753 23.655 1.00 23.15 N ATOM 872 CA THR A 91 75.338 14.972 22.889 1.00 25.90 C ATOM 873 C THR A 91 76.749 15.477 23.131 1.00 25.75 C ATOM 874 O THR A 91 77.372 15.183 24.154 1.00 26.65 O ATOM 875 CB THR A 91 74.353 16.084 23.278 1.00 26.03 C ATOM 876 OG1 THR A 91 74.493 16.376 24.675 1.00 27.74 O ATOM 877 CG2 THR A 91 72.916 15.679 22.982 1.00 29.48 C ATOM 878 HG1 THR A 91 75.419 16.675 24.857 1.00 0.00 H ATOM 879 H THR A 91 75.546 13.685 24.606 1.00 0.00 H ATOM 880 N SER A 92 77.239 16.273 22.188 1.00 21.36 N ATOM 881 CA SER A 92 78.550 16.877 22.350 1.00 20.16 C ATOM 882 C SER A 92 78.592 18.195 21.593 1.00 20.99 C ATOM 883 O SER A 92 78.178 18.262 20.431 1.00 24.25 O ATOM 884 CB SER A 92 79.644 15.938 21.850 1.00 20.59 C ATOM 885 OG SER A 92 80.917 16.473 22.152 1.00 22.35 O ATOM 886 HG SER A 92 81.619 15.857 21.824 1.00 0.00 H ATOM 887 H SER A 92 76.682 16.465 21.331 1.00 0.00 H ATOM 888 N THR A 93 79.065 19.236 22.262 1.00 19.34 N ATOM 889 CA THR A 93 79.348 20.515 21.627 1.00 22.08 C ATOM 890 C THR A 93 80.852 20.648 21.474 1.00 17.78 C ATOM 891 O THR A 93 81.591 20.477 22.447 1.00 19.05 O ATOM 892 CB THR A 93 78.805 21.671 22.458 1.00 22.17 C ATOM 893 OG1 THR A 93 77.427 21.429 22.768 1.00 28.00 O ATOM 894 CG2 THR A 93 78.944 22.978 21.682 1.00 22.77 C ATOM 895 HG1 THR A 93 77.349 20.586 23.282 1.00 0.00 H ATOM 896 H THR A 93 79.241 19.135 23.282 1.00 0.00 H ATOM 897 N GLU A 94 81.304 20.930 20.254 1.00 17.12 N ATOM 898 CA GLU A 94 82.723 20.874 19.941 1.00 16.81 C ATOM 899 C GLU A 94 83.149 22.151 19.233 1.00 17.67 C ATOM 900 O GLU A 94 82.378 22.758 18.486 1.00 18.73 O ATOM 901 CB GLU A 94 83.045 19.630 19.097 1.00 15.71 C ATOM 902 CG GLU A 94 82.713 18.384 19.918 1.00 15.74 C ATOM 903 CD GLU A 94 82.617 17.111 19.128 1.00 19.56 C ATOM 904 OE1 GLU A 94 82.906 17.109 17.910 1.00 20.17 O ATOM 905 OE2 GLU A 94 82.241 16.108 19.767 1.00 19.63 O ATOM 906 H GLU A 94 80.628 21.196 19.509 1.00 0.00 H ATOM 907 N ARG A 95 84.383 22.561 19.498 1.00 16.18 N ATOM 908 CA ARG A 95 84.930 23.809 18.987 1.00 14.68 C ATOM 909 C ARG A 95 86.122 23.510 18.096 1.00 15.60 C ATOM 910 O ARG A 95 86.953 22.669 18.433 1.00 16.59 O ATOM 911 CB ARG A 95 85.360 24.713 20.140 1.00 16.43 C ATOM 912 CG ARG A 95 86.090 25.971 19.718 1.00 18.50 C ATOM 913 CD ARG A 95 86.674 26.637 20.947 1.00 17.38 C ATOM 914 NE ARG A 95 87.184 27.967 20.629 1.00 19.18 N ATOM 915 CZ ARG A 95 88.441 28.227 20.293 1.00 19.30 C ATOM 916 NH1 ARG A 95 89.336 27.252 20.229 1.00 20.47 N ATOM 917 NH2 ARG A 95 88.804 29.478 20.023 1.00 21.79 N ATOM 918 HE ARG A 95 86.517 28.764 20.668 1.00 0.00 H ATOM 919 HH12 ARG A 95 90.319 27.465 19.965 1.00 0.00 H ATOM 920 HH11 ARG A 95 89.055 26.274 20.443 1.00 0.00 H ATOM 921 HH22 ARG A 95 89.788 29.689 19.759 1.00 0.00 H ATOM 922 HH21 ARG A 95 88.104 30.245 20.076 1.00 0.00 H ATOM 923 H ARG A 95 84.987 21.963 20.098 1.00 0.00 H ATOM 924 N LEU A 96 86.209 24.207 16.959 1.00 15.66 N ATOM 925 CA LEU A 96 87.365 24.072 16.079 1.00 16.09 C ATOM 926 C LEU A 96 88.527 24.852 16.680 1.00 18.15 C ATOM 927 O LEU A 96 88.434 26.073 16.842 1.00 17.26 O ATOM 928 CB LEU A 96 87.039 24.579 14.675 1.00 16.55 C ATOM 929 CG LEU A 96 88.177 24.538 13.655 1.00 16.58 C ATOM 930 CD1 LEU A 96 88.657 23.111 13.486 1.00 16.97 C ATOM 931 CD2 LEU A 96 87.709 25.111 12.314 1.00 16.30 C ATOM 932 H LEU A 96 85.440 24.856 16.697 1.00 0.00 H ATOM 933 N ASP A 97 89.610 24.150 17.019 1.00 15.06 N ATOM 934 CA ASP A 97 90.740 24.761 17.723 1.00 18.31 C ATOM 935 C ASP A 97 91.834 25.244 16.788 1.00 19.58 C ATOM 936 O ASP A 97 92.482 26.267 17.065 1.00 17.91 O ATOM 937 CB ASP A 97 91.384 23.770 18.701 1.00 18.84 C ATOM 938 CG ASP A 97 90.499 23.406 19.870 1.00 25.03 C ATOM 939 OD1 ASP A 97 89.619 24.193 20.260 1.00 22.08 O ATOM 940 OD2 ASP A 97 90.719 22.307 20.413 1.00 22.59 O ATOM 941 H ASP A 97 89.653 23.140 16.776 1.00 0.00 H ATOM 942 N ILE A 98 92.108 24.478 15.735 1.00 18.85 N ATOM 943 CA ILE A 98 93.189 24.777 14.806 1.00 18.05 C ATOM 944 C ILE A 98 92.756 24.319 13.425 1.00 18.38 C ATOM 945 O ILE A 98 92.147 23.257 13.269 1.00 17.92 O ATOM 946 CB ILE A 98 94.514 24.112 15.249 1.00 29.43 C ATOM 947 CG1 ILE A 98 95.582 24.225 14.158 1.00 34.93 C ATOM 948 CG2 ILE A 98 94.297 22.672 15.603 1.00 32.37 C ATOM 949 CD1 ILE A 98 96.979 23.843 14.627 1.00 42.38 C ATOM 950 H ILE A 98 91.527 23.632 15.569 1.00 0.00 H ATOM 951 N LEU A 99 93.016 25.160 12.427 1.00 16.43 N ATOM 952 CA LEU A 99 92.816 24.780 11.033 1.00 17.20 C ATOM 953 C LEU A 99 94.014 25.325 10.282 1.00 19.30 C ATOM 954 O LEU A 99 94.158 26.552 10.157 1.00 21.07 O ATOM 955 CB LEU A 99 91.513 25.342 10.475 1.00 20.07 C ATOM 956 CG LEU A 99 91.281 25.070 8.986 1.00 24.24 C ATOM 957 CD1 LEU A 99 91.157 23.566 8.726 1.00 23.84 C ATOM 958 CD2 LEU A 99 90.065 25.835 8.472 1.00 25.09 C ATOM 959 H LEU A 99 93.371 26.113 12.647 1.00 0.00 H ATOM 960 N ASP A 100 94.884 24.422 9.829 1.00 15.87 N ATOM 961 CA ASP A 100 96.076 24.784 9.073 1.00 15.86 C ATOM 962 C ASP A 100 96.008 23.998 7.771 1.00 15.59 C ATOM 963 O ASP A 100 96.457 22.851 7.684 1.00 16.70 O ATOM 964 CB ASP A 100 97.358 24.495 9.877 1.00 17.00 C ATOM 965 CG ASP A 100 98.593 25.082 9.233 1.00 16.66 C ATOM 966 OD1 ASP A 100 98.572 25.309 8.013 1.00 17.43 O ATOM 967 OD2 ASP A 100 99.583 25.319 9.957 1.00 18.30 O ATOM 968 H ASP A 100 94.704 23.416 10.024 1.00 0.00 H ATOM 969 N ASP A 101 95.437 24.634 6.751 1.00 16.21 N ATOM 970 CA ASP A 101 95.333 23.991 5.453 1.00 17.86 C ATOM 971 C ASP A 101 96.695 23.806 4.804 1.00 17.48 C ATOM 972 O ASP A 101 96.892 22.840 4.059 1.00 25.84 O ATOM 973 CB ASP A 101 94.404 24.795 4.547 1.00 19.51 C ATOM 974 CG ASP A 101 92.936 24.548 4.868 1.00 21.86 C ATOM 975 OD1 ASP A 101 92.609 23.405 5.225 1.00 18.31 O ATOM 976 OD2 ASP A 101 92.110 25.480 4.770 1.00 24.66 O ATOM 977 H ASP A 101 95.064 25.596 6.884 1.00 0.00 H ATOM 978 N GLU A 102 97.649 24.701 5.074 1.00 17.72 N ATOM 979 CA GLU A 102 98.948 24.602 4.412 1.00 20.37 C ATOM 980 C GLU A 102 99.755 23.424 4.943 1.00 21.10 C ATOM 981 O GLU A 102 100.468 22.758 4.179 1.00 24.35 O ATOM 982 CB GLU A 102 99.739 25.902 4.591 1.00 23.33 C ATOM 983 CG GLU A 102 99.140 27.105 3.863 1.00 28.65 C ATOM 984 CD GLU A 102 100.046 28.337 3.870 1.00 44.34 C ATOM 985 OE1 GLU A 102 100.875 28.493 4.793 1.00 40.42 O ATOM 986 OE2 GLU A 102 99.926 29.159 2.937 1.00 50.50 O ATOM 987 H GLU A 102 97.468 25.467 5.754 1.00 0.00 H ATOM 988 N ARG A 103 99.665 23.163 6.247 1.00 16.93 N ATOM 989 CA ARG A 103 100.419 22.099 6.894 1.00 15.13 C ATOM 990 C ARG A 103 99.590 20.846 7.119 1.00 18.41 C ATOM 991 O ARG A 103 100.140 19.834 7.572 1.00 17.08 O ATOM 992 CB ARG A 103 100.973 22.588 8.228 1.00 15.01 C ATOM 993 CG ARG A 103 101.844 23.837 8.070 1.00 15.82 C ATOM 994 CD ARG A 103 102.756 23.998 9.282 1.00 16.20 C ATOM 995 NE ARG A 103 103.485 25.267 9.304 1.00 17.00 N ATOM 996 CZ ARG A 103 104.704 25.446 8.815 1.00 18.25 C ATOM 997 NH1 ARG A 103 105.359 24.449 8.217 1.00 18.93 N ATOM 998 NH2 ARG A 103 105.283 26.639 8.926 1.00 19.03 N ATOM 999 HE ARG A 103 103.013 26.087 9.734 1.00 0.00 H ATOM 1000 HH12 ARG A 103 106.315 24.608 7.839 1.00 0.00 H ATOM 1001 HH11 ARG A 103 104.914 23.513 8.129 1.00 0.00 H ATOM 1002 HH22 ARG A 103 106.239 26.790 8.546 1.00 0.00 H ATOM 1003 HH21 ARG A 103 104.779 27.420 9.393 1.00 0.00 H ATOM 1004 H ARG A 103 99.028 23.745 6.828 1.00 0.00 H ATOM 1005 N ARG A 104 98.295 20.904 6.812 1.00 17.46 N ATOM 1006 CA ARG A 104 97.350 19.796 6.984 1.00 14.95 C ATOM 1007 C ARG A 104 97.294 19.339 8.444 1.00 15.82 C ATOM 1008 O ARG A 104 97.509 18.166 8.782 1.00 16.28 O ATOM 1009 CB ARG A 104 97.678 18.636 6.040 1.00 14.78 C ATOM 1010 CG ARG A 104 97.585 19.041 4.572 1.00 16.33 C ATOM 1011 CD ARG A 104 97.612 17.813 3.661 1.00 20.95 C ATOM 1012 NE ARG A 104 97.479 18.171 2.251 1.00 25.66 N ATOM 1013 CZ ARG A 104 98.416 17.928 1.343 1.00 25.35 C ATOM 1014 NH1 ARG A 104 99.543 17.333 1.709 1.00 28.83 N ATOM 1015 NH2 ARG A 104 98.234 18.285 0.079 1.00 30.43 N ATOM 1016 HE ARG A 104 96.604 18.641 1.942 1.00 0.00 H ATOM 1017 HH12 ARG A 104 100.282 17.139 1.003 1.00 0.00 H ATOM 1018 HH11 ARG A 104 99.688 17.060 2.702 1.00 0.00 H ATOM 1019 HH22 ARG A 104 98.972 18.092 -0.627 1.00 0.00 H ATOM 1020 HH21 ARG A 104 97.353 18.758 -0.206 1.00 0.00 H ATOM 1021 H ARG A 104 97.929 21.797 6.424 1.00 0.00 H ATOM 1022 N VAL A 105 96.941 20.294 9.303 1.00 13.95 N ATOM 1023 CA VAL A 105 96.742 20.082 10.733 1.00 13.62 C ATOM 1024 C VAL A 105 95.370 20.631 11.093 1.00 15.75 C ATOM 1025 O VAL A 105 95.050 21.771 10.744 1.00 16.06 O ATOM 1026 CB VAL A 105 97.811 20.805 11.581 1.00 15.78 C ATOM 1027 CG1 VAL A 105 97.623 20.455 13.060 1.00 16.83 C ATOM 1028 CG2 VAL A 105 99.212 20.458 11.121 1.00 17.87 C ATOM 1029 H VAL A 105 96.798 21.254 8.930 1.00 0.00 H ATOM 1030 N THR A 106 94.569 19.847 11.808 1.00 16.17 N ATOM 1031 CA THR A 106 93.338 20.390 12.368 1.00 15.31 C ATOM 1032 C THR A 106 93.071 19.745 13.721 1.00 17.65 C ATOM 1033 O THR A 106 93.601 18.682 14.042 1.00 17.05 O ATOM 1034 CB THR A 106 92.154 20.210 11.409 1.00 17.96 C ATOM 1035 OG1 THR A 106 91.029 20.966 11.891 1.00 20.26 O ATOM 1036 CG2 THR A 106 91.783 18.738 11.267 1.00 19.72 C ATOM 1037 HG1 THR A 106 90.265 20.850 11.272 1.00 0.00 H ATOM 1038 H THR A 106 94.820 18.850 11.967 1.00 0.00 H ATOM 1039 N GLY A 107 92.278 20.418 14.544 1.00 15.39 N ATOM 1040 CA GLY A 107 92.053 19.910 15.886 1.00 16.28 C ATOM 1041 C GLY A 107 90.821 20.528 16.480 1.00 16.30 C ATOM 1042 O GLY A 107 90.411 21.622 16.092 1.00 16.08 O ATOM 1043 H GLY A 107 91.823 21.299 14.232 1.00 0.00 H ATOM 1044 N PHE A 108 90.223 19.831 17.453 1.00 15.13 N ATOM 1045 CA PHE A 108 89.000 20.327 18.066 1.00 17.13 C ATOM 1046 C PHE A 108 88.988 19.982 19.544 1.00 19.08 C ATOM 1047 O PHE A 108 89.749 19.135 20.016 1.00 18.37 O ATOM 1048 CB PHE A 108 87.726 19.775 17.386 1.00 16.10 C ATOM 1049 CG PHE A 108 87.485 18.301 17.615 1.00 17.94 C ATOM 1050 CD1 PHE A 108 86.726 17.865 18.692 1.00 18.55 C ATOM 1051 CD2 PHE A 108 87.997 17.361 16.734 1.00 18.69 C ATOM 1052 CE1 PHE A 108 86.501 16.504 18.909 1.00 18.20 C ATOM 1053 CE2 PHE A 108 87.775 16.003 16.942 1.00 19.37 C ATOM 1054 CZ PHE A 108 87.022 15.578 18.022 1.00 16.55 C ATOM 1055 H PHE A 108 90.634 18.931 17.773 1.00 0.00 H ATOM 1056 N SER A 109 88.096 20.651 20.273 1.00 16.44 N ATOM 1057 CA SER A 109 87.914 20.410 21.694 1.00 17.80 C ATOM 1058 C SER A 109 86.435 20.216 21.988 1.00 18.05 C ATOM 1059 O SER A 109 85.576 20.846 21.357 1.00 18.36 O ATOM 1060 CB SER A 109 88.477 21.576 22.543 1.00 18.57 C ATOM 1061 OG SER A 109 87.973 22.842 22.110 1.00 19.77 O ATOM 1062 HG SER A 109 88.230 22.993 21.166 1.00 0.00 H ATOM 1063 H SER A 109 87.508 21.372 19.808 1.00 0.00 H ATOM 1064 N ILE A 110 86.142 19.336 22.938 1.00 16.70 N ATOM 1065 CA ILE A 110 84.787 19.213 23.458 1.00 15.36 C ATOM 1066 C ILE A 110 84.571 20.297 24.506 1.00 18.29 C ATOM 1067 O ILE A 110 85.348 20.416 25.465 1.00 20.87 O ATOM 1068 CB ILE A 110 84.554 17.815 24.048 1.00 17.02 C ATOM 1069 CG1 ILE A 110 84.738 16.752 22.959 1.00 17.67 C ATOM 1070 CG2 ILE A 110 83.172 17.755 24.673 1.00 20.60 C ATOM 1071 CD1 ILE A 110 84.327 15.325 23.368 1.00 18.34 C ATOM 1072 H ILE A 110 86.893 18.724 23.317 1.00 0.00 H ATOM 1073 N ILE A 111 83.513 21.094 24.332 1.00 17.40 N ATOM 1074 CA ILE A 111 83.227 22.206 25.232 1.00 17.86 C ATOM 1075 C ILE A 111 81.857 22.086 25.894 1.00 21.48 C ATOM 1076 O ILE A 111 81.426 23.002 26.599 1.00 25.85 O ATOM 1077 CB ILE A 111 83.362 23.560 24.502 1.00 19.39 C ATOM 1078 CG1 ILE A 111 82.350 23.650 23.349 1.00 20.86 C ATOM 1079 CG2 ILE A 111 84.773 23.741 23.980 1.00 19.60 C ATOM 1080 CD1 ILE A 111 82.180 25.080 22.806 1.00 24.96 C ATOM 1081 H ILE A 111 82.874 20.916 23.531 1.00 0.00 H ATOM 1082 N GLY A 112 81.161 20.971 25.695 1.00 19.71 N ATOM 1083 CA GLY A 112 79.896 20.764 26.380 1.00 22.11 C ATOM 1084 C GLY A 112 79.297 19.440 25.963 1.00 20.04 C ATOM 1085 O GLY A 112 79.867 18.705 25.156 1.00 21.73 O ATOM 1086 H GLY A 112 81.523 20.243 25.046 1.00 0.00 H ATOM 1087 N GLY A 113 78.155 19.131 26.561 1.00 25.03 N ATOM 1088 CA GLY A 113 77.364 17.979 26.167 1.00 27.43 C ATOM 1089 C GLY A 113 77.249 16.945 27.277 1.00 28.10 C ATOM 1090 O GLY A 113 77.896 17.015 28.322 1.00 27.02 O ATOM 1091 H GLY A 113 77.815 19.733 27.338 1.00 0.00 H ATOM 1092 N GLU A 114 76.393 15.960 27.018 1.00 30.21 N ATOM 1093 CA GLU A 114 76.161 14.851 27.942 1.00 33.63 C ATOM 1094 C GLU A 114 77.003 13.665 27.477 1.00 33.80 C ATOM 1095 O GLU A 114 76.622 12.948 26.548 1.00 34.17 O ATOM 1096 CB GLU A 114 74.678 14.503 28.002 1.00 37.93 C ATOM 1097 CG GLU A 114 74.230 13.915 29.328 1.00 49.20 C ATOM 1098 CD GLU A 114 72.731 13.679 29.381 1.00 57.50 C ATOM 1099 OE1 GLU A 114 72.124 13.479 28.308 1.00 54.92 O ATOM 1100 OE2 GLU A 114 72.159 13.701 30.493 1.00 64.45 O ATOM 1101 H GLU A 114 75.867 15.980 26.121 1.00 0.00 H ATOM 1102 N HIS A 115 78.139 13.457 28.140 1.00 30.02 N ATOM 1103 CA HIS A 115 79.106 12.406 27.824 1.00 29.18 C ATOM 1104 C HIS A 115 80.091 12.323 28.988 1.00 34.17 C ATOM 1105 O HIS A 115 80.010 13.097 29.945 1.00 35.54 O ATOM 1106 CB HIS A 115 79.832 12.723 26.521 1.00 26.52 C ATOM 1107 CG HIS A 115 80.414 14.092 26.521 1.00 28.65 C ATOM 1108 ND1 HIS A 115 81.537 14.415 27.250 1.00 31.00 N ATOM 1109 CD2 HIS A 115 79.984 15.244 25.956 1.00 30.68 C ATOM 1110 CE1 HIS A 115 81.792 15.704 27.109 1.00 26.71 C ATOM 1111 NE2 HIS A 115 80.863 16.228 26.330 1.00 28.81 N ATOM 1112 H HIS A 115 78.354 14.087 28.939 1.00 0.00 H ATOM 1113 N ARG A 116 81.063 11.413 28.875 1.00 36.93 N ATOM 1114 CA ARG A 116 82.039 11.178 29.934 1.00 32.51 C ATOM 1115 C ARG A 116 83.471 11.522 29.520 1.00 37.98 C ATOM 1116 O ARG A 116 84.423 11.016 30.123 1.00 52.63 O ATOM 1117 CB ARG A 116 81.952 9.723 30.400 1.00 39.45 C ATOM 1118 CG ARG A 116 80.616 9.363 31.032 1.00 48.51 C ATOM 1119 CD ARG A 116 80.517 7.873 31.338 1.00 64.06 C ATOM 1120 NE ARG A 116 79.460 7.577 32.302 1.00 77.94 N ATOM 1121 CZ ARG A 116 79.141 6.352 32.710 1.00 90.30 C ATOM 1122 NH1 ARG A 116 79.794 5.300 32.231 1.00 94.40 N ATOM 1123 NH2 ARG A 116 78.167 6.175 33.595 1.00 92.94 N ATOM 1124 HE ARG A 116 78.922 8.376 32.695 1.00 0.00 H ATOM 1125 HH12 ARG A 116 79.544 4.343 32.551 1.00 0.00 H ATOM 1126 HH11 ARG A 116 80.556 5.433 31.536 1.00 0.00 H ATOM 1127 HH22 ARG A 116 77.920 5.216 33.912 1.00 0.00 H ATOM 1128 HH21 ARG A 116 77.651 6.996 33.971 1.00 0.00 H ATOM 1129 H ARG A 116 81.126 10.852 28.001 1.00 0.00 H ATOM 1130 N LEU A 117 83.653 12.382 28.524 1.00 28.19 N ATOM 1131 CA LEU A 117 84.981 12.708 28.003 1.00 24.98 C ATOM 1132 C LEU A 117 85.311 14.169 28.286 1.00 31.00 C ATOM 1133 O LEU A 117 85.494 14.971 27.363 1.00 35.58 O ATOM 1134 CB LEU A 117 85.061 12.424 26.492 1.00 25.58 C ATOM 1135 CG LEU A 117 84.888 10.984 26.027 1.00 31.93 C ATOM 1136 CD1 LEU A 117 85.027 10.921 24.512 1.00 31.77 C ATOM 1137 CD2 LEU A 117 85.905 10.082 26.700 1.00 31.50 C ATOM 1138 H LEU A 117 82.822 12.840 28.099 1.00 0.00 H ATOM 1139 N THR A 118 85.419 14.515 29.568 1.00 22.90 N ATOM 1140 CA THR A 118 85.680 15.909 29.894 1.00 21.80 C ATOM 1141 C THR A 118 87.084 16.311 29.449 1.00 20.93 C ATOM 1142 O THR A 118 88.042 15.532 29.548 1.00 19.73 O ATOM 1143 CB THR A 118 85.473 16.190 31.391 1.00 21.61 C ATOM 1144 OG1 THR A 118 86.312 15.358 32.206 1.00 23.87 O ATOM 1145 CG2 THR A 118 84.017 15.959 31.776 1.00 29.32 C ATOM 1146 HG1 THR A 118 87.261 15.530 31.984 1.00 0.00 H ATOM 1147 H THR A 118 85.319 13.804 30.320 1.00 0.00 H ATOM 1148 N ASN A 119 87.183 17.543 28.939 1.00 19.39 N ATOM 1149 CA ASN A 119 88.432 18.143 28.482 1.00 19.45 C ATOM 1150 C ASN A 119 89.098 17.311 27.392 1.00 21.27 C ATOM 1151 O ASN A 119 90.327 17.304 27.265 1.00 22.44 O ATOM 1152 CB ASN A 119 89.381 18.388 29.655 1.00 18.69 C ATOM 1153 CG ASN A 119 88.883 19.502 30.557 1.00 22.13 C ATOM 1154 OD1 ASN A 119 88.653 20.623 30.099 1.00 24.61 O ATOM 1155 ND2 ASN A 119 88.673 19.192 31.835 1.00 20.28 N ATOM 1156 HD22 ASN A 119 88.881 18.233 32.178 1.00 0.00 H ATOM 1157 HD21 ASN A 119 88.301 19.909 32.490 1.00 0.00 H ATOM 1158 H ASN A 119 86.314 18.110 28.863 1.00 0.00 H ATOM 1159 N TYR A 120 88.282 16.630 26.589 1.00 19.56 N ATOM 1160 CA TYR A 120 88.769 15.956 25.394 1.00 17.35 C ATOM 1161 C TYR A 120 89.245 16.967 24.359 1.00 20.50 C ATOM 1162 O TYR A 120 88.530 17.917 24.031 1.00 21.23 O ATOM 1163 CB TYR A 120 87.658 15.097 24.792 1.00 18.25 C ATOM 1164 CG TYR A 120 88.103 14.245 23.616 1.00 18.66 C ATOM 1165 CD1 TYR A 120 88.598 12.961 23.820 1.00 19.78 C ATOM 1166 CD2 TYR A 120 88.022 14.715 22.300 1.00 16.67 C ATOM 1167 CE1 TYR A 120 89.000 12.176 22.768 1.00 20.73 C ATOM 1168 CE2 TYR A 120 88.426 13.924 21.233 1.00 17.96 C ATOM 1169 CZ TYR A 120 88.917 12.656 21.475 1.00 20.81 C ATOM 1170 OH TYR A 120 89.318 11.849 20.435 1.00 23.78 O ATOM 1171 HH TYR A 120 88.553 11.692 19.827 1.00 0.00 H ATOM 1172 H TYR A 120 87.270 16.578 26.822 1.00 0.00 H ATOM 1173 N LYS A 121 90.446 16.750 23.827 1.00 19.57 N ATOM 1174 CA LYS A 121 90.984 17.584 22.757 1.00 16.46 C ATOM 1175 C LYS A 121 91.700 16.659 21.785 1.00 15.99 C ATOM 1176 O LYS A 121 92.428 15.764 22.207 1.00 20.48 O ATOM 1177 CB LYS A 121 91.959 18.651 23.277 1.00 25.58 C ATOM 1178 CG LYS A 121 91.384 19.551 24.361 1.00 38.90 C ATOM 1179 CD LYS A 121 92.365 20.633 24.775 1.00 52.02 C ATOM 1180 CE LYS A 121 92.038 21.176 26.165 1.00 58.38 C ATOM 1181 NZ LYS A 121 90.587 21.464 26.353 1.00 55.42 N ATOM 1182 HZ1 LYS A 121 90.283 22.174 25.657 1.00 0.00 H ATOM 1183 HZ2 LYS A 121 90.041 20.589 26.219 1.00 0.00 H ATOM 1184 HZ3 LYS A 121 90.429 21.829 27.314 1.00 0.00 H ATOM 1185 H LYS A 121 91.020 15.960 24.186 1.00 0.00 H ATOM 1186 N SER A 122 91.483 16.869 20.489 1.00 17.19 N ATOM 1187 CA SER A 122 92.025 15.992 19.453 1.00 16.67 C ATOM 1188 C SER A 122 92.798 16.816 18.426 1.00 18.84 C ATOM 1189 O SER A 122 92.454 17.967 18.151 1.00 19.23 O ATOM 1190 CB SER A 122 90.895 15.222 18.760 1.00 21.36 C ATOM 1191 OG SER A 122 91.369 14.526 17.624 1.00 33.01 O ATOM 1192 HG SER A 122 91.753 15.172 16.979 1.00 0.00 H ATOM 1193 H SER A 122 90.907 17.686 20.203 1.00 0.00 H ATOM 1194 N VAL A 123 93.861 16.227 17.870 1.00 18.20 N ATOM 1195 CA VAL A 123 94.613 16.832 16.769 1.00 15.87 C ATOM 1196 C VAL A 123 94.798 15.778 15.683 1.00 15.85 C ATOM 1197 O VAL A 123 95.173 14.639 15.982 1.00 16.01 O ATOM 1198 CB VAL A 123 95.978 17.370 17.230 1.00 18.21 C ATOM 1199 CG1 VAL A 123 96.780 17.891 16.027 1.00 24.73 C ATOM 1200 CG2 VAL A 123 95.782 18.489 18.238 1.00 21.51 C ATOM 1201 H VAL A 123 94.166 15.302 18.234 1.00 0.00 H ATOM 1202 N THR A 124 94.529 16.156 14.425 1.00 14.37 N ATOM 1203 CA THR A 124 94.634 15.249 13.282 1.00 14.82 C ATOM 1204 C THR A 124 95.588 15.861 12.264 1.00 17.98 C ATOM 1205 O THR A 124 95.482 17.050 11.951 1.00 17.77 O ATOM 1206 CB THR A 124 93.275 15.010 12.616 1.00 17.34 C ATOM 1207 OG1 THR A 124 92.395 14.328 13.517 1.00 19.73 O ATOM 1208 CG2 THR A 124 93.438 14.148 11.362 1.00 20.00 C ATOM 1209 HG1 THR A 124 92.266 14.878 14.330 1.00 0.00 H ATOM 1210 H THR A 124 94.232 17.138 14.254 1.00 0.00 H ATOM 1211 N THR A 125 96.522 15.062 11.757 1.00 14.45 N ATOM 1212 CA THR A 125 97.429 15.537 10.718 1.00 13.40 C ATOM 1213 C THR A 125 97.463 14.527 9.577 1.00 14.49 C ATOM 1214 O THR A 125 97.282 13.327 9.786 1.00 15.48 O ATOM 1215 CB THR A 125 98.853 15.799 11.252 1.00 14.91 C ATOM 1216 OG1 THR A 125 99.390 14.617 11.865 1.00 16.04 O ATOM 1217 CG2 THR A 125 98.842 16.929 12.265 1.00 15.10 C ATOM 1218 HG1 THR A 125 99.427 13.888 11.196 1.00 0.00 H ATOM 1219 H THR A 125 96.607 14.086 12.106 1.00 0.00 H ATOM 1220 N VAL A 126 97.679 15.024 8.360 1.00 13.77 N ATOM 1221 CA VAL A 126 97.614 14.211 7.143 1.00 13.81 C ATOM 1222 C VAL A 126 98.953 14.313 6.421 1.00 16.76 C ATOM 1223 O VAL A 126 99.481 15.418 6.239 1.00 15.74 O ATOM 1224 CB VAL A 126 96.458 14.661 6.231 1.00 14.79 C ATOM 1225 CG1 VAL A 126 96.482 13.907 4.897 1.00 15.97 C ATOM 1226 CG2 VAL A 126 95.110 14.425 6.930 1.00 15.69 C ATOM 1227 H VAL A 126 97.904 16.035 8.270 1.00 0.00 H ATOM 1228 N HIS A 127 99.503 13.167 6.013 1.00 15.30 N ATOM 1229 CA HIS A 127 100.899 13.076 5.592 1.00 15.00 C ATOM 1230 C HIS A 127 101.031 12.394 4.243 1.00 15.60 C ATOM 1231 O HIS A 127 100.444 11.330 4.015 1.00 16.42 O ATOM 1232 CB HIS A 127 101.704 12.324 6.643 1.00 15.00 C ATOM 1233 CG HIS A 127 101.535 12.911 8.001 1.00 14.97 C ATOM 1234 ND1 HIS A 127 102.307 13.962 8.444 1.00 15.92 N ATOM 1235 CD2 HIS A 127 100.631 12.662 8.978 1.00 14.98 C ATOM 1236 CE1 HIS A 127 101.912 14.310 9.657 1.00 15.43 C ATOM 1237 NE2 HIS A 127 100.889 13.543 10.001 1.00 15.27 N ATOM 1238 H HIS A 127 98.917 12.308 5.994 1.00 0.00 H ATOM 1239 N ARG A 128 101.831 13.000 3.369 1.00 16.63 N ATOM 1240 CA ARG A 128 102.125 12.458 2.050 1.00 17.51 C ATOM 1241 C ARG A 128 103.309 11.507 2.110 1.00 17.42 C ATOM 1242 O ARG A 128 104.360 11.840 2.676 1.00 19.54 O ATOM 1243 CB ARG A 128 102.441 13.577 1.059 1.00 19.36 C ATOM 1244 CG ARG A 128 102.967 13.073 -0.284 1.00 20.64 C ATOM 1245 CD ARG A 128 103.364 14.235 -1.182 1.00 26.30 C ATOM 1246 NE ARG A 128 102.255 15.171 -1.329 1.00 35.40 N ATOM 1247 CZ ARG A 128 101.337 15.101 -2.290 1.00 43.25 C ATOM 1248 NH1 ARG A 128 101.397 14.133 -3.202 1.00 42.02 N ATOM 1249 NH2 ARG A 128 100.358 16.000 -2.338 1.00 46.78 N ATOM 1250 HE ARG A 128 102.177 15.944 -0.637 1.00 0.00 H ATOM 1251 HH12 ARG A 128 100.679 14.080 -3.952 1.00 0.00 H ATOM 1252 HH11 ARG A 128 102.162 13.430 -3.164 1.00 0.00 H ATOM 1253 HH22 ARG A 128 99.640 15.947 -3.088 1.00 0.00 H ATOM 1254 HH21 ARG A 128 100.311 16.756 -1.625 1.00 0.00 H ATOM 1255 H ARG A 128 102.267 13.904 3.641 1.00 0.00 H ATOM 1256 N PHE A 129 103.148 10.357 1.469 1.00 17.40 N ATOM 1257 CA PHE A 129 104.224 9.417 1.224 1.00 18.42 C ATOM 1258 C PHE A 129 104.343 9.141 -0.266 1.00 18.62 C ATOM 1259 O PHE A 129 103.339 9.044 -0.978 1.00 19.86 O ATOM 1260 CB PHE A 129 103.991 8.119 1.987 1.00 19.32 C ATOM 1261 CG PHE A 129 104.377 8.212 3.417 1.00 17.74 C ATOM 1262 CD1 PHE A 129 103.497 8.741 4.346 1.00 17.70 C ATOM 1263 CD2 PHE A 129 105.645 7.819 3.834 1.00 19.78 C ATOM 1264 CE1 PHE A 129 103.863 8.862 5.685 1.00 16.99 C ATOM 1265 CE2 PHE A 129 106.015 7.932 5.164 1.00 19.66 C ATOM 1266 CZ PHE A 129 105.116 8.453 6.095 1.00 19.51 C ATOM 1267 H PHE A 129 102.197 10.116 1.123 1.00 0.00 H ATOM 1268 N GLU A 130 105.581 9.046 -0.735 1.00 20.50 N ATOM 1269 CA GLU A 130 105.860 8.775 -2.133 1.00 22.52 C ATOM 1270 C GLU A 130 107.064 7.853 -2.192 1.00 26.67 C ATOM 1271 O GLU A 130 108.040 8.048 -1.463 1.00 31.68 O ATOM 1272 CB GLU A 130 106.115 10.080 -2.901 1.00 26.38 C ATOM 1273 CG GLU A 130 106.217 9.933 -4.410 1.00 40.53 C ATOM 1274 CD GLU A 130 105.928 11.238 -5.137 1.00 51.47 C ATOM 1275 OE1 GLU A 130 105.328 12.150 -4.524 1.00 53.07 O ATOM 1276 OE2 GLU A 130 106.298 11.347 -6.324 1.00 57.02 O ATOM 1277 H GLU A 130 106.378 9.170 -0.078 1.00 0.00 H ATOM 1278 N LYS A 131 106.979 6.837 -3.042 1.00 25.02 N ATOM 1279 CA LYS A 131 108.107 5.936 -3.264 1.00 27.54 C ATOM 1280 C LYS A 131 107.929 5.325 -4.639 1.00 24.12 C ATOM 1281 O LYS A 131 106.907 4.682 -4.896 1.00 30.09 O ATOM 1282 CB LYS A 131 108.183 4.849 -2.191 1.00 33.62 C ATOM 1283 CG LYS A 131 109.479 4.046 -2.226 1.00 44.36 C ATOM 1284 CD LYS A 131 109.537 3.035 -1.095 1.00 51.11 C ATOM 1285 CE LYS A 131 110.974 2.774 -0.667 1.00 59.74 C ATOM 1286 NZ LYS A 131 111.834 2.342 -1.805 1.00 64.29 N ATOM 1287 HZ1 LYS A 131 111.454 1.463 -2.211 1.00 0.00 H ATOM 1288 HZ2 LYS A 131 111.844 3.086 -2.532 1.00 0.00 H ATOM 1289 HZ3 LYS A 131 112.802 2.177 -1.463 1.00 0.00 H ATOM 1290 H LYS A 131 106.091 6.679 -3.560 1.00 0.00 H ATOM 1291 N GLU A 132 108.913 5.526 -5.512 1.00 27.34 N ATOM 1292 CA GLU A 132 108.833 5.106 -6.915 1.00 32.54 C ATOM 1293 C GLU A 132 107.565 5.734 -7.488 1.00 31.55 C ATOM 1294 O GLU A 132 107.377 6.952 -7.336 1.00 34.87 O ATOM 1295 CB GLU A 132 108.921 3.585 -7.015 1.00 37.62 C ATOM 1296 CG GLU A 132 110.269 3.014 -6.619 1.00 43.13 C ATOM 1297 CD GLU A 132 111.390 3.428 -7.561 1.00 51.87 C ATOM 1298 OE1 GLU A 132 111.100 3.809 -8.717 1.00 51.23 O ATOM 1299 OE2 GLU A 132 112.564 3.368 -7.141 1.00 51.81 O ATOM 1300 H GLU A 132 109.778 6.002 -5.185 1.00 0.00 H ATOM 1301 N ASN A 133 106.674 4.964 -8.109 1.00 29.59 N ATOM 1302 CA ASN A 133 105.469 5.499 -8.726 1.00 33.47 C ATOM 1303 C ASN A 133 104.248 5.392 -7.825 1.00 31.53 C ATOM 1304 O ASN A 133 103.120 5.455 -8.325 1.00 38.28 O ATOM 1305 CB ASN A 133 105.200 4.792 -10.060 1.00 35.37 C ATOM 1306 CG ASN A 133 105.097 3.284 -9.914 1.00 43.02 C ATOM 1307 OD1 ASN A 133 105.652 2.702 -8.986 1.00 37.90 O ATOM 1308 ND2 ASN A 133 104.394 2.644 -10.844 1.00 49.82 N ATOM 1309 HD22 ASN A 133 103.941 3.178 -11.613 1.00 0.00 H ATOM 1310 HD21 ASN A 133 104.298 1.609 -10.803 1.00 0.00 H ATOM 1311 H ASN A 133 106.846 3.939 -8.155 1.00 0.00 H ATOM 1312 N ARG A 134 104.440 5.235 -6.518 1.00 24.15 N ATOM 1313 CA ARG A 134 103.338 5.114 -5.577 1.00 20.61 C ATOM 1314 C ARG A 134 103.224 6.363 -4.717 1.00 28.71 C ATOM 1315 O ARG A 134 104.229 6.883 -4.224 1.00 25.48 O ATOM 1316 CB ARG A 134 103.517 3.906 -4.655 1.00 25.70 C ATOM 1317 CG ARG A 134 103.317 2.567 -5.303 1.00 34.16 C ATOM 1318 CD ARG A 134 103.303 1.481 -4.241 1.00 35.25 C ATOM 1319 NE ARG A 134 104.494 1.518 -3.393 1.00 47.16 N ATOM 1320 CZ ARG A 134 104.480 1.667 -2.068 1.00 44.86 C ATOM 1321 NH1 ARG A 134 103.330 1.789 -1.413 1.00 40.96 N ATOM 1322 NH2 ARG A 134 105.624 1.681 -1.392 1.00 43.96 N ATOM 1323 HE ARG A 134 105.420 1.421 -3.857 1.00 0.00 H ATOM 1324 HH12 ARG A 134 103.330 1.905 -0.379 1.00 0.00 H ATOM 1325 HH11 ARG A 134 102.430 1.769 -1.934 1.00 0.00 H ATOM 1326 HH22 ARG A 134 105.616 1.797 -0.359 1.00 0.00 H ATOM 1327 HH21 ARG A 134 106.527 1.576 -1.896 1.00 0.00 H ATOM 1328 H ARG A 134 105.414 5.197 -6.156 1.00 0.00 H ATOM 1329 N ILE A 135 101.991 6.816 -4.508 1.00 23.55 N ATOM 1330 CA ILE A 135 101.687 7.915 -3.601 1.00 20.09 C ATOM 1331 C ILE A 135 100.618 7.428 -2.635 1.00 18.66 C ATOM 1332 O ILE A 135 99.587 6.897 -3.065 1.00 22.22 O ATOM 1333 CB ILE A 135 101.193 9.165 -4.355 1.00 24.91 C ATOM 1334 CG1 ILE A 135 102.243 9.653 -5.357 1.00 30.67 C ATOM 1335 CG2 ILE A 135 100.823 10.269 -3.366 1.00 22.89 C ATOM 1336 CD1 ILE A 135 101.694 10.648 -6.368 1.00 31.81 C ATOM 1337 H ILE A 135 101.205 6.363 -5.017 1.00 0.00 H ATOM 1338 N TRP A 136 100.857 7.587 -1.336 1.00 15.57 N ATOM 1339 CA TRP A 136 99.845 7.201 -0.355 1.00 15.38 C ATOM 1340 C TRP A 136 99.863 8.182 0.809 1.00 16.49 C ATOM 1341 O TRP A 136 100.668 9.118 0.848 1.00 18.04 O ATOM 1342 CB TRP A 136 100.038 5.747 0.107 1.00 19.09 C ATOM 1343 CG TRP A 136 101.231 5.451 0.999 1.00 16.05 C ATOM 1344 CD1 TRP A 136 101.214 5.286 2.358 1.00 17.06 C ATOM 1345 CD2 TRP A 136 102.589 5.246 0.587 1.00 17.18 C ATOM 1346 NE1 TRP A 136 102.481 4.997 2.815 1.00 21.64 N ATOM 1347 CE2 TRP A 136 103.340 4.959 1.748 1.00 19.73 C ATOM 1348 CE3 TRP A 136 103.244 5.280 -0.647 1.00 17.49 C ATOM 1349 CZ2 TRP A 136 104.722 4.719 1.710 1.00 20.06 C ATOM 1350 CZ3 TRP A 136 104.614 5.031 -0.685 1.00 21.65 C ATOM 1351 CH2 TRP A 136 105.336 4.765 0.492 1.00 20.28 C ATOM 1352 HE1 TRP A 136 102.743 4.834 3.808 1.00 0.00 H ATOM 1353 H TRP A 136 101.764 7.986 -1.019 1.00 0.00 H ATOM 1354 N THR A 137 98.948 7.969 1.751 1.00 14.80 N ATOM 1355 CA THR A 137 98.722 8.869 2.870 1.00 13.95 C ATOM 1356 C THR A 137 98.841 8.119 4.187 1.00 14.55 C ATOM 1357 O THR A 137 98.459 6.950 4.293 1.00 17.17 O ATOM 1358 CB THR A 137 97.326 9.514 2.765 1.00 17.62 C ATOM 1359 OG1 THR A 137 97.239 10.217 1.522 1.00 16.03 O ATOM 1360 CG2 THR A 137 97.067 10.490 3.924 1.00 15.25 C ATOM 1361 HG1 THR A 137 97.374 9.582 0.775 1.00 0.00 H ATOM 1362 H THR A 137 98.363 7.112 1.683 1.00 0.00 H ATOM 1363 N VAL A 138 99.369 8.794 5.208 1.00 13.07 N ATOM 1364 CA VAL A 138 99.178 8.345 6.585 1.00 13.87 C ATOM 1365 C VAL A 138 98.477 9.467 7.332 1.00 16.28 C ATOM 1366 O VAL A 138 98.847 10.637 7.191 1.00 14.79 O ATOM 1367 CB VAL A 138 100.498 7.972 7.289 1.00 14.87 C ATOM 1368 CG1 VAL A 138 100.213 7.649 8.741 1.00 14.35 C ATOM 1369 CG2 VAL A 138 101.127 6.754 6.633 1.00 16.50 C ATOM 1370 H VAL A 138 99.925 9.653 5.022 1.00 0.00 H ATOM 1371 N VAL A 139 97.440 9.118 8.088 1.00 14.27 N ATOM 1372 CA VAL A 139 96.777 10.058 8.989 1.00 13.51 C ATOM 1373 C VAL A 139 97.215 9.734 10.408 1.00 15.59 C ATOM 1374 O VAL A 139 97.246 8.557 10.805 1.00 15.36 O ATOM 1375 CB VAL A 139 95.246 9.980 8.860 1.00 14.80 C ATOM 1376 CG1 VAL A 139 94.580 10.963 9.832 1.00 15.58 C ATOM 1377 CG2 VAL A 139 94.826 10.273 7.436 1.00 16.03 C ATOM 1378 H VAL A 139 97.088 8.141 8.036 1.00 0.00 H ATOM 1379 N LEU A 140 97.574 10.766 11.166 1.00 13.75 N ATOM 1380 CA LEU A 140 97.865 10.640 12.592 1.00 15.45 C ATOM 1381 C LEU A 140 96.790 11.376 13.366 1.00 14.54 C ATOM 1382 O LEU A 140 96.455 12.517 13.029 1.00 15.27 O ATOM 1383 CB LEU A 140 99.231 11.233 12.947 1.00 13.67 C ATOM 1384 CG LEU A 140 100.458 10.523 12.390 1.00 14.49 C ATOM 1385 CD1 LEU A 140 101.725 11.249 12.861 1.00 18.18 C ATOM 1386 CD2 LEU A 140 100.500 9.037 12.781 1.00 15.34 C ATOM 1387 H LEU A 140 97.651 11.704 10.724 1.00 0.00 H ATOM 1388 N GLU A 141 96.245 10.735 14.400 1.00 14.00 N ATOM 1389 CA GLU A 141 95.296 11.422 15.266 1.00 14.69 C ATOM 1390 C GLU A 141 95.641 11.121 16.715 1.00 16.45 C ATOM 1391 O GLU A 141 95.803 9.956 17.097 1.00 17.38 O ATOM 1392 CB GLU A 141 93.850 11.011 14.963 1.00 18.57 C ATOM 1393 CG GLU A 141 92.838 11.802 15.776 1.00 20.10 C ATOM 1394 CD GLU A 141 91.404 11.473 15.422 1.00 26.36 C ATOM 1395 OE1 GLU A 141 91.180 10.729 14.450 1.00 33.54 O ATOM 1396 OE2 GLU A 141 90.497 11.968 16.122 1.00 37.97 O ATOM 1397 H GLU A 141 96.497 9.744 14.589 1.00 0.00 H ATOM 1398 N SER A 142 95.763 12.172 17.514 1.00 17.17 N ATOM 1399 CA SER A 142 96.046 12.023 18.931 1.00 16.39 C ATOM 1400 C SER A 142 94.958 12.732 19.723 1.00 16.49 C ATOM 1401 O SER A 142 94.246 13.598 19.211 1.00 18.93 O ATOM 1402 CB SER A 142 97.437 12.575 19.300 1.00 23.24 C ATOM 1403 OG SER A 142 97.525 13.973 19.042 1.00 21.48 O ATOM 1404 HG SER A 142 96.844 14.450 19.579 1.00 0.00 H ATOM 1405 H SER A 142 95.653 13.127 17.116 1.00 0.00 H ATOM 1406 N TYR A 143 94.805 12.330 20.976 1.00 15.09 N ATOM 1407 CA TYR A 143 93.881 13.030 21.852 1.00 15.53 C ATOM 1408 C TYR A 143 94.474 13.086 23.248 1.00 19.10 C ATOM 1409 O TYR A 143 95.390 12.333 23.595 1.00 18.39 O ATOM 1410 CB TYR A 143 92.491 12.361 21.913 1.00 16.92 C ATOM 1411 CG TYR A 143 92.512 10.989 22.568 1.00 19.72 C ATOM 1412 CD1 TYR A 143 92.418 10.857 23.943 1.00 23.73 C ATOM 1413 CD2 TYR A 143 92.655 9.838 21.808 1.00 22.14 C ATOM 1414 CE1 TYR A 143 92.464 9.607 24.555 1.00 24.79 C ATOM 1415 CE2 TYR A 143 92.699 8.582 22.409 1.00 24.79 C ATOM 1416 CZ TYR A 143 92.602 8.480 23.783 1.00 24.19 C ATOM 1417 OH TYR A 143 92.646 7.240 24.380 1.00 27.14 O ATOM 1418 HH TYR A 143 93.507 6.802 24.164 1.00 0.00 H ATOM 1419 H TYR A 143 95.345 11.515 21.332 1.00 0.00 H ATOM 1420 N VAL A 144 93.936 13.997 24.035 1.00 17.78 N ATOM 1421 CA VAL A 144 94.114 14.001 25.479 1.00 18.86 C ATOM 1422 C VAL A 144 92.730 14.183 26.073 1.00 18.29 C ATOM 1423 O VAL A 144 91.859 14.831 25.482 1.00 18.52 O ATOM 1424 CB VAL A 144 95.087 15.101 25.966 1.00 24.87 C ATOM 1425 CG1 VAL A 144 94.516 16.479 25.690 1.00 25.88 C ATOM 1426 CG2 VAL A 144 95.379 14.924 27.451 1.00 27.57 C ATOM 1427 H VAL A 144 93.358 14.747 23.604 1.00 0.00 H ATOM 1428 N VAL A 145 92.517 13.570 27.238 1.00 20.70 N ATOM 1429 CA VAL A 145 91.211 13.586 27.881 1.00 19.41 C ATOM 1430 C VAL A 145 91.416 13.316 29.363 1.00 22.73 C ATOM 1431 O VAL A 145 92.412 12.710 29.765 1.00 26.13 O ATOM 1432 CB VAL A 145 90.256 12.554 27.225 1.00 19.83 C ATOM 1433 CG1 VAL A 145 90.708 11.130 27.511 1.00 25.68 C ATOM 1434 CG2 VAL A 145 88.833 12.770 27.676 1.00 20.81 C ATOM 1435 H VAL A 145 93.303 13.068 27.698 1.00 0.00 H ATOM 1436 N ASP A 146 90.473 13.779 30.177 1.00 22.09 N ATOM 1437 CA ASP A 146 90.536 13.537 31.612 1.00 23.96 C ATOM 1438 C ASP A 146 90.409 12.058 31.928 1.00 32.12 C ATOM 1439 O ASP A 146 89.685 11.318 31.258 1.00 29.74 O ATOM 1440 CB ASP A 146 89.426 14.287 32.330 1.00 24.85 C ATOM 1441 CG ASP A 146 89.678 15.771 32.405 1.00 23.86 C ATOM 1442 OD1 ASP A 146 90.848 16.199 32.300 1.00 26.34 O ATOM 1443 OD2 ASP A 146 88.692 16.508 32.564 1.00 24.98 O ATOM 1444 H ASP A 146 89.678 14.322 29.784 1.00 0.00 H ATOM 1445 N MET A 147 91.116 11.656 32.986 1.00 37.29 N ATOM 1446 CA MET A 147 91.078 10.335 33.612 1.00 49.21 C ATOM 1447 C MET A 147 91.396 9.215 32.634 1.00 55.97 C ATOM 1448 O MET A 147 92.452 8.586 32.737 1.00 56.23 O ATOM 1449 CB MET A 147 89.721 10.101 34.286 1.00 53.34 C ATOM 1450 CG MET A 147 88.753 9.249 33.491 1.00 60.02 C ATOM 1451 SD MET A 147 87.162 9.112 34.321 1.00 73.64 S ATOM 1452 CE MET A 147 87.683 8.708 35.989 1.00 65.45 C ATOM 1453 H MET A 147 91.760 12.354 33.409 1.00 0.00 H TER 1454 MET A 147 ATOM 1455 N ASP A 155 89.326 1.478 30.958 1.00 54.07 N ATOM 1456 CA ASP A 155 88.077 1.479 30.201 1.00 56.78 C ATOM 1457 C ASP A 155 87.906 2.740 29.364 1.00 57.18 C ATOM 1458 O ASP A 155 87.503 2.668 28.202 1.00 57.58 O ATOM 1459 CB ASP A 155 86.883 1.320 31.139 1.00 58.48 C ATOM 1460 CG ASP A 155 86.651 -0.117 31.534 1.00 65.97 C ATOM 1461 OD1 ASP A 155 87.147 -1.014 30.817 1.00 66.42 O ATOM 1462 OD2 ASP A 155 85.968 -0.351 32.553 1.00 75.87 O ATOM 1463 HN3 ASP A 155 89.341 2.295 31.601 1.00 0.00 H ATOM 1464 HN2 ASP A 155 90.129 1.538 30.300 1.00 0.00 H ATOM 1465 HN1 ASP A 155 89.394 0.600 31.510 1.00 0.00 H ATOM 1466 N THR A 156 88.200 3.895 29.966 1.00 56.90 N ATOM 1467 CA THR A 156 88.129 5.156 29.234 1.00 53.47 C ATOM 1468 C THR A 156 89.049 5.135 28.020 1.00 46.10 C ATOM 1469 O THR A 156 88.622 5.420 26.893 1.00 38.34 O ATOM 1470 CB THR A 156 88.492 6.324 30.155 1.00 58.37 C ATOM 1471 OG1 THR A 156 87.461 6.507 31.132 1.00 64.88 O ATOM 1472 CG2 THR A 156 88.671 7.609 29.349 1.00 51.86 C ATOM 1473 HG1 THR A 156 87.700 7.263 31.725 1.00 0.00 H ATOM 1474 H THR A 156 88.483 3.896 30.967 1.00 0.00 H ATOM 1475 N ARG A 157 90.325 4.801 28.234 1.00 40.39 N ATOM 1476 CA ARG A 157 91.261 4.757 27.119 1.00 41.78 C ATOM 1477 C ARG A 157 90.839 3.709 26.098 1.00 34.12 C ATOM 1478 O ARG A 157 90.950 3.933 24.888 1.00 33.76 O ATOM 1479 CB ARG A 157 92.675 4.484 27.631 1.00 47.56 C ATOM 1480 CG ARG A 157 93.744 4.743 26.585 1.00 54.77 C ATOM 1481 CD ARG A 157 95.141 4.631 27.167 1.00 66.49 C ATOM 1482 NE ARG A 157 96.155 4.999 26.183 1.00 70.59 N ATOM 1483 CZ ARG A 157 97.464 4.876 26.376 1.00 71.27 C ATOM 1484 NH1 ARG A 157 97.923 4.386 27.521 1.00 71.45 N ATOM 1485 NH2 ARG A 157 98.313 5.239 25.422 1.00 70.40 N ATOM 1486 HE ARG A 157 95.832 5.382 25.272 1.00 0.00 H ATOM 1487 HH12 ARG A 157 98.947 4.290 27.672 1.00 0.00 H ATOM 1488 HH11 ARG A 157 97.258 4.098 28.267 1.00 0.00 H ATOM 1489 HH22 ARG A 157 99.337 5.143 25.573 1.00 0.00 H ATOM 1490 HH21 ARG A 157 97.954 5.620 24.523 1.00 0.00 H ATOM 1491 H ARG A 157 90.649 4.573 29.195 1.00 0.00 H ATOM 1492 N MET A 158 90.318 2.571 26.569 1.00 34.93 N ATOM 1493 CA MET A 158 89.886 1.518 25.656 1.00 32.86 C ATOM 1494 C MET A 158 88.736 1.992 24.774 1.00 26.51 C ATOM 1495 O MET A 158 88.747 1.788 23.553 1.00 27.60 O ATOM 1496 CB MET A 158 89.489 0.279 26.460 1.00 39.41 C ATOM 1497 CG MET A 158 89.700 -1.033 25.737 1.00 48.77 C ATOM 1498 SD MET A 158 90.104 -2.368 26.890 1.00 52.48 S ATOM 1499 CE MET A 158 91.786 -1.944 27.344 1.00 59.72 C ATOM 1500 H MET A 158 90.220 2.435 27.595 1.00 0.00 H ATOM 1501 N PHE A 159 87.740 2.650 25.371 1.00 30.51 N ATOM 1502 CA PHE A 159 86.618 3.165 24.587 1.00 29.14 C ATOM 1503 C PHE A 159 87.074 4.231 23.593 1.00 29.29 C ATOM 1504 O PHE A 159 86.737 4.171 22.403 1.00 27.79 O ATOM 1505 CB PHE A 159 85.544 3.716 25.531 1.00 34.36 C ATOM 1506 CG PHE A 159 84.479 4.508 24.838 1.00 33.26 C ATOM 1507 CD1 PHE A 159 83.485 3.874 24.112 1.00 36.19 C ATOM 1508 CD2 PHE A 159 84.470 5.892 24.912 1.00 40.09 C ATOM 1509 CE1 PHE A 159 82.501 4.608 23.463 1.00 37.44 C ATOM 1510 CE2 PHE A 159 83.492 6.628 24.272 1.00 38.41 C ATOM 1511 CZ PHE A 159 82.506 5.985 23.545 1.00 36.88 C ATOM 1512 H PHE A 159 87.762 2.797 26.400 1.00 0.00 H ATOM 1513 N ALA A 160 87.841 5.220 24.064 1.00 25.99 N ATOM 1514 CA ALA A 160 88.259 6.308 23.183 1.00 23.96 C ATOM 1515 C ALA A 160 89.199 5.816 22.091 1.00 23.26 C ATOM 1516 O ALA A 160 89.101 6.255 20.940 1.00 23.78 O ATOM 1517 CB ALA A 160 88.926 7.414 23.999 1.00 28.18 C ATOM 1518 H ALA A 160 88.141 5.215 25.060 1.00 0.00 H ATOM 1519 N ASP A 161 90.136 4.930 22.434 1.00 22.00 N ATOM 1520 CA ASP A 161 91.024 4.380 21.412 1.00 24.33 C ATOM 1521 C ASP A 161 90.241 3.638 20.340 1.00 21.48 C ATOM 1522 O ASP A 161 90.545 3.756 19.149 1.00 22.97 O ATOM 1523 CB ASP A 161 92.051 3.428 22.031 1.00 23.96 C ATOM 1524 CG ASP A 161 93.129 4.148 22.801 1.00 30.62 C ATOM 1525 OD1 ASP A 161 93.282 5.369 22.604 1.00 26.01 O ATOM 1526 OD2 ASP A 161 93.822 3.486 23.603 1.00 35.95 O ATOM 1527 H ASP A 161 90.234 4.632 23.426 1.00 0.00 H ATOM 1528 N THR A 162 89.264 2.819 20.749 1.00 22.70 N ATOM 1529 CA THR A 162 88.543 2.020 19.764 1.00 21.38 C ATOM 1530 C THR A 162 87.729 2.905 18.831 1.00 18.80 C ATOM 1531 O THR A 162 87.691 2.663 17.621 1.00 21.08 O ATOM 1532 CB THR A 162 87.649 0.994 20.457 1.00 23.11 C ATOM 1533 OG1 THR A 162 88.459 0.163 21.297 1.00 28.20 O ATOM 1534 CG2 THR A 162 86.948 0.121 19.414 1.00 22.94 C ATOM 1535 HG1 THR A 162 88.913 0.724 21.975 1.00 0.00 H ATOM 1536 H THR A 162 89.022 2.753 21.758 1.00 0.00 H ATOM 1537 N VAL A 163 87.106 3.960 19.363 1.00 18.46 N ATOM 1538 CA VAL A 163 86.356 4.885 18.508 1.00 18.18 C ATOM 1539 C VAL A 163 87.286 5.602 17.537 1.00 16.78 C ATOM 1540 O VAL A 163 86.991 5.717 16.342 1.00 20.13 O ATOM 1541 CB VAL A 163 85.554 5.887 19.358 1.00 19.80 C ATOM 1542 CG1 VAL A 163 84.982 7.003 18.451 1.00 18.63 C ATOM 1543 CG2 VAL A 163 84.447 5.158 20.120 1.00 24.04 C ATOM 1544 H VAL A 163 87.153 4.126 20.389 1.00 0.00 H ATOM 1545 N VAL A 164 88.412 6.120 18.034 1.00 18.12 N ATOM 1546 CA VAL A 164 89.335 6.826 17.146 1.00 19.02 C ATOM 1547 C VAL A 164 89.814 5.895 16.043 1.00 16.93 C ATOM 1548 O VAL A 164 89.892 6.282 14.867 1.00 18.57 O ATOM 1549 CB VAL A 164 90.512 7.414 17.948 1.00 18.17 C ATOM 1550 CG1 VAL A 164 91.618 7.865 17.005 1.00 19.61 C ATOM 1551 CG2 VAL A 164 90.027 8.587 18.801 1.00 21.88 C ATOM 1552 H VAL A 164 88.631 6.022 19.046 1.00 0.00 H ATOM 1553 N LYS A 165 90.117 4.645 16.402 1.00 17.05 N ATOM 1554 CA LYS A 165 90.577 3.666 15.423 1.00 16.05 C ATOM 1555 C LYS A 165 89.504 3.398 14.371 1.00 18.75 C ATOM 1556 O LYS A 165 89.785 3.394 13.166 1.00 16.68 O ATOM 1557 CB LYS A 165 90.980 2.375 16.146 1.00 18.20 C ATOM 1558 CG LYS A 165 91.759 1.384 15.311 1.00 36.40 C ATOM 1559 CD LYS A 165 92.122 0.155 16.135 1.00 45.93 C ATOM 1560 CE LYS A 165 92.791 0.546 17.448 1.00 54.25 C ATOM 1561 NZ LYS A 165 94.097 1.234 17.254 1.00 62.01 N ATOM 1562 HZ1 LYS A 165 94.747 0.603 16.743 1.00 0.00 H ATOM 1563 HZ2 LYS A 165 93.951 2.103 16.702 1.00 0.00 H ATOM 1564 HZ3 LYS A 165 94.502 1.474 18.181 1.00 0.00 H ATOM 1565 H LYS A 165 90.023 4.364 17.399 1.00 0.00 H ATOM 1566 N LEU A 166 88.261 3.191 14.810 1.00 17.63 N ATOM 1567 CA LEU A 166 87.192 2.901 13.852 1.00 15.64 C ATOM 1568 C LEU A 166 86.927 4.094 12.944 1.00 16.78 C ATOM 1569 O LEU A 166 86.613 3.918 11.760 1.00 17.98 O ATOM 1570 CB LEU A 166 85.922 2.495 14.594 1.00 16.92 C ATOM 1571 CG LEU A 166 85.994 1.113 15.226 1.00 17.44 C ATOM 1572 CD1 LEU A 166 84.931 0.983 16.293 1.00 23.57 C ATOM 1573 CD2 LEU A 166 85.786 0.088 14.147 1.00 20.41 C ATOM 1574 H LEU A 166 88.052 3.235 15.828 1.00 0.00 H ATOM 1575 N ASN A 167 87.023 5.309 13.485 1.00 15.05 N ATOM 1576 CA ASN A 167 86.784 6.497 12.673 1.00 13.70 C ATOM 1577 C ASN A 167 87.898 6.707 11.663 1.00 14.92 C ATOM 1578 O ASN A 167 87.640 7.144 10.537 1.00 16.66 O ATOM 1579 CB ASN A 167 86.635 7.731 13.558 1.00 15.22 C ATOM 1580 CG ASN A 167 85.315 7.757 14.297 1.00 16.69 C ATOM 1581 OD1 ASN A 167 84.402 6.994 13.977 1.00 16.70 O ATOM 1582 ND2 ASN A 167 85.195 8.648 15.281 1.00 19.20 N ATOM 1583 HD22 ASN A 167 85.992 9.273 15.517 1.00 0.00 H ATOM 1584 HD21 ASN A 167 84.304 8.719 15.813 1.00 0.00 H ATOM 1585 H ASN A 167 87.269 5.410 14.490 1.00 0.00 H ATOM 1586 N LEU A 168 89.148 6.445 12.050 1.00 16.10 N ATOM 1587 CA LEU A 168 90.222 6.528 11.062 1.00 14.99 C ATOM 1588 C LEU A 168 90.006 5.506 9.957 1.00 16.70 C ATOM 1589 O LEU A 168 90.318 5.768 8.793 1.00 15.19 O ATOM 1590 CB LEU A 168 91.583 6.307 11.717 1.00 15.71 C ATOM 1591 CG LEU A 168 92.108 7.463 12.546 1.00 17.71 C ATOM 1592 CD1 LEU A 168 93.311 7.013 13.353 1.00 18.79 C ATOM 1593 CD2 LEU A 168 92.501 8.611 11.621 1.00 19.67 C ATOM 1594 H LEU A 168 89.354 6.187 13.036 1.00 0.00 H ATOM 1595 N GLN A 169 89.475 4.336 10.307 1.00 15.12 N ATOM 1596 CA GLN A 169 89.188 3.332 9.296 1.00 15.74 C ATOM 1597 C GLN A 169 88.075 3.797 8.360 1.00 15.07 C ATOM 1598 O GLN A 169 88.148 3.575 7.146 1.00 16.83 O ATOM 1599 CB GLN A 169 88.828 2.014 9.974 1.00 15.67 C ATOM 1600 CG GLN A 169 88.461 0.894 9.039 1.00 18.53 C ATOM 1601 CD GLN A 169 88.058 -0.333 9.820 1.00 22.57 C ATOM 1602 OE1 GLN A 169 86.941 -0.422 10.325 1.00 31.79 O ATOM 1603 NE2 GLN A 169 88.977 -1.272 9.953 1.00 24.28 N ATOM 1604 HE22 GLN A 169 89.909 -1.154 9.508 1.00 0.00 H ATOM 1605 HE21 GLN A 169 88.768 -2.130 10.503 1.00 0.00 H ATOM 1606 H GLN A 169 89.265 4.140 11.307 1.00 0.00 H ATOM 1607 N LYS A 170 87.041 4.450 8.891 1.00 14.56 N ATOM 1608 CA LYS A 170 86.000 4.966 8.002 1.00 15.42 C ATOM 1609 C LYS A 170 86.566 6.017 7.059 1.00 16.99 C ATOM 1610 O LYS A 170 86.248 6.034 5.865 1.00 16.97 O ATOM 1611 CB LYS A 170 84.834 5.549 8.803 1.00 17.18 C ATOM 1612 CG LYS A 170 83.759 6.170 7.893 1.00 15.87 C ATOM 1613 CD LYS A 170 82.485 6.525 8.637 1.00 13.89 C ATOM 1614 CE LYS A 170 81.484 7.229 7.693 1.00 16.48 C ATOM 1615 NZ LYS A 170 80.280 7.743 8.400 1.00 14.66 N ATOM 1616 HZ1 LYS A 170 79.782 6.951 8.855 1.00 0.00 H ATOM 1617 HZ2 LYS A 170 80.571 8.432 9.122 1.00 0.00 H ATOM 1618 HZ3 LYS A 170 79.648 8.204 7.715 1.00 0.00 H ATOM 1619 H LYS A 170 86.976 4.590 9.919 1.00 0.00 H ATOM 1620 N LEU A 171 87.376 6.929 7.591 1.00 14.98 N ATOM 1621 CA LEU A 171 88.048 7.906 6.739 1.00 12.61 C ATOM 1622 C LEU A 171 88.805 7.207 5.613 1.00 17.16 C ATOM 1623 O LEU A 171 88.710 7.606 4.448 1.00 16.06 O ATOM 1624 CB LEU A 171 88.982 8.768 7.591 1.00 14.75 C ATOM 1625 CG LEU A 171 89.853 9.782 6.863 1.00 15.38 C ATOM 1626 CD1 LEU A 171 88.991 10.823 6.156 1.00 16.19 C ATOM 1627 CD2 LEU A 171 90.810 10.442 7.848 1.00 15.40 C ATOM 1628 H LEU A 171 87.531 6.946 8.619 1.00 0.00 H ATOM 1629 N ALA A 172 89.536 6.140 5.938 1.00 14.58 N ATOM 1630 CA ALA A 172 90.268 5.397 4.914 1.00 15.93 C ATOM 1631 C ALA A 172 89.327 4.820 3.866 1.00 17.16 C ATOM 1632 O ALA A 172 89.600 4.899 2.661 1.00 17.18 O ATOM 1633 CB ALA A 172 91.090 4.279 5.564 1.00 16.11 C ATOM 1634 H ALA A 172 89.586 5.833 6.931 1.00 0.00 H ATOM 1635 N THR A 173 88.217 4.230 4.305 1.00 15.22 N ATOM 1636 CA THR A 173 87.266 3.633 3.374 1.00 15.62 C ATOM 1637 C THR A 173 86.673 4.681 2.432 1.00 17.08 C ATOM 1638 O THR A 173 86.526 4.441 1.227 1.00 18.40 O ATOM 1639 CB THR A 173 86.183 2.930 4.182 1.00 18.01 C ATOM 1640 OG1 THR A 173 86.802 1.947 5.032 1.00 20.62 O ATOM 1641 CG2 THR A 173 85.180 2.250 3.288 1.00 15.17 C ATOM 1642 HG1 THR A 173 87.439 2.395 5.643 1.00 0.00 H ATOM 1643 H THR A 173 88.025 4.194 5.327 1.00 0.00 H ATOM 1644 N VAL A 174 86.304 5.846 2.974 1.00 16.73 N ATOM 1645 CA VAL A 174 85.721 6.906 2.149 1.00 15.85 C ATOM 1646 C VAL A 174 86.729 7.403 1.117 1.00 15.34 C ATOM 1647 O VAL A 174 86.419 7.521 -0.080 1.00 17.03 O ATOM 1648 CB VAL A 174 85.216 8.050 3.046 1.00 15.99 C ATOM 1649 CG1 VAL A 174 84.820 9.266 2.215 1.00 21.24 C ATOM 1650 CG2 VAL A 174 84.049 7.563 3.880 1.00 14.74 C ATOM 1651 H VAL A 174 86.433 6.001 3.994 1.00 0.00 H ATOM 1652 N ALA A 175 87.948 7.719 1.563 1.00 14.69 N ATOM 1653 CA ALA A 175 88.960 8.244 0.652 1.00 14.90 C ATOM 1654 C ALA A 175 89.308 7.227 -0.425 1.00 16.02 C ATOM 1655 O ALA A 175 89.463 7.581 -1.601 1.00 15.70 O ATOM 1656 CB ALA A 175 90.218 8.635 1.429 1.00 14.99 C ATOM 1657 H ALA A 175 88.178 7.590 2.569 1.00 0.00 H ATOM 1658 N GLU A 176 89.434 5.956 -0.040 1.00 16.37 N ATOM 1659 CA GLU A 176 89.770 4.944 -1.035 1.00 16.15 C ATOM 1660 C GLU A 176 88.635 4.729 -2.031 1.00 18.94 C ATOM 1661 O GLU A 176 88.907 4.489 -3.213 1.00 18.29 O ATOM 1662 CB GLU A 176 90.181 3.646 -0.328 1.00 15.49 C ATOM 1663 CG GLU A 176 91.568 3.805 0.308 1.00 16.72 C ATOM 1664 CD GLU A 176 91.921 2.761 1.335 1.00 18.91 C ATOM 1665 OE1 GLU A 176 91.143 1.800 1.520 1.00 21.10 O ATOM 1666 OE2 GLU A 176 93.003 2.905 1.962 1.00 16.92 O ATOM 1667 H GLU A 176 89.295 5.690 0.956 1.00 0.00 H ATOM 1668 N ALA A 177 87.372 4.854 -1.598 1.00 15.53 N ATOM 1669 CA ALA A 177 86.261 4.786 -2.545 1.00 16.18 C ATOM 1670 C ALA A 177 86.319 5.941 -3.540 1.00 16.70 C ATOM 1671 O ALA A 177 86.080 5.746 -4.735 1.00 16.31 O ATOM 1672 CB ALA A 177 84.926 4.787 -1.798 1.00 18.02 C ATOM 1673 H ALA A 177 87.183 5.000 -0.586 1.00 0.00 H ATOM 1674 N MET A 178 86.658 7.145 -3.066 1.00 16.30 N ATOM 1675 CA MET A 178 86.733 8.302 -3.957 1.00 14.97 C ATOM 1676 C MET A 178 87.922 8.208 -4.905 1.00 15.91 C ATOM 1677 O MET A 178 87.879 8.767 -6.007 1.00 16.90 O ATOM 1678 CB MET A 178 86.823 9.591 -3.134 1.00 14.78 C ATOM 1679 CG MET A 178 85.524 9.924 -2.449 1.00 16.77 C ATOM 1680 SD MET A 178 85.744 11.415 -1.452 1.00 23.63 S ATOM 1681 CE MET A 178 84.150 12.190 -1.617 1.00 33.01 C ATOM 1682 H MET A 178 86.870 7.259 -2.054 1.00 0.00 H ATOM 1683 N ALA A 179 88.988 7.513 -4.501 1.00 15.21 N ATOM 1684 CA ALA A 179 90.203 7.485 -5.310 1.00 17.50 C ATOM 1685 C ALA A 179 90.191 6.422 -6.405 1.00 17.85 C ATOM 1686 O ALA A 179 91.114 6.401 -7.228 1.00 21.44 O ATOM 1687 CB ALA A 179 91.421 7.273 -4.406 1.00 18.17 C ATOM 1688 H ALA A 179 88.953 6.988 -3.604 1.00 0.00 H ATOM 1689 N ARG A 180 89.176 5.558 -6.460 1.00 17.94 N ATOM 1690 CA ARG A 180 89.150 4.501 -7.470 1.00 19.23 C ATOM 1691 C ARG A 180 89.161 5.051 -8.894 1.00 19.61 C ATOM 1692 O ARG A 180 88.329 5.889 -9.262 1.00 22.75 O ATOM 1693 CB ARG A 180 87.918 3.612 -7.280 1.00 19.96 C ATOM 1694 CG ARG A 180 87.971 2.768 -6.032 1.00 21.36 C ATOM 1695 CD ARG A 180 88.995 1.642 -6.143 1.00 25.08 C ATOM 1696 NE ARG A 180 89.094 0.952 -4.858 1.00 26.76 N ATOM 1697 CZ ARG A 180 90.027 0.060 -4.545 1.00 26.74 C ATOM 1698 NH1 ARG A 180 90.974 -0.271 -5.422 1.00 23.39 N ATOM 1699 NH2 ARG A 180 90.007 -0.502 -3.344 1.00 29.42 N ATOM 1700 HE ARG A 180 88.381 1.176 -4.135 1.00 0.00 H ATOM 1701 HH12 ARG A 180 91.699 -0.971 -5.165 1.00 0.00 H ATOM 1702 HH11 ARG A 180 90.988 0.170 -6.364 1.00 0.00 H ATOM 1703 HH22 ARG A 180 90.731 -1.202 -3.085 1.00 0.00 H ATOM 1704 HH21 ARG A 180 89.267 -0.243 -2.661 1.00 0.00 H ATOM 1705 H ARG A 180 88.395 5.637 -5.778 1.00 0.00 H ATOM 1706 N ASN A 181 90.065 4.516 -9.714 1.00 20.01 N ATOM 1707 CA ASN A 181 90.172 4.892 -11.122 1.00 28.50 C ATOM 1708 C ASN A 181 89.086 4.236 -11.966 1.00 30.52 C ATOM 1709 O ASN A 181 88.305 3.419 -11.473 1.00 29.48 O ATOM 1710 CB ASN A 181 91.544 4.494 -11.689 1.00 39.97 C ATOM 1711 CG ASN A 181 92.690 5.188 -10.989 1.00 48.54 C ATOM 1712 OD1 ASN A 181 92.832 6.407 -11.067 1.00 48.19 O ATOM 1713 ND2 ASN A 181 93.531 4.409 -10.314 1.00 49.55 N ATOM 1714 OXT ASN A 181 88.989 4.484 -13.172 1.00 28.51 O ATOM 1715 HD22 ASN A 181 93.371 3.382 -10.275 1.00 0.00 H ATOM 1716 HD21 ASN A 181 94.348 4.827 -9.825 1.00 0.00 H ATOM 1717 H ASN A 181 90.721 3.802 -9.337 1.00 0.00 H TER 1718 ASN A 181 ATOM 1719 N PRO B 2 102.721 -3.919 -17.110 1.00 67.34 N ATOM 1720 CA PRO B 2 101.716 -3.224 -16.297 1.00 65.17 C ATOM 1721 C PRO B 2 102.285 -1.966 -15.646 1.00 67.74 C ATOM 1722 O PRO B 2 103.180 -2.072 -14.806 1.00 67.33 O ATOM 1723 CB PRO B 2 101.334 -4.265 -15.238 1.00 59.55 C ATOM 1724 CG PRO B 2 101.770 -5.581 -15.801 1.00 59.17 C ATOM 1725 CD PRO B 2 102.992 -5.277 -16.610 1.00 64.50 C ATOM 1726 HN2 PRO B 2 103.605 -3.372 -17.092 1.00 0.00 H ATOM 1727 HN1 PRO B 2 102.375 -3.984 -18.089 1.00 0.00 H ATOM 1728 N SER B 3 101.761 -0.797 -16.022 1.00 67.21 N ATOM 1729 CA SER B 3 102.332 0.482 -15.614 1.00 70.15 C ATOM 1730 C SER B 3 101.992 0.880 -14.181 1.00 73.37 C ATOM 1731 O SER B 3 102.458 1.931 -13.726 1.00 82.86 O ATOM 1732 CB SER B 3 101.873 1.586 -16.570 1.00 72.58 C ATOM 1733 OG SER B 3 102.405 1.382 -17.867 1.00 78.05 O ATOM 1734 HG SER B 3 102.096 2.106 -18.467 1.00 0.00 H ATOM 1735 H SER B 3 100.915 -0.798 -16.627 1.00 0.00 H ATOM 1736 N GLU B 4 101.197 0.089 -13.462 1.00 61.78 N ATOM 1737 CA GLU B 4 100.876 0.399 -12.075 1.00 54.63 C ATOM 1738 C GLU B 4 101.862 -0.221 -11.091 1.00 42.12 C ATOM 1739 O GLU B 4 102.026 0.305 -9.981 1.00 40.49 O ATOM 1740 CB GLU B 4 99.448 -0.065 -11.755 1.00 54.73 C ATOM 1741 CG GLU B 4 99.010 0.110 -10.300 1.00 62.42 C ATOM 1742 CD GLU B 4 98.577 1.525 -9.953 1.00 70.97 C ATOM 1743 OE1 GLU B 4 98.763 2.437 -10.786 1.00 78.99 O ATOM 1744 OE2 GLU B 4 98.040 1.723 -8.841 1.00 70.83 O ATOM 1745 H GLU B 4 100.798 -0.766 -13.899 1.00 0.00 H ATOM 1746 N LEU B 5 102.541 -1.292 -11.486 1.00 35.33 N ATOM 1747 CA LEU B 5 103.473 -1.988 -10.605 1.00 33.08 C ATOM 1748 C LEU B 5 104.716 -1.143 -10.338 1.00 36.18 C ATOM 1749 O LEU B 5 105.201 -0.427 -11.218 1.00 34.95 O ATOM 1750 CB LEU B 5 103.891 -3.322 -11.223 1.00 32.17 C ATOM 1751 CG LEU B 5 102.833 -4.393 -11.508 1.00 33.66 C ATOM 1752 CD1 LEU B 5 103.395 -5.495 -12.408 1.00 36.19 C ATOM 1753 CD2 LEU B 5 102.330 -4.998 -10.217 1.00 36.37 C ATOM 1754 H LEU B 5 102.404 -1.646 -12.454 1.00 0.00 H ATOM 1755 N THR B 6 105.236 -1.237 -9.114 1.00 28.20 N ATOM 1756 CA THR B 6 106.513 -0.625 -8.792 1.00 30.34 C ATOM 1757 C THR B 6 107.633 -1.413 -9.459 1.00 29.58 C ATOM 1758 O THR B 6 107.435 -2.558 -9.866 1.00 26.82 O ATOM 1759 CB THR B 6 106.752 -0.617 -7.287 1.00 29.82 C ATOM 1760 OG1 THR B 6 106.874 -1.970 -6.836 1.00 26.59 O ATOM 1761 CG2 THR B 6 105.610 0.058 -6.563 1.00 31.74 C ATOM 1762 HG1 THR B 6 107.030 -1.978 -5.858 1.00 0.00 H ATOM 1763 H THR B 6 104.718 -1.757 -8.377 1.00 0.00 H ATOM 1764 N PRO B 7 108.828 -0.826 -9.569 1.00 32.43 N ATOM 1765 CA PRO B 7 109.969 -1.609 -10.071 1.00 32.12 C ATOM 1766 C PRO B 7 110.218 -2.887 -9.285 1.00 29.00 C ATOM 1767 O PRO B 7 110.512 -3.928 -9.884 1.00 27.43 O ATOM 1768 CB PRO B 7 111.138 -0.622 -9.952 1.00 36.44 C ATOM 1769 CG PRO B 7 110.503 0.722 -10.091 1.00 39.53 C ATOM 1770 CD PRO B 7 109.169 0.602 -9.399 1.00 36.81 C ATOM 1771 N GLU B 8 110.093 -2.837 -7.958 1.00 31.92 N ATOM 1772 CA GLU B 8 110.287 -4.027 -7.135 1.00 30.77 C ATOM 1773 C GLU B 8 109.212 -5.072 -7.406 1.00 25.86 C ATOM 1774 O GLU B 8 109.507 -6.268 -7.478 1.00 25.05 O ATOM 1775 CB GLU B 8 110.297 -3.632 -5.658 1.00 43.01 C ATOM 1776 CG GLU B 8 110.906 -4.654 -4.714 1.00 59.33 C ATOM 1777 CD GLU B 8 111.271 -4.045 -3.367 1.00 73.05 C ATOM 1778 OE1 GLU B 8 111.241 -2.801 -3.249 1.00 76.79 O ATOM 1779 OE2 GLU B 8 111.586 -4.807 -2.428 1.00 77.53 O ATOM 1780 H GLU B 8 109.853 -1.934 -7.501 1.00 0.00 H ATOM 1781 N GLU B 9 107.959 -4.644 -7.547 1.00 22.48 N ATOM 1782 CA GLU B 9 106.903 -5.593 -7.881 1.00 20.03 C ATOM 1783 C GLU B 9 107.146 -6.228 -9.245 1.00 21.83 C ATOM 1784 O GLU B 9 107.006 -7.444 -9.400 1.00 21.37 O ATOM 1785 CB GLU B 9 105.537 -4.902 -7.837 1.00 20.21 C ATOM 1786 CG GLU B 9 105.001 -4.693 -6.433 1.00 20.90 C ATOM 1787 CD GLU B 9 103.867 -3.703 -6.396 1.00 22.06 C ATOM 1788 OE1 GLU B 9 103.674 -2.988 -7.402 1.00 25.50 O ATOM 1789 OE2 GLU B 9 103.181 -3.624 -5.354 1.00 21.65 O ATOM 1790 H GLU B 9 107.734 -3.637 -7.419 1.00 0.00 H ATOM 1791 N ARG B 10 107.538 -5.430 -10.244 1.00 21.82 N ATOM 1792 CA ARG B 10 107.812 -6.003 -11.561 1.00 20.97 C ATOM 1793 C ARG B 10 108.954 -7.001 -11.492 1.00 20.49 C ATOM 1794 O ARG B 10 108.893 -8.069 -12.114 1.00 24.12 O ATOM 1795 CB ARG B 10 108.132 -4.900 -12.572 1.00 31.49 C ATOM 1796 CG ARG B 10 106.984 -3.946 -12.842 1.00 37.25 C ATOM 1797 CD ARG B 10 107.182 -3.210 -14.155 1.00 45.75 C ATOM 1798 NE ARG B 10 108.528 -2.656 -14.278 1.00 54.33 N ATOM 1799 CZ ARG B 10 108.884 -1.451 -13.843 1.00 62.38 C ATOM 1800 NH1 ARG B 10 107.992 -0.668 -13.251 1.00 64.89 N ATOM 1801 NH2 ARG B 10 110.134 -1.028 -14.000 1.00 63.83 N ATOM 1802 HE ARG B 10 109.255 -3.242 -14.736 1.00 0.00 H ATOM 1803 HH12 ARG B 10 108.272 0.274 -12.911 1.00 0.00 H ATOM 1804 HH11 ARG B 10 107.013 -0.996 -13.127 1.00 0.00 H ATOM 1805 HH22 ARG B 10 110.411 -0.085 -13.659 1.00 0.00 H ATOM 1806 HH21 ARG B 10 110.836 -1.640 -14.464 1.00 0.00 H ATOM 1807 H ARG B 10 107.647 -4.408 -10.085 1.00 0.00 H ATOM 1808 N SER B 11 109.998 -6.680 -10.726 1.00 23.48 N ATOM 1809 CA SER B 11 111.126 -7.599 -10.593 1.00 24.65 C ATOM 1810 C SER B 11 110.695 -8.919 -9.965 1.00 24.21 C ATOM 1811 O SER B 11 111.086 -9.998 -10.435 1.00 25.73 O ATOM 1812 CB SER B 11 112.231 -6.952 -9.762 1.00 31.86 C ATOM 1813 OG SER B 11 113.304 -7.851 -9.557 1.00 37.65 O ATOM 1814 HG SER B 11 112.974 -8.653 -9.079 1.00 0.00 H ATOM 1815 H SER B 11 110.009 -5.771 -10.221 1.00 0.00 H ATOM 1816 N GLU B 12 109.901 -8.859 -8.896 1.00 22.14 N ATOM 1817 CA GLU B 12 109.490 -10.087 -8.224 1.00 19.22 C ATOM 1818 C GLU B 12 108.469 -10.875 -9.026 1.00 19.94 C ATOM 1819 O GLU B 12 108.265 -12.058 -8.738 1.00 24.00 O ATOM 1820 CB GLU B 12 108.924 -9.790 -6.835 1.00 22.67 C ATOM 1821 CG GLU B 12 109.958 -9.252 -5.864 1.00 28.12 C ATOM 1822 CD GLU B 12 109.396 -9.021 -4.474 1.00 41.39 C ATOM 1823 OE1 GLU B 12 108.520 -9.803 -4.043 1.00 38.23 O ATOM 1824 OE2 GLU B 12 109.832 -8.057 -3.811 1.00 41.70 O ATOM 1825 H GLU B 12 109.575 -7.937 -8.541 1.00 0.00 H ATOM 1826 N LEU B 13 107.804 -10.251 -9.998 1.00 19.95 N ATOM 1827 CA LEU B 13 106.789 -10.937 -10.789 1.00 15.04 C ATOM 1828 C LEU B 13 107.295 -11.417 -12.139 1.00 19.66 C ATOM 1829 O LEU B 13 106.544 -12.086 -12.857 1.00 19.70 O ATOM 1830 CB LEU B 13 105.568 -10.034 -10.994 1.00 16.67 C ATOM 1831 CG LEU B 13 104.799 -9.708 -9.715 1.00 21.74 C ATOM 1832 CD1 LEU B 13 103.798 -8.585 -9.965 1.00 21.40 C ATOM 1833 CD2 LEU B 13 104.099 -10.958 -9.191 1.00 26.68 C ATOM 1834 H LEU B 13 108.014 -9.252 -10.197 1.00 0.00 H ATOM 1835 N LYS B 14 108.539 -11.099 -12.503 1.00 18.78 N ATOM 1836 CA LYS B 14 109.076 -11.513 -13.795 1.00 18.93 C ATOM 1837 C LYS B 14 108.913 -13.011 -14.010 1.00 20.26 C ATOM 1838 O LYS B 14 108.483 -13.454 -15.082 1.00 20.54 O ATOM 1839 CB LYS B 14 110.552 -11.124 -13.895 1.00 25.26 C ATOM 1840 CG LYS B 14 110.802 -9.731 -14.444 1.00 39.18 C ATOM 1841 CD LYS B 14 112.253 -9.565 -14.885 1.00 44.50 C ATOM 1842 CE LYS B 14 112.446 -8.267 -15.660 1.00 53.80 C ATOM 1843 NZ LYS B 14 113.800 -8.170 -16.282 1.00 53.13 N ATOM 1844 HZ1 LYS B 14 114.526 -8.211 -15.538 1.00 0.00 H ATOM 1845 HZ2 LYS B 14 113.934 -8.962 -16.943 1.00 0.00 H ATOM 1846 HZ3 LYS B 14 113.880 -7.270 -16.797 1.00 0.00 H ATOM 1847 H LYS B 14 109.136 -10.547 -11.855 1.00 0.00 H ATOM 1848 N ASN B 15 109.268 -13.804 -12.995 1.00 17.17 N ATOM 1849 CA ASN B 15 109.131 -15.257 -13.090 1.00 15.37 C ATOM 1850 C ASN B 15 107.688 -15.653 -13.385 1.00 19.48 C ATOM 1851 O ASN B 15 107.419 -16.405 -14.327 1.00 18.78 O ATOM 1852 CB ASN B 15 109.618 -15.907 -11.792 1.00 16.58 C ATOM 1853 CG ASN B 15 111.118 -16.183 -11.785 1.00 20.37 C ATOM 1854 OD1 ASN B 15 111.730 -16.385 -12.835 1.00 24.78 O ATOM 1855 ND2 ASN B 15 111.715 -16.205 -10.591 1.00 20.71 N ATOM 1856 HD22 ASN B 15 111.160 -16.029 -9.729 1.00 0.00 H ATOM 1857 HD21 ASN B 15 112.735 -16.398 -10.523 1.00 0.00 H ATOM 1858 H ASN B 15 109.648 -13.381 -12.124 1.00 0.00 H ATOM 1859 N SER B 16 106.737 -15.132 -12.602 1.00 16.60 N ATOM 1860 CA SER B 16 105.341 -15.520 -12.790 1.00 16.36 C ATOM 1861 C SER B 16 104.818 -15.113 -14.165 1.00 18.89 C ATOM 1862 O SER B 16 103.993 -15.820 -14.761 1.00 19.08 O ATOM 1863 CB SER B 16 104.471 -14.896 -11.698 1.00 14.92 C ATOM 1864 OG SER B 16 104.728 -15.473 -10.438 1.00 18.19 O ATOM 1865 HG SER B 16 105.679 -15.333 -10.200 1.00 0.00 H ATOM 1866 H SER B 16 106.991 -14.450 -11.859 1.00 0.00 H ATOM 1867 N ILE B 17 105.251 -13.960 -14.672 1.00 15.02 N ATOM 1868 CA ILE B 17 104.798 -13.537 -15.990 1.00 18.44 C ATOM 1869 C ILE B 17 105.304 -14.502 -17.052 1.00 23.74 C ATOM 1870 O ILE B 17 104.554 -14.904 -17.951 1.00 23.57 O ATOM 1871 CB ILE B 17 105.238 -12.085 -16.267 1.00 21.09 C ATOM 1872 CG1 ILE B 17 104.446 -11.142 -15.358 1.00 20.47 C ATOM 1873 CG2 ILE B 17 105.058 -11.744 -17.752 1.00 22.09 C ATOM 1874 CD1 ILE B 17 104.999 -9.749 -15.252 1.00 20.60 C ATOM 1875 H ILE B 17 105.909 -13.365 -14.130 1.00 0.00 H ATOM 1876 N ALA B 18 106.573 -14.910 -16.946 1.00 18.20 N ATOM 1877 CA ALA B 18 107.136 -15.867 -17.898 1.00 20.15 C ATOM 1878 C ALA B 18 106.465 -17.226 -17.775 1.00 23.05 C ATOM 1879 O ALA B 18 106.262 -17.923 -18.781 1.00 24.33 O ATOM 1880 CB ALA B 18 108.644 -15.998 -17.680 1.00 20.27 C ATOM 1881 H ALA B 18 107.168 -14.542 -16.176 1.00 0.00 H ATOM 1882 N GLU B 19 106.110 -17.614 -16.549 1.00 19.40 N ATOM 1883 CA GLU B 19 105.606 -18.955 -16.282 1.00 17.51 C ATOM 1884 C GLU B 19 104.152 -19.117 -16.701 1.00 20.76 C ATOM 1885 O GLU B 19 103.780 -20.155 -17.264 1.00 25.94 O ATOM 1886 CB GLU B 19 105.765 -19.280 -14.789 1.00 19.31 C ATOM 1887 CG GLU B 19 107.219 -19.446 -14.370 1.00 17.28 C ATOM 1888 CD GLU B 19 107.463 -19.214 -12.886 1.00 18.98 C ATOM 1889 OE1 GLU B 19 106.556 -18.724 -12.183 1.00 17.95 O ATOM 1890 OE2 GLU B 19 108.578 -19.522 -12.410 1.00 19.92 O ATOM 1891 H GLU B 19 106.195 -16.940 -15.761 1.00 0.00 H ATOM 1892 N PHE B 20 103.308 -18.105 -16.453 1.00 18.07 N ATOM 1893 CA PHE B 20 101.877 -18.285 -16.608 1.00 17.84 C ATOM 1894 C PHE B 20 101.210 -17.332 -17.592 1.00 19.81 C ATOM 1895 O PHE B 20 100.035 -17.550 -17.921 1.00 20.79 O ATOM 1896 CB PHE B 20 101.180 -18.152 -15.245 1.00 19.64 C ATOM 1897 CG PHE B 20 101.803 -19.001 -14.164 1.00 18.94 C ATOM 1898 CD1 PHE B 20 101.689 -20.384 -14.202 1.00 22.64 C ATOM 1899 CD2 PHE B 20 102.496 -18.408 -13.108 1.00 18.64 C ATOM 1900 CE1 PHE B 20 102.261 -21.167 -13.210 1.00 21.84 C ATOM 1901 CE2 PHE B 20 103.070 -19.177 -12.113 1.00 19.87 C ATOM 1902 CZ PHE B 20 102.958 -20.559 -12.161 1.00 18.89 C ATOM 1903 H PHE B 20 103.682 -17.184 -16.147 1.00 0.00 H ATOM 1904 N HIS B 21 101.897 -16.279 -18.045 1.00 22.60 N ATOM 1905 CA HIS B 21 101.238 -15.203 -18.779 1.00 23.42 C ATOM 1906 C HIS B 21 101.902 -14.902 -20.116 1.00 24.17 C ATOM 1907 O HIS B 21 101.773 -13.785 -20.622 1.00 26.11 O ATOM 1908 CB HIS B 21 101.181 -13.933 -17.923 1.00 20.13 C ATOM 1909 CG HIS B 21 100.352 -14.081 -16.690 1.00 19.29 C ATOM 1910 ND1 HIS B 21 98.968 -14.074 -16.712 1.00 18.88 N ATOM 1911 CD2 HIS B 21 100.702 -14.260 -15.394 1.00 17.32 C ATOM 1912 CE1 HIS B 21 98.509 -14.249 -15.490 1.00 17.55 C ATOM 1913 NE2 HIS B 21 99.543 -14.349 -14.665 1.00 17.15 N ATOM 1914 H HIS B 21 102.921 -16.225 -17.871 1.00 0.00 H ATOM 1915 N THR B 22 102.604 -15.867 -20.702 1.00 26.24 N ATOM 1916 CA THR B 22 103.251 -15.707 -21.998 1.00 28.40 C ATOM 1917 C THR B 22 102.607 -16.667 -22.988 1.00 31.00 C ATOM 1918 O THR B 22 102.422 -17.847 -22.675 1.00 39.66 O ATOM 1919 CB THR B 22 104.757 -15.966 -21.881 1.00 32.08 C ATOM 1920 OG1 THR B 22 105.306 -15.085 -20.889 1.00 31.24 O ATOM 1921 CG2 THR B 22 105.451 -15.720 -23.208 1.00 31.65 C ATOM 1922 HG1 THR B 22 104.868 -15.257 -20.018 1.00 0.00 H ATOM 1923 H THR B 22 102.696 -16.780 -20.212 1.00 0.00 H ATOM 1924 N TYR B 23 102.270 -16.168 -24.172 1.00 32.45 N ATOM 1925 CA TYR B 23 101.485 -16.934 -25.131 1.00 35.02 C ATOM 1926 C TYR B 23 102.218 -17.113 -26.451 1.00 47.31 C ATOM 1927 O TYR B 23 102.954 -16.225 -26.885 1.00 42.46 O ATOM 1928 CB TYR B 23 100.144 -16.247 -25.386 1.00 38.54 C ATOM 1929 CG TYR B 23 99.317 -16.070 -24.134 1.00 35.51 C ATOM 1930 CD1 TYR B 23 98.458 -17.074 -23.712 1.00 40.05 C ATOM 1931 CD2 TYR B 23 99.401 -14.910 -23.369 1.00 32.30 C ATOM 1932 CE1 TYR B 23 97.700 -16.932 -22.574 1.00 41.78 C ATOM 1933 CE2 TYR B 23 98.641 -14.755 -22.218 1.00 29.91 C ATOM 1934 CZ TYR B 23 97.793 -15.775 -21.830 1.00 33.04 C ATOM 1935 OH TYR B 23 97.024 -15.664 -20.701 1.00 29.56 O ATOM 1936 HH TYR B 23 97.612 -15.541 -19.914 1.00 0.00 H ATOM 1937 H TYR B 23 102.574 -15.205 -24.421 1.00 0.00 H ATOM 1938 N GLN B 24 102.015 -18.285 -27.064 1.00 46.72 N ATOM 1939 CA GLN B 24 102.298 -18.533 -28.477 1.00 54.68 C ATOM 1940 C GLN B 24 101.037 -18.155 -29.242 1.00 55.16 C ATOM 1941 O GLN B 24 100.086 -18.938 -29.321 1.00 61.34 O ATOM 1942 CB GLN B 24 102.680 -19.993 -28.706 1.00 52.56 C ATOM 1943 CG GLN B 24 102.653 -20.453 -30.159 1.00 59.01 C ATOM 1944 CD GLN B 24 103.828 -19.942 -30.956 1.00 64.04 C ATOM 1945 OE1 GLN B 24 104.929 -19.790 -30.429 1.00 67.29 O ATOM 1946 NE2 GLN B 24 103.603 -19.674 -32.239 1.00 71.54 N ATOM 1947 HE22 GLN B 24 102.655 -19.818 -32.642 1.00 0.00 H ATOM 1948 HE21 GLN B 24 104.375 -19.321 -32.840 1.00 0.00 H ATOM 1949 H GLN B 24 101.631 -19.070 -26.499 1.00 0.00 H ATOM 1950 N LEU B 25 101.016 -16.942 -29.785 1.00 47.37 N ATOM 1951 CA LEU B 25 99.796 -16.389 -30.361 1.00 52.93 C ATOM 1952 C LEU B 25 99.353 -17.189 -31.583 1.00 58.86 C ATOM 1953 O LEU B 25 100.121 -17.366 -32.534 1.00 60.52 O ATOM 1954 CB LEU B 25 100.012 -14.923 -30.727 1.00 57.83 C ATOM 1955 CG LEU B 25 100.164 -13.966 -29.543 1.00 56.07 C ATOM 1956 CD1 LEU B 25 100.230 -12.522 -30.010 1.00 56.31 C ATOM 1957 CD2 LEU B 25 99.022 -14.157 -28.559 1.00 56.07 C ATOM 1958 H LEU B 25 101.888 -16.375 -29.799 1.00 0.00 H ATOM 1959 N ASP B 26 98.113 -17.676 -31.550 1.00 55.30 N ATOM 1960 CA ASP B 26 97.510 -18.303 -32.713 1.00 64.44 C ATOM 1961 C ASP B 26 97.218 -17.250 -33.781 1.00 61.09 C ATOM 1962 O ASP B 26 97.144 -16.055 -33.483 1.00 60.61 O ATOM 1963 CB ASP B 26 96.223 -19.026 -32.320 1.00 69.09 C ATOM 1964 CG ASP B 26 96.483 -20.327 -31.584 1.00 74.95 C ATOM 1965 OD1 ASP B 26 97.514 -20.975 -31.863 1.00 79.00 O ATOM 1966 OD2 ASP B 26 95.654 -20.703 -30.730 1.00 76.79 O ATOM 1967 H ASP B 26 97.564 -17.605 -30.670 1.00 0.00 H ATOM 1968 N PRO B 27 97.059 -17.672 -35.048 1.00 62.87 N ATOM 1969 CA PRO B 27 96.772 -16.704 -36.118 1.00 61.96 C ATOM 1970 C PRO B 27 95.585 -15.787 -35.836 1.00 67.96 C ATOM 1971 O PRO B 27 94.471 -16.252 -35.569 1.00 70.18 O ATOM 1972 CB PRO B 27 96.509 -17.606 -37.330 1.00 65.60 C ATOM 1973 CG PRO B 27 97.373 -18.796 -37.077 1.00 66.73 C ATOM 1974 CD PRO B 27 97.342 -19.016 -35.585 1.00 62.84 C ATOM 1975 N GLY B 28 95.835 -14.474 -35.870 1.00 64.14 N ATOM 1976 CA GLY B 28 94.800 -13.455 -35.801 1.00 56.22 C ATOM 1977 C GLY B 28 94.265 -13.167 -34.412 1.00 52.49 C ATOM 1978 O GLY B 28 93.070 -13.331 -34.160 1.00 52.65 O ATOM 1979 H GLY B 28 96.825 -14.164 -35.950 1.00 0.00 H ATOM 1980 N SER B 29 95.121 -12.695 -33.512 1.00 49.38 N ATOM 1981 CA SER B 29 94.763 -12.672 -32.103 1.00 47.91 C ATOM 1982 C SER B 29 95.123 -11.327 -31.488 1.00 50.12 C ATOM 1983 O SER B 29 95.489 -10.364 -32.169 1.00 58.41 O ATOM 1984 CB SER B 29 95.442 -13.826 -31.358 1.00 45.18 C ATOM 1985 OG SER B 29 94.849 -15.050 -31.727 1.00 50.88 O ATOM 1986 HG SER B 29 94.952 -15.185 -32.702 1.00 0.00 H ATOM 1987 H SER B 29 96.050 -12.341 -33.816 1.00 0.00 H ATOM 1988 N CYS B 30 95.031 -11.295 -30.166 1.00 44.54 N ATOM 1989 CA CYS B 30 95.038 -10.083 -29.369 1.00 39.32 C ATOM 1990 C CYS B 30 95.218 -10.531 -27.928 1.00 35.78 C ATOM 1991 O CYS B 30 94.459 -11.377 -27.449 1.00 37.62 O ATOM 1992 CB CYS B 30 93.733 -9.310 -29.573 1.00 52.22 C ATOM 1993 SG CYS B 30 93.399 -7.956 -28.439 1.00 69.16 S ATOM 1994 H CYS B 30 94.948 -12.203 -29.665 1.00 0.00 H ATOM 1995 N SER B 31 96.235 -10.019 -27.243 1.00 33.16 N ATOM 1996 CA SER B 31 96.497 -10.440 -25.875 1.00 30.71 C ATOM 1997 C SER B 31 96.987 -9.261 -25.053 1.00 33.82 C ATOM 1998 O SER B 31 97.627 -8.342 -25.571 1.00 35.74 O ATOM 1999 CB SER B 31 97.527 -11.571 -25.817 1.00 32.23 C ATOM 2000 OG SER B 31 97.879 -11.872 -24.481 1.00 35.78 O ATOM 2001 HG SER B 31 97.071 -12.154 -23.983 1.00 0.00 H ATOM 2002 H SER B 31 96.851 -9.310 -27.690 1.00 0.00 H ATOM 2003 N SER B 32 96.689 -9.305 -23.755 1.00 26.46 N ATOM 2004 CA SER B 32 97.092 -8.237 -22.857 1.00 24.62 C ATOM 2005 C SER B 32 97.226 -8.789 -21.449 1.00 22.59 C ATOM 2006 O SER B 32 96.566 -9.770 -21.086 1.00 22.56 O ATOM 2007 CB SER B 32 96.092 -7.073 -22.879 1.00 33.91 C ATOM 2008 OG SER B 32 96.052 -6.482 -24.169 1.00 38.64 O ATOM 2009 HG SER B 32 95.773 -7.161 -24.833 1.00 0.00 H ATOM 2010 H SER B 32 96.159 -10.117 -23.379 1.00 0.00 H ATOM 2011 N LEU B 33 98.079 -8.138 -20.658 1.00 21.16 N ATOM 2012 CA LEU B 33 98.303 -8.464 -19.256 1.00 20.12 C ATOM 2013 C LEU B 33 97.932 -7.250 -18.417 1.00 19.85 C ATOM 2014 O LEU B 33 98.308 -6.124 -18.764 1.00 21.38 O ATOM 2015 CB LEU B 33 99.772 -8.843 -19.013 1.00 20.35 C ATOM 2016 CG LEU B 33 100.219 -9.026 -17.561 1.00 19.28 C ATOM 2017 CD1 LEU B 33 99.574 -10.259 -16.972 1.00 18.01 C ATOM 2018 CD2 LEU B 33 101.732 -9.143 -17.491 1.00 24.75 C ATOM 2019 H LEU B 33 98.618 -7.348 -21.067 1.00 0.00 H ATOM 2020 N HIS B 34 97.171 -7.472 -17.342 1.00 19.58 N ATOM 2021 CA HIS B 34 96.761 -6.423 -16.415 1.00 19.11 C ATOM 2022 C HIS B 34 97.143 -6.803 -14.994 1.00 19.53 C ATOM 2023 O HIS B 34 97.152 -7.980 -14.637 1.00 19.11 O ATOM 2024 CB HIS B 34 95.252 -6.182 -16.492 1.00 19.37 C ATOM 2025 CG HIS B 34 94.804 -5.692 -17.828 1.00 23.73 C ATOM 2026 ND1 HIS B 34 94.750 -4.352 -18.143 1.00 33.83 N ATOM 2027 CD2 HIS B 34 94.443 -6.358 -18.949 1.00 28.77 C ATOM 2028 CE1 HIS B 34 94.350 -4.213 -19.394 1.00 33.44 C ATOM 2029 NE2 HIS B 34 94.154 -5.415 -19.905 1.00 34.41 N ATOM 2030 H HIS B 34 96.854 -8.445 -17.156 1.00 0.00 H ATOM 2031 N ALA B 35 97.456 -5.792 -14.181 1.00 17.96 N ATOM 2032 CA ALA B 35 97.845 -6.012 -12.795 1.00 15.19 C ATOM 2033 C ALA B 35 96.960 -5.192 -11.878 1.00 15.74 C ATOM 2034 O ALA B 35 96.481 -4.118 -12.260 1.00 19.42 O ATOM 2035 CB ALA B 35 99.311 -5.627 -12.547 1.00 17.48 C ATOM 2036 H ALA B 35 97.421 -4.819 -14.548 1.00 0.00 H ATOM 2037 N GLN B 36 96.757 -5.701 -10.665 1.00 15.27 N ATOM 2038 CA GLN B 36 95.989 -4.983 -9.649 1.00 17.29 C ATOM 2039 C GLN B 36 96.626 -5.211 -8.288 1.00 14.20 C ATOM 2040 O GLN B 36 96.732 -6.352 -7.833 1.00 17.11 O ATOM 2041 CB GLN B 36 94.529 -5.443 -9.640 1.00 16.52 C ATOM 2042 CG GLN B 36 93.666 -4.818 -8.528 1.00 16.40 C ATOM 2043 CD GLN B 36 93.349 -3.354 -8.797 1.00 22.89 C ATOM 2044 OE1 GLN B 36 92.886 -2.999 -9.879 1.00 23.82 O ATOM 2045 NE2 GLN B 36 93.584 -2.501 -7.806 1.00 22.40 N ATOM 2046 HE22 GLN B 36 93.977 -2.845 -6.906 1.00 0.00 H ATOM 2047 HE21 GLN B 36 93.375 -1.490 -7.930 1.00 0.00 H ATOM 2048 H GLN B 36 97.155 -6.634 -10.434 1.00 0.00 H ATOM 2049 N ARG B 37 97.032 -4.121 -7.636 1.00 15.60 N ATOM 2050 CA ARG B 37 97.484 -4.199 -6.253 1.00 14.84 C ATOM 2051 C ARG B 37 96.278 -4.235 -5.331 1.00 14.84 C ATOM 2052 O ARG B 37 95.317 -3.484 -5.522 1.00 15.29 O ATOM 2053 CB ARG B 37 98.374 -3.004 -5.891 1.00 15.44 C ATOM 2054 CG ARG B 37 99.072 -3.168 -4.532 1.00 15.26 C ATOM 2055 CD ARG B 37 100.077 -2.046 -4.261 1.00 17.10 C ATOM 2056 NE ARG B 37 101.046 -1.880 -5.346 1.00 17.24 N ATOM 2057 CZ ARG B 37 101.044 -0.867 -6.205 1.00 18.94 C ATOM 2058 NH1 ARG B 37 100.154 0.121 -6.092 1.00 28.19 N ATOM 2059 NH2 ARG B 37 101.952 -0.817 -7.174 1.00 22.65 N ATOM 2060 HE ARG B 37 101.785 -2.604 -5.451 1.00 0.00 H ATOM 2061 HH12 ARG B 37 100.163 0.909 -6.771 1.00 0.00 H ATOM 2062 HH11 ARG B 37 99.452 0.103 -5.325 1.00 0.00 H ATOM 2063 HH22 ARG B 37 101.951 -0.024 -7.847 1.00 0.00 H ATOM 2064 HH21 ARG B 37 102.663 -1.571 -7.259 1.00 0.00 H ATOM 2065 H ARG B 37 97.026 -3.201 -8.122 1.00 0.00 H ATOM 2066 N ILE B 38 96.323 -5.125 -4.337 1.00 13.53 N ATOM 2067 CA ILE B 38 95.219 -5.301 -3.401 1.00 12.63 C ATOM 2068 C ILE B 38 95.780 -5.300 -1.991 1.00 14.73 C ATOM 2069 O ILE B 38 96.700 -6.068 -1.679 1.00 16.06 O ATOM 2070 CB ILE B 38 94.428 -6.596 -3.666 1.00 13.32 C ATOM 2071 CG1 ILE B 38 93.946 -6.617 -5.118 1.00 14.97 C ATOM 2072 CG2 ILE B 38 93.256 -6.722 -2.697 1.00 15.11 C ATOM 2073 CD1 ILE B 38 93.070 -7.809 -5.447 1.00 15.93 C ATOM 2074 H ILE B 38 97.174 -5.712 -4.227 1.00 0.00 H ATOM 2075 N HIS B 39 95.223 -4.450 -1.135 1.00 14.15 N ATOM 2076 CA HIS B 39 95.737 -4.294 0.219 1.00 15.50 C ATOM 2077 C HIS B 39 94.970 -5.231 1.147 1.00 17.90 C ATOM 2078 O HIS B 39 94.178 -4.834 2.000 1.00 17.95 O ATOM 2079 CB HIS B 39 95.661 -2.833 0.634 1.00 15.99 C ATOM 2080 CG HIS B 39 96.402 -1.948 -0.317 1.00 17.96 C ATOM 2081 ND1 HIS B 39 97.777 -1.901 -0.351 1.00 21.68 N ATOM 2082 CD2 HIS B 39 95.968 -1.151 -1.321 1.00 19.26 C ATOM 2083 CE1 HIS B 39 98.162 -1.079 -1.313 1.00 20.11 C ATOM 2084 NE2 HIS B 39 97.085 -0.618 -1.920 1.00 21.86 N ATOM 2085 H HIS B 39 94.404 -3.885 -1.438 1.00 0.00 H ATOM 2086 N ALA B 40 95.233 -6.517 0.935 1.00 17.22 N ATOM 2087 CA ALA B 40 94.612 -7.599 1.684 1.00 14.80 C ATOM 2088 C ALA B 40 95.519 -8.811 1.576 1.00 15.58 C ATOM 2089 O ALA B 40 96.386 -8.862 0.693 1.00 16.80 O ATOM 2090 CB ALA B 40 93.213 -7.920 1.129 1.00 17.66 C ATOM 2091 H ALA B 40 95.920 -6.763 0.194 1.00 0.00 H ATOM 2092 N PRO B 41 95.351 -9.811 2.437 1.00 14.92 N ATOM 2093 CA PRO B 41 96.233 -10.977 2.384 1.00 16.64 C ATOM 2094 C PRO B 41 95.980 -11.802 1.130 1.00 16.00 C ATOM 2095 O PRO B 41 94.833 -11.948 0.688 1.00 14.86 O ATOM 2096 CB PRO B 41 95.859 -11.767 3.649 1.00 19.98 C ATOM 2097 CG PRO B 41 95.171 -10.796 4.528 1.00 21.90 C ATOM 2098 CD PRO B 41 94.467 -9.849 3.617 1.00 17.59 C ATOM 2099 N PRO B 42 97.028 -12.358 0.528 1.00 15.01 N ATOM 2100 CA PRO B 42 96.814 -13.140 -0.697 1.00 14.83 C ATOM 2101 C PRO B 42 95.934 -14.361 -0.505 1.00 16.04 C ATOM 2102 O PRO B 42 95.237 -14.755 -1.453 1.00 16.46 O ATOM 2103 CB PRO B 42 98.241 -13.520 -1.134 1.00 20.25 C ATOM 2104 CG PRO B 42 99.078 -13.354 0.070 1.00 19.43 C ATOM 2105 CD PRO B 42 98.454 -12.243 0.879 1.00 18.70 C ATOM 2106 N GLU B 43 95.929 -14.970 0.686 1.00 16.17 N ATOM 2107 CA GLU B 43 95.052 -16.123 0.873 1.00 20.50 C ATOM 2108 C GLU B 43 93.593 -15.708 0.780 1.00 17.88 C ATOM 2109 O GLU B 43 92.764 -16.462 0.259 1.00 17.34 O ATOM 2110 CB GLU B 43 95.335 -16.809 2.211 1.00 22.92 C ATOM 2111 CG GLU B 43 95.196 -15.924 3.434 1.00 37.98 C ATOM 2112 CD GLU B 43 96.508 -15.274 3.853 1.00 48.95 C ATOM 2113 OE1 GLU B 43 97.359 -15.001 2.975 1.00 36.81 O ATOM 2114 OE2 GLU B 43 96.684 -15.040 5.070 1.00 52.78 O ATOM 2115 H GLU B 43 96.535 -14.631 1.460 1.00 0.00 H ATOM 2116 N LEU B 44 93.274 -14.493 1.240 1.00 14.85 N ATOM 2117 CA LEU B 44 91.906 -13.997 1.142 1.00 16.41 C ATOM 2118 C LEU B 44 91.544 -13.708 -0.309 1.00 16.16 C ATOM 2119 O LEU B 44 90.482 -14.119 -0.795 1.00 16.52 O ATOM 2120 CB LEU B 44 91.753 -12.737 2.003 1.00 17.47 C ATOM 2121 CG LEU B 44 90.395 -12.032 2.007 1.00 18.57 C ATOM 2122 CD1 LEU B 44 89.270 -12.992 2.333 1.00 23.47 C ATOM 2123 CD2 LEU B 44 90.432 -10.905 3.026 1.00 23.47 C ATOM 2124 H LEU B 44 94.008 -13.896 1.672 1.00 0.00 H ATOM 2125 N VAL B 45 92.438 -13.021 -1.021 1.00 13.79 N ATOM 2126 CA VAL B 45 92.207 -12.713 -2.430 1.00 13.10 C ATOM 2127 C VAL B 45 91.984 -13.992 -3.221 1.00 13.32 C ATOM 2128 O VAL B 45 91.037 -14.096 -4.010 1.00 15.79 O ATOM 2129 CB VAL B 45 93.382 -11.902 -2.998 1.00 12.97 C ATOM 2130 CG1 VAL B 45 93.167 -11.689 -4.498 1.00 16.36 C ATOM 2131 CG2 VAL B 45 93.491 -10.557 -2.281 1.00 15.89 C ATOM 2132 H VAL B 45 93.315 -12.699 -0.565 1.00 0.00 H ATOM 2133 N TRP B 46 92.815 -15.008 -2.972 1.00 13.83 N ATOM 2134 CA TRP B 46 92.671 -16.269 -3.688 1.00 14.23 C ATOM 2135 C TRP B 46 91.338 -16.942 -3.369 1.00 15.23 C ATOM 2136 O TRP B 46 90.681 -17.489 -4.266 1.00 16.04 O ATOM 2137 CB TRP B 46 93.846 -17.189 -3.340 1.00 14.94 C ATOM 2138 CG TRP B 46 93.748 -18.524 -4.010 1.00 15.54 C ATOM 2139 CD1 TRP B 46 93.550 -19.734 -3.405 1.00 16.38 C ATOM 2140 CD2 TRP B 46 93.783 -18.784 -5.425 1.00 17.26 C ATOM 2141 NE1 TRP B 46 93.479 -20.730 -4.352 1.00 17.58 N ATOM 2142 CE2 TRP B 46 93.625 -20.176 -5.596 1.00 17.05 C ATOM 2143 CE3 TRP B 46 93.950 -17.977 -6.557 1.00 15.28 C ATOM 2144 CZ2 TRP B 46 93.616 -20.780 -6.850 1.00 18.12 C ATOM 2145 CZ3 TRP B 46 93.937 -18.578 -7.809 1.00 15.36 C ATOM 2146 CH2 TRP B 46 93.776 -19.968 -7.943 1.00 16.73 C ATOM 2147 HE1 TRP B 46 93.337 -21.741 -4.155 1.00 0.00 H ATOM 2148 H TRP B 46 93.568 -14.898 -2.264 1.00 0.00 H ATOM 2149 N SER B 47 90.913 -16.907 -2.101 1.00 14.75 N ATOM 2150 CA SER B 47 89.659 -17.569 -1.739 1.00 15.41 C ATOM 2151 C SER B 47 88.476 -16.981 -2.504 1.00 16.31 C ATOM 2152 O SER B 47 87.479 -17.677 -2.741 1.00 17.08 O ATOM 2153 CB SER B 47 89.428 -17.466 -0.230 1.00 18.40 C ATOM 2154 OG SER B 47 89.098 -16.139 0.142 1.00 22.90 O ATOM 2155 HG SER B 47 89.840 -15.533 -0.109 1.00 0.00 H ATOM 2156 H SER B 47 91.471 -16.412 -1.376 1.00 0.00 H ATOM 2157 N ILE B 48 88.570 -15.713 -2.898 1.00 15.17 N ATOM 2158 CA ILE B 48 87.493 -15.077 -3.653 1.00 13.72 C ATOM 2159 C ILE B 48 87.565 -15.460 -5.122 1.00 16.23 C ATOM 2160 O ILE B 48 86.590 -15.943 -5.713 1.00 18.51 O ATOM 2161 CB ILE B 48 87.552 -13.547 -3.492 1.00 15.84 C ATOM 2162 CG1 ILE B 48 87.385 -13.125 -2.029 1.00 17.36 C ATOM 2163 CG2 ILE B 48 86.490 -12.904 -4.358 1.00 16.40 C ATOM 2164 CD1 ILE B 48 87.947 -11.720 -1.782 1.00 18.90 C ATOM 2165 H ILE B 48 89.424 -15.166 -2.665 1.00 0.00 H ATOM 2166 N VAL B 49 88.729 -15.255 -5.740 1.00 13.75 N ATOM 2167 CA VAL B 49 88.814 -15.350 -7.190 1.00 16.53 C ATOM 2168 C VAL B 49 88.805 -16.801 -7.667 1.00 16.07 C ATOM 2169 O VAL B 49 88.503 -17.060 -8.839 1.00 19.61 O ATOM 2170 CB VAL B 49 90.054 -14.564 -7.654 1.00 21.91 C ATOM 2171 CG1 VAL B 49 91.341 -15.366 -7.432 1.00 18.11 C ATOM 2172 CG2 VAL B 49 89.896 -14.109 -9.095 1.00 25.68 C ATOM 2173 H VAL B 49 89.578 -15.027 -5.184 1.00 0.00 H ATOM 2174 N ARG B 50 89.111 -17.764 -6.793 1.00 14.54 N ATOM 2175 CA ARG B 50 89.100 -19.157 -7.227 1.00 14.96 C ATOM 2176 C ARG B 50 87.691 -19.710 -7.402 1.00 19.14 C ATOM 2177 O ARG B 50 87.544 -20.816 -7.919 1.00 20.87 O ATOM 2178 CB ARG B 50 89.856 -20.044 -6.225 1.00 16.94 C ATOM 2179 CG ARG B 50 89.140 -20.184 -4.866 1.00 18.84 C ATOM 2180 CD ARG B 50 89.926 -21.032 -3.849 1.00 19.20 C ATOM 2181 NE ARG B 50 90.051 -22.437 -4.236 1.00 17.79 N ATOM 2182 CZ ARG B 50 89.096 -23.343 -4.047 1.00 22.95 C ATOM 2183 NH1 ARG B 50 87.943 -22.974 -3.491 1.00 20.44 N ATOM 2184 NH2 ARG B 50 89.284 -24.609 -4.417 1.00 20.85 N ATOM 2185 HE ARG B 50 90.937 -22.745 -4.685 1.00 0.00 H ATOM 2186 HH12 ARG B 50 87.191 -23.676 -3.339 1.00 0.00 H ATOM 2187 HH11 ARG B 50 87.795 -21.984 -3.208 1.00 0.00 H ATOM 2188 HH22 ARG B 50 88.533 -25.312 -4.266 1.00 0.00 H ATOM 2189 HH21 ARG B 50 90.182 -24.894 -4.857 1.00 0.00 H ATOM 2190 H ARG B 50 89.355 -17.523 -5.811 1.00 0.00 H ATOM 2191 N ARG B 51 86.658 -18.981 -6.981 1.00 18.01 N ATOM 2192 CA ARG B 51 85.296 -19.514 -7.017 1.00 20.81 C ATOM 2193 C ARG B 51 84.739 -19.352 -8.425 1.00 17.03 C ATOM 2194 O ARG B 51 84.054 -18.378 -8.750 1.00 17.19 O ATOM 2195 CB ARG B 51 84.423 -18.823 -5.978 1.00 19.22 C ATOM 2196 CG ARG B 51 84.670 -19.332 -4.564 1.00 20.02 C ATOM 2197 CD ARG B 51 84.370 -20.832 -4.410 1.00 27.78 C ATOM 2198 NE ARG B 51 82.974 -21.186 -4.683 1.00 28.11 N ATOM 2199 CZ ARG B 51 82.004 -21.194 -3.771 1.00 33.60 C ATOM 2200 NH1 ARG B 51 82.265 -20.869 -2.510 1.00 34.80 N ATOM 2201 NH2 ARG B 51 80.767 -21.538 -4.115 1.00 31.84 N ATOM 2202 HE ARG B 51 82.724 -21.449 -5.657 1.00 0.00 H ATOM 2203 HH12 ARG B 51 81.503 -20.877 -1.802 1.00 0.00 H ATOM 2204 HH11 ARG B 51 83.232 -20.606 -2.230 1.00 0.00 H ATOM 2205 HH22 ARG B 51 80.011 -21.543 -3.401 1.00 0.00 H ATOM 2206 HH21 ARG B 51 80.555 -21.802 -5.098 1.00 0.00 H ATOM 2207 H ARG B 51 86.822 -18.019 -6.622 1.00 0.00 H ATOM 2208 N PHE B 52 85.048 -20.343 -9.265 1.00 15.94 N ATOM 2209 CA PHE B 52 84.615 -20.353 -10.658 1.00 16.16 C ATOM 2210 C PHE B 52 83.100 -20.276 -10.774 1.00 16.70 C ATOM 2211 O PHE B 52 82.579 -19.719 -11.751 1.00 17.52 O ATOM 2212 CB PHE B 52 85.152 -21.622 -11.335 1.00 16.49 C ATOM 2213 CG PHE B 52 84.728 -21.792 -12.770 1.00 17.54 C ATOM 2214 CD1 PHE B 52 85.364 -21.084 -13.785 1.00 19.56 C ATOM 2215 CD2 PHE B 52 83.724 -22.678 -13.108 1.00 18.44 C ATOM 2216 CE1 PHE B 52 84.982 -21.248 -15.104 1.00 18.25 C ATOM 2217 CE2 PHE B 52 83.347 -22.851 -14.432 1.00 19.68 C ATOM 2218 CZ PHE B 52 83.980 -22.133 -15.423 1.00 19.51 C ATOM 2219 H PHE B 52 85.619 -21.138 -8.913 1.00 0.00 H ATOM 2220 N ASP B 53 82.371 -20.815 -9.787 1.00 16.89 N ATOM 2221 CA ASP B 53 80.922 -20.827 -9.893 1.00 17.15 C ATOM 2222 C ASP B 53 80.278 -19.498 -9.519 1.00 18.16 C ATOM 2223 O ASP B 53 79.076 -19.331 -9.751 1.00 19.54 O ATOM 2224 CB ASP B 53 80.332 -21.949 -9.023 1.00 18.26 C ATOM 2225 CG ASP B 53 80.880 -21.961 -7.598 1.00 22.26 C ATOM 2226 OD1 ASP B 53 82.023 -21.511 -7.360 1.00 24.05 O ATOM 2227 OD2 ASP B 53 80.160 -22.464 -6.707 1.00 27.40 O ATOM 2228 H ASP B 53 82.839 -21.221 -8.952 1.00 0.00 H ATOM 2229 N LYS B 54 81.038 -18.539 -8.982 1.00 17.41 N ATOM 2230 CA LYS B 54 80.458 -17.292 -8.475 1.00 17.14 C ATOM 2231 C LYS B 54 81.179 -16.051 -9.007 1.00 16.65 C ATOM 2232 O LYS B 54 81.562 -15.170 -8.239 1.00 19.10 O ATOM 2233 CB LYS B 54 80.479 -17.297 -6.949 1.00 19.66 C ATOM 2234 CG LYS B 54 79.652 -18.414 -6.323 1.00 26.13 C ATOM 2235 CD LYS B 54 79.893 -18.513 -4.819 1.00 43.84 C ATOM 2236 CE LYS B 54 79.440 -17.270 -4.069 1.00 52.27 C ATOM 2237 NZ LYS B 54 79.710 -17.374 -2.605 1.00 48.96 N ATOM 2238 HZ1 LYS B 54 79.200 -18.193 -2.217 1.00 0.00 H ATOM 2239 HZ2 LYS B 54 80.731 -17.495 -2.450 1.00 0.00 H ATOM 2240 HZ3 LYS B 54 79.386 -16.506 -2.132 1.00 0.00 H ATOM 2241 H LYS B 54 82.067 -18.681 -8.922 1.00 0.00 H ATOM 2242 N PRO B 55 81.341 -15.925 -10.329 1.00 14.72 N ATOM 2243 CA PRO B 55 82.072 -14.761 -10.846 1.00 14.16 C ATOM 2244 C PRO B 55 81.377 -13.455 -10.558 1.00 16.11 C ATOM 2245 O PRO B 55 82.045 -12.423 -10.488 1.00 16.28 O ATOM 2246 CB PRO B 55 82.152 -15.037 -12.352 1.00 16.58 C ATOM 2247 CG PRO B 55 80.941 -15.870 -12.633 1.00 18.14 C ATOM 2248 CD PRO B 55 80.822 -16.765 -11.423 1.00 18.11 C ATOM 2249 N GLN B 56 80.064 -13.475 -10.361 1.00 15.96 N ATOM 2250 CA GLN B 56 79.352 -12.240 -10.101 1.00 17.57 C ATOM 2251 C GLN B 56 79.758 -11.614 -8.777 1.00 18.46 C ATOM 2252 O GLN B 56 79.474 -10.429 -8.563 1.00 19.41 O ATOM 2253 CB GLN B 56 77.843 -12.495 -10.147 1.00 20.19 C ATOM 2254 CG GLN B 56 77.272 -13.326 -8.990 1.00 21.53 C ATOM 2255 CD GLN B 56 77.423 -14.829 -9.180 1.00 26.62 C ATOM 2256 OE1 GLN B 56 78.150 -15.296 -10.054 1.00 20.80 O ATOM 2257 NE2 GLN B 56 76.725 -15.595 -8.351 1.00 30.50 N ATOM 2258 HE22 GLN B 56 76.121 -15.160 -7.625 1.00 0.00 H ATOM 2259 HE21 GLN B 56 76.782 -16.631 -8.428 1.00 0.00 H ATOM 2260 H GLN B 56 79.547 -14.377 -10.393 1.00 0.00 H ATOM 2261 N THR B 57 80.429 -12.363 -7.896 1.00 17.23 N ATOM 2262 CA THR B 57 80.842 -11.791 -6.620 1.00 16.25 C ATOM 2263 C THR B 57 82.136 -11.004 -6.719 1.00 14.04 C ATOM 2264 O THR B 57 82.492 -10.310 -5.758 1.00 16.42 O ATOM 2265 CB THR B 57 80.978 -12.884 -5.556 1.00 16.44 C ATOM 2266 OG1 THR B 57 82.000 -13.824 -5.926 1.00 17.41 O ATOM 2267 CG2 THR B 57 79.643 -13.616 -5.379 1.00 17.03 C ATOM 2268 HG1 THR B 57 81.763 -14.244 -6.790 1.00 0.00 H ATOM 2269 H THR B 57 80.656 -13.353 -8.121 1.00 0.00 H ATOM 2270 N TYR B 58 82.848 -11.078 -7.854 1.00 14.70 N ATOM 2271 CA TYR B 58 84.060 -10.286 -7.997 1.00 17.60 C ATOM 2272 C TYR B 58 84.176 -9.692 -9.391 1.00 20.50 C ATOM 2273 O TYR B 58 85.244 -9.188 -9.741 1.00 17.77 O ATOM 2274 CB TYR B 58 85.322 -11.107 -7.654 1.00 15.12 C ATOM 2275 CG TYR B 58 85.409 -12.472 -8.322 1.00 14.99 C ATOM 2276 CD1 TYR B 58 84.759 -13.572 -7.775 1.00 17.26 C ATOM 2277 CD2 TYR B 58 86.138 -12.653 -9.490 1.00 21.31 C ATOM 2278 CE1 TYR B 58 84.827 -14.821 -8.381 1.00 24.67 C ATOM 2279 CE2 TYR B 58 86.215 -13.901 -10.105 1.00 24.02 C ATOM 2280 CZ TYR B 58 85.553 -14.978 -9.545 1.00 32.26 C ATOM 2281 OH TYR B 58 85.617 -16.223 -10.148 1.00 35.02 O ATOM 2282 HH TYR B 58 85.090 -16.873 -9.618 1.00 0.00 H ATOM 2283 H TYR B 58 82.535 -11.698 -8.628 1.00 0.00 H ATOM 2284 N LYS B 59 83.106 -9.708 -10.185 1.00 15.01 N ATOM 2285 CA LYS B 59 83.130 -9.132 -11.518 1.00 14.75 C ATOM 2286 C LYS B 59 81.880 -8.299 -11.724 1.00 16.03 C ATOM 2287 O LYS B 59 80.844 -8.533 -11.095 1.00 16.05 O ATOM 2288 CB LYS B 59 83.183 -10.197 -12.630 1.00 15.89 C ATOM 2289 CG LYS B 59 84.392 -11.115 -12.583 1.00 15.23 C ATOM 2290 CD LYS B 59 84.488 -11.937 -13.854 1.00 16.36 C ATOM 2291 CE LYS B 59 85.607 -12.962 -13.733 1.00 21.59 C ATOM 2292 NZ LYS B 59 86.920 -12.277 -13.517 1.00 27.08 N ATOM 2293 HZ1 LYS B 59 87.119 -11.650 -14.323 1.00 0.00 H ATOM 2294 HZ2 LYS B 59 86.877 -11.716 -12.642 1.00 0.00 H ATOM 2295 HZ3 LYS B 59 87.673 -12.990 -13.437 1.00 0.00 H ATOM 2296 H LYS B 59 82.228 -10.146 -9.840 1.00 0.00 H ATOM 2297 N HIS B 60 81.998 -7.334 -12.624 1.00 16.39 N ATOM 2298 CA HIS B 60 80.883 -6.522 -13.073 1.00 16.74 C ATOM 2299 C HIS B 60 80.123 -7.234 -14.190 1.00 17.44 C ATOM 2300 O HIS B 60 80.564 -8.250 -14.737 1.00 18.25 O ATOM 2301 CB HIS B 60 81.379 -5.186 -13.620 1.00 15.59 C ATOM 2302 CG HIS B 60 81.972 -4.267 -12.602 1.00 16.73 C ATOM 2303 ND1 HIS B 60 81.207 -3.412 -11.837 1.00 20.64 N ATOM 2304 CD2 HIS B 60 83.262 -4.002 -12.288 1.00 21.50 C ATOM 2305 CE1 HIS B 60 82.000 -2.690 -11.063 1.00 22.44 C ATOM 2306 NE2 HIS B 60 83.252 -3.016 -11.331 1.00 19.89 N ATOM 2307 H HIS B 60 82.938 -7.149 -13.029 1.00 0.00 H ATOM 2308 N PHE B 61 78.972 -6.655 -14.547 1.00 17.14 N ATOM 2309 CA PHE B 61 78.222 -6.915 -15.778 1.00 20.66 C ATOM 2310 C PHE B 61 77.519 -8.264 -15.834 1.00 19.28 C ATOM 2311 O PHE B 61 77.022 -8.635 -16.907 1.00 19.64 O ATOM 2312 CB PHE B 61 79.111 -6.788 -17.024 1.00 20.78 C ATOM 2313 CG PHE B 61 79.976 -5.562 -17.024 1.00 20.18 C ATOM 2314 CD1 PHE B 61 79.413 -4.303 -16.927 1.00 20.08 C ATOM 2315 CD2 PHE B 61 81.359 -5.670 -17.100 1.00 22.62 C ATOM 2316 CE1 PHE B 61 80.208 -3.167 -16.933 1.00 21.69 C ATOM 2317 CE2 PHE B 61 82.156 -4.540 -17.103 1.00 22.04 C ATOM 2318 CZ PHE B 61 81.572 -3.281 -17.018 1.00 22.90 C ATOM 2319 H PHE B 61 78.572 -5.955 -13.890 1.00 0.00 H ATOM 2320 N ILE B 62 77.421 -9.000 -14.731 1.00 17.71 N ATOM 2321 CA ILE B 62 76.842 -10.341 -14.760 1.00 17.86 C ATOM 2322 C ILE B 62 75.449 -10.281 -14.144 1.00 20.42 C ATOM 2323 O ILE B 62 75.295 -9.988 -12.954 1.00 23.25 O ATOM 2324 CB ILE B 62 77.732 -11.362 -14.040 1.00 15.94 C ATOM 2325 CG1 ILE B 62 79.058 -11.519 -14.793 1.00 15.50 C ATOM 2326 CG2 ILE B 62 77.010 -12.691 -13.921 1.00 19.93 C ATOM 2327 CD1 ILE B 62 80.076 -12.356 -14.060 1.00 18.79 C ATOM 2328 H ILE B 62 77.764 -8.613 -13.829 1.00 0.00 H ATOM 2329 N LYS B 63 74.432 -10.574 -14.957 1.00 19.16 N ATOM 2330 CA LYS B 63 73.070 -10.646 -14.439 1.00 22.44 C ATOM 2331 C LYS B 63 72.871 -11.910 -13.611 1.00 24.09 C ATOM 2332 O LYS B 63 72.264 -11.871 -12.532 1.00 26.29 O ATOM 2333 CB LYS B 63 72.077 -10.594 -15.601 1.00 23.94 C ATOM 2334 CG LYS B 63 70.616 -10.550 -15.171 1.00 28.46 C ATOM 2335 CD LYS B 63 69.708 -10.694 -16.375 1.00 32.50 C ATOM 2336 CE LYS B 63 68.242 -10.627 -15.984 1.00 46.99 C ATOM 2337 NZ LYS B 63 67.879 -9.281 -15.476 1.00 57.61 N ATOM 2338 HZ1 LYS B 63 68.455 -9.061 -14.639 1.00 0.00 H ATOM 2339 HZ2 LYS B 63 68.057 -8.573 -16.217 1.00 0.00 H ATOM 2340 HZ3 LYS B 63 66.872 -9.269 -15.218 1.00 0.00 H ATOM 2341 H LYS B 63 74.611 -10.752 -15.966 1.00 0.00 H ATOM 2342 N SER B 64 73.383 -13.038 -14.095 1.00 23.60 N ATOM 2343 CA SER B 64 73.270 -14.286 -13.356 1.00 25.74 C ATOM 2344 C SER B 64 74.327 -15.253 -13.865 1.00 24.13 C ATOM 2345 O SER B 64 74.799 -15.144 -15.003 1.00 22.54 O ATOM 2346 CB SER B 64 71.869 -14.901 -13.484 1.00 29.65 C ATOM 2347 OG SER B 64 71.623 -15.341 -14.810 1.00 28.83 O ATOM 2348 HG SER B 64 70.715 -15.732 -14.864 1.00 0.00 H ATOM 2349 H SER B 64 73.870 -13.028 -15.014 1.00 0.00 H ATOM 2350 N CYS B 65 74.699 -16.197 -13.004 1.00 20.04 N ATOM 2351 CA CYS B 65 75.621 -17.257 -13.382 1.00 20.61 C ATOM 2352 C CYS B 65 75.095 -18.561 -12.816 1.00 22.30 C ATOM 2353 O CYS B 65 74.897 -18.671 -11.600 1.00 26.91 O ATOM 2354 CB CYS B 65 77.033 -16.989 -12.866 1.00 19.01 C ATOM 2355 SG CYS B 65 78.193 -18.275 -13.376 1.00 20.28 S ATOM 2356 H CYS B 65 74.321 -16.176 -12.035 1.00 0.00 H ATOM 2357 N SER B 66 74.846 -19.527 -13.694 1.00 22.29 N ATOM 2358 CA SER B 66 74.305 -20.819 -13.312 1.00 23.11 C ATOM 2359 C SER B 66 75.338 -21.913 -13.536 1.00 22.66 C ATOM 2360 O SER B 66 76.138 -21.855 -14.473 1.00 22.95 O ATOM 2361 CB SER B 66 73.043 -21.148 -14.115 1.00 25.73 C ATOM 2362 OG SER B 66 72.112 -20.084 -14.029 1.00 37.64 O ATOM 2363 HG SER B 66 72.521 -19.259 -14.393 1.00 0.00 H ATOM 2364 H SER B 66 75.048 -19.350 -14.699 1.00 0.00 H ATOM 2365 N VAL B 67 75.301 -22.917 -12.659 1.00 24.87 N ATOM 2366 CA VAL B 67 76.066 -24.141 -12.828 1.00 24.81 C ATOM 2367 C VAL B 67 75.116 -25.311 -12.616 1.00 28.61 C ATOM 2368 O VAL B 67 74.027 -25.167 -12.050 1.00 30.52 O ATOM 2369 CB VAL B 67 77.273 -24.228 -11.867 1.00 23.35 C ATOM 2370 CG1 VAL B 67 78.286 -23.128 -12.181 1.00 19.87 C ATOM 2371 CG2 VAL B 67 76.815 -24.164 -10.413 1.00 26.00 C ATOM 2372 H VAL B 67 74.698 -22.820 -11.817 1.00 0.00 H ATOM 2373 N GLU B 68 75.537 -26.483 -13.080 1.00 29.95 N ATOM 2374 CA GLU B 68 74.659 -27.642 -13.025 1.00 33.94 C ATOM 2375 C GLU B 68 74.420 -28.090 -11.585 1.00 39.71 C ATOM 2376 O GLU B 68 75.178 -27.766 -10.666 1.00 35.21 O ATOM 2377 CB GLU B 68 75.240 -28.802 -13.831 1.00 38.17 C ATOM 2378 CG GLU B 68 76.525 -29.361 -13.258 1.00 39.74 C ATOM 2379 CD GLU B 68 76.968 -30.625 -13.969 1.00 49.54 C ATOM 2380 OE1 GLU B 68 76.351 -30.977 -14.996 1.00 49.26 O ATOM 2381 OE2 GLU B 68 77.930 -31.267 -13.499 1.00 49.13 O ATOM 2382 H GLU B 68 76.492 -26.572 -13.482 1.00 0.00 H ATOM 2383 N GLN B 69 73.340 -28.846 -11.400 1.00 39.65 N ATOM 2384 CA GLN B 69 73.068 -29.459 -10.106 1.00 42.33 C ATOM 2385 C GLN B 69 74.205 -30.396 -9.725 1.00 44.43 C ATOM 2386 O GLN B 69 74.790 -31.065 -10.581 1.00 51.66 O ATOM 2387 CB GLN B 69 71.749 -30.231 -10.143 1.00 49.67 C ATOM 2388 CG GLN B 69 70.517 -29.372 -10.367 1.00 57.01 C ATOM 2389 CD GLN B 69 69.236 -30.187 -10.337 1.00 70.95 C ATOM 2390 OE1 GLN B 69 69.253 -31.399 -10.561 1.00 79.52 O ATOM 2391 NE2 GLN B 69 68.118 -29.527 -10.051 1.00 71.78 N ATOM 2392 HE22 GLN B 69 68.150 -28.504 -9.869 1.00 0.00 H ATOM 2393 HE21 GLN B 69 67.211 -30.034 -10.009 1.00 0.00 H ATOM 2394 H GLN B 69 72.681 -29.001 -12.190 1.00 0.00 H ATOM 2395 N ASN B 70 74.507 -30.450 -8.426 1.00 46.88 N ATOM 2396 CA ASN B 70 75.630 -31.235 -7.909 1.00 50.33 C ATOM 2397 C ASN B 70 76.932 -30.814 -8.583 1.00 46.85 C ATOM 2398 O ASN B 70 77.754 -31.644 -8.978 1.00 47.87 O ATOM 2399 CB ASN B 70 75.389 -32.739 -8.065 1.00 52.28 C ATOM 2400 CG ASN B 70 74.201 -33.221 -7.262 1.00 59.27 C ATOM 2401 OD1 ASN B 70 73.924 -32.710 -6.177 1.00 61.68 O ATOM 2402 ND2 ASN B 70 73.488 -34.204 -7.793 1.00 66.72 N ATOM 2403 HD22 ASN B 70 73.760 -34.605 -8.713 1.00 0.00 H ATOM 2404 HD21 ASN B 70 72.657 -34.574 -7.290 1.00 0.00 H ATOM 2405 H ASN B 70 73.922 -29.913 -7.754 1.00 0.00 H ATOM 2406 N PHE B 71 77.095 -29.505 -8.737 1.00 40.38 N ATOM 2407 CA PHE B 71 78.305 -28.941 -9.313 1.00 37.40 C ATOM 2408 C PHE B 71 79.525 -29.334 -8.491 1.00 36.55 C ATOM 2409 O PHE B 71 79.480 -29.373 -7.259 1.00 39.48 O ATOM 2410 CB PHE B 71 78.160 -27.420 -9.381 1.00 36.70 C ATOM 2411 CG PHE B 71 79.401 -26.690 -9.811 1.00 31.41 C ATOM 2412 CD1 PHE B 71 79.715 -26.554 -11.153 1.00 24.42 C ATOM 2413 CD2 PHE B 71 80.232 -26.101 -8.868 1.00 26.83 C ATOM 2414 CE1 PHE B 71 80.841 -25.857 -11.550 1.00 24.06 C ATOM 2415 CE2 PHE B 71 81.361 -25.415 -9.256 1.00 23.19 C ATOM 2416 CZ PHE B 71 81.667 -25.284 -10.592 1.00 24.36 C ATOM 2417 H PHE B 71 76.334 -28.864 -8.436 1.00 0.00 H ATOM 2418 N GLU B 72 80.611 -29.657 -9.189 1.00 35.12 N ATOM 2419 CA GLU B 72 81.899 -29.948 -8.571 1.00 33.06 C ATOM 2420 C GLU B 72 82.949 -29.125 -9.296 1.00 31.91 C ATOM 2421 O GLU B 72 83.090 -29.234 -10.519 1.00 29.37 O ATOM 2422 CB GLU B 72 82.236 -31.441 -8.644 1.00 35.91 C ATOM 2423 CG GLU B 72 81.331 -32.330 -7.820 1.00 50.73 C ATOM 2424 CD GLU B 72 81.707 -33.795 -7.933 1.00 62.46 C ATOM 2425 OE1 GLU B 72 82.755 -34.098 -8.547 1.00 65.17 O ATOM 2426 OE2 GLU B 72 80.956 -34.644 -7.411 1.00 69.11 O ATOM 2427 H GLU B 72 80.537 -29.704 -10.225 1.00 0.00 H ATOM 2428 N MET B 73 83.668 -28.286 -8.559 1.00 27.16 N ATOM 2429 CA MET B 73 84.629 -27.393 -9.203 1.00 22.28 C ATOM 2430 C MET B 73 85.908 -28.161 -9.505 1.00 28.21 C ATOM 2431 O MET B 73 86.734 -28.398 -8.621 1.00 35.91 O ATOM 2432 CB MET B 73 84.916 -26.173 -8.337 1.00 30.49 C ATOM 2433 CG MET B 73 85.664 -25.115 -9.109 1.00 25.55 C ATOM 2434 SD MET B 73 85.788 -23.583 -8.195 1.00 30.39 S ATOM 2435 CE MET B 73 86.930 -24.009 -6.880 1.00 23.38 C ATOM 2436 H MET B 73 83.547 -28.265 -7.526 1.00 0.00 H ATOM 2437 N ARG B 74 86.062 -28.548 -10.769 1.00 23.97 N ATOM 2438 CA ARG B 74 87.230 -29.263 -11.256 1.00 22.31 C ATOM 2439 C ARG B 74 87.404 -28.879 -12.717 1.00 22.60 C ATOM 2440 O ARG B 74 86.467 -28.409 -13.363 1.00 22.65 O ATOM 2441 CB ARG B 74 87.070 -30.777 -11.101 1.00 27.96 C ATOM 2442 CG ARG B 74 85.887 -31.345 -11.869 1.00 35.38 C ATOM 2443 CD ARG B 74 85.699 -32.830 -11.577 1.00 47.65 C ATOM 2444 NE ARG B 74 86.937 -33.583 -11.755 1.00 57.57 N ATOM 2445 CZ ARG B 74 87.103 -34.849 -11.385 1.00 68.96 C ATOM 2446 NH1 ARG B 74 86.107 -35.513 -10.812 1.00 72.35 N ATOM 2447 NH2 ARG B 74 88.268 -35.453 -11.586 1.00 70.69 N ATOM 2448 HE ARG B 74 87.742 -33.097 -12.200 1.00 0.00 H ATOM 2449 HH12 ARG B 74 86.240 -36.503 -10.524 1.00 0.00 H ATOM 2450 HH11 ARG B 74 85.193 -35.043 -10.651 1.00 0.00 H ATOM 2451 HH22 ARG B 74 88.397 -36.443 -11.296 1.00 0.00 H ATOM 2452 HH21 ARG B 74 89.052 -34.936 -12.033 1.00 0.00 H ATOM 2453 H ARG B 74 85.304 -28.326 -11.446 1.00 0.00 H ATOM 2454 N VAL B 75 88.611 -29.094 -13.241 1.00 22.12 N ATOM 2455 CA VAL B 75 88.874 -28.737 -14.632 1.00 20.15 C ATOM 2456 C VAL B 75 87.857 -29.430 -15.531 1.00 20.87 C ATOM 2457 O VAL B 75 87.577 -30.628 -15.383 1.00 24.40 O ATOM 2458 CB VAL B 75 90.315 -29.110 -15.013 1.00 22.03 C ATOM 2459 CG1 VAL B 75 90.511 -29.043 -16.525 1.00 24.39 C ATOM 2460 CG2 VAL B 75 91.292 -28.174 -14.306 1.00 25.07 C ATOM 2461 H VAL B 75 89.364 -29.515 -12.660 1.00 0.00 H ATOM 2462 N GLY B 76 87.280 -28.661 -16.458 1.00 19.31 N ATOM 2463 CA GLY B 76 86.266 -29.146 -17.351 1.00 19.75 C ATOM 2464 C GLY B 76 84.850 -28.785 -16.951 1.00 20.50 C ATOM 2465 O GLY B 76 83.930 -28.945 -17.771 1.00 22.49 O ATOM 2466 H GLY B 76 87.578 -27.668 -16.536 1.00 0.00 H ATOM 2467 N CYS B 77 84.642 -28.358 -15.710 1.00 20.08 N ATOM 2468 CA CYS B 77 83.310 -27.927 -15.324 1.00 20.78 C ATOM 2469 C CYS B 77 82.988 -26.628 -16.045 1.00 19.66 C ATOM 2470 O CYS B 77 83.880 -25.929 -16.529 1.00 19.57 O ATOM 2471 CB CYS B 77 83.203 -27.762 -13.804 1.00 21.10 C ATOM 2472 SG CYS B 77 84.060 -26.327 -13.103 1.00 21.89 S ATOM 2473 H CYS B 77 85.423 -28.333 -15.024 1.00 0.00 H ATOM 2474 N THR B 78 81.702 -26.314 -16.146 1.00 18.74 N ATOM 2475 CA THR B 78 81.298 -25.149 -16.914 1.00 17.82 C ATOM 2476 C THR B 78 80.345 -24.271 -16.119 1.00 19.60 C ATOM 2477 O THR B 78 79.748 -24.691 -15.125 1.00 20.45 O ATOM 2478 CB THR B 78 80.637 -25.545 -18.242 1.00 18.29 C ATOM 2479 OG1 THR B 78 79.462 -26.330 -17.991 1.00 23.77 O ATOM 2480 CG2 THR B 78 81.595 -26.364 -19.068 1.00 20.38 C ATOM 2481 HG1 THR B 78 78.821 -25.800 -17.453 1.00 0.00 H ATOM 2482 H THR B 78 80.984 -26.902 -15.676 1.00 0.00 H ATOM 2483 N ARG B 79 80.201 -23.037 -16.594 1.00 18.00 N ATOM 2484 CA ARG B 79 79.248 -22.096 -16.029 1.00 15.94 C ATOM 2485 C ARG B 79 78.537 -21.383 -17.167 1.00 21.24 C ATOM 2486 O ARG B 79 79.123 -21.151 -18.224 1.00 17.41 O ATOM 2487 CB ARG B 79 79.939 -21.088 -15.093 1.00 18.29 C ATOM 2488 CG ARG B 79 80.877 -20.112 -15.782 1.00 16.20 C ATOM 2489 CD ARG B 79 81.753 -19.371 -14.786 1.00 15.94 C ATOM 2490 NE ARG B 79 82.641 -18.429 -15.464 1.00 16.39 N ATOM 2491 CZ ARG B 79 83.673 -17.829 -14.883 1.00 16.58 C ATOM 2492 NH1 ARG B 79 83.953 -18.056 -13.602 1.00 16.45 N ATOM 2493 NH2 ARG B 79 84.428 -16.995 -15.584 1.00 19.95 N ATOM 2494 HE ARG B 79 82.453 -18.215 -16.464 1.00 0.00 H ATOM 2495 HH12 ARG B 79 84.763 -17.582 -13.155 1.00 0.00 H ATOM 2496 HH11 ARG B 79 83.361 -18.708 -13.048 1.00 0.00 H ATOM 2497 HH22 ARG B 79 85.238 -16.523 -15.133 1.00 0.00 H ATOM 2498 HH21 ARG B 79 84.211 -16.813 -16.585 1.00 0.00 H ATOM 2499 H ARG B 79 80.790 -22.735 -17.396 1.00 0.00 H ATOM 2500 N ASP B 80 77.259 -21.053 -16.949 1.00 20.84 N ATOM 2501 CA ASP B 80 76.442 -20.334 -17.928 1.00 20.91 C ATOM 2502 C ASP B 80 76.190 -18.927 -17.403 1.00 21.22 C ATOM 2503 O ASP B 80 75.431 -18.747 -16.442 1.00 22.41 O ATOM 2504 CB ASP B 80 75.113 -21.046 -18.172 1.00 20.32 C ATOM 2505 CG ASP B 80 75.278 -22.411 -18.787 1.00 32.91 C ATOM 2506 OD1 ASP B 80 76.245 -22.619 -19.545 1.00 30.93 O ATOM 2507 OD2 ASP B 80 74.412 -23.275 -18.525 1.00 36.97 O ATOM 2508 H ASP B 80 76.826 -21.320 -16.042 1.00 0.00 H ATOM 2509 N VAL B 81 76.789 -17.928 -18.058 1.00 19.05 N ATOM 2510 CA VAL B 81 76.683 -16.527 -17.654 1.00 17.43 C ATOM 2511 C VAL B 81 75.651 -15.832 -18.519 1.00 19.74 C ATOM 2512 O VAL B 81 75.627 -16.007 -19.746 1.00 21.77 O ATOM 2513 CB VAL B 81 78.052 -15.828 -17.773 1.00 19.45 C ATOM 2514 CG1 VAL B 81 77.945 -14.334 -17.477 1.00 21.45 C ATOM 2515 CG2 VAL B 81 79.080 -16.487 -16.858 1.00 21.76 C ATOM 2516 H VAL B 81 77.359 -18.159 -18.897 1.00 0.00 H ATOM 2517 N ILE B 82 74.798 -15.034 -17.888 1.00 20.04 N ATOM 2518 CA ILE B 82 73.915 -14.116 -18.594 1.00 22.03 C ATOM 2519 C ILE B 82 74.388 -12.706 -18.275 1.00 25.69 C ATOM 2520 O ILE B 82 74.501 -12.333 -17.102 1.00 23.17 O ATOM 2521 CB ILE B 82 72.448 -14.320 -18.198 1.00 24.76 C ATOM 2522 CG1 ILE B 82 71.992 -15.726 -18.605 1.00 26.35 C ATOM 2523 CG2 ILE B 82 71.584 -13.234 -18.834 1.00 22.16 C ATOM 2524 CD1 ILE B 82 70.598 -16.085 -18.133 1.00 25.92 C ATOM 2525 H ILE B 82 74.759 -15.066 -16.849 1.00 0.00 H ATOM 2526 N VAL B 83 74.686 -11.941 -19.313 1.00 22.11 N ATOM 2527 CA VAL B 83 75.222 -10.592 -19.168 1.00 21.88 C ATOM 2528 C VAL B 83 74.077 -9.608 -18.974 1.00 22.95 C ATOM 2529 O VAL B 83 72.970 -9.799 -19.493 1.00 26.14 O ATOM 2530 CB VAL B 83 76.073 -10.244 -20.408 1.00 26.11 C ATOM 2531 CG1 VAL B 83 76.682 -8.863 -20.292 1.00 28.61 C ATOM 2532 CG2 VAL B 83 77.168 -11.290 -20.584 1.00 25.63 C ATOM 2533 H VAL B 83 74.532 -12.317 -20.270 1.00 0.00 H ATOM 2534 N ILE B 84 74.339 -8.549 -18.200 1.00 21.13 N ATOM 2535 CA ILE B 84 73.342 -7.491 -18.057 1.00 24.57 C ATOM 2536 C ILE B 84 73.096 -6.839 -19.420 1.00 29.42 C ATOM 2537 O ILE B 84 73.920 -6.916 -20.339 1.00 30.58 O ATOM 2538 CB ILE B 84 73.769 -6.439 -17.020 1.00 26.69 C ATOM 2539 CG1 ILE B 84 75.076 -5.769 -17.446 1.00 30.22 C ATOM 2540 CG2 ILE B 84 73.884 -7.070 -15.636 1.00 26.53 C ATOM 2541 CD1 ILE B 84 75.425 -4.525 -16.642 1.00 33.42 C ATOM 2542 H ILE B 84 75.249 -8.479 -17.702 1.00 0.00 H ATOM 2543 N SER B 85 71.943 -6.191 -19.548 1.00 29.65 N ATOM 2544 CA SER B 85 71.581 -5.611 -20.829 1.00 33.12 C ATOM 2545 C SER B 85 72.465 -4.408 -21.151 1.00 31.05 C ATOM 2546 O SER B 85 73.082 -3.797 -20.273 1.00 34.03 O ATOM 2547 CB SER B 85 70.107 -5.201 -20.832 1.00 37.59 C ATOM 2548 OG SER B 85 69.820 -4.350 -19.737 1.00 46.62 O ATOM 2549 HG SER B 85 70.018 -4.824 -18.891 1.00 0.00 H ATOM 2550 H SER B 85 71.302 -6.100 -18.734 1.00 0.00 H ATOM 2551 N GLY B 86 72.524 -4.075 -22.439 1.00 35.03 N ATOM 2552 CA GLY B 86 73.210 -2.877 -22.882 1.00 36.67 C ATOM 2553 C GLY B 86 74.675 -3.040 -23.214 1.00 36.81 C ATOM 2554 O GLY B 86 75.378 -2.030 -23.332 1.00 39.93 O ATOM 2555 H GLY B 86 72.067 -4.689 -23.144 1.00 0.00 H ATOM 2556 N LEU B 87 75.156 -4.273 -23.386 1.00 30.47 N ATOM 2557 CA LEU B 87 76.560 -4.559 -23.673 1.00 31.29 C ATOM 2558 C LEU B 87 76.680 -5.337 -24.981 1.00 31.83 C ATOM 2559 O LEU B 87 75.665 -5.812 -25.508 1.00 33.12 O ATOM 2560 CB LEU B 87 77.189 -5.335 -22.515 1.00 30.46 C ATOM 2561 CG LEU B 87 77.191 -4.577 -21.186 1.00 33.86 C ATOM 2562 CD1 LEU B 87 77.778 -5.433 -20.099 1.00 30.84 C ATOM 2563 CD2 LEU B 87 77.966 -3.286 -21.307 1.00 36.22 C ATOM 2564 H LEU B 87 74.496 -5.073 -23.312 1.00 0.00 H ATOM 2565 N PRO B 88 77.893 -5.477 -25.556 1.00 39.76 N ATOM 2566 CA PRO B 88 78.016 -6.219 -26.819 1.00 41.83 C ATOM 2567 C PRO B 88 78.052 -7.721 -26.612 1.00 36.64 C ATOM 2568 O PRO B 88 78.760 -8.435 -27.327 1.00 46.46 O ATOM 2569 CB PRO B 88 79.338 -5.705 -27.402 1.00 46.54 C ATOM 2570 CG PRO B 88 80.129 -5.298 -26.220 1.00 44.82 C ATOM 2571 CD PRO B 88 79.131 -4.739 -25.240 1.00 43.61 C ATOM 2572 N ALA B 89 77.296 -8.208 -25.632 1.00 33.42 N ATOM 2573 CA ALA B 89 77.275 -9.626 -25.309 1.00 31.11 C ATOM 2574 C ALA B 89 75.994 -9.935 -24.553 1.00 34.08 C ATOM 2575 O ALA B 89 75.515 -9.108 -23.774 1.00 34.95 O ATOM 2576 CB ALA B 89 78.490 -10.029 -24.470 1.00 28.65 C ATOM 2577 H ALA B 89 76.703 -7.556 -25.081 1.00 0.00 H ATOM 2578 N ASN B 90 75.445 -11.127 -24.783 1.00 30.88 N ATOM 2579 CA ASN B 90 74.220 -11.530 -24.108 1.00 25.04 C ATOM 2580 C ASN B 90 74.428 -12.719 -23.189 1.00 24.72 C ATOM 2581 O ASN B 90 73.947 -12.705 -22.049 1.00 27.22 O ATOM 2582 CB ASN B 90 73.121 -11.854 -25.131 1.00 25.96 C ATOM 2583 CG ASN B 90 72.685 -10.637 -25.926 1.00 36.12 C ATOM 2584 OD1 ASN B 90 72.728 -9.502 -25.437 1.00 38.38 O ATOM 2585 ND2 ASN B 90 72.256 -10.868 -27.158 1.00 40.63 N ATOM 2586 HD22 ASN B 90 72.237 -11.840 -27.528 1.00 0.00 H ATOM 2587 HD21 ASN B 90 71.938 -10.078 -27.755 1.00 0.00 H ATOM 2588 H ASN B 90 75.898 -11.779 -25.455 1.00 0.00 H ATOM 2589 N THR B 91 75.130 -13.753 -23.655 1.00 23.15 N ATOM 2590 CA THR B 91 75.338 -14.972 -22.889 1.00 25.90 C ATOM 2591 C THR B 91 76.749 -15.477 -23.131 1.00 25.75 C ATOM 2592 O THR B 91 77.372 -15.183 -24.154 1.00 26.65 O ATOM 2593 CB THR B 91 74.353 -16.084 -23.278 1.00 26.03 C ATOM 2594 OG1 THR B 91 74.493 -16.376 -24.675 1.00 27.74 O ATOM 2595 CG2 THR B 91 72.916 -15.679 -22.982 1.00 29.48 C ATOM 2596 HG1 THR B 91 75.419 -16.675 -24.857 1.00 0.00 H ATOM 2597 H THR B 91 75.546 -13.685 -24.606 1.00 0.00 H ATOM 2598 N SER B 92 77.239 -16.273 -22.188 1.00 21.36 N ATOM 2599 CA SER B 92 78.550 -16.877 -22.350 1.00 20.16 C ATOM 2600 C SER B 92 78.592 -18.195 -21.593 1.00 20.99 C ATOM 2601 O SER B 92 78.178 -18.262 -20.431 1.00 24.25 O ATOM 2602 CB SER B 92 79.644 -15.938 -21.850 1.00 20.59 C ATOM 2603 OG SER B 92 80.917 -16.473 -22.152 1.00 22.35 O ATOM 2604 HG SER B 92 81.619 -15.857 -21.824 1.00 0.00 H ATOM 2605 H SER B 92 76.682 -16.465 -21.331 1.00 0.00 H ATOM 2606 N THR B 93 79.065 -19.236 -22.262 1.00 19.34 N ATOM 2607 CA THR B 93 79.348 -20.515 -21.627 1.00 22.08 C ATOM 2608 C THR B 93 80.852 -20.648 -21.474 1.00 17.78 C ATOM 2609 O THR B 93 81.591 -20.477 -22.447 1.00 19.05 O ATOM 2610 CB THR B 93 78.805 -21.671 -22.458 1.00 22.17 C ATOM 2611 OG1 THR B 93 77.427 -21.429 -22.768 1.00 28.00 O ATOM 2612 CG2 THR B 93 78.944 -22.978 -21.682 1.00 22.77 C ATOM 2613 HG1 THR B 93 77.349 -20.586 -23.282 1.00 0.00 H ATOM 2614 H THR B 93 79.241 -19.135 -23.282 1.00 0.00 H ATOM 2615 N GLU B 94 81.304 -20.930 -20.254 1.00 17.12 N ATOM 2616 CA GLU B 94 82.723 -20.874 -19.941 1.00 16.81 C ATOM 2617 C GLU B 94 83.149 -22.151 -19.233 1.00 17.67 C ATOM 2618 O GLU B 94 82.378 -22.758 -18.486 1.00 18.73 O ATOM 2619 CB GLU B 94 83.045 -19.630 -19.097 1.00 15.71 C ATOM 2620 CG GLU B 94 82.713 -18.384 -19.918 1.00 15.74 C ATOM 2621 CD GLU B 94 82.617 -17.111 -19.128 1.00 19.56 C ATOM 2622 OE1 GLU B 94 82.906 -17.109 -17.910 1.00 20.17 O ATOM 2623 OE2 GLU B 94 82.241 -16.108 -19.767 1.00 19.63 O ATOM 2624 H GLU B 94 80.628 -21.196 -19.509 1.00 0.00 H ATOM 2625 N ARG B 95 84.383 -22.561 -19.498 1.00 16.18 N ATOM 2626 CA ARG B 95 84.930 -23.809 -18.987 1.00 14.68 C ATOM 2627 C ARG B 95 86.122 -23.510 -18.096 1.00 15.60 C ATOM 2628 O ARG B 95 86.953 -22.669 -18.433 1.00 16.59 O ATOM 2629 CB ARG B 95 85.360 -24.713 -20.140 1.00 16.43 C ATOM 2630 CG ARG B 95 86.090 -25.971 -19.718 1.00 18.50 C ATOM 2631 CD ARG B 95 86.674 -26.637 -20.947 1.00 17.38 C ATOM 2632 NE ARG B 95 87.184 -27.967 -20.629 1.00 19.18 N ATOM 2633 CZ ARG B 95 88.441 -28.227 -20.293 1.00 19.30 C ATOM 2634 NH1 ARG B 95 89.336 -27.252 -20.229 1.00 20.47 N ATOM 2635 NH2 ARG B 95 88.804 -29.478 -20.023 1.00 21.79 N ATOM 2636 HE ARG B 95 86.517 -28.764 -20.668 1.00 0.00 H ATOM 2637 HH12 ARG B 95 90.319 -27.465 -19.965 1.00 0.00 H ATOM 2638 HH11 ARG B 95 89.055 -26.274 -20.443 1.00 0.00 H ATOM 2639 HH22 ARG B 95 89.788 -29.689 -19.759 1.00 0.00 H ATOM 2640 HH21 ARG B 95 88.104 -30.245 -20.076 1.00 0.00 H ATOM 2641 H ARG B 95 84.987 -21.963 -20.098 1.00 0.00 H ATOM 2642 N LEU B 96 86.209 -24.207 -16.959 1.00 15.66 N ATOM 2643 CA LEU B 96 87.365 -24.072 -16.079 1.00 16.09 C ATOM 2644 C LEU B 96 88.527 -24.852 -16.680 1.00 18.15 C ATOM 2645 O LEU B 96 88.434 -26.073 -16.842 1.00 17.26 O ATOM 2646 CB LEU B 96 87.039 -24.579 -14.675 1.00 16.55 C ATOM 2647 CG LEU B 96 88.177 -24.538 -13.655 1.00 16.58 C ATOM 2648 CD1 LEU B 96 88.657 -23.111 -13.486 1.00 16.97 C ATOM 2649 CD2 LEU B 96 87.709 -25.111 -12.314 1.00 16.30 C ATOM 2650 H LEU B 96 85.440 -24.856 -16.697 1.00 0.00 H ATOM 2651 N ASP B 97 89.610 -24.150 -17.019 1.00 15.06 N ATOM 2652 CA ASP B 97 90.740 -24.761 -17.723 1.00 18.31 C ATOM 2653 C ASP B 97 91.834 -25.244 -16.788 1.00 19.58 C ATOM 2654 O ASP B 97 92.482 -26.267 -17.065 1.00 17.91 O ATOM 2655 CB ASP B 97 91.384 -23.770 -18.701 1.00 18.84 C ATOM 2656 CG ASP B 97 90.499 -23.406 -19.870 1.00 25.03 C ATOM 2657 OD1 ASP B 97 89.619 -24.193 -20.260 1.00 22.08 O ATOM 2658 OD2 ASP B 97 90.719 -22.307 -20.413 1.00 22.59 O ATOM 2659 H ASP B 97 89.653 -23.140 -16.776 1.00 0.00 H ATOM 2660 N ILE B 98 92.108 -24.478 -15.735 1.00 18.85 N ATOM 2661 CA ILE B 98 93.189 -24.777 -14.806 1.00 18.05 C ATOM 2662 C ILE B 98 92.756 -24.319 -13.425 1.00 18.38 C ATOM 2663 O ILE B 98 92.147 -23.257 -13.269 1.00 17.92 O ATOM 2664 CB ILE B 98 94.514 -24.112 -15.249 1.00 29.43 C ATOM 2665 CG1 ILE B 98 95.582 -24.225 -14.158 1.00 34.93 C ATOM 2666 CG2 ILE B 98 94.297 -22.672 -15.603 1.00 32.37 C ATOM 2667 CD1 ILE B 98 96.979 -23.843 -14.627 1.00 42.38 C ATOM 2668 H ILE B 98 91.527 -23.632 -15.569 1.00 0.00 H ATOM 2669 N LEU B 99 93.016 -25.160 -12.427 1.00 16.43 N ATOM 2670 CA LEU B 99 92.816 -24.780 -11.033 1.00 17.20 C ATOM 2671 C LEU B 99 94.014 -25.325 -10.282 1.00 19.30 C ATOM 2672 O LEU B 99 94.158 -26.552 -10.157 1.00 21.07 O ATOM 2673 CB LEU B 99 91.513 -25.342 -10.475 1.00 20.07 C ATOM 2674 CG LEU B 99 91.281 -25.070 -8.986 1.00 24.24 C ATOM 2675 CD1 LEU B 99 91.157 -23.566 -8.726 1.00 23.84 C ATOM 2676 CD2 LEU B 99 90.065 -25.835 -8.472 1.00 25.09 C ATOM 2677 H LEU B 99 93.371 -26.113 -12.647 1.00 0.00 H ATOM 2678 N ASP B 100 94.884 -24.422 -9.829 1.00 15.87 N ATOM 2679 CA ASP B 100 96.076 -24.784 -9.073 1.00 15.86 C ATOM 2680 C ASP B 100 96.008 -23.998 -7.771 1.00 15.59 C ATOM 2681 O ASP B 100 96.457 -22.851 -7.684 1.00 16.70 O ATOM 2682 CB ASP B 100 97.358 -24.495 -9.877 1.00 17.00 C ATOM 2683 CG ASP B 100 98.593 -25.082 -9.233 1.00 16.66 C ATOM 2684 OD1 ASP B 100 98.572 -25.309 -8.013 1.00 17.43 O ATOM 2685 OD2 ASP B 100 99.583 -25.319 -9.957 1.00 18.30 O ATOM 2686 H ASP B 100 94.704 -23.416 -10.024 1.00 0.00 H ATOM 2687 N ASP B 101 95.437 -24.634 -6.751 1.00 16.21 N ATOM 2688 CA ASP B 101 95.333 -23.991 -5.453 1.00 17.86 C ATOM 2689 C ASP B 101 96.695 -23.806 -4.804 1.00 17.48 C ATOM 2690 O ASP B 101 96.892 -22.840 -4.059 1.00 25.84 O ATOM 2691 CB ASP B 101 94.404 -24.795 -4.547 1.00 19.51 C ATOM 2692 CG ASP B 101 92.936 -24.548 -4.868 1.00 21.86 C ATOM 2693 OD1 ASP B 101 92.609 -23.405 -5.225 1.00 18.31 O ATOM 2694 OD2 ASP B 101 92.110 -25.480 -4.770 1.00 24.66 O ATOM 2695 H ASP B 101 95.064 -25.596 -6.884 1.00 0.00 H ATOM 2696 N GLU B 102 97.649 -24.701 -5.074 1.00 17.72 N ATOM 2697 CA GLU B 102 98.948 -24.602 -4.412 1.00 20.37 C ATOM 2698 C GLU B 102 99.755 -23.424 -4.943 1.00 21.10 C ATOM 2699 O GLU B 102 100.468 -22.758 -4.179 1.00 24.35 O ATOM 2700 CB GLU B 102 99.739 -25.902 -4.591 1.00 23.33 C ATOM 2701 CG GLU B 102 99.140 -27.105 -3.863 1.00 28.65 C ATOM 2702 CD GLU B 102 100.046 -28.337 -3.870 1.00 44.34 C ATOM 2703 OE1 GLU B 102 100.875 -28.493 -4.793 1.00 40.42 O ATOM 2704 OE2 GLU B 102 99.926 -29.159 -2.937 1.00 50.50 O ATOM 2705 H GLU B 102 97.468 -25.467 -5.754 1.00 0.00 H ATOM 2706 N ARG B 103 99.665 -23.163 -6.247 1.00 16.93 N ATOM 2707 CA ARG B 103 100.419 -22.099 -6.894 1.00 15.13 C ATOM 2708 C ARG B 103 99.590 -20.846 -7.119 1.00 18.41 C ATOM 2709 O ARG B 103 100.140 -19.834 -7.572 1.00 17.08 O ATOM 2710 CB ARG B 103 100.973 -22.588 -8.228 1.00 15.01 C ATOM 2711 CG ARG B 103 101.844 -23.837 -8.070 1.00 15.82 C ATOM 2712 CD ARG B 103 102.756 -23.998 -9.282 1.00 16.20 C ATOM 2713 NE ARG B 103 103.485 -25.267 -9.304 1.00 17.00 N ATOM 2714 CZ ARG B 103 104.704 -25.446 -8.815 1.00 18.25 C ATOM 2715 NH1 ARG B 103 105.359 -24.449 -8.217 1.00 18.93 N ATOM 2716 NH2 ARG B 103 105.283 -26.639 -8.926 1.00 19.03 N ATOM 2717 HE ARG B 103 103.013 -26.087 -9.734 1.00 0.00 H ATOM 2718 HH12 ARG B 103 106.315 -24.608 -7.839 1.00 0.00 H ATOM 2719 HH11 ARG B 103 104.914 -23.513 -8.129 1.00 0.00 H ATOM 2720 HH22 ARG B 103 106.239 -26.790 -8.546 1.00 0.00 H ATOM 2721 HH21 ARG B 103 104.779 -27.420 -9.393 1.00 0.00 H ATOM 2722 H ARG B 103 99.028 -23.745 -6.828 1.00 0.00 H ATOM 2723 N ARG B 104 98.295 -20.904 -6.812 1.00 17.46 N ATOM 2724 CA ARG B 104 97.350 -19.796 -6.984 1.00 14.95 C ATOM 2725 C ARG B 104 97.294 -19.339 -8.444 1.00 15.82 C ATOM 2726 O ARG B 104 97.509 -18.166 -8.782 1.00 16.28 O ATOM 2727 CB ARG B 104 97.678 -18.636 -6.040 1.00 14.78 C ATOM 2728 CG ARG B 104 97.585 -19.041 -4.572 1.00 16.33 C ATOM 2729 CD ARG B 104 97.612 -17.813 -3.661 1.00 20.95 C ATOM 2730 NE ARG B 104 97.479 -18.171 -2.251 1.00 25.66 N ATOM 2731 CZ ARG B 104 98.416 -17.928 -1.343 1.00 25.35 C ATOM 2732 NH1 ARG B 104 99.543 -17.333 -1.709 1.00 28.83 N ATOM 2733 NH2 ARG B 104 98.234 -18.285 -0.079 1.00 30.43 N ATOM 2734 HE ARG B 104 96.604 -18.641 -1.942 1.00 0.00 H ATOM 2735 HH12 ARG B 104 100.282 -17.139 -1.003 1.00 0.00 H ATOM 2736 HH11 ARG B 104 99.688 -17.060 -2.702 1.00 0.00 H ATOM 2737 HH22 ARG B 104 98.972 -18.092 0.627 1.00 0.00 H ATOM 2738 HH21 ARG B 104 97.353 -18.758 0.206 1.00 0.00 H ATOM 2739 H ARG B 104 97.929 -21.797 -6.424 1.00 0.00 H ATOM 2740 N VAL B 105 96.941 -20.294 -9.303 1.00 13.95 N ATOM 2741 CA VAL B 105 96.742 -20.082 -10.733 1.00 13.62 C ATOM 2742 C VAL B 105 95.370 -20.631 -11.093 1.00 15.75 C ATOM 2743 O VAL B 105 95.050 -21.771 -10.744 1.00 16.06 O ATOM 2744 CB VAL B 105 97.811 -20.805 -11.581 1.00 15.78 C ATOM 2745 CG1 VAL B 105 97.623 -20.455 -13.060 1.00 16.83 C ATOM 2746 CG2 VAL B 105 99.212 -20.458 -11.121 1.00 17.87 C ATOM 2747 H VAL B 105 96.798 -21.254 -8.930 1.00 0.00 H ATOM 2748 N THR B 106 94.569 -19.847 -11.808 1.00 16.17 N ATOM 2749 CA THR B 106 93.338 -20.390 -12.368 1.00 15.31 C ATOM 2750 C THR B 106 93.071 -19.745 -13.721 1.00 17.65 C ATOM 2751 O THR B 106 93.601 -18.682 -14.042 1.00 17.05 O ATOM 2752 CB THR B 106 92.154 -20.210 -11.409 1.00 17.96 C ATOM 2753 OG1 THR B 106 91.029 -20.966 -11.891 1.00 20.26 O ATOM 2754 CG2 THR B 106 91.783 -18.738 -11.267 1.00 19.72 C ATOM 2755 HG1 THR B 106 90.265 -20.850 -11.272 1.00 0.00 H ATOM 2756 H THR B 106 94.820 -18.850 -11.967 1.00 0.00 H ATOM 2757 N GLY B 107 92.278 -20.418 -14.544 1.00 15.39 N ATOM 2758 CA GLY B 107 92.053 -19.910 -15.886 1.00 16.28 C ATOM 2759 C GLY B 107 90.821 -20.528 -16.480 1.00 16.30 C ATOM 2760 O GLY B 107 90.411 -21.622 -16.092 1.00 16.08 O ATOM 2761 H GLY B 107 91.823 -21.299 -14.232 1.00 0.00 H ATOM 2762 N PHE B 108 90.223 -19.831 -17.453 1.00 15.13 N ATOM 2763 CA PHE B 108 89.000 -20.327 -18.066 1.00 17.13 C ATOM 2764 C PHE B 108 88.988 -19.982 -19.544 1.00 19.08 C ATOM 2765 O PHE B 108 89.749 -19.135 -20.016 1.00 18.37 O ATOM 2766 CB PHE B 108 87.726 -19.775 -17.386 1.00 16.10 C ATOM 2767 CG PHE B 108 87.485 -18.301 -17.615 1.00 17.94 C ATOM 2768 CD1 PHE B 108 86.726 -17.865 -18.692 1.00 18.55 C ATOM 2769 CD2 PHE B 108 87.997 -17.361 -16.734 1.00 18.69 C ATOM 2770 CE1 PHE B 108 86.501 -16.504 -18.909 1.00 18.20 C ATOM 2771 CE2 PHE B 108 87.775 -16.003 -16.942 1.00 19.37 C ATOM 2772 CZ PHE B 108 87.022 -15.578 -18.022 1.00 16.55 C ATOM 2773 H PHE B 108 90.634 -18.931 -17.773 1.00 0.00 H ATOM 2774 N SER B 109 88.096 -20.651 -20.273 1.00 16.44 N ATOM 2775 CA SER B 109 87.914 -20.410 -21.694 1.00 17.80 C ATOM 2776 C SER B 109 86.435 -20.216 -21.988 1.00 18.05 C ATOM 2777 O SER B 109 85.576 -20.846 -21.357 1.00 18.36 O ATOM 2778 CB SER B 109 88.477 -21.576 -22.543 1.00 18.57 C ATOM 2779 OG SER B 109 87.973 -22.842 -22.110 1.00 19.77 O ATOM 2780 HG SER B 109 88.230 -22.993 -21.166 1.00 0.00 H ATOM 2781 H SER B 109 87.508 -21.372 -19.808 1.00 0.00 H ATOM 2782 N ILE B 110 86.142 -19.336 -22.938 1.00 16.70 N ATOM 2783 CA ILE B 110 84.787 -19.213 -23.458 1.00 15.36 C ATOM 2784 C ILE B 110 84.571 -20.297 -24.506 1.00 18.29 C ATOM 2785 O ILE B 110 85.348 -20.416 -25.465 1.00 20.87 O ATOM 2786 CB ILE B 110 84.554 -17.815 -24.048 1.00 17.02 C ATOM 2787 CG1 ILE B 110 84.738 -16.752 -22.959 1.00 17.67 C ATOM 2788 CG2 ILE B 110 83.172 -17.755 -24.673 1.00 20.60 C ATOM 2789 CD1 ILE B 110 84.327 -15.325 -23.368 1.00 18.34 C ATOM 2790 H ILE B 110 86.893 -18.724 -23.317 1.00 0.00 H ATOM 2791 N ILE B 111 83.513 -21.094 -24.332 1.00 17.40 N ATOM 2792 CA ILE B 111 83.227 -22.206 -25.232 1.00 17.86 C ATOM 2793 C ILE B 111 81.857 -22.086 -25.894 1.00 21.48 C ATOM 2794 O ILE B 111 81.426 -23.002 -26.599 1.00 25.85 O ATOM 2795 CB ILE B 111 83.362 -23.560 -24.502 1.00 19.39 C ATOM 2796 CG1 ILE B 111 82.350 -23.650 -23.349 1.00 20.86 C ATOM 2797 CG2 ILE B 111 84.773 -23.741 -23.980 1.00 19.60 C ATOM 2798 CD1 ILE B 111 82.180 -25.080 -22.806 1.00 24.96 C ATOM 2799 H ILE B 111 82.874 -20.916 -23.531 1.00 0.00 H ATOM 2800 N GLY B 112 81.161 -20.971 -25.695 1.00 19.71 N ATOM 2801 CA GLY B 112 79.896 -20.764 -26.380 1.00 22.11 C ATOM 2802 C GLY B 112 79.297 -19.440 -25.963 1.00 20.04 C ATOM 2803 O GLY B 112 79.867 -18.705 -25.156 1.00 21.73 O ATOM 2804 H GLY B 112 81.523 -20.243 -25.046 1.00 0.00 H ATOM 2805 N GLY B 113 78.155 -19.131 -26.561 1.00 25.03 N ATOM 2806 CA GLY B 113 77.364 -17.979 -26.167 1.00 27.43 C ATOM 2807 C GLY B 113 77.249 -16.945 -27.277 1.00 28.10 C ATOM 2808 O GLY B 113 77.896 -17.015 -28.322 1.00 27.02 O ATOM 2809 H GLY B 113 77.815 -19.733 -27.338 1.00 0.00 H ATOM 2810 N GLU B 114 76.393 -15.960 -27.018 1.00 30.21 N ATOM 2811 CA GLU B 114 76.161 -14.851 -27.942 1.00 33.63 C ATOM 2812 C GLU B 114 77.003 -13.665 -27.477 1.00 33.80 C ATOM 2813 O GLU B 114 76.622 -12.948 -26.548 1.00 34.17 O ATOM 2814 CB GLU B 114 74.678 -14.503 -28.002 1.00 37.93 C ATOM 2815 CG GLU B 114 74.230 -13.915 -29.328 1.00 49.20 C ATOM 2816 CD GLU B 114 72.731 -13.679 -29.381 1.00 57.50 C ATOM 2817 OE1 GLU B 114 72.124 -13.479 -28.308 1.00 54.92 O ATOM 2818 OE2 GLU B 114 72.159 -13.701 -30.493 1.00 64.45 O ATOM 2819 H GLU B 114 75.867 -15.980 -26.121 1.00 0.00 H ATOM 2820 N HIS B 115 78.139 -13.457 -28.140 1.00 30.02 N ATOM 2821 CA HIS B 115 79.106 -12.406 -27.824 1.00 29.18 C ATOM 2822 C HIS B 115 80.091 -12.323 -28.988 1.00 34.17 C ATOM 2823 O HIS B 115 80.010 -13.097 -29.945 1.00 35.54 O ATOM 2824 CB HIS B 115 79.832 -12.723 -26.521 1.00 26.52 C ATOM 2825 CG HIS B 115 80.414 -14.092 -26.521 1.00 28.65 C ATOM 2826 ND1 HIS B 115 81.537 -14.415 -27.250 1.00 31.00 N ATOM 2827 CD2 HIS B 115 79.984 -15.244 -25.956 1.00 30.68 C ATOM 2828 CE1 HIS B 115 81.792 -15.704 -27.109 1.00 26.71 C ATOM 2829 NE2 HIS B 115 80.863 -16.228 -26.330 1.00 28.81 N ATOM 2830 H HIS B 115 78.354 -14.087 -28.939 1.00 0.00 H ATOM 2831 N ARG B 116 81.063 -11.413 -28.875 1.00 36.93 N ATOM 2832 CA ARG B 116 82.039 -11.178 -29.934 1.00 32.51 C ATOM 2833 C ARG B 116 83.471 -11.522 -29.520 1.00 37.98 C ATOM 2834 O ARG B 116 84.423 -11.016 -30.123 1.00 52.63 O ATOM 2835 CB ARG B 116 81.952 -9.723 -30.400 1.00 39.45 C ATOM 2836 CG ARG B 116 80.616 -9.363 -31.032 1.00 48.51 C ATOM 2837 CD ARG B 116 80.517 -7.873 -31.338 1.00 64.06 C ATOM 2838 NE ARG B 116 79.460 -7.577 -32.302 1.00 77.94 N ATOM 2839 CZ ARG B 116 79.141 -6.352 -32.710 1.00 90.30 C ATOM 2840 NH1 ARG B 116 79.794 -5.300 -32.231 1.00 94.40 N ATOM 2841 NH2 ARG B 116 78.167 -6.175 -33.595 1.00 92.94 N ATOM 2842 HE ARG B 116 78.922 -8.376 -32.695 1.00 0.00 H ATOM 2843 HH12 ARG B 116 79.544 -4.343 -32.551 1.00 0.00 H ATOM 2844 HH11 ARG B 116 80.556 -5.433 -31.536 1.00 0.00 H ATOM 2845 HH22 ARG B 116 77.920 -5.216 -33.912 1.00 0.00 H ATOM 2846 HH21 ARG B 116 77.651 -6.996 -33.971 1.00 0.00 H ATOM 2847 H ARG B 116 81.126 -10.852 -28.001 1.00 0.00 H ATOM 2848 N LEU B 117 83.653 -12.382 -28.524 1.00 28.19 N ATOM 2849 CA LEU B 117 84.981 -12.708 -28.003 1.00 24.98 C ATOM 2850 C LEU B 117 85.311 -14.169 -28.286 1.00 31.00 C ATOM 2851 O LEU B 117 85.494 -14.971 -27.363 1.00 35.58 O ATOM 2852 CB LEU B 117 85.061 -12.424 -26.492 1.00 25.58 C ATOM 2853 CG LEU B 117 84.888 -10.984 -26.027 1.00 31.93 C ATOM 2854 CD1 LEU B 117 85.027 -10.921 -24.512 1.00 31.77 C ATOM 2855 CD2 LEU B 117 85.905 -10.082 -26.700 1.00 31.50 C ATOM 2856 H LEU B 117 82.822 -12.840 -28.099 1.00 0.00 H ATOM 2857 N THR B 118 85.419 -14.515 -29.568 1.00 22.90 N ATOM 2858 CA THR B 118 85.680 -15.909 -29.894 1.00 21.80 C ATOM 2859 C THR B 118 87.084 -16.311 -29.449 1.00 20.93 C ATOM 2860 O THR B 118 88.042 -15.532 -29.548 1.00 19.73 O ATOM 2861 CB THR B 118 85.473 -16.190 -31.391 1.00 21.61 C ATOM 2862 OG1 THR B 118 86.312 -15.358 -32.206 1.00 23.87 O ATOM 2863 CG2 THR B 118 84.017 -15.959 -31.776 1.00 29.32 C ATOM 2864 HG1 THR B 118 87.261 -15.530 -31.984 1.00 0.00 H ATOM 2865 H THR B 118 85.319 -13.804 -30.320 1.00 0.00 H ATOM 2866 N ASN B 119 87.183 -17.543 -28.939 1.00 19.39 N ATOM 2867 CA ASN B 119 88.432 -18.143 -28.482 1.00 19.45 C ATOM 2868 C ASN B 119 89.098 -17.311 -27.392 1.00 21.27 C ATOM 2869 O ASN B 119 90.327 -17.304 -27.265 1.00 22.44 O ATOM 2870 CB ASN B 119 89.381 -18.388 -29.655 1.00 18.69 C ATOM 2871 CG ASN B 119 88.883 -19.502 -30.557 1.00 22.13 C ATOM 2872 OD1 ASN B 119 88.653 -20.623 -30.099 1.00 24.61 O ATOM 2873 ND2 ASN B 119 88.673 -19.192 -31.835 1.00 20.28 N ATOM 2874 HD22 ASN B 119 88.881 -18.233 -32.178 1.00 0.00 H ATOM 2875 HD21 ASN B 119 88.301 -19.909 -32.490 1.00 0.00 H ATOM 2876 H ASN B 119 86.314 -18.110 -28.863 1.00 0.00 H ATOM 2877 N TYR B 120 88.282 -16.630 -26.589 1.00 19.56 N ATOM 2878 CA TYR B 120 88.769 -15.956 -25.394 1.00 17.35 C ATOM 2879 C TYR B 120 89.245 -16.967 -24.359 1.00 20.50 C ATOM 2880 O TYR B 120 88.530 -17.917 -24.031 1.00 21.23 O ATOM 2881 CB TYR B 120 87.658 -15.097 -24.792 1.00 18.25 C ATOM 2882 CG TYR B 120 88.103 -14.245 -23.616 1.00 18.66 C ATOM 2883 CD1 TYR B 120 88.598 -12.961 -23.820 1.00 19.78 C ATOM 2884 CD2 TYR B 120 88.022 -14.715 -22.300 1.00 16.67 C ATOM 2885 CE1 TYR B 120 89.000 -12.176 -22.768 1.00 20.73 C ATOM 2886 CE2 TYR B 120 88.426 -13.924 -21.233 1.00 17.96 C ATOM 2887 CZ TYR B 120 88.917 -12.656 -21.475 1.00 20.81 C ATOM 2888 OH TYR B 120 89.318 -11.849 -20.435 1.00 23.78 O ATOM 2889 HH TYR B 120 88.553 -11.692 -19.827 1.00 0.00 H ATOM 2890 H TYR B 120 87.270 -16.578 -26.822 1.00 0.00 H ATOM 2891 N LYS B 121 90.446 -16.750 -23.827 1.00 19.57 N ATOM 2892 CA LYS B 121 90.984 -17.584 -22.757 1.00 16.46 C ATOM 2893 C LYS B 121 91.700 -16.659 -21.785 1.00 15.99 C ATOM 2894 O LYS B 121 92.428 -15.764 -22.207 1.00 20.48 O ATOM 2895 CB LYS B 121 91.959 -18.651 -23.277 1.00 25.58 C ATOM 2896 CG LYS B 121 91.384 -19.551 -24.361 1.00 38.90 C ATOM 2897 CD LYS B 121 92.365 -20.633 -24.775 1.00 52.02 C ATOM 2898 CE LYS B 121 92.038 -21.176 -26.165 1.00 58.38 C ATOM 2899 NZ LYS B 121 90.587 -21.464 -26.353 1.00 55.42 N ATOM 2900 HZ1 LYS B 121 90.283 -22.174 -25.657 1.00 0.00 H ATOM 2901 HZ2 LYS B 121 90.041 -20.589 -26.219 1.00 0.00 H ATOM 2902 HZ3 LYS B 121 90.429 -21.829 -27.314 1.00 0.00 H ATOM 2903 H LYS B 121 91.020 -15.960 -24.186 1.00 0.00 H ATOM 2904 N SER B 122 91.483 -16.869 -20.489 1.00 17.19 N ATOM 2905 CA SER B 122 92.025 -15.992 -19.453 1.00 16.67 C ATOM 2906 C SER B 122 92.798 -16.816 -18.426 1.00 18.84 C ATOM 2907 O SER B 122 92.454 -17.967 -18.151 1.00 19.23 O ATOM 2908 CB SER B 122 90.895 -15.222 -18.760 1.00 21.36 C ATOM 2909 OG SER B 122 91.369 -14.526 -17.624 1.00 33.01 O ATOM 2910 HG SER B 122 91.753 -15.172 -16.979 1.00 0.00 H ATOM 2911 H SER B 122 90.907 -17.686 -20.203 1.00 0.00 H ATOM 2912 N VAL B 123 93.861 -16.227 -17.870 1.00 18.20 N ATOM 2913 CA VAL B 123 94.613 -16.832 -16.769 1.00 15.87 C ATOM 2914 C VAL B 123 94.798 -15.778 -15.683 1.00 15.85 C ATOM 2915 O VAL B 123 95.173 -14.639 -15.982 1.00 16.01 O ATOM 2916 CB VAL B 123 95.978 -17.370 -17.230 1.00 18.21 C ATOM 2917 CG1 VAL B 123 96.780 -17.891 -16.027 1.00 24.73 C ATOM 2918 CG2 VAL B 123 95.782 -18.489 -18.238 1.00 21.51 C ATOM 2919 H VAL B 123 94.166 -15.302 -18.234 1.00 0.00 H ATOM 2920 N THR B 124 94.529 -16.156 -14.425 1.00 14.37 N ATOM 2921 CA THR B 124 94.634 -15.249 -13.282 1.00 14.82 C ATOM 2922 C THR B 124 95.588 -15.861 -12.264 1.00 17.98 C ATOM 2923 O THR B 124 95.482 -17.050 -11.951 1.00 17.77 O ATOM 2924 CB THR B 124 93.275 -15.010 -12.616 1.00 17.34 C ATOM 2925 OG1 THR B 124 92.395 -14.328 -13.517 1.00 19.73 O ATOM 2926 CG2 THR B 124 93.438 -14.148 -11.362 1.00 20.00 C ATOM 2927 HG1 THR B 124 92.266 -14.878 -14.330 1.00 0.00 H ATOM 2928 H THR B 124 94.232 -17.138 -14.254 1.00 0.00 H ATOM 2929 N THR B 125 96.522 -15.062 -11.757 1.00 14.45 N ATOM 2930 CA THR B 125 97.429 -15.537 -10.718 1.00 13.40 C ATOM 2931 C THR B 125 97.463 -14.527 -9.577 1.00 14.49 C ATOM 2932 O THR B 125 97.282 -13.327 -9.786 1.00 15.48 O ATOM 2933 CB THR B 125 98.853 -15.799 -11.252 1.00 14.91 C ATOM 2934 OG1 THR B 125 99.390 -14.617 -11.865 1.00 16.04 O ATOM 2935 CG2 THR B 125 98.842 -16.929 -12.265 1.00 15.10 C ATOM 2936 HG1 THR B 125 99.427 -13.888 -11.196 1.00 0.00 H ATOM 2937 H THR B 125 96.607 -14.086 -12.106 1.00 0.00 H ATOM 2938 N VAL B 126 97.679 -15.024 -8.360 1.00 13.77 N ATOM 2939 CA VAL B 126 97.614 -14.211 -7.143 1.00 13.81 C ATOM 2940 C VAL B 126 98.953 -14.313 -6.421 1.00 16.76 C ATOM 2941 O VAL B 126 99.481 -15.418 -6.239 1.00 15.74 O ATOM 2942 CB VAL B 126 96.458 -14.661 -6.231 1.00 14.79 C ATOM 2943 CG1 VAL B 126 96.482 -13.907 -4.897 1.00 15.97 C ATOM 2944 CG2 VAL B 126 95.110 -14.425 -6.930 1.00 15.69 C ATOM 2945 H VAL B 126 97.904 -16.035 -8.270 1.00 0.00 H ATOM 2946 N HIS B 127 99.503 -13.167 -6.013 1.00 15.30 N ATOM 2947 CA HIS B 127 100.899 -13.076 -5.592 1.00 15.00 C ATOM 2948 C HIS B 127 101.031 -12.394 -4.243 1.00 15.60 C ATOM 2949 O HIS B 127 100.444 -11.330 -4.015 1.00 16.42 O ATOM 2950 CB HIS B 127 101.704 -12.324 -6.643 1.00 15.00 C ATOM 2951 CG HIS B 127 101.535 -12.911 -8.001 1.00 14.97 C ATOM 2952 ND1 HIS B 127 102.307 -13.962 -8.444 1.00 15.92 N ATOM 2953 CD2 HIS B 127 100.631 -12.662 -8.978 1.00 14.98 C ATOM 2954 CE1 HIS B 127 101.912 -14.310 -9.657 1.00 15.43 C ATOM 2955 NE2 HIS B 127 100.889 -13.543 -10.001 1.00 15.27 N ATOM 2956 H HIS B 127 98.917 -12.308 -5.994 1.00 0.00 H ATOM 2957 N ARG B 128 101.831 -13.000 -3.369 1.00 16.63 N ATOM 2958 CA ARG B 128 102.125 -12.458 -2.050 1.00 17.51 C ATOM 2959 C ARG B 128 103.309 -11.507 -2.110 1.00 17.42 C ATOM 2960 O ARG B 128 104.360 -11.840 -2.676 1.00 19.54 O ATOM 2961 CB ARG B 128 102.441 -13.577 -1.059 1.00 19.36 C ATOM 2962 CG ARG B 128 102.967 -13.073 0.284 1.00 20.64 C ATOM 2963 CD ARG B 128 103.364 -14.235 1.182 1.00 26.30 C ATOM 2964 NE ARG B 128 102.255 -15.171 1.329 1.00 35.40 N ATOM 2965 CZ ARG B 128 101.337 -15.101 2.290 1.00 43.25 C ATOM 2966 NH1 ARG B 128 101.397 -14.133 3.202 1.00 42.02 N ATOM 2967 NH2 ARG B 128 100.358 -16.000 2.338 1.00 46.78 N ATOM 2968 HE ARG B 128 102.177 -15.944 0.637 1.00 0.00 H ATOM 2969 HH12 ARG B 128 100.679 -14.080 3.952 1.00 0.00 H ATOM 2970 HH11 ARG B 128 102.162 -13.430 3.164 1.00 0.00 H ATOM 2971 HH22 ARG B 128 99.640 -15.947 3.088 1.00 0.00 H ATOM 2972 HH21 ARG B 128 100.311 -16.756 1.625 1.00 0.00 H ATOM 2973 H ARG B 128 102.267 -13.904 -3.641 1.00 0.00 H ATOM 2974 N PHE B 129 103.148 -10.357 -1.469 1.00 17.40 N ATOM 2975 CA PHE B 129 104.224 -9.417 -1.224 1.00 18.42 C ATOM 2976 C PHE B 129 104.343 -9.141 0.266 1.00 18.62 C ATOM 2977 O PHE B 129 103.339 -9.044 0.978 1.00 19.86 O ATOM 2978 CB PHE B 129 103.991 -8.119 -1.987 1.00 19.32 C ATOM 2979 CG PHE B 129 104.377 -8.212 -3.417 1.00 17.74 C ATOM 2980 CD1 PHE B 129 103.497 -8.741 -4.346 1.00 17.70 C ATOM 2981 CD2 PHE B 129 105.645 -7.819 -3.834 1.00 19.78 C ATOM 2982 CE1 PHE B 129 103.863 -8.862 -5.685 1.00 16.99 C ATOM 2983 CE2 PHE B 129 106.015 -7.932 -5.164 1.00 19.66 C ATOM 2984 CZ PHE B 129 105.116 -8.453 -6.095 1.00 19.51 C ATOM 2985 H PHE B 129 102.197 -10.116 -1.123 1.00 0.00 H ATOM 2986 N GLU B 130 105.581 -9.046 0.735 1.00 20.50 N ATOM 2987 CA GLU B 130 105.860 -8.775 2.133 1.00 22.52 C ATOM 2988 C GLU B 130 107.064 -7.853 2.192 1.00 26.67 C ATOM 2989 O GLU B 130 108.040 -8.048 1.463 1.00 31.68 O ATOM 2990 CB GLU B 130 106.115 -10.080 2.901 1.00 26.38 C ATOM 2991 CG GLU B 130 106.217 -9.933 4.410 1.00 40.53 C ATOM 2992 CD GLU B 130 105.928 -11.238 5.137 1.00 51.47 C ATOM 2993 OE1 GLU B 130 105.328 -12.150 4.524 1.00 53.07 O ATOM 2994 OE2 GLU B 130 106.298 -11.347 6.324 1.00 57.02 O ATOM 2995 H GLU B 130 106.378 -9.170 0.078 1.00 0.00 H ATOM 2996 N LYS B 131 106.979 -6.837 3.042 1.00 25.02 N ATOM 2997 CA LYS B 131 108.107 -5.936 3.264 1.00 27.54 C ATOM 2998 C LYS B 131 107.929 -5.325 4.639 1.00 24.12 C ATOM 2999 O LYS B 131 106.907 -4.682 4.896 1.00 30.09 O ATOM 3000 CB LYS B 131 108.183 -4.849 2.191 1.00 33.62 C ATOM 3001 CG LYS B 131 109.479 -4.046 2.226 1.00 44.36 C ATOM 3002 CD LYS B 131 109.537 -3.035 1.095 1.00 51.11 C ATOM 3003 CE LYS B 131 110.974 -2.774 0.667 1.00 59.74 C ATOM 3004 NZ LYS B 131 111.834 -2.342 1.805 1.00 64.29 N ATOM 3005 HZ1 LYS B 131 111.454 -1.463 2.211 1.00 0.00 H ATOM 3006 HZ2 LYS B 131 111.844 -3.086 2.532 1.00 0.00 H ATOM 3007 HZ3 LYS B 131 112.802 -2.177 1.463 1.00 0.00 H ATOM 3008 H LYS B 131 106.091 -6.679 3.560 1.00 0.00 H ATOM 3009 N GLU B 132 108.913 -5.526 5.512 1.00 27.34 N ATOM 3010 CA GLU B 132 108.833 -5.106 6.915 1.00 32.54 C ATOM 3011 C GLU B 132 107.565 -5.734 7.488 1.00 31.55 C ATOM 3012 O GLU B 132 107.377 -6.952 7.336 1.00 34.87 O ATOM 3013 CB GLU B 132 108.921 -3.585 7.015 1.00 37.62 C ATOM 3014 CG GLU B 132 110.269 -3.014 6.619 1.00 43.13 C ATOM 3015 CD GLU B 132 111.390 -3.428 7.561 1.00 51.87 C ATOM 3016 OE1 GLU B 132 111.100 -3.809 8.717 1.00 51.23 O ATOM 3017 OE2 GLU B 132 112.564 -3.368 7.141 1.00 51.81 O ATOM 3018 H GLU B 132 109.778 -6.002 5.185 1.00 0.00 H ATOM 3019 N ASN B 133 106.674 -4.964 8.109 1.00 29.59 N ATOM 3020 CA ASN B 133 105.469 -5.499 8.726 1.00 33.47 C ATOM 3021 C ASN B 133 104.248 -5.392 7.825 1.00 31.53 C ATOM 3022 O ASN B 133 103.120 -5.455 8.325 1.00 38.28 O ATOM 3023 CB ASN B 133 105.200 -4.792 10.060 1.00 35.37 C ATOM 3024 CG ASN B 133 105.097 -3.284 9.914 1.00 43.02 C ATOM 3025 OD1 ASN B 133 105.652 -2.702 8.986 1.00 37.90 O ATOM 3026 ND2 ASN B 133 104.394 -2.644 10.844 1.00 49.82 N ATOM 3027 HD22 ASN B 133 103.941 -3.178 11.613 1.00 0.00 H ATOM 3028 HD21 ASN B 133 104.298 -1.609 10.803 1.00 0.00 H ATOM 3029 H ASN B 133 106.846 -3.939 8.155 1.00 0.00 H ATOM 3030 N ARG B 134 104.440 -5.235 6.518 1.00 24.15 N ATOM 3031 CA ARG B 134 103.338 -5.114 5.577 1.00 20.61 C ATOM 3032 C ARG B 134 103.224 -6.363 4.717 1.00 28.71 C ATOM 3033 O ARG B 134 104.229 -6.883 4.224 1.00 25.48 O ATOM 3034 CB ARG B 134 103.517 -3.906 4.655 1.00 25.70 C ATOM 3035 CG ARG B 134 103.317 -2.567 5.303 1.00 34.16 C ATOM 3036 CD ARG B 134 103.303 -1.481 4.241 1.00 35.25 C ATOM 3037 NE ARG B 134 104.494 -1.518 3.393 1.00 47.16 N ATOM 3038 CZ ARG B 134 104.480 -1.667 2.068 1.00 44.86 C ATOM 3039 NH1 ARG B 134 103.330 -1.789 1.413 1.00 40.96 N ATOM 3040 NH2 ARG B 134 105.624 -1.681 1.392 1.00 43.96 N ATOM 3041 HE ARG B 134 105.420 -1.421 3.857 1.00 0.00 H ATOM 3042 HH12 ARG B 134 103.330 -1.905 0.379 1.00 0.00 H ATOM 3043 HH11 ARG B 134 102.430 -1.769 1.934 1.00 0.00 H ATOM 3044 HH22 ARG B 134 105.616 -1.797 0.359 1.00 0.00 H ATOM 3045 HH21 ARG B 134 106.527 -1.576 1.896 1.00 0.00 H ATOM 3046 H ARG B 134 105.414 -5.197 6.156 1.00 0.00 H ATOM 3047 N ILE B 135 101.991 -6.816 4.508 1.00 23.55 N ATOM 3048 CA ILE B 135 101.687 -7.915 3.601 1.00 20.09 C ATOM 3049 C ILE B 135 100.618 -7.428 2.635 1.00 18.66 C ATOM 3050 O ILE B 135 99.587 -6.897 3.065 1.00 22.22 O ATOM 3051 CB ILE B 135 101.193 -9.165 4.355 1.00 24.91 C ATOM 3052 CG1 ILE B 135 102.243 -9.653 5.357 1.00 30.67 C ATOM 3053 CG2 ILE B 135 100.823 -10.269 3.366 1.00 22.89 C ATOM 3054 CD1 ILE B 135 101.694 -10.648 6.368 1.00 31.81 C ATOM 3055 H ILE B 135 101.205 -6.363 5.017 1.00 0.00 H ATOM 3056 N TRP B 136 100.857 -7.587 1.336 1.00 15.57 N ATOM 3057 CA TRP B 136 99.845 -7.201 0.355 1.00 15.38 C ATOM 3058 C TRP B 136 99.863 -8.182 -0.809 1.00 16.49 C ATOM 3059 O TRP B 136 100.668 -9.118 -0.848 1.00 18.04 O ATOM 3060 CB TRP B 136 100.038 -5.747 -0.107 1.00 19.09 C ATOM 3061 CG TRP B 136 101.231 -5.451 -0.999 1.00 16.05 C ATOM 3062 CD1 TRP B 136 101.214 -5.286 -2.358 1.00 17.06 C ATOM 3063 CD2 TRP B 136 102.589 -5.246 -0.587 1.00 17.18 C ATOM 3064 NE1 TRP B 136 102.481 -4.997 -2.815 1.00 21.64 N ATOM 3065 CE2 TRP B 136 103.340 -4.959 -1.748 1.00 19.73 C ATOM 3066 CE3 TRP B 136 103.244 -5.280 0.647 1.00 17.49 C ATOM 3067 CZ2 TRP B 136 104.722 -4.719 -1.710 1.00 20.06 C ATOM 3068 CZ3 TRP B 136 104.614 -5.031 0.685 1.00 21.65 C ATOM 3069 CH2 TRP B 136 105.336 -4.765 -0.492 1.00 20.28 C ATOM 3070 HE1 TRP B 136 102.743 -4.834 -3.808 1.00 0.00 H ATOM 3071 H TRP B 136 101.764 -7.986 1.019 1.00 0.00 H ATOM 3072 N THR B 137 98.948 -7.969 -1.751 1.00 14.80 N ATOM 3073 CA THR B 137 98.722 -8.869 -2.870 1.00 13.95 C ATOM 3074 C THR B 137 98.841 -8.119 -4.187 1.00 14.55 C ATOM 3075 O THR B 137 98.459 -6.950 -4.293 1.00 17.17 O ATOM 3076 CB THR B 137 97.326 -9.514 -2.765 1.00 17.62 C ATOM 3077 OG1 THR B 137 97.239 -10.217 -1.522 1.00 16.03 O ATOM 3078 CG2 THR B 137 97.067 -10.490 -3.924 1.00 15.25 C ATOM 3079 HG1 THR B 137 97.374 -9.582 -0.775 1.00 0.00 H ATOM 3080 H THR B 137 98.363 -7.112 -1.683 1.00 0.00 H ATOM 3081 N VAL B 138 99.369 -8.794 -5.208 1.00 13.07 N ATOM 3082 CA VAL B 138 99.178 -8.345 -6.585 1.00 13.87 C ATOM 3083 C VAL B 138 98.477 -9.467 -7.332 1.00 16.28 C ATOM 3084 O VAL B 138 98.847 -10.637 -7.191 1.00 14.79 O ATOM 3085 CB VAL B 138 100.498 -7.972 -7.289 1.00 14.87 C ATOM 3086 CG1 VAL B 138 100.213 -7.649 -8.741 1.00 14.35 C ATOM 3087 CG2 VAL B 138 101.127 -6.754 -6.633 1.00 16.50 C ATOM 3088 H VAL B 138 99.925 -9.653 -5.022 1.00 0.00 H ATOM 3089 N VAL B 139 97.440 -9.118 -8.088 1.00 14.27 N ATOM 3090 CA VAL B 139 96.777 -10.058 -8.989 1.00 13.51 C ATOM 3091 C VAL B 139 97.215 -9.734 -10.408 1.00 15.59 C ATOM 3092 O VAL B 139 97.246 -8.557 -10.805 1.00 15.36 O ATOM 3093 CB VAL B 139 95.246 -9.980 -8.860 1.00 14.80 C ATOM 3094 CG1 VAL B 139 94.580 -10.963 -9.832 1.00 15.58 C ATOM 3095 CG2 VAL B 139 94.826 -10.273 -7.436 1.00 16.03 C ATOM 3096 H VAL B 139 97.088 -8.141 -8.036 1.00 0.00 H ATOM 3097 N LEU B 140 97.574 -10.766 -11.166 1.00 13.75 N ATOM 3098 CA LEU B 140 97.865 -10.640 -12.592 1.00 15.45 C ATOM 3099 C LEU B 140 96.790 -11.376 -13.366 1.00 14.54 C ATOM 3100 O LEU B 140 96.455 -12.517 -13.029 1.00 15.27 O ATOM 3101 CB LEU B 140 99.231 -11.233 -12.947 1.00 13.67 C ATOM 3102 CG LEU B 140 100.458 -10.523 -12.390 1.00 14.49 C ATOM 3103 CD1 LEU B 140 101.725 -11.249 -12.861 1.00 18.18 C ATOM 3104 CD2 LEU B 140 100.500 -9.037 -12.781 1.00 15.34 C ATOM 3105 H LEU B 140 97.651 -11.704 -10.724 1.00 0.00 H ATOM 3106 N GLU B 141 96.245 -10.735 -14.400 1.00 14.00 N ATOM 3107 CA GLU B 141 95.296 -11.422 -15.266 1.00 14.69 C ATOM 3108 C GLU B 141 95.641 -11.121 -16.715 1.00 16.45 C ATOM 3109 O GLU B 141 95.803 -9.956 -17.097 1.00 17.38 O ATOM 3110 CB GLU B 141 93.850 -11.011 -14.963 1.00 18.57 C ATOM 3111 CG GLU B 141 92.838 -11.802 -15.776 1.00 20.10 C ATOM 3112 CD GLU B 141 91.404 -11.473 -15.422 1.00 26.36 C ATOM 3113 OE1 GLU B 141 91.180 -10.729 -14.450 1.00 33.54 O ATOM 3114 OE2 GLU B 141 90.497 -11.968 -16.122 1.00 37.97 O ATOM 3115 H GLU B 141 96.497 -9.744 -14.589 1.00 0.00 H ATOM 3116 N SER B 142 95.763 -12.172 -17.514 1.00 17.17 N ATOM 3117 CA SER B 142 96.046 -12.023 -18.931 1.00 16.39 C ATOM 3118 C SER B 142 94.958 -12.732 -19.723 1.00 16.49 C ATOM 3119 O SER B 142 94.246 -13.598 -19.211 1.00 18.93 O ATOM 3120 CB SER B 142 97.437 -12.575 -19.300 1.00 23.24 C ATOM 3121 OG SER B 142 97.525 -13.973 -19.042 1.00 21.48 O ATOM 3122 HG SER B 142 96.844 -14.450 -19.579 1.00 0.00 H ATOM 3123 H SER B 142 95.653 -13.127 -17.116 1.00 0.00 H ATOM 3124 N TYR B 143 94.805 -12.330 -20.976 1.00 15.09 N ATOM 3125 CA TYR B 143 93.881 -13.030 -21.852 1.00 15.53 C ATOM 3126 C TYR B 143 94.474 -13.086 -23.248 1.00 19.10 C ATOM 3127 O TYR B 143 95.390 -12.333 -23.595 1.00 18.39 O ATOM 3128 CB TYR B 143 92.491 -12.361 -21.913 1.00 16.92 C ATOM 3129 CG TYR B 143 92.512 -10.989 -22.568 1.00 19.72 C ATOM 3130 CD1 TYR B 143 92.418 -10.857 -23.943 1.00 23.73 C ATOM 3131 CD2 TYR B 143 92.655 -9.838 -21.808 1.00 22.14 C ATOM 3132 CE1 TYR B 143 92.464 -9.607 -24.555 1.00 24.79 C ATOM 3133 CE2 TYR B 143 92.699 -8.582 -22.409 1.00 24.79 C ATOM 3134 CZ TYR B 143 92.602 -8.480 -23.783 1.00 24.19 C ATOM 3135 OH TYR B 143 92.646 -7.240 -24.380 1.00 27.14 O ATOM 3136 HH TYR B 143 93.507 -6.802 -24.164 1.00 0.00 H ATOM 3137 H TYR B 143 95.345 -11.515 -21.332 1.00 0.00 H ATOM 3138 N VAL B 144 93.936 -13.997 -24.035 1.00 17.78 N ATOM 3139 CA VAL B 144 94.114 -14.001 -25.479 1.00 18.86 C ATOM 3140 C VAL B 144 92.730 -14.183 -26.073 1.00 18.29 C ATOM 3141 O VAL B 144 91.859 -14.831 -25.482 1.00 18.52 O ATOM 3142 CB VAL B 144 95.087 -15.101 -25.966 1.00 24.87 C ATOM 3143 CG1 VAL B 144 94.516 -16.479 -25.690 1.00 25.88 C ATOM 3144 CG2 VAL B 144 95.379 -14.924 -27.451 1.00 27.57 C ATOM 3145 H VAL B 144 93.358 -14.747 -23.604 1.00 0.00 H ATOM 3146 N VAL B 145 92.517 -13.570 -27.238 1.00 20.70 N ATOM 3147 CA VAL B 145 91.211 -13.586 -27.881 1.00 19.41 C ATOM 3148 C VAL B 145 91.416 -13.316 -29.363 1.00 22.73 C ATOM 3149 O VAL B 145 92.412 -12.710 -29.765 1.00 26.13 O ATOM 3150 CB VAL B 145 90.256 -12.554 -27.225 1.00 19.83 C ATOM 3151 CG1 VAL B 145 90.708 -11.130 -27.511 1.00 25.68 C ATOM 3152 CG2 VAL B 145 88.833 -12.770 -27.676 1.00 20.81 C ATOM 3153 H VAL B 145 93.303 -13.068 -27.698 1.00 0.00 H ATOM 3154 N ASP B 146 90.473 -13.779 -30.177 1.00 22.09 N ATOM 3155 CA ASP B 146 90.536 -13.537 -31.612 1.00 23.96 C ATOM 3156 C ASP B 146 90.409 -12.058 -31.928 1.00 32.12 C ATOM 3157 O ASP B 146 89.685 -11.318 -31.258 1.00 29.74 O ATOM 3158 CB ASP B 146 89.426 -14.287 -32.330 1.00 24.85 C ATOM 3159 CG ASP B 146 89.678 -15.771 -32.405 1.00 23.86 C ATOM 3160 OD1 ASP B 146 90.848 -16.199 -32.300 1.00 26.34 O ATOM 3161 OD2 ASP B 146 88.692 -16.508 -32.564 1.00 24.98 O ATOM 3162 H ASP B 146 89.678 -14.322 -29.784 1.00 0.00 H ATOM 3163 N MET B 147 91.116 -11.656 -32.986 1.00 37.29 N ATOM 3164 CA MET B 147 91.078 -10.335 -33.612 1.00 49.21 C ATOM 3165 C MET B 147 91.396 -9.215 -32.634 1.00 55.97 C ATOM 3166 O MET B 147 92.452 -8.586 -32.737 1.00 56.23 O ATOM 3167 CB MET B 147 89.721 -10.101 -34.286 1.00 53.34 C ATOM 3168 CG MET B 147 88.753 -9.249 -33.491 1.00 60.02 C ATOM 3169 SD MET B 147 87.162 -9.112 -34.321 1.00 73.64 S ATOM 3170 CE MET B 147 87.683 -8.708 -35.989 1.00 65.45 C ATOM 3171 H MET B 147 91.760 -12.354 -33.409 1.00 0.00 H TER 3172 MET B 147 ATOM 3173 N ASP B 155 89.326 -1.478 -30.958 1.00 54.07 N ATOM 3174 CA ASP B 155 88.077 -1.479 -30.201 1.00 56.78 C ATOM 3175 C ASP B 155 87.906 -2.740 -29.364 1.00 57.18 C ATOM 3176 O ASP B 155 87.503 -2.668 -28.202 1.00 57.58 O ATOM 3177 CB ASP B 155 86.883 -1.320 -31.139 1.00 58.48 C ATOM 3178 CG ASP B 155 86.651 0.117 -31.534 1.00 65.97 C ATOM 3179 OD1 ASP B 155 87.147 1.014 -30.817 1.00 66.42 O ATOM 3180 OD2 ASP B 155 85.968 0.351 -32.553 1.00 75.87 O ATOM 3181 HN3 ASP B 155 89.341 -2.295 -31.601 1.00 0.00 H ATOM 3182 HN2 ASP B 155 90.129 -1.538 -30.300 1.00 0.00 H ATOM 3183 HN1 ASP B 155 89.394 -0.600 -31.510 1.00 0.00 H ATOM 3184 N THR B 156 88.200 -3.895 -29.966 1.00 56.90 N ATOM 3185 CA THR B 156 88.129 -5.156 -29.234 1.00 53.47 C ATOM 3186 C THR B 156 89.049 -5.135 -28.020 1.00 46.10 C ATOM 3187 O THR B 156 88.622 -5.420 -26.893 1.00 38.34 O ATOM 3188 CB THR B 156 88.492 -6.324 -30.155 1.00 58.37 C ATOM 3189 OG1 THR B 156 87.461 -6.507 -31.132 1.00 64.88 O ATOM 3190 CG2 THR B 156 88.671 -7.609 -29.349 1.00 51.86 C ATOM 3191 HG1 THR B 156 87.700 -7.263 -31.725 1.00 0.00 H ATOM 3192 H THR B 156 88.483 -3.896 -30.967 1.00 0.00 H ATOM 3193 N ARG B 157 90.325 -4.801 -28.234 1.00 40.39 N ATOM 3194 CA ARG B 157 91.261 -4.757 -27.119 1.00 41.78 C ATOM 3195 C ARG B 157 90.839 -3.709 -26.098 1.00 34.12 C ATOM 3196 O ARG B 157 90.950 -3.933 -24.888 1.00 33.76 O ATOM 3197 CB ARG B 157 92.675 -4.484 -27.631 1.00 47.56 C ATOM 3198 CG ARG B 157 93.744 -4.743 -26.585 1.00 54.77 C ATOM 3199 CD ARG B 157 95.141 -4.631 -27.167 1.00 66.49 C ATOM 3200 NE ARG B 157 96.155 -4.999 -26.183 1.00 70.59 N ATOM 3201 CZ ARG B 157 97.464 -4.876 -26.376 1.00 71.27 C ATOM 3202 NH1 ARG B 157 97.923 -4.386 -27.521 1.00 71.45 N ATOM 3203 NH2 ARG B 157 98.313 -5.239 -25.422 1.00 70.40 N ATOM 3204 HE ARG B 157 95.832 -5.382 -25.272 1.00 0.00 H ATOM 3205 HH12 ARG B 157 98.947 -4.290 -27.672 1.00 0.00 H ATOM 3206 HH11 ARG B 157 97.258 -4.098 -28.267 1.00 0.00 H ATOM 3207 HH22 ARG B 157 99.337 -5.143 -25.573 1.00 0.00 H ATOM 3208 HH21 ARG B 157 97.954 -5.620 -24.523 1.00 0.00 H ATOM 3209 H ARG B 157 90.649 -4.573 -29.195 1.00 0.00 H ATOM 3210 N MET B 158 90.318 -2.571 -26.569 1.00 34.93 N ATOM 3211 CA MET B 158 89.886 -1.518 -25.656 1.00 32.86 C ATOM 3212 C MET B 158 88.736 -1.992 -24.774 1.00 26.51 C ATOM 3213 O MET B 158 88.747 -1.788 -23.553 1.00 27.60 O ATOM 3214 CB MET B 158 89.489 -0.279 -26.460 1.00 39.41 C ATOM 3215 CG MET B 158 89.700 1.033 -25.737 1.00 48.77 C ATOM 3216 SD MET B 158 90.104 2.368 -26.890 1.00 52.48 S ATOM 3217 CE MET B 158 91.786 1.944 -27.344 1.00 59.72 C ATOM 3218 H MET B 158 90.220 -2.435 -27.595 1.00 0.00 H ATOM 3219 N PHE B 159 87.740 -2.650 -25.371 1.00 30.51 N ATOM 3220 CA PHE B 159 86.618 -3.165 -24.587 1.00 29.14 C ATOM 3221 C PHE B 159 87.074 -4.231 -23.593 1.00 29.29 C ATOM 3222 O PHE B 159 86.737 -4.171 -22.403 1.00 27.79 O ATOM 3223 CB PHE B 159 85.544 -3.716 -25.531 1.00 34.36 C ATOM 3224 CG PHE B 159 84.479 -4.508 -24.838 1.00 33.26 C ATOM 3225 CD1 PHE B 159 83.485 -3.874 -24.112 1.00 36.19 C ATOM 3226 CD2 PHE B 159 84.470 -5.892 -24.912 1.00 40.09 C ATOM 3227 CE1 PHE B 159 82.501 -4.608 -23.463 1.00 37.44 C ATOM 3228 CE2 PHE B 159 83.492 -6.628 -24.272 1.00 38.41 C ATOM 3229 CZ PHE B 159 82.506 -5.985 -23.545 1.00 36.88 C ATOM 3230 H PHE B 159 87.762 -2.797 -26.400 1.00 0.00 H ATOM 3231 N ALA B 160 87.841 -5.220 -24.064 1.00 25.99 N ATOM 3232 CA ALA B 160 88.259 -6.308 -23.183 1.00 23.96 C ATOM 3233 C ALA B 160 89.199 -5.816 -22.091 1.00 23.26 C ATOM 3234 O ALA B 160 89.101 -6.255 -20.940 1.00 23.78 O ATOM 3235 CB ALA B 160 88.926 -7.414 -23.999 1.00 28.18 C ATOM 3236 H ALA B 160 88.141 -5.215 -25.060 1.00 0.00 H ATOM 3237 N ASP B 161 90.136 -4.930 -22.434 1.00 22.00 N ATOM 3238 CA ASP B 161 91.024 -4.380 -21.412 1.00 24.33 C ATOM 3239 C ASP B 161 90.241 -3.638 -20.340 1.00 21.48 C ATOM 3240 O ASP B 161 90.545 -3.756 -19.149 1.00 22.97 O ATOM 3241 CB ASP B 161 92.051 -3.428 -22.031 1.00 23.96 C ATOM 3242 CG ASP B 161 93.129 -4.148 -22.801 1.00 30.62 C ATOM 3243 OD1 ASP B 161 93.282 -5.369 -22.604 1.00 26.01 O ATOM 3244 OD2 ASP B 161 93.822 -3.486 -23.603 1.00 35.95 O ATOM 3245 H ASP B 161 90.234 -4.632 -23.426 1.00 0.00 H ATOM 3246 N THR B 162 89.264 -2.819 -20.749 1.00 22.70 N ATOM 3247 CA THR B 162 88.543 -2.020 -19.764 1.00 21.38 C ATOM 3248 C THR B 162 87.729 -2.905 -18.831 1.00 18.80 C ATOM 3249 O THR B 162 87.691 -2.663 -17.621 1.00 21.08 O ATOM 3250 CB THR B 162 87.649 -0.994 -20.457 1.00 23.11 C ATOM 3251 OG1 THR B 162 88.459 -0.163 -21.297 1.00 28.20 O ATOM 3252 CG2 THR B 162 86.948 -0.121 -19.414 1.00 22.94 C ATOM 3253 HG1 THR B 162 88.913 -0.724 -21.975 1.00 0.00 H ATOM 3254 H THR B 162 89.022 -2.753 -21.758 1.00 0.00 H ATOM 3255 N VAL B 163 87.106 -3.960 -19.363 1.00 18.46 N ATOM 3256 CA VAL B 163 86.356 -4.885 -18.508 1.00 18.18 C ATOM 3257 C VAL B 163 87.286 -5.602 -17.537 1.00 16.78 C ATOM 3258 O VAL B 163 86.991 -5.717 -16.342 1.00 20.13 O ATOM 3259 CB VAL B 163 85.554 -5.887 -19.358 1.00 19.80 C ATOM 3260 CG1 VAL B 163 84.982 -7.003 -18.451 1.00 18.63 C ATOM 3261 CG2 VAL B 163 84.447 -5.158 -20.120 1.00 24.04 C ATOM 3262 H VAL B 163 87.153 -4.126 -20.389 1.00 0.00 H ATOM 3263 N VAL B 164 88.412 -6.120 -18.034 1.00 18.12 N ATOM 3264 CA VAL B 164 89.335 -6.826 -17.146 1.00 19.02 C ATOM 3265 C VAL B 164 89.814 -5.895 -16.043 1.00 16.93 C ATOM 3266 O VAL B 164 89.892 -6.282 -14.867 1.00 18.57 O ATOM 3267 CB VAL B 164 90.512 -7.414 -17.948 1.00 18.17 C ATOM 3268 CG1 VAL B 164 91.618 -7.865 -17.005 1.00 19.61 C ATOM 3269 CG2 VAL B 164 90.027 -8.587 -18.801 1.00 21.88 C ATOM 3270 H VAL B 164 88.631 -6.022 -19.046 1.00 0.00 H ATOM 3271 N LYS B 165 90.117 -4.645 -16.402 1.00 17.05 N ATOM 3272 CA LYS B 165 90.577 -3.666 -15.423 1.00 16.05 C ATOM 3273 C LYS B 165 89.504 -3.398 -14.371 1.00 18.75 C ATOM 3274 O LYS B 165 89.785 -3.394 -13.166 1.00 16.68 O ATOM 3275 CB LYS B 165 90.980 -2.375 -16.146 1.00 18.20 C ATOM 3276 CG LYS B 165 91.759 -1.384 -15.311 1.00 36.40 C ATOM 3277 CD LYS B 165 92.122 -0.155 -16.135 1.00 45.93 C ATOM 3278 CE LYS B 165 92.791 -0.546 -17.448 1.00 54.25 C ATOM 3279 NZ LYS B 165 94.097 -1.234 -17.254 1.00 62.01 N ATOM 3280 HZ1 LYS B 165 94.747 -0.603 -16.743 1.00 0.00 H ATOM 3281 HZ2 LYS B 165 93.951 -2.103 -16.702 1.00 0.00 H ATOM 3282 HZ3 LYS B 165 94.502 -1.474 -18.181 1.00 0.00 H ATOM 3283 H LYS B 165 90.023 -4.364 -17.399 1.00 0.00 H ATOM 3284 N LEU B 166 88.261 -3.191 -14.810 1.00 17.63 N ATOM 3285 CA LEU B 166 87.192 -2.901 -13.852 1.00 15.64 C ATOM 3286 C LEU B 166 86.927 -4.094 -12.944 1.00 16.78 C ATOM 3287 O LEU B 166 86.613 -3.918 -11.760 1.00 17.98 O ATOM 3288 CB LEU B 166 85.922 -2.495 -14.594 1.00 16.92 C ATOM 3289 CG LEU B 166 85.994 -1.113 -15.226 1.00 17.44 C ATOM 3290 CD1 LEU B 166 84.931 -0.983 -16.293 1.00 23.57 C ATOM 3291 CD2 LEU B 166 85.786 -0.088 -14.147 1.00 20.41 C ATOM 3292 H LEU B 166 88.052 -3.235 -15.828 1.00 0.00 H ATOM 3293 N ASN B 167 87.023 -5.309 -13.485 1.00 15.05 N ATOM 3294 CA ASN B 167 86.784 -6.497 -12.673 1.00 13.70 C ATOM 3295 C ASN B 167 87.898 -6.707 -11.663 1.00 14.92 C ATOM 3296 O ASN B 167 87.640 -7.144 -10.537 1.00 16.66 O ATOM 3297 CB ASN B 167 86.635 -7.731 -13.558 1.00 15.22 C ATOM 3298 CG ASN B 167 85.315 -7.757 -14.297 1.00 16.69 C ATOM 3299 OD1 ASN B 167 84.402 -6.994 -13.977 1.00 16.70 O ATOM 3300 ND2 ASN B 167 85.195 -8.648 -15.281 1.00 19.20 N ATOM 3301 HD22 ASN B 167 85.992 -9.273 -15.517 1.00 0.00 H ATOM 3302 HD21 ASN B 167 84.304 -8.719 -15.813 1.00 0.00 H ATOM 3303 H ASN B 167 87.269 -5.410 -14.490 1.00 0.00 H ATOM 3304 N LEU B 168 89.148 -6.445 -12.050 1.00 16.10 N ATOM 3305 CA LEU B 168 90.222 -6.528 -11.062 1.00 14.99 C ATOM 3306 C LEU B 168 90.006 -5.506 -9.957 1.00 16.70 C ATOM 3307 O LEU B 168 90.318 -5.768 -8.793 1.00 15.19 O ATOM 3308 CB LEU B 168 91.583 -6.307 -11.717 1.00 15.71 C ATOM 3309 CG LEU B 168 92.108 -7.463 -12.546 1.00 17.71 C ATOM 3310 CD1 LEU B 168 93.311 -7.013 -13.353 1.00 18.79 C ATOM 3311 CD2 LEU B 168 92.501 -8.611 -11.621 1.00 19.67 C ATOM 3312 H LEU B 168 89.354 -6.187 -13.036 1.00 0.00 H ATOM 3313 N GLN B 169 89.475 -4.336 -10.307 1.00 15.12 N ATOM 3314 CA GLN B 169 89.188 -3.332 -9.296 1.00 15.74 C ATOM 3315 C GLN B 169 88.075 -3.797 -8.360 1.00 15.07 C ATOM 3316 O GLN B 169 88.148 -3.575 -7.146 1.00 16.83 O ATOM 3317 CB GLN B 169 88.828 -2.014 -9.974 1.00 15.67 C ATOM 3318 CG GLN B 169 88.461 -0.894 -9.039 1.00 18.53 C ATOM 3319 CD GLN B 169 88.058 0.333 -9.820 1.00 22.57 C ATOM 3320 OE1 GLN B 169 86.941 0.422 -10.325 1.00 31.79 O ATOM 3321 NE2 GLN B 169 88.977 1.272 -9.953 1.00 24.28 N ATOM 3322 HE22 GLN B 169 89.909 1.154 -9.508 1.00 0.00 H ATOM 3323 HE21 GLN B 169 88.768 2.130 -10.503 1.00 0.00 H ATOM 3324 H GLN B 169 89.265 -4.140 -11.307 1.00 0.00 H ATOM 3325 N LYS B 170 87.041 -4.450 -8.891 1.00 14.56 N ATOM 3326 CA LYS B 170 86.000 -4.966 -8.002 1.00 15.42 C ATOM 3327 C LYS B 170 86.566 -6.017 -7.059 1.00 16.99 C ATOM 3328 O LYS B 170 86.248 -6.034 -5.865 1.00 16.97 O ATOM 3329 CB LYS B 170 84.834 -5.549 -8.803 1.00 17.18 C ATOM 3330 CG LYS B 170 83.759 -6.170 -7.893 1.00 15.87 C ATOM 3331 CD LYS B 170 82.485 -6.525 -8.637 1.00 13.89 C ATOM 3332 CE LYS B 170 81.484 -7.229 -7.693 1.00 16.48 C ATOM 3333 NZ LYS B 170 80.280 -7.743 -8.400 1.00 14.66 N ATOM 3334 HZ1 LYS B 170 79.782 -6.951 -8.855 1.00 0.00 H ATOM 3335 HZ2 LYS B 170 80.571 -8.432 -9.122 1.00 0.00 H ATOM 3336 HZ3 LYS B 170 79.648 -8.204 -7.715 1.00 0.00 H ATOM 3337 H LYS B 170 86.976 -4.590 -9.919 1.00 0.00 H ATOM 3338 N LEU B 171 87.376 -6.929 -7.591 1.00 14.98 N ATOM 3339 CA LEU B 171 88.048 -7.906 -6.739 1.00 12.61 C ATOM 3340 C LEU B 171 88.805 -7.207 -5.613 1.00 17.16 C ATOM 3341 O LEU B 171 88.710 -7.606 -4.448 1.00 16.06 O ATOM 3342 CB LEU B 171 88.982 -8.768 -7.591 1.00 14.75 C ATOM 3343 CG LEU B 171 89.853 -9.782 -6.863 1.00 15.38 C ATOM 3344 CD1 LEU B 171 88.991 -10.823 -6.156 1.00 16.19 C ATOM 3345 CD2 LEU B 171 90.810 -10.442 -7.848 1.00 15.40 C ATOM 3346 H LEU B 171 87.531 -6.946 -8.619 1.00 0.00 H ATOM 3347 N ALA B 172 89.536 -6.140 -5.938 1.00 14.58 N ATOM 3348 CA ALA B 172 90.268 -5.397 -4.914 1.00 15.93 C ATOM 3349 C ALA B 172 89.327 -4.820 -3.866 1.00 17.16 C ATOM 3350 O ALA B 172 89.600 -4.899 -2.661 1.00 17.18 O ATOM 3351 CB ALA B 172 91.090 -4.279 -5.564 1.00 16.11 C ATOM 3352 H ALA B 172 89.586 -5.833 -6.931 1.00 0.00 H ATOM 3353 N THR B 173 88.217 -4.230 -4.305 1.00 15.22 N ATOM 3354 CA THR B 173 87.266 -3.633 -3.374 1.00 15.62 C ATOM 3355 C THR B 173 86.673 -4.681 -2.432 1.00 17.08 C ATOM 3356 O THR B 173 86.526 -4.441 -1.227 1.00 18.40 O ATOM 3357 CB THR B 173 86.183 -2.930 -4.182 1.00 18.01 C ATOM 3358 OG1 THR B 173 86.802 -1.947 -5.032 1.00 20.62 O ATOM 3359 CG2 THR B 173 85.180 -2.250 -3.288 1.00 15.17 C ATOM 3360 HG1 THR B 173 87.439 -2.395 -5.643 1.00 0.00 H ATOM 3361 H THR B 173 88.025 -4.194 -5.327 1.00 0.00 H ATOM 3362 N VAL B 174 86.304 -5.846 -2.974 1.00 16.73 N ATOM 3363 CA VAL B 174 85.721 -6.906 -2.149 1.00 15.85 C ATOM 3364 C VAL B 174 86.729 -7.403 -1.117 1.00 15.34 C ATOM 3365 O VAL B 174 86.419 -7.521 0.080 1.00 17.03 O ATOM 3366 CB VAL B 174 85.216 -8.050 -3.046 1.00 15.99 C ATOM 3367 CG1 VAL B 174 84.820 -9.266 -2.215 1.00 21.24 C ATOM 3368 CG2 VAL B 174 84.049 -7.563 -3.880 1.00 14.74 C ATOM 3369 H VAL B 174 86.433 -6.001 -3.994 1.00 0.00 H ATOM 3370 N ALA B 175 87.948 -7.719 -1.563 1.00 14.69 N ATOM 3371 CA ALA B 175 88.960 -8.244 -0.652 1.00 14.90 C ATOM 3372 C ALA B 175 89.308 -7.227 0.425 1.00 16.02 C ATOM 3373 O ALA B 175 89.463 -7.581 1.601 1.00 15.70 O ATOM 3374 CB ALA B 175 90.218 -8.635 -1.429 1.00 14.99 C ATOM 3375 H ALA B 175 88.178 -7.590 -2.569 1.00 0.00 H ATOM 3376 N GLU B 176 89.434 -5.956 0.040 1.00 16.37 N ATOM 3377 CA GLU B 176 89.770 -4.944 1.035 1.00 16.15 C ATOM 3378 C GLU B 176 88.635 -4.729 2.031 1.00 18.94 C ATOM 3379 O GLU B 176 88.907 -4.489 3.213 1.00 18.29 O ATOM 3380 CB GLU B 176 90.181 -3.646 0.328 1.00 15.49 C ATOM 3381 CG GLU B 176 91.568 -3.805 -0.308 1.00 16.72 C ATOM 3382 CD GLU B 176 91.921 -2.761 -1.335 1.00 18.91 C ATOM 3383 OE1 GLU B 176 91.143 -1.800 -1.520 1.00 21.10 O ATOM 3384 OE2 GLU B 176 93.003 -2.905 -1.962 1.00 16.92 O ATOM 3385 H GLU B 176 89.295 -5.690 -0.956 1.00 0.00 H ATOM 3386 N ALA B 177 87.372 -4.854 1.598 1.00 15.53 N ATOM 3387 CA ALA B 177 86.261 -4.786 2.545 1.00 16.18 C ATOM 3388 C ALA B 177 86.319 -5.941 3.540 1.00 16.70 C ATOM 3389 O ALA B 177 86.080 -5.746 4.735 1.00 16.31 O ATOM 3390 CB ALA B 177 84.926 -4.787 1.798 1.00 18.02 C ATOM 3391 H ALA B 177 87.183 -5.000 0.586 1.00 0.00 H ATOM 3392 N MET B 178 86.658 -7.145 3.066 1.00 16.30 N ATOM 3393 CA MET B 178 86.733 -8.302 3.957 1.00 14.97 C ATOM 3394 C MET B 178 87.922 -8.208 4.905 1.00 15.91 C ATOM 3395 O MET B 178 87.879 -8.767 6.007 1.00 16.90 O ATOM 3396 CB MET B 178 86.823 -9.591 3.134 1.00 14.78 C ATOM 3397 CG MET B 178 85.524 -9.924 2.449 1.00 16.77 C ATOM 3398 SD MET B 178 85.744 -11.415 1.452 1.00 23.63 S ATOM 3399 CE MET B 178 84.150 -12.190 1.617 1.00 33.01 C ATOM 3400 H MET B 178 86.870 -7.259 2.054 1.00 0.00 H ATOM 3401 N ALA B 179 88.988 -7.513 4.501 1.00 15.21 N ATOM 3402 CA ALA B 179 90.203 -7.485 5.310 1.00 17.50 C ATOM 3403 C ALA B 179 90.191 -6.422 6.405 1.00 17.85 C ATOM 3404 O ALA B 179 91.114 -6.401 7.228 1.00 21.44 O ATOM 3405 CB ALA B 179 91.421 -7.273 4.406 1.00 18.17 C ATOM 3406 H ALA B 179 88.953 -6.988 3.604 1.00 0.00 H ATOM 3407 N ARG B 180 89.176 -5.558 6.460 1.00 17.94 N ATOM 3408 CA ARG B 180 89.150 -4.501 7.470 1.00 19.23 C ATOM 3409 C ARG B 180 89.161 -5.051 8.894 1.00 19.61 C ATOM 3410 O ARG B 180 88.329 -5.889 9.262 1.00 22.75 O ATOM 3411 CB ARG B 180 87.918 -3.612 7.280 1.00 19.96 C ATOM 3412 CG ARG B 180 87.971 -2.768 6.032 1.00 21.36 C ATOM 3413 CD ARG B 180 88.995 -1.642 6.143 1.00 25.08 C ATOM 3414 NE ARG B 180 89.094 -0.952 4.858 1.00 26.76 N ATOM 3415 CZ ARG B 180 90.027 -0.060 4.545 1.00 26.74 C ATOM 3416 NH1 ARG B 180 90.974 0.271 5.422 1.00 23.39 N ATOM 3417 NH2 ARG B 180 90.007 0.502 3.344 1.00 29.42 N ATOM 3418 HE ARG B 180 88.381 -1.176 4.135 1.00 0.00 H ATOM 3419 HH12 ARG B 180 91.699 0.971 5.165 1.00 0.00 H ATOM 3420 HH11 ARG B 180 90.988 -0.170 6.364 1.00 0.00 H ATOM 3421 HH22 ARG B 180 90.731 1.202 3.085 1.00 0.00 H ATOM 3422 HH21 ARG B 180 89.267 0.243 2.661 1.00 0.00 H ATOM 3423 H ARG B 180 88.395 -5.637 5.778 1.00 0.00 H ATOM 3424 N ASN B 181 90.065 -4.516 9.714 1.00 20.01 N ATOM 3425 CA ASN B 181 90.172 -4.892 11.122 1.00 28.50 C ATOM 3426 C ASN B 181 89.086 -4.236 11.966 1.00 30.52 C ATOM 3427 O ASN B 181 88.305 -3.419 11.473 1.00 29.48 O ATOM 3428 CB ASN B 181 91.544 -4.494 11.689 1.00 39.97 C ATOM 3429 CG ASN B 181 92.690 -5.188 10.989 1.00 48.54 C ATOM 3430 OD1 ASN B 181 92.832 -6.407 11.067 1.00 48.19 O ATOM 3431 ND2 ASN B 181 93.531 -4.409 10.314 1.00 49.55 N ATOM 3432 OXT ASN B 181 88.989 -4.484 13.172 1.00 28.51 O ATOM 3433 HD22 ASN B 181 93.371 -3.382 10.275 1.00 0.00 H ATOM 3434 HD21 ASN B 181 94.348 -4.827 9.825 1.00 0.00 H ATOM 3435 H ASN B 181 90.721 -3.802 9.337 1.00 0.00 H TER 3436 ASN B 181 HETATM 3437 O HOH 1 89.402 9.298 14.508 1.00 32.43 O HETATM 3438 O HOH 2 104.843 18.777 5.038 1.00 24.06 O HETATM 3439 O HOH 3 91.411 20.738 0.574 1.00 26.15 O HETATM 3440 O HOH 4 77.375 25.153 18.513 1.00 38.53 O HETATM 3441 O HOH 5 85.326 1.468 10.261 1.00 31.99 O HETATM 3442 O HOH 6 88.626 12.282 17.780 1.00 27.16 O HETATM 3443 O HOH 7 102.366 27.326 6.457 1.00 21.65 O HETATM 3444 O HOH 8 114.250 16.473 13.151 1.00 21.15 O HETATM 3445 O HOH 9 92.303 2.584 12.339 1.00 23.16 O HETATM 3446 O HOH 10 84.092 28.983 20.349 1.00 31.64 O HETATM 3447 O HOH 11 100.996 11.325 20.834 1.00 33.84 O HETATM 3448 O HOH 12 97.633 16.822 -6.716 1.00 47.30 O HETATM 3449 O HOH 13 74.605 1.921 19.288 1.00 34.84 O HETATM 3450 O HOH 14 112.054 3.852 11.995 1.00 36.67 O HETATM 3451 O HOH 15 97.788 5.019 -2.713 1.00 27.13 O HETATM 3452 O HOH 16 86.377 21.400 29.022 1.00 33.08 O HETATM 3453 O HOH 17 113.219 9.345 7.386 1.00 47.01 O HETATM 3454 O HOH 18 77.857 26.494 14.724 1.00 24.34 O HETATM 3455 O HOH 19 91.319 13.394 36.144 1.00 38.21 O HETATM 3456 O HOH 20 82.282 25.237 27.732 1.00 22.08 O HETATM 3457 O HOH 21 92.051 16.395 36.635 1.00 22.59 O HETATM 3458 O HOH 22 71.834 10.483 21.793 1.00 41.16 O HETATM 3459 O HOH 23 91.742 -0.033 12.051 1.00 35.68 O HETATM 3460 O HOH 24 106.474 11.465 4.397 1.00 28.55 O HETATM 3461 O HOH 25 80.638 15.383 31.175 1.00 49.12 O HETATM 3462 O HOH 26 73.876 7.077 23.012 1.00 28.50 O HETATM 3463 O HOH 27 95.904 21.685 1.845 1.00 37.34 O HETATM 3464 O HOH 28 86.769 11.915 31.087 1.00 25.92 O HETATM 3465 O HOH 29 76.541 18.564 9.244 1.00 32.00 O HETATM 3466 O HOH 30 88.632 20.941 10.641 1.00 23.28 O HETATM 3467 O HOH 31 100.589 17.211 8.075 1.00 18.01 O HETATM 3468 O HOH 32 94.491 27.865 16.199 1.00 28.87 O HETATM 3469 O HOH 33 69.231 14.157 15.292 1.00 41.68 O HETATM 3470 O HOH 34 94.511 3.342 13.977 1.00 25.61 O HETATM 3471 O HOH 35 70.307 9.272 19.807 1.00 52.82 O HETATM 3472 O HOH 36 107.126 14.294 9.851 1.00 17.91 O HETATM 3473 O HOH 37 101.089 27.358 8.923 1.00 20.82 O HETATM 3474 O HOH 38 100.011 4.737 -5.692 1.00 40.61 O HETATM 3475 O HOH 39 93.460 1.616 4.344 1.00 18.46 O HETATM 3476 O HOH 40 91.405 18.666 33.377 1.00 26.49 O HETATM 3477 O HOH 41 85.680 1.975 0.340 1.00 15.37 O HETATM 3478 O HOH 42 93.309 2.401 -2.960 1.00 28.79 O HETATM 3479 O HOH 43 109.663 13.595 6.926 1.00 40.21 O HETATM 3480 O HOH 44 82.497 9.270 16.418 1.00 19.53 O HETATM 3481 O HOH 45 80.122 30.080 12.316 1.00 33.35 O HETATM 3482 O HOH 46 74.744 10.994 10.443 1.00 41.87 O HETATM 3483 O HOH 47 100.545 2.667 -7.709 1.00 40.60 O HETATM 3484 O HOH 48 88.223 20.099 25.903 1.00 21.31 O HETATM 3485 O HOH 49 79.353 29.091 17.809 1.00 39.13 O HETATM 3486 O HOH 50 107.003 2.171 4.076 1.00 25.66 O HETATM 3487 O HOH 51 94.837 17.224 21.388 1.00 29.50 O HETATM 3488 O HOH 52 93.140 19.209 -0.335 1.00 24.26 O HETATM 3489 O HOH 53 83.252 28.170 5.819 1.00 37.78 O HETATM 3490 O HOH 54 111.396 17.224 15.460 1.00 44.72 O HETATM 3491 O HOH 55 75.668 19.283 22.883 1.00 38.05 O HETATM 3492 O HOH 56 71.960 22.218 17.758 1.00 39.45 O HETATM 3493 O HOH 57 78.198 8.608 11.939 1.00 18.77 O HETATM 3494 O HOH 58 100.117 10.660 23.351 1.00 34.85 O HETATM 3495 O HOH 59 72.772 18.098 15.924 1.00 29.44 O HETATM 3496 O HOH 60 71.007 9.834 11.104 1.00 40.17 O HETATM 3497 O HOH 61 87.073 20.355 2.075 1.00 19.76 O HETATM 3498 O HOH 62 74.532 26.435 8.300 1.00 36.74 O HETATM 3499 O HOH 63 95.749 19.542 0.529 1.00 33.58 O HETATM 3500 O HOH 64 81.495 9.075 27.118 1.00 33.30 O HETATM 3501 O HOH 65 77.448 23.185 6.596 1.00 33.21 O HETATM 3502 O HOH 66 80.327 17.558 29.626 1.00 41.43 O HETATM 3503 O HOH 67 87.489 18.613 10.953 1.00 29.24 O HETATM 3504 O HOH 68 84.409 3.576 -5.376 1.00 21.46 O HETATM 3505 O HOH 69 108.496 6.760 1.699 1.00 39.36 O HETATM 3506 O HOH 70 89.581 0.000 0.000 1.00 27.01 O HETATM 3507 O HOH 71 85.064 19.261 28.190 1.00 26.62 O HETATM 3508 O HOH 72 87.174 1.207 -2.796 1.00 25.16 O HETATM 3509 O HOH 73 103.161 18.773 19.993 1.00 29.37 O HETATM 3510 O HOH 74 96.913 1.586 8.903 1.00 23.59 O HETATM 3511 O HOH 75 97.466 8.148 -4.475 1.00 40.38 O HETATM 3512 O HOH 76 93.072 -0.287 1.345 1.00 25.08 O HETATM 3513 O HOH 77 74.533 18.537 20.467 1.00 25.55 O HETATM 3514 O HOH 78 91.135 16.339 15.106 1.00 29.16 O HETATM 3515 O HOH 79 99.070 13.490 -4.809 1.00 31.34 O HETATM 3516 O HOH 80 104.250 1.728 3.503 1.00 23.04 O HETATM 3517 O HOH 81 104.490 14.763 6.774 1.00 18.59 O HETATM 3518 O HOH 82 83.974 15.592 4.592 1.00 23.44 O HETATM 3519 O HOH 83 101.285 20.024 3.834 1.00 37.33 O HETATM 3520 O HOH 84 104.527 16.860 2.409 1.00 35.06 O HETATM 3521 O HOH 85 84.547 19.937 0.986 1.00 43.07 O HETATM 3522 O HOH 86 87.553 10.209 11.175 1.00 27.13 O HETATM 3523 O HOH 87 92.896 20.685 19.374 1.00 23.38 O HETATM 3524 O HOH 88 103.109 15.457 4.255 1.00 21.54 O HETATM 3525 O HOH 89 91.349 3.484 -4.448 1.00 26.90 O HETATM 3526 O HOH 90 73.497 22.325 10.431 1.00 34.21 O HETATM 3527 O HOH 91 110.768 12.971 10.623 1.00 21.90 O HETATM 3528 O HOH 92 101.828 22.162 18.125 1.00 44.95 O HETATM 3529 O HOH 93 73.578 15.675 10.339 1.00 33.35 O HETATM 3530 O HOH 94 97.998 3.223 15.520 1.00 19.09 O HETATM 3531 O HOH 95 94.567 0.823 -4.264 1.00 34.49 O HETATM 3532 O HOH 96 95.819 27.578 6.584 1.00 30.08 O HETATM 3533 O HOH 97 99.966 6.320 22.068 1.00 30.58 O HETATM 3534 O HOH 98 86.367 16.322 13.411 1.00 31.68 O HETATM 3535 O HOH 99 93.041 4.268 -6.445 1.00 36.19 O HETATM 3536 O HOH 100 107.638 10.030 1.200 1.00 30.13 O HETATM 3537 O HOH 101 87.597 10.387 15.738 1.00 20.05 O HETATM 3538 O HOH 102 89.537 13.494 12.717 1.00 34.12 O HETATM 3539 O HOH 103 109.973 0.357 6.274 1.00 33.06 O HETATM 3540 O HOH 104 84.960 32.090 15.595 1.00 34.65 O HETATM 3541 O HOH 105 113.993 10.464 11.051 1.00 32.68 O HETATM 3542 O HOH 106 110.349 15.788 7.942 1.00 25.50 O HETATM 3543 O HOH 107 108.118 8.076 15.024 1.00 42.93 O HETATM 3544 O HOH 108 79.970 28.400 14.829 1.00 22.07 O HETATM 3545 O HOH 109 90.656 30.001 11.187 1.00 27.42 O HETATM 3546 O HOH 110 79.125 24.389 25.177 1.00 44.80 O HETATM 3547 O HOH 111 89.569 10.006 11.967 1.00 38.06 O HETATM 3548 O HOH 112 71.568 29.544 13.780 1.00 41.67 O HETATM 3549 O HOH 113 98.807 21.318 2.027 1.00 47.68 O HETATM 3550 O HOH 114 106.194 13.003 6.650 1.00 46.12 O HETATM 3551 O HOH 115 70.485 5.004 24.574 1.00 45.34 O HETATM 3552 O HOH 116 76.582 21.064 28.415 1.00 38.79 O HETATM 3553 O HOH 117 69.801 6.686 17.345 1.00 45.33 O HETATM 3554 O HOH 118 99.123 20.495 18.501 1.00 42.80 O HETATM 3555 O HOH 119 92.745 22.665 1.992 1.00 23.79 O HETATM 3556 O HOH 120 77.756 14.947 31.257 1.00 40.79 O HETATM 3557 O HOH 121 81.086 15.652 0.235 1.00 40.50 O HETATM 3558 O HOH 122 108.295 3.947 2.501 1.00 32.64 O HETATM 3559 O HOH 123 93.258 29.451 11.327 1.00 30.44 O HETATM 3560 O HOH 124 101.870 17.970 5.182 1.00 43.97 O HETATM 3561 O HOH 125 99.128 9.614 28.944 1.00 40.96 O HETATM 3562 O HOH 126 85.053 0.995 7.777 1.00 51.02 O HETATM 3563 O HOH 127 73.626 13.177 9.570 1.00 45.02 O HETATM 3564 O HOH 128 83.507 12.035 33.371 1.00 40.80 O HETATM 3565 O HOH 129 111.874 7.124 -4.460 1.00 42.38 O HETATM 3566 O HOH 130 76.150 26.622 16.712 1.00 35.35 O HETATM 3567 O HOH 131 74.913 13.414 6.121 1.00 41.21 O HETATM 3568 O HOH 132 74.932 17.030 30.777 1.00 45.72 O HETATM 3569 O HOH 133 108.349 0.580 -3.879 1.00 31.86 O HETATM 3570 O HOH 134 84.936 -1.298 4.099 1.00 27.11 O HETATM 3571 O HOH 135 74.070 20.228 25.026 1.00 45.55 O HETATM 3572 O HOH 136 82.877 2.047 7.576 1.00 25.06 O HETATM 3573 O HOH 137 77.138 26.455 21.130 1.00 40.62 O HETATM 3574 O HOH 138 95.159 7.037 -5.193 1.00 37.12 O HETATM 3575 O HOH 139 89.225 16.629 13.381 1.00 31.24 O HETATM 3576 O HOH 140 71.449 19.558 17.887 1.00 37.79 O HETATM 3577 O HOH 141 92.132 10.531 -6.476 1.00 31.72 O HETATM 3578 O HOH 142 85.479 -0.996 26.228 1.00 47.96 O HETATM 3579 O HOH 143 76.490 25.544 6.595 1.00 41.78 O HETATM 3580 O HOH 144 99.876 22.582 17.052 1.00 33.63 O HETATM 3581 O HOH 145 81.568 29.007 21.801 1.00 32.80 O HETATM 3582 O HOH 146 71.896 18.827 20.398 1.00 33.03 O HETATM 3583 O HOH 147 67.694 13.902 17.431 1.00 37.14 O HETATM 3584 O HOH 148 70.013 17.603 21.657 1.00 43.76 O HETATM 3585 O HOH 149 89.402 -9.298 -14.508 1.00 32.43 O HETATM 3586 O HOH 150 104.843 -18.777 -5.038 1.00 24.06 O HETATM 3587 O HOH 151 91.411 -20.738 -0.574 1.00 26.15 O HETATM 3588 O HOH 152 77.375 -25.153 -18.513 1.00 38.53 O HETATM 3589 O HOH 153 85.326 -1.468 -10.261 1.00 31.99 O HETATM 3590 O HOH 154 88.626 -12.282 -17.780 1.00 27.16 O HETATM 3591 O HOH 155 102.366 -27.326 -6.457 1.00 21.65 O HETATM 3592 O HOH 156 114.250 -16.473 -13.151 1.00 21.15 O HETATM 3593 O HOH 157 92.303 -2.584 -12.339 1.00 23.16 O HETATM 3594 O HOH 158 84.092 -28.983 -20.349 1.00 31.64 O HETATM 3595 O HOH 159 100.996 -11.325 -20.834 1.00 33.84 O HETATM 3596 O HOH 160 97.633 -16.822 6.716 1.00 47.30 O HETATM 3597 O HOH 161 74.605 -1.921 -19.288 1.00 34.84 O HETATM 3598 O HOH 162 112.054 -3.852 -11.995 1.00 36.67 O HETATM 3599 O HOH 163 97.788 -5.019 2.713 1.00 27.13 O HETATM 3600 O HOH 164 86.377 -21.400 -29.022 1.00 33.08 O HETATM 3601 O HOH 165 113.219 -9.345 -7.386 1.00 47.01 O HETATM 3602 O HOH 166 77.857 -26.494 -14.724 1.00 24.34 O HETATM 3603 O HOH 167 91.319 -13.394 -36.144 1.00 38.21 O HETATM 3604 O HOH 168 82.282 -25.237 -27.732 1.00 22.08 O HETATM 3605 O HOH 169 92.051 -16.395 -36.635 1.00 22.59 O HETATM 3606 O HOH 170 71.834 -10.483 -21.793 1.00 41.16 O HETATM 3607 O HOH 171 91.742 0.033 -12.051 1.00 35.68 O HETATM 3608 O HOH 172 106.474 -11.465 -4.397 1.00 28.55 O HETATM 3609 O HOH 173 80.638 -15.383 -31.175 1.00 49.12 O HETATM 3610 O HOH 174 73.876 -7.077 -23.012 1.00 28.50 O HETATM 3611 O HOH 175 95.904 -21.685 -1.845 1.00 37.34 O HETATM 3612 O HOH 176 86.769 -11.915 -31.087 1.00 25.92 O HETATM 3613 O HOH 177 76.541 -18.564 -9.244 1.00 32.00 O HETATM 3614 O HOH 178 88.632 -20.941 -10.641 1.00 23.28 O HETATM 3615 O HOH 179 100.589 -17.211 -8.075 1.00 18.01 O HETATM 3616 O HOH 180 94.491 -27.865 -16.199 1.00 28.87 O HETATM 3617 O HOH 181 69.231 -14.157 -15.292 1.00 41.68 O HETATM 3618 O HOH 182 94.511 -3.342 -13.977 1.00 25.61 O HETATM 3619 O HOH 183 70.307 -9.272 -19.807 1.00 52.82 O HETATM 3620 O HOH 184 107.126 -14.294 -9.851 1.00 17.91 O HETATM 3621 O HOH 185 101.089 -27.358 -8.923 1.00 20.82 O HETATM 3622 O HOH 186 100.011 -4.737 5.692 1.00 40.61 O HETATM 3623 O HOH 187 93.460 -1.616 -4.344 1.00 18.46 O HETATM 3624 O HOH 188 91.405 -18.666 -33.377 1.00 26.49 O HETATM 3625 O HOH 189 93.309 -2.401 2.960 1.00 28.79 O HETATM 3626 O HOH 190 109.663 -13.595 -6.926 1.00 40.21 O HETATM 3627 O HOH 191 82.497 -9.270 -16.418 1.00 19.53 O HETATM 3628 O HOH 192 80.122 -30.080 -12.316 1.00 33.35 O HETATM 3629 O HOH 193 74.744 -10.994 -10.443 1.00 41.87 O HETATM 3630 O HOH 194 100.545 -2.667 7.709 1.00 40.60 O HETATM 3631 O HOH 195 88.223 -20.099 -25.903 1.00 21.31 O HETATM 3632 O HOH 196 79.353 -29.091 -17.809 1.00 39.13 O HETATM 3633 O HOH 197 107.003 -2.171 -4.076 1.00 25.66 O HETATM 3634 O HOH 198 94.837 -17.224 -21.388 1.00 29.50 O HETATM 3635 O HOH 199 93.140 -19.209 0.335 1.00 24.26 O HETATM 3636 O HOH 200 83.252 -28.170 -5.819 1.00 37.78 O HETATM 3637 O HOH 201 111.396 -17.224 -15.460 1.00 44.72 O HETATM 3638 O HOH 202 75.668 -19.283 -22.883 1.00 38.05 O HETATM 3639 O HOH 203 71.960 -22.218 -17.758 1.00 39.45 O HETATM 3640 O HOH 204 78.198 -8.608 -11.939 1.00 18.77 O HETATM 3641 O HOH 205 100.117 -10.660 -23.351 1.00 34.85 O HETATM 3642 O HOH 206 72.772 -18.098 -15.924 1.00 29.44 O HETATM 3643 O HOH 207 71.007 -9.834 -11.104 1.00 40.17 O HETATM 3644 O HOH 208 87.073 -20.355 -2.075 1.00 19.76 O HETATM 3645 O HOH 209 74.532 -26.435 -8.300 1.00 36.74 O HETATM 3646 O HOH 210 95.749 -19.542 -0.529 1.00 33.58 O HETATM 3647 O HOH 211 81.495 -9.075 -27.118 1.00 33.30 O HETATM 3648 O HOH 212 77.448 -23.185 -6.596 1.00 33.21 O HETATM 3649 O HOH 213 80.327 -17.558 -29.626 1.00 41.43 O HETATM 3650 O HOH 214 87.489 -18.613 -10.953 1.00 29.24 O HETATM 3651 O HOH 215 84.409 -3.576 5.376 1.00 21.46 O HETATM 3652 O HOH 216 108.496 -6.760 -1.699 1.00 39.36 O HETATM 3653 O HOH 217 85.064 -19.261 -28.190 1.00 26.62 O HETATM 3654 O HOH 218 87.174 -1.207 2.796 1.00 25.16 O HETATM 3655 O HOH 219 103.161 -18.773 -19.993 1.00 29.37 O HETATM 3656 O HOH 220 96.913 -1.586 -8.903 1.00 23.59 O HETATM 3657 O HOH 221 97.466 -8.148 4.475 1.00 40.38 O HETATM 3658 O HOH 222 93.072 0.287 -1.345 1.00 25.08 O HETATM 3659 O HOH 223 74.533 -18.537 -20.467 1.00 25.55 O HETATM 3660 O HOH 224 91.135 -16.339 -15.106 1.00 29.16 O HETATM 3661 O HOH 225 99.070 -13.490 4.809 1.00 31.34 O HETATM 3662 O HOH 226 104.250 -1.728 -3.503 1.00 23.04 O HETATM 3663 O HOH 227 104.490 -14.763 -6.774 1.00 18.59 O HETATM 3664 O HOH 228 83.974 -15.592 -4.592 1.00 23.44 O HETATM 3665 O HOH 229 101.285 -20.024 -3.834 1.00 37.33 O HETATM 3666 O HOH 230 104.527 -16.860 -2.409 1.00 35.06 O HETATM 3667 O HOH 231 84.547 -19.937 -0.986 1.00 43.07 O HETATM 3668 O HOH 232 87.553 -10.209 -11.175 1.00 27.13 O HETATM 3669 O HOH 233 92.896 -20.685 -19.374 1.00 23.38 O HETATM 3670 O HOH 234 103.109 -15.457 -4.255 1.00 21.54 O HETATM 3671 O HOH 235 91.349 -3.484 4.448 1.00 26.90 O HETATM 3672 O HOH 236 73.497 -22.325 -10.431 1.00 34.21 O HETATM 3673 O HOH 237 110.768 -12.971 -10.623 1.00 21.90 O HETATM 3674 O HOH 238 101.828 -22.162 -18.125 1.00 44.95 O HETATM 3675 O HOH 239 73.578 -15.675 -10.339 1.00 33.35 O HETATM 3676 O HOH 240 94.567 -0.823 4.264 1.00 34.49 O HETATM 3677 O HOH 241 95.819 -27.578 -6.584 1.00 30.08 O HETATM 3678 O HOH 242 99.966 -6.320 -22.068 1.00 30.58 O HETATM 3679 O HOH 243 86.367 -16.322 -13.411 1.00 31.68 O HETATM 3680 O HOH 244 93.041 -4.268 6.445 1.00 36.19 O HETATM 3681 O HOH 245 107.638 -10.030 -1.200 1.00 30.13 O HETATM 3682 O HOH 246 87.597 -10.387 -15.738 1.00 20.05 O HETATM 3683 O HOH 247 89.537 -13.494 -12.717 1.00 34.12 O HETATM 3684 O HOH 248 109.973 -0.357 -6.274 1.00 33.06 O HETATM 3685 O HOH 249 84.960 -32.090 -15.595 1.00 34.65 O HETATM 3686 O HOH 250 113.993 -10.464 -11.051 1.00 32.68 O HETATM 3687 O HOH 251 110.349 -15.788 -7.942 1.00 25.50 O HETATM 3688 O HOH 252 108.118 -8.076 -15.024 1.00 42.93 O HETATM 3689 O HOH 253 79.970 -28.400 -14.829 1.00 22.07 O HETATM 3690 O HOH 254 90.656 -30.001 -11.187 1.00 27.42 O HETATM 3691 O HOH 255 79.125 -24.389 -25.177 1.00 44.80 O HETATM 3692 O HOH 256 89.569 -10.006 -11.967 1.00 38.06 O HETATM 3693 O HOH 257 71.568 -29.544 -13.780 1.00 41.67 O HETATM 3694 O HOH 258 98.807 -21.318 -2.027 1.00 47.68 O HETATM 3695 O HOH 259 106.194 -13.003 -6.650 1.00 46.12 O HETATM 3696 O HOH 260 70.485 -5.004 -24.574 1.00 45.34 O HETATM 3697 O HOH 261 76.582 -21.064 -28.415 1.00 38.79 O HETATM 3698 O HOH 262 69.801 -6.686 -17.345 1.00 45.33 O HETATM 3699 O HOH 263 99.123 -20.495 -18.501 1.00 42.80 O HETATM 3700 O HOH 264 92.745 -22.665 -1.992 1.00 23.79 O HETATM 3701 O HOH 265 77.756 -14.947 -31.257 1.00 40.79 O HETATM 3702 O HOH 266 81.086 -15.652 -0.235 1.00 40.50 O HETATM 3703 O HOH 267 108.295 -3.947 -2.501 1.00 32.64 O HETATM 3704 O HOH 268 93.258 -29.451 -11.327 1.00 30.44 O HETATM 3705 O HOH 269 101.870 -17.970 -5.182 1.00 43.97 O HETATM 3706 O HOH 270 99.128 -9.614 -28.944 1.00 40.96 O HETATM 3707 O HOH 271 85.053 -0.995 -7.777 1.00 51.02 O HETATM 3708 O HOH 272 73.626 -13.177 -9.570 1.00 45.02 O HETATM 3709 O HOH 273 83.507 -12.035 -33.371 1.00 40.80 O HETATM 3710 O HOH 274 111.874 -7.124 4.460 1.00 42.38 O HETATM 3711 O HOH 275 76.150 -26.622 -16.712 1.00 35.35 O HETATM 3712 O HOH 276 74.913 -13.414 -6.121 1.00 41.21 O HETATM 3713 O HOH 277 74.932 -17.030 -30.777 1.00 45.72 O HETATM 3714 O HOH 278 108.349 -0.580 3.879 1.00 31.86 O HETATM 3715 O HOH 279 84.936 1.298 -4.099 1.00 27.11 O HETATM 3716 O HOH 280 74.070 -20.228 -25.026 1.00 45.55 O HETATM 3717 O HOH 281 82.877 -2.047 -7.576 1.00 25.06 O HETATM 3718 O HOH 282 77.138 -26.455 -21.130 1.00 40.62 O HETATM 3719 O HOH 283 95.159 -7.037 5.193 1.00 37.12 O HETATM 3720 O HOH 284 89.225 -16.629 -13.381 1.00 31.24 O HETATM 3721 O HOH 285 71.449 -19.558 -17.887 1.00 37.79 O HETATM 3722 O HOH 286 92.132 -10.531 6.476 1.00 31.72 O HETATM 3723 O HOH 287 85.479 0.996 -26.228 1.00 47.96 O HETATM 3724 O HOH 288 76.490 -25.544 -6.595 1.00 41.78 O HETATM 3725 O HOH 289 99.876 -22.582 -17.052 1.00 33.63 O HETATM 3726 O HOH 290 81.568 -29.007 -21.801 1.00 32.80 O HETATM 3727 O HOH 291 71.896 -18.827 -20.398 1.00 33.03 O HETATM 3728 O HOH 292 67.694 -13.902 -17.431 1.00 37.14 O HETATM 3729 O HOH 293 70.013 -17.603 -21.657 1.00 43.76 O HETATM 3730 CAH UNN A 294 81.747 8.221 19.896 1.00 -0.04 C HETATM 3731 CAI UNN A 294 80.261 8.405 20.123 1.00 -0.04 C HETATM 3732 CAG UNN A 294 81.257 9.051 21.069 1.00 -0.00 C HETATM 3733 CAA UNN A 294 81.436 10.566 21.099 1.00 -0.02 C HETATM 3734 CAB UNN A 294 81.381 11.351 19.944 1.00 -0.03 C HETATM 3735 CAC UNN A 294 81.564 12.733 20.027 1.00 0.07 C HETATM 3736 CAD UNN A 294 81.784 13.307 21.279 1.00 -0.04 C HETATM 3737 CAE UNN A 294 81.841 12.541 22.437 1.00 -0.05 C HETATM 3738 CAF UNN A 294 81.670 11.166 22.332 1.00 0.08 C HETATM 3739 CAJ UNN A 294 81.727 10.353 23.498 1.00 0.08 C HETATM 3740 NAK UNN A 294 81.768 9.713 24.405 1.00 -0.35 N HETATM 3741 H7 UNN A 294 82.015 13.006 23.401 1.00 0.07 H HETATM 3742 H8 UNN A 294 81.914 14.381 21.351 1.00 0.05 H HETATM 3743 NAL UNN A 294 81.508 13.629 18.889 1.00 -0.18 N HETATM 3744 SAM UNN A 294 82.235 13.308 17.442 1.00 0.07 S HETATM 3745 OAW UNN A 294 81.711 14.228 16.480 1.00 -0.15 O HETATM 3746 OAV UNN A 294 82.120 11.920 17.149 1.00 -0.15 O HETATM 3747 CAN UNN A 294 83.992 13.674 17.575 1.00 0.12 C HETATM 3748 CAO UNN A 294 84.639 12.709 18.533 1.00 -0.03 C HETATM 3749 CAT UNN A 294 85.134 11.500 18.063 1.00 -0.07 C HETATM 3750 CAS UNN A 294 85.733 10.609 18.938 1.00 -0.07 C HETATM 3751 CAR UNN A 294 85.857 10.906 20.285 1.00 -0.05 C HETATM 3752 CAU UNN A 294 86.521 9.898 21.215 1.00 -0.03 C HETATM 3753 H14 UNN A 294 86.533 10.297 22.240 1.00 0.04 H HETATM 3754 H15 UNN A 294 87.553 9.715 20.881 1.00 0.04 H HETATM 3755 H16 UNN A 294 85.957 8.954 21.196 1.00 0.04 H HETATM 3756 CAQ UNN A 294 85.365 12.118 20.761 1.00 -0.07 C HETATM 3757 CAP UNN A 294 84.772 13.018 19.883 1.00 -0.07 C HETATM 3758 H18 UNN A 294 84.410 13.970 20.254 1.00 0.05 H HETATM 3759 H17 UNN A 294 85.444 12.360 21.815 1.00 0.05 H HETATM 3760 H13 UNN A 294 86.111 9.665 18.563 1.00 0.05 H HETATM 3761 H12 UNN A 294 85.052 11.253 17.011 1.00 0.05 H HETATM 3762 H10 UNN A 294 84.125 14.701 17.945 1.00 0.07 H HETATM 3763 H11 UNN A 294 84.462 13.577 16.585 1.00 0.07 H HETATM 3764 H9 UNN A 294 81.002 14.486 18.985 1.00 0.22 H HETATM 3765 H6 UNN A 294 81.196 10.886 18.982 1.00 0.04 H HETATM 3766 H5 UNN A 294 81.368 8.660 22.091 1.00 0.05 H HETATM 3767 H3 UNN A 294 79.648 7.558 20.465 1.00 0.03 H HETATM 3768 H4 UNN A 294 79.673 9.029 19.434 1.00 0.03 H HETATM 3769 H1 UNN A 294 82.238 8.711 19.042 1.00 0.03 H HETATM 3770 H2 UNN A 294 82.213 7.240 20.073 1.00 0.03 H CONECT 1 2 7 8 9 CONECT 8 1 CONECT 9 1 CONECT 1455 1456 1463 1464 1465 CONECT 1463 1455 CONECT 1464 1455 CONECT 1465 1455 CONECT 1719 1720 1725 1726 1727 CONECT 1726 1719 CONECT 1727 1719 CONECT 3173 3174 3181 3182 3183 CONECT 3181 3173 CONECT 3182 3173 CONECT 3183 3173 CONECT 3730 3731 3732 3769 3770 CONECT 3731 3730 3732 3767 3768 CONECT 3732 3730 3731 3733 3766 CONECT 3733 3732 3734 3738 CONECT 3734 3733 3735 3765 CONECT 3735 3734 3736 3743 CONECT 3736 3735 3737 3742 CONECT 3737 3736 3738 3741 CONECT 3738 3733 3737 3739 CONECT 3739 3738 3740 CONECT 3740 3739 CONECT 3741 3737 CONECT 3742 3736 CONECT 3743 3735 3744 3764 CONECT 3744 3743 3745 3746 3747 CONECT 3745 3744 CONECT 3746 3744 CONECT 3747 3744 3748 3762 3763 CONECT 3748 3747 3749 3757 CONECT 3749 3748 3750 3761 CONECT 3750 3749 3751 3760 CONECT 3751 3750 3752 3756 CONECT 3752 3751 3753 3754 3755 CONECT 3753 3752 CONECT 3754 3752 CONECT 3755 3752 CONECT 3756 3751 3757 3759 CONECT 3757 3748 3756 3758 CONECT 3758 3757 CONECT 3759 3756 CONECT 3760 3750 CONECT 3761 3749 CONECT 3762 3747 CONECT 3763 3747 CONECT 3764 3743 CONECT 3765 3734 CONECT 3766 3732 CONECT 3767 3731 CONECT 3768 3731 CONECT 3769 3730 CONECT 3770 3730 MASTER 0 0 0 0 0 0 0 0 3766 4 55 30 END
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Structure:
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Related entries of code: 5ur6
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5ur5
RCSB PDB
PDBbind
181aa, >5UR5_1|Chain... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5ur6
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Abscisic acid receptor PYR1
Ligand Name
8KM
EC.Number
E.C.-.-.-.-
Resolution
1.63(Å)
Affinity (Kd/Ki/IC50)
IC50=87nM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) ACS Chem. Biol. Vol. 12: pp. 2842-2848
Ligand Properties
Formula
C
1
8
H
1
8
N
2
O
2
S
Molecular Weight
326.413
Exact Mass
326.109
No. of atoms
41
No. of bonds
43
Polar Surface Area
78.34
LOGP Value
3.37 (
Computed with XLOGP3
)
4.84 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 3
Canonical SMILES
N#Cc1ccc(cc1C1CC1)NS(=O)(=O)Cc1ccc(cc1)C
InChI String
InChI=1S/C18H18N2O2S/c1-13-2-4-14(5-3-13)12-23(21,22)20-17-9-8-16(11-19)18(10-17)15-6-7-15/h2-5,8-10,15,20H,6-7,12H2,1H3
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
O49686
Entrez Gene ID
NCBI Entrez Gene ID:
827510
ASD
Information of known allosteric effects of PDB entries
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