USER MOD reduce.3.24.130724 H: found=0, std=0, add=1233, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1231 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 155 TYR OH : rot -12:sc= -0.699 USER MOD Set 1.2: A 157 GLN : amide:sc= -1.31 X(o=-2,f=-1.8) USER MOD Set 2.1: A 59 ASN : amide:sc= -1.53 K(o=-14,f=-18) USER MOD Set 2.2: A 71 HIS :FLIP no HE2:sc= -2.41! C(o=-17!,f=-14!) USER MOD Set 2.3: A 73 ASN :FLIP amide:sc= -9.98! C(o=-15!,f=-14!) USER MOD Set 2.4: A 84 ASN :FLIP amide:sc= -0.219 F(o=-17!,f=-14) USER MOD Set 3.1: A 17 MET CE :methyl -118:sc= -3.66! (180deg=-3.66) USER MOD Set 3.2: A 29 TYR OH : rot 180:sc= -0.0554 USER MOD Single : A 1 GLY N :NH3+ -116:sc= 0.0663 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 HIS : no HD1:sc= 0.136 K(o=0.14,f=-1.1) USER MOD Single : A 9 GLN : amide:sc= -0.146 X(o=-0.15,f=-0.59) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 ASN : amide:sc= -0.02 X(o=-0.02,f=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -0.0846 X(o=-0.085,f=0) USER MOD Single : A 34 GLN : amide:sc= -0.149 X(o=-0.15,f=0) USER MOD Single : A 38 THR OG1 : rot 180:sc= -0.833 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ -118:sc= 0.259 (180deg=0) USER MOD Single : A 48 TYR OH : rot -30:sc= -0.89 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot -143:sc= 0.291 USER MOD Single : A 76 MET CE :methyl -149:sc= -2.03 (180deg=-3.65) USER MOD Single : A 78 ASN : amide:sc= -0.0764 X(o=-0.076,f=-0.26) USER MOD Single : A 80 THR OG1 : rot 180:sc= -0.387 USER MOD Single : A 85 SER OG : rot 33:sc= 0.444 USER MOD Single : A 88 ASN :FLIP amide:sc= -1.23! C(o=-3.9!,f=-1.2!) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot -9:sc= 0.992 USER MOD Single : A 96 LYS NZ :NH3+ 154:sc= -0.628 (180deg=-1.7!) USER MOD Single : A 97 LYS NZ :NH3+ 149:sc= -0.0099 (180deg=-0.888) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 HIS : no HD1:sc= -1.88 K(o=-1.9,f=-4.5!) USER MOD Single : A 101 ASN : amide:sc= -2.26! C(o=-2.3!,f=-5.2!) USER MOD Single : A 107 GLN : amide:sc= -0.541 X(o=-0.54,f=-0.7) USER MOD Single : A 112 SER OG : rot 180:sc= -0.0346 USER MOD Single : A 115 CYS SG : rot 60:sc= -2.69! USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 TYR OH : rot 180:sc= -0.0547 USER MOD Single : A 125 ASN : amide:sc= -0.038 K(o=-0.038,f=-1.3) USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 HIS : no HD1:sc= 0 X(o=0,f=-0.0056) USER MOD Single : A 134 HIS :FLIP+bothHN:sc= -1.12 F(o=-3.6,f=-1.1) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 144 THR OG1 : rot -150:sc= -0.0991 USER MOD Single : A 148 GLN :FLIP amide:sc= -0.339 F(o=-1.1,f=-0.34) USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD Single : A 159 SER OG : rot 180:sc= 0 USER MOD Single : A 162 SER OG : rot 180:sc= -0.039 USER MOD Single : A 163 SER OG : rot 30:sc= 0.705 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -42.353 -14.924 3.838 1.00 0.00 N ATOM 2 CA GLY A 1 -41.403 -14.764 2.753 1.00 0.00 C ATOM 3 C GLY A 1 -40.068 -15.417 3.049 1.00 0.00 C ATOM 4 O GLY A 1 -39.760 -15.719 4.202 1.00 0.00 O ATOM 0 H1 GLY A 1 -43.160 -15.493 3.512 1.00 0.00 H new ATOM 0 H2 GLY A 1 -41.891 -15.405 4.636 1.00 0.00 H new ATOM 0 H3 GLY A 1 -42.690 -13.989 4.145 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -41.820 -15.194 1.843 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -41.250 -13.702 2.562 1.00 0.00 H new ATOM 8 N SER A 2 -39.275 -15.639 2.006 1.00 0.00 N ATOM 9 CA SER A 2 -37.967 -16.266 2.160 1.00 0.00 C ATOM 10 C SER A 2 -36.851 -15.295 1.788 1.00 0.00 C ATOM 11 O SER A 2 -35.938 -15.050 2.576 1.00 0.00 O ATOM 12 CB SER A 2 -37.876 -17.523 1.292 1.00 0.00 C ATOM 13 OG SER A 2 -38.807 -18.504 1.716 1.00 0.00 O ATOM 0 H SER A 2 -39.515 -15.394 1.045 1.00 0.00 H new ATOM 0 HA SER A 2 -37.846 -16.546 3.207 1.00 0.00 H new ATOM 0 HB2 SER A 2 -38.065 -17.264 0.250 1.00 0.00 H new ATOM 0 HB3 SER A 2 -36.866 -17.930 1.341 1.00 0.00 H new ATOM 0 HG SER A 2 -38.730 -19.296 1.145 1.00 0.00 H new ATOM 19 N SER A 3 -36.932 -14.745 0.580 1.00 0.00 N ATOM 20 CA SER A 3 -35.928 -13.804 0.100 1.00 0.00 C ATOM 21 C SER A 3 -36.586 -12.552 -0.472 1.00 0.00 C ATOM 22 O SER A 3 -37.724 -12.593 -0.939 1.00 0.00 O ATOM 23 CB SER A 3 -35.048 -14.463 -0.964 1.00 0.00 C ATOM 24 OG SER A 3 -35.763 -14.648 -2.174 1.00 0.00 O ATOM 0 H SER A 3 -37.683 -14.935 -0.084 1.00 0.00 H new ATOM 0 HA SER A 3 -35.306 -13.512 0.946 1.00 0.00 H new ATOM 0 HB2 SER A 3 -34.169 -13.845 -1.148 1.00 0.00 H new ATOM 0 HB3 SER A 3 -34.690 -15.425 -0.599 1.00 0.00 H new ATOM 0 HG SER A 3 -35.178 -15.069 -2.838 1.00 0.00 H new ATOM 30 N GLY A 4 -35.861 -11.438 -0.431 1.00 0.00 N ATOM 31 CA GLY A 4 -36.390 -10.189 -0.948 1.00 0.00 C ATOM 32 C GLY A 4 -35.774 -8.977 -0.277 1.00 0.00 C ATOM 33 O GLY A 4 -36.223 -8.553 0.788 1.00 0.00 O ATOM 0 H GLY A 4 -34.917 -11.378 -0.049 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -36.208 -10.138 -2.022 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -37.471 -10.169 -0.806 1.00 0.00 H new ATOM 37 N SER A 5 -34.742 -8.419 -0.900 1.00 0.00 N ATOM 38 CA SER A 5 -34.059 -7.252 -0.354 1.00 0.00 C ATOM 39 C SER A 5 -34.044 -6.109 -1.365 1.00 0.00 C ATOM 40 O SER A 5 -34.172 -6.329 -2.569 1.00 0.00 O ATOM 41 CB SER A 5 -32.627 -7.613 0.046 1.00 0.00 C ATOM 42 OG SER A 5 -32.608 -8.365 1.247 1.00 0.00 O ATOM 0 H SER A 5 -34.360 -8.756 -1.784 1.00 0.00 H new ATOM 0 HA SER A 5 -34.604 -6.924 0.531 1.00 0.00 H new ATOM 0 HB2 SER A 5 -32.156 -8.186 -0.753 1.00 0.00 H new ATOM 0 HB3 SER A 5 -32.041 -6.703 0.174 1.00 0.00 H new ATOM 0 HG SER A 5 -31.682 -8.585 1.481 1.00 0.00 H new ATOM 48 N SER A 6 -33.887 -4.887 -0.865 1.00 0.00 N ATOM 49 CA SER A 6 -33.858 -3.709 -1.723 1.00 0.00 C ATOM 50 C SER A 6 -32.423 -3.291 -2.025 1.00 0.00 C ATOM 51 O SER A 6 -32.062 -3.054 -3.177 1.00 0.00 O ATOM 52 CB SER A 6 -34.610 -2.552 -1.061 1.00 0.00 C ATOM 53 OG SER A 6 -34.334 -1.325 -1.713 1.00 0.00 O ATOM 0 H SER A 6 -33.778 -4.688 0.129 1.00 0.00 H new ATOM 0 HA SER A 6 -34.349 -3.962 -2.663 1.00 0.00 H new ATOM 0 HB2 SER A 6 -35.682 -2.748 -1.087 1.00 0.00 H new ATOM 0 HB3 SER A 6 -34.325 -2.482 -0.011 1.00 0.00 H new ATOM 0 HG SER A 6 -34.827 -0.602 -1.272 1.00 0.00 H new ATOM 59 N GLY A 7 -31.606 -3.202 -0.979 1.00 0.00 N ATOM 60 CA GLY A 7 -30.219 -2.813 -1.152 1.00 0.00 C ATOM 61 C GLY A 7 -29.920 -1.452 -0.555 1.00 0.00 C ATOM 62 O GLY A 7 -30.485 -0.443 -0.977 1.00 0.00 O ATOM 0 H GLY A 7 -31.881 -3.392 -0.015 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -29.575 -3.560 -0.688 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -29.978 -2.801 -2.215 1.00 0.00 H new ATOM 66 N HIS A 8 -29.029 -1.424 0.432 1.00 0.00 N ATOM 67 CA HIS A 8 -28.657 -0.176 1.090 1.00 0.00 C ATOM 68 C HIS A 8 -27.586 0.560 0.291 1.00 0.00 C ATOM 69 O HIS A 8 -26.572 -0.024 -0.090 1.00 0.00 O ATOM 70 CB HIS A 8 -28.153 -0.453 2.506 1.00 0.00 C ATOM 71 CG HIS A 8 -27.076 -1.492 2.567 1.00 0.00 C ATOM 72 ND1 HIS A 8 -27.338 -2.842 2.667 1.00 0.00 N ATOM 73 CD2 HIS A 8 -25.728 -1.373 2.540 1.00 0.00 C ATOM 74 CE1 HIS A 8 -26.198 -3.508 2.700 1.00 0.00 C ATOM 75 NE2 HIS A 8 -25.206 -2.640 2.624 1.00 0.00 N ATOM 0 H HIS A 8 -28.552 -2.250 0.793 1.00 0.00 H new ATOM 0 HA HIS A 8 -29.543 0.456 1.145 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -27.776 0.475 2.936 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -28.991 -0.774 3.125 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -25.167 -0.453 2.466 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -26.095 -4.580 2.776 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -24.213 -2.873 2.627 1.00 0.00 H new ATOM 84 N GLN A 9 -27.819 1.845 0.040 1.00 0.00 N ATOM 85 CA GLN A 9 -26.875 2.659 -0.715 1.00 0.00 C ATOM 86 C GLN A 9 -25.703 3.088 0.163 1.00 0.00 C ATOM 87 O GLN A 9 -25.738 4.148 0.785 1.00 0.00 O ATOM 88 CB GLN A 9 -27.576 3.893 -1.287 1.00 0.00 C ATOM 89 CG GLN A 9 -28.681 3.560 -2.277 1.00 0.00 C ATOM 90 CD GLN A 9 -28.176 2.775 -3.472 1.00 0.00 C ATOM 91 OE1 GLN A 9 -27.059 2.991 -3.944 1.00 0.00 O ATOM 92 NE2 GLN A 9 -28.998 1.859 -3.969 1.00 0.00 N ATOM 0 H GLN A 9 -28.653 2.344 0.349 1.00 0.00 H new ATOM 0 HA GLN A 9 -26.489 2.055 -1.536 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -27.997 4.474 -0.467 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -26.837 4.525 -1.779 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -29.456 2.985 -1.771 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -29.144 4.484 -2.623 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -29.915 1.713 -3.546 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -28.713 1.301 -4.774 1.00 0.00 H new ATOM 101 N GLN A 10 -24.668 2.255 0.206 1.00 0.00 N ATOM 102 CA GLN A 10 -23.486 2.548 1.008 1.00 0.00 C ATOM 103 C GLN A 10 -22.246 2.662 0.129 1.00 0.00 C ATOM 104 O GLN A 10 -21.483 1.705 -0.015 1.00 0.00 O ATOM 105 CB GLN A 10 -23.278 1.461 2.065 1.00 0.00 C ATOM 106 CG GLN A 10 -22.018 1.651 2.894 1.00 0.00 C ATOM 107 CD GLN A 10 -21.869 0.602 3.978 1.00 0.00 C ATOM 108 OE1 GLN A 10 -22.742 0.447 4.833 1.00 0.00 O ATOM 109 NE2 GLN A 10 -20.760 -0.127 3.948 1.00 0.00 N ATOM 0 H GLN A 10 -24.624 1.373 -0.304 1.00 0.00 H new ATOM 0 HA GLN A 10 -23.645 3.504 1.506 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -24.141 1.443 2.730 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -23.235 0.490 1.572 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -21.148 1.617 2.238 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -22.034 2.640 3.351 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -20.063 0.035 3.221 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -20.605 -0.849 4.651 1.00 0.00 H new ATOM 118 N LEU A 11 -22.049 3.837 -0.459 1.00 0.00 N ATOM 119 CA LEU A 11 -20.901 4.076 -1.326 1.00 0.00 C ATOM 120 C LEU A 11 -20.003 5.168 -0.752 1.00 0.00 C ATOM 121 O LEU A 11 -19.545 6.052 -1.474 1.00 0.00 O ATOM 122 CB LEU A 11 -21.369 4.470 -2.728 1.00 0.00 C ATOM 123 CG LEU A 11 -22.008 3.358 -3.560 1.00 0.00 C ATOM 124 CD1 LEU A 11 -22.771 3.943 -4.738 1.00 0.00 C ATOM 125 CD2 LEU A 11 -20.950 2.377 -4.042 1.00 0.00 C ATOM 0 H LEU A 11 -22.670 4.639 -0.351 1.00 0.00 H new ATOM 0 HA LEU A 11 -20.325 3.153 -1.388 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -22.087 5.284 -2.634 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -20.513 4.862 -3.278 1.00 0.00 H new ATOM 0 HG LEU A 11 -22.714 2.819 -2.928 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -23.219 3.136 -5.318 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -23.556 4.605 -4.371 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -22.086 4.508 -5.370 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -21.423 1.592 -4.632 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -20.219 2.903 -4.657 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -20.448 1.932 -3.183 1.00 0.00 H new ATOM 137 N ASN A 12 -19.755 5.098 0.552 1.00 0.00 N ATOM 138 CA ASN A 12 -18.911 6.079 1.223 1.00 0.00 C ATOM 139 C ASN A 12 -17.519 6.117 0.599 1.00 0.00 C ATOM 140 O ASN A 12 -16.932 7.186 0.432 1.00 0.00 O ATOM 141 CB ASN A 12 -18.804 5.755 2.715 1.00 0.00 C ATOM 142 CG ASN A 12 -20.128 5.912 3.437 1.00 0.00 C ATOM 143 OD1 ASN A 12 -20.697 7.002 3.484 1.00 0.00 O ATOM 144 ND2 ASN A 12 -20.625 4.819 4.004 1.00 0.00 N ATOM 0 H ASN A 12 -20.127 4.372 1.165 1.00 0.00 H new ATOM 0 HA ASN A 12 -19.371 7.060 1.103 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -18.446 4.733 2.837 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -18.063 6.410 3.174 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -21.513 4.863 4.504 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -20.119 3.936 3.940 1.00 0.00 H new ATOM 151 N SER A 13 -16.999 4.944 0.254 1.00 0.00 N ATOM 152 CA SER A 13 -15.675 4.842 -0.349 1.00 0.00 C ATOM 153 C SER A 13 -15.780 4.543 -1.842 1.00 0.00 C ATOM 154 O SER A 13 -16.796 4.033 -2.315 1.00 0.00 O ATOM 155 CB SER A 13 -14.857 3.751 0.345 1.00 0.00 C ATOM 156 OG SER A 13 -15.574 2.530 0.393 1.00 0.00 O ATOM 0 H SER A 13 -17.474 4.051 0.382 1.00 0.00 H new ATOM 0 HA SER A 13 -15.170 5.800 -0.222 1.00 0.00 H new ATOM 0 HB2 SER A 13 -13.917 3.604 -0.186 1.00 0.00 H new ATOM 0 HB3 SER A 13 -14.605 4.069 1.357 1.00 0.00 H new ATOM 0 HG SER A 13 -15.030 1.848 0.839 1.00 0.00 H new ATOM 162 N LEU A 14 -14.723 4.865 -2.578 1.00 0.00 N ATOM 163 CA LEU A 14 -14.694 4.632 -4.018 1.00 0.00 C ATOM 164 C LEU A 14 -15.068 3.189 -4.344 1.00 0.00 C ATOM 165 O LEU A 14 -14.846 2.271 -3.554 1.00 0.00 O ATOM 166 CB LEU A 14 -13.306 4.950 -4.579 1.00 0.00 C ATOM 167 CG LEU A 14 -12.853 6.406 -4.463 1.00 0.00 C ATOM 168 CD1 LEU A 14 -11.434 6.566 -4.984 1.00 0.00 C ATOM 169 CD2 LEU A 14 -13.806 7.322 -5.217 1.00 0.00 C ATOM 0 H LEU A 14 -13.874 5.288 -2.202 1.00 0.00 H new ATOM 0 HA LEU A 14 -15.427 5.292 -4.482 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -12.577 4.322 -4.068 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -13.288 4.667 -5.632 1.00 0.00 H new ATOM 0 HG LEU A 14 -12.866 6.688 -3.410 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -11.129 7.608 -4.894 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -10.760 5.938 -4.401 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -11.395 6.266 -6.031 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -13.469 8.354 -5.124 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -13.825 7.040 -6.270 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -14.808 7.229 -4.798 1.00 0.00 H new ATOM 181 N PRO A 15 -15.648 2.983 -5.535 1.00 0.00 N ATOM 182 CA PRO A 15 -16.062 1.654 -5.994 1.00 0.00 C ATOM 183 C PRO A 15 -14.874 0.751 -6.306 1.00 0.00 C ATOM 184 O PRO A 15 -13.745 1.030 -5.901 1.00 0.00 O ATOM 185 CB PRO A 15 -16.858 1.950 -7.268 1.00 0.00 C ATOM 186 CG PRO A 15 -16.320 3.251 -7.756 1.00 0.00 C ATOM 187 CD PRO A 15 -15.943 4.031 -6.527 1.00 0.00 C ATOM 0 HA PRO A 15 -16.632 1.120 -5.233 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -16.725 1.163 -8.010 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -17.926 2.016 -7.061 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -15.455 3.098 -8.402 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -17.066 3.786 -8.344 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -15.078 4.670 -6.706 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -16.755 4.679 -6.198 1.00 0.00 H new ATOM 195 N THR A 16 -15.133 -0.333 -7.030 1.00 0.00 N ATOM 196 CA THR A 16 -14.085 -1.277 -7.396 1.00 0.00 C ATOM 197 C THR A 16 -13.422 -0.880 -8.710 1.00 0.00 C ATOM 198 O THR A 16 -14.057 -0.286 -9.582 1.00 0.00 O ATOM 199 CB THR A 16 -14.638 -2.709 -7.526 1.00 0.00 C ATOM 200 OG1 THR A 16 -14.713 -3.324 -6.235 1.00 0.00 O ATOM 201 CG2 THR A 16 -13.761 -3.547 -8.444 1.00 0.00 C ATOM 0 H THR A 16 -16.061 -0.579 -7.375 1.00 0.00 H new ATOM 0 HA THR A 16 -13.345 -1.253 -6.596 1.00 0.00 H new ATOM 0 HB THR A 16 -15.637 -2.652 -7.959 1.00 0.00 H new ATOM 0 HG1 THR A 16 -15.067 -4.233 -6.326 1.00 0.00 H new ATOM 0 HG21 THR A 16 -14.172 -4.554 -8.520 1.00 0.00 H new ATOM 0 HG22 THR A 16 -13.731 -3.092 -9.434 1.00 0.00 H new ATOM 0 HG23 THR A 16 -12.751 -3.597 -8.037 1.00 0.00 H new ATOM 209 N MET A 17 -12.142 -1.212 -8.846 1.00 0.00 N ATOM 210 CA MET A 17 -11.394 -0.890 -10.056 1.00 0.00 C ATOM 211 C MET A 17 -11.377 -2.076 -11.015 1.00 0.00 C ATOM 212 O MET A 17 -10.622 -3.029 -10.824 1.00 0.00 O ATOM 213 CB MET A 17 -9.962 -0.484 -9.703 1.00 0.00 C ATOM 214 CG MET A 17 -9.881 0.738 -8.802 1.00 0.00 C ATOM 215 SD MET A 17 -9.849 0.309 -7.051 1.00 0.00 S ATOM 216 CE MET A 17 -8.309 -0.600 -6.954 1.00 0.00 C ATOM 0 H MET A 17 -11.602 -1.703 -8.134 1.00 0.00 H new ATOM 0 HA MET A 17 -11.890 -0.054 -10.549 1.00 0.00 H new ATOM 0 HB2 MET A 17 -9.466 -1.321 -9.211 1.00 0.00 H new ATOM 0 HB3 MET A 17 -9.413 -0.284 -10.623 1.00 0.00 H new ATOM 0 HG2 MET A 17 -8.985 1.308 -9.049 1.00 0.00 H new ATOM 0 HG3 MET A 17 -10.735 1.386 -8.998 1.00 0.00 H new ATOM 0 HE1 MET A 17 -8.511 -1.625 -6.643 1.00 0.00 H new ATOM 0 HE2 MET A 17 -7.827 -0.605 -7.932 1.00 0.00 H new ATOM 0 HE3 MET A 17 -7.650 -0.123 -6.228 1.00 0.00 H new ATOM 226 N GLU A 18 -12.213 -2.010 -12.046 1.00 0.00 N ATOM 227 CA GLU A 18 -12.294 -3.080 -13.034 1.00 0.00 C ATOM 228 C GLU A 18 -11.774 -2.609 -14.389 1.00 0.00 C ATOM 229 O GLU A 18 -11.646 -1.410 -14.635 1.00 0.00 O ATOM 230 CB GLU A 18 -13.737 -3.570 -13.171 1.00 0.00 C ATOM 231 CG GLU A 18 -14.720 -2.472 -13.538 1.00 0.00 C ATOM 232 CD GLU A 18 -14.851 -2.282 -15.037 1.00 0.00 C ATOM 233 OE1 GLU A 18 -15.683 -2.981 -15.652 1.00 0.00 O ATOM 234 OE2 GLU A 18 -14.121 -1.436 -15.594 1.00 0.00 O ATOM 0 H GLU A 18 -12.844 -1.227 -12.219 1.00 0.00 H new ATOM 0 HA GLU A 18 -11.669 -3.905 -12.691 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -13.776 -4.350 -13.931 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -14.048 -4.025 -12.231 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -15.698 -2.710 -13.119 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -14.398 -1.535 -13.084 1.00 0.00 H new ATOM 241 N GLY A 19 -11.474 -3.563 -15.265 1.00 0.00 N ATOM 242 CA GLY A 19 -10.970 -3.227 -16.584 1.00 0.00 C ATOM 243 C GLY A 19 -9.504 -2.845 -16.565 1.00 0.00 C ATOM 244 O GLY A 19 -8.669 -3.532 -15.975 1.00 0.00 O ATOM 0 H GLY A 19 -11.571 -4.562 -15.085 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -11.112 -4.077 -17.251 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -11.552 -2.401 -16.992 1.00 0.00 H new ATOM 248 N PRO A 20 -9.171 -1.726 -17.225 1.00 0.00 N ATOM 249 CA PRO A 20 -7.794 -1.229 -17.297 1.00 0.00 C ATOM 250 C PRO A 20 -7.296 -0.703 -15.955 1.00 0.00 C ATOM 251 O PRO A 20 -8.062 -0.526 -15.008 1.00 0.00 O ATOM 252 CB PRO A 20 -7.880 -0.092 -18.318 1.00 0.00 C ATOM 253 CG PRO A 20 -9.296 0.366 -18.257 1.00 0.00 C ATOM 254 CD PRO A 20 -10.114 -0.858 -17.950 1.00 0.00 C ATOM 0 HA PRO A 20 -7.091 -2.015 -17.572 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -7.192 0.716 -18.070 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -7.618 -0.438 -19.318 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -9.427 1.126 -17.487 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -9.603 0.813 -19.203 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -10.986 -0.616 -17.342 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -10.481 -1.334 -18.859 1.00 0.00 H new ATOM 262 N PRO A 21 -5.982 -0.448 -15.869 1.00 0.00 N ATOM 263 CA PRO A 21 -5.353 0.063 -14.647 1.00 0.00 C ATOM 264 C PRO A 21 -5.753 1.503 -14.348 1.00 0.00 C ATOM 265 O PRO A 21 -6.535 2.108 -15.082 1.00 0.00 O ATOM 266 CB PRO A 21 -3.856 -0.024 -14.956 1.00 0.00 C ATOM 267 CG PRO A 21 -3.772 0.044 -16.442 1.00 0.00 C ATOM 268 CD PRO A 21 -5.009 -0.636 -16.959 1.00 0.00 C ATOM 0 HA PRO A 21 -5.654 -0.504 -13.766 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -3.307 0.795 -14.490 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -3.427 -0.951 -14.577 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -3.724 1.078 -16.783 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -2.873 -0.454 -16.805 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -5.356 -0.186 -17.889 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -4.832 -1.692 -17.162 1.00 0.00 H new ATOM 276 N THR A 22 -5.210 2.050 -13.264 1.00 0.00 N ATOM 277 CA THR A 22 -5.511 3.420 -12.867 1.00 0.00 C ATOM 278 C THR A 22 -4.426 4.380 -13.340 1.00 0.00 C ATOM 279 O THR A 22 -3.256 4.010 -13.440 1.00 0.00 O ATOM 280 CB THR A 22 -5.658 3.542 -11.339 1.00 0.00 C ATOM 281 OG1 THR A 22 -6.525 4.635 -11.016 1.00 0.00 O ATOM 282 CG2 THR A 22 -4.303 3.752 -10.680 1.00 0.00 C ATOM 0 H THR A 22 -4.560 1.565 -12.646 1.00 0.00 H new ATOM 0 HA THR A 22 -6.457 3.685 -13.338 1.00 0.00 H new ATOM 0 HB THR A 22 -6.088 2.614 -10.962 1.00 0.00 H new ATOM 0 HG1 THR A 22 -6.615 4.705 -10.043 1.00 0.00 H new ATOM 0 HG21 THR A 22 -4.432 3.835 -9.601 1.00 0.00 H new ATOM 0 HG22 THR A 22 -3.655 2.905 -10.903 1.00 0.00 H new ATOM 0 HG23 THR A 22 -3.850 4.667 -11.063 1.00 0.00 H new ATOM 290 N PHE A 23 -4.821 5.615 -13.630 1.00 0.00 N ATOM 291 CA PHE A 23 -3.881 6.630 -14.093 1.00 0.00 C ATOM 292 C PHE A 23 -4.174 7.980 -13.445 1.00 0.00 C ATOM 293 O PHE A 23 -5.305 8.464 -13.479 1.00 0.00 O ATOM 294 CB PHE A 23 -3.947 6.758 -15.617 1.00 0.00 C ATOM 295 CG PHE A 23 -2.992 5.848 -16.336 1.00 0.00 C ATOM 296 CD1 PHE A 23 -3.104 4.472 -16.220 1.00 0.00 C ATOM 297 CD2 PHE A 23 -1.982 6.370 -17.129 1.00 0.00 C ATOM 298 CE1 PHE A 23 -2.228 3.633 -16.881 1.00 0.00 C ATOM 299 CE2 PHE A 23 -1.103 5.535 -17.793 1.00 0.00 C ATOM 300 CZ PHE A 23 -1.226 4.165 -17.668 1.00 0.00 C ATOM 0 H PHE A 23 -5.786 5.938 -13.553 1.00 0.00 H new ATOM 0 HA PHE A 23 -2.877 6.319 -13.804 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -4.963 6.541 -15.948 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -3.734 7.790 -15.897 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -3.886 4.050 -15.605 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -1.881 7.441 -17.229 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -2.327 2.562 -16.782 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -0.321 5.953 -18.409 1.00 0.00 H new ATOM 0 HZ PHE A 23 -0.540 3.511 -18.185 1.00 0.00 H new ATOM 310 N ASN A 24 -3.147 8.581 -12.854 1.00 0.00 N ATOM 311 CA ASN A 24 -3.294 9.874 -12.197 1.00 0.00 C ATOM 312 C ASN A 24 -4.288 9.788 -11.042 1.00 0.00 C ATOM 313 O ASN A 24 -5.179 10.624 -10.895 1.00 0.00 O ATOM 314 CB ASN A 24 -3.753 10.932 -13.202 1.00 0.00 C ATOM 315 CG ASN A 24 -2.658 11.316 -14.178 1.00 0.00 C ATOM 316 OD1 ASN A 24 -2.042 12.375 -14.053 1.00 0.00 O ATOM 317 ND2 ASN A 24 -2.410 10.455 -15.158 1.00 0.00 N ATOM 0 H ASN A 24 -2.204 8.193 -12.817 1.00 0.00 H new ATOM 0 HA ASN A 24 -2.322 10.162 -11.796 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -4.613 10.555 -13.755 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -4.085 11.820 -12.664 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -1.685 10.660 -15.845 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -2.945 9.589 -15.224 1.00 0.00 H new ATOM 324 N PRO A 25 -4.132 8.753 -10.204 1.00 0.00 N ATOM 325 CA PRO A 25 -5.006 8.533 -9.047 1.00 0.00 C ATOM 326 C PRO A 25 -4.795 9.577 -7.955 1.00 0.00 C ATOM 327 O PRO A 25 -3.668 9.930 -7.609 1.00 0.00 O ATOM 328 CB PRO A 25 -4.592 7.146 -8.549 1.00 0.00 C ATOM 329 CG PRO A 25 -3.186 6.982 -9.012 1.00 0.00 C ATOM 330 CD PRO A 25 -3.091 7.718 -10.319 1.00 0.00 C ATOM 0 HA PRO A 25 -6.061 8.608 -9.312 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -4.662 7.078 -7.463 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -5.237 6.369 -8.959 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -2.485 7.389 -8.283 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -2.937 5.928 -9.139 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -2.103 8.156 -10.463 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -3.273 7.057 -11.166 1.00 0.00 H new ATOM 338 N PRO A 26 -5.905 10.082 -7.397 1.00 0.00 N ATOM 339 CA PRO A 26 -5.868 11.092 -6.335 1.00 0.00 C ATOM 340 C PRO A 26 -5.345 10.529 -5.018 1.00 0.00 C ATOM 341 O PRO A 26 -4.970 9.359 -4.937 1.00 0.00 O ATOM 342 CB PRO A 26 -7.333 11.511 -6.192 1.00 0.00 C ATOM 343 CG PRO A 26 -8.112 10.337 -6.675 1.00 0.00 C ATOM 344 CD PRO A 26 -7.282 9.707 -7.760 1.00 0.00 C ATOM 0 HA PRO A 26 -5.197 11.915 -6.579 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -7.577 11.749 -5.157 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -7.550 12.400 -6.784 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -8.296 9.631 -5.865 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -9.085 10.645 -7.057 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.410 8.625 -7.787 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -7.555 10.085 -8.745 1.00 0.00 H new ATOM 352 N VAL A 27 -5.323 11.368 -3.988 1.00 0.00 N ATOM 353 CA VAL A 27 -4.847 10.953 -2.674 1.00 0.00 C ATOM 354 C VAL A 27 -5.688 11.574 -1.564 1.00 0.00 C ATOM 355 O VAL A 27 -6.052 12.749 -1.609 1.00 0.00 O ATOM 356 CB VAL A 27 -3.371 11.342 -2.463 1.00 0.00 C ATOM 357 CG1 VAL A 27 -2.921 10.986 -1.054 1.00 0.00 C ATOM 358 CG2 VAL A 27 -2.489 10.664 -3.500 1.00 0.00 C ATOM 0 H VAL A 27 -5.629 12.340 -4.038 1.00 0.00 H new ATOM 0 HA VAL A 27 -4.939 9.868 -2.632 1.00 0.00 H new ATOM 0 HB VAL A 27 -3.276 12.421 -2.587 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -1.876 11.268 -0.924 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.535 11.522 -0.330 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -3.029 9.913 -0.898 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.450 10.950 -3.337 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.587 9.582 -3.409 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.798 10.974 -4.499 1.00 0.00 H new ATOM 368 N PRO A 28 -6.005 10.767 -0.540 1.00 0.00 N ATOM 369 CA PRO A 28 -5.577 9.366 -0.475 1.00 0.00 C ATOM 370 C PRO A 28 -6.284 8.496 -1.508 1.00 0.00 C ATOM 371 O PRO A 28 -7.460 8.703 -1.809 1.00 0.00 O ATOM 372 CB PRO A 28 -5.971 8.941 0.942 1.00 0.00 C ATOM 373 CG PRO A 28 -7.091 9.850 1.313 1.00 0.00 C ATOM 374 CD PRO A 28 -6.805 11.159 0.632 1.00 0.00 C ATOM 0 HA PRO A 28 -4.514 9.254 -0.689 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -6.283 7.897 0.970 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -5.134 9.042 1.633 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -8.048 9.442 0.988 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -7.149 9.977 2.394 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -7.723 11.669 0.339 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -6.256 11.839 1.283 1.00 0.00 H new ATOM 382 N TYR A 29 -5.561 7.521 -2.048 1.00 0.00 N ATOM 383 CA TYR A 29 -6.120 6.620 -3.049 1.00 0.00 C ATOM 384 C TYR A 29 -6.586 5.316 -2.409 1.00 0.00 C ATOM 385 O TYR A 29 -5.787 4.563 -1.852 1.00 0.00 O ATOM 386 CB TYR A 29 -5.083 6.325 -4.135 1.00 0.00 C ATOM 387 CG TYR A 29 -5.395 5.091 -4.951 1.00 0.00 C ATOM 388 CD1 TYR A 29 -4.984 3.833 -4.528 1.00 0.00 C ATOM 389 CD2 TYR A 29 -6.099 5.183 -6.145 1.00 0.00 C ATOM 390 CE1 TYR A 29 -5.265 2.703 -5.271 1.00 0.00 C ATOM 391 CE2 TYR A 29 -6.387 4.058 -6.893 1.00 0.00 C ATOM 392 CZ TYR A 29 -5.968 2.820 -6.452 1.00 0.00 C ATOM 393 OH TYR A 29 -6.251 1.697 -7.195 1.00 0.00 O ATOM 0 H TYR A 29 -4.587 7.334 -1.809 1.00 0.00 H new ATOM 0 HA TYR A 29 -6.982 7.110 -3.501 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -5.014 7.184 -4.803 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -4.105 6.204 -3.669 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -4.436 3.737 -3.603 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -6.427 6.151 -6.495 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -4.936 1.733 -4.929 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -6.937 4.147 -7.818 1.00 0.00 H new ATOM 0 HH TYR A 29 -6.753 1.953 -7.997 1.00 0.00 H new ATOM 403 N PHE A 30 -7.887 5.056 -2.494 1.00 0.00 N ATOM 404 CA PHE A 30 -8.462 3.843 -1.923 1.00 0.00 C ATOM 405 C PHE A 30 -8.702 2.794 -3.004 1.00 0.00 C ATOM 406 O PHE A 30 -9.667 2.877 -3.763 1.00 0.00 O ATOM 407 CB PHE A 30 -9.777 4.165 -1.208 1.00 0.00 C ATOM 408 CG PHE A 30 -9.634 5.199 -0.129 1.00 0.00 C ATOM 409 CD1 PHE A 30 -9.303 4.828 1.165 1.00 0.00 C ATOM 410 CD2 PHE A 30 -9.831 6.542 -0.407 1.00 0.00 C ATOM 411 CE1 PHE A 30 -9.172 5.778 2.160 1.00 0.00 C ATOM 412 CE2 PHE A 30 -9.702 7.496 0.585 1.00 0.00 C ATOM 413 CZ PHE A 30 -9.371 7.114 1.870 1.00 0.00 C ATOM 0 H PHE A 30 -8.562 5.668 -2.952 1.00 0.00 H new ATOM 0 HA PHE A 30 -7.752 3.439 -1.201 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -10.504 4.514 -1.941 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -10.178 3.250 -0.772 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -9.146 3.785 1.398 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -10.088 6.847 -1.411 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -8.914 5.476 3.164 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -9.860 8.539 0.355 1.00 0.00 H new ATOM 0 HZ PHE A 30 -9.268 7.858 2.646 1.00 0.00 H new ATOM 423 N GLY A 31 -7.815 1.806 -3.069 1.00 0.00 N ATOM 424 CA GLY A 31 -7.946 0.754 -4.061 1.00 0.00 C ATOM 425 C GLY A 31 -8.604 -0.491 -3.501 1.00 0.00 C ATOM 426 O GLY A 31 -8.009 -1.207 -2.695 1.00 0.00 O ATOM 0 H GLY A 31 -7.008 1.715 -2.452 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.532 1.123 -4.903 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -6.959 0.498 -4.447 1.00 0.00 H new ATOM 430 N ARG A 32 -9.836 -0.751 -3.928 1.00 0.00 N ATOM 431 CA ARG A 32 -10.576 -1.917 -3.462 1.00 0.00 C ATOM 432 C ARG A 32 -10.016 -3.197 -4.075 1.00 0.00 C ATOM 433 O ARG A 32 -10.272 -3.504 -5.240 1.00 0.00 O ATOM 434 CB ARG A 32 -12.059 -1.778 -3.811 1.00 0.00 C ATOM 435 CG ARG A 32 -12.887 -1.140 -2.708 1.00 0.00 C ATOM 436 CD ARG A 32 -13.531 -2.189 -1.816 1.00 0.00 C ATOM 437 NE ARG A 32 -14.421 -1.593 -0.823 1.00 0.00 N ATOM 438 CZ ARG A 32 -15.394 -2.261 -0.213 1.00 0.00 C ATOM 439 NH1 ARG A 32 -15.600 -3.541 -0.492 1.00 0.00 N ATOM 440 NH2 ARG A 32 -16.162 -1.649 0.679 1.00 0.00 N ATOM 0 H ARG A 32 -10.342 -0.170 -4.596 1.00 0.00 H new ATOM 0 HA ARG A 32 -10.468 -1.976 -2.379 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -12.156 -1.181 -4.718 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -12.465 -2.765 -4.034 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -12.253 -0.489 -2.106 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -13.661 -0.512 -3.150 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -14.093 -2.892 -2.431 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -12.753 -2.760 -1.309 1.00 0.00 H new ATOM 0 HE ARG A 32 -14.288 -0.610 -0.585 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -15.011 -4.015 -1.176 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -16.348 -4.051 -0.022 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -16.006 -0.665 0.897 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -16.909 -2.163 1.147 1.00 0.00 H new ATOM 454 N LEU A 33 -9.251 -3.940 -3.283 1.00 0.00 N ATOM 455 CA LEU A 33 -8.654 -5.187 -3.747 1.00 0.00 C ATOM 456 C LEU A 33 -9.715 -6.269 -3.917 1.00 0.00 C ATOM 457 O LEU A 33 -10.329 -6.707 -2.944 1.00 0.00 O ATOM 458 CB LEU A 33 -7.581 -5.659 -2.764 1.00 0.00 C ATOM 459 CG LEU A 33 -6.647 -4.578 -2.220 1.00 0.00 C ATOM 460 CD1 LEU A 33 -6.026 -5.021 -0.904 1.00 0.00 C ATOM 461 CD2 LEU A 33 -5.565 -4.246 -3.238 1.00 0.00 C ATOM 0 H LEU A 33 -9.030 -3.700 -2.317 1.00 0.00 H new ATOM 0 HA LEU A 33 -8.193 -5.001 -4.717 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -8.076 -6.141 -1.921 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -6.975 -6.420 -3.256 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.233 -3.678 -2.036 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.364 -4.239 -0.532 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.814 -5.207 -0.174 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.454 -5.935 -1.061 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -4.909 -3.475 -2.834 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.982 -5.141 -3.454 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.028 -3.884 -4.156 1.00 0.00 H new ATOM 473 N GLN A 34 -9.924 -6.697 -5.158 1.00 0.00 N ATOM 474 CA GLN A 34 -10.910 -7.729 -5.454 1.00 0.00 C ATOM 475 C GLN A 34 -10.305 -9.121 -5.298 1.00 0.00 C ATOM 476 O GLN A 34 -9.692 -9.650 -6.224 1.00 0.00 O ATOM 477 CB GLN A 34 -11.454 -7.553 -6.873 1.00 0.00 C ATOM 478 CG GLN A 34 -12.528 -6.483 -6.984 1.00 0.00 C ATOM 479 CD GLN A 34 -13.922 -7.029 -6.740 1.00 0.00 C ATOM 480 OE1 GLN A 34 -14.662 -7.316 -7.681 1.00 0.00 O ATOM 481 NE2 GLN A 34 -14.287 -7.174 -5.471 1.00 0.00 N ATOM 0 H GLN A 34 -9.424 -6.345 -5.974 1.00 0.00 H new ATOM 0 HA GLN A 34 -11.730 -7.627 -4.743 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -10.630 -7.300 -7.540 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -11.862 -8.503 -7.217 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -12.321 -5.690 -6.265 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -12.486 -6.033 -7.976 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -13.641 -6.923 -4.723 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -15.213 -7.536 -5.245 1.00 0.00 H new ATOM 490 N GLY A 35 -10.482 -9.709 -4.119 1.00 0.00 N ATOM 491 CA GLY A 35 -9.948 -11.034 -3.863 1.00 0.00 C ATOM 492 C GLY A 35 -9.185 -11.108 -2.555 1.00 0.00 C ATOM 493 O GLY A 35 -9.181 -12.142 -1.888 1.00 0.00 O ATOM 0 H GLY A 35 -10.986 -9.291 -3.336 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -10.766 -11.755 -3.845 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -9.288 -11.321 -4.682 1.00 0.00 H new ATOM 497 N GLY A 36 -8.535 -10.008 -2.187 1.00 0.00 N ATOM 498 CA GLY A 36 -7.772 -9.975 -0.953 1.00 0.00 C ATOM 499 C GLY A 36 -6.340 -10.432 -1.144 1.00 0.00 C ATOM 500 O GLY A 36 -5.965 -10.891 -2.224 1.00 0.00 O ATOM 0 H GLY A 36 -8.523 -9.139 -2.721 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.776 -8.961 -0.554 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.257 -10.611 -0.212 1.00 0.00 H new ATOM 504 N LEU A 37 -5.535 -10.305 -0.094 1.00 0.00 N ATOM 505 CA LEU A 37 -4.134 -10.707 -0.152 1.00 0.00 C ATOM 506 C LEU A 37 -4.004 -12.175 -0.545 1.00 0.00 C ATOM 507 O LEU A 37 -4.256 -13.070 0.263 1.00 0.00 O ATOM 508 CB LEU A 37 -3.458 -10.468 1.200 1.00 0.00 C ATOM 509 CG LEU A 37 -3.373 -9.011 1.658 1.00 0.00 C ATOM 510 CD1 LEU A 37 -2.890 -8.933 3.098 1.00 0.00 C ATOM 511 CD2 LEU A 37 -2.453 -8.217 0.742 1.00 0.00 C ATOM 0 H LEU A 37 -5.829 -9.927 0.807 1.00 0.00 H new ATOM 0 HA LEU A 37 -3.639 -10.101 -0.911 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -3.996 -11.036 1.959 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -2.447 -10.874 1.156 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.370 -8.574 1.606 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -2.835 -7.889 3.407 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.586 -9.467 3.745 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.902 -9.387 3.175 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -2.404 -7.183 1.083 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.454 -8.653 0.763 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -2.840 -8.246 -0.276 1.00 0.00 H new ATOM 523 N THR A 38 -3.607 -12.416 -1.790 1.00 0.00 N ATOM 524 CA THR A 38 -3.443 -13.775 -2.291 1.00 0.00 C ATOM 525 C THR A 38 -1.992 -14.049 -2.671 1.00 0.00 C ATOM 526 O THR A 38 -1.264 -13.142 -3.073 1.00 0.00 O ATOM 527 CB THR A 38 -4.341 -14.036 -3.515 1.00 0.00 C ATOM 528 OG1 THR A 38 -3.850 -13.308 -4.646 1.00 0.00 O ATOM 529 CG2 THR A 38 -5.778 -13.629 -3.228 1.00 0.00 C ATOM 0 H THR A 38 -3.393 -11.687 -2.471 1.00 0.00 H new ATOM 0 HA THR A 38 -3.738 -14.447 -1.485 1.00 0.00 H new ATOM 0 HB THR A 38 -4.320 -15.104 -3.733 1.00 0.00 H new ATOM 0 HG1 THR A 38 -4.425 -13.480 -5.421 1.00 0.00 H new ATOM 0 HG21 THR A 38 -6.393 -13.822 -4.107 1.00 0.00 H new ATOM 0 HG22 THR A 38 -6.158 -14.206 -2.385 1.00 0.00 H new ATOM 0 HG23 THR A 38 -5.814 -12.567 -2.987 1.00 0.00 H new ATOM 537 N ALA A 39 -1.579 -15.306 -2.543 1.00 0.00 N ATOM 538 CA ALA A 39 -0.215 -15.699 -2.877 1.00 0.00 C ATOM 539 C ALA A 39 0.100 -15.402 -4.339 1.00 0.00 C ATOM 540 O ALA A 39 1.264 -15.289 -4.722 1.00 0.00 O ATOM 541 CB ALA A 39 -0.005 -17.176 -2.580 1.00 0.00 C ATOM 0 H ALA A 39 -2.169 -16.069 -2.211 1.00 0.00 H new ATOM 0 HA ALA A 39 0.467 -15.114 -2.260 1.00 0.00 H new ATOM 0 HB1 ALA A 39 1.017 -17.456 -2.834 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -0.180 -17.363 -1.520 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -0.702 -17.769 -3.173 1.00 0.00 H new ATOM 547 N ARG A 40 -0.945 -15.277 -5.151 1.00 0.00 N ATOM 548 CA ARG A 40 -0.779 -14.994 -6.572 1.00 0.00 C ATOM 549 C ARG A 40 -1.113 -13.538 -6.879 1.00 0.00 C ATOM 550 O ARG A 40 -1.507 -13.203 -7.997 1.00 0.00 O ATOM 551 CB ARG A 40 -1.668 -15.919 -7.405 1.00 0.00 C ATOM 552 CG ARG A 40 -1.158 -17.349 -7.479 1.00 0.00 C ATOM 553 CD ARG A 40 0.079 -17.455 -8.357 1.00 0.00 C ATOM 554 NE ARG A 40 -0.262 -17.652 -9.763 1.00 0.00 N ATOM 555 CZ ARG A 40 -0.600 -18.828 -10.279 1.00 0.00 C ATOM 556 NH1 ARG A 40 -0.643 -19.906 -9.509 1.00 0.00 N ATOM 557 NH2 ARG A 40 -0.898 -18.927 -11.569 1.00 0.00 N ATOM 0 H ARG A 40 -1.915 -15.367 -4.849 1.00 0.00 H new ATOM 0 HA ARG A 40 0.264 -15.172 -6.833 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -2.672 -15.922 -6.982 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -1.749 -15.518 -8.415 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -0.925 -17.706 -6.476 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -1.942 -17.996 -7.873 1.00 0.00 H new ATOM 0 HD2 ARG A 40 0.676 -16.549 -8.253 1.00 0.00 H new ATOM 0 HD3 ARG A 40 0.697 -18.285 -8.014 1.00 0.00 H new ATOM 0 HE ARG A 40 -0.239 -16.842 -10.383 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -0.416 -19.834 -8.517 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -0.903 -20.808 -9.908 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -0.867 -18.099 -12.164 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -1.157 -19.831 -11.965 1.00 0.00 H new ATOM 571 N ARG A 41 -0.954 -12.676 -5.880 1.00 0.00 N ATOM 572 CA ARG A 41 -1.241 -11.256 -6.043 1.00 0.00 C ATOM 573 C ARG A 41 0.022 -10.421 -5.853 1.00 0.00 C ATOM 574 O ARG A 41 0.864 -10.731 -5.009 1.00 0.00 O ATOM 575 CB ARG A 41 -2.313 -10.812 -5.046 1.00 0.00 C ATOM 576 CG ARG A 41 -2.432 -9.303 -4.911 1.00 0.00 C ATOM 577 CD ARG A 41 -3.447 -8.917 -3.847 1.00 0.00 C ATOM 578 NE ARG A 41 -3.114 -7.648 -3.207 1.00 0.00 N ATOM 579 CZ ARG A 41 -3.638 -7.245 -2.055 1.00 0.00 C ATOM 580 NH1 ARG A 41 -4.516 -8.009 -1.420 1.00 0.00 N ATOM 581 NH2 ARG A 41 -3.285 -6.076 -1.536 1.00 0.00 N ATOM 0 H ARG A 41 -0.628 -12.936 -4.949 1.00 0.00 H new ATOM 0 HA ARG A 41 -1.611 -11.100 -7.057 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.276 -11.217 -5.356 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -2.087 -11.239 -4.069 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -1.459 -8.882 -4.657 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -2.726 -8.873 -5.869 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -4.436 -8.846 -4.299 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -3.497 -9.702 -3.092 1.00 0.00 H new ATOM 0 HE ARG A 41 -2.442 -7.037 -3.670 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -4.790 -8.908 -1.816 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -4.917 -7.698 -0.535 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -2.610 -5.485 -2.022 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -3.688 -5.768 -0.651 1.00 0.00 H new ATOM 595 N THR A 42 0.149 -9.359 -6.643 1.00 0.00 N ATOM 596 CA THR A 42 1.309 -8.481 -6.563 1.00 0.00 C ATOM 597 C THR A 42 0.895 -7.015 -6.639 1.00 0.00 C ATOM 598 O THR A 42 0.280 -6.585 -7.615 1.00 0.00 O ATOM 599 CB THR A 42 2.317 -8.777 -7.690 1.00 0.00 C ATOM 600 OG1 THR A 42 2.762 -10.135 -7.604 1.00 0.00 O ATOM 601 CG2 THR A 42 3.512 -7.840 -7.607 1.00 0.00 C ATOM 0 H THR A 42 -0.538 -9.087 -7.346 1.00 0.00 H new ATOM 0 HA THR A 42 1.784 -8.672 -5.601 1.00 0.00 H new ATOM 0 HB THR A 42 1.817 -8.618 -8.646 1.00 0.00 H new ATOM 0 HG1 THR A 42 3.401 -10.316 -8.325 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.210 -8.068 -8.413 1.00 0.00 H new ATOM 0 HG22 THR A 42 3.173 -6.808 -7.702 1.00 0.00 H new ATOM 0 HG23 THR A 42 4.011 -7.971 -6.647 1.00 0.00 H new ATOM 609 N ILE A 43 1.237 -6.254 -5.605 1.00 0.00 N ATOM 610 CA ILE A 43 0.903 -4.836 -5.557 1.00 0.00 C ATOM 611 C ILE A 43 2.019 -3.987 -6.157 1.00 0.00 C ATOM 612 O ILE A 43 3.193 -4.171 -5.835 1.00 0.00 O ATOM 613 CB ILE A 43 0.636 -4.369 -4.114 1.00 0.00 C ATOM 614 CG1 ILE A 43 -0.548 -5.133 -3.518 1.00 0.00 C ATOM 615 CG2 ILE A 43 0.378 -2.870 -4.081 1.00 0.00 C ATOM 616 CD1 ILE A 43 -0.156 -6.431 -2.849 1.00 0.00 C ATOM 0 H ILE A 43 1.745 -6.596 -4.789 1.00 0.00 H new ATOM 0 HA ILE A 43 -0.005 -4.706 -6.146 1.00 0.00 H new ATOM 0 HB ILE A 43 1.519 -4.579 -3.511 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -1.051 -4.496 -2.790 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -1.268 -5.344 -4.308 1.00 0.00 H new ATOM 0 HG21 ILE A 43 0.191 -2.556 -3.054 1.00 0.00 H new ATOM 0 HG22 ILE A 43 1.249 -2.342 -4.469 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -0.491 -2.637 -4.696 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -1.046 -6.918 -2.450 1.00 0.00 H new ATOM 0 HD12 ILE A 43 0.320 -7.087 -3.578 1.00 0.00 H new ATOM 0 HD13 ILE A 43 0.541 -6.226 -2.036 1.00 0.00 H new ATOM 628 N ILE A 44 1.644 -3.057 -7.028 1.00 0.00 N ATOM 629 CA ILE A 44 2.613 -2.177 -7.669 1.00 0.00 C ATOM 630 C ILE A 44 2.208 -0.714 -7.524 1.00 0.00 C ATOM 631 O ILE A 44 1.163 -0.296 -8.023 1.00 0.00 O ATOM 632 CB ILE A 44 2.769 -2.508 -9.165 1.00 0.00 C ATOM 633 CG1 ILE A 44 3.330 -3.921 -9.341 1.00 0.00 C ATOM 634 CG2 ILE A 44 3.670 -1.486 -9.843 1.00 0.00 C ATOM 635 CD1 ILE A 44 3.118 -4.487 -10.728 1.00 0.00 C ATOM 0 H ILE A 44 0.676 -2.893 -7.306 1.00 0.00 H new ATOM 0 HA ILE A 44 3.567 -2.339 -7.167 1.00 0.00 H new ATOM 0 HB ILE A 44 1.787 -2.466 -9.636 1.00 0.00 H new ATOM 0 HG12 ILE A 44 4.398 -3.909 -9.121 1.00 0.00 H new ATOM 0 HG13 ILE A 44 2.862 -4.582 -8.612 1.00 0.00 H new ATOM 0 HG21 ILE A 44 3.770 -1.734 -10.900 1.00 0.00 H new ATOM 0 HG22 ILE A 44 3.233 -0.493 -9.743 1.00 0.00 H new ATOM 0 HG23 ILE A 44 4.653 -1.499 -9.372 1.00 0.00 H new ATOM 0 HD11 ILE A 44 3.541 -5.490 -10.780 1.00 0.00 H new ATOM 0 HD12 ILE A 44 2.050 -4.531 -10.944 1.00 0.00 H new ATOM 0 HD13 ILE A 44 3.610 -3.848 -11.461 1.00 0.00 H new ATOM 647 N ILE A 45 3.043 0.060 -6.838 1.00 0.00 N ATOM 648 CA ILE A 45 2.774 1.477 -6.630 1.00 0.00 C ATOM 649 C ILE A 45 3.833 2.343 -7.303 1.00 0.00 C ATOM 650 O ILE A 45 4.972 2.420 -6.843 1.00 0.00 O ATOM 651 CB ILE A 45 2.720 1.825 -5.130 1.00 0.00 C ATOM 652 CG1 ILE A 45 1.570 1.077 -4.452 1.00 0.00 C ATOM 653 CG2 ILE A 45 2.567 3.327 -4.940 1.00 0.00 C ATOM 654 CD1 ILE A 45 1.789 0.847 -2.973 1.00 0.00 C ATOM 0 H ILE A 45 3.911 -0.271 -6.417 1.00 0.00 H new ATOM 0 HA ILE A 45 1.802 1.683 -7.078 1.00 0.00 H new ATOM 0 HB ILE A 45 3.655 1.513 -4.666 1.00 0.00 H new ATOM 0 HG12 ILE A 45 0.648 1.641 -4.591 1.00 0.00 H new ATOM 0 HG13 ILE A 45 1.432 0.115 -4.945 1.00 0.00 H new ATOM 0 HG21 ILE A 45 2.530 3.557 -3.875 1.00 0.00 H new ATOM 0 HG22 ILE A 45 3.416 3.839 -5.393 1.00 0.00 H new ATOM 0 HG23 ILE A 45 1.645 3.662 -5.416 1.00 0.00 H new ATOM 0 HD11 ILE A 45 0.935 0.312 -2.558 1.00 0.00 H new ATOM 0 HD12 ILE A 45 2.693 0.256 -2.827 1.00 0.00 H new ATOM 0 HD13 ILE A 45 1.897 1.807 -2.468 1.00 0.00 H new ATOM 666 N LYS A 46 3.450 2.994 -8.396 1.00 0.00 N ATOM 667 CA LYS A 46 4.364 3.858 -9.133 1.00 0.00 C ATOM 668 C LYS A 46 3.950 5.321 -9.008 1.00 0.00 C ATOM 669 O LYS A 46 2.922 5.733 -9.543 1.00 0.00 O ATOM 670 CB LYS A 46 4.404 3.452 -10.608 1.00 0.00 C ATOM 671 CG LYS A 46 5.482 2.432 -10.929 1.00 0.00 C ATOM 672 CD LYS A 46 5.230 1.756 -12.267 1.00 0.00 C ATOM 673 CE LYS A 46 4.398 0.493 -12.105 1.00 0.00 C ATOM 674 NZ LYS A 46 4.144 -0.175 -13.411 1.00 0.00 N ATOM 0 H LYS A 46 2.511 2.939 -8.791 1.00 0.00 H new ATOM 0 HA LYS A 46 5.359 3.743 -8.704 1.00 0.00 H new ATOM 0 HB2 LYS A 46 3.434 3.044 -10.890 1.00 0.00 H new ATOM 0 HB3 LYS A 46 4.565 4.342 -11.217 1.00 0.00 H new ATOM 0 HG2 LYS A 46 6.455 2.923 -10.946 1.00 0.00 H new ATOM 0 HG3 LYS A 46 5.518 1.679 -10.141 1.00 0.00 H new ATOM 0 HD2 LYS A 46 4.717 2.448 -12.935 1.00 0.00 H new ATOM 0 HD3 LYS A 46 6.182 1.508 -12.736 1.00 0.00 H new ATOM 0 HE2 LYS A 46 4.913 -0.198 -11.438 1.00 0.00 H new ATOM 0 HE3 LYS A 46 3.447 0.742 -11.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 3.121 -0.195 -13.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 4.624 0.351 -14.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 4.509 -1.148 -13.380 1.00 0.00 H new ATOM 688 N GLY A 47 4.760 6.102 -8.299 1.00 0.00 N ATOM 689 CA GLY A 47 4.461 7.510 -8.118 1.00 0.00 C ATOM 690 C GLY A 47 5.708 8.372 -8.117 1.00 0.00 C ATOM 691 O GLY A 47 6.656 8.105 -8.855 1.00 0.00 O ATOM 0 H GLY A 47 5.617 5.784 -7.847 1.00 0.00 H new ATOM 0 HA2 GLY A 47 3.794 7.842 -8.914 1.00 0.00 H new ATOM 0 HA3 GLY A 47 3.928 7.647 -7.177 1.00 0.00 H new ATOM 695 N TYR A 48 5.707 9.410 -7.288 1.00 0.00 N ATOM 696 CA TYR A 48 6.846 10.316 -7.197 1.00 0.00 C ATOM 697 C TYR A 48 6.723 11.224 -5.977 1.00 0.00 C ATOM 698 O TYR A 48 5.781 12.008 -5.864 1.00 0.00 O ATOM 699 CB TYR A 48 6.954 11.162 -8.467 1.00 0.00 C ATOM 700 CG TYR A 48 7.666 12.479 -8.258 1.00 0.00 C ATOM 701 CD1 TYR A 48 6.992 13.583 -7.751 1.00 0.00 C ATOM 702 CD2 TYR A 48 9.013 12.620 -8.569 1.00 0.00 C ATOM 703 CE1 TYR A 48 7.638 14.789 -7.560 1.00 0.00 C ATOM 704 CE2 TYR A 48 9.668 13.821 -8.379 1.00 0.00 C ATOM 705 CZ TYR A 48 8.976 14.903 -7.875 1.00 0.00 C ATOM 706 OH TYR A 48 9.625 16.102 -7.685 1.00 0.00 O ATOM 0 H TYR A 48 4.931 9.645 -6.670 1.00 0.00 H new ATOM 0 HA TYR A 48 7.749 9.715 -7.091 1.00 0.00 H new ATOM 0 HB2 TYR A 48 7.482 10.590 -9.231 1.00 0.00 H new ATOM 0 HB3 TYR A 48 5.952 11.357 -8.850 1.00 0.00 H new ATOM 0 HD1 TYR A 48 5.945 13.497 -7.502 1.00 0.00 H new ATOM 0 HD2 TYR A 48 9.557 11.776 -8.966 1.00 0.00 H new ATOM 0 HE1 TYR A 48 7.099 15.638 -7.166 1.00 0.00 H new ATOM 0 HE2 TYR A 48 10.716 13.913 -8.624 1.00 0.00 H new ATOM 0 HH TYR A 48 8.989 16.839 -7.796 1.00 0.00 H new ATOM 716 N VAL A 49 7.683 11.111 -5.065 1.00 0.00 N ATOM 717 CA VAL A 49 7.686 11.922 -3.853 1.00 0.00 C ATOM 718 C VAL A 49 7.984 13.383 -4.170 1.00 0.00 C ATOM 719 O VAL A 49 9.069 13.735 -4.633 1.00 0.00 O ATOM 720 CB VAL A 49 8.721 11.407 -2.835 1.00 0.00 C ATOM 721 CG1 VAL A 49 8.534 12.093 -1.490 1.00 0.00 C ATOM 722 CG2 VAL A 49 8.620 9.896 -2.692 1.00 0.00 C ATOM 0 H VAL A 49 8.469 10.466 -5.142 1.00 0.00 H new ATOM 0 HA VAL A 49 6.690 11.844 -3.418 1.00 0.00 H new ATOM 0 HB VAL A 49 9.719 11.648 -3.202 1.00 0.00 H new ATOM 0 HG11 VAL A 49 9.274 11.717 -0.784 1.00 0.00 H new ATOM 0 HG12 VAL A 49 8.661 13.169 -1.610 1.00 0.00 H new ATOM 0 HG13 VAL A 49 7.533 11.886 -1.112 1.00 0.00 H new ATOM 0 HG21 VAL A 49 9.358 9.549 -1.969 1.00 0.00 H new ATOM 0 HG22 VAL A 49 7.621 9.629 -2.347 1.00 0.00 H new ATOM 0 HG23 VAL A 49 8.808 9.426 -3.657 1.00 0.00 H new ATOM 732 N PRO A 50 6.999 14.257 -3.915 1.00 0.00 N ATOM 733 CA PRO A 50 7.132 15.695 -4.164 1.00 0.00 C ATOM 734 C PRO A 50 8.107 16.363 -3.200 1.00 0.00 C ATOM 735 O PRO A 50 8.398 15.850 -2.120 1.00 0.00 O ATOM 736 CB PRO A 50 5.714 16.227 -3.943 1.00 0.00 C ATOM 737 CG PRO A 50 5.081 15.244 -3.019 1.00 0.00 C ATOM 738 CD PRO A 50 5.679 13.908 -3.362 1.00 0.00 C ATOM 0 HA PRO A 50 7.529 15.901 -5.158 1.00 0.00 H new ATOM 0 HB2 PRO A 50 5.729 17.226 -3.508 1.00 0.00 H new ATOM 0 HB3 PRO A 50 5.166 16.297 -4.883 1.00 0.00 H new ATOM 0 HG2 PRO A 50 5.277 15.504 -1.979 1.00 0.00 H new ATOM 0 HG3 PRO A 50 3.998 15.231 -3.145 1.00 0.00 H new ATOM 0 HD2 PRO A 50 5.768 13.270 -2.483 1.00 0.00 H new ATOM 0 HD3 PRO A 50 5.069 13.369 -4.087 1.00 0.00 H new ATOM 746 N PRO A 51 8.624 17.535 -3.598 1.00 0.00 N ATOM 747 CA PRO A 51 9.574 18.299 -2.783 1.00 0.00 C ATOM 748 C PRO A 51 8.922 18.896 -1.540 1.00 0.00 C ATOM 749 O PRO A 51 9.590 19.156 -0.539 1.00 0.00 O ATOM 750 CB PRO A 51 10.040 19.409 -3.728 1.00 0.00 C ATOM 751 CG PRO A 51 8.923 19.573 -4.700 1.00 0.00 C ATOM 752 CD PRO A 51 8.321 18.206 -4.873 1.00 0.00 C ATOM 0 HA PRO A 51 10.383 17.673 -2.407 1.00 0.00 H new ATOM 0 HB2 PRO A 51 10.233 20.335 -3.186 1.00 0.00 H new ATOM 0 HB3 PRO A 51 10.967 19.136 -4.232 1.00 0.00 H new ATOM 0 HG2 PRO A 51 8.183 20.281 -4.328 1.00 0.00 H new ATOM 0 HG3 PRO A 51 9.287 19.962 -5.651 1.00 0.00 H new ATOM 0 HD2 PRO A 51 7.247 18.260 -5.053 1.00 0.00 H new ATOM 0 HD3 PRO A 51 8.760 17.678 -5.719 1.00 0.00 H new ATOM 760 N THR A 52 7.612 19.111 -1.610 1.00 0.00 N ATOM 761 CA THR A 52 6.869 19.679 -0.492 1.00 0.00 C ATOM 762 C THR A 52 6.128 18.595 0.283 1.00 0.00 C ATOM 763 O THR A 52 5.233 18.886 1.075 1.00 0.00 O ATOM 764 CB THR A 52 5.856 20.737 -0.969 1.00 0.00 C ATOM 765 OG1 THR A 52 4.957 20.159 -1.922 1.00 0.00 O ATOM 766 CG2 THR A 52 6.570 21.926 -1.593 1.00 0.00 C ATOM 0 H THR A 52 7.043 18.900 -2.430 1.00 0.00 H new ATOM 0 HA THR A 52 7.599 20.156 0.162 1.00 0.00 H new ATOM 0 HB THR A 52 5.292 21.086 -0.104 1.00 0.00 H new ATOM 0 HG1 THR A 52 4.315 20.837 -2.219 1.00 0.00 H new ATOM 0 HG21 THR A 52 5.835 22.660 -1.922 1.00 0.00 H new ATOM 0 HG22 THR A 52 7.232 22.381 -0.856 1.00 0.00 H new ATOM 0 HG23 THR A 52 7.156 21.590 -2.449 1.00 0.00 H new ATOM 774 N GLY A 53 6.508 17.342 0.049 1.00 0.00 N ATOM 775 CA GLY A 53 5.869 16.233 0.733 1.00 0.00 C ATOM 776 C GLY A 53 6.783 15.572 1.745 1.00 0.00 C ATOM 777 O GLY A 53 7.845 15.059 1.392 1.00 0.00 O ATOM 0 H GLY A 53 7.247 17.076 -0.602 1.00 0.00 H new ATOM 0 HA2 GLY A 53 4.971 16.590 1.238 1.00 0.00 H new ATOM 0 HA3 GLY A 53 5.549 15.493 -0.001 1.00 0.00 H new ATOM 781 N LYS A 54 6.372 15.586 3.009 1.00 0.00 N ATOM 782 CA LYS A 54 7.161 14.984 4.077 1.00 0.00 C ATOM 783 C LYS A 54 7.320 13.483 3.856 1.00 0.00 C ATOM 784 O LYS A 54 8.437 12.976 3.749 1.00 0.00 O ATOM 785 CB LYS A 54 6.503 15.244 5.434 1.00 0.00 C ATOM 786 CG LYS A 54 6.249 16.715 5.714 1.00 0.00 C ATOM 787 CD LYS A 54 6.174 16.993 7.206 1.00 0.00 C ATOM 788 CE LYS A 54 7.559 17.061 7.831 1.00 0.00 C ATOM 789 NZ LYS A 54 7.532 17.714 9.169 1.00 0.00 N ATOM 0 H LYS A 54 5.496 16.008 3.318 1.00 0.00 H new ATOM 0 HA LYS A 54 8.150 15.442 4.066 1.00 0.00 H new ATOM 0 HB2 LYS A 54 5.556 14.705 5.479 1.00 0.00 H new ATOM 0 HB3 LYS A 54 7.139 14.837 6.221 1.00 0.00 H new ATOM 0 HG2 LYS A 54 7.045 17.314 5.271 1.00 0.00 H new ATOM 0 HG3 LYS A 54 5.317 17.021 5.238 1.00 0.00 H new ATOM 0 HD2 LYS A 54 5.650 17.934 7.376 1.00 0.00 H new ATOM 0 HD3 LYS A 54 5.592 16.211 7.694 1.00 0.00 H new ATOM 0 HE2 LYS A 54 7.964 16.054 7.927 1.00 0.00 H new ATOM 0 HE3 LYS A 54 8.229 17.613 7.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 8.495 17.741 9.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 7.169 18.684 9.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 6.913 17.174 9.807 1.00 0.00 H new ATOM 803 N SER A 55 6.196 12.777 3.789 1.00 0.00 N ATOM 804 CA SER A 55 6.211 11.333 3.583 1.00 0.00 C ATOM 805 C SER A 55 4.792 10.791 3.437 1.00 0.00 C ATOM 806 O SER A 55 3.821 11.451 3.808 1.00 0.00 O ATOM 807 CB SER A 55 6.917 10.638 4.749 1.00 0.00 C ATOM 808 OG SER A 55 6.352 11.023 5.990 1.00 0.00 O ATOM 0 H SER A 55 5.263 13.181 3.874 1.00 0.00 H new ATOM 0 HA SER A 55 6.757 11.127 2.662 1.00 0.00 H new ATOM 0 HB2 SER A 55 6.842 9.557 4.631 1.00 0.00 H new ATOM 0 HB3 SER A 55 7.978 10.887 4.736 1.00 0.00 H new ATOM 0 HG SER A 55 6.819 10.564 6.719 1.00 0.00 H new ATOM 814 N PHE A 56 4.681 9.583 2.893 1.00 0.00 N ATOM 815 CA PHE A 56 3.382 8.951 2.696 1.00 0.00 C ATOM 816 C PHE A 56 3.262 7.682 3.535 1.00 0.00 C ATOM 817 O PHE A 56 4.149 7.362 4.325 1.00 0.00 O ATOM 818 CB PHE A 56 3.171 8.620 1.217 1.00 0.00 C ATOM 819 CG PHE A 56 4.307 7.850 0.607 1.00 0.00 C ATOM 820 CD1 PHE A 56 5.541 8.449 0.409 1.00 0.00 C ATOM 821 CD2 PHE A 56 4.142 6.526 0.232 1.00 0.00 C ATOM 822 CE1 PHE A 56 6.588 7.743 -0.151 1.00 0.00 C ATOM 823 CE2 PHE A 56 5.186 5.815 -0.328 1.00 0.00 C ATOM 824 CZ PHE A 56 6.411 6.425 -0.521 1.00 0.00 C ATOM 0 H PHE A 56 5.474 9.023 2.581 1.00 0.00 H new ATOM 0 HA PHE A 56 2.612 9.652 3.017 1.00 0.00 H new ATOM 0 HB2 PHE A 56 2.252 8.043 1.110 1.00 0.00 H new ATOM 0 HB3 PHE A 56 3.032 9.548 0.662 1.00 0.00 H new ATOM 0 HD1 PHE A 56 5.686 9.480 0.696 1.00 0.00 H new ATOM 0 HD2 PHE A 56 3.187 6.045 0.379 1.00 0.00 H new ATOM 0 HE1 PHE A 56 7.545 8.222 -0.299 1.00 0.00 H new ATOM 0 HE2 PHE A 56 5.045 4.783 -0.615 1.00 0.00 H new ATOM 0 HZ PHE A 56 7.228 5.872 -0.960 1.00 0.00 H new ATOM 834 N ALA A 57 2.157 6.964 3.357 1.00 0.00 N ATOM 835 CA ALA A 57 1.921 5.730 4.095 1.00 0.00 C ATOM 836 C ALA A 57 0.939 4.827 3.356 1.00 0.00 C ATOM 837 O ALA A 57 -0.070 5.294 2.826 1.00 0.00 O ATOM 838 CB ALA A 57 1.405 6.042 5.492 1.00 0.00 C ATOM 0 H ALA A 57 1.412 7.216 2.708 1.00 0.00 H new ATOM 0 HA ALA A 57 2.869 5.199 4.179 1.00 0.00 H new ATOM 0 HB1 ALA A 57 1.233 5.111 6.033 1.00 0.00 H new ATOM 0 HB2 ALA A 57 2.142 6.641 6.027 1.00 0.00 H new ATOM 0 HB3 ALA A 57 0.470 6.597 5.419 1.00 0.00 H new ATOM 844 N ILE A 58 1.241 3.534 3.323 1.00 0.00 N ATOM 845 CA ILE A 58 0.385 2.567 2.649 1.00 0.00 C ATOM 846 C ILE A 58 -0.156 1.532 3.631 1.00 0.00 C ATOM 847 O ILE A 58 0.542 0.589 4.001 1.00 0.00 O ATOM 848 CB ILE A 58 1.137 1.841 1.518 1.00 0.00 C ATOM 849 CG1 ILE A 58 1.769 2.855 0.563 1.00 0.00 C ATOM 850 CG2 ILE A 58 0.194 0.913 0.765 1.00 0.00 C ATOM 851 CD1 ILE A 58 3.139 3.325 1.001 1.00 0.00 C ATOM 0 H ILE A 58 2.073 3.132 3.755 1.00 0.00 H new ATOM 0 HA ILE A 58 -0.446 3.127 2.220 1.00 0.00 H new ATOM 0 HB ILE A 58 1.933 1.240 1.958 1.00 0.00 H new ATOM 0 HG12 ILE A 58 1.847 2.409 -0.428 1.00 0.00 H new ATOM 0 HG13 ILE A 58 1.109 3.718 0.473 1.00 0.00 H new ATOM 0 HG21 ILE A 58 0.740 0.407 -0.031 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.214 0.172 1.453 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -0.621 1.494 0.333 1.00 0.00 H new ATOM 0 HD11 ILE A 58 3.526 4.042 0.277 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.065 3.801 1.979 1.00 0.00 H new ATOM 0 HD13 ILE A 58 3.814 2.471 1.063 1.00 0.00 H new ATOM 863 N ASN A 59 -1.404 1.715 4.047 1.00 0.00 N ATOM 864 CA ASN A 59 -2.040 0.797 4.985 1.00 0.00 C ATOM 865 C ASN A 59 -2.952 -0.183 4.254 1.00 0.00 C ATOM 866 O ASN A 59 -3.601 0.173 3.270 1.00 0.00 O ATOM 867 CB ASN A 59 -2.842 1.576 6.030 1.00 0.00 C ATOM 868 CG ASN A 59 -1.952 2.366 6.970 1.00 0.00 C ATOM 869 OD1 ASN A 59 -1.883 2.079 8.165 1.00 0.00 O ATOM 870 ND2 ASN A 59 -1.266 3.368 6.433 1.00 0.00 N ATOM 0 H ASN A 59 -1.996 2.491 3.750 1.00 0.00 H new ATOM 0 HA ASN A 59 -1.256 0.230 5.487 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -3.527 2.257 5.525 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -3.451 0.881 6.608 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -0.651 3.935 7.016 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -1.354 3.570 5.437 1.00 0.00 H new ATOM 877 N PHE A 60 -2.997 -1.418 4.742 1.00 0.00 N ATOM 878 CA PHE A 60 -3.830 -2.450 4.135 1.00 0.00 C ATOM 879 C PHE A 60 -4.933 -2.891 5.092 1.00 0.00 C ATOM 880 O PHE A 60 -4.712 -3.721 5.974 1.00 0.00 O ATOM 881 CB PHE A 60 -2.975 -3.655 3.735 1.00 0.00 C ATOM 882 CG PHE A 60 -2.013 -3.363 2.619 1.00 0.00 C ATOM 883 CD1 PHE A 60 -0.859 -2.632 2.855 1.00 0.00 C ATOM 884 CD2 PHE A 60 -2.261 -3.819 1.335 1.00 0.00 C ATOM 885 CE1 PHE A 60 0.028 -2.361 1.831 1.00 0.00 C ATOM 886 CE2 PHE A 60 -1.377 -3.551 0.306 1.00 0.00 C ATOM 887 CZ PHE A 60 -0.231 -2.823 0.555 1.00 0.00 C ATOM 0 H PHE A 60 -2.467 -1.729 5.556 1.00 0.00 H new ATOM 0 HA PHE A 60 -4.294 -2.029 3.243 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -2.416 -3.999 4.605 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -3.631 -4.472 3.434 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -0.651 -2.270 3.851 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -3.155 -4.391 1.135 1.00 0.00 H new ATOM 0 HE1 PHE A 60 0.923 -1.789 2.028 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -1.583 -3.911 -0.691 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.462 -2.615 -0.247 1.00 0.00 H new ATOM 897 N LYS A 61 -6.124 -2.329 4.911 1.00 0.00 N ATOM 898 CA LYS A 61 -7.264 -2.662 5.756 1.00 0.00 C ATOM 899 C LYS A 61 -8.133 -3.732 5.101 1.00 0.00 C ATOM 900 O LYS A 61 -7.975 -4.035 3.919 1.00 0.00 O ATOM 901 CB LYS A 61 -8.101 -1.412 6.037 1.00 0.00 C ATOM 902 CG LYS A 61 -9.255 -1.654 6.994 1.00 0.00 C ATOM 903 CD LYS A 61 -9.973 -0.361 7.340 1.00 0.00 C ATOM 904 CE LYS A 61 -9.220 0.428 8.400 1.00 0.00 C ATOM 905 NZ LYS A 61 -9.833 1.765 8.636 1.00 0.00 N ATOM 0 H LYS A 61 -6.324 -1.640 4.186 1.00 0.00 H new ATOM 0 HA LYS A 61 -6.882 -3.055 6.698 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -7.454 -0.638 6.450 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -8.495 -1.030 5.095 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -9.960 -2.354 6.546 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -8.881 -2.119 7.906 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -10.083 0.247 6.442 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -10.978 -0.586 7.698 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -9.208 -0.136 9.333 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -8.182 0.554 8.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -9.291 2.272 9.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -9.821 2.313 7.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -10.815 1.645 8.956 1.00 0.00 H new ATOM 919 N VAL A 62 -9.052 -4.298 5.877 1.00 0.00 N ATOM 920 CA VAL A 62 -9.947 -5.332 5.371 1.00 0.00 C ATOM 921 C VAL A 62 -11.320 -4.756 5.040 1.00 0.00 C ATOM 922 O VAL A 62 -11.983 -4.174 5.898 1.00 0.00 O ATOM 923 CB VAL A 62 -10.115 -6.476 6.388 1.00 0.00 C ATOM 924 CG1 VAL A 62 -10.971 -7.589 5.803 1.00 0.00 C ATOM 925 CG2 VAL A 62 -8.756 -7.008 6.819 1.00 0.00 C ATOM 0 H VAL A 62 -9.196 -4.058 6.858 1.00 0.00 H new ATOM 0 HA VAL A 62 -9.492 -5.727 4.463 1.00 0.00 H new ATOM 0 HB VAL A 62 -10.623 -6.085 7.269 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -11.079 -8.389 6.536 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -11.955 -7.195 5.548 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -10.494 -7.982 4.905 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -8.893 -7.816 7.538 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.220 -7.384 5.948 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.181 -6.205 7.280 1.00 0.00 H new ATOM 935 N GLY A 63 -11.740 -4.922 3.790 1.00 0.00 N ATOM 936 CA GLY A 63 -13.032 -4.414 3.368 1.00 0.00 C ATOM 937 C GLY A 63 -14.175 -4.989 4.180 1.00 0.00 C ATOM 938 O GLY A 63 -15.118 -4.277 4.527 1.00 0.00 O ATOM 0 H GLY A 63 -11.209 -5.399 3.062 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -13.038 -3.328 3.457 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -13.185 -4.649 2.315 1.00 0.00 H new ATOM 942 N SER A 64 -14.093 -6.280 4.484 1.00 0.00 N ATOM 943 CA SER A 64 -15.131 -6.951 5.257 1.00 0.00 C ATOM 944 C SER A 64 -15.214 -6.379 6.668 1.00 0.00 C ATOM 945 O SER A 64 -16.174 -5.692 7.017 1.00 0.00 O ATOM 946 CB SER A 64 -14.858 -8.456 5.319 1.00 0.00 C ATOM 947 OG SER A 64 -16.057 -9.183 5.523 1.00 0.00 O ATOM 0 H SER A 64 -13.318 -6.882 4.207 1.00 0.00 H new ATOM 0 HA SER A 64 -16.086 -6.782 4.759 1.00 0.00 H new ATOM 0 HB2 SER A 64 -14.385 -8.782 4.393 1.00 0.00 H new ATOM 0 HB3 SER A 64 -14.158 -8.669 6.127 1.00 0.00 H new ATOM 0 HG SER A 64 -15.856 -10.142 5.557 1.00 0.00 H new ATOM 953 N SER A 65 -14.200 -6.669 7.478 1.00 0.00 N ATOM 954 CA SER A 65 -14.158 -6.187 8.853 1.00 0.00 C ATOM 955 C SER A 65 -13.694 -4.734 8.906 1.00 0.00 C ATOM 956 O SER A 65 -14.493 -3.824 9.120 1.00 0.00 O ATOM 957 CB SER A 65 -13.227 -7.062 9.694 1.00 0.00 C ATOM 958 OG SER A 65 -13.165 -6.601 11.033 1.00 0.00 O ATOM 0 H SER A 65 -13.397 -7.235 7.205 1.00 0.00 H new ATOM 0 HA SER A 65 -15.167 -6.243 9.262 1.00 0.00 H new ATOM 0 HB2 SER A 65 -13.579 -8.094 9.677 1.00 0.00 H new ATOM 0 HB3 SER A 65 -12.228 -7.059 9.258 1.00 0.00 H new ATOM 0 HG SER A 65 -12.253 -6.712 11.375 1.00 0.00 H new ATOM 964 N GLY A 66 -12.396 -4.527 8.710 1.00 0.00 N ATOM 965 CA GLY A 66 -11.847 -3.184 8.739 1.00 0.00 C ATOM 966 C GLY A 66 -10.612 -3.081 9.613 1.00 0.00 C ATOM 967 O GLY A 66 -10.447 -2.112 10.354 1.00 0.00 O ATOM 0 H GLY A 66 -11.715 -5.265 8.532 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -11.597 -2.875 7.724 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -12.606 -2.492 9.105 1.00 0.00 H new ATOM 971 N ASP A 67 -9.744 -4.083 9.526 1.00 0.00 N ATOM 972 CA ASP A 67 -8.517 -4.102 10.315 1.00 0.00 C ATOM 973 C ASP A 67 -7.290 -4.011 9.414 1.00 0.00 C ATOM 974 O ASP A 67 -7.256 -4.599 8.333 1.00 0.00 O ATOM 975 CB ASP A 67 -8.451 -5.373 11.163 1.00 0.00 C ATOM 976 CG ASP A 67 -9.821 -5.850 11.601 1.00 0.00 C ATOM 977 OD1 ASP A 67 -10.525 -5.081 12.290 1.00 0.00 O ATOM 978 OD2 ASP A 67 -10.191 -6.991 11.254 1.00 0.00 O ATOM 0 H ASP A 67 -9.867 -4.892 8.918 1.00 0.00 H new ATOM 0 HA ASP A 67 -8.525 -3.235 10.975 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -7.961 -6.162 10.592 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -7.836 -5.187 12.043 1.00 0.00 H new ATOM 983 N ILE A 68 -6.284 -3.269 9.866 1.00 0.00 N ATOM 984 CA ILE A 68 -5.055 -3.101 9.101 1.00 0.00 C ATOM 985 C ILE A 68 -4.055 -4.208 9.418 1.00 0.00 C ATOM 986 O ILE A 68 -3.627 -4.363 10.561 1.00 0.00 O ATOM 987 CB ILE A 68 -4.399 -1.736 9.381 1.00 0.00 C ATOM 988 CG1 ILE A 68 -5.406 -0.606 9.156 1.00 0.00 C ATOM 989 CG2 ILE A 68 -3.175 -1.546 8.498 1.00 0.00 C ATOM 990 CD1 ILE A 68 -4.977 0.714 9.756 1.00 0.00 C ATOM 0 H ILE A 68 -6.296 -2.775 10.758 1.00 0.00 H new ATOM 0 HA ILE A 68 -5.330 -3.153 8.047 1.00 0.00 H new ATOM 0 HB ILE A 68 -4.079 -1.710 10.423 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -5.560 -0.476 8.085 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -6.366 -0.895 9.584 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -2.722 -0.577 8.707 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -2.452 -2.336 8.703 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -3.472 -1.589 7.450 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -5.738 1.468 9.558 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -4.850 0.600 10.833 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -4.032 1.026 9.311 1.00 0.00 H new ATOM 1002 N ALA A 69 -3.685 -4.974 8.396 1.00 0.00 N ATOM 1003 CA ALA A 69 -2.732 -6.064 8.565 1.00 0.00 C ATOM 1004 C ALA A 69 -1.303 -5.582 8.341 1.00 0.00 C ATOM 1005 O ALA A 69 -0.366 -6.069 8.977 1.00 0.00 O ATOM 1006 CB ALA A 69 -3.062 -7.205 7.614 1.00 0.00 C ATOM 0 H ALA A 69 -4.031 -4.860 7.443 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.809 -6.427 9.590 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.342 -8.012 7.751 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -4.066 -7.574 7.823 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -3.014 -6.847 6.586 1.00 0.00 H new ATOM 1012 N LEU A 70 -1.141 -4.625 7.435 1.00 0.00 N ATOM 1013 CA LEU A 70 0.176 -4.078 7.126 1.00 0.00 C ATOM 1014 C LEU A 70 0.112 -2.562 6.967 1.00 0.00 C ATOM 1015 O LEU A 70 -0.743 -2.038 6.253 1.00 0.00 O ATOM 1016 CB LEU A 70 0.728 -4.713 5.849 1.00 0.00 C ATOM 1017 CG LEU A 70 2.070 -4.171 5.355 1.00 0.00 C ATOM 1018 CD1 LEU A 70 3.170 -4.470 6.362 1.00 0.00 C ATOM 1019 CD2 LEU A 70 2.414 -4.759 3.995 1.00 0.00 C ATOM 0 H LEU A 70 -1.905 -4.211 6.901 1.00 0.00 H new ATOM 0 HA LEU A 70 0.842 -4.310 7.957 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.831 -5.785 6.016 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -0.008 -4.583 5.055 1.00 0.00 H new ATOM 0 HG LEU A 70 1.987 -3.089 5.250 1.00 0.00 H new ATOM 0 HD11 LEU A 70 4.117 -4.077 5.993 1.00 0.00 H new ATOM 0 HD12 LEU A 70 2.928 -4.000 7.315 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.254 -5.548 6.500 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.372 -4.362 3.659 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.478 -5.844 4.073 1.00 0.00 H new ATOM 0 HD23 LEU A 70 1.639 -4.492 3.277 1.00 0.00 H new ATOM 1031 N HIS A 71 1.024 -1.863 7.636 1.00 0.00 N ATOM 1032 CA HIS A 71 1.073 -0.407 7.567 1.00 0.00 C ATOM 1033 C HIS A 71 2.506 0.080 7.377 1.00 0.00 C ATOM 1034 O HIS A 71 3.245 0.257 8.346 1.00 0.00 O ATOM 1035 CB HIS A 71 0.478 0.206 8.835 1.00 0.00 C ATOM 1036 CG HIS A 71 0.902 1.622 9.072 1.00 0.00 C ATOM 1037 ND1 HIS A 71 1.061 2.318 10.222 1.00 0.00 N flip ATOM 1038 CD2 HIS A 71 1.216 2.495 8.051 1.00 0.00 C flip ATOM 1039 CE1 HIS A 71 1.466 3.585 9.878 1.00 0.00 C flip ATOM 1040 NE2 HIS A 71 1.552 3.665 8.563 1.00 0.00 N flip ATOM 0 H HIS A 71 1.739 -2.281 8.232 1.00 0.00 H new ATOM 0 HA HIS A 71 0.483 -0.089 6.708 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -0.609 0.167 8.772 1.00 0.00 H new ATOM 0 HB3 HIS A 71 0.769 -0.400 9.693 1.00 0.00 H new ATOM 0 HD1 HIS A 71 0.909 1.967 11.168 1.00 0.00 H new ATOM 0 HD2 HIS A 71 1.191 2.259 6.998 1.00 0.00 H new ATOM 0 HE1 HIS A 71 1.679 4.386 10.571 1.00 0.00 H new ATOM 1049 N ILE A 72 2.892 0.293 6.123 1.00 0.00 N ATOM 1050 CA ILE A 72 4.237 0.759 5.807 1.00 0.00 C ATOM 1051 C ILE A 72 4.257 2.267 5.584 1.00 0.00 C ATOM 1052 O ILE A 72 3.417 2.810 4.868 1.00 0.00 O ATOM 1053 CB ILE A 72 4.796 0.058 4.555 1.00 0.00 C ATOM 1054 CG1 ILE A 72 4.668 -1.460 4.694 1.00 0.00 C ATOM 1055 CG2 ILE A 72 6.247 0.455 4.330 1.00 0.00 C ATOM 1056 CD1 ILE A 72 4.623 -2.186 3.367 1.00 0.00 C ATOM 0 H ILE A 72 2.293 0.150 5.310 1.00 0.00 H new ATOM 0 HA ILE A 72 4.866 0.512 6.662 1.00 0.00 H new ATOM 0 HB ILE A 72 4.215 0.374 3.689 1.00 0.00 H new ATOM 0 HG12 ILE A 72 5.509 -1.836 5.276 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.763 -1.690 5.256 1.00 0.00 H new ATOM 0 HG21 ILE A 72 6.628 -0.048 3.442 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.312 1.534 4.191 1.00 0.00 H new ATOM 0 HG23 ILE A 72 6.842 0.164 5.196 1.00 0.00 H new ATOM 0 HD11 ILE A 72 4.532 -3.258 3.542 1.00 0.00 H new ATOM 0 HD12 ILE A 72 3.766 -1.838 2.791 1.00 0.00 H new ATOM 0 HD13 ILE A 72 5.539 -1.986 2.811 1.00 0.00 H new ATOM 1068 N ASN A 73 5.224 2.938 6.202 1.00 0.00 N ATOM 1069 CA ASN A 73 5.355 4.385 6.070 1.00 0.00 C ATOM 1070 C ASN A 73 6.822 4.791 5.970 1.00 0.00 C ATOM 1071 O ASN A 73 7.569 4.758 6.949 1.00 0.00 O ATOM 1072 CB ASN A 73 4.699 5.088 7.259 1.00 0.00 C ATOM 1073 CG ASN A 73 4.365 6.537 6.962 1.00 0.00 C ATOM 1074 OD1 ASN A 73 5.364 7.297 6.528 1.00 0.00 O flip ATOM 1075 ND2 ASN A 73 3.223 6.968 7.121 1.00 0.00 N flip ATOM 0 H ASN A 73 5.928 2.503 6.799 1.00 0.00 H new ATOM 0 HA ASN A 73 4.849 4.689 5.153 1.00 0.00 H new ATOM 0 HB2 ASN A 73 3.788 4.557 7.534 1.00 0.00 H new ATOM 0 HB3 ASN A 73 5.367 5.041 8.119 1.00 0.00 H new ATOM 0 HD21 ASN A 73 2.486 6.348 7.457 1.00 0.00 H new ATOM 0 HD22 ASN A 73 3.014 7.945 6.917 1.00 0.00 H new ATOM 1082 N PRO A 74 7.247 5.184 4.760 1.00 0.00 N ATOM 1083 CA PRO A 74 8.627 5.606 4.504 1.00 0.00 C ATOM 1084 C PRO A 74 8.957 6.941 5.161 1.00 0.00 C ATOM 1085 O PRO A 74 8.070 7.758 5.410 1.00 0.00 O ATOM 1086 CB PRO A 74 8.682 5.733 2.979 1.00 0.00 C ATOM 1087 CG PRO A 74 7.274 5.996 2.570 1.00 0.00 C ATOM 1088 CD PRO A 74 6.412 5.248 3.549 1.00 0.00 C ATOM 0 HA PRO A 74 9.351 4.901 4.914 1.00 0.00 H new ATOM 0 HB2 PRO A 74 9.341 6.545 2.673 1.00 0.00 H new ATOM 0 HB3 PRO A 74 9.064 4.822 2.519 1.00 0.00 H new ATOM 0 HG2 PRO A 74 7.054 7.063 2.592 1.00 0.00 H new ATOM 0 HG3 PRO A 74 7.093 5.655 1.551 1.00 0.00 H new ATOM 0 HD2 PRO A 74 5.472 5.768 3.736 1.00 0.00 H new ATOM 0 HD3 PRO A 74 6.158 4.253 3.183 1.00 0.00 H new ATOM 1096 N ARG A 75 10.238 7.158 5.441 1.00 0.00 N ATOM 1097 CA ARG A 75 10.685 8.394 6.071 1.00 0.00 C ATOM 1098 C ARG A 75 11.901 8.965 5.347 1.00 0.00 C ATOM 1099 O ARG A 75 13.037 8.583 5.626 1.00 0.00 O ATOM 1100 CB ARG A 75 11.022 8.149 7.542 1.00 0.00 C ATOM 1101 CG ARG A 75 9.805 7.874 8.409 1.00 0.00 C ATOM 1102 CD ARG A 75 10.205 7.435 9.809 1.00 0.00 C ATOM 1103 NE ARG A 75 10.419 8.573 10.699 1.00 0.00 N ATOM 1104 CZ ARG A 75 9.434 9.239 11.290 1.00 0.00 C ATOM 1105 NH1 ARG A 75 8.173 8.883 11.087 1.00 0.00 N ATOM 1106 NH2 ARG A 75 9.709 10.264 12.086 1.00 0.00 N ATOM 0 H ARG A 75 10.985 6.493 5.241 1.00 0.00 H new ATOM 0 HA ARG A 75 9.873 9.119 6.008 1.00 0.00 H new ATOM 0 HB2 ARG A 75 11.706 7.304 7.613 1.00 0.00 H new ATOM 0 HB3 ARG A 75 11.548 9.019 7.935 1.00 0.00 H new ATOM 0 HG2 ARG A 75 9.190 8.772 8.470 1.00 0.00 H new ATOM 0 HG3 ARG A 75 9.194 7.100 7.945 1.00 0.00 H new ATOM 0 HD2 ARG A 75 9.428 6.792 10.223 1.00 0.00 H new ATOM 0 HD3 ARG A 75 11.117 6.840 9.756 1.00 0.00 H new ATOM 0 HE ARG A 75 11.378 8.873 10.876 1.00 0.00 H new ATOM 0 HH11 ARG A 75 7.957 8.096 10.475 1.00 0.00 H new ATOM 0 HH12 ARG A 75 7.418 9.397 11.542 1.00 0.00 H new ATOM 0 HH21 ARG A 75 10.678 10.541 12.244 1.00 0.00 H new ATOM 0 HH22 ARG A 75 8.952 10.775 12.540 1.00 0.00 H new ATOM 1120 N MET A 76 11.653 9.881 4.416 1.00 0.00 N ATOM 1121 CA MET A 76 12.728 10.504 3.653 1.00 0.00 C ATOM 1122 C MET A 76 13.851 10.968 4.575 1.00 0.00 C ATOM 1123 O MET A 76 15.005 11.071 4.160 1.00 0.00 O ATOM 1124 CB MET A 76 12.190 11.689 2.848 1.00 0.00 C ATOM 1125 CG MET A 76 11.300 11.280 1.685 1.00 0.00 C ATOM 1126 SD MET A 76 9.592 10.991 2.186 1.00 0.00 S ATOM 1127 CE MET A 76 9.153 9.622 1.117 1.00 0.00 C ATOM 0 H MET A 76 10.718 10.208 4.172 1.00 0.00 H new ATOM 0 HA MET A 76 13.131 9.760 2.966 1.00 0.00 H new ATOM 0 HB2 MET A 76 11.627 12.344 3.513 1.00 0.00 H new ATOM 0 HB3 MET A 76 13.030 12.269 2.466 1.00 0.00 H new ATOM 0 HG2 MET A 76 11.324 12.059 0.923 1.00 0.00 H new ATOM 0 HG3 MET A 76 11.699 10.374 1.228 1.00 0.00 H new ATOM 0 HE1 MET A 76 8.090 9.671 0.881 1.00 0.00 H new ATOM 0 HE2 MET A 76 9.732 9.680 0.195 1.00 0.00 H new ATOM 0 HE3 MET A 76 9.369 8.681 1.623 1.00 0.00 H new ATOM 1137 N GLY A 77 13.505 11.248 5.828 1.00 0.00 N ATOM 1138 CA GLY A 77 14.495 11.699 6.788 1.00 0.00 C ATOM 1139 C GLY A 77 15.696 10.777 6.858 1.00 0.00 C ATOM 1140 O GLY A 77 16.633 10.906 6.072 1.00 0.00 O ATOM 0 H GLY A 77 12.557 11.170 6.195 1.00 0.00 H new ATOM 0 HA2 GLY A 77 14.826 12.702 6.520 1.00 0.00 H new ATOM 0 HA3 GLY A 77 14.036 11.768 7.774 1.00 0.00 H new ATOM 1144 N ASN A 78 15.669 9.844 7.805 1.00 0.00 N ATOM 1145 CA ASN A 78 16.765 8.897 7.977 1.00 0.00 C ATOM 1146 C ASN A 78 16.544 7.649 7.128 1.00 0.00 C ATOM 1147 O ASN A 78 17.133 6.599 7.384 1.00 0.00 O ATOM 1148 CB ASN A 78 16.905 8.508 9.450 1.00 0.00 C ATOM 1149 CG ASN A 78 16.463 9.618 10.385 1.00 0.00 C ATOM 1150 OD1 ASN A 78 16.870 10.770 10.234 1.00 0.00 O ATOM 1151 ND2 ASN A 78 15.628 9.274 11.358 1.00 0.00 N ATOM 0 H ASN A 78 14.900 9.724 8.465 1.00 0.00 H new ATOM 0 HA ASN A 78 17.685 9.381 7.647 1.00 0.00 H new ATOM 0 HB2 ASN A 78 16.312 7.614 9.645 1.00 0.00 H new ATOM 0 HB3 ASN A 78 17.944 8.253 9.659 1.00 0.00 H new ATOM 0 HD21 ASN A 78 15.297 9.977 12.019 1.00 0.00 H new ATOM 0 HD22 ASN A 78 15.317 8.306 11.445 1.00 0.00 H new ATOM 1158 N GLY A 79 15.691 7.772 6.115 1.00 0.00 N ATOM 1159 CA GLY A 79 15.408 6.646 5.244 1.00 0.00 C ATOM 1160 C GLY A 79 14.964 5.417 6.011 1.00 0.00 C ATOM 1161 O GLY A 79 15.353 4.295 5.682 1.00 0.00 O ATOM 0 H GLY A 79 15.192 8.630 5.882 1.00 0.00 H new ATOM 0 HA2 GLY A 79 14.631 6.927 4.533 1.00 0.00 H new ATOM 0 HA3 GLY A 79 16.299 6.406 4.664 1.00 0.00 H new ATOM 1165 N THR A 80 14.147 5.625 7.039 1.00 0.00 N ATOM 1166 CA THR A 80 13.652 4.525 7.857 1.00 0.00 C ATOM 1167 C THR A 80 12.168 4.280 7.608 1.00 0.00 C ATOM 1168 O THR A 80 11.334 5.150 7.858 1.00 0.00 O ATOM 1169 CB THR A 80 13.870 4.798 9.357 1.00 0.00 C ATOM 1170 OG1 THR A 80 13.358 6.090 9.700 1.00 0.00 O ATOM 1171 CG2 THR A 80 15.348 4.723 9.711 1.00 0.00 C ATOM 0 H THR A 80 13.814 6.546 7.325 1.00 0.00 H new ATOM 0 HA THR A 80 14.218 3.638 7.570 1.00 0.00 H new ATOM 0 HB THR A 80 13.337 4.035 9.924 1.00 0.00 H new ATOM 0 HG1 THR A 80 13.499 6.255 10.656 1.00 0.00 H new ATOM 0 HG21 THR A 80 15.478 4.919 10.775 1.00 0.00 H new ATOM 0 HG22 THR A 80 15.728 3.729 9.476 1.00 0.00 H new ATOM 0 HG23 THR A 80 15.898 5.467 9.135 1.00 0.00 H new ATOM 1179 N VAL A 81 11.845 3.089 7.114 1.00 0.00 N ATOM 1180 CA VAL A 81 10.460 2.728 6.833 1.00 0.00 C ATOM 1181 C VAL A 81 9.874 1.880 7.956 1.00 0.00 C ATOM 1182 O VAL A 81 10.260 0.726 8.143 1.00 0.00 O ATOM 1183 CB VAL A 81 10.340 1.956 5.505 1.00 0.00 C ATOM 1184 CG1 VAL A 81 8.882 1.836 5.087 1.00 0.00 C ATOM 1185 CG2 VAL A 81 11.160 2.634 4.419 1.00 0.00 C ATOM 0 H VAL A 81 12.523 2.358 6.900 1.00 0.00 H new ATOM 0 HA VAL A 81 9.900 3.660 6.755 1.00 0.00 H new ATOM 0 HB VAL A 81 10.735 0.951 5.652 1.00 0.00 H new ATOM 0 HG11 VAL A 81 8.817 1.288 4.147 1.00 0.00 H new ATOM 0 HG12 VAL A 81 8.325 1.303 5.857 1.00 0.00 H new ATOM 0 HG13 VAL A 81 8.458 2.832 4.957 1.00 0.00 H new ATOM 0 HG21 VAL A 81 11.064 2.075 3.488 1.00 0.00 H new ATOM 0 HG22 VAL A 81 10.797 3.651 4.271 1.00 0.00 H new ATOM 0 HG23 VAL A 81 12.208 2.662 4.718 1.00 0.00 H new ATOM 1195 N VAL A 82 8.939 2.460 8.702 1.00 0.00 N ATOM 1196 CA VAL A 82 8.298 1.757 9.807 1.00 0.00 C ATOM 1197 C VAL A 82 7.161 0.872 9.309 1.00 0.00 C ATOM 1198 O VAL A 82 6.466 1.215 8.353 1.00 0.00 O ATOM 1199 CB VAL A 82 7.746 2.742 10.854 1.00 0.00 C ATOM 1200 CG1 VAL A 82 7.072 1.991 11.992 1.00 0.00 C ATOM 1201 CG2 VAL A 82 8.857 3.638 11.380 1.00 0.00 C ATOM 0 H VAL A 82 8.609 3.415 8.561 1.00 0.00 H new ATOM 0 HA VAL A 82 9.062 1.135 10.272 1.00 0.00 H new ATOM 0 HB VAL A 82 6.998 3.373 10.374 1.00 0.00 H new ATOM 0 HG11 VAL A 82 6.688 2.704 12.722 1.00 0.00 H new ATOM 0 HG12 VAL A 82 6.248 1.396 11.598 1.00 0.00 H new ATOM 0 HG13 VAL A 82 7.796 1.334 12.473 1.00 0.00 H new ATOM 0 HG21 VAL A 82 8.449 4.328 12.119 1.00 0.00 H new ATOM 0 HG22 VAL A 82 9.630 3.025 11.844 1.00 0.00 H new ATOM 0 HG23 VAL A 82 9.289 4.204 10.555 1.00 0.00 H new ATOM 1211 N ARG A 83 6.977 -0.270 9.964 1.00 0.00 N ATOM 1212 CA ARG A 83 5.924 -1.206 9.588 1.00 0.00 C ATOM 1213 C ARG A 83 5.037 -1.536 10.784 1.00 0.00 C ATOM 1214 O ARG A 83 5.520 -1.984 11.823 1.00 0.00 O ATOM 1215 CB ARG A 83 6.533 -2.490 9.021 1.00 0.00 C ATOM 1216 CG ARG A 83 6.949 -2.374 7.564 1.00 0.00 C ATOM 1217 CD ARG A 83 8.391 -1.909 7.431 1.00 0.00 C ATOM 1218 NE ARG A 83 9.340 -2.954 7.804 1.00 0.00 N ATOM 1219 CZ ARG A 83 10.603 -2.981 7.394 1.00 0.00 C ATOM 1220 NH1 ARG A 83 11.066 -2.024 6.602 1.00 0.00 N ATOM 1221 NH2 ARG A 83 11.406 -3.966 7.776 1.00 0.00 N ATOM 0 H ARG A 83 7.544 -0.569 10.758 1.00 0.00 H new ATOM 0 HA ARG A 83 5.309 -0.734 8.822 1.00 0.00 H new ATOM 0 HB2 ARG A 83 7.403 -2.764 9.618 1.00 0.00 H new ATOM 0 HB3 ARG A 83 5.810 -3.300 9.120 1.00 0.00 H new ATOM 0 HG2 ARG A 83 6.830 -3.340 7.073 1.00 0.00 H new ATOM 0 HG3 ARG A 83 6.291 -1.673 7.051 1.00 0.00 H new ATOM 0 HD2 ARG A 83 8.579 -1.599 6.403 1.00 0.00 H new ATOM 0 HD3 ARG A 83 8.549 -1.034 8.061 1.00 0.00 H new ATOM 0 HE ARG A 83 9.015 -3.705 8.413 1.00 0.00 H new ATOM 0 HH11 ARG A 83 10.452 -1.265 6.306 1.00 0.00 H new ATOM 0 HH12 ARG A 83 12.036 -2.047 6.288 1.00 0.00 H new ATOM 0 HH21 ARG A 83 11.054 -4.704 8.385 1.00 0.00 H new ATOM 0 HH22 ARG A 83 12.376 -3.985 7.460 1.00 0.00 H new ATOM 1235 N ASN A 84 3.736 -1.311 10.630 1.00 0.00 N ATOM 1236 CA ASN A 84 2.781 -1.583 11.698 1.00 0.00 C ATOM 1237 C ASN A 84 1.546 -2.296 11.155 1.00 0.00 C ATOM 1238 O ASN A 84 1.426 -2.520 9.951 1.00 0.00 O ATOM 1239 CB ASN A 84 2.370 -0.281 12.388 1.00 0.00 C ATOM 1240 CG ASN A 84 3.500 0.730 12.435 1.00 0.00 C ATOM 1241 OD1 ASN A 84 4.442 0.522 13.348 1.00 0.00 O flip ATOM 1242 ND2 ASN A 84 3.525 1.686 11.659 1.00 0.00 N flip ATOM 0 H ASN A 84 3.319 -0.941 9.776 1.00 0.00 H new ATOM 0 HA ASN A 84 3.264 -2.235 12.426 1.00 0.00 H new ATOM 0 HB2 ASN A 84 1.519 0.153 11.862 1.00 0.00 H new ATOM 0 HB3 ASN A 84 2.039 -0.500 13.403 1.00 0.00 H new ATOM 0 HD21 ASN A 84 2.779 1.806 10.973 1.00 0.00 H new ATOM 0 HD22 ASN A 84 4.291 2.358 11.702 1.00 0.00 H new ATOM 1249 N SER A 85 0.631 -2.648 12.052 1.00 0.00 N ATOM 1250 CA SER A 85 -0.594 -3.338 11.663 1.00 0.00 C ATOM 1251 C SER A 85 -1.659 -3.206 12.748 1.00 0.00 C ATOM 1252 O SER A 85 -1.585 -3.857 13.790 1.00 0.00 O ATOM 1253 CB SER A 85 -0.307 -4.816 11.392 1.00 0.00 C ATOM 1254 OG SER A 85 0.048 -5.494 12.585 1.00 0.00 O ATOM 0 H SER A 85 0.714 -2.467 13.052 1.00 0.00 H new ATOM 0 HA SER A 85 -0.969 -2.875 10.751 1.00 0.00 H new ATOM 0 HB2 SER A 85 -1.186 -5.286 10.951 1.00 0.00 H new ATOM 0 HB3 SER A 85 0.500 -4.906 10.665 1.00 0.00 H new ATOM 0 HG SER A 85 -0.433 -5.098 13.342 1.00 0.00 H new ATOM 1260 N LEU A 86 -2.650 -2.358 12.494 1.00 0.00 N ATOM 1261 CA LEU A 86 -3.732 -2.139 13.447 1.00 0.00 C ATOM 1262 C LEU A 86 -4.738 -3.284 13.402 1.00 0.00 C ATOM 1263 O LEU A 86 -5.355 -3.542 12.367 1.00 0.00 O ATOM 1264 CB LEU A 86 -4.437 -0.813 13.152 1.00 0.00 C ATOM 1265 CG LEU A 86 -5.796 -0.612 13.824 1.00 0.00 C ATOM 1266 CD1 LEU A 86 -5.642 -0.568 15.337 1.00 0.00 C ATOM 1267 CD2 LEU A 86 -6.458 0.661 13.317 1.00 0.00 C ATOM 0 H LEU A 86 -2.726 -1.811 11.636 1.00 0.00 H new ATOM 0 HA LEU A 86 -3.300 -2.099 14.447 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -3.779 0.001 13.457 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -4.571 -0.728 12.074 1.00 0.00 H new ATOM 0 HG LEU A 86 -6.435 -1.457 13.568 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -6.619 -0.424 15.798 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -5.210 -1.506 15.686 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -4.986 0.258 15.612 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -7.424 0.788 13.806 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -5.822 1.517 13.543 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -6.603 0.591 12.239 1.00 0.00 H new ATOM 1279 N LEU A 87 -4.901 -3.967 14.529 1.00 0.00 N ATOM 1280 CA LEU A 87 -5.835 -5.084 14.620 1.00 0.00 C ATOM 1281 C LEU A 87 -7.169 -4.632 15.205 1.00 0.00 C ATOM 1282 O LEU A 87 -7.256 -3.581 15.838 1.00 0.00 O ATOM 1283 CB LEU A 87 -5.241 -6.203 15.478 1.00 0.00 C ATOM 1284 CG LEU A 87 -3.934 -6.815 14.972 1.00 0.00 C ATOM 1285 CD1 LEU A 87 -3.415 -7.852 15.955 1.00 0.00 C ATOM 1286 CD2 LEU A 87 -4.133 -7.434 13.596 1.00 0.00 C ATOM 0 H LEU A 87 -4.398 -3.767 15.394 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.011 -5.462 13.613 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -5.072 -5.813 16.482 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -5.981 -6.998 15.566 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.192 -6.021 14.887 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.484 -8.277 15.578 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -3.234 -7.380 16.920 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.154 -8.644 16.072 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.193 -7.865 13.251 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.890 -8.216 13.655 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.459 -6.665 12.895 1.00 0.00 H new ATOM 1298 N ASN A 88 -8.206 -5.436 14.991 1.00 0.00 N ATOM 1299 CA ASN A 88 -9.536 -5.120 15.499 1.00 0.00 C ATOM 1300 C ASN A 88 -9.452 -4.484 16.883 1.00 0.00 C ATOM 1301 O ASN A 88 -9.263 -5.174 17.884 1.00 0.00 O ATOM 1302 CB ASN A 88 -10.396 -6.383 15.556 1.00 0.00 C ATOM 1303 CG ASN A 88 -9.940 -7.345 16.637 1.00 0.00 C ATOM 1304 OD1 ASN A 88 -8.631 -7.544 16.737 1.00 0.00 O flip ATOM 1305 ND2 ASN A 88 -10.755 -7.901 17.373 1.00 0.00 N flip ATOM 0 H ASN A 88 -8.151 -6.311 14.469 1.00 0.00 H new ATOM 0 HA ASN A 88 -9.998 -4.405 14.818 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -11.434 -6.104 15.736 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -10.364 -6.885 14.589 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -11.752 -7.718 17.260 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -10.433 -8.545 18.096 1.00 0.00 H new ATOM 1312 N GLY A 89 -9.596 -3.163 16.932 1.00 0.00 N ATOM 1313 CA GLY A 89 -9.535 -2.457 18.198 1.00 0.00 C ATOM 1314 C GLY A 89 -8.170 -2.556 18.852 1.00 0.00 C ATOM 1315 O GLY A 89 -7.912 -1.907 19.866 1.00 0.00 O ATOM 0 H GLY A 89 -9.754 -2.570 16.118 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -9.782 -1.408 18.038 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -10.288 -2.863 18.873 1.00 0.00 H new ATOM 1319 N SER A 90 -7.295 -3.370 18.271 1.00 0.00 N ATOM 1320 CA SER A 90 -5.952 -3.556 18.806 1.00 0.00 C ATOM 1321 C SER A 90 -4.899 -3.091 17.805 1.00 0.00 C ATOM 1322 O SER A 90 -5.210 -2.804 16.649 1.00 0.00 O ATOM 1323 CB SER A 90 -5.720 -5.026 19.162 1.00 0.00 C ATOM 1324 OG SER A 90 -4.921 -5.150 20.326 1.00 0.00 O ATOM 0 H SER A 90 -7.492 -3.911 17.429 1.00 0.00 H new ATOM 0 HA SER A 90 -5.861 -2.953 19.709 1.00 0.00 H new ATOM 0 HB2 SER A 90 -6.678 -5.520 19.321 1.00 0.00 H new ATOM 0 HB3 SER A 90 -5.234 -5.533 18.328 1.00 0.00 H new ATOM 0 HG SER A 90 -4.789 -6.099 20.533 1.00 0.00 H new ATOM 1330 N TRP A 91 -3.652 -3.020 18.258 1.00 0.00 N ATOM 1331 CA TRP A 91 -2.552 -2.591 17.402 1.00 0.00 C ATOM 1332 C TRP A 91 -1.403 -3.591 17.450 1.00 0.00 C ATOM 1333 O TRP A 91 -1.308 -4.399 18.372 1.00 0.00 O ATOM 1334 CB TRP A 91 -2.058 -1.207 17.828 1.00 0.00 C ATOM 1335 CG TRP A 91 -2.674 -0.089 17.042 1.00 0.00 C ATOM 1336 CD1 TRP A 91 -3.711 0.711 17.430 1.00 0.00 C ATOM 1337 CD2 TRP A 91 -2.293 0.351 15.734 1.00 0.00 C ATOM 1338 NE1 TRP A 91 -3.997 1.622 16.442 1.00 0.00 N ATOM 1339 CE2 TRP A 91 -3.140 1.423 15.391 1.00 0.00 C ATOM 1340 CE3 TRP A 91 -1.316 -0.054 14.820 1.00 0.00 C ATOM 1341 CZ2 TRP A 91 -3.040 2.091 14.174 1.00 0.00 C ATOM 1342 CZ3 TRP A 91 -1.218 0.610 13.613 1.00 0.00 C ATOM 1343 CH2 TRP A 91 -2.075 1.673 13.298 1.00 0.00 C ATOM 0 H TRP A 91 -3.378 -3.254 19.212 1.00 0.00 H new ATOM 0 HA TRP A 91 -2.920 -2.539 16.377 1.00 0.00 H new ATOM 0 HB2 TRP A 91 -2.276 -1.061 18.886 1.00 0.00 H new ATOM 0 HB3 TRP A 91 -0.974 -1.166 17.717 1.00 0.00 H new ATOM 0 HD1 TRP A 91 -4.230 0.638 18.374 1.00 0.00 H new ATOM 0 HE1 TRP A 91 -4.729 2.331 16.484 1.00 0.00 H new ATOM 0 HE3 TRP A 91 -0.650 -0.871 15.053 1.00 0.00 H new ATOM 0 HZ2 TRP A 91 -3.700 2.910 13.930 1.00 0.00 H new ATOM 0 HZ3 TRP A 91 -0.467 0.305 12.899 1.00 0.00 H new ATOM 0 HH2 TRP A 91 -1.972 2.172 12.346 1.00 0.00 H new ATOM 1354 N GLY A 92 -0.529 -3.531 16.449 1.00 0.00 N ATOM 1355 CA GLY A 92 0.603 -4.438 16.396 1.00 0.00 C ATOM 1356 C GLY A 92 1.846 -3.851 17.035 1.00 0.00 C ATOM 1357 O GLY A 92 1.908 -3.688 18.254 1.00 0.00 O ATOM 0 H GLY A 92 -0.585 -2.870 15.674 1.00 0.00 H new ATOM 0 HA2 GLY A 92 0.343 -5.368 16.901 1.00 0.00 H new ATOM 0 HA3 GLY A 92 0.816 -4.688 15.357 1.00 0.00 H new ATOM 1361 N SER A 93 2.839 -3.534 16.211 1.00 0.00 N ATOM 1362 CA SER A 93 4.089 -2.966 16.703 1.00 0.00 C ATOM 1363 C SER A 93 4.838 -2.250 15.584 1.00 0.00 C ATOM 1364 O SER A 93 4.394 -2.235 14.436 1.00 0.00 O ATOM 1365 CB SER A 93 4.971 -4.064 17.302 1.00 0.00 C ATOM 1366 OG SER A 93 4.386 -4.606 18.473 1.00 0.00 O ATOM 0 H SER A 93 2.803 -3.661 15.200 1.00 0.00 H new ATOM 0 HA SER A 93 3.849 -2.239 17.479 1.00 0.00 H new ATOM 0 HB2 SER A 93 5.122 -4.855 16.567 1.00 0.00 H new ATOM 0 HB3 SER A 93 5.954 -3.657 17.538 1.00 0.00 H new ATOM 0 HG SER A 93 3.612 -4.064 18.733 1.00 0.00 H new ATOM 1372 N GLU A 94 5.978 -1.658 15.928 1.00 0.00 N ATOM 1373 CA GLU A 94 6.789 -0.939 14.952 1.00 0.00 C ATOM 1374 C GLU A 94 7.999 -1.769 14.533 1.00 0.00 C ATOM 1375 O GLU A 94 8.798 -2.187 15.370 1.00 0.00 O ATOM 1376 CB GLU A 94 7.251 0.401 15.529 1.00 0.00 C ATOM 1377 CG GLU A 94 6.126 1.225 16.132 1.00 0.00 C ATOM 1378 CD GLU A 94 6.598 2.572 16.642 1.00 0.00 C ATOM 1379 OE1 GLU A 94 7.133 2.627 17.768 1.00 0.00 O ATOM 1380 OE2 GLU A 94 6.432 3.573 15.913 1.00 0.00 O ATOM 0 H GLU A 94 6.360 -1.662 16.874 1.00 0.00 H new ATOM 0 HA GLU A 94 6.174 -0.755 14.071 1.00 0.00 H new ATOM 0 HB2 GLU A 94 8.005 0.217 16.294 1.00 0.00 H new ATOM 0 HB3 GLU A 94 7.732 0.980 14.740 1.00 0.00 H new ATOM 0 HG2 GLU A 94 5.350 1.376 15.382 1.00 0.00 H new ATOM 0 HG3 GLU A 94 5.673 0.669 16.952 1.00 0.00 H new ATOM 1387 N GLU A 95 8.126 -2.004 13.230 1.00 0.00 N ATOM 1388 CA GLU A 95 9.237 -2.785 12.700 1.00 0.00 C ATOM 1389 C GLU A 95 10.023 -1.982 11.668 1.00 0.00 C ATOM 1390 O GLU A 95 9.495 -1.608 10.621 1.00 0.00 O ATOM 1391 CB GLU A 95 8.723 -4.081 12.070 1.00 0.00 C ATOM 1392 CG GLU A 95 7.999 -4.989 13.050 1.00 0.00 C ATOM 1393 CD GLU A 95 6.680 -4.406 13.519 1.00 0.00 C ATOM 1394 OE1 GLU A 95 5.706 -4.434 12.738 1.00 0.00 O ATOM 1395 OE2 GLU A 95 6.622 -3.922 14.669 1.00 0.00 O ATOM 0 H GLU A 95 7.474 -1.665 12.523 1.00 0.00 H new ATOM 0 HA GLU A 95 9.903 -3.030 13.528 1.00 0.00 H new ATOM 0 HB2 GLU A 95 8.048 -3.834 11.250 1.00 0.00 H new ATOM 0 HB3 GLU A 95 9.564 -4.624 11.638 1.00 0.00 H new ATOM 0 HG2 GLU A 95 7.818 -5.955 12.579 1.00 0.00 H new ATOM 0 HG3 GLU A 95 8.639 -5.170 13.913 1.00 0.00 H new ATOM 1402 N LYS A 96 11.290 -1.719 11.972 1.00 0.00 N ATOM 1403 CA LYS A 96 12.151 -0.961 11.073 1.00 0.00 C ATOM 1404 C LYS A 96 13.345 -1.800 10.627 1.00 0.00 C ATOM 1405 O LYS A 96 14.139 -2.256 11.450 1.00 0.00 O ATOM 1406 CB LYS A 96 12.640 0.317 11.758 1.00 0.00 C ATOM 1407 CG LYS A 96 11.522 1.276 12.125 1.00 0.00 C ATOM 1408 CD LYS A 96 12.065 2.634 12.540 1.00 0.00 C ATOM 1409 CE LYS A 96 12.326 2.695 14.037 1.00 0.00 C ATOM 1410 NZ LYS A 96 13.387 1.737 14.455 1.00 0.00 N ATOM 0 H LYS A 96 11.743 -2.020 12.835 1.00 0.00 H new ATOM 0 HA LYS A 96 11.568 -0.693 10.192 1.00 0.00 H new ATOM 0 HB2 LYS A 96 13.188 0.048 12.661 1.00 0.00 H new ATOM 0 HB3 LYS A 96 13.343 0.827 11.099 1.00 0.00 H new ATOM 0 HG2 LYS A 96 10.851 1.396 11.275 1.00 0.00 H new ATOM 0 HG3 LYS A 96 10.933 0.855 12.939 1.00 0.00 H new ATOM 0 HD2 LYS A 96 12.989 2.838 12.000 1.00 0.00 H new ATOM 0 HD3 LYS A 96 11.354 3.412 12.261 1.00 0.00 H new ATOM 0 HE2 LYS A 96 12.622 3.707 14.313 1.00 0.00 H new ATOM 0 HE3 LYS A 96 11.404 2.474 14.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 13.844 2.082 15.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.962 0.805 14.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 14.097 1.654 13.700 1.00 0.00 H new ATOM 1424 N LYS A 97 13.467 -1.999 9.319 1.00 0.00 N ATOM 1425 CA LYS A 97 14.564 -2.780 8.762 1.00 0.00 C ATOM 1426 C LYS A 97 14.583 -2.686 7.240 1.00 0.00 C ATOM 1427 O LYS A 97 13.727 -3.257 6.563 1.00 0.00 O ATOM 1428 CB LYS A 97 14.445 -4.244 9.191 1.00 0.00 C ATOM 1429 CG LYS A 97 15.748 -5.017 9.088 1.00 0.00 C ATOM 1430 CD LYS A 97 15.502 -6.512 8.969 1.00 0.00 C ATOM 1431 CE LYS A 97 15.286 -7.151 10.333 1.00 0.00 C ATOM 1432 NZ LYS A 97 13.889 -6.969 10.816 1.00 0.00 N ATOM 0 H LYS A 97 12.818 -1.629 8.624 1.00 0.00 H new ATOM 0 HA LYS A 97 15.498 -2.370 9.145 1.00 0.00 H new ATOM 0 HB2 LYS A 97 14.089 -4.284 10.221 1.00 0.00 H new ATOM 0 HB3 LYS A 97 13.692 -4.734 8.574 1.00 0.00 H new ATOM 0 HG2 LYS A 97 16.310 -4.670 8.221 1.00 0.00 H new ATOM 0 HG3 LYS A 97 16.361 -4.817 9.967 1.00 0.00 H new ATOM 0 HD2 LYS A 97 14.629 -6.689 8.340 1.00 0.00 H new ATOM 0 HD3 LYS A 97 16.352 -6.984 8.475 1.00 0.00 H new ATOM 0 HE2 LYS A 97 15.515 -8.215 10.276 1.00 0.00 H new ATOM 0 HE3 LYS A 97 15.979 -6.714 11.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 13.618 -7.780 11.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 13.827 -6.096 11.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 13.246 -6.904 10.001 1.00 0.00 H new ATOM 1446 N ILE A 98 15.563 -1.964 6.708 1.00 0.00 N ATOM 1447 CA ILE A 98 15.693 -1.798 5.266 1.00 0.00 C ATOM 1448 C ILE A 98 17.157 -1.673 4.857 1.00 0.00 C ATOM 1449 O ILE A 98 17.995 -1.216 5.635 1.00 0.00 O ATOM 1450 CB ILE A 98 14.926 -0.558 4.770 1.00 0.00 C ATOM 1451 CG1 ILE A 98 15.246 -0.287 3.299 1.00 0.00 C ATOM 1452 CG2 ILE A 98 15.269 0.654 5.624 1.00 0.00 C ATOM 1453 CD1 ILE A 98 14.570 0.951 2.751 1.00 0.00 C ATOM 0 H ILE A 98 16.279 -1.485 7.254 1.00 0.00 H new ATOM 0 HA ILE A 98 15.264 -2.688 4.806 1.00 0.00 H new ATOM 0 HB ILE A 98 13.857 -0.751 4.860 1.00 0.00 H new ATOM 0 HG12 ILE A 98 16.325 -0.183 3.184 1.00 0.00 H new ATOM 0 HG13 ILE A 98 14.943 -1.149 2.705 1.00 0.00 H new ATOM 0 HG21 ILE A 98 14.719 1.522 5.261 1.00 0.00 H new ATOM 0 HG22 ILE A 98 14.995 0.458 6.661 1.00 0.00 H new ATOM 0 HG23 ILE A 98 16.339 0.851 5.563 1.00 0.00 H new ATOM 0 HD11 ILE A 98 14.842 1.081 1.704 1.00 0.00 H new ATOM 0 HD12 ILE A 98 13.489 0.842 2.834 1.00 0.00 H new ATOM 0 HD13 ILE A 98 14.892 1.823 3.320 1.00 0.00 H new ATOM 1465 N THR A 99 17.459 -2.080 3.628 1.00 0.00 N ATOM 1466 CA THR A 99 18.821 -2.013 3.114 1.00 0.00 C ATOM 1467 C THR A 99 19.120 -0.639 2.525 1.00 0.00 C ATOM 1468 O THR A 99 20.159 -0.043 2.810 1.00 0.00 O ATOM 1469 CB THR A 99 19.068 -3.086 2.036 1.00 0.00 C ATOM 1470 OG1 THR A 99 20.431 -3.038 1.600 1.00 0.00 O ATOM 1471 CG2 THR A 99 18.143 -2.880 0.846 1.00 0.00 C ATOM 0 H THR A 99 16.778 -2.460 2.970 1.00 0.00 H new ATOM 0 HA THR A 99 19.486 -2.196 3.958 1.00 0.00 H new ATOM 0 HB THR A 99 18.861 -4.063 2.473 1.00 0.00 H new ATOM 0 HG1 THR A 99 20.580 -3.724 0.916 1.00 0.00 H new ATOM 0 HG21 THR A 99 18.336 -3.649 0.098 1.00 0.00 H new ATOM 0 HG22 THR A 99 17.106 -2.946 1.175 1.00 0.00 H new ATOM 0 HG23 THR A 99 18.324 -1.897 0.411 1.00 0.00 H new ATOM 1479 N HIS A 100 18.203 -0.141 1.702 1.00 0.00 N ATOM 1480 CA HIS A 100 18.368 1.165 1.074 1.00 0.00 C ATOM 1481 C HIS A 100 17.019 1.853 0.888 1.00 0.00 C ATOM 1482 O HIS A 100 16.059 1.242 0.421 1.00 0.00 O ATOM 1483 CB HIS A 100 19.070 1.020 -0.276 1.00 0.00 C ATOM 1484 CG HIS A 100 18.155 0.599 -1.385 1.00 0.00 C ATOM 1485 ND1 HIS A 100 17.199 -0.384 -1.239 1.00 0.00 N ATOM 1486 CD2 HIS A 100 18.053 1.035 -2.662 1.00 0.00 C ATOM 1487 CE1 HIS A 100 16.550 -0.536 -2.379 1.00 0.00 C ATOM 1488 NE2 HIS A 100 17.049 0.314 -3.259 1.00 0.00 N ATOM 0 H HIS A 100 17.338 -0.622 1.454 1.00 0.00 H new ATOM 0 HA HIS A 100 18.983 1.781 1.730 1.00 0.00 H new ATOM 0 HB2 HIS A 100 19.533 1.971 -0.539 1.00 0.00 H new ATOM 0 HB3 HIS A 100 19.873 0.289 -0.182 1.00 0.00 H new ATOM 0 HD2 HIS A 100 18.650 1.806 -3.125 1.00 0.00 H new ATOM 0 HE1 HIS A 100 15.748 -1.236 -2.561 1.00 0.00 H new ATOM 0 HE2 HIS A 100 16.739 0.418 -4.225 1.00 0.00 H new ATOM 1497 N ASN A 101 16.955 3.129 1.257 1.00 0.00 N ATOM 1498 CA ASN A 101 15.723 3.899 1.132 1.00 0.00 C ATOM 1499 C ASN A 101 15.792 4.844 -0.064 1.00 0.00 C ATOM 1500 O ASN A 101 16.358 5.935 0.006 1.00 0.00 O ATOM 1501 CB ASN A 101 15.464 4.697 2.411 1.00 0.00 C ATOM 1502 CG ASN A 101 13.985 4.918 2.665 1.00 0.00 C ATOM 1503 OD1 ASN A 101 13.225 3.966 2.840 1.00 0.00 O ATOM 1504 ND2 ASN A 101 13.571 6.180 2.687 1.00 0.00 N ATOM 0 H ASN A 101 17.741 3.651 1.645 1.00 0.00 H new ATOM 0 HA ASN A 101 14.901 3.200 0.975 1.00 0.00 H new ATOM 0 HB2 ASN A 101 15.901 4.170 3.259 1.00 0.00 H new ATOM 0 HB3 ASN A 101 15.966 5.662 2.342 1.00 0.00 H new ATOM 0 HD21 ASN A 101 12.587 6.391 2.854 1.00 0.00 H new ATOM 0 HD22 ASN A 101 14.237 6.938 2.537 1.00 0.00 H new ATOM 1511 N PRO A 102 15.201 4.417 -1.190 1.00 0.00 N ATOM 1512 CA PRO A 102 15.180 5.210 -2.423 1.00 0.00 C ATOM 1513 C PRO A 102 14.288 6.441 -2.305 1.00 0.00 C ATOM 1514 O PRO A 102 14.651 7.528 -2.755 1.00 0.00 O ATOM 1515 CB PRO A 102 14.614 4.237 -3.461 1.00 0.00 C ATOM 1516 CG PRO A 102 13.807 3.266 -2.669 1.00 0.00 C ATOM 1517 CD PRO A 102 14.506 3.128 -1.346 1.00 0.00 C ATOM 0 HA PRO A 102 16.167 5.597 -2.675 1.00 0.00 H new ATOM 0 HB2 PRO A 102 13.999 4.756 -4.196 1.00 0.00 H new ATOM 0 HB3 PRO A 102 15.411 3.735 -4.009 1.00 0.00 H new ATOM 0 HG2 PRO A 102 12.786 3.624 -2.535 1.00 0.00 H new ATOM 0 HG3 PRO A 102 13.743 2.305 -3.179 1.00 0.00 H new ATOM 0 HD2 PRO A 102 13.799 2.952 -0.535 1.00 0.00 H new ATOM 0 HD3 PRO A 102 15.205 2.292 -1.347 1.00 0.00 H new ATOM 1525 N PHE A 103 13.119 6.264 -1.698 1.00 0.00 N ATOM 1526 CA PHE A 103 12.175 7.361 -1.521 1.00 0.00 C ATOM 1527 C PHE A 103 12.910 8.680 -1.300 1.00 0.00 C ATOM 1528 O PHE A 103 13.535 8.889 -0.262 1.00 0.00 O ATOM 1529 CB PHE A 103 11.246 7.077 -0.339 1.00 0.00 C ATOM 1530 CG PHE A 103 10.628 5.709 -0.377 1.00 0.00 C ATOM 1531 CD1 PHE A 103 10.114 5.199 -1.559 1.00 0.00 C ATOM 1532 CD2 PHE A 103 10.563 4.932 0.768 1.00 0.00 C ATOM 1533 CE1 PHE A 103 9.544 3.940 -1.596 1.00 0.00 C ATOM 1534 CE2 PHE A 103 9.995 3.672 0.736 1.00 0.00 C ATOM 1535 CZ PHE A 103 9.486 3.175 -0.447 1.00 0.00 C ATOM 0 H PHE A 103 12.803 5.371 -1.320 1.00 0.00 H new ATOM 0 HA PHE A 103 11.579 7.445 -2.430 1.00 0.00 H new ATOM 0 HB2 PHE A 103 11.807 7.188 0.589 1.00 0.00 H new ATOM 0 HB3 PHE A 103 10.453 7.825 -0.323 1.00 0.00 H new ATOM 0 HD1 PHE A 103 10.159 5.792 -2.461 1.00 0.00 H new ATOM 0 HD2 PHE A 103 10.961 5.315 1.696 1.00 0.00 H new ATOM 0 HE1 PHE A 103 9.144 3.555 -2.522 1.00 0.00 H new ATOM 0 HE2 PHE A 103 9.950 3.077 1.636 1.00 0.00 H new ATOM 0 HZ PHE A 103 9.043 2.190 -0.474 1.00 0.00 H new ATOM 1545 N GLY A 104 12.829 9.568 -2.287 1.00 0.00 N ATOM 1546 CA GLY A 104 13.490 10.856 -2.182 1.00 0.00 C ATOM 1547 C GLY A 104 12.587 12.006 -2.581 1.00 0.00 C ATOM 1548 O GLY A 104 11.864 11.939 -3.575 1.00 0.00 O ATOM 0 H GLY A 104 12.318 9.418 -3.157 1.00 0.00 H new ATOM 0 HA2 GLY A 104 13.830 11.004 -1.157 1.00 0.00 H new ATOM 0 HA3 GLY A 104 14.377 10.858 -2.815 1.00 0.00 H new ATOM 1552 N PRO A 105 12.621 13.091 -1.794 1.00 0.00 N ATOM 1553 CA PRO A 105 11.805 14.281 -2.050 1.00 0.00 C ATOM 1554 C PRO A 105 12.264 15.044 -3.287 1.00 0.00 C ATOM 1555 O PRO A 105 13.205 15.834 -3.227 1.00 0.00 O ATOM 1556 CB PRO A 105 12.009 15.129 -0.792 1.00 0.00 C ATOM 1557 CG PRO A 105 13.332 14.700 -0.257 1.00 0.00 C ATOM 1558 CD PRO A 105 13.460 13.240 -0.593 1.00 0.00 C ATOM 0 HA PRO A 105 10.763 14.026 -2.244 1.00 0.00 H new ATOM 0 HB2 PRO A 105 12.003 16.193 -1.027 1.00 0.00 H new ATOM 0 HB3 PRO A 105 11.214 14.958 -0.066 1.00 0.00 H new ATOM 0 HG2 PRO A 105 14.140 15.276 -0.707 1.00 0.00 H new ATOM 0 HG3 PRO A 105 13.388 14.859 0.820 1.00 0.00 H new ATOM 0 HD2 PRO A 105 14.496 12.962 -0.789 1.00 0.00 H new ATOM 0 HD3 PRO A 105 13.110 12.608 0.223 1.00 0.00 H new ATOM 1566 N GLY A 106 11.593 14.802 -4.410 1.00 0.00 N ATOM 1567 CA GLY A 106 11.948 15.475 -5.645 1.00 0.00 C ATOM 1568 C GLY A 106 12.349 14.505 -6.739 1.00 0.00 C ATOM 1569 O GLY A 106 12.714 14.918 -7.839 1.00 0.00 O ATOM 0 H GLY A 106 10.810 14.152 -4.486 1.00 0.00 H new ATOM 0 HA2 GLY A 106 11.102 16.073 -5.986 1.00 0.00 H new ATOM 0 HA3 GLY A 106 12.770 16.165 -5.456 1.00 0.00 H new ATOM 1573 N GLN A 107 12.282 13.213 -6.435 1.00 0.00 N ATOM 1574 CA GLN A 107 12.644 12.182 -7.401 1.00 0.00 C ATOM 1575 C GLN A 107 11.609 11.063 -7.416 1.00 0.00 C ATOM 1576 O GLN A 107 10.983 10.768 -6.397 1.00 0.00 O ATOM 1577 CB GLN A 107 14.026 11.612 -7.077 1.00 0.00 C ATOM 1578 CG GLN A 107 14.168 11.144 -5.637 1.00 0.00 C ATOM 1579 CD GLN A 107 15.612 11.092 -5.180 1.00 0.00 C ATOM 1580 OE1 GLN A 107 16.367 12.049 -5.357 1.00 0.00 O ATOM 1581 NE2 GLN A 107 16.006 9.970 -4.588 1.00 0.00 N ATOM 0 H GLN A 107 11.981 12.855 -5.529 1.00 0.00 H new ATOM 0 HA GLN A 107 12.671 12.639 -8.390 1.00 0.00 H new ATOM 0 HB2 GLN A 107 14.230 10.775 -7.744 1.00 0.00 H new ATOM 0 HB3 GLN A 107 14.780 12.372 -7.279 1.00 0.00 H new ATOM 0 HG2 GLN A 107 13.608 11.814 -4.984 1.00 0.00 H new ATOM 0 HG3 GLN A 107 13.723 10.154 -5.535 1.00 0.00 H new ATOM 0 HE21 GLN A 107 15.347 9.202 -4.462 1.00 0.00 H new ATOM 0 HE22 GLN A 107 16.967 9.877 -4.260 1.00 0.00 H new ATOM 1590 N PHE A 108 11.433 10.441 -8.577 1.00 0.00 N ATOM 1591 CA PHE A 108 10.473 9.354 -8.725 1.00 0.00 C ATOM 1592 C PHE A 108 10.900 8.136 -7.911 1.00 0.00 C ATOM 1593 O PHE A 108 12.025 8.070 -7.415 1.00 0.00 O ATOM 1594 CB PHE A 108 10.328 8.970 -10.199 1.00 0.00 C ATOM 1595 CG PHE A 108 10.135 10.149 -11.110 1.00 0.00 C ATOM 1596 CD1 PHE A 108 11.224 10.880 -11.558 1.00 0.00 C ATOM 1597 CD2 PHE A 108 8.866 10.527 -11.517 1.00 0.00 C ATOM 1598 CE1 PHE A 108 11.051 11.965 -12.396 1.00 0.00 C ATOM 1599 CE2 PHE A 108 8.687 11.611 -12.355 1.00 0.00 C ATOM 1600 CZ PHE A 108 9.780 12.332 -12.794 1.00 0.00 C ATOM 0 H PHE A 108 11.943 10.672 -9.430 1.00 0.00 H new ATOM 0 HA PHE A 108 9.510 9.700 -8.350 1.00 0.00 H new ATOM 0 HB2 PHE A 108 11.216 8.421 -10.512 1.00 0.00 H new ATOM 0 HB3 PHE A 108 9.480 8.294 -10.308 1.00 0.00 H new ATOM 0 HD1 PHE A 108 12.220 10.598 -11.248 1.00 0.00 H new ATOM 0 HD2 PHE A 108 8.007 9.968 -11.176 1.00 0.00 H new ATOM 0 HE1 PHE A 108 11.908 12.525 -12.739 1.00 0.00 H new ATOM 0 HE2 PHE A 108 7.693 11.894 -12.667 1.00 0.00 H new ATOM 0 HZ PHE A 108 9.641 13.181 -13.447 1.00 0.00 H new ATOM 1610 N PHE A 109 9.992 7.175 -7.775 1.00 0.00 N ATOM 1611 CA PHE A 109 10.273 5.960 -7.020 1.00 0.00 C ATOM 1612 C PHE A 109 9.299 4.847 -7.397 1.00 0.00 C ATOM 1613 O PHE A 109 8.083 5.025 -7.332 1.00 0.00 O ATOM 1614 CB PHE A 109 10.191 6.238 -5.517 1.00 0.00 C ATOM 1615 CG PHE A 109 8.786 6.253 -4.987 1.00 0.00 C ATOM 1616 CD1 PHE A 109 8.028 7.412 -5.028 1.00 0.00 C ATOM 1617 CD2 PHE A 109 8.223 5.108 -4.446 1.00 0.00 C ATOM 1618 CE1 PHE A 109 6.734 7.429 -4.541 1.00 0.00 C ATOM 1619 CE2 PHE A 109 6.930 5.119 -3.958 1.00 0.00 C ATOM 1620 CZ PHE A 109 6.185 6.281 -4.004 1.00 0.00 C ATOM 0 H PHE A 109 9.056 7.214 -8.178 1.00 0.00 H new ATOM 0 HA PHE A 109 11.283 5.634 -7.268 1.00 0.00 H new ATOM 0 HB2 PHE A 109 10.764 5.480 -4.983 1.00 0.00 H new ATOM 0 HB3 PHE A 109 10.661 7.199 -5.307 1.00 0.00 H new ATOM 0 HD1 PHE A 109 8.453 8.313 -5.445 1.00 0.00 H new ATOM 0 HD2 PHE A 109 8.801 4.197 -4.405 1.00 0.00 H new ATOM 0 HE1 PHE A 109 6.153 8.339 -4.580 1.00 0.00 H new ATOM 0 HE2 PHE A 109 6.502 4.219 -3.541 1.00 0.00 H new ATOM 0 HZ PHE A 109 5.175 6.292 -3.621 1.00 0.00 H new ATOM 1630 N ASP A 110 9.843 3.701 -7.791 1.00 0.00 N ATOM 1631 CA ASP A 110 9.024 2.559 -8.178 1.00 0.00 C ATOM 1632 C ASP A 110 8.964 1.528 -7.056 1.00 0.00 C ATOM 1633 O ASP A 110 9.946 0.839 -6.778 1.00 0.00 O ATOM 1634 CB ASP A 110 9.577 1.915 -9.450 1.00 0.00 C ATOM 1635 CG ASP A 110 9.231 0.443 -9.552 1.00 0.00 C ATOM 1636 OD1 ASP A 110 8.146 0.124 -10.082 1.00 0.00 O ATOM 1637 OD2 ASP A 110 10.045 -0.390 -9.102 1.00 0.00 O ATOM 0 H ASP A 110 10.848 3.538 -7.851 1.00 0.00 H new ATOM 0 HA ASP A 110 8.013 2.918 -8.372 1.00 0.00 H new ATOM 0 HB2 ASP A 110 9.182 2.439 -10.320 1.00 0.00 H new ATOM 0 HB3 ASP A 110 10.660 2.033 -9.472 1.00 0.00 H new ATOM 1642 N LEU A 111 7.806 1.428 -6.413 1.00 0.00 N ATOM 1643 CA LEU A 111 7.617 0.481 -5.319 1.00 0.00 C ATOM 1644 C LEU A 111 6.646 -0.626 -5.718 1.00 0.00 C ATOM 1645 O LEU A 111 5.630 -0.371 -6.365 1.00 0.00 O ATOM 1646 CB LEU A 111 7.100 1.205 -4.075 1.00 0.00 C ATOM 1647 CG LEU A 111 7.423 0.548 -2.733 1.00 0.00 C ATOM 1648 CD1 LEU A 111 6.692 -0.778 -2.597 1.00 0.00 C ATOM 1649 CD2 LEU A 111 8.925 0.349 -2.585 1.00 0.00 C ATOM 0 H LEU A 111 6.984 1.991 -6.630 1.00 0.00 H new ATOM 0 HA LEU A 111 8.582 0.028 -5.093 1.00 0.00 H new ATOM 0 HB2 LEU A 111 7.510 2.215 -4.070 1.00 0.00 H new ATOM 0 HB3 LEU A 111 6.017 1.301 -4.159 1.00 0.00 H new ATOM 0 HG LEU A 111 7.083 1.209 -1.936 1.00 0.00 H new ATOM 0 HD11 LEU A 111 6.935 -1.230 -1.635 1.00 0.00 H new ATOM 0 HD12 LEU A 111 5.617 -0.609 -2.657 1.00 0.00 H new ATOM 0 HD13 LEU A 111 7.000 -1.447 -3.401 1.00 0.00 H new ATOM 0 HD21 LEU A 111 9.137 -0.120 -1.624 1.00 0.00 H new ATOM 0 HD22 LEU A 111 9.288 -0.291 -3.389 1.00 0.00 H new ATOM 0 HD23 LEU A 111 9.427 1.315 -2.636 1.00 0.00 H new ATOM 1661 N SER A 112 6.965 -1.855 -5.326 1.00 0.00 N ATOM 1662 CA SER A 112 6.122 -3.002 -5.645 1.00 0.00 C ATOM 1663 C SER A 112 6.134 -4.018 -4.506 1.00 0.00 C ATOM 1664 O SER A 112 7.170 -4.609 -4.199 1.00 0.00 O ATOM 1665 CB SER A 112 6.593 -3.664 -6.940 1.00 0.00 C ATOM 1666 OG SER A 112 7.013 -2.695 -7.885 1.00 0.00 O ATOM 0 H SER A 112 7.801 -2.082 -4.787 1.00 0.00 H new ATOM 0 HA SER A 112 5.101 -2.645 -5.780 1.00 0.00 H new ATOM 0 HB2 SER A 112 7.415 -4.347 -6.725 1.00 0.00 H new ATOM 0 HB3 SER A 112 5.785 -4.261 -7.362 1.00 0.00 H new ATOM 0 HG SER A 112 7.311 -3.144 -8.704 1.00 0.00 H new ATOM 1672 N ILE A 113 4.976 -4.215 -3.885 1.00 0.00 N ATOM 1673 CA ILE A 113 4.853 -5.159 -2.782 1.00 0.00 C ATOM 1674 C ILE A 113 4.316 -6.502 -3.265 1.00 0.00 C ATOM 1675 O ILE A 113 3.328 -6.560 -3.997 1.00 0.00 O ATOM 1676 CB ILE A 113 3.927 -4.617 -1.677 1.00 0.00 C ATOM 1677 CG1 ILE A 113 4.406 -3.241 -1.210 1.00 0.00 C ATOM 1678 CG2 ILE A 113 3.871 -5.589 -0.508 1.00 0.00 C ATOM 1679 CD1 ILE A 113 3.757 -2.092 -1.950 1.00 0.00 C ATOM 0 H ILE A 113 4.110 -3.733 -4.127 1.00 0.00 H new ATOM 0 HA ILE A 113 5.853 -5.296 -2.372 1.00 0.00 H new ATOM 0 HB ILE A 113 2.922 -4.512 -2.085 1.00 0.00 H new ATOM 0 HG12 ILE A 113 4.203 -3.137 -0.144 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.487 -3.179 -1.336 1.00 0.00 H new ATOM 0 HG21 ILE A 113 3.213 -5.192 0.264 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.488 -6.550 -0.852 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.872 -5.723 -0.098 1.00 0.00 H new ATOM 0 HD11 ILE A 113 4.144 -1.148 -1.567 1.00 0.00 H new ATOM 0 HD12 ILE A 113 3.981 -2.171 -3.014 1.00 0.00 H new ATOM 0 HD13 ILE A 113 2.678 -2.128 -1.803 1.00 0.00 H new ATOM 1691 N ARG A 114 4.974 -7.580 -2.851 1.00 0.00 N ATOM 1692 CA ARG A 114 4.563 -8.923 -3.241 1.00 0.00 C ATOM 1693 C ARG A 114 3.863 -9.634 -2.087 1.00 0.00 C ATOM 1694 O ARG A 114 4.342 -9.617 -0.952 1.00 0.00 O ATOM 1695 CB ARG A 114 5.774 -9.738 -3.697 1.00 0.00 C ATOM 1696 CG ARG A 114 6.094 -9.581 -5.174 1.00 0.00 C ATOM 1697 CD ARG A 114 6.907 -10.755 -5.697 1.00 0.00 C ATOM 1698 NE ARG A 114 6.059 -11.879 -6.083 1.00 0.00 N ATOM 1699 CZ ARG A 114 5.782 -12.900 -5.281 1.00 0.00 C ATOM 1700 NH1 ARG A 114 6.283 -12.939 -4.054 1.00 0.00 N ATOM 1701 NH2 ARG A 114 5.001 -13.886 -5.705 1.00 0.00 N ATOM 0 H ARG A 114 5.794 -7.549 -2.245 1.00 0.00 H new ATOM 0 HA ARG A 114 3.861 -8.834 -4.070 1.00 0.00 H new ATOM 0 HB2 ARG A 114 6.644 -9.439 -3.112 1.00 0.00 H new ATOM 0 HB3 ARG A 114 5.593 -10.791 -3.483 1.00 0.00 H new ATOM 0 HG2 ARG A 114 5.167 -9.498 -5.741 1.00 0.00 H new ATOM 0 HG3 ARG A 114 6.648 -8.655 -5.331 1.00 0.00 H new ATOM 0 HD2 ARG A 114 7.496 -10.434 -6.556 1.00 0.00 H new ATOM 0 HD3 ARG A 114 7.611 -11.079 -4.930 1.00 0.00 H new ATOM 0 HE ARG A 114 5.657 -11.880 -7.021 1.00 0.00 H new ATOM 0 HH11 ARG A 114 6.883 -12.183 -3.724 1.00 0.00 H new ATOM 0 HH12 ARG A 114 6.068 -13.725 -3.440 1.00 0.00 H new ATOM 0 HH21 ARG A 114 4.613 -13.860 -6.648 1.00 0.00 H new ATOM 0 HH22 ARG A 114 4.789 -14.670 -5.088 1.00 0.00 H new ATOM 1715 N CYS A 115 2.728 -10.258 -2.384 1.00 0.00 N ATOM 1716 CA CYS A 115 1.961 -10.974 -1.371 1.00 0.00 C ATOM 1717 C CYS A 115 2.261 -12.468 -1.417 1.00 0.00 C ATOM 1718 O CYS A 115 2.073 -13.118 -2.445 1.00 0.00 O ATOM 1719 CB CYS A 115 0.463 -10.736 -1.572 1.00 0.00 C ATOM 1720 SG CYS A 115 -0.596 -11.887 -0.666 1.00 0.00 S ATOM 0 H CYS A 115 2.319 -10.282 -3.318 1.00 0.00 H new ATOM 0 HA CYS A 115 2.254 -10.593 -0.393 1.00 0.00 H new ATOM 0 HB2 CYS A 115 0.223 -9.719 -1.263 1.00 0.00 H new ATOM 0 HB3 CYS A 115 0.234 -10.809 -2.635 1.00 0.00 H new ATOM 0 HG CYS A 115 -0.360 -11.783 0.608 1.00 0.00 H new ATOM 1726 N GLY A 116 2.732 -13.007 -0.296 1.00 0.00 N ATOM 1727 CA GLY A 116 3.052 -14.421 -0.231 1.00 0.00 C ATOM 1728 C GLY A 116 2.297 -15.137 0.871 1.00 0.00 C ATOM 1729 O GLY A 116 1.302 -14.624 1.386 1.00 0.00 O ATOM 0 H GLY A 116 2.897 -12.490 0.567 1.00 0.00 H new ATOM 0 HA2 GLY A 116 2.819 -14.887 -1.188 1.00 0.00 H new ATOM 0 HA3 GLY A 116 4.123 -14.541 -0.070 1.00 0.00 H new ATOM 1733 N LEU A 117 2.768 -16.325 1.234 1.00 0.00 N ATOM 1734 CA LEU A 117 2.129 -17.114 2.282 1.00 0.00 C ATOM 1735 C LEU A 117 2.941 -17.064 3.572 1.00 0.00 C ATOM 1736 O LEU A 117 2.391 -17.180 4.668 1.00 0.00 O ATOM 1737 CB LEU A 117 1.963 -18.564 1.826 1.00 0.00 C ATOM 1738 CG LEU A 117 0.803 -18.838 0.868 1.00 0.00 C ATOM 1739 CD1 LEU A 117 1.146 -19.983 -0.073 1.00 0.00 C ATOM 1740 CD2 LEU A 117 -0.469 -19.147 1.644 1.00 0.00 C ATOM 0 H LEU A 117 3.590 -16.763 0.818 1.00 0.00 H new ATOM 0 HA LEU A 117 1.146 -16.686 2.477 1.00 0.00 H new ATOM 0 HB2 LEU A 117 2.888 -18.880 1.344 1.00 0.00 H new ATOM 0 HB3 LEU A 117 1.834 -19.189 2.710 1.00 0.00 H new ATOM 0 HG LEU A 117 0.632 -17.942 0.271 1.00 0.00 H new ATOM 0 HD11 LEU A 117 0.309 -20.163 -0.747 1.00 0.00 H new ATOM 0 HD12 LEU A 117 2.031 -19.723 -0.655 1.00 0.00 H new ATOM 0 HD13 LEU A 117 1.345 -20.884 0.507 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -1.284 -19.339 0.946 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -0.310 -20.027 2.267 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -0.726 -18.296 2.275 1.00 0.00 H new ATOM 1752 N ASP A 118 4.250 -16.889 3.435 1.00 0.00 N ATOM 1753 CA ASP A 118 5.138 -16.820 4.590 1.00 0.00 C ATOM 1754 C ASP A 118 5.432 -15.371 4.964 1.00 0.00 C ATOM 1755 O ASP A 118 5.485 -15.023 6.144 1.00 0.00 O ATOM 1756 CB ASP A 118 6.445 -17.560 4.300 1.00 0.00 C ATOM 1757 CG ASP A 118 7.440 -17.444 5.437 1.00 0.00 C ATOM 1758 OD1 ASP A 118 7.637 -16.319 5.942 1.00 0.00 O ATOM 1759 OD2 ASP A 118 8.022 -18.479 5.824 1.00 0.00 O ATOM 0 H ASP A 118 4.721 -16.792 2.535 1.00 0.00 H new ATOM 0 HA ASP A 118 4.637 -17.299 5.431 1.00 0.00 H new ATOM 0 HB2 ASP A 118 6.230 -18.612 4.115 1.00 0.00 H new ATOM 0 HB3 ASP A 118 6.891 -17.161 3.389 1.00 0.00 H new ATOM 1764 N ARG A 119 5.623 -14.531 3.952 1.00 0.00 N ATOM 1765 CA ARG A 119 5.914 -13.120 4.175 1.00 0.00 C ATOM 1766 C ARG A 119 5.853 -12.339 2.866 1.00 0.00 C ATOM 1767 O ARG A 119 5.880 -12.921 1.781 1.00 0.00 O ATOM 1768 CB ARG A 119 7.293 -12.956 4.815 1.00 0.00 C ATOM 1769 CG ARG A 119 8.444 -13.200 3.853 1.00 0.00 C ATOM 1770 CD ARG A 119 9.772 -13.306 4.587 1.00 0.00 C ATOM 1771 NE ARG A 119 10.846 -13.767 3.711 1.00 0.00 N ATOM 1772 CZ ARG A 119 11.087 -15.048 3.456 1.00 0.00 C ATOM 1773 NH1 ARG A 119 10.333 -15.990 4.006 1.00 0.00 N ATOM 1774 NH2 ARG A 119 12.083 -15.389 2.649 1.00 0.00 N ATOM 0 H ARG A 119 5.581 -14.803 2.970 1.00 0.00 H new ATOM 0 HA ARG A 119 5.158 -12.722 4.852 1.00 0.00 H new ATOM 0 HB2 ARG A 119 7.378 -11.948 5.222 1.00 0.00 H new ATOM 0 HB3 ARG A 119 7.379 -13.647 5.654 1.00 0.00 H new ATOM 0 HG2 ARG A 119 8.263 -14.117 3.293 1.00 0.00 H new ATOM 0 HG3 ARG A 119 8.492 -12.388 3.128 1.00 0.00 H new ATOM 0 HD2 ARG A 119 10.035 -12.333 5.002 1.00 0.00 H new ATOM 0 HD3 ARG A 119 9.668 -13.994 5.426 1.00 0.00 H new ATOM 0 HE ARG A 119 11.443 -13.067 3.271 1.00 0.00 H new ATOM 0 HH11 ARG A 119 9.566 -15.732 4.627 1.00 0.00 H new ATOM 0 HH12 ARG A 119 10.520 -16.973 3.809 1.00 0.00 H new ATOM 0 HH21 ARG A 119 12.665 -14.667 2.224 1.00 0.00 H new ATOM 0 HH22 ARG A 119 12.267 -16.373 2.454 1.00 0.00 H new ATOM 1788 N PHE A 120 5.770 -11.017 2.975 1.00 0.00 N ATOM 1789 CA PHE A 120 5.703 -10.156 1.800 1.00 0.00 C ATOM 1790 C PHE A 120 7.103 -9.780 1.321 1.00 0.00 C ATOM 1791 O PHE A 120 8.058 -9.778 2.098 1.00 0.00 O ATOM 1792 CB PHE A 120 4.903 -8.890 2.114 1.00 0.00 C ATOM 1793 CG PHE A 120 3.424 -9.048 1.904 1.00 0.00 C ATOM 1794 CD1 PHE A 120 2.657 -9.768 2.805 1.00 0.00 C ATOM 1795 CD2 PHE A 120 2.802 -8.476 0.806 1.00 0.00 C ATOM 1796 CE1 PHE A 120 1.296 -9.916 2.614 1.00 0.00 C ATOM 1797 CE2 PHE A 120 1.441 -8.620 0.610 1.00 0.00 C ATOM 1798 CZ PHE A 120 0.687 -9.340 1.516 1.00 0.00 C ATOM 0 H PHE A 120 5.748 -10.519 3.865 1.00 0.00 H new ATOM 0 HA PHE A 120 5.201 -10.707 1.005 1.00 0.00 H new ATOM 0 HB2 PHE A 120 5.086 -8.601 3.149 1.00 0.00 H new ATOM 0 HB3 PHE A 120 5.266 -8.076 1.487 1.00 0.00 H new ATOM 0 HD1 PHE A 120 3.128 -10.219 3.666 1.00 0.00 H new ATOM 0 HD2 PHE A 120 3.387 -7.911 0.095 1.00 0.00 H new ATOM 0 HE1 PHE A 120 0.709 -10.482 3.323 1.00 0.00 H new ATOM 0 HE2 PHE A 120 0.968 -8.170 -0.250 1.00 0.00 H new ATOM 0 HZ PHE A 120 -0.377 -9.452 1.366 1.00 0.00 H new ATOM 1808 N LYS A 121 7.217 -9.465 0.035 1.00 0.00 N ATOM 1809 CA LYS A 121 8.498 -9.087 -0.550 1.00 0.00 C ATOM 1810 C LYS A 121 8.390 -7.753 -1.281 1.00 0.00 C ATOM 1811 O LYS A 121 7.912 -7.691 -2.414 1.00 0.00 O ATOM 1812 CB LYS A 121 8.981 -10.172 -1.515 1.00 0.00 C ATOM 1813 CG LYS A 121 9.087 -11.547 -0.880 1.00 0.00 C ATOM 1814 CD LYS A 121 10.114 -12.412 -1.591 1.00 0.00 C ATOM 1815 CE LYS A 121 11.528 -12.090 -1.132 1.00 0.00 C ATOM 1816 NZ LYS A 121 11.938 -12.925 0.030 1.00 0.00 N ATOM 0 H LYS A 121 6.437 -9.464 -0.622 1.00 0.00 H new ATOM 0 HA LYS A 121 9.221 -8.980 0.259 1.00 0.00 H new ATOM 0 HB2 LYS A 121 8.297 -10.224 -2.362 1.00 0.00 H new ATOM 0 HB3 LYS A 121 9.956 -9.887 -1.910 1.00 0.00 H new ATOM 0 HG2 LYS A 121 9.361 -11.444 0.170 1.00 0.00 H new ATOM 0 HG3 LYS A 121 8.114 -12.038 -0.909 1.00 0.00 H new ATOM 0 HD2 LYS A 121 9.899 -13.464 -1.401 1.00 0.00 H new ATOM 0 HD3 LYS A 121 10.036 -12.260 -2.668 1.00 0.00 H new ATOM 0 HE2 LYS A 121 12.223 -12.250 -1.957 1.00 0.00 H new ATOM 0 HE3 LYS A 121 11.591 -11.036 -0.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 12.907 -12.675 0.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 11.291 -12.754 0.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 11.903 -13.930 -0.235 1.00 0.00 H new ATOM 1830 N VAL A 122 8.837 -6.686 -0.626 1.00 0.00 N ATOM 1831 CA VAL A 122 8.793 -5.353 -1.216 1.00 0.00 C ATOM 1832 C VAL A 122 10.043 -5.077 -2.044 1.00 0.00 C ATOM 1833 O VAL A 122 11.164 -5.317 -1.595 1.00 0.00 O ATOM 1834 CB VAL A 122 8.657 -4.265 -0.134 1.00 0.00 C ATOM 1835 CG1 VAL A 122 8.485 -2.895 -0.772 1.00 0.00 C ATOM 1836 CG2 VAL A 122 7.493 -4.580 0.794 1.00 0.00 C ATOM 0 H VAL A 122 9.234 -6.719 0.313 1.00 0.00 H new ATOM 0 HA VAL A 122 7.917 -5.322 -1.864 1.00 0.00 H new ATOM 0 HB VAL A 122 9.572 -4.250 0.459 1.00 0.00 H new ATOM 0 HG11 VAL A 122 8.391 -2.140 0.008 1.00 0.00 H new ATOM 0 HG12 VAL A 122 9.353 -2.670 -1.391 1.00 0.00 H new ATOM 0 HG13 VAL A 122 7.588 -2.892 -1.391 1.00 0.00 H new ATOM 0 HG21 VAL A 122 7.411 -3.801 1.552 1.00 0.00 H new ATOM 0 HG22 VAL A 122 6.569 -4.623 0.217 1.00 0.00 H new ATOM 0 HG23 VAL A 122 7.664 -5.542 1.278 1.00 0.00 H new ATOM 1846 N TYR A 123 9.842 -4.570 -3.256 1.00 0.00 N ATOM 1847 CA TYR A 123 10.953 -4.262 -4.149 1.00 0.00 C ATOM 1848 C TYR A 123 10.913 -2.801 -4.584 1.00 0.00 C ATOM 1849 O TYR A 123 9.841 -2.217 -4.741 1.00 0.00 O ATOM 1850 CB TYR A 123 10.914 -5.173 -5.377 1.00 0.00 C ATOM 1851 CG TYR A 123 11.018 -6.644 -5.044 1.00 0.00 C ATOM 1852 CD1 TYR A 123 9.882 -7.397 -4.773 1.00 0.00 C ATOM 1853 CD2 TYR A 123 12.252 -7.281 -5.000 1.00 0.00 C ATOM 1854 CE1 TYR A 123 9.973 -8.741 -4.467 1.00 0.00 C ATOM 1855 CE2 TYR A 123 12.352 -8.625 -4.697 1.00 0.00 C ATOM 1856 CZ TYR A 123 11.210 -9.351 -4.430 1.00 0.00 C ATOM 1857 OH TYR A 123 11.304 -10.690 -4.127 1.00 0.00 O ATOM 0 H TYR A 123 8.921 -4.364 -3.642 1.00 0.00 H new ATOM 0 HA TYR A 123 11.882 -4.435 -3.606 1.00 0.00 H new ATOM 0 HB2 TYR A 123 9.985 -4.997 -5.920 1.00 0.00 H new ATOM 0 HB3 TYR A 123 11.731 -4.902 -6.046 1.00 0.00 H new ATOM 0 HD1 TYR A 123 8.912 -6.924 -4.802 1.00 0.00 H new ATOM 0 HD2 TYR A 123 13.149 -6.715 -5.206 1.00 0.00 H new ATOM 0 HE1 TYR A 123 9.080 -9.312 -4.258 1.00 0.00 H new ATOM 0 HE2 TYR A 123 13.319 -9.105 -4.669 1.00 0.00 H new ATOM 0 HH TYR A 123 12.245 -10.964 -4.144 1.00 0.00 H new ATOM 1867 N ALA A 124 12.091 -2.216 -4.778 1.00 0.00 N ATOM 1868 CA ALA A 124 12.192 -0.824 -5.198 1.00 0.00 C ATOM 1869 C ALA A 124 13.214 -0.661 -6.318 1.00 0.00 C ATOM 1870 O ALA A 124 14.414 -0.833 -6.106 1.00 0.00 O ATOM 1871 CB ALA A 124 12.559 0.059 -4.014 1.00 0.00 C ATOM 0 H ALA A 124 12.988 -2.685 -4.651 1.00 0.00 H new ATOM 0 HA ALA A 124 11.220 -0.515 -5.581 1.00 0.00 H new ATOM 0 HB1 ALA A 124 12.631 1.096 -4.342 1.00 0.00 H new ATOM 0 HB2 ALA A 124 11.791 -0.026 -3.245 1.00 0.00 H new ATOM 0 HB3 ALA A 124 13.518 -0.260 -3.606 1.00 0.00 H new ATOM 1877 N ASN A 125 12.730 -0.330 -7.511 1.00 0.00 N ATOM 1878 CA ASN A 125 13.603 -0.145 -8.665 1.00 0.00 C ATOM 1879 C ASN A 125 14.453 -1.388 -8.908 1.00 0.00 C ATOM 1880 O ASN A 125 15.607 -1.292 -9.323 1.00 0.00 O ATOM 1881 CB ASN A 125 14.506 1.072 -8.459 1.00 0.00 C ATOM 1882 CG ASN A 125 13.811 2.186 -7.699 1.00 0.00 C ATOM 1883 OD1 ASN A 125 12.931 2.862 -8.233 1.00 0.00 O ATOM 1884 ND2 ASN A 125 14.203 2.381 -6.446 1.00 0.00 N ATOM 0 H ASN A 125 11.739 -0.184 -7.704 1.00 0.00 H new ATOM 0 HA ASN A 125 12.976 0.022 -9.541 1.00 0.00 H new ATOM 0 HB2 ASN A 125 15.401 0.769 -7.916 1.00 0.00 H new ATOM 0 HB3 ASN A 125 14.833 1.447 -9.429 1.00 0.00 H new ATOM 0 HD21 ASN A 125 13.771 3.115 -5.885 1.00 0.00 H new ATOM 0 HD22 ASN A 125 14.936 1.797 -6.044 1.00 0.00 H new ATOM 1891 N GLY A 126 13.874 -2.556 -8.646 1.00 0.00 N ATOM 1892 CA GLY A 126 14.593 -3.801 -8.843 1.00 0.00 C ATOM 1893 C GLY A 126 15.563 -4.095 -7.716 1.00 0.00 C ATOM 1894 O GLY A 126 16.672 -4.573 -7.953 1.00 0.00 O ATOM 0 H GLY A 126 12.920 -2.662 -8.301 1.00 0.00 H new ATOM 0 HA2 GLY A 126 13.879 -4.620 -8.926 1.00 0.00 H new ATOM 0 HA3 GLY A 126 15.139 -3.757 -9.786 1.00 0.00 H new ATOM 1898 N GLN A 127 15.147 -3.805 -6.488 1.00 0.00 N ATOM 1899 CA GLN A 127 15.989 -4.039 -5.321 1.00 0.00 C ATOM 1900 C GLN A 127 15.148 -4.441 -4.114 1.00 0.00 C ATOM 1901 O GLN A 127 14.172 -3.771 -3.773 1.00 0.00 O ATOM 1902 CB GLN A 127 16.804 -2.786 -4.995 1.00 0.00 C ATOM 1903 CG GLN A 127 17.562 -2.226 -6.187 1.00 0.00 C ATOM 1904 CD GLN A 127 18.783 -1.425 -5.779 1.00 0.00 C ATOM 1905 OE1 GLN A 127 18.772 -0.194 -5.813 1.00 0.00 O ATOM 1906 NE2 GLN A 127 19.844 -2.120 -5.389 1.00 0.00 N ATOM 0 H GLN A 127 14.232 -3.408 -6.275 1.00 0.00 H new ATOM 0 HA GLN A 127 16.670 -4.857 -5.554 1.00 0.00 H new ATOM 0 HB2 GLN A 127 16.135 -2.018 -4.607 1.00 0.00 H new ATOM 0 HB3 GLN A 127 17.514 -3.021 -4.201 1.00 0.00 H new ATOM 0 HG2 GLN A 127 17.870 -3.047 -6.835 1.00 0.00 H new ATOM 0 HG3 GLN A 127 16.895 -1.592 -6.771 1.00 0.00 H new ATOM 0 HE21 GLN A 127 19.809 -3.139 -5.376 1.00 0.00 H new ATOM 0 HE22 GLN A 127 20.694 -1.635 -5.102 1.00 0.00 H new ATOM 1915 N HIS A 128 15.532 -5.540 -3.471 1.00 0.00 N ATOM 1916 CA HIS A 128 14.813 -6.031 -2.301 1.00 0.00 C ATOM 1917 C HIS A 128 14.828 -4.997 -1.180 1.00 0.00 C ATOM 1918 O HIS A 128 15.809 -4.877 -0.445 1.00 0.00 O ATOM 1919 CB HIS A 128 15.430 -7.342 -1.811 1.00 0.00 C ATOM 1920 CG HIS A 128 14.733 -7.922 -0.619 1.00 0.00 C ATOM 1921 ND1 HIS A 128 15.339 -8.067 0.611 1.00 0.00 N ATOM 1922 CD2 HIS A 128 13.473 -8.395 -0.473 1.00 0.00 C ATOM 1923 CE1 HIS A 128 14.483 -8.605 1.461 1.00 0.00 C ATOM 1924 NE2 HIS A 128 13.343 -8.813 0.828 1.00 0.00 N ATOM 0 H HIS A 128 16.336 -6.107 -3.741 1.00 0.00 H new ATOM 0 HA HIS A 128 13.778 -6.211 -2.590 1.00 0.00 H new ATOM 0 HB2 HIS A 128 15.410 -8.069 -2.623 1.00 0.00 H new ATOM 0 HB3 HIS A 128 16.477 -7.171 -1.562 1.00 0.00 H new ATOM 0 HD2 HIS A 128 12.712 -8.436 -1.238 1.00 0.00 H new ATOM 0 HE1 HIS A 128 14.682 -8.836 2.497 1.00 0.00 H new ATOM 0 HE2 HIS A 128 12.502 -9.219 1.239 1.00 0.00 H new ATOM 1933 N LEU A 129 13.735 -4.252 -1.054 1.00 0.00 N ATOM 1934 CA LEU A 129 13.622 -3.227 -0.022 1.00 0.00 C ATOM 1935 C LEU A 129 13.590 -3.854 1.367 1.00 0.00 C ATOM 1936 O LEU A 129 14.538 -3.722 2.142 1.00 0.00 O ATOM 1937 CB LEU A 129 12.363 -2.387 -0.245 1.00 0.00 C ATOM 1938 CG LEU A 129 12.436 -0.932 0.218 1.00 0.00 C ATOM 1939 CD1 LEU A 129 13.516 -0.182 -0.545 1.00 0.00 C ATOM 1940 CD2 LEU A 129 11.087 -0.249 0.046 1.00 0.00 C ATOM 0 H LEU A 129 12.914 -4.339 -1.654 1.00 0.00 H new ATOM 0 HA LEU A 129 14.498 -2.582 -0.088 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.128 -2.397 -1.309 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.532 -2.870 0.270 1.00 0.00 H new ATOM 0 HG LEU A 129 12.694 -0.921 1.277 1.00 0.00 H new ATOM 0 HD11 LEU A 129 13.553 0.852 -0.202 1.00 0.00 H new ATOM 0 HD12 LEU A 129 14.481 -0.657 -0.370 1.00 0.00 H new ATOM 0 HD13 LEU A 129 13.289 -0.202 -1.611 1.00 0.00 H new ATOM 0 HD21 LEU A 129 11.158 0.786 0.381 1.00 0.00 H new ATOM 0 HD22 LEU A 129 10.799 -0.272 -1.005 1.00 0.00 H new ATOM 0 HD23 LEU A 129 10.336 -0.771 0.639 1.00 0.00 H new ATOM 1952 N PHE A 130 12.494 -4.540 1.676 1.00 0.00 N ATOM 1953 CA PHE A 130 12.338 -5.189 2.972 1.00 0.00 C ATOM 1954 C PHE A 130 11.219 -6.225 2.931 1.00 0.00 C ATOM 1955 O PHE A 130 10.479 -6.317 1.951 1.00 0.00 O ATOM 1956 CB PHE A 130 12.046 -4.149 4.056 1.00 0.00 C ATOM 1957 CG PHE A 130 10.675 -3.544 3.951 1.00 0.00 C ATOM 1958 CD1 PHE A 130 9.547 -4.298 4.231 1.00 0.00 C ATOM 1959 CD2 PHE A 130 10.515 -2.221 3.572 1.00 0.00 C ATOM 1960 CE1 PHE A 130 8.284 -3.744 4.136 1.00 0.00 C ATOM 1961 CE2 PHE A 130 9.255 -1.662 3.476 1.00 0.00 C ATOM 1962 CZ PHE A 130 8.138 -2.424 3.757 1.00 0.00 C ATOM 0 H PHE A 130 11.701 -4.661 1.046 1.00 0.00 H new ATOM 0 HA PHE A 130 13.272 -5.698 3.209 1.00 0.00 H new ATOM 0 HB2 PHE A 130 12.155 -4.616 5.035 1.00 0.00 H new ATOM 0 HB3 PHE A 130 12.791 -3.355 3.997 1.00 0.00 H new ATOM 0 HD1 PHE A 130 9.656 -5.331 4.527 1.00 0.00 H new ATOM 0 HD2 PHE A 130 11.384 -1.620 3.349 1.00 0.00 H new ATOM 0 HE1 PHE A 130 7.413 -4.343 4.358 1.00 0.00 H new ATOM 0 HE2 PHE A 130 9.144 -0.629 3.181 1.00 0.00 H new ATOM 0 HZ PHE A 130 7.153 -1.989 3.681 1.00 0.00 H new ATOM 1972 N ASP A 131 11.102 -7.004 4.000 1.00 0.00 N ATOM 1973 CA ASP A 131 10.073 -8.034 4.087 1.00 0.00 C ATOM 1974 C ASP A 131 9.101 -7.736 5.224 1.00 0.00 C ATOM 1975 O ASP A 131 9.479 -7.158 6.243 1.00 0.00 O ATOM 1976 CB ASP A 131 10.713 -9.408 4.295 1.00 0.00 C ATOM 1977 CG ASP A 131 11.518 -9.484 5.577 1.00 0.00 C ATOM 1978 OD1 ASP A 131 12.705 -9.097 5.555 1.00 0.00 O ATOM 1979 OD2 ASP A 131 10.962 -9.932 6.602 1.00 0.00 O ATOM 0 H ASP A 131 11.707 -6.942 4.819 1.00 0.00 H new ATOM 0 HA ASP A 131 9.518 -8.038 3.149 1.00 0.00 H new ATOM 0 HB2 ASP A 131 9.933 -10.170 4.313 1.00 0.00 H new ATOM 0 HB3 ASP A 131 11.361 -9.636 3.449 1.00 0.00 H new ATOM 1984 N PHE A 132 7.846 -8.133 5.041 1.00 0.00 N ATOM 1985 CA PHE A 132 6.818 -7.906 6.050 1.00 0.00 C ATOM 1986 C PHE A 132 6.274 -9.230 6.580 1.00 0.00 C ATOM 1987 O PHE A 132 5.544 -9.936 5.886 1.00 0.00 O ATOM 1988 CB PHE A 132 5.676 -7.071 5.467 1.00 0.00 C ATOM 1989 CG PHE A 132 4.323 -7.453 5.995 1.00 0.00 C ATOM 1990 CD1 PHE A 132 4.077 -7.473 7.358 1.00 0.00 C ATOM 1991 CD2 PHE A 132 3.297 -7.793 5.128 1.00 0.00 C ATOM 1992 CE1 PHE A 132 2.832 -7.826 7.846 1.00 0.00 C ATOM 1993 CE2 PHE A 132 2.051 -8.146 5.610 1.00 0.00 C ATOM 1994 CZ PHE A 132 1.818 -8.161 6.971 1.00 0.00 C ATOM 0 H PHE A 132 7.517 -8.613 4.204 1.00 0.00 H new ATOM 0 HA PHE A 132 7.272 -7.361 6.878 1.00 0.00 H new ATOM 0 HB2 PHE A 132 5.858 -6.019 5.685 1.00 0.00 H new ATOM 0 HB3 PHE A 132 5.677 -7.177 4.382 1.00 0.00 H new ATOM 0 HD1 PHE A 132 4.866 -7.210 8.047 1.00 0.00 H new ATOM 0 HD2 PHE A 132 3.473 -7.782 4.063 1.00 0.00 H new ATOM 0 HE1 PHE A 132 2.653 -7.840 8.911 1.00 0.00 H new ATOM 0 HE2 PHE A 132 1.260 -8.410 4.923 1.00 0.00 H new ATOM 0 HZ PHE A 132 0.844 -8.434 7.350 1.00 0.00 H new ATOM 2004 N ALA A 133 6.638 -9.560 7.816 1.00 0.00 N ATOM 2005 CA ALA A 133 6.187 -10.797 8.440 1.00 0.00 C ATOM 2006 C ALA A 133 4.675 -10.790 8.643 1.00 0.00 C ATOM 2007 O ALA A 133 4.108 -9.810 9.127 1.00 0.00 O ATOM 2008 CB ALA A 133 6.899 -11.008 9.768 1.00 0.00 C ATOM 0 H ALA A 133 7.244 -8.987 8.404 1.00 0.00 H new ATOM 0 HA ALA A 133 6.434 -11.623 7.773 1.00 0.00 H new ATOM 0 HB1 ALA A 133 6.552 -11.936 10.223 1.00 0.00 H new ATOM 0 HB2 ALA A 133 7.974 -11.066 9.599 1.00 0.00 H new ATOM 0 HB3 ALA A 133 6.681 -10.173 10.434 1.00 0.00 H new ATOM 2014 N HIS A 134 4.028 -11.889 8.270 1.00 0.00 N ATOM 2015 CA HIS A 134 2.581 -12.009 8.411 1.00 0.00 C ATOM 2016 C HIS A 134 2.166 -11.886 9.874 1.00 0.00 C ATOM 2017 O HIS A 134 2.419 -12.782 10.679 1.00 0.00 O ATOM 2018 CB HIS A 134 2.101 -13.346 7.844 1.00 0.00 C ATOM 2019 CG HIS A 134 2.185 -13.428 6.351 1.00 0.00 C ATOM 2020 ND1 HIS A 134 2.590 -14.434 5.541 1.00 0.00 N flip ATOM 2021 CD2 HIS A 134 1.828 -12.388 5.519 1.00 0.00 C flip ATOM 2022 CE1 HIS A 134 2.470 -13.988 4.247 1.00 0.00 C flip ATOM 2023 NE2 HIS A 134 2.008 -12.751 4.262 1.00 0.00 N flip ATOM 0 H HIS A 134 4.482 -12.709 7.868 1.00 0.00 H new ATOM 0 HA HIS A 134 2.118 -11.197 7.850 1.00 0.00 H new ATOM 0 HB2 HIS A 134 2.696 -14.150 8.278 1.00 0.00 H new ATOM 0 HB3 HIS A 134 1.068 -13.512 8.151 1.00 0.00 H new ATOM 0 HD1 HIS A 134 2.922 -15.352 5.836 1.00 0.00 H new ATOM 0 HD2 HIS A 134 1.459 -11.427 5.844 1.00 0.00 H new ATOM 0 HE1 HIS A 134 2.714 -14.557 3.362 1.00 0.00 H new ATOM 0 HE2 HIS A 134 1.822 -12.174 3.442 1.00 0.00 H new ATOM 2032 N ARG A 135 1.528 -10.769 10.211 1.00 0.00 N ATOM 2033 CA ARG A 135 1.080 -10.528 11.577 1.00 0.00 C ATOM 2034 C ARG A 135 -0.348 -11.026 11.777 1.00 0.00 C ATOM 2035 O ARG A 135 -0.631 -11.772 12.715 1.00 0.00 O ATOM 2036 CB ARG A 135 1.163 -9.036 11.907 1.00 0.00 C ATOM 2037 CG ARG A 135 2.585 -8.525 12.067 1.00 0.00 C ATOM 2038 CD ARG A 135 2.609 -7.100 12.597 1.00 0.00 C ATOM 2039 NE ARG A 135 3.808 -6.829 13.385 1.00 0.00 N ATOM 2040 CZ ARG A 135 3.940 -7.167 14.662 1.00 0.00 C ATOM 2041 NH1 ARG A 135 2.952 -7.786 15.293 1.00 0.00 N ATOM 2042 NH2 ARG A 135 5.063 -6.886 15.312 1.00 0.00 N ATOM 0 H ARG A 135 1.310 -10.017 9.557 1.00 0.00 H new ATOM 0 HA ARG A 135 1.736 -11.079 12.251 1.00 0.00 H new ATOM 0 HB2 ARG A 135 0.669 -8.470 11.117 1.00 0.00 H new ATOM 0 HB3 ARG A 135 0.612 -8.845 12.828 1.00 0.00 H new ATOM 0 HG2 ARG A 135 3.132 -9.177 12.748 1.00 0.00 H new ATOM 0 HG3 ARG A 135 3.098 -8.565 11.106 1.00 0.00 H new ATOM 0 HD2 ARG A 135 2.559 -6.402 11.762 1.00 0.00 H new ATOM 0 HD3 ARG A 135 1.725 -6.927 13.211 1.00 0.00 H new ATOM 0 HE ARG A 135 4.587 -6.354 12.929 1.00 0.00 H new ATOM 0 HH11 ARG A 135 2.088 -8.004 14.797 1.00 0.00 H new ATOM 0 HH12 ARG A 135 3.056 -8.044 16.274 1.00 0.00 H new ATOM 0 HH21 ARG A 135 5.826 -6.410 14.830 1.00 0.00 H new ATOM 0 HH22 ARG A 135 5.163 -7.146 16.293 1.00 0.00 H new ATOM 2056 N LEU A 136 -1.244 -10.607 10.890 1.00 0.00 N ATOM 2057 CA LEU A 136 -2.644 -11.010 10.969 1.00 0.00 C ATOM 2058 C LEU A 136 -2.903 -12.249 10.117 1.00 0.00 C ATOM 2059 O LEU A 136 -2.888 -12.184 8.888 1.00 0.00 O ATOM 2060 CB LEU A 136 -3.551 -9.866 10.513 1.00 0.00 C ATOM 2061 CG LEU A 136 -5.023 -10.220 10.299 1.00 0.00 C ATOM 2062 CD1 LEU A 136 -5.810 -10.037 11.588 1.00 0.00 C ATOM 2063 CD2 LEU A 136 -5.619 -9.373 9.184 1.00 0.00 C ATOM 0 H LEU A 136 -1.026 -9.989 10.108 1.00 0.00 H new ATOM 0 HA LEU A 136 -2.869 -11.252 12.008 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -3.494 -9.067 11.252 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -3.155 -9.465 9.580 1.00 0.00 H new ATOM 0 HG LEU A 136 -5.085 -11.268 10.005 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -6.855 -10.294 11.416 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -5.399 -10.687 12.361 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -5.740 -8.999 11.913 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -6.667 -9.639 9.046 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -5.544 -8.318 9.448 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -5.074 -9.555 8.258 1.00 0.00 H new ATOM 2075 N SER A 137 -3.143 -13.376 10.779 1.00 0.00 N ATOM 2076 CA SER A 137 -3.404 -14.631 10.083 1.00 0.00 C ATOM 2077 C SER A 137 -4.472 -14.444 9.009 1.00 0.00 C ATOM 2078 O SER A 137 -4.417 -15.066 7.949 1.00 0.00 O ATOM 2079 CB SER A 137 -3.846 -15.707 11.076 1.00 0.00 C ATOM 2080 OG SER A 137 -5.136 -15.429 11.590 1.00 0.00 O ATOM 0 H SER A 137 -3.162 -13.446 11.796 1.00 0.00 H new ATOM 0 HA SER A 137 -2.480 -14.950 9.601 1.00 0.00 H new ATOM 0 HB2 SER A 137 -3.849 -16.680 10.585 1.00 0.00 H new ATOM 0 HB3 SER A 137 -3.130 -15.766 11.896 1.00 0.00 H new ATOM 0 HG SER A 137 -5.395 -16.133 12.221 1.00 0.00 H new ATOM 2086 N ALA A 138 -5.443 -13.583 9.293 1.00 0.00 N ATOM 2087 CA ALA A 138 -6.523 -13.312 8.353 1.00 0.00 C ATOM 2088 C ALA A 138 -6.095 -12.292 7.304 1.00 0.00 C ATOM 2089 O ALA A 138 -6.873 -11.419 6.918 1.00 0.00 O ATOM 2090 CB ALA A 138 -7.759 -12.823 9.094 1.00 0.00 C ATOM 0 H ALA A 138 -5.504 -13.061 10.167 1.00 0.00 H new ATOM 0 HA ALA A 138 -6.766 -14.242 7.840 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -8.557 -12.625 8.379 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -8.086 -13.586 9.800 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -7.520 -11.907 9.635 1.00 0.00 H new ATOM 2096 N PHE A 139 -4.852 -12.406 6.847 1.00 0.00 N ATOM 2097 CA PHE A 139 -4.320 -11.492 5.843 1.00 0.00 C ATOM 2098 C PHE A 139 -5.131 -11.567 4.553 1.00 0.00 C ATOM 2099 O PHE A 139 -5.359 -10.555 3.891 1.00 0.00 O ATOM 2100 CB PHE A 139 -2.852 -11.815 5.556 1.00 0.00 C ATOM 2101 CG PHE A 139 -2.666 -13.001 4.653 1.00 0.00 C ATOM 2102 CD1 PHE A 139 -2.968 -14.279 5.094 1.00 0.00 C ATOM 2103 CD2 PHE A 139 -2.187 -12.838 3.363 1.00 0.00 C ATOM 2104 CE1 PHE A 139 -2.798 -15.372 4.266 1.00 0.00 C ATOM 2105 CE2 PHE A 139 -2.015 -13.927 2.530 1.00 0.00 C ATOM 2106 CZ PHE A 139 -2.320 -15.196 2.983 1.00 0.00 C ATOM 0 H PHE A 139 -4.195 -13.122 7.156 1.00 0.00 H new ATOM 0 HA PHE A 139 -4.392 -10.478 6.237 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -2.379 -10.945 5.102 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -2.338 -12.002 6.499 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -3.341 -14.423 6.097 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -1.945 -11.848 3.004 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -3.039 -16.363 4.622 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -1.643 -13.786 1.526 1.00 0.00 H new ATOM 0 HZ PHE A 139 -2.185 -16.049 2.334 1.00 0.00 H new ATOM 2116 N GLN A 140 -5.564 -12.774 4.203 1.00 0.00 N ATOM 2117 CA GLN A 140 -6.349 -12.982 2.992 1.00 0.00 C ATOM 2118 C GLN A 140 -7.588 -12.093 2.987 1.00 0.00 C ATOM 2119 O GLN A 140 -8.040 -11.648 1.932 1.00 0.00 O ATOM 2120 CB GLN A 140 -6.760 -14.451 2.871 1.00 0.00 C ATOM 2121 CG GLN A 140 -7.789 -14.881 3.903 1.00 0.00 C ATOM 2122 CD GLN A 140 -7.772 -16.375 4.158 1.00 0.00 C ATOM 2123 OE1 GLN A 140 -8.061 -17.172 3.265 1.00 0.00 O ATOM 2124 NE2 GLN A 140 -7.430 -16.764 5.381 1.00 0.00 N ATOM 0 H GLN A 140 -5.385 -13.622 4.741 1.00 0.00 H new ATOM 0 HA GLN A 140 -5.729 -12.714 2.137 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -7.163 -14.626 1.873 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -5.873 -15.077 2.971 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -7.601 -14.355 4.839 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -8.782 -14.585 3.565 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -7.198 -16.069 6.091 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -7.399 -17.757 5.610 1.00 0.00 H new ATOM 2133 N ARG A 141 -8.132 -11.838 4.172 1.00 0.00 N ATOM 2134 CA ARG A 141 -9.320 -11.003 4.303 1.00 0.00 C ATOM 2135 C ARG A 141 -9.046 -9.586 3.808 1.00 0.00 C ATOM 2136 O ARG A 141 -9.906 -8.956 3.191 1.00 0.00 O ATOM 2137 CB ARG A 141 -9.783 -10.964 5.761 1.00 0.00 C ATOM 2138 CG ARG A 141 -10.088 -12.336 6.340 1.00 0.00 C ATOM 2139 CD ARG A 141 -10.891 -12.232 7.627 1.00 0.00 C ATOM 2140 NE ARG A 141 -12.327 -12.168 7.372 1.00 0.00 N ATOM 2141 CZ ARG A 141 -13.071 -13.232 7.088 1.00 0.00 C ATOM 2142 NH1 ARG A 141 -12.517 -14.434 7.023 1.00 0.00 N ATOM 2143 NH2 ARG A 141 -14.372 -13.093 6.868 1.00 0.00 N ATOM 0 H ARG A 141 -7.769 -12.197 5.055 1.00 0.00 H new ATOM 0 HA ARG A 141 -10.109 -11.438 3.689 1.00 0.00 H new ATOM 0 HB2 ARG A 141 -9.012 -10.487 6.366 1.00 0.00 H new ATOM 0 HB3 ARG A 141 -10.675 -10.342 5.834 1.00 0.00 H new ATOM 0 HG2 ARG A 141 -10.643 -12.925 5.610 1.00 0.00 H new ATOM 0 HG3 ARG A 141 -9.155 -12.866 6.534 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -10.673 -13.092 8.261 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -10.581 -11.344 8.177 1.00 0.00 H new ATOM 0 HE ARG A 141 -12.784 -11.257 7.414 1.00 0.00 H new ATOM 0 HH11 ARG A 141 -11.517 -14.544 7.191 1.00 0.00 H new ATOM 0 HH12 ARG A 141 -13.091 -15.249 6.805 1.00 0.00 H new ATOM 0 HH21 ARG A 141 -14.802 -12.169 6.917 1.00 0.00 H new ATOM 0 HH22 ARG A 141 -14.943 -13.910 6.650 1.00 0.00 H new ATOM 2157 N VAL A 142 -7.844 -9.091 4.081 1.00 0.00 N ATOM 2158 CA VAL A 142 -7.456 -7.749 3.663 1.00 0.00 C ATOM 2159 C VAL A 142 -7.774 -7.520 2.190 1.00 0.00 C ATOM 2160 O VAL A 142 -7.070 -8.012 1.308 1.00 0.00 O ATOM 2161 CB VAL A 142 -5.954 -7.500 3.897 1.00 0.00 C ATOM 2162 CG1 VAL A 142 -5.548 -6.137 3.358 1.00 0.00 C ATOM 2163 CG2 VAL A 142 -5.620 -7.619 5.376 1.00 0.00 C ATOM 0 H VAL A 142 -7.121 -9.599 4.590 1.00 0.00 H new ATOM 0 HA VAL A 142 -8.031 -7.050 4.270 1.00 0.00 H new ATOM 0 HB VAL A 142 -5.388 -8.260 3.357 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -4.484 -5.979 3.532 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -5.751 -6.094 2.288 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -6.118 -5.360 3.867 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -4.555 -7.440 5.524 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -6.193 -6.882 5.939 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -5.872 -8.620 5.727 1.00 0.00 H new ATOM 2173 N ASP A 143 -8.839 -6.769 1.930 1.00 0.00 N ATOM 2174 CA ASP A 143 -9.250 -6.472 0.563 1.00 0.00 C ATOM 2175 C ASP A 143 -9.420 -4.970 0.360 1.00 0.00 C ATOM 2176 O ASP A 143 -10.292 -4.527 -0.388 1.00 0.00 O ATOM 2177 CB ASP A 143 -10.557 -7.195 0.233 1.00 0.00 C ATOM 2178 CG ASP A 143 -10.348 -8.669 -0.052 1.00 0.00 C ATOM 2179 OD1 ASP A 143 -9.728 -9.353 0.788 1.00 0.00 O ATOM 2180 OD2 ASP A 143 -10.803 -9.139 -1.117 1.00 0.00 O ATOM 0 H ASP A 143 -9.433 -6.355 2.648 1.00 0.00 H new ATOM 0 HA ASP A 143 -8.468 -6.825 -0.110 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -11.250 -7.084 1.067 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -11.021 -6.723 -0.633 1.00 0.00 H new ATOM 2185 N THR A 144 -8.581 -4.189 1.034 1.00 0.00 N ATOM 2186 CA THR A 144 -8.639 -2.736 0.930 1.00 0.00 C ATOM 2187 C THR A 144 -7.251 -2.120 1.057 1.00 0.00 C ATOM 2188 O THR A 144 -6.631 -2.175 2.120 1.00 0.00 O ATOM 2189 CB THR A 144 -9.558 -2.132 2.009 1.00 0.00 C ATOM 2190 OG1 THR A 144 -10.812 -2.824 2.028 1.00 0.00 O ATOM 2191 CG2 THR A 144 -9.793 -0.651 1.752 1.00 0.00 C ATOM 0 H THR A 144 -7.853 -4.539 1.658 1.00 0.00 H new ATOM 0 HA THR A 144 -9.047 -2.505 -0.054 1.00 0.00 H new ATOM 0 HB THR A 144 -9.068 -2.243 2.976 1.00 0.00 H new ATOM 0 HG1 THR A 144 -11.520 -2.210 2.316 1.00 0.00 H new ATOM 0 HG21 THR A 144 -10.445 -0.246 2.526 1.00 0.00 H new ATOM 0 HG22 THR A 144 -8.839 -0.123 1.768 1.00 0.00 H new ATOM 0 HG23 THR A 144 -10.264 -0.521 0.777 1.00 0.00 H new ATOM 2199 N LEU A 145 -6.768 -1.532 -0.031 1.00 0.00 N ATOM 2200 CA LEU A 145 -5.451 -0.903 -0.041 1.00 0.00 C ATOM 2201 C LEU A 145 -5.572 0.611 -0.184 1.00 0.00 C ATOM 2202 O LEU A 145 -5.894 1.118 -1.257 1.00 0.00 O ATOM 2203 CB LEU A 145 -4.603 -1.468 -1.182 1.00 0.00 C ATOM 2204 CG LEU A 145 -3.496 -0.556 -1.711 1.00 0.00 C ATOM 2205 CD1 LEU A 145 -2.326 -0.519 -0.740 1.00 0.00 C ATOM 2206 CD2 LEU A 145 -3.036 -1.017 -3.086 1.00 0.00 C ATOM 0 H LEU A 145 -7.268 -1.477 -0.918 1.00 0.00 H new ATOM 0 HA LEU A 145 -4.964 -1.122 0.909 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -4.148 -2.399 -0.843 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -5.266 -1.720 -2.010 1.00 0.00 H new ATOM 0 HG LEU A 145 -3.897 0.453 -1.804 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -1.548 0.135 -1.133 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -2.665 -0.141 0.224 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -1.925 -1.525 -0.614 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -2.248 -0.356 -3.447 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -2.653 -2.035 -3.019 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -3.877 -0.990 -3.779 1.00 0.00 H new ATOM 2218 N GLU A 146 -5.309 1.325 0.906 1.00 0.00 N ATOM 2219 CA GLU A 146 -5.387 2.781 0.901 1.00 0.00 C ATOM 2220 C GLU A 146 -3.996 3.401 0.994 1.00 0.00 C ATOM 2221 O GLU A 146 -3.067 2.789 1.522 1.00 0.00 O ATOM 2222 CB GLU A 146 -6.255 3.272 2.062 1.00 0.00 C ATOM 2223 CG GLU A 146 -6.005 2.530 3.364 1.00 0.00 C ATOM 2224 CD GLU A 146 -6.832 1.265 3.483 1.00 0.00 C ATOM 2225 OE1 GLU A 146 -8.064 1.376 3.653 1.00 0.00 O ATOM 2226 OE2 GLU A 146 -6.247 0.164 3.406 1.00 0.00 O ATOM 0 H GLU A 146 -5.040 0.919 1.803 1.00 0.00 H new ATOM 0 HA GLU A 146 -5.842 3.091 -0.040 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -6.071 4.335 2.218 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -7.305 3.167 1.789 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -4.947 2.276 3.436 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -6.232 3.188 4.202 1.00 0.00 H new ATOM 2233 N ILE A 147 -3.861 4.618 0.479 1.00 0.00 N ATOM 2234 CA ILE A 147 -2.584 5.321 0.504 1.00 0.00 C ATOM 2235 C ILE A 147 -2.777 6.801 0.814 1.00 0.00 C ATOM 2236 O ILE A 147 -3.254 7.563 -0.027 1.00 0.00 O ATOM 2237 CB ILE A 147 -1.838 5.181 -0.836 1.00 0.00 C ATOM 2238 CG1 ILE A 147 -1.657 3.704 -1.193 1.00 0.00 C ATOM 2239 CG2 ILE A 147 -0.490 5.884 -0.768 1.00 0.00 C ATOM 2240 CD1 ILE A 147 -1.545 3.451 -2.680 1.00 0.00 C ATOM 0 H ILE A 147 -4.620 5.138 0.039 1.00 0.00 H new ATOM 0 HA ILE A 147 -1.987 4.863 1.292 1.00 0.00 H new ATOM 0 HB ILE A 147 -2.434 5.654 -1.617 1.00 0.00 H new ATOM 0 HG12 ILE A 147 -0.761 3.327 -0.700 1.00 0.00 H new ATOM 0 HG13 ILE A 147 -2.501 3.137 -0.799 1.00 0.00 H new ATOM 0 HG21 ILE A 147 0.025 5.776 -1.722 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -0.642 6.942 -0.555 1.00 0.00 H new ATOM 0 HG23 ILE A 147 0.114 5.438 0.022 1.00 0.00 H new ATOM 0 HD11 ILE A 147 -1.419 2.383 -2.859 1.00 0.00 H new ATOM 0 HD12 ILE A 147 -2.451 3.798 -3.177 1.00 0.00 H new ATOM 0 HD13 ILE A 147 -0.685 3.990 -3.077 1.00 0.00 H new ATOM 2252 N GLN A 148 -2.403 7.201 2.025 1.00 0.00 N ATOM 2253 CA GLN A 148 -2.534 8.591 2.445 1.00 0.00 C ATOM 2254 C GLN A 148 -1.166 9.212 2.708 1.00 0.00 C ATOM 2255 O GLN A 148 -0.149 8.519 2.712 1.00 0.00 O ATOM 2256 CB GLN A 148 -3.401 8.686 3.701 1.00 0.00 C ATOM 2257 CG GLN A 148 -3.091 7.617 4.736 1.00 0.00 C ATOM 2258 CD GLN A 148 -3.903 6.353 4.530 1.00 0.00 C ATOM 2259 OE1 GLN A 148 -3.231 5.274 4.145 1.00 0.00 O flip ATOM 2260 NE2 GLN A 148 -5.120 6.345 4.714 1.00 0.00 N flip ATOM 0 H GLN A 148 -2.007 6.582 2.732 1.00 0.00 H new ATOM 0 HA GLN A 148 -3.014 9.145 1.638 1.00 0.00 H new ATOM 0 HB2 GLN A 148 -3.264 9.668 4.153 1.00 0.00 H new ATOM 0 HB3 GLN A 148 -4.450 8.610 3.415 1.00 0.00 H new ATOM 0 HG2 GLN A 148 -2.029 7.373 4.694 1.00 0.00 H new ATOM 0 HG3 GLN A 148 -3.288 8.013 5.732 1.00 0.00 H new ATOM 0 HE21 GLN A 148 -5.597 7.197 5.010 1.00 0.00 H new ATOM 0 HE22 GLN A 148 -5.652 5.486 4.571 1.00 0.00 H new ATOM 2269 N GLY A 149 -1.149 10.523 2.927 1.00 0.00 N ATOM 2270 CA GLY A 149 0.100 11.215 3.187 1.00 0.00 C ATOM 2271 C GLY A 149 0.504 12.131 2.048 1.00 0.00 C ATOM 2272 O GLY A 149 -0.350 12.712 1.378 1.00 0.00 O ATOM 0 H GLY A 149 -1.977 11.118 2.929 1.00 0.00 H new ATOM 0 HA2 GLY A 149 0.004 11.799 4.102 1.00 0.00 H new ATOM 0 HA3 GLY A 149 0.889 10.482 3.357 1.00 0.00 H new ATOM 2276 N ASP A 150 1.807 12.261 1.830 1.00 0.00 N ATOM 2277 CA ASP A 150 2.323 13.113 0.765 1.00 0.00 C ATOM 2278 C ASP A 150 3.033 12.283 -0.300 1.00 0.00 C ATOM 2279 O ASP A 150 4.223 11.991 -0.182 1.00 0.00 O ATOM 2280 CB ASP A 150 3.281 14.159 1.338 1.00 0.00 C ATOM 2281 CG ASP A 150 2.644 14.989 2.434 1.00 0.00 C ATOM 2282 OD1 ASP A 150 1.697 14.493 3.080 1.00 0.00 O ATOM 2283 OD2 ASP A 150 3.093 16.134 2.648 1.00 0.00 O ATOM 0 H ASP A 150 2.526 11.787 2.377 1.00 0.00 H new ATOM 0 HA ASP A 150 1.479 13.622 0.300 1.00 0.00 H new ATOM 0 HB2 ASP A 150 4.166 13.659 1.732 1.00 0.00 H new ATOM 0 HB3 ASP A 150 3.617 14.817 0.537 1.00 0.00 H new ATOM 2288 N VAL A 151 2.295 11.905 -1.338 1.00 0.00 N ATOM 2289 CA VAL A 151 2.854 11.108 -2.424 1.00 0.00 C ATOM 2290 C VAL A 151 2.131 11.384 -3.737 1.00 0.00 C ATOM 2291 O VAL A 151 0.913 11.569 -3.762 1.00 0.00 O ATOM 2292 CB VAL A 151 2.774 9.601 -2.113 1.00 0.00 C ATOM 2293 CG1 VAL A 151 1.352 9.207 -1.744 1.00 0.00 C ATOM 2294 CG2 VAL A 151 3.272 8.786 -3.297 1.00 0.00 C ATOM 0 H VAL A 151 1.308 12.138 -1.450 1.00 0.00 H new ATOM 0 HA VAL A 151 3.901 11.396 -2.522 1.00 0.00 H new ATOM 0 HB VAL A 151 3.417 9.389 -1.259 1.00 0.00 H new ATOM 0 HG11 VAL A 151 1.315 8.139 -1.528 1.00 0.00 H new ATOM 0 HG12 VAL A 151 1.036 9.767 -0.864 1.00 0.00 H new ATOM 0 HG13 VAL A 151 0.685 9.432 -2.576 1.00 0.00 H new ATOM 0 HG21 VAL A 151 3.209 7.724 -3.060 1.00 0.00 H new ATOM 0 HG22 VAL A 151 2.657 9.000 -4.171 1.00 0.00 H new ATOM 0 HG23 VAL A 151 4.308 9.049 -3.510 1.00 0.00 H new ATOM 2304 N THR A 152 2.888 11.410 -4.829 1.00 0.00 N ATOM 2305 CA THR A 152 2.320 11.664 -6.147 1.00 0.00 C ATOM 2306 C THR A 152 2.168 10.371 -6.939 1.00 0.00 C ATOM 2307 O THR A 152 3.108 9.917 -7.593 1.00 0.00 O ATOM 2308 CB THR A 152 3.189 12.647 -6.954 1.00 0.00 C ATOM 2309 OG1 THR A 152 3.545 13.769 -6.138 1.00 0.00 O ATOM 2310 CG2 THR A 152 2.452 13.129 -8.194 1.00 0.00 C ATOM 0 H THR A 152 3.897 11.258 -4.827 1.00 0.00 H new ATOM 0 HA THR A 152 1.337 12.107 -5.987 1.00 0.00 H new ATOM 0 HB THR A 152 4.093 12.125 -7.268 1.00 0.00 H new ATOM 0 HG1 THR A 152 4.099 14.389 -6.657 1.00 0.00 H new ATOM 0 HG21 THR A 152 3.086 13.822 -8.748 1.00 0.00 H new ATOM 0 HG22 THR A 152 2.208 12.276 -8.827 1.00 0.00 H new ATOM 0 HG23 THR A 152 1.533 13.635 -7.897 1.00 0.00 H new ATOM 2318 N LEU A 153 0.979 9.781 -6.877 1.00 0.00 N ATOM 2319 CA LEU A 153 0.703 8.538 -7.590 1.00 0.00 C ATOM 2320 C LEU A 153 0.473 8.802 -9.074 1.00 0.00 C ATOM 2321 O LEU A 153 -0.200 9.762 -9.448 1.00 0.00 O ATOM 2322 CB LEU A 153 -0.519 7.843 -6.988 1.00 0.00 C ATOM 2323 CG LEU A 153 -0.405 7.438 -5.518 1.00 0.00 C ATOM 2324 CD1 LEU A 153 -1.744 6.939 -4.996 1.00 0.00 C ATOM 2325 CD2 LEU A 153 0.669 6.375 -5.339 1.00 0.00 C ATOM 0 H LEU A 153 0.191 10.143 -6.340 1.00 0.00 H new ATOM 0 HA LEU A 153 1.571 7.887 -7.486 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -1.378 8.505 -7.096 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -0.729 6.949 -7.575 1.00 0.00 H new ATOM 0 HG LEU A 153 -0.118 8.317 -4.940 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -1.643 6.655 -3.948 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -2.488 7.730 -5.088 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -2.061 6.073 -5.577 1.00 0.00 H new ATOM 0 HD21 LEU A 153 0.736 6.099 -4.287 1.00 0.00 H new ATOM 0 HD22 LEU A 153 0.412 5.495 -5.929 1.00 0.00 H new ATOM 0 HD23 LEU A 153 1.629 6.768 -5.673 1.00 0.00 H new ATOM 2337 N SER A 154 1.035 7.941 -9.917 1.00 0.00 N ATOM 2338 CA SER A 154 0.893 8.081 -11.361 1.00 0.00 C ATOM 2339 C SER A 154 0.271 6.828 -11.970 1.00 0.00 C ATOM 2340 O SER A 154 -0.560 6.910 -12.875 1.00 0.00 O ATOM 2341 CB SER A 154 2.253 8.354 -12.005 1.00 0.00 C ATOM 2342 OG SER A 154 2.903 9.447 -11.381 1.00 0.00 O ATOM 0 H SER A 154 1.593 7.139 -9.624 1.00 0.00 H new ATOM 0 HA SER A 154 0.231 8.925 -11.556 1.00 0.00 H new ATOM 0 HB2 SER A 154 2.879 7.465 -11.931 1.00 0.00 H new ATOM 0 HB3 SER A 154 2.121 8.563 -13.066 1.00 0.00 H new ATOM 0 HG SER A 154 3.771 9.600 -11.810 1.00 0.00 H new ATOM 2348 N TYR A 155 0.681 5.669 -11.468 1.00 0.00 N ATOM 2349 CA TYR A 155 0.167 4.397 -11.963 1.00 0.00 C ATOM 2350 C TYR A 155 0.074 3.372 -10.837 1.00 0.00 C ATOM 2351 O TYR A 155 1.036 3.149 -10.103 1.00 0.00 O ATOM 2352 CB TYR A 155 1.063 3.862 -13.082 1.00 0.00 C ATOM 2353 CG TYR A 155 0.662 2.490 -13.574 1.00 0.00 C ATOM 2354 CD1 TYR A 155 1.024 1.346 -12.874 1.00 0.00 C ATOM 2355 CD2 TYR A 155 -0.079 2.338 -14.740 1.00 0.00 C ATOM 2356 CE1 TYR A 155 0.660 0.090 -13.321 1.00 0.00 C ATOM 2357 CE2 TYR A 155 -0.448 1.086 -15.193 1.00 0.00 C ATOM 2358 CZ TYR A 155 -0.076 -0.035 -14.481 1.00 0.00 C ATOM 2359 OH TYR A 155 -0.441 -1.284 -14.928 1.00 0.00 O ATOM 0 H TYR A 155 1.368 5.584 -10.719 1.00 0.00 H new ATOM 0 HA TYR A 155 -0.834 4.568 -12.358 1.00 0.00 H new ATOM 0 HB2 TYR A 155 1.041 4.560 -13.919 1.00 0.00 H new ATOM 0 HB3 TYR A 155 2.092 3.825 -12.725 1.00 0.00 H new ATOM 0 HD1 TYR A 155 1.600 1.440 -11.965 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -0.371 3.213 -15.301 1.00 0.00 H new ATOM 0 HE1 TYR A 155 0.950 -0.789 -12.765 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -1.025 0.986 -16.100 1.00 0.00 H new ATOM 0 HH TYR A 155 0.054 -1.967 -14.429 1.00 0.00 H new ATOM 2369 N VAL A 156 -1.094 2.749 -10.708 1.00 0.00 N ATOM 2370 CA VAL A 156 -1.315 1.746 -9.674 1.00 0.00 C ATOM 2371 C VAL A 156 -2.141 0.581 -10.206 1.00 0.00 C ATOM 2372 O VAL A 156 -3.348 0.707 -10.411 1.00 0.00 O ATOM 2373 CB VAL A 156 -2.028 2.349 -8.449 1.00 0.00 C ATOM 2374 CG1 VAL A 156 -2.395 1.260 -7.453 1.00 0.00 C ATOM 2375 CG2 VAL A 156 -1.155 3.409 -7.794 1.00 0.00 C ATOM 0 H VAL A 156 -1.901 2.922 -11.307 1.00 0.00 H new ATOM 0 HA VAL A 156 -0.333 1.383 -9.371 1.00 0.00 H new ATOM 0 HB VAL A 156 -2.949 2.825 -8.785 1.00 0.00 H new ATOM 0 HG11 VAL A 156 -2.898 1.706 -6.595 1.00 0.00 H new ATOM 0 HG12 VAL A 156 -3.061 0.540 -7.930 1.00 0.00 H new ATOM 0 HG13 VAL A 156 -1.490 0.752 -7.120 1.00 0.00 H new ATOM 0 HG21 VAL A 156 -1.674 3.825 -6.930 1.00 0.00 H new ATOM 0 HG22 VAL A 156 -0.216 2.959 -7.471 1.00 0.00 H new ATOM 0 HG23 VAL A 156 -0.949 4.204 -8.511 1.00 0.00 H new ATOM 2385 N GLN A 157 -1.483 -0.553 -10.426 1.00 0.00 N ATOM 2386 CA GLN A 157 -2.158 -1.741 -10.935 1.00 0.00 C ATOM 2387 C GLN A 157 -2.013 -2.908 -9.964 1.00 0.00 C ATOM 2388 O GLN A 157 -0.917 -3.189 -9.476 1.00 0.00 O ATOM 2389 CB GLN A 157 -1.594 -2.128 -12.303 1.00 0.00 C ATOM 2390 CG GLN A 157 -2.028 -3.506 -12.773 1.00 0.00 C ATOM 2391 CD GLN A 157 -2.055 -3.627 -14.284 1.00 0.00 C ATOM 2392 OE1 GLN A 157 -1.057 -3.991 -14.907 1.00 0.00 O ATOM 2393 NE2 GLN A 157 -3.200 -3.320 -14.882 1.00 0.00 N ATOM 0 H GLN A 157 -0.484 -0.674 -10.260 1.00 0.00 H new ATOM 0 HA GLN A 157 -3.218 -1.508 -11.039 1.00 0.00 H new ATOM 0 HB2 GLN A 157 -1.907 -1.387 -13.039 1.00 0.00 H new ATOM 0 HB3 GLN A 157 -0.505 -2.094 -12.261 1.00 0.00 H new ATOM 0 HG2 GLN A 157 -1.350 -4.255 -12.365 1.00 0.00 H new ATOM 0 HG3 GLN A 157 -3.020 -3.725 -12.377 1.00 0.00 H new ATOM 0 HE21 GLN A 157 -4.002 -3.023 -14.326 1.00 0.00 H new ATOM 0 HE22 GLN A 157 -3.278 -3.381 -15.897 1.00 0.00 H new ATOM 2402 N ILE A 158 -3.123 -3.583 -9.687 1.00 0.00 N ATOM 2403 CA ILE A 158 -3.118 -4.720 -8.775 1.00 0.00 C ATOM 2404 C ILE A 158 -3.079 -6.038 -9.539 1.00 0.00 C ATOM 2405 O ILE A 158 -4.119 -6.619 -9.850 1.00 0.00 O ATOM 2406 CB ILE A 158 -4.354 -4.709 -7.855 1.00 0.00 C ATOM 2407 CG1 ILE A 158 -4.424 -3.395 -7.074 1.00 0.00 C ATOM 2408 CG2 ILE A 158 -4.317 -5.896 -6.905 1.00 0.00 C ATOM 2409 CD1 ILE A 158 -5.836 -2.953 -6.760 1.00 0.00 C ATOM 0 H ILE A 158 -4.038 -3.362 -10.081 1.00 0.00 H new ATOM 0 HA ILE A 158 -2.219 -4.631 -8.164 1.00 0.00 H new ATOM 0 HB ILE A 158 -5.249 -4.790 -8.472 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -3.871 -3.506 -6.141 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -3.927 -2.613 -7.648 1.00 0.00 H new ATOM 0 HG21 ILE A 158 -5.197 -5.875 -6.262 1.00 0.00 H new ATOM 0 HG22 ILE A 158 -4.310 -6.822 -7.480 1.00 0.00 H new ATOM 0 HG23 ILE A 158 -3.417 -5.843 -6.292 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -5.809 -2.015 -6.205 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -6.387 -2.809 -7.689 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -6.331 -3.716 -6.159 1.00 0.00 H new ATOM 2421 N SER A 159 -1.871 -6.507 -9.838 1.00 0.00 N ATOM 2422 CA SER A 159 -1.696 -7.757 -10.568 1.00 0.00 C ATOM 2423 C SER A 159 -2.397 -8.907 -9.852 1.00 0.00 C ATOM 2424 O SER A 159 -2.075 -9.231 -8.710 1.00 0.00 O ATOM 2425 CB SER A 159 -0.207 -8.073 -10.729 1.00 0.00 C ATOM 2426 OG SER A 159 0.378 -7.270 -11.738 1.00 0.00 O ATOM 0 H SER A 159 -1.000 -6.040 -9.586 1.00 0.00 H new ATOM 0 HA SER A 159 -2.144 -7.639 -11.554 1.00 0.00 H new ATOM 0 HB2 SER A 159 0.308 -7.906 -9.783 1.00 0.00 H new ATOM 0 HB3 SER A 159 -0.081 -9.126 -10.979 1.00 0.00 H new ATOM 0 HG SER A 159 1.330 -7.490 -11.820 1.00 0.00 H new ATOM 2432 N GLY A 160 -3.359 -9.522 -10.534 1.00 0.00 N ATOM 2433 CA GLY A 160 -4.092 -10.629 -9.949 1.00 0.00 C ATOM 2434 C GLY A 160 -4.242 -11.796 -10.905 1.00 0.00 C ATOM 2435 O GLY A 160 -4.037 -11.666 -12.112 1.00 0.00 O ATOM 0 H GLY A 160 -3.643 -9.273 -11.481 1.00 0.00 H new ATOM 0 HA2 GLY A 160 -3.578 -10.965 -9.048 1.00 0.00 H new ATOM 0 HA3 GLY A 160 -5.080 -10.285 -9.643 1.00 0.00 H new ATOM 2439 N PRO A 161 -4.605 -12.968 -10.363 1.00 0.00 N ATOM 2440 CA PRO A 161 -4.788 -14.185 -11.159 1.00 0.00 C ATOM 2441 C PRO A 161 -6.016 -14.109 -12.060 1.00 0.00 C ATOM 2442 O PRO A 161 -6.277 -15.019 -12.847 1.00 0.00 O ATOM 2443 CB PRO A 161 -4.967 -15.277 -10.101 1.00 0.00 C ATOM 2444 CG PRO A 161 -5.490 -14.562 -8.904 1.00 0.00 C ATOM 2445 CD PRO A 161 -4.865 -13.194 -8.932 1.00 0.00 C ATOM 0 HA PRO A 161 -3.951 -14.360 -11.835 1.00 0.00 H new ATOM 0 HB2 PRO A 161 -5.663 -16.045 -10.439 1.00 0.00 H new ATOM 0 HB3 PRO A 161 -4.023 -15.776 -9.883 1.00 0.00 H new ATOM 0 HG2 PRO A 161 -6.578 -14.495 -8.934 1.00 0.00 H new ATOM 0 HG3 PRO A 161 -5.229 -15.092 -7.988 1.00 0.00 H new ATOM 0 HD2 PRO A 161 -5.534 -12.438 -8.521 1.00 0.00 H new ATOM 0 HD3 PRO A 161 -3.946 -13.160 -8.346 1.00 0.00 H new ATOM 2453 N SER A 162 -6.766 -13.019 -11.939 1.00 0.00 N ATOM 2454 CA SER A 162 -7.969 -12.826 -12.741 1.00 0.00 C ATOM 2455 C SER A 162 -7.793 -11.665 -13.715 1.00 0.00 C ATOM 2456 O SER A 162 -6.801 -10.938 -13.658 1.00 0.00 O ATOM 2457 CB SER A 162 -9.175 -12.569 -11.835 1.00 0.00 C ATOM 2458 OG SER A 162 -10.388 -12.678 -12.559 1.00 0.00 O ATOM 0 H SER A 162 -6.562 -12.256 -11.294 1.00 0.00 H new ATOM 0 HA SER A 162 -8.142 -13.736 -13.316 1.00 0.00 H new ATOM 0 HB2 SER A 162 -9.174 -13.283 -11.011 1.00 0.00 H new ATOM 0 HB3 SER A 162 -9.098 -11.575 -11.395 1.00 0.00 H new ATOM 0 HG SER A 162 -11.144 -12.511 -11.958 1.00 0.00 H new ATOM 2464 N SER A 163 -8.763 -11.497 -14.608 1.00 0.00 N ATOM 2465 CA SER A 163 -8.715 -10.427 -15.597 1.00 0.00 C ATOM 2466 C SER A 163 -10.088 -10.203 -16.222 1.00 0.00 C ATOM 2467 O SER A 163 -10.585 -11.041 -16.974 1.00 0.00 O ATOM 2468 CB SER A 163 -7.694 -10.758 -16.687 1.00 0.00 C ATOM 2469 OG SER A 163 -8.033 -11.960 -17.356 1.00 0.00 O ATOM 0 H SER A 163 -9.592 -12.089 -14.667 1.00 0.00 H new ATOM 0 HA SER A 163 -8.412 -9.511 -15.091 1.00 0.00 H new ATOM 0 HB2 SER A 163 -7.646 -9.940 -17.405 1.00 0.00 H new ATOM 0 HB3 SER A 163 -6.702 -10.852 -16.244 1.00 0.00 H new ATOM 0 HG SER A 163 -9.006 -12.074 -17.351 1.00 0.00 H new ATOM 2475 N GLY A 164 -10.697 -9.065 -15.904 1.00 0.00 N ATOM 2476 CA GLY A 164 -12.008 -8.749 -16.442 1.00 0.00 C ATOM 2477 C GLY A 164 -12.046 -7.394 -17.120 1.00 0.00 C ATOM 2478 O GLY A 164 -11.285 -6.494 -16.764 1.00 0.00 O ATOM 0 H GLY A 164 -10.306 -8.356 -15.283 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -12.298 -9.518 -17.158 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -12.742 -8.769 -15.637 1.00 0.00 H new TER 2482 GLY A 164