USER MOD reduce.3.24.130724 H: found=0, std=0, add=908, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 908 hydrogens (12 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 102 TYR OH : rot 26:sc= 0.745 USER MOD Set 1.2: A 106 GLN : amide:sc= 0.303 K(o=1,f=-4.5!) USER MOD Set 2.1: A 55 SER OG : rot 23:sc= 0.83 USER MOD Set 2.2: A 99 CYS SG : rot 80:sc= 0.23 USER MOD Single : A 1 ATP O2' : rot -23:sc= 0.591 USER MOD Single : A 1 ATP O3' : rot -18:sc= 1.64 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 29 GLN :FLIP amide:sc=-0.00109 F(o=-1.2!,f=-0.0011) USER MOD Single : A 32 SER OG : rot -132:sc= -0.2 USER MOD Single : A 34 HIS :FLIP no HD1:sc= -0.431 F(o=-1.1,f=-0.43) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 42 HIS :FLIP no HD1:sc= -1.24 F(o=-2.9!,f=-1.2) USER MOD Single : A 43 ASN : amide:sc= -0.0146 K(o=-0.015,f=-1.9!) USER MOD Single : A 47 SER OG : rot 180:sc= 0.0027 USER MOD Single : A 61 LYS NZ :NH3+ -160:sc= -0.183 (180deg=-0.825) USER MOD Single : A 63 GLN : amide:sc= -0.0287 X(o=-0.029,f=0) USER MOD Single : A 64 SER OG : rot -113:sc= 1.56 USER MOD Single : A 68 THR OG1 : rot -49:sc= -0.693 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ -135:sc= -5.94! (180deg=-7.22!) USER MOD Single : A 88 GLN : amide:sc= -0.0499 K(o=-0.05,f=-2!) USER MOD Single : A 92 TYR OH : rot 165:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 180:sc= -0.524 USER MOD Single : A 100 HIS : no HE2:sc= 1.11 K(o=1.1,f=-7.3!) USER MOD Single : A 105 TYR OH : rot 180:sc=-0.000378 USER MOD Single : A 107 GLN : amide:sc= -3.4! C(o=-3.4!,f=-9.7!) USER MOD Single : A 109 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 THR OG1 : rot -160:sc= 0 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 GLN : amide:sc= -5.75! C(o=-5.7!,f=-5.3!) USER MOD Single : A 120 SER OG : rot -90:sc= -1.76 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 THR OG1 : rot -73:sc= 0.749 USER MOD Single : A 137 GLN :FLIP amide:sc= -6.01! C(o=-11!,f=-6!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 17 14.860 9.019 -34.123 1.00 0.00 N ATOM 2 CA GLY A 17 15.619 8.720 -35.370 1.00 0.00 C ATOM 3 C GLY A 17 15.557 9.927 -36.307 1.00 0.00 C ATOM 4 O GLY A 17 14.913 9.893 -37.337 1.00 0.00 O ATOM 0 HA2 GLY A 17 16.656 8.486 -35.130 1.00 0.00 H new ATOM 0 HA3 GLY A 17 15.200 7.842 -35.862 1.00 0.00 H new ATOM 10 N ALA A 18 16.225 10.993 -35.962 1.00 0.00 N ATOM 11 CA ALA A 18 16.207 12.199 -36.837 1.00 0.00 C ATOM 12 C ALA A 18 17.236 13.228 -36.329 1.00 0.00 C ATOM 13 O ALA A 18 18.086 13.667 -37.079 1.00 0.00 O ATOM 14 CB ALA A 18 14.781 12.798 -36.864 1.00 0.00 C ATOM 0 H ALA A 18 16.782 11.081 -35.112 1.00 0.00 H new ATOM 0 HA ALA A 18 16.481 11.921 -37.855 1.00 0.00 H new ATOM 0 HB1 ALA A 18 14.769 13.680 -37.504 1.00 0.00 H new ATOM 0 HB2 ALA A 18 14.083 12.057 -37.253 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.485 13.079 -35.853 1.00 0.00 H new ATOM 20 N PRO A 19 17.174 13.614 -35.073 1.00 0.00 N ATOM 21 CA PRO A 19 18.133 14.605 -34.502 1.00 0.00 C ATOM 22 C PRO A 19 19.577 14.336 -34.942 1.00 0.00 C ATOM 23 O PRO A 19 20.292 13.571 -34.326 1.00 0.00 O ATOM 24 CB PRO A 19 17.978 14.416 -32.992 1.00 0.00 C ATOM 25 CG PRO A 19 16.555 13.994 -32.813 1.00 0.00 C ATOM 26 CD PRO A 19 16.198 13.163 -34.055 1.00 0.00 C ATOM 0 HA PRO A 19 17.924 15.621 -34.837 1.00 0.00 H new ATOM 0 HB2 PRO A 19 18.667 13.661 -32.614 1.00 0.00 H new ATOM 0 HB3 PRO A 19 18.189 15.339 -32.452 1.00 0.00 H new ATOM 0 HG2 PRO A 19 16.434 13.406 -31.903 1.00 0.00 H new ATOM 0 HG3 PRO A 19 15.900 14.860 -32.722 1.00 0.00 H new ATOM 0 HD2 PRO A 19 16.287 12.094 -33.861 1.00 0.00 H new ATOM 0 HD3 PRO A 19 15.172 13.344 -34.376 1.00 0.00 H new ATOM 34 N GLU A 20 20.010 14.961 -36.003 1.00 0.00 N ATOM 35 CA GLU A 20 21.404 14.742 -36.481 1.00 0.00 C ATOM 36 C GLU A 20 21.743 15.774 -37.558 1.00 0.00 C ATOM 37 O GLU A 20 21.239 15.722 -38.662 1.00 0.00 O ATOM 38 CB GLU A 20 21.527 13.334 -37.067 1.00 0.00 C ATOM 39 CG GLU A 20 22.948 13.122 -37.592 1.00 0.00 C ATOM 40 CD GLU A 20 23.177 11.633 -37.859 1.00 0.00 C ATOM 41 OE1 GLU A 20 22.199 10.929 -38.051 1.00 0.00 O ATOM 42 OE2 GLU A 20 24.326 11.222 -37.866 1.00 0.00 O ATOM 0 H GLU A 20 19.458 15.614 -36.559 1.00 0.00 H new ATOM 0 HA GLU A 20 22.095 14.850 -35.645 1.00 0.00 H new ATOM 0 HB2 GLU A 20 21.295 12.590 -36.305 1.00 0.00 H new ATOM 0 HB3 GLU A 20 20.806 13.200 -37.874 1.00 0.00 H new ATOM 0 HG2 GLU A 20 23.098 13.694 -38.508 1.00 0.00 H new ATOM 0 HG3 GLU A 20 23.674 13.488 -36.866 1.00 0.00 H new ATOM 49 N GLY A 21 22.593 16.714 -37.246 1.00 0.00 N ATOM 50 CA GLY A 21 22.963 17.748 -38.252 1.00 0.00 C ATOM 51 C GLY A 21 23.910 18.768 -37.613 1.00 0.00 C ATOM 52 O GLY A 21 25.027 18.949 -38.056 1.00 0.00 O ATOM 0 H GLY A 21 23.047 16.810 -36.338 1.00 0.00 H new ATOM 0 HA2 GLY A 21 23.443 17.279 -39.111 1.00 0.00 H new ATOM 0 HA3 GLY A 21 22.068 18.249 -38.621 1.00 0.00 H new ATOM 56 N PRO A 22 23.464 19.430 -36.577 1.00 0.00 N ATOM 57 CA PRO A 22 24.281 20.452 -35.860 1.00 0.00 C ATOM 58 C PRO A 22 25.710 19.967 -35.587 1.00 0.00 C ATOM 59 O PRO A 22 26.656 20.726 -35.651 1.00 0.00 O ATOM 60 CB PRO A 22 23.513 20.662 -34.550 1.00 0.00 C ATOM 61 CG PRO A 22 22.087 20.372 -34.898 1.00 0.00 C ATOM 62 CD PRO A 22 22.127 19.277 -35.972 1.00 0.00 C ATOM 0 HA PRO A 22 24.404 21.365 -36.443 1.00 0.00 H new ATOM 0 HB2 PRO A 22 23.874 19.994 -33.768 1.00 0.00 H new ATOM 0 HB3 PRO A 22 23.632 21.680 -34.180 1.00 0.00 H new ATOM 0 HG2 PRO A 22 21.532 20.038 -34.021 1.00 0.00 H new ATOM 0 HG3 PRO A 22 21.587 21.266 -35.271 1.00 0.00 H new ATOM 0 HD2 PRO A 22 21.995 18.286 -35.538 1.00 0.00 H new ATOM 0 HD3 PRO A 22 21.336 19.410 -36.710 1.00 0.00 H new ATOM 70 N GLY A 23 25.872 18.708 -35.284 1.00 0.00 N ATOM 71 CA GLY A 23 27.236 18.177 -35.009 1.00 0.00 C ATOM 72 C GLY A 23 27.134 16.719 -34.552 1.00 0.00 C ATOM 73 O GLY A 23 26.055 16.180 -34.412 1.00 0.00 O ATOM 0 H GLY A 23 25.118 18.024 -35.215 1.00 0.00 H new ATOM 0 HA2 GLY A 23 27.852 18.246 -35.905 1.00 0.00 H new ATOM 0 HA3 GLY A 23 27.723 18.777 -34.240 1.00 0.00 H new ATOM 77 N PRO A 24 28.256 16.088 -34.323 1.00 0.00 N ATOM 78 CA PRO A 24 28.305 14.666 -33.874 1.00 0.00 C ATOM 79 C PRO A 24 27.927 14.517 -32.394 1.00 0.00 C ATOM 80 O PRO A 24 28.776 14.487 -31.526 1.00 0.00 O ATOM 81 CB PRO A 24 29.769 14.274 -34.109 1.00 0.00 C ATOM 82 CG PRO A 24 30.531 15.552 -33.953 1.00 0.00 C ATOM 83 CD PRO A 24 29.606 16.662 -34.467 1.00 0.00 C ATOM 0 HA PRO A 24 27.596 14.035 -34.410 1.00 0.00 H new ATOM 0 HB2 PRO A 24 30.099 13.525 -33.389 1.00 0.00 H new ATOM 0 HB3 PRO A 24 29.911 13.847 -35.102 1.00 0.00 H new ATOM 0 HG2 PRO A 24 30.801 15.721 -32.910 1.00 0.00 H new ATOM 0 HG3 PRO A 24 31.460 15.524 -34.522 1.00 0.00 H new ATOM 0 HD2 PRO A 24 29.716 17.577 -33.884 1.00 0.00 H new ATOM 0 HD3 PRO A 24 29.824 16.917 -35.504 1.00 0.00 H new ATOM 91 N SER A 25 26.658 14.425 -32.103 1.00 0.00 N ATOM 92 CA SER A 25 26.228 14.279 -30.684 1.00 0.00 C ATOM 93 C SER A 25 26.875 13.030 -30.081 1.00 0.00 C ATOM 94 O SER A 25 27.085 12.041 -30.755 1.00 0.00 O ATOM 95 CB SER A 25 24.705 14.143 -30.625 1.00 0.00 C ATOM 96 OG SER A 25 24.278 13.179 -31.576 1.00 0.00 O ATOM 0 H SER A 25 25.901 14.445 -32.786 1.00 0.00 H new ATOM 0 HA SER A 25 26.537 15.158 -30.118 1.00 0.00 H new ATOM 0 HB2 SER A 25 24.395 13.844 -29.624 1.00 0.00 H new ATOM 0 HB3 SER A 25 24.235 15.105 -30.830 1.00 0.00 H new ATOM 0 HG SER A 25 23.303 13.091 -31.537 1.00 0.00 H new ATOM 102 N GLY A 26 27.193 13.068 -28.816 1.00 0.00 N ATOM 103 CA GLY A 26 27.826 11.883 -28.171 1.00 0.00 C ATOM 104 C GLY A 26 26.751 10.842 -27.850 1.00 0.00 C ATOM 105 O GLY A 26 25.607 10.977 -28.237 1.00 0.00 O ATOM 0 H GLY A 26 27.042 13.868 -28.201 1.00 0.00 H new ATOM 0 HA2 GLY A 26 28.577 11.453 -28.833 1.00 0.00 H new ATOM 0 HA3 GLY A 26 28.340 12.184 -27.258 1.00 0.00 H new ATOM 109 N GLY A 27 27.110 9.803 -27.147 1.00 0.00 N ATOM 110 CA GLY A 27 26.109 8.755 -26.802 1.00 0.00 C ATOM 111 C GLY A 27 26.834 7.466 -26.412 1.00 0.00 C ATOM 112 O GLY A 27 26.538 6.400 -26.915 1.00 0.00 O ATOM 0 H GLY A 27 28.053 9.635 -26.797 1.00 0.00 H new ATOM 0 HA2 GLY A 27 25.480 9.094 -25.979 1.00 0.00 H new ATOM 0 HA3 GLY A 27 25.451 8.572 -27.651 1.00 0.00 H new ATOM 116 N ALA A 28 27.782 7.553 -25.520 1.00 0.00 N ATOM 117 CA ALA A 28 28.524 6.332 -25.100 1.00 0.00 C ATOM 118 C ALA A 28 27.660 5.515 -24.137 1.00 0.00 C ATOM 119 O ALA A 28 27.606 4.304 -24.211 1.00 0.00 O ATOM 120 CB ALA A 28 29.822 6.740 -24.399 1.00 0.00 C ATOM 0 H ALA A 28 28.075 8.417 -25.064 1.00 0.00 H new ATOM 0 HA ALA A 28 28.758 5.730 -25.978 1.00 0.00 H new ATOM 0 HB1 ALA A 28 30.366 5.847 -24.091 1.00 0.00 H new ATOM 0 HB2 ALA A 28 30.438 7.322 -25.084 1.00 0.00 H new ATOM 0 HB3 ALA A 28 29.588 7.342 -23.521 1.00 0.00 H new ATOM 126 N GLN A 29 26.982 6.170 -23.232 1.00 0.00 N ATOM 127 CA GLN A 29 26.119 5.434 -22.261 1.00 0.00 C ATOM 128 C GLN A 29 24.983 6.349 -21.798 1.00 0.00 C ATOM 129 O GLN A 29 23.921 6.382 -22.387 1.00 0.00 O ATOM 130 CB GLN A 29 26.955 5.012 -21.050 1.00 0.00 C ATOM 131 CG GLN A 29 27.998 3.977 -21.481 1.00 0.00 C ATOM 132 CD GLN A 29 28.584 3.298 -20.241 1.00 0.00 C ATOM 133 OE1 GLN A 29 28.292 3.764 -19.057 1.00 0.00 O flip ATOM 134 NE2 GLN A 29 29.315 2.333 -20.351 1.00 0.00 N flip ATOM 0 H GLN A 29 26.988 7.184 -23.123 1.00 0.00 H new ATOM 0 HA GLN A 29 25.704 4.548 -22.743 1.00 0.00 H new ATOM 0 HB2 GLN A 29 27.449 5.881 -20.615 1.00 0.00 H new ATOM 0 HB3 GLN A 29 26.310 4.593 -20.278 1.00 0.00 H new ATOM 0 HG2 GLN A 29 27.540 3.234 -22.134 1.00 0.00 H new ATOM 0 HG3 GLN A 29 28.790 4.460 -22.053 1.00 0.00 H new ATOM 0 HE21 GLN A 29 29.543 1.969 -21.276 1.00 0.00 H new ATOM 0 HE22 GLN A 29 29.700 1.887 -19.518 1.00 0.00 H new ATOM 143 N GLY A 30 25.198 7.091 -20.747 1.00 0.00 N ATOM 144 CA GLY A 30 24.130 8.002 -20.247 1.00 0.00 C ATOM 145 C GLY A 30 22.962 7.173 -19.710 1.00 0.00 C ATOM 146 O GLY A 30 22.945 6.777 -18.562 1.00 0.00 O ATOM 0 H GLY A 30 26.067 7.106 -20.213 1.00 0.00 H new ATOM 0 HA2 GLY A 30 24.525 8.645 -19.461 1.00 0.00 H new ATOM 0 HA3 GLY A 30 23.788 8.654 -21.051 1.00 0.00 H new ATOM 150 N GLY A 31 21.984 6.906 -20.532 1.00 0.00 N ATOM 151 CA GLY A 31 20.818 6.102 -20.067 1.00 0.00 C ATOM 152 C GLY A 31 20.289 6.683 -18.755 1.00 0.00 C ATOM 153 O GLY A 31 19.871 7.822 -18.692 1.00 0.00 O ATOM 0 H GLY A 31 21.942 7.210 -21.505 1.00 0.00 H new ATOM 0 HA2 GLY A 31 20.033 6.109 -20.823 1.00 0.00 H new ATOM 0 HA3 GLY A 31 21.113 5.063 -19.924 1.00 0.00 H new ATOM 157 N SER A 32 20.303 5.909 -17.704 1.00 0.00 N ATOM 158 CA SER A 32 19.800 6.418 -16.397 1.00 0.00 C ATOM 159 C SER A 32 20.694 7.563 -15.917 1.00 0.00 C ATOM 160 O SER A 32 21.867 7.381 -15.659 1.00 0.00 O ATOM 161 CB SER A 32 19.824 5.287 -15.367 1.00 0.00 C ATOM 162 OG SER A 32 19.600 5.822 -14.071 1.00 0.00 O ATOM 0 H SER A 32 20.641 4.947 -17.694 1.00 0.00 H new ATOM 0 HA SER A 32 18.779 6.780 -16.517 1.00 0.00 H new ATOM 0 HB2 SER A 32 19.058 4.548 -15.604 1.00 0.00 H new ATOM 0 HB3 SER A 32 20.784 4.772 -15.399 1.00 0.00 H new ATOM 0 HG SER A 32 20.271 5.468 -13.451 1.00 0.00 H new ATOM 168 N ILE A 33 20.149 8.742 -15.796 1.00 0.00 N ATOM 169 CA ILE A 33 20.968 9.898 -15.333 1.00 0.00 C ATOM 170 C ILE A 33 21.229 9.766 -13.829 1.00 0.00 C ATOM 171 O ILE A 33 21.909 8.862 -13.386 1.00 0.00 O ATOM 172 CB ILE A 33 20.216 11.202 -15.620 1.00 0.00 C ATOM 173 CG1 ILE A 33 18.737 11.029 -15.259 1.00 0.00 C ATOM 174 CG2 ILE A 33 20.336 11.548 -17.107 1.00 0.00 C ATOM 175 CD1 ILE A 33 18.065 12.402 -15.190 1.00 0.00 C ATOM 0 H ILE A 33 19.172 8.955 -15.998 1.00 0.00 H new ATOM 0 HA ILE A 33 21.921 9.910 -15.863 1.00 0.00 H new ATOM 0 HB ILE A 33 20.647 12.006 -15.023 1.00 0.00 H new ATOM 0 HG12 ILE A 33 18.240 10.406 -16.003 1.00 0.00 H new ATOM 0 HG13 ILE A 33 18.643 10.518 -14.301 1.00 0.00 H new ATOM 0 HG21 ILE A 33 19.801 12.476 -17.309 1.00 0.00 H new ATOM 0 HG22 ILE A 33 21.387 11.671 -17.368 1.00 0.00 H new ATOM 0 HG23 ILE A 33 19.906 10.744 -17.704 1.00 0.00 H new ATOM 0 HD11 ILE A 33 17.013 12.280 -14.933 1.00 0.00 H new ATOM 0 HD12 ILE A 33 18.556 13.009 -14.430 1.00 0.00 H new ATOM 0 HD13 ILE A 33 18.147 12.896 -16.158 1.00 0.00 H new ATOM 187 N HIS A 34 20.695 10.658 -13.039 1.00 0.00 N ATOM 188 CA HIS A 34 20.916 10.577 -11.568 1.00 0.00 C ATOM 189 C HIS A 34 19.983 9.522 -10.969 1.00 0.00 C ATOM 190 O HIS A 34 19.947 9.319 -9.772 1.00 0.00 O ATOM 191 CB HIS A 34 20.621 11.938 -10.933 1.00 0.00 C ATOM 192 CG HIS A 34 21.290 13.021 -11.734 1.00 0.00 C ATOM 193 ND1 HIS A 34 22.281 12.980 -12.683 1.00 0.00 N flip ATOM 194 CD2 HIS A 34 20.950 14.357 -11.599 1.00 0.00 C flip ATOM 195 CE1 HIS A 34 22.553 14.269 -13.132 1.00 0.00 C flip ATOM 196 NE2 HIS A 34 21.723 15.060 -12.446 1.00 0.00 N flip ATOM 0 H HIS A 34 20.116 11.438 -13.349 1.00 0.00 H new ATOM 0 HA HIS A 34 21.952 10.300 -11.371 1.00 0.00 H new ATOM 0 HB2 HIS A 34 19.545 12.109 -10.898 1.00 0.00 H new ATOM 0 HB3 HIS A 34 20.981 11.957 -9.904 1.00 0.00 H new ATOM 0 HD2 HIS A 34 20.200 14.761 -10.934 1.00 0.00 H new ATOM 0 HE1 HIS A 34 23.279 14.566 -13.875 1.00 0.00 H new ATOM 0 HE2 HIS A 34 21.681 16.074 -12.552 1.00 0.00 H new ATOM 204 N SER A 35 19.228 8.849 -11.794 1.00 0.00 N ATOM 205 CA SER A 35 18.299 7.808 -11.271 1.00 0.00 C ATOM 206 C SER A 35 19.081 6.526 -10.979 1.00 0.00 C ATOM 207 O SER A 35 20.015 6.184 -11.677 1.00 0.00 O ATOM 208 CB SER A 35 17.218 7.519 -12.315 1.00 0.00 C ATOM 209 OG SER A 35 16.195 6.726 -11.730 1.00 0.00 O ATOM 0 H SER A 35 19.214 8.975 -12.806 1.00 0.00 H new ATOM 0 HA SER A 35 17.832 8.166 -10.353 1.00 0.00 H new ATOM 0 HB2 SER A 35 16.800 8.453 -12.689 1.00 0.00 H new ATOM 0 HB3 SER A 35 17.652 6.999 -13.169 1.00 0.00 H new ATOM 0 HG SER A 35 15.502 6.542 -12.398 1.00 0.00 H new ATOM 215 N GLY A 36 18.708 5.813 -9.952 1.00 0.00 N ATOM 216 CA GLY A 36 19.430 4.553 -9.616 1.00 0.00 C ATOM 217 C GLY A 36 19.147 4.175 -8.161 1.00 0.00 C ATOM 218 O GLY A 36 18.011 4.003 -7.764 1.00 0.00 O ATOM 0 H GLY A 36 17.934 6.048 -9.331 1.00 0.00 H new ATOM 0 HA2 GLY A 36 19.110 3.750 -10.280 1.00 0.00 H new ATOM 0 HA3 GLY A 36 20.502 4.684 -9.767 1.00 0.00 H new ATOM 222 N ARG A 37 20.170 4.044 -7.362 1.00 0.00 N ATOM 223 CA ARG A 37 19.958 3.677 -5.934 1.00 0.00 C ATOM 224 C ARG A 37 19.285 4.841 -5.203 1.00 0.00 C ATOM 225 O ARG A 37 19.570 5.994 -5.457 1.00 0.00 O ATOM 226 CB ARG A 37 21.308 3.377 -5.279 1.00 0.00 C ATOM 227 CG ARG A 37 21.095 3.031 -3.803 1.00 0.00 C ATOM 228 CD ARG A 37 22.406 2.517 -3.205 1.00 0.00 C ATOM 229 NE ARG A 37 22.304 2.511 -1.718 1.00 0.00 N ATOM 230 CZ ARG A 37 23.386 2.482 -0.989 1.00 0.00 C ATOM 231 NH1 ARG A 37 24.558 2.460 -1.563 1.00 0.00 N ATOM 232 NH2 ARG A 37 23.296 2.477 0.312 1.00 0.00 N ATOM 0 H ARG A 37 21.144 4.175 -7.637 1.00 0.00 H new ATOM 0 HA ARG A 37 19.321 2.794 -5.876 1.00 0.00 H new ATOM 0 HB2 ARG A 37 21.796 2.548 -5.791 1.00 0.00 H new ATOM 0 HB3 ARG A 37 21.968 4.240 -5.369 1.00 0.00 H new ATOM 0 HG2 ARG A 37 20.755 3.911 -3.258 1.00 0.00 H new ATOM 0 HG3 ARG A 37 20.317 2.274 -3.705 1.00 0.00 H new ATOM 0 HD2 ARG A 37 22.615 1.512 -3.570 1.00 0.00 H new ATOM 0 HD3 ARG A 37 23.235 3.150 -3.521 1.00 0.00 H new ATOM 0 HE ARG A 37 21.388 2.530 -1.270 1.00 0.00 H new ATOM 0 HH11 ARG A 37 24.628 2.466 -2.581 1.00 0.00 H new ATOM 0 HH12 ARG A 37 25.404 2.437 -0.994 1.00 0.00 H new ATOM 0 HH21 ARG A 37 22.380 2.496 0.760 1.00 0.00 H new ATOM 0 HH22 ARG A 37 24.142 2.454 0.882 1.00 0.00 H new ATOM 246 N ILE A 38 18.391 4.547 -4.294 1.00 0.00 N ATOM 247 CA ILE A 38 17.693 5.634 -3.539 1.00 0.00 C ATOM 248 C ILE A 38 17.465 5.173 -2.101 1.00 0.00 C ATOM 249 O ILE A 38 16.533 4.452 -1.805 1.00 0.00 O ATOM 250 CB ILE A 38 16.347 5.936 -4.214 1.00 0.00 C ATOM 251 CG1 ILE A 38 16.608 6.303 -5.677 1.00 0.00 C ATOM 252 CG2 ILE A 38 15.641 7.107 -3.507 1.00 0.00 C ATOM 253 CD1 ILE A 38 15.320 6.816 -6.330 1.00 0.00 C ATOM 0 H ILE A 38 18.113 3.599 -4.041 1.00 0.00 H new ATOM 0 HA ILE A 38 18.301 6.539 -3.536 1.00 0.00 H new ATOM 0 HB ILE A 38 15.704 5.058 -4.152 1.00 0.00 H new ATOM 0 HG12 ILE A 38 17.384 7.067 -5.735 1.00 0.00 H new ATOM 0 HG13 ILE A 38 16.977 5.432 -6.218 1.00 0.00 H new ATOM 0 HG21 ILE A 38 14.689 7.308 -3.998 1.00 0.00 H new ATOM 0 HG22 ILE A 38 15.463 6.848 -2.463 1.00 0.00 H new ATOM 0 HG23 ILE A 38 16.270 7.996 -3.558 1.00 0.00 H new ATOM 0 HD11 ILE A 38 15.517 7.074 -7.370 1.00 0.00 H new ATOM 0 HD12 ILE A 38 14.556 6.040 -6.287 1.00 0.00 H new ATOM 0 HD13 ILE A 38 14.969 7.700 -5.797 1.00 0.00 H new ATOM 265 N ALA A 39 18.317 5.587 -1.204 1.00 0.00 N ATOM 266 CA ALA A 39 18.166 5.181 0.224 1.00 0.00 C ATOM 267 C ALA A 39 17.276 6.191 0.952 1.00 0.00 C ATOM 268 O ALA A 39 17.752 7.146 1.534 1.00 0.00 O ATOM 269 CB ALA A 39 19.545 5.145 0.884 1.00 0.00 C ATOM 0 H ALA A 39 19.115 6.192 -1.399 1.00 0.00 H new ATOM 0 HA ALA A 39 17.708 4.193 0.278 1.00 0.00 H new ATOM 0 HB1 ALA A 39 19.441 4.849 1.928 1.00 0.00 H new ATOM 0 HB2 ALA A 39 20.178 4.426 0.364 1.00 0.00 H new ATOM 0 HB3 ALA A 39 20.000 6.134 0.831 1.00 0.00 H new ATOM 275 N ALA A 40 15.984 5.988 0.920 1.00 0.00 N ATOM 276 CA ALA A 40 15.044 6.930 1.603 1.00 0.00 C ATOM 277 C ALA A 40 13.942 6.127 2.308 1.00 0.00 C ATOM 278 O ALA A 40 13.973 4.910 2.349 1.00 0.00 O ATOM 279 CB ALA A 40 14.431 7.873 0.557 1.00 0.00 C ATOM 0 H ALA A 40 15.535 5.204 0.446 1.00 0.00 H new ATOM 0 HA ALA A 40 15.579 7.521 2.346 1.00 0.00 H new ATOM 0 HB1 ALA A 40 13.744 8.563 1.047 1.00 0.00 H new ATOM 0 HB2 ALA A 40 15.224 8.437 0.067 1.00 0.00 H new ATOM 0 HB3 ALA A 40 13.889 7.289 -0.186 1.00 0.00 H new ATOM 285 N VAL A 41 12.978 6.802 2.873 1.00 0.00 N ATOM 286 CA VAL A 41 11.873 6.091 3.584 1.00 0.00 C ATOM 287 C VAL A 41 10.919 5.481 2.554 1.00 0.00 C ATOM 288 O VAL A 41 10.667 6.051 1.511 1.00 0.00 O ATOM 289 CB VAL A 41 11.108 7.087 4.463 1.00 0.00 C ATOM 290 CG1 VAL A 41 9.939 6.386 5.160 1.00 0.00 C ATOM 291 CG2 VAL A 41 12.049 7.667 5.523 1.00 0.00 C ATOM 0 H VAL A 41 12.907 7.819 2.874 1.00 0.00 H new ATOM 0 HA VAL A 41 12.289 5.301 4.209 1.00 0.00 H new ATOM 0 HB VAL A 41 10.723 7.888 3.832 1.00 0.00 H new ATOM 0 HG11 VAL A 41 9.403 7.103 5.782 1.00 0.00 H new ATOM 0 HG12 VAL A 41 9.261 5.977 4.411 1.00 0.00 H new ATOM 0 HG13 VAL A 41 10.320 5.578 5.785 1.00 0.00 H new ATOM 0 HG21 VAL A 41 11.503 8.375 6.146 1.00 0.00 H new ATOM 0 HG22 VAL A 41 12.438 6.861 6.145 1.00 0.00 H new ATOM 0 HG23 VAL A 41 12.877 8.179 5.033 1.00 0.00 H new ATOM 301 N HIS A 42 10.395 4.321 2.837 1.00 0.00 N ATOM 302 CA HIS A 42 9.462 3.656 1.878 1.00 0.00 C ATOM 303 C HIS A 42 8.488 2.757 2.647 1.00 0.00 C ATOM 304 O HIS A 42 8.858 2.093 3.595 1.00 0.00 O ATOM 305 CB HIS A 42 10.277 2.782 0.914 1.00 0.00 C ATOM 306 CG HIS A 42 10.830 3.610 -0.215 1.00 0.00 C ATOM 307 ND1 HIS A 42 11.851 4.525 -0.271 1.00 0.00 N flip ATOM 308 CD2 HIS A 42 10.328 3.523 -1.503 1.00 0.00 C flip ATOM 309 CE1 HIS A 42 11.983 4.999 -1.572 1.00 0.00 C flip ATOM 310 NE2 HIS A 42 11.042 4.362 -2.273 1.00 0.00 N flip ATOM 0 H HIS A 42 10.573 3.800 3.696 1.00 0.00 H new ATOM 0 HA HIS A 42 8.907 4.415 1.327 1.00 0.00 H new ATOM 0 HB2 HIS A 42 11.093 2.301 1.453 1.00 0.00 H new ATOM 0 HB3 HIS A 42 9.647 1.987 0.514 1.00 0.00 H new ATOM 0 HD2 HIS A 42 9.512 2.895 -1.829 1.00 0.00 H new ATOM 0 HE1 HIS A 42 12.694 5.726 -1.937 1.00 0.00 H new ATOM 0 HE2 HIS A 42 10.884 4.496 -3.272 1.00 0.00 H new ATOM 318 N ASN A 43 7.254 2.705 2.225 1.00 0.00 N ATOM 319 CA ASN A 43 6.272 1.821 2.909 1.00 0.00 C ATOM 320 C ASN A 43 6.463 0.397 2.385 1.00 0.00 C ATOM 321 O ASN A 43 5.948 0.035 1.346 1.00 0.00 O ATOM 322 CB ASN A 43 4.855 2.295 2.593 1.00 0.00 C ATOM 323 CG ASN A 43 4.592 3.617 3.312 1.00 0.00 C ATOM 324 OD1 ASN A 43 5.383 4.046 4.128 1.00 0.00 O ATOM 325 ND2 ASN A 43 3.507 4.286 3.042 1.00 0.00 N ATOM 0 H ASN A 43 6.885 3.237 1.437 1.00 0.00 H new ATOM 0 HA ASN A 43 6.425 1.849 3.988 1.00 0.00 H new ATOM 0 HB2 ASN A 43 4.733 2.423 1.517 1.00 0.00 H new ATOM 0 HB3 ASN A 43 4.130 1.545 2.909 1.00 0.00 H new ATOM 0 HD21 ASN A 43 3.322 5.170 3.516 1.00 0.00 H new ATOM 0 HD22 ASN A 43 2.843 3.926 2.357 1.00 0.00 H new ATOM 332 N VAL A 44 7.211 -0.412 3.087 1.00 0.00 N ATOM 333 CA VAL A 44 7.448 -1.815 2.617 1.00 0.00 C ATOM 334 C VAL A 44 6.357 -2.739 3.213 1.00 0.00 C ATOM 335 O VAL A 44 6.164 -2.752 4.413 1.00 0.00 O ATOM 336 CB VAL A 44 8.856 -2.263 3.064 1.00 0.00 C ATOM 337 CG1 VAL A 44 8.868 -2.642 4.544 1.00 0.00 C ATOM 338 CG2 VAL A 44 9.304 -3.473 2.241 1.00 0.00 C ATOM 0 H VAL A 44 7.669 -0.166 3.965 1.00 0.00 H new ATOM 0 HA VAL A 44 7.393 -1.870 1.530 1.00 0.00 H new ATOM 0 HB VAL A 44 9.538 -1.428 2.906 1.00 0.00 H new ATOM 0 HG11 VAL A 44 9.872 -2.954 4.832 1.00 0.00 H new ATOM 0 HG12 VAL A 44 8.570 -1.781 5.142 1.00 0.00 H new ATOM 0 HG13 VAL A 44 8.171 -3.462 4.715 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.298 -3.783 2.562 1.00 0.00 H new ATOM 0 HG22 VAL A 44 8.602 -4.294 2.389 1.00 0.00 H new ATOM 0 HG23 VAL A 44 9.331 -3.205 1.185 1.00 0.00 H new ATOM 348 N PRO A 45 5.628 -3.499 2.404 1.00 0.00 N ATOM 349 CA PRO A 45 4.548 -4.400 2.924 1.00 0.00 C ATOM 350 C PRO A 45 4.984 -5.259 4.116 1.00 0.00 C ATOM 351 O PRO A 45 6.085 -5.768 4.167 1.00 0.00 O ATOM 352 CB PRO A 45 4.210 -5.296 1.726 1.00 0.00 C ATOM 353 CG PRO A 45 4.538 -4.473 0.526 1.00 0.00 C ATOM 354 CD PRO A 45 5.727 -3.590 0.923 1.00 0.00 C ATOM 0 HA PRO A 45 3.707 -3.817 3.299 1.00 0.00 H new ATOM 0 HB2 PRO A 45 4.793 -6.217 1.745 1.00 0.00 H new ATOM 0 HB3 PRO A 45 3.159 -5.584 1.732 1.00 0.00 H new ATOM 0 HG2 PRO A 45 4.791 -5.107 -0.323 1.00 0.00 H new ATOM 0 HG3 PRO A 45 3.685 -3.865 0.226 1.00 0.00 H new ATOM 0 HD2 PRO A 45 6.674 -4.032 0.613 1.00 0.00 H new ATOM 0 HD3 PRO A 45 5.667 -2.606 0.458 1.00 0.00 H new ATOM 362 N LEU A 46 4.108 -5.434 5.069 1.00 0.00 N ATOM 363 CA LEU A 46 4.444 -6.273 6.251 1.00 0.00 C ATOM 364 C LEU A 46 4.606 -7.726 5.811 1.00 0.00 C ATOM 365 O LEU A 46 5.374 -8.484 6.370 1.00 0.00 O ATOM 366 CB LEU A 46 3.294 -6.221 7.259 1.00 0.00 C ATOM 367 CG LEU A 46 3.093 -4.788 7.805 1.00 0.00 C ATOM 368 CD1 LEU A 46 1.611 -4.561 8.088 1.00 0.00 C ATOM 369 CD2 LEU A 46 3.879 -4.581 9.107 1.00 0.00 C ATOM 0 H LEU A 46 3.172 -5.030 5.078 1.00 0.00 H new ATOM 0 HA LEU A 46 5.365 -5.899 6.699 1.00 0.00 H new ATOM 0 HB2 LEU A 46 2.375 -6.564 6.784 1.00 0.00 H new ATOM 0 HB3 LEU A 46 3.500 -6.902 8.085 1.00 0.00 H new ATOM 0 HG LEU A 46 3.455 -4.082 7.057 1.00 0.00 H new ATOM 0 HD11 LEU A 46 1.465 -3.552 8.473 1.00 0.00 H new ATOM 0 HD12 LEU A 46 1.042 -4.684 7.167 1.00 0.00 H new ATOM 0 HD13 LEU A 46 1.267 -5.285 8.827 1.00 0.00 H new ATOM 0 HD21 LEU A 46 3.721 -3.566 9.470 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.534 -5.293 9.857 1.00 0.00 H new ATOM 0 HD23 LEU A 46 4.941 -4.738 8.920 1.00 0.00 H new ATOM 381 N SER A 47 3.844 -8.119 4.836 1.00 0.00 N ATOM 382 CA SER A 47 3.879 -9.531 4.357 1.00 0.00 C ATOM 383 C SER A 47 5.264 -9.929 3.827 1.00 0.00 C ATOM 384 O SER A 47 5.613 -11.093 3.847 1.00 0.00 O ATOM 385 CB SER A 47 2.849 -9.693 3.239 1.00 0.00 C ATOM 386 OG SER A 47 2.996 -8.635 2.302 1.00 0.00 O ATOM 0 H SER A 47 3.187 -7.516 4.341 1.00 0.00 H new ATOM 0 HA SER A 47 3.650 -10.181 5.201 1.00 0.00 H new ATOM 0 HB2 SER A 47 2.984 -10.654 2.743 1.00 0.00 H new ATOM 0 HB3 SER A 47 1.841 -9.687 3.655 1.00 0.00 H new ATOM 0 HG SER A 47 2.337 -8.740 1.584 1.00 0.00 H new ATOM 392 N VAL A 48 6.047 -9.000 3.330 1.00 0.00 N ATOM 393 CA VAL A 48 7.394 -9.370 2.774 1.00 0.00 C ATOM 394 C VAL A 48 8.524 -9.019 3.753 1.00 0.00 C ATOM 395 O VAL A 48 9.654 -8.824 3.352 1.00 0.00 O ATOM 396 CB VAL A 48 7.618 -8.643 1.439 1.00 0.00 C ATOM 397 CG1 VAL A 48 6.400 -8.844 0.534 1.00 0.00 C ATOM 398 CG2 VAL A 48 7.841 -7.143 1.666 1.00 0.00 C ATOM 0 H VAL A 48 5.816 -8.008 3.284 1.00 0.00 H new ATOM 0 HA VAL A 48 7.410 -10.448 2.616 1.00 0.00 H new ATOM 0 HB VAL A 48 8.506 -9.060 0.964 1.00 0.00 H new ATOM 0 HG11 VAL A 48 6.561 -8.328 -0.412 1.00 0.00 H new ATOM 0 HG12 VAL A 48 6.257 -9.908 0.347 1.00 0.00 H new ATOM 0 HG13 VAL A 48 5.513 -8.439 1.022 1.00 0.00 H new ATOM 0 HG21 VAL A 48 7.997 -6.649 0.707 1.00 0.00 H new ATOM 0 HG22 VAL A 48 6.966 -6.715 2.156 1.00 0.00 H new ATOM 0 HG23 VAL A 48 8.718 -6.997 2.297 1.00 0.00 H new ATOM 408 N LEU A 49 8.250 -8.963 5.033 1.00 0.00 N ATOM 409 CA LEU A 49 9.335 -8.655 6.013 1.00 0.00 C ATOM 410 C LEU A 49 9.957 -9.970 6.484 1.00 0.00 C ATOM 411 O LEU A 49 9.270 -10.875 6.913 1.00 0.00 O ATOM 412 CB LEU A 49 8.759 -7.927 7.232 1.00 0.00 C ATOM 413 CG LEU A 49 8.286 -6.513 6.864 1.00 0.00 C ATOM 414 CD1 LEU A 49 7.722 -5.852 8.127 1.00 0.00 C ATOM 415 CD2 LEU A 49 9.455 -5.671 6.318 1.00 0.00 C ATOM 0 H LEU A 49 7.327 -9.116 5.439 1.00 0.00 H new ATOM 0 HA LEU A 49 10.081 -8.021 5.533 1.00 0.00 H new ATOM 0 HB2 LEU A 49 7.924 -8.498 7.639 1.00 0.00 H new ATOM 0 HB3 LEU A 49 9.516 -7.868 8.014 1.00 0.00 H new ATOM 0 HG LEU A 49 7.522 -6.575 6.089 1.00 0.00 H new ATOM 0 HD11 LEU A 49 7.380 -4.845 7.889 1.00 0.00 H new ATOM 0 HD12 LEU A 49 6.885 -6.441 8.503 1.00 0.00 H new ATOM 0 HD13 LEU A 49 8.500 -5.800 8.889 1.00 0.00 H new ATOM 0 HD21 LEU A 49 9.097 -4.673 6.064 1.00 0.00 H new ATOM 0 HD22 LEU A 49 10.234 -5.595 7.077 1.00 0.00 H new ATOM 0 HD23 LEU A 49 9.862 -6.148 5.427 1.00 0.00 H new ATOM 427 N ILE A 50 11.253 -10.086 6.399 1.00 0.00 N ATOM 428 CA ILE A 50 11.931 -11.343 6.830 1.00 0.00 C ATOM 429 C ILE A 50 12.449 -11.205 8.261 1.00 0.00 C ATOM 430 O ILE A 50 13.280 -10.367 8.560 1.00 0.00 O ATOM 431 CB ILE A 50 13.101 -11.606 5.894 1.00 0.00 C ATOM 432 CG1 ILE A 50 12.605 -11.481 4.454 1.00 0.00 C ATOM 433 CG2 ILE A 50 13.658 -13.009 6.137 1.00 0.00 C ATOM 434 CD1 ILE A 50 13.702 -11.918 3.487 1.00 0.00 C ATOM 0 H ILE A 50 11.877 -9.360 6.047 1.00 0.00 H new ATOM 0 HA ILE A 50 11.221 -12.169 6.795 1.00 0.00 H new ATOM 0 HB ILE A 50 13.896 -10.883 6.077 1.00 0.00 H new ATOM 0 HG12 ILE A 50 11.716 -12.096 4.312 1.00 0.00 H new ATOM 0 HG13 ILE A 50 12.316 -10.450 4.248 1.00 0.00 H new ATOM 0 HG21 ILE A 50 14.495 -13.190 5.463 1.00 0.00 H new ATOM 0 HG22 ILE A 50 13.999 -13.092 7.169 1.00 0.00 H new ATOM 0 HG23 ILE A 50 12.878 -13.747 5.952 1.00 0.00 H new ATOM 0 HD11 ILE A 50 13.342 -11.826 2.462 1.00 0.00 H new ATOM 0 HD12 ILE A 50 14.579 -11.285 3.621 1.00 0.00 H new ATOM 0 HD13 ILE A 50 13.970 -12.956 3.686 1.00 0.00 H new ATOM 446 N ARG A 51 11.965 -12.040 9.142 1.00 0.00 N ATOM 447 CA ARG A 51 12.411 -12.005 10.567 1.00 0.00 C ATOM 448 C ARG A 51 12.711 -13.436 11.041 1.00 0.00 C ATOM 449 O ARG A 51 11.823 -14.139 11.481 1.00 0.00 O ATOM 450 CB ARG A 51 11.274 -11.435 11.419 1.00 0.00 C ATOM 451 CG ARG A 51 11.213 -9.923 11.236 1.00 0.00 C ATOM 452 CD ARG A 51 10.120 -9.341 12.134 1.00 0.00 C ATOM 453 NE ARG A 51 10.196 -7.853 12.109 1.00 0.00 N ATOM 454 CZ ARG A 51 11.092 -7.233 12.826 1.00 0.00 C ATOM 455 NH1 ARG A 51 11.922 -7.915 13.566 1.00 0.00 N ATOM 456 NH2 ARG A 51 11.158 -5.929 12.804 1.00 0.00 N ATOM 0 H ARG A 51 11.269 -12.756 8.932 1.00 0.00 H new ATOM 0 HA ARG A 51 13.306 -11.390 10.661 1.00 0.00 H new ATOM 0 HB2 ARG A 51 10.325 -11.886 11.128 1.00 0.00 H new ATOM 0 HB3 ARG A 51 11.434 -11.679 12.469 1.00 0.00 H new ATOM 0 HG2 ARG A 51 12.177 -9.477 11.483 1.00 0.00 H new ATOM 0 HG3 ARG A 51 11.008 -9.681 10.193 1.00 0.00 H new ATOM 0 HD2 ARG A 51 9.139 -9.671 11.792 1.00 0.00 H new ATOM 0 HD3 ARG A 51 10.241 -9.705 13.154 1.00 0.00 H new ATOM 0 HE ARG A 51 9.547 -7.319 11.531 1.00 0.00 H new ATOM 0 HH11 ARG A 51 11.870 -8.934 13.584 1.00 0.00 H new ATOM 0 HH12 ARG A 51 12.623 -7.430 14.127 1.00 0.00 H new ATOM 0 HH21 ARG A 51 10.509 -5.395 12.226 1.00 0.00 H new ATOM 0 HH22 ARG A 51 11.859 -5.444 13.365 1.00 0.00 H new ATOM 470 N PRO A 52 13.950 -13.864 10.982 1.00 0.00 N ATOM 471 CA PRO A 52 14.360 -15.215 11.438 1.00 0.00 C ATOM 472 C PRO A 52 14.940 -15.182 12.855 1.00 0.00 C ATOM 473 O PRO A 52 15.780 -15.986 13.209 1.00 0.00 O ATOM 474 CB PRO A 52 15.451 -15.553 10.434 1.00 0.00 C ATOM 475 CG PRO A 52 16.164 -14.246 10.224 1.00 0.00 C ATOM 476 CD PRO A 52 15.116 -13.132 10.451 1.00 0.00 C ATOM 0 HA PRO A 52 13.537 -15.928 11.480 1.00 0.00 H new ATOM 0 HB2 PRO A 52 16.125 -16.319 10.818 1.00 0.00 H new ATOM 0 HB3 PRO A 52 15.033 -15.935 9.503 1.00 0.00 H new ATOM 0 HG2 PRO A 52 16.997 -14.142 10.920 1.00 0.00 H new ATOM 0 HG3 PRO A 52 16.580 -14.188 9.218 1.00 0.00 H new ATOM 0 HD2 PRO A 52 15.474 -12.381 11.155 1.00 0.00 H new ATOM 0 HD3 PRO A 52 14.876 -12.611 9.524 1.00 0.00 H new ATOM 484 N LEU A 53 14.522 -14.238 13.659 1.00 0.00 N ATOM 485 CA LEU A 53 15.073 -14.126 15.043 1.00 0.00 C ATOM 486 C LEU A 53 13.953 -13.711 16.014 1.00 0.00 C ATOM 487 O LEU A 53 13.753 -12.539 16.266 1.00 0.00 O ATOM 488 CB LEU A 53 16.173 -13.052 15.015 1.00 0.00 C ATOM 489 CG LEU A 53 17.140 -13.203 16.202 1.00 0.00 C ATOM 490 CD1 LEU A 53 17.905 -14.543 16.122 1.00 0.00 C ATOM 491 CD2 LEU A 53 18.138 -12.038 16.155 1.00 0.00 C ATOM 0 H LEU A 53 13.821 -13.538 13.416 1.00 0.00 H new ATOM 0 HA LEU A 53 15.480 -15.080 15.378 1.00 0.00 H new ATOM 0 HB2 LEU A 53 16.729 -13.124 14.080 1.00 0.00 H new ATOM 0 HB3 LEU A 53 15.717 -12.062 15.040 1.00 0.00 H new ATOM 0 HG LEU A 53 16.576 -13.192 17.134 1.00 0.00 H new ATOM 0 HD11 LEU A 53 18.582 -14.627 16.972 1.00 0.00 H new ATOM 0 HD12 LEU A 53 17.194 -15.369 16.142 1.00 0.00 H new ATOM 0 HD13 LEU A 53 18.479 -14.580 15.196 1.00 0.00 H new ATOM 0 HD21 LEU A 53 18.836 -12.123 16.988 1.00 0.00 H new ATOM 0 HD22 LEU A 53 18.689 -12.069 15.215 1.00 0.00 H new ATOM 0 HD23 LEU A 53 17.599 -11.094 16.228 1.00 0.00 H new ATOM 503 N PRO A 54 13.227 -14.661 16.558 1.00 0.00 N ATOM 504 CA PRO A 54 12.114 -14.375 17.515 1.00 0.00 C ATOM 505 C PRO A 54 12.528 -13.386 18.612 1.00 0.00 C ATOM 506 O PRO A 54 13.690 -13.064 18.764 1.00 0.00 O ATOM 507 CB PRO A 54 11.790 -15.751 18.108 1.00 0.00 C ATOM 508 CG PRO A 54 12.162 -16.719 17.032 1.00 0.00 C ATOM 509 CD PRO A 54 13.377 -16.112 16.324 1.00 0.00 C ATOM 0 HA PRO A 54 11.262 -13.904 17.025 1.00 0.00 H new ATOM 0 HB2 PRO A 54 12.358 -15.934 19.020 1.00 0.00 H new ATOM 0 HB3 PRO A 54 10.735 -15.833 18.368 1.00 0.00 H new ATOM 0 HG2 PRO A 54 12.402 -17.696 17.451 1.00 0.00 H new ATOM 0 HG3 PRO A 54 11.336 -16.865 16.335 1.00 0.00 H new ATOM 0 HD2 PRO A 54 14.312 -16.490 16.737 1.00 0.00 H new ATOM 0 HD3 PRO A 54 13.380 -16.348 15.260 1.00 0.00 H new ATOM 517 N SER A 55 11.584 -12.898 19.374 1.00 0.00 N ATOM 518 CA SER A 55 11.925 -11.928 20.455 1.00 0.00 C ATOM 519 C SER A 55 10.837 -11.946 21.530 1.00 0.00 C ATOM 520 O SER A 55 9.751 -12.451 21.326 1.00 0.00 O ATOM 521 CB SER A 55 12.022 -10.519 19.858 1.00 0.00 C ATOM 522 OG SER A 55 13.293 -10.350 19.248 1.00 0.00 O ATOM 0 H SER A 55 10.594 -13.129 19.294 1.00 0.00 H new ATOM 0 HA SER A 55 12.879 -12.208 20.902 1.00 0.00 H new ATOM 0 HB2 SER A 55 11.231 -10.369 19.123 1.00 0.00 H new ATOM 0 HB3 SER A 55 11.879 -9.771 20.638 1.00 0.00 H new ATOM 0 HG SER A 55 13.668 -11.228 19.026 1.00 0.00 H new ATOM 528 N VAL A 56 11.124 -11.377 22.673 1.00 0.00 N ATOM 529 CA VAL A 56 10.115 -11.330 23.778 1.00 0.00 C ATOM 530 C VAL A 56 9.409 -9.969 23.737 1.00 0.00 C ATOM 531 O VAL A 56 10.027 -8.933 23.882 1.00 0.00 O ATOM 532 CB VAL A 56 10.816 -11.547 25.140 1.00 0.00 C ATOM 533 CG1 VAL A 56 11.465 -10.249 25.649 1.00 0.00 C ATOM 534 CG2 VAL A 56 9.790 -12.027 26.171 1.00 0.00 C ATOM 0 H VAL A 56 12.019 -10.940 22.891 1.00 0.00 H new ATOM 0 HA VAL A 56 9.377 -12.122 23.650 1.00 0.00 H new ATOM 0 HB VAL A 56 11.597 -12.295 25.002 1.00 0.00 H new ATOM 0 HG11 VAL A 56 11.949 -10.436 26.608 1.00 0.00 H new ATOM 0 HG12 VAL A 56 12.208 -9.907 24.928 1.00 0.00 H new ATOM 0 HG13 VAL A 56 10.699 -9.483 25.772 1.00 0.00 H new ATOM 0 HG21 VAL A 56 10.283 -12.180 27.131 1.00 0.00 H new ATOM 0 HG22 VAL A 56 9.007 -11.277 26.281 1.00 0.00 H new ATOM 0 HG23 VAL A 56 9.349 -12.966 25.836 1.00 0.00 H new ATOM 544 N LEU A 57 8.120 -9.964 23.516 1.00 0.00 N ATOM 545 CA LEU A 57 7.368 -8.674 23.440 1.00 0.00 C ATOM 546 C LEU A 57 6.640 -8.393 24.747 1.00 0.00 C ATOM 547 O LEU A 57 6.157 -9.281 25.422 1.00 0.00 O ATOM 548 CB LEU A 57 6.332 -8.742 22.325 1.00 0.00 C ATOM 549 CG LEU A 57 7.017 -9.032 20.985 1.00 0.00 C ATOM 550 CD1 LEU A 57 5.940 -9.204 19.908 1.00 0.00 C ATOM 551 CD2 LEU A 57 7.949 -7.868 20.609 1.00 0.00 C ATOM 0 H LEU A 57 7.553 -10.801 23.384 1.00 0.00 H new ATOM 0 HA LEU A 57 8.088 -7.879 23.245 1.00 0.00 H new ATOM 0 HB2 LEU A 57 5.601 -9.520 22.544 1.00 0.00 H new ATOM 0 HB3 LEU A 57 5.787 -7.800 22.267 1.00 0.00 H new ATOM 0 HG LEU A 57 7.611 -9.943 21.065 1.00 0.00 H new ATOM 0 HD11 LEU A 57 6.414 -9.411 18.949 1.00 0.00 H new ATOM 0 HD12 LEU A 57 5.287 -10.034 20.176 1.00 0.00 H new ATOM 0 HD13 LEU A 57 5.352 -8.289 19.832 1.00 0.00 H new ATOM 0 HD21 LEU A 57 8.432 -8.082 19.656 1.00 0.00 H new ATOM 0 HD22 LEU A 57 7.368 -6.950 20.524 1.00 0.00 H new ATOM 0 HD23 LEU A 57 8.709 -7.746 21.381 1.00 0.00 H new ATOM 563 N ASP A 58 6.548 -7.142 25.083 1.00 0.00 N ATOM 564 CA ASP A 58 5.843 -6.716 26.320 1.00 0.00 C ATOM 565 C ASP A 58 4.445 -6.200 25.910 1.00 0.00 C ATOM 566 O ASP A 58 4.331 -5.441 24.968 1.00 0.00 O ATOM 567 CB ASP A 58 6.668 -5.592 26.954 1.00 0.00 C ATOM 568 CG ASP A 58 5.825 -4.808 27.963 1.00 0.00 C ATOM 569 OD1 ASP A 58 4.873 -4.177 27.542 1.00 0.00 O ATOM 570 OD2 ASP A 58 6.148 -4.854 29.138 1.00 0.00 O ATOM 0 H ASP A 58 6.942 -6.376 24.538 1.00 0.00 H new ATOM 0 HA ASP A 58 5.730 -7.532 27.034 1.00 0.00 H new ATOM 0 HB2 ASP A 58 7.543 -6.012 27.451 1.00 0.00 H new ATOM 0 HB3 ASP A 58 7.034 -4.920 26.178 1.00 0.00 H new ATOM 575 N PRO A 59 3.386 -6.609 26.576 1.00 0.00 N ATOM 576 CA PRO A 59 2.002 -6.168 26.213 1.00 0.00 C ATOM 577 C PRO A 59 1.692 -4.728 26.649 1.00 0.00 C ATOM 578 O PRO A 59 0.748 -4.122 26.182 1.00 0.00 O ATOM 579 CB PRO A 59 1.109 -7.167 26.962 1.00 0.00 C ATOM 580 CG PRO A 59 1.900 -7.543 28.173 1.00 0.00 C ATOM 581 CD PRO A 59 3.371 -7.526 27.738 1.00 0.00 C ATOM 0 HA PRO A 59 1.852 -6.160 25.133 1.00 0.00 H new ATOM 0 HB2 PRO A 59 0.154 -6.718 27.236 1.00 0.00 H new ATOM 0 HB3 PRO A 59 0.887 -8.039 26.347 1.00 0.00 H new ATOM 0 HG2 PRO A 59 1.726 -6.840 28.987 1.00 0.00 H new ATOM 0 HG3 PRO A 59 1.612 -8.529 28.537 1.00 0.00 H new ATOM 0 HD2 PRO A 59 4.020 -7.169 28.537 1.00 0.00 H new ATOM 0 HD3 PRO A 59 3.719 -8.522 27.466 1.00 0.00 H new ATOM 589 N ALA A 60 2.466 -4.179 27.544 1.00 0.00 N ATOM 590 CA ALA A 60 2.202 -2.786 28.011 1.00 0.00 C ATOM 591 C ALA A 60 2.895 -1.782 27.084 1.00 0.00 C ATOM 592 O ALA A 60 2.336 -0.764 26.726 1.00 0.00 O ATOM 593 CB ALA A 60 2.736 -2.631 29.436 1.00 0.00 C ATOM 0 H ALA A 60 3.271 -4.634 27.974 1.00 0.00 H new ATOM 0 HA ALA A 60 1.129 -2.592 27.996 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.548 -1.616 29.787 1.00 0.00 H new ATOM 0 HB2 ALA A 60 2.233 -3.341 30.092 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.808 -2.825 29.446 1.00 0.00 H new ATOM 599 N LYS A 61 4.113 -2.054 26.705 1.00 0.00 N ATOM 600 CA LYS A 61 4.851 -1.116 25.818 1.00 0.00 C ATOM 601 C LYS A 61 4.234 -1.137 24.409 1.00 0.00 C ATOM 602 O LYS A 61 4.237 -0.143 23.710 1.00 0.00 O ATOM 603 CB LYS A 61 6.342 -1.534 25.774 1.00 0.00 C ATOM 604 CG LYS A 61 7.244 -0.308 25.940 1.00 0.00 C ATOM 605 CD LYS A 61 8.710 -0.734 25.846 1.00 0.00 C ATOM 606 CE LYS A 61 9.609 0.445 26.224 1.00 0.00 C ATOM 607 NZ LYS A 61 9.067 1.696 25.622 1.00 0.00 N ATOM 0 H LYS A 61 4.630 -2.891 26.974 1.00 0.00 H new ATOM 0 HA LYS A 61 4.779 -0.099 26.205 1.00 0.00 H new ATOM 0 HB2 LYS A 61 6.548 -2.255 26.565 1.00 0.00 H new ATOM 0 HB3 LYS A 61 6.560 -2.029 24.827 1.00 0.00 H new ATOM 0 HG2 LYS A 61 7.019 0.429 25.169 1.00 0.00 H new ATOM 0 HG3 LYS A 61 7.054 0.168 26.902 1.00 0.00 H new ATOM 0 HD2 LYS A 61 8.898 -1.577 26.511 1.00 0.00 H new ATOM 0 HD3 LYS A 61 8.938 -1.069 24.834 1.00 0.00 H new ATOM 0 HE2 LYS A 61 9.661 0.543 27.308 1.00 0.00 H new ATOM 0 HE3 LYS A 61 10.625 0.269 25.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 9.818 2.414 25.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 8.723 1.498 24.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 8.282 2.050 26.205 1.00 0.00 H new ATOM 621 N VAL A 62 3.702 -2.254 23.986 1.00 0.00 N ATOM 622 CA VAL A 62 3.091 -2.313 22.627 1.00 0.00 C ATOM 623 C VAL A 62 1.836 -1.439 22.607 1.00 0.00 C ATOM 624 O VAL A 62 1.662 -0.605 21.741 1.00 0.00 O ATOM 625 CB VAL A 62 2.718 -3.764 22.288 1.00 0.00 C ATOM 626 CG1 VAL A 62 1.856 -3.795 21.021 1.00 0.00 C ATOM 627 CG2 VAL A 62 3.993 -4.580 22.054 1.00 0.00 C ATOM 0 H VAL A 62 3.665 -3.122 24.520 1.00 0.00 H new ATOM 0 HA VAL A 62 3.804 -1.949 21.888 1.00 0.00 H new ATOM 0 HB VAL A 62 2.157 -4.193 23.118 1.00 0.00 H new ATOM 0 HG11 VAL A 62 1.594 -4.826 20.784 1.00 0.00 H new ATOM 0 HG12 VAL A 62 0.946 -3.218 21.186 1.00 0.00 H new ATOM 0 HG13 VAL A 62 2.414 -3.363 20.190 1.00 0.00 H new ATOM 0 HG21 VAL A 62 3.727 -5.609 21.814 1.00 0.00 H new ATOM 0 HG22 VAL A 62 4.555 -4.148 21.226 1.00 0.00 H new ATOM 0 HG23 VAL A 62 4.605 -4.565 22.956 1.00 0.00 H new ATOM 637 N GLN A 63 0.959 -1.623 23.555 1.00 0.00 N ATOM 638 CA GLN A 63 -0.282 -0.802 23.583 1.00 0.00 C ATOM 639 C GLN A 63 0.091 0.678 23.477 1.00 0.00 C ATOM 640 O GLN A 63 -0.486 1.421 22.707 1.00 0.00 O ATOM 641 CB GLN A 63 -1.031 -1.049 24.897 1.00 0.00 C ATOM 642 CG GLN A 63 -1.606 -2.476 24.915 1.00 0.00 C ATOM 643 CD GLN A 63 -2.954 -2.515 24.181 1.00 0.00 C ATOM 644 OE1 GLN A 63 -3.082 -3.154 23.155 1.00 0.00 O ATOM 645 NE2 GLN A 63 -3.970 -1.853 24.668 1.00 0.00 N ATOM 0 H GLN A 63 1.048 -2.304 24.309 1.00 0.00 H new ATOM 0 HA GLN A 63 -0.923 -1.079 22.746 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -0.356 -0.909 25.742 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -1.836 -0.322 25.009 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -0.906 -3.164 24.441 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -1.734 -2.811 25.944 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -3.864 -1.316 25.529 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -4.869 -1.873 24.187 1.00 0.00 H new ATOM 654 N SER A 64 1.056 1.111 24.241 1.00 0.00 N ATOM 655 CA SER A 64 1.470 2.541 24.182 1.00 0.00 C ATOM 656 C SER A 64 1.787 2.917 22.732 1.00 0.00 C ATOM 657 O SER A 64 1.438 3.984 22.267 1.00 0.00 O ATOM 658 CB SER A 64 2.716 2.749 25.046 1.00 0.00 C ATOM 659 OG SER A 64 3.334 3.979 24.698 1.00 0.00 O ATOM 0 H SER A 64 1.576 0.536 24.904 1.00 0.00 H new ATOM 0 HA SER A 64 0.662 3.170 24.555 1.00 0.00 H new ATOM 0 HB2 SER A 64 2.443 2.753 26.101 1.00 0.00 H new ATOM 0 HB3 SER A 64 3.414 1.925 24.900 1.00 0.00 H new ATOM 0 HG SER A 64 4.202 3.802 24.278 1.00 0.00 H new ATOM 665 N LEU A 65 2.440 2.045 22.013 1.00 0.00 N ATOM 666 CA LEU A 65 2.772 2.345 20.597 1.00 0.00 C ATOM 667 C LEU A 65 1.475 2.346 19.782 1.00 0.00 C ATOM 668 O LEU A 65 1.218 3.241 19.002 1.00 0.00 O ATOM 669 CB LEU A 65 3.738 1.261 20.084 1.00 0.00 C ATOM 670 CG LEU A 65 5.202 1.696 20.323 1.00 0.00 C ATOM 671 CD1 LEU A 65 6.101 0.460 20.413 1.00 0.00 C ATOM 672 CD2 LEU A 65 5.680 2.585 19.169 1.00 0.00 C ATOM 0 H LEU A 65 2.757 1.136 22.349 1.00 0.00 H new ATOM 0 HA LEU A 65 3.249 3.320 20.502 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.543 0.318 20.595 1.00 0.00 H new ATOM 0 HB3 LEU A 65 3.571 1.088 19.021 1.00 0.00 H new ATOM 0 HG LEU A 65 5.255 2.256 21.257 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.132 0.771 20.581 1.00 0.00 H new ATOM 0 HD12 LEU A 65 5.772 -0.170 21.240 1.00 0.00 H new ATOM 0 HD13 LEU A 65 6.040 -0.103 19.482 1.00 0.00 H new ATOM 0 HD21 LEU A 65 6.712 2.887 19.346 1.00 0.00 H new ATOM 0 HD22 LEU A 65 5.619 2.030 18.233 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.049 3.471 19.107 1.00 0.00 H new ATOM 684 N VAL A 66 0.648 1.357 19.975 1.00 0.00 N ATOM 685 CA VAL A 66 -0.640 1.302 19.237 1.00 0.00 C ATOM 686 C VAL A 66 -1.400 2.607 19.494 1.00 0.00 C ATOM 687 O VAL A 66 -2.153 3.076 18.664 1.00 0.00 O ATOM 688 CB VAL A 66 -1.444 0.106 19.766 1.00 0.00 C ATOM 689 CG1 VAL A 66 -2.910 0.210 19.342 1.00 0.00 C ATOM 690 CG2 VAL A 66 -0.846 -1.192 19.218 1.00 0.00 C ATOM 0 H VAL A 66 0.812 0.581 20.616 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.478 1.185 18.165 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.395 0.107 20.855 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -3.462 -0.647 19.727 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.340 1.128 19.742 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.974 0.224 18.254 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.416 -2.042 19.593 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.887 -1.180 18.129 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.191 -1.280 19.541 1.00 0.00 H new ATOM 700 N ASP A 67 -1.202 3.193 20.643 1.00 0.00 N ATOM 701 CA ASP A 67 -1.898 4.464 20.975 1.00 0.00 C ATOM 702 C ASP A 67 -1.240 5.630 20.226 1.00 0.00 C ATOM 703 O ASP A 67 -1.901 6.559 19.809 1.00 0.00 O ATOM 704 CB ASP A 67 -1.797 4.701 22.486 1.00 0.00 C ATOM 705 CG ASP A 67 -2.846 3.856 23.215 1.00 0.00 C ATOM 706 OD1 ASP A 67 -2.750 2.642 23.150 1.00 0.00 O ATOM 707 OD2 ASP A 67 -3.726 4.439 23.826 1.00 0.00 O ATOM 0 H ASP A 67 -0.581 2.840 21.372 1.00 0.00 H new ATOM 0 HA ASP A 67 -2.944 4.399 20.677 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -0.799 4.441 22.838 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -1.949 5.757 22.709 1.00 0.00 H new ATOM 712 N THR A 68 0.055 5.595 20.058 1.00 0.00 N ATOM 713 CA THR A 68 0.739 6.708 19.345 1.00 0.00 C ATOM 714 C THR A 68 0.328 6.693 17.873 1.00 0.00 C ATOM 715 O THR A 68 -0.011 7.709 17.299 1.00 0.00 O ATOM 716 CB THR A 68 2.256 6.530 19.459 1.00 0.00 C ATOM 717 OG1 THR A 68 2.588 6.155 20.788 1.00 0.00 O ATOM 718 CG2 THR A 68 2.953 7.844 19.110 1.00 0.00 C ATOM 0 H THR A 68 0.666 4.845 20.383 1.00 0.00 H new ATOM 0 HA THR A 68 0.454 7.661 19.791 1.00 0.00 H new ATOM 0 HB THR A 68 2.584 5.753 18.768 1.00 0.00 H new ATOM 0 HG1 THR A 68 2.145 6.760 21.419 1.00 0.00 H new ATOM 0 HG21 THR A 68 4.032 7.716 19.191 1.00 0.00 H new ATOM 0 HG22 THR A 68 2.698 8.132 18.090 1.00 0.00 H new ATOM 0 HG23 THR A 68 2.627 8.623 19.799 1.00 0.00 H new ATOM 726 N ILE A 69 0.354 5.543 17.260 1.00 0.00 N ATOM 727 CA ILE A 69 -0.035 5.448 15.827 1.00 0.00 C ATOM 728 C ILE A 69 -1.507 5.851 15.673 1.00 0.00 C ATOM 729 O ILE A 69 -1.883 6.513 14.725 1.00 0.00 O ATOM 730 CB ILE A 69 0.170 4.005 15.346 1.00 0.00 C ATOM 731 CG1 ILE A 69 1.617 3.578 15.650 1.00 0.00 C ATOM 732 CG2 ILE A 69 -0.090 3.922 13.834 1.00 0.00 C ATOM 733 CD1 ILE A 69 1.945 2.253 14.952 1.00 0.00 C ATOM 0 H ILE A 69 0.629 4.661 17.692 1.00 0.00 H new ATOM 0 HA ILE A 69 0.581 6.118 15.227 1.00 0.00 H new ATOM 0 HB ILE A 69 -0.525 3.342 15.862 1.00 0.00 H new ATOM 0 HG12 ILE A 69 2.308 4.352 15.317 1.00 0.00 H new ATOM 0 HG13 ILE A 69 1.752 3.472 16.726 1.00 0.00 H new ATOM 0 HG21 ILE A 69 0.056 2.896 13.495 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -1.114 4.231 13.623 1.00 0.00 H new ATOM 0 HG23 ILE A 69 0.603 4.580 13.309 1.00 0.00 H new ATOM 0 HD11 ILE A 69 2.972 1.967 15.178 1.00 0.00 H new ATOM 0 HD12 ILE A 69 1.266 1.477 15.306 1.00 0.00 H new ATOM 0 HD13 ILE A 69 1.830 2.371 13.875 1.00 0.00 H new ATOM 745 N ARG A 70 -2.341 5.452 16.593 1.00 0.00 N ATOM 746 CA ARG A 70 -3.790 5.803 16.500 1.00 0.00 C ATOM 747 C ARG A 70 -4.011 7.269 16.915 1.00 0.00 C ATOM 748 O ARG A 70 -4.873 7.944 16.388 1.00 0.00 O ATOM 749 CB ARG A 70 -4.599 4.867 17.431 1.00 0.00 C ATOM 750 CG ARG A 70 -5.124 3.657 16.646 1.00 0.00 C ATOM 751 CD ARG A 70 -5.882 2.711 17.586 1.00 0.00 C ATOM 752 NE ARG A 70 -6.743 3.500 18.522 1.00 0.00 N ATOM 753 CZ ARG A 70 -6.313 3.829 19.717 1.00 0.00 C ATOM 754 NH1 ARG A 70 -5.105 3.514 20.099 1.00 0.00 N ATOM 755 NH2 ARG A 70 -7.096 4.490 20.526 1.00 0.00 N ATOM 0 H ARG A 70 -2.083 4.896 17.408 1.00 0.00 H new ATOM 0 HA ARG A 70 -4.125 5.679 15.470 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -3.969 4.529 18.254 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -5.433 5.413 17.871 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -5.783 3.991 15.844 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -4.294 3.129 16.177 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -6.497 2.024 17.005 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -5.175 2.105 18.153 1.00 0.00 H new ATOM 0 HE ARG A 70 -7.677 3.786 18.227 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -4.486 3.007 19.466 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -4.780 3.775 21.030 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -8.037 4.748 20.228 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -6.767 4.748 21.456 1.00 0.00 H new ATOM 769 N GLU A 71 -3.259 7.762 17.864 1.00 0.00 N ATOM 770 CA GLU A 71 -3.452 9.173 18.316 1.00 0.00 C ATOM 771 C GLU A 71 -2.630 10.128 17.450 1.00 0.00 C ATOM 772 O GLU A 71 -3.036 11.240 17.180 1.00 0.00 O ATOM 773 CB GLU A 71 -2.998 9.302 19.771 1.00 0.00 C ATOM 774 CG GLU A 71 -3.387 10.681 20.304 1.00 0.00 C ATOM 775 CD GLU A 71 -3.010 10.781 21.784 1.00 0.00 C ATOM 776 OE1 GLU A 71 -1.831 10.917 22.067 1.00 0.00 O ATOM 777 OE2 GLU A 71 -3.907 10.719 22.609 1.00 0.00 O ATOM 0 H GLU A 71 -2.520 7.250 18.346 1.00 0.00 H new ATOM 0 HA GLU A 71 -4.507 9.431 18.226 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -3.459 8.522 20.378 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -1.919 9.164 19.840 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -2.879 11.459 19.735 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -4.458 10.842 20.179 1.00 0.00 H new ATOM 784 N ASP A 72 -1.470 9.712 17.022 1.00 0.00 N ATOM 785 CA ASP A 72 -0.617 10.609 16.187 1.00 0.00 C ATOM 786 C ASP A 72 0.344 9.764 15.331 1.00 0.00 C ATOM 787 O ASP A 72 1.386 9.359 15.807 1.00 0.00 O ATOM 788 CB ASP A 72 0.203 11.511 17.114 1.00 0.00 C ATOM 789 CG ASP A 72 0.775 12.685 16.316 1.00 0.00 C ATOM 790 OD1 ASP A 72 1.145 12.474 15.173 1.00 0.00 O ATOM 791 OD2 ASP A 72 0.834 13.774 16.862 1.00 0.00 O ATOM 0 H ASP A 72 -1.075 8.791 17.213 1.00 0.00 H new ATOM 0 HA ASP A 72 -1.249 11.211 15.534 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -0.424 11.881 17.925 1.00 0.00 H new ATOM 0 HB3 ASP A 72 1.012 10.941 17.571 1.00 0.00 H new ATOM 796 N PRO A 73 0.016 9.483 14.086 1.00 0.00 N ATOM 797 CA PRO A 73 0.903 8.662 13.210 1.00 0.00 C ATOM 798 C PRO A 73 2.126 9.444 12.695 1.00 0.00 C ATOM 799 O PRO A 73 2.971 8.901 12.012 1.00 0.00 O ATOM 800 CB PRO A 73 -0.019 8.246 12.056 1.00 0.00 C ATOM 801 CG PRO A 73 -1.030 9.345 11.954 1.00 0.00 C ATOM 802 CD PRO A 73 -1.218 9.897 13.374 1.00 0.00 C ATOM 0 HA PRO A 73 1.334 7.817 13.747 1.00 0.00 H new ATOM 0 HB2 PRO A 73 0.538 8.135 11.126 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -0.497 7.287 12.258 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -0.686 10.127 11.276 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -1.973 8.969 11.556 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -1.331 10.981 13.369 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -2.109 9.485 13.848 1.00 0.00 H new ATOM 810 N ASP A 74 2.225 10.713 13.006 1.00 0.00 N ATOM 811 CA ASP A 74 3.391 11.520 12.520 1.00 0.00 C ATOM 812 C ASP A 74 4.542 11.491 13.543 1.00 0.00 C ATOM 813 O ASP A 74 5.697 11.586 13.180 1.00 0.00 O ATOM 814 CB ASP A 74 2.946 12.970 12.293 1.00 0.00 C ATOM 815 CG ASP A 74 2.100 13.051 11.020 1.00 0.00 C ATOM 816 OD1 ASP A 74 2.457 12.399 10.053 1.00 0.00 O ATOM 817 OD2 ASP A 74 1.110 13.764 11.035 1.00 0.00 O ATOM 0 H ASP A 74 1.551 11.226 13.574 1.00 0.00 H new ATOM 0 HA ASP A 74 3.748 11.088 11.585 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.370 13.323 13.148 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.817 13.619 12.206 1.00 0.00 H new ATOM 822 N SER A 75 4.249 11.366 14.814 1.00 0.00 N ATOM 823 CA SER A 75 5.340 11.340 15.832 1.00 0.00 C ATOM 824 C SER A 75 5.932 9.929 15.914 1.00 0.00 C ATOM 825 O SER A 75 6.519 9.555 16.911 1.00 0.00 O ATOM 826 CB SER A 75 4.765 11.727 17.196 1.00 0.00 C ATOM 827 OG SER A 75 3.944 12.876 17.056 1.00 0.00 O ATOM 0 H SER A 75 3.304 11.281 15.188 1.00 0.00 H new ATOM 0 HA SER A 75 6.121 12.045 15.547 1.00 0.00 H new ATOM 0 HB2 SER A 75 4.185 10.900 17.605 1.00 0.00 H new ATOM 0 HB3 SER A 75 5.573 11.928 17.899 1.00 0.00 H new ATOM 0 HG SER A 75 3.575 13.122 17.930 1.00 0.00 H new ATOM 833 N VAL A 76 5.777 9.139 14.874 1.00 0.00 N ATOM 834 CA VAL A 76 6.319 7.742 14.875 1.00 0.00 C ATOM 835 C VAL A 76 7.351 7.614 13.732 1.00 0.00 C ATOM 836 O VAL A 76 6.976 7.545 12.578 1.00 0.00 O ATOM 837 CB VAL A 76 5.149 6.770 14.632 1.00 0.00 C ATOM 838 CG1 VAL A 76 5.496 5.369 15.157 1.00 0.00 C ATOM 839 CG2 VAL A 76 3.906 7.290 15.361 1.00 0.00 C ATOM 0 H VAL A 76 5.293 9.407 14.017 1.00 0.00 H new ATOM 0 HA VAL A 76 6.799 7.511 15.826 1.00 0.00 H new ATOM 0 HB VAL A 76 4.958 6.706 13.561 1.00 0.00 H new ATOM 0 HG11 VAL A 76 4.658 4.695 14.977 1.00 0.00 H new ATOM 0 HG12 VAL A 76 6.380 4.995 14.640 1.00 0.00 H new ATOM 0 HG13 VAL A 76 5.697 5.421 16.227 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.073 6.607 15.193 1.00 0.00 H new ATOM 0 HG22 VAL A 76 4.112 7.356 16.429 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.647 8.278 14.980 1.00 0.00 H new ATOM 849 N PRO A 77 8.639 7.608 14.024 1.00 0.00 N ATOM 850 CA PRO A 77 9.685 7.517 12.962 1.00 0.00 C ATOM 851 C PRO A 77 9.830 6.100 12.379 1.00 0.00 C ATOM 852 O PRO A 77 9.394 5.131 12.969 1.00 0.00 O ATOM 853 CB PRO A 77 10.974 7.962 13.671 1.00 0.00 C ATOM 854 CG PRO A 77 10.755 7.679 15.130 1.00 0.00 C ATOM 855 CD PRO A 77 9.236 7.686 15.373 1.00 0.00 C ATOM 0 HA PRO A 77 9.433 8.136 12.101 1.00 0.00 H new ATOM 0 HB2 PRO A 77 11.838 7.416 13.292 1.00 0.00 H new ATOM 0 HB3 PRO A 77 11.168 9.021 13.503 1.00 0.00 H new ATOM 0 HG2 PRO A 77 11.184 6.715 15.403 1.00 0.00 H new ATOM 0 HG3 PRO A 77 11.246 8.432 15.746 1.00 0.00 H new ATOM 0 HD2 PRO A 77 8.930 6.842 15.991 1.00 0.00 H new ATOM 0 HD3 PRO A 77 8.922 8.591 15.893 1.00 0.00 H new ATOM 863 N PRO A 78 10.445 5.987 11.222 1.00 0.00 N ATOM 864 CA PRO A 78 10.658 4.673 10.540 1.00 0.00 C ATOM 865 C PRO A 78 11.771 3.854 11.198 1.00 0.00 C ATOM 866 O PRO A 78 12.474 4.329 12.069 1.00 0.00 O ATOM 867 CB PRO A 78 11.053 5.073 9.112 1.00 0.00 C ATOM 868 CG PRO A 78 11.711 6.406 9.260 1.00 0.00 C ATOM 869 CD PRO A 78 11.007 7.104 10.430 1.00 0.00 C ATOM 0 HA PRO A 78 9.773 4.038 10.587 1.00 0.00 H new ATOM 0 HB2 PRO A 78 11.731 4.343 8.670 1.00 0.00 H new ATOM 0 HB3 PRO A 78 10.180 5.132 8.462 1.00 0.00 H new ATOM 0 HG2 PRO A 78 12.777 6.294 9.458 1.00 0.00 H new ATOM 0 HG3 PRO A 78 11.617 6.990 8.345 1.00 0.00 H new ATOM 0 HD2 PRO A 78 11.705 7.700 11.018 1.00 0.00 H new ATOM 0 HD3 PRO A 78 10.226 7.780 10.081 1.00 0.00 H new ATOM 877 N ILE A 79 11.933 2.626 10.777 1.00 0.00 N ATOM 878 CA ILE A 79 12.999 1.747 11.355 1.00 0.00 C ATOM 879 C ILE A 79 14.064 1.480 10.289 1.00 0.00 C ATOM 880 O ILE A 79 13.856 1.719 9.117 1.00 0.00 O ATOM 881 CB ILE A 79 12.375 0.415 11.797 1.00 0.00 C ATOM 882 CG1 ILE A 79 11.378 -0.067 10.724 1.00 0.00 C ATOM 883 CG2 ILE A 79 11.647 0.605 13.138 1.00 0.00 C ATOM 884 CD1 ILE A 79 11.193 -1.580 10.837 1.00 0.00 C ATOM 0 H ILE A 79 11.367 2.188 10.050 1.00 0.00 H new ATOM 0 HA ILE A 79 13.455 2.239 12.214 1.00 0.00 H new ATOM 0 HB ILE A 79 13.160 -0.331 11.920 1.00 0.00 H new ATOM 0 HG12 ILE A 79 10.420 0.437 10.851 1.00 0.00 H new ATOM 0 HG13 ILE A 79 11.745 0.191 9.731 1.00 0.00 H new ATOM 0 HG21 ILE A 79 11.205 -0.341 13.449 1.00 0.00 H new ATOM 0 HG22 ILE A 79 12.358 0.940 13.894 1.00 0.00 H new ATOM 0 HG23 ILE A 79 10.861 1.352 13.023 1.00 0.00 H new ATOM 0 HD11 ILE A 79 10.488 -1.918 10.078 1.00 0.00 H new ATOM 0 HD12 ILE A 79 12.152 -2.076 10.688 1.00 0.00 H new ATOM 0 HD13 ILE A 79 10.807 -1.826 11.826 1.00 0.00 H new ATOM 896 N ASP A 80 15.203 0.980 10.687 1.00 0.00 N ATOM 897 CA ASP A 80 16.281 0.691 9.708 1.00 0.00 C ATOM 898 C ASP A 80 16.076 -0.720 9.148 1.00 0.00 C ATOM 899 O ASP A 80 15.818 -1.654 9.881 1.00 0.00 O ATOM 900 CB ASP A 80 17.631 0.775 10.428 1.00 0.00 C ATOM 901 CG ASP A 80 18.069 2.239 10.541 1.00 0.00 C ATOM 902 OD1 ASP A 80 18.707 2.719 9.619 1.00 0.00 O ATOM 903 OD2 ASP A 80 17.757 2.853 11.548 1.00 0.00 O ATOM 0 H ASP A 80 15.431 0.759 11.656 1.00 0.00 H new ATOM 0 HA ASP A 80 16.258 1.411 8.890 1.00 0.00 H new ATOM 0 HB2 ASP A 80 17.552 0.332 11.421 1.00 0.00 H new ATOM 0 HB3 ASP A 80 18.381 0.203 9.882 1.00 0.00 H new ATOM 908 N VAL A 81 16.180 -0.879 7.854 1.00 0.00 N ATOM 909 CA VAL A 81 15.983 -2.227 7.233 1.00 0.00 C ATOM 910 C VAL A 81 17.048 -2.451 6.155 1.00 0.00 C ATOM 911 O VAL A 81 17.371 -1.566 5.389 1.00 0.00 O ATOM 912 CB VAL A 81 14.569 -2.286 6.629 1.00 0.00 C ATOM 913 CG1 VAL A 81 14.450 -3.441 5.630 1.00 0.00 C ATOM 914 CG2 VAL A 81 13.554 -2.494 7.756 1.00 0.00 C ATOM 0 H VAL A 81 16.394 -0.130 7.196 1.00 0.00 H new ATOM 0 HA VAL A 81 16.084 -3.013 7.981 1.00 0.00 H new ATOM 0 HB VAL A 81 14.373 -1.350 6.105 1.00 0.00 H new ATOM 0 HG11 VAL A 81 13.442 -3.462 5.217 1.00 0.00 H new ATOM 0 HG12 VAL A 81 15.170 -3.300 4.824 1.00 0.00 H new ATOM 0 HG13 VAL A 81 14.654 -4.384 6.138 1.00 0.00 H new ATOM 0 HG21 VAL A 81 12.549 -2.537 7.337 1.00 0.00 H new ATOM 0 HG22 VAL A 81 13.772 -3.428 8.274 1.00 0.00 H new ATOM 0 HG23 VAL A 81 13.618 -1.665 8.461 1.00 0.00 H new ATOM 924 N LEU A 82 17.599 -3.635 6.103 1.00 0.00 N ATOM 925 CA LEU A 82 18.654 -3.936 5.090 1.00 0.00 C ATOM 926 C LEU A 82 18.008 -4.409 3.786 1.00 0.00 C ATOM 927 O LEU A 82 17.073 -5.186 3.786 1.00 0.00 O ATOM 928 CB LEU A 82 19.572 -5.040 5.629 1.00 0.00 C ATOM 929 CG LEU A 82 20.177 -4.617 6.988 1.00 0.00 C ATOM 930 CD1 LEU A 82 20.521 -5.861 7.812 1.00 0.00 C ATOM 931 CD2 LEU A 82 21.456 -3.799 6.765 1.00 0.00 C ATOM 0 H LEU A 82 17.363 -4.411 6.722 1.00 0.00 H new ATOM 0 HA LEU A 82 19.233 -3.033 4.896 1.00 0.00 H new ATOM 0 HB2 LEU A 82 19.009 -5.966 5.746 1.00 0.00 H new ATOM 0 HB3 LEU A 82 20.370 -5.240 4.914 1.00 0.00 H new ATOM 0 HG LEU A 82 19.445 -4.010 7.521 1.00 0.00 H new ATOM 0 HD11 LEU A 82 20.947 -5.558 8.768 1.00 0.00 H new ATOM 0 HD12 LEU A 82 19.616 -6.444 7.986 1.00 0.00 H new ATOM 0 HD13 LEU A 82 21.245 -6.468 7.269 1.00 0.00 H new ATOM 0 HD21 LEU A 82 21.873 -3.506 7.728 1.00 0.00 H new ATOM 0 HD22 LEU A 82 22.184 -4.402 6.222 1.00 0.00 H new ATOM 0 HD23 LEU A 82 21.221 -2.906 6.186 1.00 0.00 H new ATOM 943 N TRP A 83 18.509 -3.938 2.673 1.00 0.00 N ATOM 944 CA TRP A 83 17.957 -4.330 1.339 1.00 0.00 C ATOM 945 C TRP A 83 19.036 -5.115 0.587 1.00 0.00 C ATOM 946 O TRP A 83 20.033 -4.560 0.168 1.00 0.00 O ATOM 947 CB TRP A 83 17.619 -3.039 0.596 1.00 0.00 C ATOM 948 CG TRP A 83 17.149 -3.282 -0.807 1.00 0.00 C ATOM 949 CD1 TRP A 83 16.663 -4.445 -1.318 1.00 0.00 C ATOM 950 CD2 TRP A 83 17.108 -2.314 -1.889 1.00 0.00 C ATOM 951 NE1 TRP A 83 16.328 -4.237 -2.650 1.00 0.00 N ATOM 952 CE2 TRP A 83 16.586 -2.938 -3.045 1.00 0.00 C ATOM 953 CE3 TRP A 83 17.475 -0.960 -1.970 1.00 0.00 C ATOM 954 CZ2 TRP A 83 16.432 -2.237 -4.243 1.00 0.00 C ATOM 955 CZ3 TRP A 83 17.322 -0.253 -3.172 1.00 0.00 C ATOM 956 CH2 TRP A 83 16.801 -0.890 -4.306 1.00 0.00 C ATOM 0 H TRP A 83 19.292 -3.286 2.631 1.00 0.00 H new ATOM 0 HA TRP A 83 17.066 -4.952 1.429 1.00 0.00 H new ATOM 0 HB2 TRP A 83 16.846 -2.501 1.145 1.00 0.00 H new ATOM 0 HB3 TRP A 83 18.500 -2.397 0.573 1.00 0.00 H new ATOM 0 HD1 TRP A 83 16.556 -5.374 -0.779 1.00 0.00 H new ATOM 0 HE1 TRP A 83 15.939 -4.955 -3.261 1.00 0.00 H new ATOM 0 HE3 TRP A 83 17.877 -0.460 -1.101 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 16.031 -2.732 -5.115 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 17.607 0.787 -3.224 1.00 0.00 H new ATOM 0 HH2 TRP A 83 16.684 -0.341 -5.228 1.00 0.00 H new ATOM 967 N ILE A 84 18.858 -6.408 0.435 1.00 0.00 N ATOM 968 CA ILE A 84 19.887 -7.247 -0.266 1.00 0.00 C ATOM 969 C ILE A 84 19.232 -8.037 -1.400 1.00 0.00 C ATOM 970 O ILE A 84 18.091 -8.446 -1.311 1.00 0.00 O ATOM 971 CB ILE A 84 20.509 -8.219 0.744 1.00 0.00 C ATOM 972 CG1 ILE A 84 21.007 -7.434 1.960 1.00 0.00 C ATOM 973 CG2 ILE A 84 21.696 -8.948 0.107 1.00 0.00 C ATOM 974 CD1 ILE A 84 21.702 -8.389 2.931 1.00 0.00 C ATOM 0 H ILE A 84 18.041 -6.921 0.767 1.00 0.00 H new ATOM 0 HA ILE A 84 20.659 -6.602 -0.685 1.00 0.00 H new ATOM 0 HB ILE A 84 19.756 -8.946 1.048 1.00 0.00 H new ATOM 0 HG12 ILE A 84 21.698 -6.652 1.644 1.00 0.00 H new ATOM 0 HG13 ILE A 84 20.171 -6.939 2.455 1.00 0.00 H new ATOM 0 HG21 ILE A 84 22.132 -9.636 0.831 1.00 0.00 H new ATOM 0 HG22 ILE A 84 21.355 -9.507 -0.765 1.00 0.00 H new ATOM 0 HG23 ILE A 84 22.448 -8.221 -0.200 1.00 0.00 H new ATOM 0 HD11 ILE A 84 22.057 -7.832 3.798 1.00 0.00 H new ATOM 0 HD12 ILE A 84 20.997 -9.154 3.256 1.00 0.00 H new ATOM 0 HD13 ILE A 84 22.548 -8.863 2.433 1.00 0.00 H new ATOM 986 N LYS A 85 19.956 -8.246 -2.473 1.00 0.00 N ATOM 987 CA LYS A 85 19.408 -9.001 -3.644 1.00 0.00 C ATOM 988 C LYS A 85 20.078 -10.373 -3.735 1.00 0.00 C ATOM 989 O LYS A 85 21.162 -10.588 -3.231 1.00 0.00 O ATOM 990 CB LYS A 85 19.691 -8.203 -4.927 1.00 0.00 C ATOM 991 CG LYS A 85 18.558 -7.215 -5.181 1.00 0.00 C ATOM 992 CD LYS A 85 18.883 -6.354 -6.408 1.00 0.00 C ATOM 993 CE LYS A 85 17.589 -5.788 -6.998 1.00 0.00 C ATOM 994 NZ LYS A 85 16.839 -5.069 -5.934 1.00 0.00 N ATOM 0 H LYS A 85 20.916 -7.921 -2.589 1.00 0.00 H new ATOM 0 HA LYS A 85 18.334 -9.138 -3.522 1.00 0.00 H new ATOM 0 HB2 LYS A 85 20.637 -7.669 -4.833 1.00 0.00 H new ATOM 0 HB3 LYS A 85 19.791 -8.882 -5.774 1.00 0.00 H new ATOM 0 HG2 LYS A 85 17.623 -7.753 -5.340 1.00 0.00 H new ATOM 0 HG3 LYS A 85 18.415 -6.579 -4.307 1.00 0.00 H new ATOM 0 HD2 LYS A 85 19.552 -5.541 -6.127 1.00 0.00 H new ATOM 0 HD3 LYS A 85 19.404 -6.952 -7.156 1.00 0.00 H new ATOM 0 HE2 LYS A 85 17.817 -5.110 -7.821 1.00 0.00 H new ATOM 0 HE3 LYS A 85 16.980 -6.593 -7.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 15.834 -5.333 -5.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 17.224 -5.327 -5.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 16.934 -4.043 -6.075 1.00 0.00 H new ATOM 1008 N GLY A 86 19.423 -11.304 -4.378 1.00 0.00 N ATOM 1009 CA GLY A 86 19.991 -12.677 -4.519 1.00 0.00 C ATOM 1010 C GLY A 86 20.640 -12.841 -5.893 1.00 0.00 C ATOM 1011 O GLY A 86 20.914 -11.882 -6.587 1.00 0.00 O ATOM 0 H GLY A 86 18.511 -11.170 -4.815 1.00 0.00 H new ATOM 0 HA2 GLY A 86 20.729 -12.855 -3.737 1.00 0.00 H new ATOM 0 HA3 GLY A 86 19.203 -13.419 -4.390 1.00 0.00 H new ATOM 1015 N ALA A 87 20.898 -14.060 -6.278 1.00 0.00 N ATOM 1016 CA ALA A 87 21.544 -14.321 -7.596 1.00 0.00 C ATOM 1017 C ALA A 87 20.571 -14.033 -8.750 1.00 0.00 C ATOM 1018 O ALA A 87 20.953 -14.077 -9.902 1.00 0.00 O ATOM 1019 CB ALA A 87 21.985 -15.789 -7.650 1.00 0.00 C ATOM 0 H ALA A 87 20.687 -14.895 -5.731 1.00 0.00 H new ATOM 0 HA ALA A 87 22.406 -13.663 -7.704 1.00 0.00 H new ATOM 0 HB1 ALA A 87 22.459 -15.991 -8.610 1.00 0.00 H new ATOM 0 HB2 ALA A 87 22.695 -15.986 -6.846 1.00 0.00 H new ATOM 0 HB3 ALA A 87 21.115 -16.435 -7.532 1.00 0.00 H new ATOM 1025 N GLN A 88 19.317 -13.754 -8.461 1.00 0.00 N ATOM 1026 CA GLN A 88 18.325 -13.482 -9.560 1.00 0.00 C ATOM 1027 C GLN A 88 17.544 -12.188 -9.278 1.00 0.00 C ATOM 1028 O GLN A 88 16.360 -12.099 -9.535 1.00 0.00 O ATOM 1029 CB GLN A 88 17.355 -14.662 -9.656 1.00 0.00 C ATOM 1030 CG GLN A 88 18.154 -15.969 -9.644 1.00 0.00 C ATOM 1031 CD GLN A 88 17.265 -17.123 -10.113 1.00 0.00 C ATOM 1032 OE1 GLN A 88 16.155 -16.907 -10.558 1.00 0.00 O ATOM 1033 NE2 GLN A 88 17.709 -18.349 -10.032 1.00 0.00 N ATOM 0 H GLN A 88 18.938 -13.703 -7.515 1.00 0.00 H new ATOM 0 HA GLN A 88 18.860 -13.360 -10.502 1.00 0.00 H new ATOM 0 HB2 GLN A 88 16.654 -14.642 -8.821 1.00 0.00 H new ATOM 0 HB3 GLN A 88 16.765 -14.590 -10.570 1.00 0.00 H new ATOM 0 HG2 GLN A 88 19.024 -15.880 -10.295 1.00 0.00 H new ATOM 0 HG3 GLN A 88 18.526 -16.169 -8.639 1.00 0.00 H new ATOM 0 HE21 GLN A 88 18.641 -18.530 -9.659 1.00 0.00 H new ATOM 0 HE22 GLN A 88 17.124 -19.125 -10.342 1.00 0.00 H new ATOM 1042 N GLY A 89 18.208 -11.176 -8.785 1.00 0.00 N ATOM 1043 CA GLY A 89 17.525 -9.873 -8.521 1.00 0.00 C ATOM 1044 C GLY A 89 16.456 -10.003 -7.427 1.00 0.00 C ATOM 1045 O GLY A 89 15.929 -9.017 -6.953 1.00 0.00 O ATOM 0 H GLY A 89 19.201 -11.195 -8.552 1.00 0.00 H new ATOM 0 HA2 GLY A 89 18.263 -9.129 -8.221 1.00 0.00 H new ATOM 0 HA3 GLY A 89 17.063 -9.512 -9.440 1.00 0.00 H new ATOM 1049 N GLY A 90 16.124 -11.197 -7.021 1.00 0.00 N ATOM 1050 CA GLY A 90 15.091 -11.363 -5.965 1.00 0.00 C ATOM 1051 C GLY A 90 15.394 -10.421 -4.803 1.00 0.00 C ATOM 1052 O GLY A 90 16.336 -10.610 -4.060 1.00 0.00 O ATOM 0 H GLY A 90 16.525 -12.065 -7.376 1.00 0.00 H new ATOM 0 HA2 GLY A 90 14.103 -11.149 -6.372 1.00 0.00 H new ATOM 0 HA3 GLY A 90 15.076 -12.395 -5.616 1.00 0.00 H new ATOM 1056 N ASP A 91 14.602 -9.406 -4.647 1.00 0.00 N ATOM 1057 CA ASP A 91 14.828 -8.444 -3.540 1.00 0.00 C ATOM 1058 C ASP A 91 14.351 -9.066 -2.228 1.00 0.00 C ATOM 1059 O ASP A 91 13.256 -9.586 -2.139 1.00 0.00 O ATOM 1060 CB ASP A 91 14.042 -7.161 -3.810 1.00 0.00 C ATOM 1061 CG ASP A 91 14.723 -6.366 -4.923 1.00 0.00 C ATOM 1062 OD1 ASP A 91 15.291 -6.988 -5.805 1.00 0.00 O ATOM 1063 OD2 ASP A 91 14.664 -5.148 -4.876 1.00 0.00 O ATOM 0 H ASP A 91 13.801 -9.198 -5.243 1.00 0.00 H new ATOM 0 HA ASP A 91 15.890 -8.210 -3.470 1.00 0.00 H new ATOM 0 HB2 ASP A 91 13.019 -7.403 -4.096 1.00 0.00 H new ATOM 0 HB3 ASP A 91 13.985 -6.560 -2.903 1.00 0.00 H new ATOM 1068 N TYR A 92 15.171 -9.016 -1.212 1.00 0.00 N ATOM 1069 CA TYR A 92 14.794 -9.599 0.114 1.00 0.00 C ATOM 1070 C TYR A 92 15.013 -8.532 1.190 1.00 0.00 C ATOM 1071 O TYR A 92 16.083 -7.968 1.304 1.00 0.00 O ATOM 1072 CB TYR A 92 15.678 -10.820 0.381 1.00 0.00 C ATOM 1073 CG TYR A 92 15.448 -11.841 -0.715 1.00 0.00 C ATOM 1074 CD1 TYR A 92 14.329 -12.684 -0.668 1.00 0.00 C ATOM 1075 CD2 TYR A 92 16.349 -11.941 -1.783 1.00 0.00 C ATOM 1076 CE1 TYR A 92 14.113 -13.621 -1.685 1.00 0.00 C ATOM 1077 CE2 TYR A 92 16.132 -12.878 -2.799 1.00 0.00 C ATOM 1078 CZ TYR A 92 15.014 -13.718 -2.751 1.00 0.00 C ATOM 1079 OH TYR A 92 14.801 -14.642 -3.753 1.00 0.00 O ATOM 0 H TYR A 92 16.098 -8.591 -1.243 1.00 0.00 H new ATOM 0 HA TYR A 92 13.749 -9.909 0.123 1.00 0.00 H new ATOM 0 HB2 TYR A 92 16.727 -10.527 0.409 1.00 0.00 H new ATOM 0 HB3 TYR A 92 15.442 -11.251 1.354 1.00 0.00 H new ATOM 0 HD1 TYR A 92 13.633 -12.610 0.154 1.00 0.00 H new ATOM 0 HD2 TYR A 92 17.213 -11.294 -1.822 1.00 0.00 H new ATOM 0 HE1 TYR A 92 13.250 -14.270 -1.647 1.00 0.00 H new ATOM 0 HE2 TYR A 92 16.828 -12.953 -3.621 1.00 0.00 H new ATOM 0 HH TYR A 92 15.367 -14.426 -4.523 1.00 0.00 H new ATOM 1089 N PHE A 93 13.998 -8.228 1.965 1.00 0.00 N ATOM 1090 CA PHE A 93 14.130 -7.176 3.013 1.00 0.00 C ATOM 1091 C PHE A 93 14.352 -7.822 4.380 1.00 0.00 C ATOM 1092 O PHE A 93 13.517 -8.541 4.888 1.00 0.00 O ATOM 1093 CB PHE A 93 12.848 -6.333 3.032 1.00 0.00 C ATOM 1094 CG PHE A 93 12.616 -5.729 1.661 1.00 0.00 C ATOM 1095 CD1 PHE A 93 13.369 -4.622 1.239 1.00 0.00 C ATOM 1096 CD2 PHE A 93 11.655 -6.283 0.804 1.00 0.00 C ATOM 1097 CE1 PHE A 93 13.161 -4.079 -0.034 1.00 0.00 C ATOM 1098 CE2 PHE A 93 11.447 -5.734 -0.467 1.00 0.00 C ATOM 1099 CZ PHE A 93 12.201 -4.634 -0.886 1.00 0.00 C ATOM 0 H PHE A 93 13.080 -8.669 1.913 1.00 0.00 H new ATOM 0 HA PHE A 93 14.986 -6.540 2.789 1.00 0.00 H new ATOM 0 HB2 PHE A 93 11.997 -6.953 3.316 1.00 0.00 H new ATOM 0 HB3 PHE A 93 12.931 -5.544 3.779 1.00 0.00 H new ATOM 0 HD1 PHE A 93 14.109 -4.189 1.896 1.00 0.00 H new ATOM 0 HD2 PHE A 93 11.074 -7.135 1.125 1.00 0.00 H new ATOM 0 HE1 PHE A 93 13.743 -3.229 -0.359 1.00 0.00 H new ATOM 0 HE2 PHE A 93 10.704 -6.161 -1.124 1.00 0.00 H new ATOM 0 HZ PHE A 93 12.042 -4.213 -1.868 1.00 0.00 H new ATOM 1109 N TYR A 94 15.484 -7.561 4.975 1.00 0.00 N ATOM 1110 CA TYR A 94 15.806 -8.141 6.313 1.00 0.00 C ATOM 1111 C TYR A 94 15.637 -7.055 7.378 1.00 0.00 C ATOM 1112 O TYR A 94 16.109 -5.947 7.218 1.00 0.00 O ATOM 1113 CB TYR A 94 17.274 -8.614 6.301 1.00 0.00 C ATOM 1114 CG TYR A 94 17.342 -10.077 5.950 1.00 0.00 C ATOM 1115 CD1 TYR A 94 17.308 -10.476 4.612 1.00 0.00 C ATOM 1116 CD2 TYR A 94 17.432 -11.030 6.966 1.00 0.00 C ATOM 1117 CE1 TYR A 94 17.366 -11.832 4.288 1.00 0.00 C ATOM 1118 CE2 TYR A 94 17.490 -12.389 6.643 1.00 0.00 C ATOM 1119 CZ TYR A 94 17.457 -12.791 5.303 1.00 0.00 C ATOM 1120 OH TYR A 94 17.513 -14.133 4.983 1.00 0.00 O ATOM 0 H TYR A 94 16.211 -6.961 4.585 1.00 0.00 H new ATOM 0 HA TYR A 94 15.144 -8.978 6.533 1.00 0.00 H new ATOM 0 HB2 TYR A 94 17.846 -8.032 5.579 1.00 0.00 H new ATOM 0 HB3 TYR A 94 17.727 -8.445 7.278 1.00 0.00 H new ATOM 0 HD1 TYR A 94 17.237 -9.736 3.829 1.00 0.00 H new ATOM 0 HD2 TYR A 94 17.457 -10.718 8.000 1.00 0.00 H new ATOM 0 HE1 TYR A 94 17.341 -12.141 3.254 1.00 0.00 H new ATOM 0 HE2 TYR A 94 17.560 -13.128 7.427 1.00 0.00 H new ATOM 0 HH TYR A 94 17.575 -14.663 5.805 1.00 0.00 H new ATOM 1130 N SER A 95 14.987 -7.371 8.469 1.00 0.00 N ATOM 1131 CA SER A 95 14.801 -6.365 9.563 1.00 0.00 C ATOM 1132 C SER A 95 15.319 -6.950 10.879 1.00 0.00 C ATOM 1133 O SER A 95 15.008 -8.067 11.244 1.00 0.00 O ATOM 1134 CB SER A 95 13.312 -6.011 9.693 1.00 0.00 C ATOM 1135 OG SER A 95 13.183 -4.673 10.150 1.00 0.00 O ATOM 0 H SER A 95 14.575 -8.286 8.652 1.00 0.00 H new ATOM 0 HA SER A 95 15.359 -5.459 9.327 1.00 0.00 H new ATOM 0 HB2 SER A 95 12.814 -6.128 8.731 1.00 0.00 H new ATOM 0 HB3 SER A 95 12.824 -6.693 10.389 1.00 0.00 H new ATOM 0 HG SER A 95 12.233 -4.445 10.232 1.00 0.00 H new ATOM 1141 N PHE A 96 16.087 -6.183 11.602 1.00 0.00 N ATOM 1142 CA PHE A 96 16.620 -6.639 12.913 1.00 0.00 C ATOM 1143 C PHE A 96 16.376 -5.508 13.908 1.00 0.00 C ATOM 1144 O PHE A 96 17.187 -4.618 14.070 1.00 0.00 O ATOM 1145 CB PHE A 96 18.119 -6.880 12.808 1.00 0.00 C ATOM 1146 CG PHE A 96 18.380 -8.164 12.056 1.00 0.00 C ATOM 1147 CD1 PHE A 96 18.146 -9.396 12.674 1.00 0.00 C ATOM 1148 CD2 PHE A 96 18.875 -8.122 10.750 1.00 0.00 C ATOM 1149 CE1 PHE A 96 18.403 -10.585 11.984 1.00 0.00 C ATOM 1150 CE2 PHE A 96 19.137 -9.308 10.062 1.00 0.00 C ATOM 1151 CZ PHE A 96 18.901 -10.541 10.678 1.00 0.00 C ATOM 0 H PHE A 96 16.372 -5.241 11.333 1.00 0.00 H new ATOM 0 HA PHE A 96 16.135 -7.564 13.224 1.00 0.00 H new ATOM 0 HB2 PHE A 96 18.596 -6.044 12.296 1.00 0.00 H new ATOM 0 HB3 PHE A 96 18.558 -6.936 13.804 1.00 0.00 H new ATOM 0 HD1 PHE A 96 17.767 -9.430 13.685 1.00 0.00 H new ATOM 0 HD2 PHE A 96 19.055 -7.170 10.272 1.00 0.00 H new ATOM 0 HE1 PHE A 96 18.217 -11.537 12.460 1.00 0.00 H new ATOM 0 HE2 PHE A 96 19.522 -9.273 9.054 1.00 0.00 H new ATOM 0 HZ PHE A 96 19.103 -11.459 10.146 1.00 0.00 H new ATOM 1161 N GLY A 97 15.254 -5.531 14.551 1.00 0.00 N ATOM 1162 CA GLY A 97 14.898 -4.462 15.529 1.00 0.00 C ATOM 1163 C GLY A 97 13.434 -4.081 15.295 1.00 0.00 C ATOM 1164 O GLY A 97 12.685 -4.827 14.697 1.00 0.00 O ATOM 0 H GLY A 97 14.548 -6.259 14.443 1.00 0.00 H new ATOM 0 HA2 GLY A 97 15.042 -4.815 16.550 1.00 0.00 H new ATOM 0 HA3 GLY A 97 15.544 -3.594 15.398 1.00 0.00 H new ATOM 1168 N GLY A 98 13.022 -2.925 15.738 1.00 0.00 N ATOM 1169 CA GLY A 98 11.606 -2.503 15.512 1.00 0.00 C ATOM 1170 C GLY A 98 10.648 -3.658 15.833 1.00 0.00 C ATOM 1171 O GLY A 98 9.554 -3.730 15.309 1.00 0.00 O ATOM 0 H GLY A 98 13.600 -2.255 16.245 1.00 0.00 H new ATOM 0 HA2 GLY A 98 11.372 -1.642 16.138 1.00 0.00 H new ATOM 0 HA3 GLY A 98 11.474 -2.189 14.477 1.00 0.00 H new ATOM 1175 N CYS A 99 11.052 -4.568 16.675 1.00 0.00 N ATOM 1176 CA CYS A 99 10.170 -5.719 17.011 1.00 0.00 C ATOM 1177 C CYS A 99 8.880 -5.213 17.668 1.00 0.00 C ATOM 1178 O CYS A 99 7.790 -5.490 17.210 1.00 0.00 O ATOM 1179 CB CYS A 99 10.917 -6.661 17.966 1.00 0.00 C ATOM 1180 SG CYS A 99 12.680 -6.653 17.557 1.00 0.00 S ATOM 0 H CYS A 99 11.957 -4.564 17.146 1.00 0.00 H new ATOM 0 HA CYS A 99 9.908 -6.259 16.101 1.00 0.00 H new ATOM 0 HB2 CYS A 99 10.770 -6.343 18.998 1.00 0.00 H new ATOM 0 HB3 CYS A 99 10.518 -7.672 17.884 1.00 0.00 H new ATOM 0 HG CYS A 99 13.239 -5.596 18.067 1.00 0.00 H new ATOM 1186 N HIS A 100 8.994 -4.481 18.740 1.00 0.00 N ATOM 1187 CA HIS A 100 7.774 -3.967 19.422 1.00 0.00 C ATOM 1188 C HIS A 100 6.977 -3.078 18.459 1.00 0.00 C ATOM 1189 O HIS A 100 5.762 -3.096 18.455 1.00 0.00 O ATOM 1190 CB HIS A 100 8.186 -3.163 20.663 1.00 0.00 C ATOM 1191 CG HIS A 100 8.513 -4.107 21.796 1.00 0.00 C ATOM 1192 ND1 HIS A 100 9.643 -4.912 21.784 1.00 0.00 N ATOM 1193 CD2 HIS A 100 7.866 -4.390 22.977 1.00 0.00 C ATOM 1194 CE1 HIS A 100 9.641 -5.632 22.921 1.00 0.00 C ATOM 1195 NE2 HIS A 100 8.581 -5.352 23.683 1.00 0.00 N ATOM 0 H HIS A 100 9.879 -4.216 19.173 1.00 0.00 H new ATOM 0 HA HIS A 100 7.147 -4.804 19.728 1.00 0.00 H new ATOM 0 HB2 HIS A 100 9.051 -2.541 20.434 1.00 0.00 H new ATOM 0 HB3 HIS A 100 7.379 -2.492 20.958 1.00 0.00 H new ATOM 0 HD1 HIS A 100 10.347 -4.951 21.047 1.00 0.00 H new ATOM 0 HD2 HIS A 100 6.944 -3.935 23.306 1.00 0.00 H new ATOM 0 HE1 HIS A 100 10.404 -6.349 23.185 1.00 0.00 H new ATOM 1203 N ARG A 101 7.639 -2.303 17.642 1.00 0.00 N ATOM 1204 CA ARG A 101 6.891 -1.429 16.692 1.00 0.00 C ATOM 1205 C ARG A 101 6.177 -2.299 15.651 1.00 0.00 C ATOM 1206 O ARG A 101 5.132 -1.940 15.145 1.00 0.00 O ATOM 1207 CB ARG A 101 7.853 -0.450 15.996 1.00 0.00 C ATOM 1208 CG ARG A 101 7.054 0.541 15.108 1.00 0.00 C ATOM 1209 CD ARG A 101 7.715 1.932 15.114 1.00 0.00 C ATOM 1210 NE ARG A 101 7.163 2.737 16.241 1.00 0.00 N ATOM 1211 CZ ARG A 101 7.821 3.773 16.688 1.00 0.00 C ATOM 1212 NH1 ARG A 101 8.965 4.099 16.152 1.00 0.00 N ATOM 1213 NH2 ARG A 101 7.335 4.481 17.670 1.00 0.00 N ATOM 0 H ARG A 101 8.656 -2.237 17.591 1.00 0.00 H new ATOM 0 HA ARG A 101 6.152 -0.850 17.245 1.00 0.00 H new ATOM 0 HB2 ARG A 101 8.428 0.100 16.742 1.00 0.00 H new ATOM 0 HB3 ARG A 101 8.568 -1.002 15.386 1.00 0.00 H new ATOM 0 HG2 ARG A 101 7.002 0.162 14.087 1.00 0.00 H new ATOM 0 HG3 ARG A 101 6.029 0.618 15.472 1.00 0.00 H new ATOM 0 HD2 ARG A 101 8.795 1.833 15.218 1.00 0.00 H new ATOM 0 HD3 ARG A 101 7.531 2.438 14.166 1.00 0.00 H new ATOM 0 HE ARG A 101 6.271 2.479 16.663 1.00 0.00 H new ATOM 0 HH11 ARG A 101 9.345 3.545 15.384 1.00 0.00 H new ATOM 0 HH12 ARG A 101 9.479 4.908 16.501 1.00 0.00 H new ATOM 0 HH21 ARG A 101 6.441 4.226 18.089 1.00 0.00 H new ATOM 0 HH22 ARG A 101 7.849 5.290 18.019 1.00 0.00 H new ATOM 1227 N TYR A 102 6.723 -3.443 15.330 1.00 0.00 N ATOM 1228 CA TYR A 102 6.064 -4.329 14.329 1.00 0.00 C ATOM 1229 C TYR A 102 4.736 -4.832 14.910 1.00 0.00 C ATOM 1230 O TYR A 102 3.727 -4.864 14.237 1.00 0.00 O ATOM 1231 CB TYR A 102 6.995 -5.511 14.017 1.00 0.00 C ATOM 1232 CG TYR A 102 6.247 -6.596 13.278 1.00 0.00 C ATOM 1233 CD1 TYR A 102 5.544 -7.558 14.004 1.00 0.00 C ATOM 1234 CD2 TYR A 102 6.265 -6.649 11.877 1.00 0.00 C ATOM 1235 CE1 TYR A 102 4.856 -8.576 13.340 1.00 0.00 C ATOM 1236 CE2 TYR A 102 5.575 -7.669 11.209 1.00 0.00 C ATOM 1237 CZ TYR A 102 4.871 -8.633 11.941 1.00 0.00 C ATOM 1238 OH TYR A 102 4.192 -9.638 11.284 1.00 0.00 O ATOM 0 H TYR A 102 7.596 -3.801 15.718 1.00 0.00 H new ATOM 0 HA TYR A 102 5.865 -3.782 13.407 1.00 0.00 H new ATOM 0 HB2 TYR A 102 7.838 -5.169 13.416 1.00 0.00 H new ATOM 0 HB3 TYR A 102 7.406 -5.912 14.944 1.00 0.00 H new ATOM 0 HD1 TYR A 102 5.532 -7.515 15.083 1.00 0.00 H new ATOM 0 HD2 TYR A 102 6.809 -5.905 11.314 1.00 0.00 H new ATOM 0 HE1 TYR A 102 4.313 -9.319 13.905 1.00 0.00 H new ATOM 0 HE2 TYR A 102 5.586 -7.712 10.130 1.00 0.00 H new ATOM 0 HH TYR A 102 3.456 -9.958 11.847 1.00 0.00 H new ATOM 1248 N ALA A 103 4.733 -5.217 16.157 1.00 0.00 N ATOM 1249 CA ALA A 103 3.472 -5.711 16.786 1.00 0.00 C ATOM 1250 C ALA A 103 2.402 -4.619 16.724 1.00 0.00 C ATOM 1251 O ALA A 103 1.263 -4.874 16.388 1.00 0.00 O ATOM 1252 CB ALA A 103 3.737 -6.076 18.250 1.00 0.00 C ATOM 0 H ALA A 103 5.549 -5.211 16.769 1.00 0.00 H new ATOM 0 HA ALA A 103 3.124 -6.592 16.246 1.00 0.00 H new ATOM 0 HB1 ALA A 103 2.816 -6.436 18.708 1.00 0.00 H new ATOM 0 HB2 ALA A 103 4.496 -6.857 18.299 1.00 0.00 H new ATOM 0 HB3 ALA A 103 4.088 -5.195 18.787 1.00 0.00 H new ATOM 1258 N ALA A 104 2.754 -3.405 17.050 1.00 0.00 N ATOM 1259 CA ALA A 104 1.748 -2.310 17.011 1.00 0.00 C ATOM 1260 C ALA A 104 1.179 -2.197 15.596 1.00 0.00 C ATOM 1261 O ALA A 104 -0.005 -2.005 15.405 1.00 0.00 O ATOM 1262 CB ALA A 104 2.409 -0.988 17.412 1.00 0.00 C ATOM 0 H ALA A 104 3.691 -3.126 17.340 1.00 0.00 H new ATOM 0 HA ALA A 104 0.941 -2.530 17.710 1.00 0.00 H new ATOM 0 HB1 ALA A 104 1.669 -0.188 17.382 1.00 0.00 H new ATOM 0 HB2 ALA A 104 2.811 -1.074 18.422 1.00 0.00 H new ATOM 0 HB3 ALA A 104 3.218 -0.760 16.718 1.00 0.00 H new ATOM 1268 N TYR A 105 2.013 -2.321 14.601 1.00 0.00 N ATOM 1269 CA TYR A 105 1.523 -2.227 13.202 1.00 0.00 C ATOM 1270 C TYR A 105 0.722 -3.494 12.866 1.00 0.00 C ATOM 1271 O TYR A 105 -0.325 -3.430 12.253 1.00 0.00 O ATOM 1272 CB TYR A 105 2.739 -2.098 12.261 1.00 0.00 C ATOM 1273 CG TYR A 105 3.018 -0.642 11.949 1.00 0.00 C ATOM 1274 CD1 TYR A 105 3.790 0.129 12.825 1.00 0.00 C ATOM 1275 CD2 TYR A 105 2.501 -0.069 10.782 1.00 0.00 C ATOM 1276 CE1 TYR A 105 4.045 1.474 12.534 1.00 0.00 C ATOM 1277 CE2 TYR A 105 2.755 1.276 10.491 1.00 0.00 C ATOM 1278 CZ TYR A 105 3.527 2.048 11.367 1.00 0.00 C ATOM 1279 OH TYR A 105 3.778 3.375 11.080 1.00 0.00 O ATOM 0 H TYR A 105 3.015 -2.484 14.699 1.00 0.00 H new ATOM 0 HA TYR A 105 0.878 -1.357 13.079 1.00 0.00 H new ATOM 0 HB2 TYR A 105 3.615 -2.551 12.726 1.00 0.00 H new ATOM 0 HB3 TYR A 105 2.550 -2.644 11.337 1.00 0.00 H new ATOM 0 HD1 TYR A 105 4.189 -0.314 13.726 1.00 0.00 H new ATOM 0 HD2 TYR A 105 1.906 -0.665 10.106 1.00 0.00 H new ATOM 0 HE1 TYR A 105 4.641 2.069 13.210 1.00 0.00 H new ATOM 0 HE2 TYR A 105 2.355 1.718 9.590 1.00 0.00 H new ATOM 0 HH TYR A 105 3.347 3.614 10.233 1.00 0.00 H new ATOM 1289 N GLN A 106 1.206 -4.641 13.259 1.00 0.00 N ATOM 1290 CA GLN A 106 0.475 -5.898 12.958 1.00 0.00 C ATOM 1291 C GLN A 106 -0.904 -5.857 13.620 1.00 0.00 C ATOM 1292 O GLN A 106 -1.915 -6.094 12.989 1.00 0.00 O ATOM 1293 CB GLN A 106 1.267 -7.083 13.505 1.00 0.00 C ATOM 1294 CG GLN A 106 0.695 -8.378 12.926 1.00 0.00 C ATOM 1295 CD GLN A 106 1.499 -9.575 13.445 1.00 0.00 C ATOM 1296 OE1 GLN A 106 2.393 -10.049 12.773 1.00 0.00 O ATOM 1297 NE2 GLN A 106 1.220 -10.097 14.612 1.00 0.00 N ATOM 0 H GLN A 106 2.077 -4.759 13.776 1.00 0.00 H new ATOM 0 HA GLN A 106 0.356 -6.003 11.880 1.00 0.00 H new ATOM 0 HB2 GLN A 106 2.320 -6.986 13.240 1.00 0.00 H new ATOM 0 HB3 GLN A 106 1.212 -7.101 14.593 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -0.353 -8.482 13.207 1.00 0.00 H new ATOM 0 HG3 GLN A 106 0.731 -8.348 11.837 1.00 0.00 H new ATOM 0 HE21 GLN A 106 0.470 -9.703 15.181 1.00 0.00 H new ATOM 0 HE22 GLN A 106 1.752 -10.898 14.953 1.00 0.00 H new ATOM 1306 N GLN A 107 -0.949 -5.562 14.890 1.00 0.00 N ATOM 1307 CA GLN A 107 -2.251 -5.507 15.603 1.00 0.00 C ATOM 1308 C GLN A 107 -3.201 -4.549 14.879 1.00 0.00 C ATOM 1309 O GLN A 107 -4.378 -4.818 14.738 1.00 0.00 O ATOM 1310 CB GLN A 107 -2.005 -5.014 17.029 1.00 0.00 C ATOM 1311 CG GLN A 107 -3.287 -5.142 17.863 1.00 0.00 C ATOM 1312 CD GLN A 107 -4.198 -3.936 17.614 1.00 0.00 C ATOM 1313 OE1 GLN A 107 -3.832 -3.017 16.909 1.00 0.00 O ATOM 1314 NE2 GLN A 107 -5.378 -3.900 18.170 1.00 0.00 N ATOM 0 H GLN A 107 -0.133 -5.356 15.466 1.00 0.00 H new ATOM 0 HA GLN A 107 -2.704 -6.498 15.625 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -1.204 -5.593 17.489 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -1.677 -3.975 17.011 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -3.809 -6.062 17.603 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -3.037 -5.206 18.922 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -5.686 -4.671 18.762 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -5.992 -3.101 18.012 1.00 0.00 H new ATOM 1323 N LEU A 108 -2.704 -3.432 14.421 1.00 0.00 N ATOM 1324 CA LEU A 108 -3.584 -2.462 13.710 1.00 0.00 C ATOM 1325 C LEU A 108 -3.930 -3.005 12.323 1.00 0.00 C ATOM 1326 O LEU A 108 -4.540 -2.332 11.516 1.00 0.00 O ATOM 1327 CB LEU A 108 -2.858 -1.122 13.574 1.00 0.00 C ATOM 1328 CG LEU A 108 -2.690 -0.484 14.964 1.00 0.00 C ATOM 1329 CD1 LEU A 108 -1.785 0.751 14.854 1.00 0.00 C ATOM 1330 CD2 LEU A 108 -4.064 -0.076 15.538 1.00 0.00 C ATOM 0 H LEU A 108 -1.728 -3.150 14.508 1.00 0.00 H new ATOM 0 HA LEU A 108 -4.503 -2.319 14.278 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.883 -1.270 13.110 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -3.423 -0.455 12.922 1.00 0.00 H new ATOM 0 HG LEU A 108 -2.234 -1.212 15.635 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -1.666 1.203 15.838 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -0.809 0.454 14.470 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -2.237 1.474 14.175 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -3.928 0.374 16.522 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -4.537 0.645 14.871 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -4.698 -0.958 15.627 1.00 0.00 H new ATOM 1342 N GLN A 109 -3.552 -4.221 12.043 1.00 0.00 N ATOM 1343 CA GLN A 109 -3.864 -4.816 10.713 1.00 0.00 C ATOM 1344 C GLN A 109 -3.511 -3.825 9.600 1.00 0.00 C ATOM 1345 O GLN A 109 -4.175 -3.759 8.585 1.00 0.00 O ATOM 1346 CB GLN A 109 -5.356 -5.147 10.642 1.00 0.00 C ATOM 1347 CG GLN A 109 -5.764 -5.931 11.891 1.00 0.00 C ATOM 1348 CD GLN A 109 -7.160 -6.524 11.688 1.00 0.00 C ATOM 1349 OE1 GLN A 109 -8.153 -5.849 11.873 1.00 0.00 O ATOM 1350 NE2 GLN A 109 -7.278 -7.768 11.311 1.00 0.00 N ATOM 0 H GLN A 109 -3.039 -4.830 12.680 1.00 0.00 H new ATOM 0 HA GLN A 109 -3.277 -5.725 10.582 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -5.940 -4.230 10.568 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -5.568 -5.732 9.747 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -5.044 -6.726 12.085 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -5.759 -5.276 12.762 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -6.445 -8.335 11.156 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -8.204 -8.173 11.172 1.00 0.00 H new ATOM 1359 N ARG A 110 -2.466 -3.063 9.772 1.00 0.00 N ATOM 1360 CA ARG A 110 -2.074 -2.095 8.716 1.00 0.00 C ATOM 1361 C ARG A 110 -1.556 -2.873 7.510 1.00 0.00 C ATOM 1362 O ARG A 110 -1.139 -4.007 7.624 1.00 0.00 O ATOM 1363 CB ARG A 110 -0.972 -1.174 9.254 1.00 0.00 C ATOM 1364 CG ARG A 110 -1.548 -0.210 10.312 1.00 0.00 C ATOM 1365 CD ARG A 110 -2.147 1.028 9.633 1.00 0.00 C ATOM 1366 NE ARG A 110 -1.104 1.698 8.805 1.00 0.00 N ATOM 1367 CZ ARG A 110 -1.382 2.808 8.179 1.00 0.00 C ATOM 1368 NH1 ARG A 110 -2.573 3.333 8.278 1.00 0.00 N ATOM 1369 NH2 ARG A 110 -0.469 3.394 7.454 1.00 0.00 N ATOM 0 H ARG A 110 -1.869 -3.071 10.599 1.00 0.00 H new ATOM 0 HA ARG A 110 -2.931 -1.489 8.423 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -0.172 -1.771 9.693 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -0.532 -0.605 8.435 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -2.314 -0.718 10.898 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -0.763 0.091 11.006 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -2.992 0.739 9.008 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -2.528 1.719 10.385 1.00 0.00 H new ATOM 0 HE ARG A 110 -0.173 1.288 8.728 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -3.287 2.875 8.845 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -2.790 4.201 7.788 1.00 0.00 H new ATOM 0 HH21 ARG A 110 0.462 2.984 7.377 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -0.686 4.262 6.964 1.00 0.00 H new ATOM 1383 N GLU A 111 -1.600 -2.281 6.352 1.00 0.00 N ATOM 1384 CA GLU A 111 -1.128 -2.994 5.129 1.00 0.00 C ATOM 1385 C GLU A 111 0.400 -2.903 5.007 1.00 0.00 C ATOM 1386 O GLU A 111 1.052 -3.869 4.655 1.00 0.00 O ATOM 1387 CB GLU A 111 -1.782 -2.369 3.892 1.00 0.00 C ATOM 1388 CG GLU A 111 -3.240 -2.827 3.800 1.00 0.00 C ATOM 1389 CD GLU A 111 -4.004 -2.349 5.037 1.00 0.00 C ATOM 1390 OE1 GLU A 111 -3.792 -1.217 5.440 1.00 0.00 O ATOM 1391 OE2 GLU A 111 -4.787 -3.125 5.561 1.00 0.00 O ATOM 0 H GLU A 111 -1.942 -1.333 6.196 1.00 0.00 H new ATOM 0 HA GLU A 111 -1.408 -4.045 5.204 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -1.734 -1.282 3.952 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -1.240 -2.663 2.993 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -3.702 -2.427 2.897 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -3.287 -3.914 3.728 1.00 0.00 H new ATOM 1398 N THR A 112 0.981 -1.754 5.273 1.00 0.00 N ATOM 1399 CA THR A 112 2.470 -1.610 5.144 1.00 0.00 C ATOM 1400 C THR A 112 3.042 -0.887 6.360 1.00 0.00 C ATOM 1401 O THR A 112 2.319 -0.456 7.237 1.00 0.00 O ATOM 1402 CB THR A 112 2.778 -0.776 3.900 1.00 0.00 C ATOM 1403 OG1 THR A 112 2.025 0.429 3.953 1.00 0.00 O ATOM 1404 CG2 THR A 112 2.405 -1.551 2.625 1.00 0.00 C ATOM 0 H THR A 112 0.490 -0.912 5.573 1.00 0.00 H new ATOM 0 HA THR A 112 2.916 -2.602 5.070 1.00 0.00 H new ATOM 0 HB THR A 112 3.845 -0.555 3.876 1.00 0.00 H new ATOM 0 HG1 THR A 112 1.959 0.813 3.054 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.631 -0.942 1.750 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.979 -2.477 2.581 1.00 0.00 H new ATOM 0 HG23 THR A 112 1.340 -1.784 2.639 1.00 0.00 H new ATOM 1412 N ILE A 113 4.346 -0.741 6.408 1.00 0.00 N ATOM 1413 CA ILE A 113 4.989 -0.027 7.563 1.00 0.00 C ATOM 1414 C ILE A 113 6.144 0.859 7.054 1.00 0.00 C ATOM 1415 O ILE A 113 6.884 0.440 6.184 1.00 0.00 O ATOM 1416 CB ILE A 113 5.563 -1.049 8.554 1.00 0.00 C ATOM 1417 CG1 ILE A 113 5.975 -0.321 9.838 1.00 0.00 C ATOM 1418 CG2 ILE A 113 6.795 -1.741 7.949 1.00 0.00 C ATOM 1419 CD1 ILE A 113 6.337 -1.344 10.916 1.00 0.00 C ATOM 0 H ILE A 113 4.994 -1.084 5.699 1.00 0.00 H new ATOM 0 HA ILE A 113 4.235 0.588 8.055 1.00 0.00 H new ATOM 0 HB ILE A 113 4.805 -1.801 8.773 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.826 0.331 9.641 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.160 0.315 10.185 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.193 -2.464 8.661 1.00 0.00 H new ATOM 0 HG22 ILE A 113 6.509 -2.256 7.032 1.00 0.00 H new ATOM 0 HG23 ILE A 113 7.558 -0.995 7.724 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.630 -0.824 11.828 1.00 0.00 H new ATOM 0 HD12 ILE A 113 5.474 -1.978 11.121 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.166 -1.961 10.569 1.00 0.00 H new ATOM 1431 N PRO A 114 6.347 2.054 7.590 1.00 0.00 N ATOM 1432 CA PRO A 114 7.485 2.910 7.145 1.00 0.00 C ATOM 1433 C PRO A 114 8.825 2.288 7.561 1.00 0.00 C ATOM 1434 O PRO A 114 9.011 1.897 8.696 1.00 0.00 O ATOM 1435 CB PRO A 114 7.263 4.263 7.858 1.00 0.00 C ATOM 1436 CG PRO A 114 5.866 4.210 8.399 1.00 0.00 C ATOM 1437 CD PRO A 114 5.559 2.735 8.643 1.00 0.00 C ATOM 0 HA PRO A 114 7.520 3.019 6.061 1.00 0.00 H new ATOM 0 HB2 PRO A 114 7.988 4.407 8.659 1.00 0.00 H new ATOM 0 HB3 PRO A 114 7.383 5.096 7.165 1.00 0.00 H new ATOM 0 HG2 PRO A 114 5.785 4.782 9.323 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.158 4.643 7.692 1.00 0.00 H new ATOM 0 HD2 PRO A 114 5.861 2.419 9.642 1.00 0.00 H new ATOM 0 HD3 PRO A 114 4.494 2.523 8.551 1.00 0.00 H new ATOM 1445 N ALA A 115 9.752 2.189 6.655 1.00 0.00 N ATOM 1446 CA ALA A 115 11.073 1.588 6.998 1.00 0.00 C ATOM 1447 C ALA A 115 12.149 2.158 6.074 1.00 0.00 C ATOM 1448 O ALA A 115 11.972 2.244 4.874 1.00 0.00 O ATOM 1449 CB ALA A 115 11.003 0.071 6.820 1.00 0.00 C ATOM 0 H ALA A 115 9.655 2.498 5.688 1.00 0.00 H new ATOM 0 HA ALA A 115 11.321 1.823 8.033 1.00 0.00 H new ATOM 0 HB1 ALA A 115 11.968 -0.370 7.070 1.00 0.00 H new ATOM 0 HB2 ALA A 115 10.236 -0.338 7.478 1.00 0.00 H new ATOM 0 HB3 ALA A 115 10.755 -0.163 5.785 1.00 0.00 H new ATOM 1455 N LYS A 116 13.264 2.551 6.626 1.00 0.00 N ATOM 1456 CA LYS A 116 14.352 3.115 5.787 1.00 0.00 C ATOM 1457 C LYS A 116 15.089 1.975 5.083 1.00 0.00 C ATOM 1458 O LYS A 116 15.648 1.101 5.715 1.00 0.00 O ATOM 1459 CB LYS A 116 15.334 3.892 6.681 1.00 0.00 C ATOM 1460 CG LYS A 116 16.060 4.953 5.855 1.00 0.00 C ATOM 1461 CD LYS A 116 16.962 5.794 6.766 1.00 0.00 C ATOM 1462 CE LYS A 116 18.087 4.927 7.348 1.00 0.00 C ATOM 1463 NZ LYS A 116 19.231 5.799 7.738 1.00 0.00 N ATOM 0 H LYS A 116 13.466 2.505 7.625 1.00 0.00 H new ATOM 0 HA LYS A 116 13.931 3.789 5.042 1.00 0.00 H new ATOM 0 HB2 LYS A 116 14.796 4.364 7.503 1.00 0.00 H new ATOM 0 HB3 LYS A 116 16.056 3.207 7.124 1.00 0.00 H new ATOM 0 HG2 LYS A 116 16.657 4.476 5.077 1.00 0.00 H new ATOM 0 HG3 LYS A 116 15.336 5.594 5.353 1.00 0.00 H new ATOM 0 HD2 LYS A 116 17.388 6.624 6.202 1.00 0.00 H new ATOM 0 HD3 LYS A 116 16.372 6.227 7.574 1.00 0.00 H new ATOM 0 HE2 LYS A 116 17.724 4.375 8.215 1.00 0.00 H new ATOM 0 HE3 LYS A 116 18.411 4.190 6.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 19.995 5.214 8.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 19.581 6.307 6.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 18.916 6.486 8.453 1.00 0.00 H new ATOM 1477 N LEU A 117 15.106 1.981 3.781 1.00 0.00 N ATOM 1478 CA LEU A 117 15.822 0.896 3.050 1.00 0.00 C ATOM 1479 C LEU A 117 17.322 1.186 3.076 1.00 0.00 C ATOM 1480 O LEU A 117 17.756 2.298 2.846 1.00 0.00 O ATOM 1481 CB LEU A 117 15.346 0.822 1.595 1.00 0.00 C ATOM 1482 CG LEU A 117 13.820 0.649 1.532 1.00 0.00 C ATOM 1483 CD1 LEU A 117 13.391 0.471 0.068 1.00 0.00 C ATOM 1484 CD2 LEU A 117 13.390 -0.586 2.339 1.00 0.00 C ATOM 0 H LEU A 117 14.659 2.684 3.193 1.00 0.00 H new ATOM 0 HA LEU A 117 15.612 -0.057 3.535 1.00 0.00 H new ATOM 0 HB2 LEU A 117 15.637 1.729 1.065 1.00 0.00 H new ATOM 0 HB3 LEU A 117 15.833 -0.012 1.090 1.00 0.00 H new ATOM 0 HG LEU A 117 13.345 1.533 1.956 1.00 0.00 H new ATOM 0 HD11 LEU A 117 12.309 0.348 0.018 1.00 0.00 H new ATOM 0 HD12 LEU A 117 13.683 1.350 -0.506 1.00 0.00 H new ATOM 0 HD13 LEU A 117 13.876 -0.412 -0.349 1.00 0.00 H new ATOM 0 HD21 LEU A 117 12.307 -0.696 2.286 1.00 0.00 H new ATOM 0 HD22 LEU A 117 13.866 -1.475 1.925 1.00 0.00 H new ATOM 0 HD23 LEU A 117 13.691 -0.464 3.379 1.00 0.00 H new ATOM 1496 N VAL A 118 18.113 0.186 3.363 1.00 0.00 N ATOM 1497 CA VAL A 118 19.597 0.363 3.424 1.00 0.00 C ATOM 1498 C VAL A 118 20.263 -0.664 2.510 1.00 0.00 C ATOM 1499 O VAL A 118 20.341 -1.833 2.833 1.00 0.00 O ATOM 1500 CB VAL A 118 20.059 0.142 4.873 1.00 0.00 C ATOM 1501 CG1 VAL A 118 21.577 -0.064 4.929 1.00 0.00 C ATOM 1502 CG2 VAL A 118 19.683 1.362 5.715 1.00 0.00 C ATOM 0 H VAL A 118 17.790 -0.761 3.561 1.00 0.00 H new ATOM 0 HA VAL A 118 19.871 1.366 3.098 1.00 0.00 H new ATOM 0 HB VAL A 118 19.569 -0.749 5.266 1.00 0.00 H new ATOM 0 HG11 VAL A 118 21.885 -0.219 5.963 1.00 0.00 H new ATOM 0 HG12 VAL A 118 21.848 -0.937 4.335 1.00 0.00 H new ATOM 0 HG13 VAL A 118 22.079 0.817 4.529 1.00 0.00 H new ATOM 0 HG21 VAL A 118 20.009 1.209 6.744 1.00 0.00 H new ATOM 0 HG22 VAL A 118 20.169 2.249 5.308 1.00 0.00 H new ATOM 0 HG23 VAL A 118 18.602 1.499 5.694 1.00 0.00 H new ATOM 1512 N GLN A 119 20.758 -0.246 1.379 1.00 0.00 N ATOM 1513 CA GLN A 119 21.426 -1.225 0.481 1.00 0.00 C ATOM 1514 C GLN A 119 22.542 -1.914 1.277 1.00 0.00 C ATOM 1515 O GLN A 119 23.385 -1.265 1.865 1.00 0.00 O ATOM 1516 CB GLN A 119 22.013 -0.498 -0.746 1.00 0.00 C ATOM 1517 CG GLN A 119 22.252 -1.473 -1.913 1.00 0.00 C ATOM 1518 CD GLN A 119 23.018 -2.703 -1.420 1.00 0.00 C ATOM 1519 OE1 GLN A 119 24.225 -2.658 -1.284 1.00 0.00 O ATOM 1520 NE2 GLN A 119 22.379 -3.806 -1.144 1.00 0.00 N ATOM 0 H GLN A 119 20.730 0.716 1.042 1.00 0.00 H new ATOM 0 HA GLN A 119 20.709 -1.965 0.125 1.00 0.00 H new ATOM 0 HB2 GLN A 119 21.332 0.292 -1.063 1.00 0.00 H new ATOM 0 HB3 GLN A 119 22.953 -0.018 -0.472 1.00 0.00 H new ATOM 0 HG2 GLN A 119 21.298 -1.777 -2.344 1.00 0.00 H new ATOM 0 HG3 GLN A 119 22.815 -0.976 -2.703 1.00 0.00 H new ATOM 0 HE21 GLN A 119 21.366 -3.850 -1.256 1.00 0.00 H new ATOM 0 HE22 GLN A 119 22.892 -4.624 -0.816 1.00 0.00 H new ATOM 1529 N SER A 120 22.542 -3.224 1.316 1.00 0.00 N ATOM 1530 CA SER A 120 23.588 -3.970 2.093 1.00 0.00 C ATOM 1531 C SER A 120 24.152 -5.115 1.244 1.00 0.00 C ATOM 1532 O SER A 120 23.779 -5.298 0.104 1.00 0.00 O ATOM 1533 CB SER A 120 22.948 -4.541 3.363 1.00 0.00 C ATOM 1534 OG SER A 120 22.854 -3.519 4.344 1.00 0.00 O ATOM 0 H SER A 120 21.859 -3.814 0.841 1.00 0.00 H new ATOM 0 HA SER A 120 24.400 -3.293 2.357 1.00 0.00 H new ATOM 0 HB2 SER A 120 21.958 -4.937 3.138 1.00 0.00 H new ATOM 0 HB3 SER A 120 23.544 -5.371 3.742 1.00 0.00 H new ATOM 0 HG SER A 120 23.668 -3.514 4.890 1.00 0.00 H new ATOM 1540 N THR A 121 25.058 -5.884 1.800 1.00 0.00 N ATOM 1541 CA THR A 121 25.670 -7.024 1.047 1.00 0.00 C ATOM 1542 C THR A 121 25.526 -8.308 1.868 1.00 0.00 C ATOM 1543 O THR A 121 25.304 -8.274 3.063 1.00 0.00 O ATOM 1544 CB THR A 121 27.155 -6.732 0.816 1.00 0.00 C ATOM 1545 OG1 THR A 121 27.725 -6.219 2.012 1.00 0.00 O ATOM 1546 CG2 THR A 121 27.308 -5.704 -0.306 1.00 0.00 C ATOM 0 H THR A 121 25.403 -5.769 2.753 1.00 0.00 H new ATOM 0 HA THR A 121 25.166 -7.146 0.088 1.00 0.00 H new ATOM 0 HB THR A 121 27.667 -7.652 0.533 1.00 0.00 H new ATOM 0 HG1 THR A 121 28.676 -6.033 1.867 1.00 0.00 H new ATOM 0 HG21 THR A 121 28.366 -5.498 -0.469 1.00 0.00 H new ATOM 0 HG22 THR A 121 26.870 -6.098 -1.223 1.00 0.00 H new ATOM 0 HG23 THR A 121 26.797 -4.782 -0.027 1.00 0.00 H new ATOM 1554 N LEU A 122 25.644 -9.444 1.241 1.00 0.00 N ATOM 1555 CA LEU A 122 25.503 -10.715 2.006 1.00 0.00 C ATOM 1556 C LEU A 122 26.479 -10.710 3.192 1.00 0.00 C ATOM 1557 O LEU A 122 26.185 -11.242 4.244 1.00 0.00 O ATOM 1558 CB LEU A 122 25.789 -11.918 1.092 1.00 0.00 C ATOM 1559 CG LEU A 122 25.407 -13.229 1.804 1.00 0.00 C ATOM 1560 CD1 LEU A 122 23.879 -13.324 1.987 1.00 0.00 C ATOM 1561 CD2 LEU A 122 25.889 -14.414 0.961 1.00 0.00 C ATOM 0 H LEU A 122 25.830 -9.549 0.244 1.00 0.00 H new ATOM 0 HA LEU A 122 24.482 -10.797 2.380 1.00 0.00 H new ATOM 0 HB2 LEU A 122 25.225 -11.822 0.164 1.00 0.00 H new ATOM 0 HB3 LEU A 122 26.845 -11.936 0.822 1.00 0.00 H new ATOM 0 HG LEU A 122 25.878 -13.247 2.787 1.00 0.00 H new ATOM 0 HD11 LEU A 122 23.630 -14.257 2.492 1.00 0.00 H new ATOM 0 HD12 LEU A 122 23.531 -12.483 2.587 1.00 0.00 H new ATOM 0 HD13 LEU A 122 23.393 -13.299 1.011 1.00 0.00 H new ATOM 0 HD21 LEU A 122 25.622 -15.347 1.458 1.00 0.00 H new ATOM 0 HD22 LEU A 122 25.417 -14.378 -0.021 1.00 0.00 H new ATOM 0 HD23 LEU A 122 26.972 -14.361 0.845 1.00 0.00 H new ATOM 1573 N SER A 123 27.632 -10.108 3.041 1.00 0.00 N ATOM 1574 CA SER A 123 28.605 -10.068 4.171 1.00 0.00 C ATOM 1575 C SER A 123 27.929 -9.446 5.396 1.00 0.00 C ATOM 1576 O SER A 123 28.067 -9.925 6.503 1.00 0.00 O ATOM 1577 CB SER A 123 29.817 -9.225 3.773 1.00 0.00 C ATOM 1578 OG SER A 123 30.413 -9.773 2.607 1.00 0.00 O ATOM 0 H SER A 123 27.939 -9.644 2.186 1.00 0.00 H new ATOM 0 HA SER A 123 28.932 -11.080 4.408 1.00 0.00 H new ATOM 0 HB2 SER A 123 29.512 -8.195 3.589 1.00 0.00 H new ATOM 0 HB3 SER A 123 30.541 -9.202 4.588 1.00 0.00 H new ATOM 0 HG SER A 123 31.189 -9.232 2.351 1.00 0.00 H new ATOM 1584 N ASP A 124 27.190 -8.387 5.208 1.00 0.00 N ATOM 1585 CA ASP A 124 26.501 -7.751 6.356 1.00 0.00 C ATOM 1586 C ASP A 124 25.593 -8.795 7.021 1.00 0.00 C ATOM 1587 O ASP A 124 25.514 -8.896 8.236 1.00 0.00 O ATOM 1588 CB ASP A 124 25.662 -6.581 5.834 1.00 0.00 C ATOM 1589 CG ASP A 124 26.563 -5.367 5.590 1.00 0.00 C ATOM 1590 OD1 ASP A 124 27.056 -4.816 6.561 1.00 0.00 O ATOM 1591 OD2 ASP A 124 26.742 -5.009 4.438 1.00 0.00 O ATOM 0 H ASP A 124 27.036 -7.937 4.306 1.00 0.00 H new ATOM 0 HA ASP A 124 27.222 -7.382 7.085 1.00 0.00 H new ATOM 0 HB2 ASP A 124 25.160 -6.865 4.909 1.00 0.00 H new ATOM 0 HB3 ASP A 124 24.884 -6.329 6.554 1.00 0.00 H new ATOM 1596 N LEU A 125 24.906 -9.578 6.232 1.00 0.00 N ATOM 1597 CA LEU A 125 24.006 -10.608 6.822 1.00 0.00 C ATOM 1598 C LEU A 125 24.843 -11.627 7.615 1.00 0.00 C ATOM 1599 O LEU A 125 24.400 -12.146 8.616 1.00 0.00 O ATOM 1600 CB LEU A 125 23.189 -11.303 5.702 1.00 0.00 C ATOM 1601 CG LEU A 125 21.746 -11.576 6.169 1.00 0.00 C ATOM 1602 CD1 LEU A 125 20.974 -10.252 6.372 1.00 0.00 C ATOM 1603 CD2 LEU A 125 21.040 -12.433 5.115 1.00 0.00 C ATOM 0 H LEU A 125 24.929 -9.549 5.213 1.00 0.00 H new ATOM 0 HA LEU A 125 23.302 -10.133 7.505 1.00 0.00 H new ATOM 0 HB2 LEU A 125 23.175 -10.674 4.812 1.00 0.00 H new ATOM 0 HB3 LEU A 125 23.670 -12.241 5.423 1.00 0.00 H new ATOM 0 HG LEU A 125 21.773 -12.102 7.123 1.00 0.00 H new ATOM 0 HD11 LEU A 125 19.958 -10.470 6.702 1.00 0.00 H new ATOM 0 HD12 LEU A 125 21.479 -9.649 7.127 1.00 0.00 H new ATOM 0 HD13 LEU A 125 20.940 -9.703 5.431 1.00 0.00 H new ATOM 0 HD21 LEU A 125 20.017 -12.633 5.434 1.00 0.00 H new ATOM 0 HD22 LEU A 125 21.026 -11.901 4.164 1.00 0.00 H new ATOM 0 HD23 LEU A 125 21.574 -13.376 4.996 1.00 0.00 H new ATOM 1615 N ARG A 126 26.052 -11.906 7.194 1.00 0.00 N ATOM 1616 CA ARG A 126 26.895 -12.876 7.958 1.00 0.00 C ATOM 1617 C ARG A 126 27.180 -12.294 9.348 1.00 0.00 C ATOM 1618 O ARG A 126 27.291 -13.016 10.319 1.00 0.00 O ATOM 1619 CB ARG A 126 28.206 -13.127 7.178 1.00 0.00 C ATOM 1620 CG ARG A 126 29.331 -13.658 8.104 1.00 0.00 C ATOM 1621 CD ARG A 126 30.209 -12.499 8.609 1.00 0.00 C ATOM 1622 NE ARG A 126 30.831 -12.880 9.908 1.00 0.00 N ATOM 1623 CZ ARG A 126 31.469 -11.987 10.613 1.00 0.00 C ATOM 1624 NH1 ARG A 126 31.562 -10.759 10.181 1.00 0.00 N ATOM 1625 NH2 ARG A 126 32.014 -12.321 11.751 1.00 0.00 N ATOM 0 H ARG A 126 26.488 -11.508 6.362 1.00 0.00 H new ATOM 0 HA ARG A 126 26.378 -13.828 8.078 1.00 0.00 H new ATOM 0 HB2 ARG A 126 28.022 -13.846 6.379 1.00 0.00 H new ATOM 0 HB3 ARG A 126 28.531 -12.200 6.705 1.00 0.00 H new ATOM 0 HG2 ARG A 126 28.893 -14.186 8.951 1.00 0.00 H new ATOM 0 HG3 ARG A 126 29.945 -14.378 7.563 1.00 0.00 H new ATOM 0 HD2 ARG A 126 30.982 -12.268 7.877 1.00 0.00 H new ATOM 0 HD3 ARG A 126 29.607 -11.599 8.731 1.00 0.00 H new ATOM 0 HE ARG A 126 30.758 -13.840 10.246 1.00 0.00 H new ATOM 0 HH11 ARG A 126 31.136 -10.497 9.292 1.00 0.00 H new ATOM 0 HH12 ARG A 126 32.061 -10.061 10.732 1.00 0.00 H new ATOM 0 HH21 ARG A 126 31.941 -13.281 12.089 1.00 0.00 H new ATOM 0 HH22 ARG A 126 32.513 -11.622 12.302 1.00 0.00 H new ATOM 1639 N VAL A 127 27.282 -10.997 9.459 1.00 0.00 N ATOM 1640 CA VAL A 127 27.538 -10.391 10.791 1.00 0.00 C ATOM 1641 C VAL A 127 26.370 -10.740 11.714 1.00 0.00 C ATOM 1642 O VAL A 127 26.540 -10.939 12.901 1.00 0.00 O ATOM 1643 CB VAL A 127 27.647 -8.871 10.655 1.00 0.00 C ATOM 1644 CG1 VAL A 127 27.894 -8.256 12.033 1.00 0.00 C ATOM 1645 CG2 VAL A 127 28.817 -8.526 9.733 1.00 0.00 C ATOM 0 H VAL A 127 27.199 -10.336 8.687 1.00 0.00 H new ATOM 0 HA VAL A 127 28.471 -10.776 11.203 1.00 0.00 H new ATOM 0 HB VAL A 127 26.722 -8.475 10.236 1.00 0.00 H new ATOM 0 HG11 VAL A 127 27.972 -7.173 11.939 1.00 0.00 H new ATOM 0 HG12 VAL A 127 27.065 -8.504 12.696 1.00 0.00 H new ATOM 0 HG13 VAL A 127 28.821 -8.652 12.447 1.00 0.00 H new ATOM 0 HG21 VAL A 127 28.896 -7.443 9.635 1.00 0.00 H new ATOM 0 HG22 VAL A 127 29.741 -8.921 10.155 1.00 0.00 H new ATOM 0 HG23 VAL A 127 28.649 -8.968 8.751 1.00 0.00 H new ATOM 1655 N TYR A 128 25.176 -10.814 11.175 1.00 0.00 N ATOM 1656 CA TYR A 128 23.988 -11.150 12.026 1.00 0.00 C ATOM 1657 C TYR A 128 23.759 -12.666 12.062 1.00 0.00 C ATOM 1658 O TYR A 128 23.537 -13.244 13.107 1.00 0.00 O ATOM 1659 CB TYR A 128 22.730 -10.502 11.444 1.00 0.00 C ATOM 1660 CG TYR A 128 22.833 -8.998 11.503 1.00 0.00 C ATOM 1661 CD1 TYR A 128 22.527 -8.320 12.688 1.00 0.00 C ATOM 1662 CD2 TYR A 128 23.219 -8.282 10.366 1.00 0.00 C ATOM 1663 CE1 TYR A 128 22.607 -6.923 12.735 1.00 0.00 C ATOM 1664 CE2 TYR A 128 23.301 -6.887 10.412 1.00 0.00 C ATOM 1665 CZ TYR A 128 22.994 -6.206 11.596 1.00 0.00 C ATOM 1666 OH TYR A 128 23.074 -4.829 11.642 1.00 0.00 O ATOM 0 H TYR A 128 24.972 -10.657 10.188 1.00 0.00 H new ATOM 0 HA TYR A 128 24.183 -10.779 13.032 1.00 0.00 H new ATOM 0 HB2 TYR A 128 22.594 -10.823 10.411 1.00 0.00 H new ATOM 0 HB3 TYR A 128 21.853 -10.834 11.999 1.00 0.00 H new ATOM 0 HD1 TYR A 128 22.229 -8.874 13.566 1.00 0.00 H new ATOM 0 HD2 TYR A 128 23.454 -8.807 9.452 1.00 0.00 H new ATOM 0 HE1 TYR A 128 22.370 -6.399 13.649 1.00 0.00 H new ATOM 0 HE2 TYR A 128 23.601 -6.335 9.534 1.00 0.00 H new ATOM 0 HH TYR A 128 23.358 -4.488 10.768 1.00 0.00 H new ATOM 1676 N LEU A 129 23.776 -13.301 10.918 1.00 0.00 N ATOM 1677 CA LEU A 129 23.522 -14.769 10.841 1.00 0.00 C ATOM 1678 C LEU A 129 24.748 -15.488 10.286 1.00 0.00 C ATOM 1679 O LEU A 129 24.635 -16.315 9.407 1.00 0.00 O ATOM 1680 CB LEU A 129 22.370 -15.008 9.873 1.00 0.00 C ATOM 1681 CG LEU A 129 21.102 -14.271 10.324 1.00 0.00 C ATOM 1682 CD1 LEU A 129 19.952 -14.662 9.387 1.00 0.00 C ATOM 1683 CD2 LEU A 129 20.743 -14.643 11.772 1.00 0.00 C ATOM 0 H LEU A 129 23.959 -12.855 10.019 1.00 0.00 H new ATOM 0 HA LEU A 129 23.293 -15.144 11.839 1.00 0.00 H new ATOM 0 HB2 LEU A 129 22.654 -14.671 8.876 1.00 0.00 H new ATOM 0 HB3 LEU A 129 22.167 -16.077 9.803 1.00 0.00 H new ATOM 0 HG LEU A 129 21.275 -13.196 10.283 1.00 0.00 H new ATOM 0 HD11 LEU A 129 19.042 -14.147 9.693 1.00 0.00 H new ATOM 0 HD12 LEU A 129 20.203 -14.378 8.365 1.00 0.00 H new ATOM 0 HD13 LEU A 129 19.793 -15.739 9.436 1.00 0.00 H new ATOM 0 HD21 LEU A 129 19.841 -14.109 12.072 1.00 0.00 H new ATOM 0 HD22 LEU A 129 20.569 -15.717 11.839 1.00 0.00 H new ATOM 0 HD23 LEU A 129 21.565 -14.367 12.433 1.00 0.00 H new ATOM 1695 N GLY A 130 25.909 -15.181 10.773 1.00 0.00 N ATOM 1696 CA GLY A 130 27.134 -15.854 10.256 1.00 0.00 C ATOM 1697 C GLY A 130 27.095 -17.357 10.579 1.00 0.00 C ATOM 1698 O GLY A 130 28.106 -17.952 10.898 1.00 0.00 O ATOM 0 H GLY A 130 26.069 -14.492 11.508 1.00 0.00 H new ATOM 0 HA2 GLY A 130 27.209 -15.709 9.178 1.00 0.00 H new ATOM 0 HA3 GLY A 130 28.020 -15.402 10.701 1.00 0.00 H new ATOM 1702 N ALA A 131 25.946 -17.982 10.493 1.00 0.00 N ATOM 1703 CA ALA A 131 25.864 -19.442 10.789 1.00 0.00 C ATOM 1704 C ALA A 131 24.653 -20.042 10.066 1.00 0.00 C ATOM 1705 O ALA A 131 24.775 -20.998 9.326 1.00 0.00 O ATOM 1706 CB ALA A 131 25.724 -19.651 12.300 1.00 0.00 C ATOM 0 H ALA A 131 25.064 -17.543 10.231 1.00 0.00 H new ATOM 0 HA ALA A 131 26.771 -19.937 10.442 1.00 0.00 H new ATOM 0 HB1 ALA A 131 25.664 -20.718 12.516 1.00 0.00 H new ATOM 0 HB2 ALA A 131 26.590 -19.226 12.808 1.00 0.00 H new ATOM 0 HB3 ALA A 131 24.818 -19.158 12.653 1.00 0.00 H new ATOM 1712 N SER A 132 23.484 -19.488 10.270 1.00 0.00 N ATOM 1713 CA SER A 132 22.260 -20.023 9.593 1.00 0.00 C ATOM 1714 C SER A 132 21.935 -19.159 8.372 1.00 0.00 C ATOM 1715 O SER A 132 20.786 -18.915 8.061 1.00 0.00 O ATOM 1716 CB SER A 132 21.083 -19.981 10.570 1.00 0.00 C ATOM 1717 OG SER A 132 21.398 -20.746 11.724 1.00 0.00 O ATOM 0 H SER A 132 23.323 -18.685 10.878 1.00 0.00 H new ATOM 0 HA SER A 132 22.438 -21.051 9.276 1.00 0.00 H new ATOM 0 HB2 SER A 132 20.867 -18.950 10.852 1.00 0.00 H new ATOM 0 HB3 SER A 132 20.186 -20.376 10.093 1.00 0.00 H new ATOM 0 HG SER A 132 20.645 -20.718 12.351 1.00 0.00 H new ATOM 1723 N THR A 133 22.938 -18.687 7.684 1.00 0.00 N ATOM 1724 CA THR A 133 22.688 -17.830 6.489 1.00 0.00 C ATOM 1725 C THR A 133 22.278 -18.722 5.290 1.00 0.00 C ATOM 1726 O THR A 133 23.061 -19.539 4.847 1.00 0.00 O ATOM 1727 CB THR A 133 23.993 -17.067 6.144 1.00 0.00 C ATOM 1728 OG1 THR A 133 24.887 -17.156 7.242 1.00 0.00 O ATOM 1729 CG2 THR A 133 23.698 -15.590 5.853 1.00 0.00 C ATOM 0 H THR A 133 23.921 -18.857 7.897 1.00 0.00 H new ATOM 0 HA THR A 133 21.887 -17.122 6.699 1.00 0.00 H new ATOM 0 HB THR A 133 24.438 -17.516 5.256 1.00 0.00 H new ATOM 0 HG1 THR A 133 24.567 -16.585 7.971 1.00 0.00 H new ATOM 0 HG21 THR A 133 24.628 -15.074 5.613 1.00 0.00 H new ATOM 0 HG22 THR A 133 23.013 -15.515 5.008 1.00 0.00 H new ATOM 0 HG23 THR A 133 23.243 -15.130 6.730 1.00 0.00 H new ATOM 1737 N PRO A 134 21.086 -18.570 4.747 1.00 0.00 N ATOM 1738 CA PRO A 134 20.642 -19.381 3.577 1.00 0.00 C ATOM 1739 C PRO A 134 21.204 -18.829 2.262 1.00 0.00 C ATOM 1740 O PRO A 134 21.986 -17.899 2.252 1.00 0.00 O ATOM 1741 CB PRO A 134 19.117 -19.253 3.617 1.00 0.00 C ATOM 1742 CG PRO A 134 18.870 -17.898 4.201 1.00 0.00 C ATOM 1743 CD PRO A 134 20.030 -17.630 5.173 1.00 0.00 C ATOM 0 HA PRO A 134 20.989 -20.413 3.626 1.00 0.00 H new ATOM 0 HB2 PRO A 134 18.685 -19.340 2.620 1.00 0.00 H new ATOM 0 HB3 PRO A 134 18.669 -20.036 4.228 1.00 0.00 H new ATOM 0 HG2 PRO A 134 18.834 -17.139 3.420 1.00 0.00 H new ATOM 0 HG3 PRO A 134 17.912 -17.867 4.720 1.00 0.00 H new ATOM 0 HD2 PRO A 134 20.369 -16.596 5.112 1.00 0.00 H new ATOM 0 HD3 PRO A 134 19.732 -17.808 6.206 1.00 0.00 H new ATOM 1751 N ASP A 135 20.805 -19.396 1.155 1.00 0.00 N ATOM 1752 CA ASP A 135 21.296 -18.923 -0.170 1.00 0.00 C ATOM 1753 C ASP A 135 20.198 -18.111 -0.844 1.00 0.00 C ATOM 1754 O ASP A 135 19.064 -18.536 -0.954 1.00 0.00 O ATOM 1755 CB ASP A 135 21.644 -20.126 -1.041 1.00 0.00 C ATOM 1756 CG ASP A 135 22.439 -19.661 -2.262 1.00 0.00 C ATOM 1757 OD1 ASP A 135 22.502 -18.463 -2.483 1.00 0.00 O ATOM 1758 OD2 ASP A 135 22.971 -20.511 -2.957 1.00 0.00 O ATOM 0 H ASP A 135 20.151 -20.177 1.113 1.00 0.00 H new ATOM 0 HA ASP A 135 22.184 -18.305 -0.036 1.00 0.00 H new ATOM 0 HB2 ASP A 135 22.227 -20.847 -0.468 1.00 0.00 H new ATOM 0 HB3 ASP A 135 20.733 -20.633 -1.359 1.00 0.00 H new ATOM 1763 N LEU A 136 20.532 -16.940 -1.282 1.00 0.00 N ATOM 1764 CA LEU A 136 19.527 -16.057 -1.946 1.00 0.00 C ATOM 1765 C LEU A 136 19.530 -16.289 -3.460 1.00 0.00 C ATOM 1766 O LEU A 136 20.566 -16.427 -4.079 1.00 0.00 O ATOM 1767 CB LEU A 136 19.878 -14.596 -1.662 1.00 0.00 C ATOM 1768 CG LEU A 136 19.831 -14.320 -0.156 1.00 0.00 C ATOM 1769 CD1 LEU A 136 20.261 -12.870 0.093 1.00 0.00 C ATOM 1770 CD2 LEU A 136 18.406 -14.536 0.379 1.00 0.00 C ATOM 0 H LEU A 136 21.469 -16.544 -1.211 1.00 0.00 H new ATOM 0 HA LEU A 136 18.537 -16.290 -1.554 1.00 0.00 H new ATOM 0 HB2 LEU A 136 20.872 -14.372 -2.049 1.00 0.00 H new ATOM 0 HB3 LEU A 136 19.179 -13.940 -2.181 1.00 0.00 H new ATOM 0 HG LEU A 136 20.504 -15.004 0.361 1.00 0.00 H new ATOM 0 HD11 LEU A 136 20.232 -12.660 1.162 1.00 0.00 H new ATOM 0 HD12 LEU A 136 21.275 -12.722 -0.278 1.00 0.00 H new ATOM 0 HD13 LEU A 136 19.582 -12.195 -0.428 1.00 0.00 H new ATOM 0 HD21 LEU A 136 18.386 -14.337 1.450 1.00 0.00 H new ATOM 0 HD22 LEU A 136 17.720 -13.858 -0.129 1.00 0.00 H new ATOM 0 HD23 LEU A 136 18.101 -15.566 0.196 1.00 0.00 H new ATOM 1782 N GLN A 137 18.362 -16.323 -4.054 1.00 0.00 N ATOM 1783 CA GLN A 137 18.245 -16.538 -5.530 1.00 0.00 C ATOM 1784 C GLN A 137 17.346 -15.451 -6.130 1.00 0.00 C ATOM 1785 O GLN A 137 17.665 -14.286 -5.962 1.00 0.00 O ATOM 1786 CB GLN A 137 17.624 -17.915 -5.792 1.00 0.00 C ATOM 1787 CG GLN A 137 18.230 -18.943 -4.835 1.00 0.00 C ATOM 1788 CD GLN A 137 19.755 -18.948 -4.989 1.00 0.00 C ATOM 1789 OE1 GLN A 137 20.514 -18.837 -3.931 1.00 0.00 O flip ATOM 1790 NE2 GLN A 137 20.262 -19.055 -6.088 1.00 0.00 N flip ATOM 1791 OXT GLN A 137 16.356 -15.804 -6.749 1.00 0.00 O ATOM 0 H GLN A 137 17.471 -16.209 -3.571 1.00 0.00 H new ATOM 0 HA GLN A 137 19.233 -16.489 -5.989 1.00 0.00 H new ATOM 0 HB2 GLN A 137 16.543 -17.869 -5.656 1.00 0.00 H new ATOM 0 HB3 GLN A 137 17.803 -18.215 -6.825 1.00 0.00 H new ATOM 0 HG2 GLN A 137 17.958 -18.703 -3.807 1.00 0.00 H new ATOM 0 HG3 GLN A 137 17.829 -19.934 -5.048 1.00 0.00 H new ATOM 0 HE21 GLN A 137 19.672 -19.142 -6.916 1.00 0.00 H new ATOM 0 HE22 GLN A 137 21.278 -19.058 -6.183 1.00 0.00 H new TER 1800 GLN A 137 HETATM 1801 MG MG A 2 17.164 -1.134 24.616 1.00 0.00 MG HETATM 1802 PG ATP A 1 11.833 -2.623 19.655 1.00 0.00 P HETATM 1803 O1G ATP A 1 11.685 -3.838 20.520 1.00 0.00 O HETATM 1804 O2G ATP A 1 10.555 -2.239 18.979 1.00 0.00 O HETATM 1805 O3G ATP A 1 13.081 -2.549 18.826 1.00 0.00 O HETATM 1806 PB ATP A 1 12.923 -0.274 21.980 1.00 0.00 P HETATM 1807 O1B ATP A 1 11.962 0.443 22.873 1.00 0.00 O HETATM 1808 O2B ATP A 1 13.891 -1.127 22.732 1.00 0.00 O HETATM 1809 O3B ATP A 1 12.002 -1.266 20.916 1.00 0.00 O HETATM 1810 PA ATP A 1 13.708 2.160 20.048 1.00 0.00 P HETATM 1811 O1A ATP A 1 14.526 1.828 18.868 1.00 0.00 O HETATM 1812 O2A ATP A 1 14.065 3.428 20.714 1.00 0.00 O HETATM 1813 O3A ATP A 1 13.883 0.911 21.185 1.00 0.00 O HETATM 1814 O5' ATP A 1 12.124 2.316 19.496 1.00 0.00 O HETATM 1815 C5' ATP A 1 11.115 2.938 20.276 1.00 0.00 C HETATM 1816 C4' ATP A 1 11.160 4.483 20.148 1.00 0.00 C HETATM 1817 O4' ATP A 1 9.885 4.962 19.730 1.00 0.00 O HETATM 1818 C3' ATP A 1 11.475 5.227 21.463 1.00 0.00 C HETATM 1819 O3' ATP A 1 12.872 5.492 21.616 1.00 0.00 O HETATM 1820 C2' ATP A 1 10.698 6.538 21.354 1.00 0.00 C HETATM 1821 O2' ATP A 1 11.637 7.543 21.007 1.00 0.00 O HETATM 1822 C1' ATP A 1 9.677 6.284 20.229 1.00 0.00 C HETATM 1823 N9 ATP A 1 8.279 6.436 20.694 1.00 0.00 N HETATM 1824 C8 ATP A 1 7.382 7.431 20.366 1.00 0.00 C HETATM 1825 N7 ATP A 1 6.208 7.329 20.934 1.00 0.00 N HETATM 1826 C5 ATP A 1 6.320 6.194 21.728 1.00 0.00 C HETATM 1827 C6 ATP A 1 5.458 5.525 22.630 1.00 0.00 C HETATM 1828 N6 ATP A 1 4.216 5.941 22.891 1.00 0.00 N HETATM 1829 N1 ATP A 1 5.913 4.427 23.276 1.00 0.00 N HETATM 1830 C2 ATP A 1 7.164 4.002 23.049 1.00 0.00 C HETATM 1831 N3 ATP A 1 8.091 4.535 22.249 1.00 0.00 N HETATM 1832 C4 ATP A 1 7.618 5.634 21.596 1.00 0.00 C HETATM 0 HO3' ATP A 1 13.383 4.907 21.019 1.00 0.00 H new HETATM 0 HO2' ATP A 1 12.536 7.256 21.272 1.00 0.00 H new HETATM 0 HN62 ATP A 1 3.633 5.424 23.549 1.00 0.00 H new HETATM 0 HN61 ATP A 1 3.851 6.775 22.432 1.00 0.00 H new HETATM 0 H5'2 ATP A 1 10.137 2.575 19.961 1.00 0.00 H new HETATM 0 H5'1 ATP A 1 11.238 2.656 21.322 1.00 0.00 H new HETATM 0 H8 ATP A 1 7.633 8.243 19.683 1.00 0.00 H new HETATM 0 H4' ATP A 1 11.960 4.681 19.435 1.00 0.00 H new HETATM 0 H3' ATP A 1 11.194 4.630 22.331 1.00 0.00 H new HETATM 0 H2' ATP A 1 10.187 6.854 22.263 1.00 0.00 H new HETATM 0 H2 ATP A 1 7.464 3.103 23.588 1.00 0.00 H new HETATM 0 H1' ATP A 1 9.830 7.026 19.445 1.00 0.00 H new