USER MOD reduce.3.24.130724 H: found=0, std=0, add=1103, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1103 hydrogens (55 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 86 TYR OH : rot 180:sc= -0.0788 USER MOD Set 1.2: A 90 GLN : amide:sc= -0.365 K(o=-0.44,f=-1.9) USER MOD Set 2.1: A 65 GLN : amide:sc=-0.00708 X(o=-0.59,f=-0.58) USER MOD Set 2.2: A 79 TYR OH : rot 180:sc= -0.581 USER MOD Set 3.1: A 59 GLN : amide:sc= 0 X(o=0,f=0.31) USER MOD Set 3.2: A 63 GLN : amide:sc= 0 X(o=0,f=0.31) USER MOD Set 4.1: A 29 TYR OH : rot -88:sc= 1.1 USER MOD Set 4.2: A 97 THR OG1 : rot -119:sc= 0.494 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot -170:sc= -0.142 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.314) USER MOD Single : A 28 GLN : amide:sc= -2.38 K(o=-2.4,f=-3.6) USER MOD Single : A 30 LYS NZ :NH3+ -157:sc= -0.76 (180deg=-1.93!) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HD1:sc= -1.94 K(o=-1.9,f=-8.2!) USER MOD Single : A 38 SER OG : rot 180:sc= -3.67! USER MOD Single : A 47 ASN : amide:sc= -1.02 K(o=-1,f=-1.6) USER MOD Single : A 53 THR OG1 : rot -27:sc= 1.61 USER MOD Single : A 54 SER OG : rot 146:sc= 1.25 USER MOD Single : A 57 CYS SG : rot 180:sc= -0.389 USER MOD Single : A 67 SER OG : rot 99:sc= 0.876 USER MOD Single : A 69 GLN : amide:sc= -0.0461 X(o=-0.046,f=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc= 0.086 USER MOD Single : A 77 SER OG : rot -83:sc= 1.23 USER MOD Single : A 80 ASN : amide:sc= -5.09! C(o=-5.1!,f=-5.6!) USER MOD Single : A 81 THR OG1 : rot 180:sc= -0.564 USER MOD Single : A 87 CYS SG : rot 83:sc= -0.208 USER MOD Single : A 89 HIS : no HE2:sc= -0.427 K(o=0.26,f=-3.8!) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 GLN : amide:sc= -0.198 K(o=-0.2,f=-2.1!) USER MOD Single : A 109 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 6:sc= 0.614 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN : amide:sc= -0.392 K(o=-0.39,f=-1.2) USER MOD Single : A 117 GLN : amide:sc= -0.0846 K(o=-0.085,f=-2.2) USER MOD Single : A 122 THR OG1 : rot -103:sc= 0.994 USER MOD Single : A 124 ASN : amide:sc= -0.207 K(o=-0.21,f=-1.5) USER MOD Single : A 125 ASN : amide:sc= -0.173 K(o=-0.17,f=-0.82) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 GLN : amide:sc= -0.0036 K(o=-0.0036,f=-1.1) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 130 GLN : amide:sc= -0.0788 X(o=-0.079,f=0) USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 300 PBU O2 : rot -156:sc= 0.0696 USER MOD Single : A 300 PBU O3 : rot 170:sc= 0.0842 USER MOD Single : A 300 PBU O6 : rot 25:sc= 0.0923 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 9.017 1.905 -22.368 1.00 10.04 N ATOM 2 CA GLY A 2 8.383 1.293 -21.214 1.00 14.40 C ATOM 3 C GLY A 2 9.120 1.592 -19.923 1.00 44.41 C ATOM 4 O GLY A 2 10.253 2.072 -19.943 1.00 42.34 O ATOM 0 HA2 GLY A 2 7.357 1.651 -21.134 1.00 14.40 H new ATOM 0 HA3 GLY A 2 8.334 0.214 -21.360 1.00 14.40 H new ATOM 8 N ALA A 3 8.475 1.309 -18.796 1.00 4.12 N ATOM 9 CA ALA A 3 9.075 1.548 -17.490 1.00 53.42 C ATOM 10 C ALA A 3 10.005 0.406 -17.095 1.00 3.45 C ATOM 11 O ALA A 3 11.052 0.628 -16.486 1.00 42.23 O ATOM 12 CB ALA A 3 7.993 1.739 -16.438 1.00 54.22 C ATOM 0 H ALA A 3 7.535 0.913 -18.762 1.00 4.12 H new ATOM 0 HA ALA A 3 9.669 2.460 -17.553 1.00 53.42 H new ATOM 0 HB1 ALA A 3 8.456 1.917 -15.468 1.00 54.22 H new ATOM 0 HB2 ALA A 3 7.372 2.594 -16.706 1.00 54.22 H new ATOM 0 HB3 ALA A 3 7.374 0.843 -16.386 1.00 54.22 H new ATOM 18 N ARG A 4 9.615 -0.816 -17.443 1.00 61.34 N ATOM 19 CA ARG A 4 10.413 -1.993 -17.123 1.00 30.32 C ATOM 20 C ARG A 4 10.660 -2.089 -15.621 1.00 23.44 C ATOM 21 O ARG A 4 11.708 -1.676 -15.126 1.00 53.43 O ATOM 22 CB ARG A 4 11.748 -1.950 -17.869 1.00 34.23 C ATOM 23 CG ARG A 4 12.438 -3.300 -17.961 1.00 33.02 C ATOM 24 CD ARG A 4 12.145 -3.986 -19.286 1.00 13.33 C ATOM 25 NE ARG A 4 13.363 -4.250 -20.047 1.00 62.10 N ATOM 26 CZ ARG A 4 13.367 -4.612 -21.326 1.00 11.13 C ATOM 27 NH1 ARG A 4 12.224 -4.752 -21.982 1.00 25.30 N ATOM 28 NH2 ARG A 4 14.516 -4.834 -21.949 1.00 43.15 N ATOM 0 H ARG A 4 8.751 -1.017 -17.947 1.00 61.34 H new ATOM 0 HA ARG A 4 9.857 -2.875 -17.440 1.00 30.32 H new ATOM 0 HB2 ARG A 4 11.580 -1.568 -18.876 1.00 34.23 H new ATOM 0 HB3 ARG A 4 12.412 -1.246 -17.368 1.00 34.23 H new ATOM 0 HG2 ARG A 4 13.514 -3.168 -17.848 1.00 33.02 H new ATOM 0 HG3 ARG A 4 12.107 -3.936 -17.140 1.00 33.02 H new ATOM 0 HD2 ARG A 4 11.623 -4.925 -19.100 1.00 13.33 H new ATOM 0 HD3 ARG A 4 11.476 -3.361 -19.878 1.00 13.33 H new ATOM 0 HE ARG A 4 14.260 -4.151 -19.571 1.00 62.10 H new ATOM 0 HH11 ARG A 4 11.338 -4.582 -21.505 1.00 25.30 H new ATOM 0 HH12 ARG A 4 12.230 -5.030 -22.963 1.00 25.30 H new ATOM 0 HH21 ARG A 4 15.397 -4.727 -21.447 1.00 43.15 H new ATOM 0 HH22 ARG A 4 14.519 -5.112 -22.930 1.00 43.15 H new ATOM 42 N ALA A 5 9.687 -2.638 -14.900 1.00 41.00 N ATOM 43 CA ALA A 5 9.800 -2.791 -13.455 1.00 74.33 C ATOM 44 C ALA A 5 8.813 -3.829 -12.934 1.00 22.41 C ATOM 45 O ALA A 5 9.181 -4.722 -12.171 1.00 45.10 O ATOM 46 CB ALA A 5 9.575 -1.453 -12.765 1.00 22.32 C ATOM 0 H ALA A 5 8.812 -2.984 -15.294 1.00 41.00 H new ATOM 0 HA ALA A 5 10.807 -3.141 -13.228 1.00 74.33 H new ATOM 0 HB1 ALA A 5 9.662 -1.581 -11.686 1.00 22.32 H new ATOM 0 HB2 ALA A 5 10.322 -0.737 -13.107 1.00 22.32 H new ATOM 0 HB3 ALA A 5 8.579 -1.082 -13.007 1.00 22.32 H new ATOM 52 N SER A 6 7.556 -3.706 -13.349 1.00 63.22 N ATOM 53 CA SER A 6 6.515 -4.633 -12.921 1.00 35.44 C ATOM 54 C SER A 6 5.249 -4.450 -13.754 1.00 34.34 C ATOM 55 O SER A 6 5.104 -3.464 -14.476 1.00 35.12 O ATOM 56 CB SER A 6 6.198 -4.426 -11.438 1.00 60.21 C ATOM 57 OG SER A 6 6.106 -3.047 -11.124 1.00 3.42 O ATOM 0 H SER A 6 7.234 -2.973 -13.981 1.00 63.22 H new ATOM 0 HA SER A 6 6.883 -5.648 -13.069 1.00 35.44 H new ATOM 0 HB2 SER A 6 5.259 -4.922 -11.191 1.00 60.21 H new ATOM 0 HB3 SER A 6 6.974 -4.890 -10.829 1.00 60.21 H new ATOM 0 HG SER A 6 5.901 -2.941 -10.171 1.00 3.42 H new ATOM 63 N VAL A 7 4.335 -5.409 -13.647 1.00 11.11 N ATOM 64 CA VAL A 7 3.080 -5.354 -14.387 1.00 45.45 C ATOM 65 C VAL A 7 2.049 -4.499 -13.662 1.00 12.35 C ATOM 66 O VAL A 7 1.610 -3.467 -14.174 1.00 5.31 O ATOM 67 CB VAL A 7 2.498 -6.763 -14.608 1.00 64.22 C ATOM 68 CG1 VAL A 7 1.196 -6.687 -15.391 1.00 72.20 C ATOM 69 CG2 VAL A 7 3.507 -7.651 -15.322 1.00 41.03 C ATOM 0 H VAL A 7 4.440 -6.233 -13.055 1.00 11.11 H new ATOM 0 HA VAL A 7 3.303 -4.904 -15.354 1.00 45.45 H new ATOM 0 HB VAL A 7 2.284 -7.205 -13.635 1.00 64.22 H new ATOM 0 HG11 VAL A 7 0.800 -7.692 -15.537 1.00 72.20 H new ATOM 0 HG12 VAL A 7 0.473 -6.089 -14.837 1.00 72.20 H new ATOM 0 HG13 VAL A 7 1.381 -6.225 -16.361 1.00 72.20 H new ATOM 0 HG21 VAL A 7 3.079 -8.642 -15.470 1.00 41.03 H new ATOM 0 HG22 VAL A 7 3.755 -7.215 -16.290 1.00 41.03 H new ATOM 0 HG23 VAL A 7 4.411 -7.732 -14.719 1.00 41.03 H new ATOM 79 N LEU A 8 1.666 -4.931 -12.465 1.00 40.34 N ATOM 80 CA LEU A 8 0.686 -4.204 -11.666 1.00 62.45 C ATOM 81 C LEU A 8 1.316 -3.668 -10.386 1.00 42.50 C ATOM 82 O LEU A 8 1.812 -4.433 -9.559 1.00 44.31 O ATOM 83 CB LEU A 8 -0.498 -5.111 -11.325 1.00 45.54 C ATOM 84 CG LEU A 8 -1.286 -5.662 -12.514 1.00 24.43 C ATOM 85 CD1 LEU A 8 -2.499 -6.445 -12.034 1.00 34.31 C ATOM 86 CD2 LEU A 8 -1.710 -4.534 -13.442 1.00 15.10 C ATOM 0 H LEU A 8 2.020 -5.781 -12.027 1.00 40.34 H new ATOM 0 HA LEU A 8 0.330 -3.359 -12.255 1.00 62.45 H new ATOM 0 HB2 LEU A 8 -0.128 -5.952 -10.739 1.00 45.54 H new ATOM 0 HB3 LEU A 8 -1.184 -4.554 -10.687 1.00 45.54 H new ATOM 0 HG LEU A 8 -0.639 -6.340 -13.071 1.00 24.43 H new ATOM 0 HD11 LEU A 8 -3.048 -6.829 -12.894 1.00 34.31 H new ATOM 0 HD12 LEU A 8 -2.172 -7.277 -11.411 1.00 34.31 H new ATOM 0 HD13 LEU A 8 -3.148 -5.790 -11.453 1.00 34.31 H new ATOM 0 HD21 LEU A 8 -2.270 -4.945 -14.282 1.00 15.10 H new ATOM 0 HD22 LEU A 8 -2.339 -3.831 -12.896 1.00 15.10 H new ATOM 0 HD23 LEU A 8 -0.825 -4.017 -13.813 1.00 15.10 H new ATOM 98 N SER A 9 1.292 -2.349 -10.228 1.00 1.43 N ATOM 99 CA SER A 9 1.864 -1.710 -9.047 1.00 1.41 C ATOM 100 C SER A 9 1.015 -1.994 -7.812 1.00 0.02 C ATOM 101 O SER A 9 0.079 -2.791 -7.857 1.00 11.22 O ATOM 102 CB SER A 9 1.980 -0.200 -9.264 1.00 41.34 C ATOM 103 OG SER A 9 0.856 0.479 -8.734 1.00 73.55 O ATOM 0 H SER A 9 0.883 -1.702 -10.902 1.00 1.43 H new ATOM 0 HA SER A 9 2.859 -2.124 -8.886 1.00 1.41 H new ATOM 0 HB2 SER A 9 2.889 0.170 -8.790 1.00 41.34 H new ATOM 0 HB3 SER A 9 2.068 0.012 -10.330 1.00 41.34 H new ATOM 0 HG SER A 9 0.875 1.416 -9.021 1.00 73.55 H new ATOM 109 N GLY A 10 1.350 -1.333 -6.706 1.00 45.55 N ATOM 110 CA GLY A 10 0.611 -1.528 -5.474 1.00 35.01 C ATOM 111 C GLY A 10 -0.877 -1.296 -5.647 1.00 54.33 C ATOM 112 O GLY A 10 -1.692 -2.127 -5.251 1.00 60.22 O ATOM 0 H GLY A 10 2.120 -0.667 -6.643 1.00 45.55 H new ATOM 0 HA2 GLY A 10 0.778 -2.542 -5.111 1.00 35.01 H new ATOM 0 HA3 GLY A 10 0.995 -0.849 -4.712 1.00 35.01 H new ATOM 116 N GLY A 11 -1.232 -0.160 -6.242 1.00 24.34 N ATOM 117 CA GLY A 11 -2.631 0.160 -6.454 1.00 62.45 C ATOM 118 C GLY A 11 -3.302 -0.794 -7.423 1.00 71.52 C ATOM 119 O GLY A 11 -4.394 -1.294 -7.155 1.00 70.34 O ATOM 0 H GLY A 11 -0.575 0.543 -6.580 1.00 24.34 H new ATOM 0 HA2 GLY A 11 -3.156 0.132 -5.499 1.00 62.45 H new ATOM 0 HA3 GLY A 11 -2.714 1.178 -6.834 1.00 62.45 H new ATOM 123 N GLU A 12 -2.649 -1.043 -8.554 1.00 5.00 N ATOM 124 CA GLU A 12 -3.192 -1.941 -9.567 1.00 52.31 C ATOM 125 C GLU A 12 -3.376 -3.348 -9.005 1.00 34.11 C ATOM 126 O GLU A 12 -4.298 -4.067 -9.392 1.00 22.35 O ATOM 127 CB GLU A 12 -2.271 -1.984 -10.788 1.00 44.10 C ATOM 128 CG GLU A 12 -1.853 -0.610 -11.284 1.00 21.14 C ATOM 129 CD GLU A 12 -1.088 -0.670 -12.592 1.00 42.05 C ATOM 130 OE1 GLU A 12 0.138 -0.906 -12.552 1.00 35.13 O ATOM 131 OE2 GLU A 12 -1.715 -0.480 -13.655 1.00 3.01 O ATOM 0 H GLU A 12 -1.744 -0.636 -8.792 1.00 5.00 H new ATOM 0 HA GLU A 12 -4.167 -1.559 -9.869 1.00 52.31 H new ATOM 0 HB2 GLU A 12 -1.378 -2.558 -10.539 1.00 44.10 H new ATOM 0 HB3 GLU A 12 -2.776 -2.514 -11.595 1.00 44.10 H new ATOM 0 HG2 GLU A 12 -2.740 0.010 -11.414 1.00 21.14 H new ATOM 0 HG3 GLU A 12 -1.234 -0.127 -10.527 1.00 21.14 H new ATOM 138 N LEU A 13 -2.493 -3.734 -8.090 1.00 72.44 N ATOM 139 CA LEU A 13 -2.557 -5.055 -7.475 1.00 13.01 C ATOM 140 C LEU A 13 -3.839 -5.216 -6.665 1.00 50.13 C ATOM 141 O LEU A 13 -4.447 -6.287 -6.653 1.00 54.21 O ATOM 142 CB LEU A 13 -1.340 -5.279 -6.576 1.00 34.13 C ATOM 143 CG LEU A 13 -1.042 -6.730 -6.198 1.00 63.21 C ATOM 144 CD1 LEU A 13 -0.457 -7.480 -7.386 1.00 21.34 C ATOM 145 CD2 LEU A 13 -0.095 -6.789 -5.009 1.00 50.43 C ATOM 0 H LEU A 13 -1.725 -3.151 -7.758 1.00 72.44 H new ATOM 0 HA LEU A 13 -2.556 -5.800 -8.270 1.00 13.01 H new ATOM 0 HB2 LEU A 13 -0.463 -4.868 -7.076 1.00 34.13 H new ATOM 0 HB3 LEU A 13 -1.481 -4.707 -5.659 1.00 34.13 H new ATOM 0 HG LEU A 13 -1.978 -7.211 -5.914 1.00 63.21 H new ATOM 0 HD11 LEU A 13 -0.251 -8.511 -7.099 1.00 21.34 H new ATOM 0 HD12 LEU A 13 -1.170 -7.468 -8.211 1.00 21.34 H new ATOM 0 HD13 LEU A 13 0.469 -6.999 -7.700 1.00 21.34 H new ATOM 0 HD21 LEU A 13 0.105 -7.830 -4.755 1.00 50.43 H new ATOM 0 HD22 LEU A 13 0.841 -6.291 -5.264 1.00 50.43 H new ATOM 0 HD23 LEU A 13 -0.551 -6.288 -4.155 1.00 50.43 H new ATOM 157 N ASP A 14 -4.246 -4.147 -5.991 1.00 51.00 N ATOM 158 CA ASP A 14 -5.458 -4.168 -5.181 1.00 3.30 C ATOM 159 C ASP A 14 -6.675 -4.512 -6.034 1.00 34.21 C ATOM 160 O ASP A 14 -7.366 -5.498 -5.780 1.00 44.03 O ATOM 161 CB ASP A 14 -5.664 -2.816 -4.496 1.00 25.24 C ATOM 162 CG ASP A 14 -4.995 -2.747 -3.138 1.00 2.31 C ATOM 163 OD1 ASP A 14 -3.766 -2.963 -3.071 1.00 33.35 O ATOM 164 OD2 ASP A 14 -5.699 -2.480 -2.142 1.00 35.02 O ATOM 0 H ASP A 14 -3.754 -3.254 -5.989 1.00 51.00 H new ATOM 0 HA ASP A 14 -5.342 -4.938 -4.418 1.00 3.30 H new ATOM 0 HB2 ASP A 14 -5.268 -2.025 -5.133 1.00 25.24 H new ATOM 0 HB3 ASP A 14 -6.732 -2.629 -4.382 1.00 25.24 H new ATOM 169 N LYS A 15 -6.934 -3.689 -7.045 1.00 43.31 N ATOM 170 CA LYS A 15 -8.067 -3.905 -7.936 1.00 71.33 C ATOM 171 C LYS A 15 -7.961 -5.258 -8.634 1.00 34.51 C ATOM 172 O LYS A 15 -8.960 -5.957 -8.803 1.00 42.34 O ATOM 173 CB LYS A 15 -8.142 -2.787 -8.978 1.00 55.11 C ATOM 174 CG LYS A 15 -8.305 -1.402 -8.374 1.00 43.13 C ATOM 175 CD LYS A 15 -9.673 -1.230 -7.737 1.00 71.52 C ATOM 176 CE LYS A 15 -9.752 0.054 -6.924 1.00 52.13 C ATOM 177 NZ LYS A 15 -10.436 -0.158 -5.618 1.00 50.31 N ATOM 0 H LYS A 15 -6.374 -2.866 -7.267 1.00 43.31 H new ATOM 0 HA LYS A 15 -8.976 -3.896 -7.335 1.00 71.33 H new ATOM 0 HB2 LYS A 15 -7.236 -2.806 -9.584 1.00 55.11 H new ATOM 0 HB3 LYS A 15 -8.979 -2.982 -9.649 1.00 55.11 H new ATOM 0 HG2 LYS A 15 -7.530 -1.237 -7.625 1.00 43.13 H new ATOM 0 HG3 LYS A 15 -8.166 -0.648 -9.148 1.00 43.13 H new ATOM 0 HD2 LYS A 15 -10.438 -1.218 -8.513 1.00 71.52 H new ATOM 0 HD3 LYS A 15 -9.886 -2.083 -7.093 1.00 71.52 H new ATOM 0 HE2 LYS A 15 -8.746 0.436 -6.749 1.00 52.13 H new ATOM 0 HE3 LYS A 15 -10.287 0.813 -7.495 1.00 52.13 H new ATOM 0 HZ1 LYS A 15 -10.470 0.740 -5.094 1.00 50.31 H new ATOM 0 HZ2 LYS A 15 -11.405 -0.498 -5.785 1.00 50.31 H new ATOM 0 HZ3 LYS A 15 -9.912 -0.864 -5.062 1.00 50.31 H new ATOM 191 N TRP A 16 -6.748 -5.619 -9.033 1.00 13.11 N ATOM 192 CA TRP A 16 -6.513 -6.888 -9.711 1.00 25.54 C ATOM 193 C TRP A 16 -6.986 -8.058 -8.854 1.00 71.11 C ATOM 194 O TRP A 16 -7.816 -8.858 -9.284 1.00 44.04 O ATOM 195 CB TRP A 16 -5.027 -7.048 -10.039 1.00 24.51 C ATOM 196 CG TRP A 16 -4.702 -8.354 -10.699 1.00 65.43 C ATOM 197 CD1 TRP A 16 -4.190 -9.470 -10.102 1.00 15.11 C ATOM 198 CD2 TRP A 16 -4.866 -8.677 -12.084 1.00 44.50 C ATOM 199 NE1 TRP A 16 -4.025 -10.467 -11.031 1.00 1.31 N ATOM 200 CE2 TRP A 16 -4.433 -10.008 -12.255 1.00 74.04 C ATOM 201 CE3 TRP A 16 -5.338 -7.975 -13.196 1.00 71.43 C ATOM 202 CZ2 TRP A 16 -4.458 -10.645 -13.493 1.00 10.23 C ATOM 203 CZ3 TRP A 16 -5.362 -8.610 -14.424 1.00 53.01 C ATOM 204 CH2 TRP A 16 -4.924 -9.934 -14.565 1.00 35.42 C ATOM 0 H TRP A 16 -5.911 -5.051 -8.899 1.00 13.11 H new ATOM 0 HA TRP A 16 -7.084 -6.887 -10.639 1.00 25.54 H new ATOM 0 HB2 TRP A 16 -4.716 -6.232 -10.692 1.00 24.51 H new ATOM 0 HB3 TRP A 16 -4.448 -6.959 -9.120 1.00 24.51 H new ATOM 0 HD1 TRP A 16 -3.950 -9.556 -9.053 1.00 15.11 H new ATOM 0 HE1 TRP A 16 -3.658 -11.399 -10.840 1.00 1.31 H new ATOM 0 HE3 TRP A 16 -5.678 -6.955 -13.098 1.00 71.43 H new ATOM 0 HZ2 TRP A 16 -4.121 -11.665 -13.603 1.00 10.23 H new ATOM 0 HZ3 TRP A 16 -5.725 -8.076 -15.290 1.00 53.01 H new ATOM 0 HH2 TRP A 16 -4.955 -10.402 -15.538 1.00 35.42 H new ATOM 215 N GLU A 17 -6.452 -8.151 -7.640 1.00 63.14 N ATOM 216 CA GLU A 17 -6.820 -9.224 -6.724 1.00 43.31 C ATOM 217 C GLU A 17 -8.328 -9.246 -6.490 1.00 11.42 C ATOM 218 O GLU A 17 -8.901 -10.284 -6.157 1.00 73.13 O ATOM 219 CB GLU A 17 -6.088 -9.061 -5.391 1.00 52.40 C ATOM 220 CG GLU A 17 -4.595 -9.329 -5.480 1.00 44.41 C ATOM 221 CD GLU A 17 -3.924 -9.349 -4.120 1.00 40.11 C ATOM 222 OE1 GLU A 17 -4.647 -9.327 -3.102 1.00 55.41 O ATOM 223 OE2 GLU A 17 -2.677 -9.386 -4.074 1.00 4.41 O ATOM 0 H GLU A 17 -5.764 -7.497 -7.268 1.00 63.14 H new ATOM 0 HA GLU A 17 -6.526 -10.171 -7.177 1.00 43.31 H new ATOM 0 HB2 GLU A 17 -6.245 -8.048 -5.021 1.00 52.40 H new ATOM 0 HB3 GLU A 17 -6.527 -9.739 -4.659 1.00 52.40 H new ATOM 0 HG2 GLU A 17 -4.430 -10.285 -5.976 1.00 44.41 H new ATOM 0 HG3 GLU A 17 -4.128 -8.563 -6.100 1.00 44.41 H new ATOM 230 N LYS A 18 -8.964 -8.093 -6.665 1.00 11.32 N ATOM 231 CA LYS A 18 -10.404 -7.977 -6.473 1.00 62.51 C ATOM 232 C LYS A 18 -11.160 -8.511 -7.687 1.00 3.25 C ATOM 233 O LYS A 18 -12.101 -9.293 -7.548 1.00 60.21 O ATOM 234 CB LYS A 18 -10.791 -6.517 -6.222 1.00 2.33 C ATOM 235 CG LYS A 18 -12.205 -6.345 -5.697 1.00 32.54 C ATOM 236 CD LYS A 18 -12.346 -5.071 -4.880 1.00 53.00 C ATOM 237 CE LYS A 18 -13.758 -4.908 -4.339 1.00 3.43 C ATOM 238 NZ LYS A 18 -13.892 -5.461 -2.962 1.00 11.00 N ATOM 0 H LYS A 18 -8.504 -7.225 -6.940 1.00 11.32 H new ATOM 0 HA LYS A 18 -10.678 -8.574 -5.603 1.00 62.51 H new ATOM 0 HB2 LYS A 18 -10.092 -6.082 -5.508 1.00 2.33 H new ATOM 0 HB3 LYS A 18 -10.687 -5.957 -7.151 1.00 2.33 H new ATOM 0 HG2 LYS A 18 -12.904 -6.321 -6.533 1.00 32.54 H new ATOM 0 HG3 LYS A 18 -12.473 -7.204 -5.082 1.00 32.54 H new ATOM 0 HD2 LYS A 18 -11.638 -5.089 -4.052 1.00 53.00 H new ATOM 0 HD3 LYS A 18 -12.091 -4.211 -5.499 1.00 53.00 H new ATOM 0 HE2 LYS A 18 -14.025 -3.851 -4.334 1.00 3.43 H new ATOM 0 HE3 LYS A 18 -14.461 -5.411 -5.002 1.00 3.43 H new ATOM 0 HZ1 LYS A 18 -14.869 -5.331 -2.629 1.00 11.00 H new ATOM 0 HZ2 LYS A 18 -13.662 -6.475 -2.971 1.00 11.00 H new ATOM 0 HZ3 LYS A 18 -13.239 -4.964 -2.323 1.00 11.00 H new ATOM 252 N ILE A 19 -10.740 -8.086 -8.874 1.00 32.33 N ATOM 253 CA ILE A 19 -11.375 -8.525 -10.110 1.00 35.01 C ATOM 254 C ILE A 19 -11.470 -10.046 -10.170 1.00 55.33 C ATOM 255 O ILE A 19 -10.543 -10.751 -9.773 1.00 53.31 O ATOM 256 CB ILE A 19 -10.609 -8.020 -11.346 1.00 10.00 C ATOM 257 CG1 ILE A 19 -10.543 -6.491 -11.344 1.00 22.01 C ATOM 258 CG2 ILE A 19 -11.267 -8.525 -12.621 1.00 61.42 C ATOM 259 CD1 ILE A 19 -9.207 -5.943 -11.791 1.00 12.53 C ATOM 0 H ILE A 19 -9.963 -7.438 -9.006 1.00 32.33 H new ATOM 0 HA ILE A 19 -12.379 -8.101 -10.117 1.00 35.01 H new ATOM 0 HB ILE A 19 -9.591 -8.409 -11.307 1.00 10.00 H new ATOM 0 HG12 ILE A 19 -11.323 -6.101 -11.997 1.00 22.01 H new ATOM 0 HG13 ILE A 19 -10.758 -6.128 -10.339 1.00 22.01 H new ATOM 0 HG21 ILE A 19 -10.713 -8.159 -13.486 1.00 61.42 H new ATOM 0 HG22 ILE A 19 -11.266 -9.615 -12.624 1.00 61.42 H new ATOM 0 HG23 ILE A 19 -12.294 -8.163 -12.668 1.00 61.42 H new ATOM 0 HD11 ILE A 19 -9.233 -4.854 -11.765 1.00 12.53 H new ATOM 0 HD12 ILE A 19 -8.424 -6.303 -11.124 1.00 12.53 H new ATOM 0 HD13 ILE A 19 -8.999 -6.276 -12.808 1.00 12.53 H new ATOM 271 N ARG A 20 -12.596 -10.543 -10.671 1.00 12.24 N ATOM 272 CA ARG A 20 -12.812 -11.981 -10.784 1.00 52.33 C ATOM 273 C ARG A 20 -12.765 -12.424 -12.244 1.00 31.23 C ATOM 274 O ARG A 20 -13.120 -11.665 -13.145 1.00 74.41 O ATOM 275 CB ARG A 20 -14.156 -12.366 -10.165 1.00 2.24 C ATOM 276 CG ARG A 20 -14.233 -12.110 -8.668 1.00 63.05 C ATOM 277 CD ARG A 20 -15.658 -11.815 -8.227 1.00 73.51 C ATOM 278 NE ARG A 20 -16.038 -12.590 -7.049 1.00 51.11 N ATOM 279 CZ ARG A 20 -15.651 -12.288 -5.814 1.00 40.44 C ATOM 280 NH1 ARG A 20 -14.876 -11.234 -5.598 1.00 35.21 N ATOM 281 NH2 ARG A 20 -16.038 -13.042 -4.793 1.00 42.41 N ATOM 0 H ARG A 20 -13.372 -9.972 -11.005 1.00 12.24 H new ATOM 0 HA ARG A 20 -12.013 -12.488 -10.243 1.00 52.33 H new ATOM 0 HB2 ARG A 20 -14.949 -11.807 -10.662 1.00 2.24 H new ATOM 0 HB3 ARG A 20 -14.344 -13.423 -10.355 1.00 2.24 H new ATOM 0 HG2 ARG A 20 -13.857 -12.979 -8.129 1.00 63.05 H new ATOM 0 HG3 ARG A 20 -13.589 -11.270 -8.408 1.00 63.05 H new ATOM 0 HD2 ARG A 20 -15.757 -10.752 -8.009 1.00 73.51 H new ATOM 0 HD3 ARG A 20 -16.344 -12.038 -9.044 1.00 73.51 H new ATOM 0 HE ARG A 20 -16.633 -13.408 -7.181 1.00 51.11 H new ATOM 0 HH11 ARG A 20 -14.576 -10.653 -6.381 1.00 35.21 H new ATOM 0 HH12 ARG A 20 -14.580 -11.004 -4.649 1.00 35.21 H new ATOM 0 HH21 ARG A 20 -16.633 -13.854 -4.956 1.00 42.41 H new ATOM 0 HH22 ARG A 20 -15.740 -12.809 -3.846 1.00 42.41 H new ATOM 295 N LEU A 21 -12.326 -13.657 -12.468 1.00 23.01 N ATOM 296 CA LEU A 21 -12.233 -14.203 -13.818 1.00 0.31 C ATOM 297 C LEU A 21 -13.597 -14.201 -14.501 1.00 5.04 C ATOM 298 O LEU A 21 -13.700 -13.956 -15.702 1.00 25.01 O ATOM 299 CB LEU A 21 -11.671 -15.624 -13.777 1.00 64.00 C ATOM 300 CG LEU A 21 -10.380 -15.813 -12.981 1.00 3.32 C ATOM 301 CD1 LEU A 21 -10.234 -17.260 -12.534 1.00 12.52 C ATOM 302 CD2 LEU A 21 -9.176 -15.385 -13.807 1.00 62.25 C ATOM 0 H LEU A 21 -12.029 -14.298 -11.733 1.00 23.01 H new ATOM 0 HA LEU A 21 -11.558 -13.570 -14.394 1.00 0.31 H new ATOM 0 HB2 LEU A 21 -12.432 -16.282 -13.358 1.00 64.00 H new ATOM 0 HB3 LEU A 21 -11.494 -15.953 -14.801 1.00 64.00 H new ATOM 0 HG LEU A 21 -10.429 -15.183 -12.093 1.00 3.32 H new ATOM 0 HD11 LEU A 21 -9.309 -17.375 -11.969 1.00 12.52 H new ATOM 0 HD12 LEU A 21 -11.080 -17.533 -11.904 1.00 12.52 H new ATOM 0 HD13 LEU A 21 -10.208 -17.910 -13.409 1.00 12.52 H new ATOM 0 HD21 LEU A 21 -8.266 -15.527 -13.224 1.00 62.25 H new ATOM 0 HD22 LEU A 21 -9.124 -15.988 -14.714 1.00 62.25 H new ATOM 0 HD23 LEU A 21 -9.275 -14.333 -14.076 1.00 62.25 H new ATOM 314 N ARG A 22 -14.642 -14.476 -13.725 1.00 52.55 N ATOM 315 CA ARG A 22 -15.999 -14.506 -14.256 1.00 22.34 C ATOM 316 C ARG A 22 -16.899 -13.532 -13.499 1.00 44.11 C ATOM 317 O ARG A 22 -16.607 -13.123 -12.376 1.00 53.21 O ATOM 318 CB ARG A 22 -16.572 -15.921 -14.166 1.00 61.15 C ATOM 319 CG ARG A 22 -16.279 -16.775 -15.390 1.00 74.42 C ATOM 320 CD ARG A 22 -17.257 -17.933 -15.508 1.00 42.11 C ATOM 321 NE ARG A 22 -17.002 -18.746 -16.694 1.00 51.05 N ATOM 322 CZ ARG A 22 -17.355 -18.383 -17.923 1.00 3.31 C ATOM 323 NH1 ARG A 22 -17.973 -17.228 -18.125 1.00 70.44 N ATOM 324 NH2 ARG A 22 -17.088 -19.177 -18.953 1.00 0.20 N ATOM 0 H ARG A 22 -14.574 -14.681 -12.728 1.00 52.55 H new ATOM 0 HA ARG A 22 -15.961 -14.202 -15.302 1.00 22.34 H new ATOM 0 HB2 ARG A 22 -16.164 -16.414 -13.283 1.00 61.15 H new ATOM 0 HB3 ARG A 22 -17.651 -15.859 -14.026 1.00 61.15 H new ATOM 0 HG2 ARG A 22 -16.334 -16.158 -16.287 1.00 74.42 H new ATOM 0 HG3 ARG A 22 -15.261 -17.161 -15.330 1.00 74.42 H new ATOM 0 HD2 ARG A 22 -17.187 -18.558 -14.618 1.00 42.11 H new ATOM 0 HD3 ARG A 22 -18.275 -17.545 -15.546 1.00 42.11 H new ATOM 0 HE ARG A 22 -16.527 -19.641 -16.573 1.00 51.05 H new ATOM 0 HH11 ARG A 22 -18.179 -16.615 -17.336 1.00 70.44 H new ATOM 0 HH12 ARG A 22 -18.243 -16.952 -19.069 1.00 70.44 H new ATOM 0 HH21 ARG A 22 -16.612 -20.066 -18.801 1.00 0.20 H new ATOM 0 HH22 ARG A 22 -17.359 -18.898 -19.896 1.00 0.20 H new ATOM 338 N PRO A 23 -18.021 -13.152 -14.129 1.00 44.21 N ATOM 339 CA PRO A 23 -18.986 -12.224 -13.535 1.00 34.32 C ATOM 340 C PRO A 23 -19.738 -12.841 -12.361 1.00 21.13 C ATOM 341 O PRO A 23 -20.091 -12.151 -11.406 1.00 54.10 O ATOM 342 CB PRO A 23 -19.948 -11.925 -14.688 1.00 54.42 C ATOM 343 CG PRO A 23 -19.852 -13.116 -15.579 1.00 74.20 C ATOM 344 CD PRO A 23 -18.433 -13.601 -15.470 1.00 1.15 C ATOM 0 HA PRO A 23 -18.500 -11.338 -13.127 1.00 34.32 H new ATOM 0 HB2 PRO A 23 -20.966 -11.782 -14.327 1.00 54.42 H new ATOM 0 HB3 PRO A 23 -19.665 -11.013 -15.214 1.00 54.42 H new ATOM 0 HG2 PRO A 23 -20.554 -13.891 -15.272 1.00 74.20 H new ATOM 0 HG3 PRO A 23 -20.097 -12.854 -16.608 1.00 74.20 H new ATOM 0 HD2 PRO A 23 -18.370 -14.685 -15.568 1.00 1.15 H new ATOM 0 HD3 PRO A 23 -17.801 -13.173 -16.249 1.00 1.15 H new ATOM 352 N GLY A 24 -19.979 -14.146 -12.439 1.00 62.32 N ATOM 353 CA GLY A 24 -20.688 -14.834 -11.376 1.00 40.31 C ATOM 354 C GLY A 24 -19.955 -16.072 -10.897 1.00 53.21 C ATOM 355 O GLY A 24 -20.430 -17.191 -11.076 1.00 2.32 O ATOM 0 H GLY A 24 -19.696 -14.739 -13.219 1.00 62.32 H new ATOM 0 HA2 GLY A 24 -20.830 -14.152 -10.537 1.00 40.31 H new ATOM 0 HA3 GLY A 24 -21.680 -15.116 -11.729 1.00 40.31 H new ATOM 359 N GLY A 25 -18.791 -15.869 -10.287 1.00 52.10 N ATOM 360 CA GLY A 25 -18.009 -16.986 -9.792 1.00 55.43 C ATOM 361 C GLY A 25 -17.452 -16.735 -8.404 1.00 24.02 C ATOM 362 O GLY A 25 -17.597 -15.642 -7.857 1.00 75.15 O ATOM 0 H GLY A 25 -18.376 -14.951 -10.127 1.00 52.10 H new ATOM 0 HA2 GLY A 25 -18.631 -17.881 -9.774 1.00 55.43 H new ATOM 0 HA3 GLY A 25 -17.187 -17.183 -10.480 1.00 55.43 H new ATOM 366 N LYS A 26 -16.816 -17.751 -7.831 1.00 32.12 N ATOM 367 CA LYS A 26 -16.237 -17.637 -6.498 1.00 14.24 C ATOM 368 C LYS A 26 -14.713 -17.646 -6.564 1.00 3.13 C ATOM 369 O LYS A 26 -14.043 -18.118 -5.644 1.00 22.31 O ATOM 370 CB LYS A 26 -16.726 -18.781 -5.607 1.00 14.35 C ATOM 371 CG LYS A 26 -17.237 -18.321 -4.253 1.00 20.30 C ATOM 372 CD LYS A 26 -16.217 -18.575 -3.156 1.00 5.41 C ATOM 373 CE LYS A 26 -16.562 -17.813 -1.886 1.00 31.22 C ATOM 374 NZ LYS A 26 -15.859 -18.368 -0.697 1.00 2.03 N ATOM 0 H LYS A 26 -16.688 -18.663 -8.269 1.00 32.12 H new ATOM 0 HA LYS A 26 -16.559 -16.688 -6.070 1.00 14.24 H new ATOM 0 HB2 LYS A 26 -17.522 -19.318 -6.123 1.00 14.35 H new ATOM 0 HB3 LYS A 26 -15.910 -19.488 -5.457 1.00 14.35 H new ATOM 0 HG2 LYS A 26 -17.471 -17.257 -4.294 1.00 20.30 H new ATOM 0 HG3 LYS A 26 -18.164 -18.843 -4.017 1.00 20.30 H new ATOM 0 HD2 LYS A 26 -16.172 -19.642 -2.940 1.00 5.41 H new ATOM 0 HD3 LYS A 26 -15.227 -18.278 -3.502 1.00 5.41 H new ATOM 0 HE2 LYS A 26 -16.295 -16.763 -2.009 1.00 31.22 H new ATOM 0 HE3 LYS A 26 -17.639 -17.851 -1.721 1.00 31.22 H new ATOM 0 HZ1 LYS A 26 -16.121 -17.821 0.148 1.00 2.03 H new ATOM 0 HZ2 LYS A 26 -16.133 -19.362 -0.564 1.00 2.03 H new ATOM 0 HZ3 LYS A 26 -14.831 -18.309 -0.843 1.00 2.03 H new ATOM 388 N LYS A 27 -14.169 -17.120 -7.656 1.00 44.13 N ATOM 389 CA LYS A 27 -12.724 -17.065 -7.843 1.00 25.14 C ATOM 390 C LYS A 27 -12.279 -15.662 -8.240 1.00 34.30 C ATOM 391 O LYS A 27 -12.955 -14.983 -9.012 1.00 61.33 O ATOM 392 CB LYS A 27 -12.288 -18.071 -8.910 1.00 41.52 C ATOM 393 CG LYS A 27 -10.876 -18.594 -8.713 1.00 4.24 C ATOM 394 CD LYS A 27 -10.604 -19.810 -9.582 1.00 42.00 C ATOM 395 CE LYS A 27 -9.116 -19.989 -9.842 1.00 44.12 C ATOM 396 NZ LYS A 27 -8.785 -21.388 -10.232 1.00 25.20 N ATOM 0 H LYS A 27 -14.708 -16.725 -8.426 1.00 44.13 H new ATOM 0 HA LYS A 27 -12.251 -17.322 -6.895 1.00 25.14 H new ATOM 0 HB2 LYS A 27 -12.981 -18.912 -8.909 1.00 41.52 H new ATOM 0 HB3 LYS A 27 -12.359 -17.601 -9.891 1.00 41.52 H new ATOM 0 HG2 LYS A 27 -10.160 -17.808 -8.952 1.00 4.24 H new ATOM 0 HG3 LYS A 27 -10.727 -18.854 -7.665 1.00 4.24 H new ATOM 0 HD2 LYS A 27 -10.999 -20.702 -9.095 1.00 42.00 H new ATOM 0 HD3 LYS A 27 -11.130 -19.705 -10.531 1.00 42.00 H new ATOM 0 HE2 LYS A 27 -8.801 -19.308 -10.632 1.00 44.12 H new ATOM 0 HE3 LYS A 27 -8.556 -19.719 -8.947 1.00 44.12 H new ATOM 0 HZ1 LYS A 27 -7.836 -21.415 -10.657 1.00 25.20 H new ATOM 0 HZ2 LYS A 27 -8.804 -21.997 -9.389 1.00 25.20 H new ATOM 0 HZ3 LYS A 27 -9.484 -21.730 -10.922 1.00 25.20 H new ATOM 410 N GLN A 28 -11.139 -15.234 -7.707 1.00 63.41 N ATOM 411 CA GLN A 28 -10.606 -13.911 -8.008 1.00 4.10 C ATOM 412 C GLN A 28 -9.316 -14.015 -8.817 1.00 23.44 C ATOM 413 O GLN A 28 -8.846 -15.113 -9.114 1.00 1.42 O ATOM 414 CB GLN A 28 -10.349 -13.135 -6.715 1.00 21.34 C ATOM 415 CG GLN A 28 -9.668 -13.960 -5.636 1.00 52.30 C ATOM 416 CD GLN A 28 -8.261 -14.375 -6.020 1.00 22.24 C ATOM 417 OE1 GLN A 28 -8.059 -15.411 -6.655 1.00 3.22 O ATOM 418 NE2 GLN A 28 -7.279 -13.567 -5.637 1.00 63.23 N ATOM 0 H GLN A 28 -10.568 -15.784 -7.065 1.00 63.41 H new ATOM 0 HA GLN A 28 -11.346 -13.376 -8.604 1.00 4.10 H new ATOM 0 HB2 GLN A 28 -9.732 -12.265 -6.940 1.00 21.34 H new ATOM 0 HB3 GLN A 28 -11.298 -12.761 -6.330 1.00 21.34 H new ATOM 0 HG2 GLN A 28 -9.633 -13.384 -4.711 1.00 52.30 H new ATOM 0 HG3 GLN A 28 -10.263 -14.851 -5.435 1.00 52.30 H new ATOM 0 HE21 GLN A 28 -7.492 -12.719 -5.112 1.00 63.23 H new ATOM 0 HE22 GLN A 28 -6.312 -13.795 -5.868 1.00 63.23 H new ATOM 427 N TYR A 29 -8.751 -12.866 -9.168 1.00 55.14 N ATOM 428 CA TYR A 29 -7.517 -12.828 -9.945 1.00 72.41 C ATOM 429 C TYR A 29 -6.297 -12.833 -9.030 1.00 15.33 C ATOM 430 O TYR A 29 -6.345 -12.329 -7.907 1.00 32.33 O ATOM 431 CB TYR A 29 -7.491 -11.588 -10.840 1.00 60.23 C ATOM 432 CG TYR A 29 -7.955 -11.853 -12.255 1.00 43.32 C ATOM 433 CD1 TYR A 29 -7.117 -12.466 -13.178 1.00 52.34 C ATOM 434 CD2 TYR A 29 -9.231 -11.490 -12.669 1.00 24.32 C ATOM 435 CE1 TYR A 29 -7.536 -12.709 -14.472 1.00 42.45 C ATOM 436 CE2 TYR A 29 -9.658 -11.731 -13.960 1.00 21.41 C ATOM 437 CZ TYR A 29 -8.807 -12.341 -14.858 1.00 21.21 C ATOM 438 OH TYR A 29 -9.230 -12.581 -16.145 1.00 42.33 O ATOM 0 H TYR A 29 -9.127 -11.949 -8.927 1.00 55.14 H new ATOM 0 HA TYR A 29 -7.484 -13.720 -10.570 1.00 72.41 H new ATOM 0 HB2 TYR A 29 -8.123 -10.818 -10.398 1.00 60.23 H new ATOM 0 HB3 TYR A 29 -6.476 -11.191 -10.868 1.00 60.23 H new ATOM 0 HD1 TYR A 29 -6.121 -12.758 -12.879 1.00 52.34 H new ATOM 0 HD2 TYR A 29 -9.900 -11.011 -11.969 1.00 24.32 H new ATOM 0 HE1 TYR A 29 -6.871 -13.185 -15.177 1.00 42.45 H new ATOM 0 HE2 TYR A 29 -10.653 -11.443 -14.265 1.00 21.41 H new ATOM 0 HH TYR A 29 -8.986 -11.823 -16.716 1.00 42.33 H new ATOM 448 N LYS A 30 -5.202 -13.406 -9.517 1.00 74.00 N ATOM 449 CA LYS A 30 -3.966 -13.476 -8.746 1.00 75.15 C ATOM 450 C LYS A 30 -2.750 -13.293 -9.649 1.00 50.15 C ATOM 451 O LYS A 30 -2.854 -13.384 -10.873 1.00 14.42 O ATOM 452 CB LYS A 30 -3.873 -14.816 -8.014 1.00 23.13 C ATOM 453 CG LYS A 30 -3.633 -15.998 -8.937 1.00 61.40 C ATOM 454 CD LYS A 30 -4.533 -17.171 -8.586 1.00 4.23 C ATOM 455 CE LYS A 30 -4.360 -18.320 -9.567 1.00 71.23 C ATOM 456 NZ LYS A 30 -3.292 -19.263 -9.136 1.00 4.44 N ATOM 0 H LYS A 30 -5.145 -13.829 -10.443 1.00 74.00 H new ATOM 0 HA LYS A 30 -3.978 -12.669 -8.014 1.00 75.15 H new ATOM 0 HB2 LYS A 30 -3.065 -14.766 -7.284 1.00 23.13 H new ATOM 0 HB3 LYS A 30 -4.796 -14.981 -7.458 1.00 23.13 H new ATOM 0 HG2 LYS A 30 -3.812 -15.697 -9.969 1.00 61.40 H new ATOM 0 HG3 LYS A 30 -2.590 -16.306 -8.871 1.00 61.40 H new ATOM 0 HD2 LYS A 30 -4.306 -17.516 -7.577 1.00 4.23 H new ATOM 0 HD3 LYS A 30 -5.573 -16.845 -8.585 1.00 4.23 H new ATOM 0 HE2 LYS A 30 -5.302 -18.859 -9.664 1.00 71.23 H new ATOM 0 HE3 LYS A 30 -4.117 -17.922 -10.552 1.00 71.23 H new ATOM 0 HZ1 LYS A 30 -2.934 -19.783 -9.962 1.00 4.44 H new ATOM 0 HZ2 LYS A 30 -2.514 -18.730 -8.699 1.00 4.44 H new ATOM 0 HZ3 LYS A 30 -3.681 -19.936 -8.445 1.00 4.44 H new ATOM 470 N LEU A 31 -1.599 -13.035 -9.038 1.00 72.52 N ATOM 471 CA LEU A 31 -0.362 -12.841 -9.787 1.00 31.20 C ATOM 472 C LEU A 31 -0.125 -13.995 -10.756 1.00 62.24 C ATOM 473 O LEU A 31 0.444 -13.810 -11.832 1.00 54.21 O ATOM 474 CB LEU A 31 0.823 -12.714 -8.829 1.00 22.44 C ATOM 475 CG LEU A 31 0.758 -11.557 -7.830 1.00 4.11 C ATOM 476 CD1 LEU A 31 1.381 -11.962 -6.503 1.00 73.31 C ATOM 477 CD2 LEU A 31 1.452 -10.326 -8.394 1.00 43.33 C ATOM 0 H LEU A 31 -1.496 -12.955 -8.026 1.00 72.52 H new ATOM 0 HA LEU A 31 -0.456 -11.920 -10.363 1.00 31.20 H new ATOM 0 HB2 LEU A 31 0.914 -13.645 -8.270 1.00 22.44 H new ATOM 0 HB3 LEU A 31 1.732 -12.607 -9.420 1.00 22.44 H new ATOM 0 HG LEU A 31 -0.289 -11.311 -7.656 1.00 4.11 H new ATOM 0 HD11 LEU A 31 1.326 -11.127 -5.805 1.00 73.31 H new ATOM 0 HD12 LEU A 31 0.840 -12.814 -6.092 1.00 73.31 H new ATOM 0 HD13 LEU A 31 2.424 -12.236 -6.659 1.00 73.31 H new ATOM 0 HD21 LEU A 31 1.396 -9.513 -7.670 1.00 43.33 H new ATOM 0 HD22 LEU A 31 2.497 -10.559 -8.598 1.00 43.33 H new ATOM 0 HD23 LEU A 31 0.961 -10.023 -9.319 1.00 43.33 H new ATOM 489 N LYS A 32 -0.568 -15.186 -10.369 1.00 63.40 N ATOM 490 CA LYS A 32 -0.408 -16.370 -11.204 1.00 23.41 C ATOM 491 C LYS A 32 -0.891 -16.103 -12.626 1.00 3.22 C ATOM 492 O LYS A 32 -0.179 -16.370 -13.595 1.00 55.51 O ATOM 493 CB LYS A 32 -1.181 -17.549 -10.606 1.00 52.24 C ATOM 494 CG LYS A 32 -0.634 -18.905 -11.018 1.00 61.22 C ATOM 495 CD LYS A 32 0.211 -19.524 -9.917 1.00 43.14 C ATOM 496 CE LYS A 32 0.585 -20.962 -10.243 1.00 74.13 C ATOM 497 NZ LYS A 32 0.090 -21.912 -9.210 1.00 14.21 N ATOM 0 H LYS A 32 -1.041 -15.357 -9.482 1.00 63.40 H new ATOM 0 HA LYS A 32 0.653 -16.618 -11.239 1.00 23.41 H new ATOM 0 HB2 LYS A 32 -1.160 -17.473 -9.519 1.00 52.24 H new ATOM 0 HB3 LYS A 32 -2.225 -17.480 -10.910 1.00 52.24 H new ATOM 0 HG2 LYS A 32 -1.460 -19.573 -11.262 1.00 61.22 H new ATOM 0 HG3 LYS A 32 -0.034 -18.797 -11.921 1.00 61.22 H new ATOM 0 HD2 LYS A 32 1.117 -18.934 -9.777 1.00 43.14 H new ATOM 0 HD3 LYS A 32 -0.338 -19.494 -8.976 1.00 43.14 H new ATOM 0 HE2 LYS A 32 0.171 -21.234 -11.214 1.00 74.13 H new ATOM 0 HE3 LYS A 32 1.669 -21.046 -10.324 1.00 74.13 H new ATOM 0 HZ1 LYS A 32 0.365 -22.881 -9.469 1.00 14.21 H new ATOM 0 HZ2 LYS A 32 0.505 -21.669 -8.288 1.00 14.21 H new ATOM 0 HZ3 LYS A 32 -0.946 -21.851 -9.150 1.00 14.21 H new ATOM 511 N HIS A 33 -2.104 -15.573 -12.746 1.00 33.24 N ATOM 512 CA HIS A 33 -2.681 -15.266 -14.050 1.00 21.23 C ATOM 513 C HIS A 33 -1.866 -14.193 -14.764 1.00 74.00 C ATOM 514 O HIS A 33 -1.769 -14.278 -15.989 1.00 51.41 O ATOM 515 CB HIS A 33 -4.131 -14.804 -13.894 1.00 54.54 C ATOM 516 CG HIS A 33 -4.936 -15.660 -12.966 1.00 60.01 C ATOM 517 ND1 HIS A 33 -5.449 -15.199 -11.773 1.00 62.42 N ATOM 518 CD2 HIS A 33 -5.316 -16.956 -13.063 1.00 20.54 C ATOM 519 CE1 HIS A 33 -6.110 -16.175 -11.175 1.00 3.21 C ATOM 520 NE2 HIS A 33 -6.045 -17.252 -11.938 1.00 13.10 N ATOM 0 H HIS A 33 -2.707 -15.347 -11.955 1.00 33.24 H new ATOM 0 HA HIS A 33 -2.661 -16.174 -14.653 1.00 21.23 H new ATOM 0 HB2 HIS A 33 -4.139 -13.778 -13.527 1.00 54.54 H new ATOM 0 HB3 HIS A 33 -4.609 -14.796 -14.874 1.00 54.54 H new ATOM 0 HD2 HIS A 33 -5.088 -17.631 -13.874 1.00 20.54 H new ATOM 0 HE1 HIS A 33 -6.617 -16.104 -10.224 1.00 3.21 H new ATOM 0 HE2 HIS A 33 -6.468 -18.156 -11.726 1.00 13.10 H new ATOM 528 N ILE A 34 -1.299 -13.219 -14.059 1.00 50.05 N ATOM 529 CA ILE A 34 -0.510 -12.173 -14.698 1.00 61.34 C ATOM 530 C ILE A 34 0.733 -12.751 -15.364 1.00 72.34 C ATOM 531 O ILE A 34 1.142 -12.303 -16.436 1.00 33.23 O ATOM 532 CB ILE A 34 -0.083 -11.093 -13.686 1.00 52.23 C ATOM 533 CG1 ILE A 34 -1.305 -10.536 -12.954 1.00 53.12 C ATOM 534 CG2 ILE A 34 0.674 -9.977 -14.391 1.00 64.52 C ATOM 535 CD1 ILE A 34 -0.955 -9.590 -11.827 1.00 54.02 C ATOM 0 H ILE A 34 -1.372 -13.133 -13.045 1.00 50.05 H new ATOM 0 HA ILE A 34 -1.146 -11.717 -15.457 1.00 61.34 H new ATOM 0 HB ILE A 34 0.580 -11.548 -12.950 1.00 52.23 H new ATOM 0 HG12 ILE A 34 -1.941 -10.016 -13.670 1.00 53.12 H new ATOM 0 HG13 ILE A 34 -1.888 -11.365 -12.554 1.00 53.12 H new ATOM 0 HG21 ILE A 34 0.969 -9.221 -13.663 1.00 64.52 H new ATOM 0 HG22 ILE A 34 1.563 -10.387 -14.870 1.00 64.52 H new ATOM 0 HG23 ILE A 34 0.032 -9.523 -15.146 1.00 64.52 H new ATOM 0 HD11 ILE A 34 -1.870 -9.234 -11.353 1.00 54.02 H new ATOM 0 HD12 ILE A 34 -0.344 -10.112 -11.090 1.00 54.02 H new ATOM 0 HD13 ILE A 34 -0.398 -8.741 -12.224 1.00 54.02 H new ATOM 547 N VAL A 35 1.330 -13.750 -14.724 1.00 43.13 N ATOM 548 CA VAL A 35 2.526 -14.393 -15.256 1.00 1.14 C ATOM 549 C VAL A 35 2.167 -15.450 -16.294 1.00 20.00 C ATOM 550 O VAL A 35 2.865 -15.614 -17.295 1.00 50.55 O ATOM 551 CB VAL A 35 3.356 -15.051 -14.136 1.00 75.01 C ATOM 552 CG1 VAL A 35 4.578 -15.744 -14.715 1.00 44.33 C ATOM 553 CG2 VAL A 35 3.761 -14.016 -13.097 1.00 72.22 C ATOM 0 H VAL A 35 1.005 -14.132 -13.836 1.00 43.13 H new ATOM 0 HA VAL A 35 3.121 -13.611 -15.728 1.00 1.14 H new ATOM 0 HB VAL A 35 2.740 -15.804 -13.645 1.00 75.01 H new ATOM 0 HG11 VAL A 35 5.152 -16.203 -13.910 1.00 44.33 H new ATOM 0 HG12 VAL A 35 4.261 -16.514 -15.418 1.00 44.33 H new ATOM 0 HG13 VAL A 35 5.199 -15.013 -15.233 1.00 44.33 H new ATOM 0 HG21 VAL A 35 4.346 -14.497 -12.313 1.00 72.22 H new ATOM 0 HG22 VAL A 35 4.360 -13.239 -13.572 1.00 72.22 H new ATOM 0 HG23 VAL A 35 2.867 -13.570 -12.660 1.00 72.22 H new ATOM 563 N TRP A 36 1.074 -16.163 -16.050 1.00 4.54 N ATOM 564 CA TRP A 36 0.622 -17.205 -16.965 1.00 21.34 C ATOM 565 C TRP A 36 0.430 -16.649 -18.371 1.00 71.14 C ATOM 566 O TRP A 36 0.653 -17.346 -19.360 1.00 62.32 O ATOM 567 CB TRP A 36 -0.686 -17.820 -16.463 1.00 41.11 C ATOM 568 CG TRP A 36 -1.302 -18.780 -17.435 1.00 63.34 C ATOM 569 CD1 TRP A 36 -1.230 -20.143 -17.398 1.00 22.30 C ATOM 570 CD2 TRP A 36 -2.083 -18.449 -18.589 1.00 52.23 C ATOM 571 NE1 TRP A 36 -1.919 -20.679 -18.459 1.00 4.22 N ATOM 572 CE2 TRP A 36 -2.452 -19.662 -19.204 1.00 55.42 C ATOM 573 CE3 TRP A 36 -2.507 -17.247 -19.162 1.00 24.24 C ATOM 574 CZ2 TRP A 36 -3.222 -19.703 -20.363 1.00 62.23 C ATOM 575 CZ3 TRP A 36 -3.272 -17.291 -20.312 1.00 12.11 C ATOM 576 CH2 TRP A 36 -3.624 -18.511 -20.902 1.00 23.23 C ATOM 0 H TRP A 36 0.484 -16.039 -15.227 1.00 4.54 H new ATOM 0 HA TRP A 36 1.389 -17.979 -17.003 1.00 21.34 H new ATOM 0 HB2 TRP A 36 -0.498 -18.337 -15.522 1.00 41.11 H new ATOM 0 HB3 TRP A 36 -1.397 -17.021 -16.252 1.00 41.11 H new ATOM 0 HD1 TRP A 36 -0.708 -20.716 -16.645 1.00 22.30 H new ATOM 0 HE1 TRP A 36 -2.017 -21.674 -18.659 1.00 4.22 H new ATOM 0 HE3 TRP A 36 -2.242 -16.301 -18.714 1.00 24.24 H new ATOM 0 HZ2 TRP A 36 -3.493 -20.643 -20.821 1.00 62.23 H new ATOM 0 HZ3 TRP A 36 -3.604 -16.368 -20.764 1.00 12.11 H new ATOM 0 HH2 TRP A 36 -4.224 -18.511 -21.800 1.00 23.23 H new ATOM 587 N ALA A 37 0.015 -15.389 -18.453 1.00 10.03 N ATOM 588 CA ALA A 37 -0.204 -14.739 -19.739 1.00 50.52 C ATOM 589 C ALA A 37 1.119 -14.355 -20.393 1.00 22.03 C ATOM 590 O ALA A 37 1.276 -14.465 -21.609 1.00 13.51 O ATOM 591 CB ALA A 37 -1.085 -13.510 -19.566 1.00 3.23 C ATOM 0 H ALA A 37 -0.176 -14.798 -17.644 1.00 10.03 H new ATOM 0 HA ALA A 37 -0.711 -15.447 -20.394 1.00 50.52 H new ATOM 0 HB1 ALA A 37 -1.240 -13.034 -20.534 1.00 3.23 H new ATOM 0 HB2 ALA A 37 -2.047 -13.808 -19.150 1.00 3.23 H new ATOM 0 HB3 ALA A 37 -0.599 -12.806 -18.890 1.00 3.23 H new ATOM 597 N SER A 38 2.067 -13.904 -19.578 1.00 42.53 N ATOM 598 CA SER A 38 3.377 -13.500 -20.079 1.00 62.31 C ATOM 599 C SER A 38 4.088 -14.673 -20.748 1.00 14.33 C ATOM 600 O SER A 38 4.773 -14.502 -21.757 1.00 42.21 O ATOM 601 CB SER A 38 4.236 -12.952 -18.938 1.00 21.53 C ATOM 602 OG SER A 38 4.107 -11.545 -18.833 1.00 34.14 O ATOM 0 H SER A 38 1.953 -13.809 -18.569 1.00 42.53 H new ATOM 0 HA SER A 38 3.229 -12.716 -20.822 1.00 62.31 H new ATOM 0 HB2 SER A 38 3.939 -13.419 -17.999 1.00 21.53 H new ATOM 0 HB3 SER A 38 5.281 -13.213 -19.107 1.00 21.53 H new ATOM 0 HG SER A 38 4.664 -11.220 -18.096 1.00 34.14 H new ATOM 608 N ARG A 39 3.920 -15.862 -20.179 1.00 52.12 N ATOM 609 CA ARG A 39 4.547 -17.062 -20.718 1.00 64.42 C ATOM 610 C ARG A 39 3.880 -17.483 -22.025 1.00 21.51 C ATOM 611 O ARG A 39 4.500 -18.129 -22.869 1.00 73.12 O ATOM 612 CB ARG A 39 4.469 -18.204 -19.704 1.00 23.34 C ATOM 613 CG ARG A 39 5.780 -18.951 -19.527 1.00 23.05 C ATOM 614 CD ARG A 39 5.910 -19.525 -18.124 1.00 23.34 C ATOM 615 NE ARG A 39 5.999 -20.983 -18.136 1.00 3.24 N ATOM 616 CZ ARG A 39 7.103 -21.649 -18.458 1.00 62.41 C ATOM 617 NH1 ARG A 39 8.204 -20.991 -18.793 1.00 74.13 N ATOM 618 NH2 ARG A 39 7.106 -22.976 -18.445 1.00 15.32 N ATOM 0 H ARG A 39 3.355 -16.020 -19.345 1.00 52.12 H new ATOM 0 HA ARG A 39 5.594 -16.835 -20.920 1.00 64.42 H new ATOM 0 HB2 ARG A 39 4.156 -17.802 -18.740 1.00 23.34 H new ATOM 0 HB3 ARG A 39 3.699 -18.908 -20.021 1.00 23.34 H new ATOM 0 HG2 ARG A 39 5.842 -19.757 -20.258 1.00 23.05 H new ATOM 0 HG3 ARG A 39 6.614 -18.277 -19.724 1.00 23.05 H new ATOM 0 HD2 ARG A 39 6.797 -19.111 -17.644 1.00 23.34 H new ATOM 0 HD3 ARG A 39 5.052 -19.219 -17.526 1.00 23.34 H new ATOM 0 HE ARG A 39 5.169 -21.519 -17.884 1.00 3.24 H new ATOM 0 HH11 ARG A 39 8.205 -19.971 -18.804 1.00 74.13 H new ATOM 0 HH12 ARG A 39 9.050 -21.505 -19.040 1.00 74.13 H new ATOM 0 HH21 ARG A 39 6.261 -23.485 -18.188 1.00 15.32 H new ATOM 0 HH22 ARG A 39 7.954 -23.487 -18.692 1.00 15.32 H new ATOM 632 N GLU A 40 2.613 -17.111 -22.184 1.00 2.42 N ATOM 633 CA GLU A 40 1.863 -17.451 -23.387 1.00 43.21 C ATOM 634 C GLU A 40 2.071 -16.400 -24.473 1.00 24.25 C ATOM 635 O GLU A 40 1.950 -16.689 -25.665 1.00 14.04 O ATOM 636 CB GLU A 40 0.372 -17.582 -23.066 1.00 53.41 C ATOM 637 CG GLU A 40 -0.329 -18.669 -23.862 1.00 5.13 C ATOM 638 CD GLU A 40 -0.725 -18.212 -25.252 1.00 35.22 C ATOM 639 OE1 GLU A 40 -0.739 -16.986 -25.491 1.00 62.54 O ATOM 640 OE2 GLU A 40 -1.022 -19.080 -26.100 1.00 14.34 O ATOM 0 H GLU A 40 2.085 -16.575 -21.495 1.00 2.42 H new ATOM 0 HA GLU A 40 2.233 -18.408 -23.756 1.00 43.21 H new ATOM 0 HB2 GLU A 40 0.255 -17.790 -22.002 1.00 53.41 H new ATOM 0 HB3 GLU A 40 -0.118 -16.628 -23.260 1.00 53.41 H new ATOM 0 HG2 GLU A 40 0.327 -19.536 -23.942 1.00 5.13 H new ATOM 0 HG3 GLU A 40 -1.219 -18.992 -23.323 1.00 5.13 H new ATOM 647 N LEU A 41 2.382 -15.178 -24.054 1.00 22.12 N ATOM 648 CA LEU A 41 2.606 -14.082 -24.990 1.00 11.14 C ATOM 649 C LEU A 41 3.918 -14.270 -25.744 1.00 54.43 C ATOM 650 O LEU A 41 3.964 -14.147 -26.968 1.00 54.11 O ATOM 651 CB LEU A 41 2.618 -12.746 -24.246 1.00 11.20 C ATOM 652 CG LEU A 41 1.309 -11.957 -24.260 1.00 73.42 C ATOM 653 CD1 LEU A 41 1.448 -10.677 -23.451 1.00 24.23 C ATOM 654 CD2 LEU A 41 0.889 -11.644 -25.689 1.00 41.43 C ATOM 0 H LEU A 41 2.485 -14.921 -23.072 1.00 22.12 H new ATOM 0 HA LEU A 41 1.790 -14.081 -25.713 1.00 11.14 H new ATOM 0 HB2 LEU A 41 2.895 -12.934 -23.208 1.00 11.20 H new ATOM 0 HB3 LEU A 41 3.400 -12.121 -24.676 1.00 11.20 H new ATOM 0 HG LEU A 41 0.534 -12.570 -23.801 1.00 73.42 H new ATOM 0 HD11 LEU A 41 0.506 -10.129 -23.473 1.00 24.23 H new ATOM 0 HD12 LEU A 41 1.701 -10.924 -22.420 1.00 24.23 H new ATOM 0 HD13 LEU A 41 2.237 -10.059 -23.880 1.00 24.23 H new ATOM 0 HD21 LEU A 41 -0.045 -11.082 -25.679 1.00 41.43 H new ATOM 0 HD22 LEU A 41 1.664 -11.051 -26.174 1.00 41.43 H new ATOM 0 HD23 LEU A 41 0.747 -12.575 -26.238 1.00 41.43 H new ATOM 666 N GLU A 42 4.982 -14.571 -25.006 1.00 71.20 N ATOM 667 CA GLU A 42 6.294 -14.776 -25.607 1.00 1.42 C ATOM 668 C GLU A 42 6.237 -15.858 -26.682 1.00 11.24 C ATOM 669 O GLU A 42 7.049 -15.871 -27.607 1.00 63.34 O ATOM 670 CB GLU A 42 7.316 -15.162 -24.535 1.00 31.43 C ATOM 671 CG GLU A 42 8.655 -15.605 -25.100 1.00 71.24 C ATOM 672 CD GLU A 42 9.826 -15.147 -24.254 1.00 2.32 C ATOM 673 OE1 GLU A 42 9.974 -15.655 -23.123 1.00 44.10 O ATOM 674 OE2 GLU A 42 10.595 -14.281 -24.722 1.00 22.43 O ATOM 0 H GLU A 42 4.961 -14.678 -23.992 1.00 71.20 H new ATOM 0 HA GLU A 42 6.602 -13.840 -26.073 1.00 1.42 H new ATOM 0 HB2 GLU A 42 7.475 -14.311 -23.873 1.00 31.43 H new ATOM 0 HB3 GLU A 42 6.904 -15.967 -23.926 1.00 31.43 H new ATOM 0 HG2 GLU A 42 8.671 -16.692 -25.177 1.00 71.24 H new ATOM 0 HG3 GLU A 42 8.766 -15.212 -26.111 1.00 71.24 H new ATOM 681 N ARG A 43 5.272 -16.763 -26.552 1.00 12.24 N ATOM 682 CA ARG A 43 5.109 -17.849 -27.510 1.00 4.22 C ATOM 683 C ARG A 43 4.543 -17.331 -28.828 1.00 72.13 C ATOM 684 O ARG A 43 4.769 -17.918 -29.886 1.00 42.04 O ATOM 685 CB ARG A 43 4.190 -18.929 -26.937 1.00 5.35 C ATOM 686 CG ARG A 43 4.883 -20.264 -26.715 1.00 63.45 C ATOM 687 CD ARG A 43 4.618 -21.227 -27.863 1.00 21.32 C ATOM 688 NE ARG A 43 4.459 -22.602 -27.398 1.00 30.14 N ATOM 689 CZ ARG A 43 3.343 -23.068 -26.848 1.00 40.12 C ATOM 690 NH1 ARG A 43 2.292 -22.273 -26.697 1.00 4.52 N ATOM 691 NH2 ARG A 43 3.276 -24.332 -26.450 1.00 73.12 N ATOM 0 H ARG A 43 4.591 -16.765 -25.792 1.00 12.24 H new ATOM 0 HA ARG A 43 6.091 -18.281 -27.702 1.00 4.22 H new ATOM 0 HB2 ARG A 43 3.780 -18.580 -25.989 1.00 5.35 H new ATOM 0 HB3 ARG A 43 3.348 -19.074 -27.614 1.00 5.35 H new ATOM 0 HG2 ARG A 43 5.956 -20.105 -26.612 1.00 63.45 H new ATOM 0 HG3 ARG A 43 4.535 -20.705 -25.781 1.00 63.45 H new ATOM 0 HD2 ARG A 43 3.718 -20.918 -28.395 1.00 21.32 H new ATOM 0 HD3 ARG A 43 5.442 -21.178 -28.575 1.00 21.32 H new ATOM 0 HE ARG A 43 5.248 -23.240 -27.501 1.00 30.14 H new ATOM 0 HH11 ARG A 43 2.339 -21.301 -27.003 1.00 4.52 H new ATOM 0 HH12 ARG A 43 1.436 -22.633 -26.274 1.00 4.52 H new ATOM 0 HH21 ARG A 43 4.082 -24.947 -26.566 1.00 73.12 H new ATOM 0 HH22 ARG A 43 2.419 -24.689 -26.028 1.00 73.12 H new ATOM 705 N PHE A 44 3.806 -16.228 -28.756 1.00 62.40 N ATOM 706 CA PHE A 44 3.205 -15.631 -29.944 1.00 24.41 C ATOM 707 C PHE A 44 4.083 -14.511 -30.493 1.00 54.33 C ATOM 708 O PHE A 44 3.592 -13.574 -31.121 1.00 15.54 O ATOM 709 CB PHE A 44 1.812 -15.089 -29.619 1.00 73.31 C ATOM 710 CG PHE A 44 0.740 -16.141 -29.636 1.00 62.55 C ATOM 711 CD1 PHE A 44 0.841 -17.265 -28.833 1.00 23.14 C ATOM 712 CD2 PHE A 44 -0.369 -16.005 -30.455 1.00 72.44 C ATOM 713 CE1 PHE A 44 -0.143 -18.235 -28.848 1.00 64.02 C ATOM 714 CE2 PHE A 44 -1.358 -16.971 -30.473 1.00 64.04 C ATOM 715 CZ PHE A 44 -1.244 -18.087 -29.668 1.00 25.43 C ATOM 0 H PHE A 44 3.610 -15.729 -27.888 1.00 62.40 H new ATOM 0 HA PHE A 44 3.117 -16.406 -30.705 1.00 24.41 H new ATOM 0 HB2 PHE A 44 1.834 -14.620 -28.635 1.00 73.31 H new ATOM 0 HB3 PHE A 44 1.557 -14.310 -30.338 1.00 73.31 H new ATOM 0 HD1 PHE A 44 1.699 -17.385 -28.188 1.00 23.14 H new ATOM 0 HD2 PHE A 44 -0.462 -15.134 -31.087 1.00 72.44 H new ATOM 0 HE1 PHE A 44 -0.051 -19.108 -28.219 1.00 64.02 H new ATOM 0 HE2 PHE A 44 -2.218 -16.853 -31.115 1.00 64.04 H new ATOM 0 HZ PHE A 44 -2.015 -18.843 -29.680 1.00 25.43 H new ATOM 725 N ALA A 45 5.386 -14.617 -30.251 1.00 34.25 N ATOM 726 CA ALA A 45 6.334 -13.614 -30.722 1.00 51.40 C ATOM 727 C ALA A 45 6.072 -12.261 -30.069 1.00 34.04 C ATOM 728 O ALA A 45 6.481 -11.221 -30.586 1.00 64.12 O ATOM 729 CB ALA A 45 6.265 -13.493 -32.237 1.00 62.45 C ATOM 0 H ALA A 45 5.809 -15.387 -29.732 1.00 34.25 H new ATOM 0 HA ALA A 45 7.336 -13.936 -30.439 1.00 51.40 H new ATOM 0 HB1 ALA A 45 6.978 -12.741 -32.575 1.00 62.45 H new ATOM 0 HB2 ALA A 45 6.509 -14.454 -32.690 1.00 62.45 H new ATOM 0 HB3 ALA A 45 5.258 -13.198 -32.533 1.00 62.45 H new ATOM 735 N VAL A 46 5.388 -12.282 -28.929 1.00 53.12 N ATOM 736 CA VAL A 46 5.072 -11.056 -28.205 1.00 64.34 C ATOM 737 C VAL A 46 5.702 -11.060 -26.817 1.00 52.21 C ATOM 738 O VAL A 46 5.350 -11.875 -25.966 1.00 23.42 O ATOM 739 CB VAL A 46 3.550 -10.864 -28.065 1.00 40.34 C ATOM 740 CG1 VAL A 46 3.242 -9.604 -27.271 1.00 33.40 C ATOM 741 CG2 VAL A 46 2.892 -10.815 -29.435 1.00 31.40 C ATOM 0 H VAL A 46 5.042 -13.134 -28.487 1.00 53.12 H new ATOM 0 HA VAL A 46 5.483 -10.230 -28.785 1.00 64.34 H new ATOM 0 HB VAL A 46 3.142 -11.716 -27.521 1.00 40.34 H new ATOM 0 HG11 VAL A 46 2.162 -9.485 -27.182 1.00 33.40 H new ATOM 0 HG12 VAL A 46 3.681 -9.684 -26.277 1.00 33.40 H new ATOM 0 HG13 VAL A 46 3.662 -8.739 -27.784 1.00 33.40 H new ATOM 0 HG21 VAL A 46 1.817 -10.679 -29.318 1.00 31.40 H new ATOM 0 HG22 VAL A 46 3.303 -9.983 -30.006 1.00 31.40 H new ATOM 0 HG23 VAL A 46 3.084 -11.748 -29.964 1.00 31.40 H new ATOM 751 N ASN A 47 6.639 -10.142 -26.596 1.00 20.50 N ATOM 752 CA ASN A 47 7.319 -10.039 -25.311 1.00 30.10 C ATOM 753 C ASN A 47 6.328 -9.729 -24.193 1.00 72.53 C ATOM 754 O ASN A 47 5.357 -8.995 -24.378 1.00 30.54 O ATOM 755 CB ASN A 47 8.398 -8.955 -25.366 1.00 5.11 C ATOM 756 CG ASN A 47 9.769 -9.485 -24.990 1.00 73.22 C ATOM 757 OD1 ASN A 47 10.256 -9.247 -23.885 1.00 22.25 O ATOM 758 ND2 ASN A 47 10.398 -10.205 -25.911 1.00 21.55 N ATOM 0 H ASN A 47 6.944 -9.460 -27.290 1.00 20.50 H new ATOM 0 HA ASN A 47 7.789 -11.000 -25.100 1.00 30.10 H new ATOM 0 HB2 ASN A 47 8.437 -8.535 -26.371 1.00 5.11 H new ATOM 0 HB3 ASN A 47 8.128 -8.143 -24.691 1.00 5.11 H new ATOM 0 HD21 ASN A 47 11.324 -10.586 -25.716 1.00 21.55 H new ATOM 0 HD22 ASN A 47 9.956 -10.377 -26.814 1.00 21.55 H new ATOM 765 N PRO A 48 6.577 -10.299 -23.005 1.00 51.42 N ATOM 766 CA PRO A 48 5.719 -10.097 -21.834 1.00 51.22 C ATOM 767 C PRO A 48 5.815 -8.677 -21.283 1.00 44.41 C ATOM 768 O PRO A 48 5.024 -8.277 -20.431 1.00 64.11 O ATOM 769 CB PRO A 48 6.264 -11.103 -20.817 1.00 52.31 C ATOM 770 CG PRO A 48 7.684 -11.313 -21.215 1.00 72.44 C ATOM 771 CD PRO A 48 7.717 -11.185 -22.714 1.00 12.53 C ATOM 0 HA PRO A 48 4.665 -10.239 -22.072 1.00 51.22 H new ATOM 0 HB2 PRO A 48 6.191 -10.717 -19.800 1.00 52.31 H new ATOM 0 HB3 PRO A 48 5.703 -12.037 -20.845 1.00 52.31 H new ATOM 0 HG2 PRO A 48 8.334 -10.575 -20.746 1.00 72.44 H new ATOM 0 HG3 PRO A 48 8.037 -12.295 -20.899 1.00 72.44 H new ATOM 0 HD2 PRO A 48 8.658 -10.757 -23.060 1.00 12.53 H new ATOM 0 HD3 PRO A 48 7.609 -12.153 -23.203 1.00 12.53 H new ATOM 779 N GLY A 49 6.790 -7.920 -21.777 1.00 2.42 N ATOM 780 CA GLY A 49 6.971 -6.554 -21.322 1.00 51.21 C ATOM 781 C GLY A 49 5.834 -5.647 -21.747 1.00 53.02 C ATOM 782 O GLY A 49 5.669 -4.552 -21.208 1.00 72.20 O ATOM 0 H GLY A 49 7.458 -8.228 -22.484 1.00 2.42 H new ATOM 0 HA2 GLY A 49 7.053 -6.544 -20.235 1.00 51.21 H new ATOM 0 HA3 GLY A 49 7.910 -6.164 -21.716 1.00 51.21 H new ATOM 786 N LEU A 50 5.048 -6.101 -22.717 1.00 71.04 N ATOM 787 CA LEU A 50 3.920 -5.321 -23.216 1.00 55.34 C ATOM 788 C LEU A 50 2.755 -5.360 -22.234 1.00 35.43 C ATOM 789 O LEU A 50 1.916 -4.458 -22.213 1.00 32.23 O ATOM 790 CB LEU A 50 3.471 -5.851 -24.579 1.00 30.34 C ATOM 791 CG LEU A 50 4.568 -6.009 -25.632 1.00 51.33 C ATOM 792 CD1 LEU A 50 3.981 -6.508 -26.944 1.00 25.15 C ATOM 793 CD2 LEU A 50 5.301 -4.691 -25.842 1.00 24.43 C ATOM 0 H LEU A 50 5.171 -7.005 -23.174 1.00 71.04 H new ATOM 0 HA LEU A 50 4.245 -4.286 -23.325 1.00 55.34 H new ATOM 0 HB2 LEU A 50 2.995 -6.820 -24.431 1.00 30.34 H new ATOM 0 HB3 LEU A 50 2.709 -5.179 -24.975 1.00 30.34 H new ATOM 0 HG LEU A 50 5.285 -6.748 -25.273 1.00 51.33 H new ATOM 0 HD11 LEU A 50 4.777 -6.614 -27.681 1.00 25.15 H new ATOM 0 HD12 LEU A 50 3.503 -7.474 -26.784 1.00 25.15 H new ATOM 0 HD13 LEU A 50 3.243 -5.793 -27.307 1.00 25.15 H new ATOM 0 HD21 LEU A 50 6.078 -4.823 -26.595 1.00 24.43 H new ATOM 0 HD22 LEU A 50 4.595 -3.932 -26.178 1.00 24.43 H new ATOM 0 HD23 LEU A 50 5.755 -4.374 -24.903 1.00 24.43 H new ATOM 805 N LEU A 51 2.709 -6.408 -21.419 1.00 12.01 N ATOM 806 CA LEU A 51 1.646 -6.563 -20.431 1.00 42.50 C ATOM 807 C LEU A 51 1.688 -5.435 -19.404 1.00 40.34 C ATOM 808 O LEU A 51 0.675 -5.105 -18.790 1.00 3.21 O ATOM 809 CB LEU A 51 1.773 -7.914 -19.725 1.00 44.51 C ATOM 810 CG LEU A 51 1.412 -9.144 -20.560 1.00 35.12 C ATOM 811 CD1 LEU A 51 1.561 -10.412 -19.734 1.00 40.35 C ATOM 812 CD2 LEU A 51 -0.005 -9.023 -21.102 1.00 74.54 C ATOM 0 H LEU A 51 3.395 -7.163 -21.422 1.00 12.01 H new ATOM 0 HA LEU A 51 0.690 -6.520 -20.953 1.00 42.50 H new ATOM 0 HB2 LEU A 51 2.800 -8.024 -19.377 1.00 44.51 H new ATOM 0 HB3 LEU A 51 1.136 -7.900 -18.840 1.00 44.51 H new ATOM 0 HG LEU A 51 2.100 -9.201 -21.404 1.00 35.12 H new ATOM 0 HD11 LEU A 51 1.300 -11.277 -20.344 1.00 40.35 H new ATOM 0 HD12 LEU A 51 2.592 -10.506 -19.394 1.00 40.35 H new ATOM 0 HD13 LEU A 51 0.897 -10.364 -18.871 1.00 40.35 H new ATOM 0 HD21 LEU A 51 -0.245 -9.907 -21.694 1.00 74.54 H new ATOM 0 HD22 LEU A 51 -0.706 -8.941 -20.272 1.00 74.54 H new ATOM 0 HD23 LEU A 51 -0.080 -8.135 -21.730 1.00 74.54 H new ATOM 824 N GLU A 52 2.867 -4.847 -19.227 1.00 12.22 N ATOM 825 CA GLU A 52 3.040 -3.754 -18.276 1.00 44.14 C ATOM 826 C GLU A 52 3.008 -2.405 -18.987 1.00 21.22 C ATOM 827 O GLU A 52 3.560 -1.419 -18.498 1.00 10.41 O ATOM 828 CB GLU A 52 4.359 -3.912 -17.517 1.00 45.51 C ATOM 829 CG GLU A 52 5.587 -3.814 -18.406 1.00 51.13 C ATOM 830 CD GLU A 52 6.729 -3.070 -17.742 1.00 2.30 C ATOM 831 OE1 GLU A 52 6.675 -1.824 -17.691 1.00 35.20 O ATOM 832 OE2 GLU A 52 7.678 -3.733 -17.273 1.00 42.23 O ATOM 0 H GLU A 52 3.716 -5.108 -19.729 1.00 12.22 H new ATOM 0 HA GLU A 52 2.214 -3.791 -17.565 1.00 44.14 H new ATOM 0 HB2 GLU A 52 4.418 -3.146 -16.744 1.00 45.51 H new ATOM 0 HB3 GLU A 52 4.364 -4.877 -17.010 1.00 45.51 H new ATOM 0 HG2 GLU A 52 5.919 -4.817 -18.673 1.00 51.13 H new ATOM 0 HG3 GLU A 52 5.320 -3.309 -19.334 1.00 51.13 H new ATOM 839 N THR A 53 2.356 -2.367 -20.144 1.00 64.32 N ATOM 840 CA THR A 53 2.252 -1.140 -20.924 1.00 70.32 C ATOM 841 C THR A 53 0.827 -0.923 -21.421 1.00 33.32 C ATOM 842 O THR A 53 0.258 -1.780 -22.097 1.00 11.01 O ATOM 843 CB THR A 53 3.207 -1.159 -22.132 1.00 3.11 C ATOM 844 OG1 THR A 53 2.712 -2.056 -23.133 1.00 51.34 O ATOM 845 CG2 THR A 53 4.605 -1.586 -21.710 1.00 55.43 C ATOM 0 H THR A 53 1.891 -3.173 -20.562 1.00 64.32 H new ATOM 0 HA THR A 53 2.532 -0.321 -20.262 1.00 70.32 H new ATOM 0 HB THR A 53 3.260 -0.150 -22.541 1.00 3.11 H new ATOM 0 HG1 THR A 53 2.165 -2.749 -22.709 1.00 51.34 H new ATOM 0 HG21 THR A 53 5.262 -1.592 -22.580 1.00 55.43 H new ATOM 0 HG22 THR A 53 4.991 -0.886 -20.969 1.00 55.43 H new ATOM 0 HG23 THR A 53 4.565 -2.586 -21.279 1.00 55.43 H new ATOM 853 N SER A 54 0.256 0.229 -21.081 1.00 5.52 N ATOM 854 CA SER A 54 -1.104 0.557 -21.490 1.00 60.15 C ATOM 855 C SER A 54 -1.241 0.511 -23.010 1.00 23.14 C ATOM 856 O SER A 54 -2.336 0.324 -23.539 1.00 20.14 O ATOM 857 CB SER A 54 -1.494 1.943 -20.974 1.00 71.11 C ATOM 858 OG SER A 54 -2.880 2.008 -20.683 1.00 11.40 O ATOM 0 H SER A 54 0.714 0.950 -20.524 1.00 5.52 H new ATOM 0 HA SER A 54 -1.775 -0.186 -21.059 1.00 60.15 H new ATOM 0 HB2 SER A 54 -0.920 2.175 -20.077 1.00 71.11 H new ATOM 0 HB3 SER A 54 -1.240 2.697 -21.719 1.00 71.11 H new ATOM 0 HG SER A 54 -3.026 2.603 -19.918 1.00 11.40 H new ATOM 864 N GLU A 55 -0.120 0.680 -23.704 1.00 33.14 N ATOM 865 CA GLU A 55 -0.115 0.659 -25.161 1.00 52.23 C ATOM 866 C GLU A 55 -0.033 -0.772 -25.684 1.00 42.34 C ATOM 867 O GLU A 55 -0.802 -1.170 -26.558 1.00 11.31 O ATOM 868 CB GLU A 55 1.059 1.479 -25.702 1.00 12.45 C ATOM 869 CG GLU A 55 0.694 2.360 -26.884 1.00 60.20 C ATOM 870 CD GLU A 55 0.772 1.624 -28.206 1.00 64.23 C ATOM 871 OE1 GLU A 55 1.631 0.726 -28.336 1.00 31.42 O ATOM 872 OE2 GLU A 55 -0.025 1.944 -29.113 1.00 74.43 O ATOM 0 H GLU A 55 0.795 0.833 -23.281 1.00 33.14 H new ATOM 0 HA GLU A 55 -1.049 1.102 -25.508 1.00 52.23 H new ATOM 0 HB2 GLU A 55 1.453 2.105 -24.901 1.00 12.45 H new ATOM 0 HB3 GLU A 55 1.859 0.800 -25.999 1.00 12.45 H new ATOM 0 HG2 GLU A 55 -0.316 2.746 -26.746 1.00 60.20 H new ATOM 0 HG3 GLU A 55 1.363 3.220 -26.911 1.00 60.20 H new ATOM 879 N GLY A 56 0.906 -1.542 -25.141 1.00 53.04 N ATOM 880 CA GLY A 56 1.072 -2.919 -25.566 1.00 10.31 C ATOM 881 C GLY A 56 -0.211 -3.718 -25.456 1.00 23.03 C ATOM 882 O GLY A 56 -0.600 -4.414 -26.395 1.00 52.12 O ATOM 0 H GLY A 56 1.554 -1.236 -24.415 1.00 53.04 H new ATOM 0 HA2 GLY A 56 1.421 -2.938 -26.599 1.00 10.31 H new ATOM 0 HA3 GLY A 56 1.844 -3.392 -24.960 1.00 10.31 H new ATOM 886 N CYS A 57 -0.869 -3.622 -24.306 1.00 23.23 N ATOM 887 CA CYS A 57 -2.115 -4.344 -24.076 1.00 32.25 C ATOM 888 C CYS A 57 -3.111 -4.084 -25.201 1.00 54.13 C ATOM 889 O CYS A 57 -3.751 -5.007 -25.703 1.00 45.14 O ATOM 890 CB CYS A 57 -2.726 -3.935 -22.734 1.00 11.11 C ATOM 891 SG CYS A 57 -2.542 -5.174 -21.431 1.00 64.41 S ATOM 0 H CYS A 57 -0.561 -3.052 -23.519 1.00 23.23 H new ATOM 0 HA CYS A 57 -1.889 -5.410 -24.055 1.00 32.25 H new ATOM 0 HB2 CYS A 57 -2.263 -3.005 -22.404 1.00 11.11 H new ATOM 0 HB3 CYS A 57 -3.787 -3.729 -22.878 1.00 11.11 H new ATOM 0 HG CYS A 57 -3.088 -4.736 -20.335 1.00 64.41 H new ATOM 897 N ARG A 58 -3.237 -2.820 -25.592 1.00 53.10 N ATOM 898 CA ARG A 58 -4.157 -2.438 -26.656 1.00 71.25 C ATOM 899 C ARG A 58 -3.829 -3.177 -27.950 1.00 60.25 C ATOM 900 O ARG A 58 -4.724 -3.651 -28.648 1.00 63.53 O ATOM 901 CB ARG A 58 -4.100 -0.927 -26.891 1.00 15.11 C ATOM 902 CG ARG A 58 -5.161 -0.419 -27.855 1.00 2.54 C ATOM 903 CD ARG A 58 -4.574 0.549 -28.868 1.00 42.55 C ATOM 904 NE ARG A 58 -4.069 1.765 -28.236 1.00 73.55 N ATOM 905 CZ ARG A 58 -3.673 2.836 -28.915 1.00 53.50 C ATOM 906 NH1 ARG A 58 -3.723 2.842 -30.240 1.00 41.30 N ATOM 907 NH2 ARG A 58 -3.226 3.905 -28.268 1.00 60.05 N ATOM 0 H ARG A 58 -2.714 -2.043 -25.188 1.00 53.10 H new ATOM 0 HA ARG A 58 -5.165 -2.713 -26.346 1.00 71.25 H new ATOM 0 HB2 ARG A 58 -4.214 -0.415 -25.936 1.00 15.11 H new ATOM 0 HB3 ARG A 58 -3.115 -0.665 -27.277 1.00 15.11 H new ATOM 0 HG2 ARG A 58 -5.615 -1.262 -28.376 1.00 2.54 H new ATOM 0 HG3 ARG A 58 -5.956 0.075 -27.296 1.00 2.54 H new ATOM 0 HD2 ARG A 58 -3.765 0.060 -29.410 1.00 42.55 H new ATOM 0 HD3 ARG A 58 -5.336 0.812 -29.602 1.00 42.55 H new ATOM 0 HE ARG A 58 -4.018 1.793 -27.218 1.00 73.55 H new ATOM 0 HH11 ARG A 58 -4.066 2.023 -30.741 1.00 41.30 H new ATOM 0 HH12 ARG A 58 -3.418 3.666 -30.758 1.00 41.30 H new ATOM 0 HH21 ARG A 58 -3.186 3.905 -27.249 1.00 60.05 H new ATOM 0 HH22 ARG A 58 -2.922 4.727 -28.790 1.00 60.05 H new ATOM 921 N GLN A 59 -2.540 -3.269 -28.262 1.00 22.22 N ATOM 922 CA GLN A 59 -2.095 -3.950 -29.472 1.00 42.32 C ATOM 923 C GLN A 59 -2.404 -5.442 -29.404 1.00 30.54 C ATOM 924 O GLN A 59 -2.852 -6.038 -30.383 1.00 30.50 O ATOM 925 CB GLN A 59 -0.594 -3.737 -29.680 1.00 22.54 C ATOM 926 CG GLN A 59 -0.166 -3.806 -31.136 1.00 51.51 C ATOM 927 CD GLN A 59 1.031 -4.712 -31.350 1.00 3.30 C ATOM 928 OE1 GLN A 59 2.005 -4.660 -30.600 1.00 11.44 O ATOM 929 NE2 GLN A 59 0.963 -5.550 -32.378 1.00 31.11 N ATOM 0 H GLN A 59 -1.787 -2.881 -27.694 1.00 22.22 H new ATOM 0 HA GLN A 59 -2.636 -3.524 -30.317 1.00 42.32 H new ATOM 0 HB2 GLN A 59 -0.314 -2.765 -29.273 1.00 22.54 H new ATOM 0 HB3 GLN A 59 -0.047 -4.490 -29.113 1.00 22.54 H new ATOM 0 HG2 GLN A 59 -1.000 -4.164 -31.739 1.00 51.51 H new ATOM 0 HG3 GLN A 59 0.075 -2.803 -31.488 1.00 51.51 H new ATOM 0 HE21 GLN A 59 0.136 -5.559 -32.974 1.00 31.11 H new ATOM 0 HE22 GLN A 59 1.738 -6.184 -32.571 1.00 31.11 H new ATOM 938 N ILE A 60 -2.163 -6.038 -28.241 1.00 65.23 N ATOM 939 CA ILE A 60 -2.417 -7.460 -28.046 1.00 15.43 C ATOM 940 C ILE A 60 -3.891 -7.789 -28.255 1.00 43.14 C ATOM 941 O ILE A 60 -4.232 -8.838 -28.803 1.00 63.30 O ATOM 942 CB ILE A 60 -1.996 -7.918 -26.636 1.00 44.43 C ATOM 943 CG1 ILE A 60 -0.511 -7.628 -26.405 1.00 44.13 C ATOM 944 CG2 ILE A 60 -2.288 -9.400 -26.453 1.00 15.54 C ATOM 945 CD1 ILE A 60 -0.113 -7.641 -24.945 1.00 63.35 C ATOM 0 H ILE A 60 -1.793 -5.559 -27.420 1.00 65.23 H new ATOM 0 HA ILE A 60 -1.820 -7.992 -28.787 1.00 15.43 H new ATOM 0 HB ILE A 60 -2.574 -7.360 -25.899 1.00 44.43 H new ATOM 0 HG12 ILE A 60 0.083 -8.367 -26.942 1.00 44.13 H new ATOM 0 HG13 ILE A 60 -0.269 -6.654 -26.831 1.00 44.13 H new ATOM 0 HG21 ILE A 60 -1.986 -9.710 -25.453 1.00 15.54 H new ATOM 0 HG22 ILE A 60 -3.356 -9.579 -26.581 1.00 15.54 H new ATOM 0 HG23 ILE A 60 -1.732 -9.975 -27.194 1.00 15.54 H new ATOM 0 HD11 ILE A 60 0.952 -7.428 -24.856 1.00 63.35 H new ATOM 0 HD12 ILE A 60 -0.681 -6.882 -24.406 1.00 63.35 H new ATOM 0 HD13 ILE A 60 -0.323 -8.622 -24.519 1.00 63.35 H new ATOM 957 N LEU A 61 -4.761 -6.886 -27.817 1.00 61.23 N ATOM 958 CA LEU A 61 -6.200 -7.078 -27.959 1.00 65.54 C ATOM 959 C LEU A 61 -6.636 -6.887 -29.408 1.00 41.34 C ATOM 960 O LEU A 61 -7.646 -7.439 -29.841 1.00 71.33 O ATOM 961 CB LEU A 61 -6.957 -6.104 -27.055 1.00 12.15 C ATOM 962 CG LEU A 61 -6.665 -6.213 -25.557 1.00 40.34 C ATOM 963 CD1 LEU A 61 -7.050 -4.927 -24.843 1.00 74.04 C ATOM 964 CD2 LEU A 61 -7.401 -7.401 -24.956 1.00 34.32 C ATOM 0 H LEU A 61 -4.495 -6.013 -27.360 1.00 61.23 H new ATOM 0 HA LEU A 61 -6.435 -8.099 -27.660 1.00 65.54 H new ATOM 0 HB2 LEU A 61 -6.728 -5.088 -27.377 1.00 12.15 H new ATOM 0 HB3 LEU A 61 -8.026 -6.253 -27.208 1.00 12.15 H new ATOM 0 HG LEU A 61 -5.594 -6.370 -25.425 1.00 40.34 H new ATOM 0 HD11 LEU A 61 -6.835 -5.023 -23.779 1.00 74.04 H new ATOM 0 HD12 LEU A 61 -6.477 -4.096 -25.255 1.00 74.04 H new ATOM 0 HD13 LEU A 61 -8.114 -4.738 -24.983 1.00 74.04 H new ATOM 0 HD21 LEU A 61 -7.182 -7.463 -23.890 1.00 34.32 H new ATOM 0 HD22 LEU A 61 -8.474 -7.274 -25.099 1.00 34.32 H new ATOM 0 HD23 LEU A 61 -7.075 -8.318 -25.448 1.00 34.32 H new ATOM 976 N GLY A 62 -5.863 -6.104 -30.155 1.00 12.43 N ATOM 977 CA GLY A 62 -6.184 -5.856 -31.548 1.00 53.24 C ATOM 978 C GLY A 62 -6.006 -7.089 -32.412 1.00 71.13 C ATOM 979 O GLY A 62 -6.557 -7.168 -33.510 1.00 3.42 O ATOM 0 H GLY A 62 -5.020 -5.637 -29.820 1.00 12.43 H new ATOM 0 HA2 GLY A 62 -7.214 -5.508 -31.624 1.00 53.24 H new ATOM 0 HA3 GLY A 62 -5.549 -5.056 -31.927 1.00 53.24 H new ATOM 983 N GLN A 63 -5.235 -8.051 -31.917 1.00 11.12 N ATOM 984 CA GLN A 63 -4.984 -9.284 -32.653 1.00 32.53 C ATOM 985 C GLN A 63 -5.902 -10.403 -32.169 1.00 52.24 C ATOM 986 O GLN A 63 -6.342 -11.242 -32.955 1.00 2.14 O ATOM 987 CB GLN A 63 -3.522 -9.706 -32.501 1.00 44.45 C ATOM 988 CG GLN A 63 -2.659 -9.349 -33.700 1.00 13.34 C ATOM 989 CD GLN A 63 -2.106 -7.939 -33.621 1.00 62.33 C ATOM 990 OE1 GLN A 63 -0.928 -7.737 -33.326 1.00 62.23 O ATOM 991 NE2 GLN A 63 -2.956 -6.954 -33.887 1.00 10.11 N ATOM 0 H GLN A 63 -4.773 -8.000 -31.009 1.00 11.12 H new ATOM 0 HA GLN A 63 -5.192 -9.097 -33.706 1.00 32.53 H new ATOM 0 HB2 GLN A 63 -3.107 -9.233 -31.611 1.00 44.45 H new ATOM 0 HB3 GLN A 63 -3.478 -10.783 -32.340 1.00 44.45 H new ATOM 0 HG2 GLN A 63 -1.833 -10.056 -33.772 1.00 13.34 H new ATOM 0 HG3 GLN A 63 -3.248 -9.454 -34.611 1.00 13.34 H new ATOM 0 HE21 GLN A 63 -3.924 -7.167 -34.127 1.00 10.11 H new ATOM 0 HE22 GLN A 63 -2.641 -5.985 -33.851 1.00 10.11 H new ATOM 1000 N LEU A 64 -6.186 -10.408 -30.872 1.00 13.33 N ATOM 1001 CA LEU A 64 -7.052 -11.424 -30.282 1.00 13.54 C ATOM 1002 C LEU A 64 -8.521 -11.081 -30.502 1.00 20.21 C ATOM 1003 O LEU A 64 -9.377 -11.966 -30.528 1.00 73.04 O ATOM 1004 CB LEU A 64 -6.766 -11.559 -28.785 1.00 13.41 C ATOM 1005 CG LEU A 64 -5.344 -11.974 -28.408 1.00 12.35 C ATOM 1006 CD1 LEU A 64 -5.198 -12.068 -26.897 1.00 73.03 C ATOM 1007 CD2 LEU A 64 -4.983 -13.299 -29.064 1.00 64.12 C ATOM 0 H LEU A 64 -5.830 -9.720 -30.208 1.00 13.33 H new ATOM 0 HA LEU A 64 -6.843 -12.375 -30.773 1.00 13.54 H new ATOM 0 HB2 LEU A 64 -6.983 -10.604 -28.307 1.00 13.41 H new ATOM 0 HB3 LEU A 64 -7.459 -12.290 -28.368 1.00 13.41 H new ATOM 0 HG LEU A 64 -4.655 -11.212 -28.772 1.00 12.35 H new ATOM 0 HD11 LEU A 64 -4.179 -12.365 -26.648 1.00 73.03 H new ATOM 0 HD12 LEU A 64 -5.413 -11.098 -26.450 1.00 73.03 H new ATOM 0 HD13 LEU A 64 -5.897 -12.809 -26.509 1.00 73.03 H new ATOM 0 HD21 LEU A 64 -3.967 -13.579 -28.784 1.00 64.12 H new ATOM 0 HD22 LEU A 64 -5.677 -14.071 -28.731 1.00 64.12 H new ATOM 0 HD23 LEU A 64 -5.046 -13.198 -30.147 1.00 64.12 H new ATOM 1019 N GLN A 65 -8.806 -9.792 -30.663 1.00 4.13 N ATOM 1020 CA GLN A 65 -10.172 -9.335 -30.882 1.00 22.42 C ATOM 1021 C GLN A 65 -10.826 -10.099 -32.029 1.00 53.22 C ATOM 1022 O GLN A 65 -11.827 -10.794 -31.855 1.00 72.40 O ATOM 1023 CB GLN A 65 -10.189 -7.834 -31.179 1.00 31.02 C ATOM 1024 CG GLN A 65 -10.522 -6.978 -29.968 1.00 61.44 C ATOM 1025 CD GLN A 65 -11.801 -6.185 -30.149 1.00 62.10 C ATOM 1026 OE1 GLN A 65 -12.837 -6.514 -29.569 1.00 63.02 O ATOM 1027 NE2 GLN A 65 -11.736 -5.132 -30.955 1.00 31.24 N ATOM 0 H GLN A 65 -8.109 -9.047 -30.646 1.00 4.13 H new ATOM 0 HA GLN A 65 -10.741 -9.525 -29.972 1.00 22.42 H new ATOM 0 HB2 GLN A 65 -9.214 -7.538 -31.566 1.00 31.02 H new ATOM 0 HB3 GLN A 65 -10.918 -7.636 -31.965 1.00 31.02 H new ATOM 0 HG2 GLN A 65 -10.616 -7.618 -29.090 1.00 61.44 H new ATOM 0 HG3 GLN A 65 -9.698 -6.292 -29.775 1.00 61.44 H new ATOM 0 HE21 GLN A 65 -10.857 -4.896 -31.415 1.00 31.24 H new ATOM 0 HE22 GLN A 65 -12.565 -4.559 -31.114 1.00 31.24 H new ATOM 1036 N PRO A 66 -10.246 -9.969 -33.232 1.00 25.02 N ATOM 1037 CA PRO A 66 -10.755 -10.641 -34.432 1.00 12.01 C ATOM 1038 C PRO A 66 -10.545 -12.150 -34.384 1.00 44.53 C ATOM 1039 O PRO A 66 -11.165 -12.897 -35.141 1.00 63.13 O ATOM 1040 CB PRO A 66 -9.929 -10.021 -35.563 1.00 2.04 C ATOM 1041 CG PRO A 66 -8.668 -9.572 -34.908 1.00 24.34 C ATOM 1042 CD PRO A 66 -9.050 -9.158 -33.514 1.00 32.42 C ATOM 0 HA PRO A 66 -11.830 -10.508 -34.549 1.00 12.01 H new ATOM 0 HB2 PRO A 66 -9.729 -10.747 -36.351 1.00 2.04 H new ATOM 0 HB3 PRO A 66 -10.455 -9.185 -36.025 1.00 2.04 H new ATOM 0 HG2 PRO A 66 -7.931 -10.375 -34.888 1.00 24.34 H new ATOM 0 HG3 PRO A 66 -8.220 -8.741 -35.453 1.00 24.34 H new ATOM 0 HD2 PRO A 66 -8.250 -9.360 -32.802 1.00 32.42 H new ATOM 0 HD3 PRO A 66 -9.265 -8.091 -33.457 1.00 32.42 H new ATOM 1050 N SER A 67 -9.667 -12.594 -33.490 1.00 72.41 N ATOM 1051 CA SER A 67 -9.374 -14.014 -33.347 1.00 10.54 C ATOM 1052 C SER A 67 -10.079 -14.595 -32.125 1.00 75.40 C ATOM 1053 O SER A 67 -9.625 -15.579 -31.540 1.00 65.11 O ATOM 1054 CB SER A 67 -7.864 -14.235 -33.230 1.00 2.51 C ATOM 1055 OG SER A 67 -7.172 -13.603 -34.293 1.00 61.13 O ATOM 0 H SER A 67 -9.146 -11.990 -32.854 1.00 72.41 H new ATOM 0 HA SER A 67 -9.743 -14.526 -34.236 1.00 10.54 H new ATOM 0 HB2 SER A 67 -7.509 -13.843 -32.277 1.00 2.51 H new ATOM 0 HB3 SER A 67 -7.648 -15.303 -33.236 1.00 2.51 H new ATOM 0 HG SER A 67 -6.813 -12.745 -33.985 1.00 61.13 H new ATOM 1061 N LEU A 68 -11.192 -13.977 -31.744 1.00 3.21 N ATOM 1062 CA LEU A 68 -11.962 -14.431 -30.591 1.00 61.51 C ATOM 1063 C LEU A 68 -12.878 -15.591 -30.970 1.00 42.13 C ATOM 1064 O LEU A 68 -13.052 -16.534 -30.199 1.00 15.33 O ATOM 1065 CB LEU A 68 -12.792 -13.278 -30.021 1.00 43.41 C ATOM 1066 CG LEU A 68 -12.172 -12.524 -28.845 1.00 13.31 C ATOM 1067 CD1 LEU A 68 -13.023 -11.320 -28.473 1.00 60.32 C ATOM 1068 CD2 LEU A 68 -12.002 -13.449 -27.648 1.00 31.32 C ATOM 0 H LEU A 68 -11.581 -13.161 -32.216 1.00 3.21 H new ATOM 0 HA LEU A 68 -11.261 -14.778 -29.831 1.00 61.51 H new ATOM 0 HB2 LEU A 68 -12.986 -12.565 -30.822 1.00 43.41 H new ATOM 0 HB3 LEU A 68 -13.758 -13.673 -29.705 1.00 43.41 H new ATOM 0 HG LEU A 68 -11.187 -12.167 -29.147 1.00 13.31 H new ATOM 0 HD11 LEU A 68 -12.565 -10.796 -27.634 1.00 60.32 H new ATOM 0 HD12 LEU A 68 -13.093 -10.646 -29.327 1.00 60.32 H new ATOM 0 HD13 LEU A 68 -14.022 -11.653 -28.191 1.00 60.32 H new ATOM 0 HD21 LEU A 68 -11.559 -12.895 -26.820 1.00 31.32 H new ATOM 0 HD22 LEU A 68 -12.975 -13.836 -27.346 1.00 31.32 H new ATOM 0 HD23 LEU A 68 -11.350 -14.279 -27.919 1.00 31.32 H new ATOM 1080 N GLN A 69 -13.458 -15.515 -32.164 1.00 73.31 N ATOM 1081 CA GLN A 69 -14.354 -16.560 -32.645 1.00 51.35 C ATOM 1082 C GLN A 69 -13.564 -17.735 -33.210 1.00 65.41 C ATOM 1083 O GLN A 69 -13.883 -18.896 -32.946 1.00 20.11 O ATOM 1084 CB GLN A 69 -15.294 -16.001 -33.715 1.00 52.02 C ATOM 1085 CG GLN A 69 -16.378 -16.977 -34.141 1.00 63.41 C ATOM 1086 CD GLN A 69 -16.661 -16.923 -35.629 1.00 62.23 C ATOM 1087 OE1 GLN A 69 -16.754 -17.955 -36.294 1.00 31.23 O ATOM 1088 NE2 GLN A 69 -16.801 -15.714 -36.162 1.00 31.32 N ATOM 0 H GLN A 69 -13.324 -14.741 -32.815 1.00 73.31 H new ATOM 0 HA GLN A 69 -14.945 -16.915 -31.801 1.00 51.35 H new ATOM 0 HB2 GLN A 69 -15.763 -15.093 -33.337 1.00 52.02 H new ATOM 0 HB3 GLN A 69 -14.708 -15.717 -34.589 1.00 52.02 H new ATOM 0 HG2 GLN A 69 -16.078 -17.989 -33.869 1.00 63.41 H new ATOM 0 HG3 GLN A 69 -17.294 -16.758 -33.593 1.00 63.41 H new ATOM 0 HE21 GLN A 69 -16.716 -14.885 -35.574 1.00 31.32 H new ATOM 0 HE22 GLN A 69 -16.993 -15.615 -37.159 1.00 31.32 H new ATOM 1097 N THR A 70 -12.531 -17.430 -33.990 1.00 32.33 N ATOM 1098 CA THR A 70 -11.697 -18.462 -34.593 1.00 51.10 C ATOM 1099 C THR A 70 -10.463 -18.737 -33.742 1.00 53.13 C ATOM 1100 O THR A 70 -9.437 -19.190 -34.248 1.00 20.14 O ATOM 1101 CB THR A 70 -11.250 -18.063 -36.012 1.00 65.34 C ATOM 1102 OG1 THR A 70 -10.620 -16.778 -35.985 1.00 1.32 O ATOM 1103 CG2 THR A 70 -12.437 -18.032 -36.964 1.00 2.01 C ATOM 0 H THR A 70 -12.252 -16.476 -34.219 1.00 32.33 H new ATOM 0 HA THR A 70 -12.303 -19.366 -34.651 1.00 51.10 H new ATOM 0 HB THR A 70 -10.538 -18.808 -36.368 1.00 65.34 H new ATOM 0 HG1 THR A 70 -10.338 -16.533 -36.891 1.00 1.32 H new ATOM 0 HG21 THR A 70 -12.097 -17.748 -37.960 1.00 2.01 H new ATOM 0 HG22 THR A 70 -12.896 -19.020 -37.005 1.00 2.01 H new ATOM 0 HG23 THR A 70 -13.169 -17.306 -36.609 1.00 2.01 H new ATOM 1111 N GLY A 71 -10.569 -18.460 -32.446 1.00 3.32 N ATOM 1112 CA GLY A 71 -9.453 -18.685 -31.546 1.00 2.14 C ATOM 1113 C GLY A 71 -9.707 -19.827 -30.582 1.00 21.13 C ATOM 1114 O GLY A 71 -10.828 -20.008 -30.104 1.00 31.21 O ATOM 0 H GLY A 71 -11.408 -18.084 -32.003 1.00 3.32 H new ATOM 0 HA2 GLY A 71 -8.557 -18.898 -32.129 1.00 2.14 H new ATOM 0 HA3 GLY A 71 -9.256 -17.774 -30.981 1.00 2.14 H new ATOM 1118 N SER A 72 -8.665 -20.602 -30.295 1.00 61.40 N ATOM 1119 CA SER A 72 -8.783 -21.736 -29.387 1.00 31.13 C ATOM 1120 C SER A 72 -8.891 -21.263 -27.940 1.00 5.12 C ATOM 1121 O SER A 72 -8.787 -20.070 -27.657 1.00 25.34 O ATOM 1122 CB SER A 72 -7.580 -22.668 -29.542 1.00 13.22 C ATOM 1123 OG SER A 72 -6.541 -22.041 -30.274 1.00 41.32 O ATOM 0 H SER A 72 -7.730 -20.465 -30.679 1.00 61.40 H new ATOM 0 HA SER A 72 -9.691 -22.282 -29.642 1.00 31.13 H new ATOM 0 HB2 SER A 72 -7.212 -22.959 -28.558 1.00 13.22 H new ATOM 0 HB3 SER A 72 -7.887 -23.582 -30.050 1.00 13.22 H new ATOM 0 HG SER A 72 -5.783 -22.656 -30.358 1.00 41.32 H new ATOM 1129 N GLU A 73 -9.100 -22.209 -27.028 1.00 51.55 N ATOM 1130 CA GLU A 73 -9.222 -21.889 -25.612 1.00 24.12 C ATOM 1131 C GLU A 73 -8.029 -21.066 -25.133 1.00 42.25 C ATOM 1132 O GLU A 73 -8.164 -20.209 -24.260 1.00 45.31 O ATOM 1133 CB GLU A 73 -9.334 -23.173 -24.784 1.00 50.15 C ATOM 1134 CG GLU A 73 -8.038 -23.963 -24.710 1.00 62.32 C ATOM 1135 CD GLU A 73 -8.268 -25.432 -24.407 1.00 33.34 C ATOM 1136 OE1 GLU A 73 -8.652 -25.748 -23.261 1.00 14.32 O ATOM 1137 OE2 GLU A 73 -8.064 -26.264 -25.315 1.00 14.00 O ATOM 0 H GLU A 73 -9.188 -23.202 -27.246 1.00 51.55 H new ATOM 0 HA GLU A 73 -10.127 -21.297 -25.478 1.00 24.12 H new ATOM 0 HB2 GLU A 73 -9.652 -22.917 -23.773 1.00 50.15 H new ATOM 0 HB3 GLU A 73 -10.111 -23.805 -25.213 1.00 50.15 H new ATOM 0 HG2 GLU A 73 -7.505 -23.870 -25.656 1.00 62.32 H new ATOM 0 HG3 GLU A 73 -7.398 -23.533 -23.940 1.00 62.32 H new ATOM 1144 N GLU A 74 -6.863 -21.334 -25.713 1.00 41.42 N ATOM 1145 CA GLU A 74 -5.647 -20.619 -25.346 1.00 55.14 C ATOM 1146 C GLU A 74 -5.774 -19.131 -25.660 1.00 34.23 C ATOM 1147 O GLU A 74 -5.199 -18.288 -24.970 1.00 34.51 O ATOM 1148 CB GLU A 74 -4.441 -21.205 -26.083 1.00 40.15 C ATOM 1149 CG GLU A 74 -4.273 -22.702 -25.883 1.00 72.42 C ATOM 1150 CD GLU A 74 -2.818 -23.120 -25.802 1.00 73.34 C ATOM 1151 OE1 GLU A 74 -2.124 -22.676 -24.865 1.00 2.02 O ATOM 1152 OE2 GLU A 74 -2.375 -23.892 -26.678 1.00 42.21 O ATOM 0 H GLU A 74 -6.735 -22.040 -26.438 1.00 41.42 H new ATOM 0 HA GLU A 74 -5.499 -20.735 -24.272 1.00 55.14 H new ATOM 0 HB2 GLU A 74 -4.542 -20.999 -27.149 1.00 40.15 H new ATOM 0 HB3 GLU A 74 -3.537 -20.698 -25.744 1.00 40.15 H new ATOM 0 HG2 GLU A 74 -4.785 -23.002 -24.969 1.00 72.42 H new ATOM 0 HG3 GLU A 74 -4.754 -23.231 -26.706 1.00 72.42 H new ATOM 1159 N LEU A 75 -6.532 -18.815 -26.705 1.00 1.40 N ATOM 1160 CA LEU A 75 -6.735 -17.429 -27.111 1.00 45.14 C ATOM 1161 C LEU A 75 -7.709 -16.724 -26.173 1.00 1.22 C ATOM 1162 O LEU A 75 -7.441 -15.618 -25.701 1.00 5.20 O ATOM 1163 CB LEU A 75 -7.261 -17.370 -28.547 1.00 44.43 C ATOM 1164 CG LEU A 75 -6.902 -16.114 -29.342 1.00 41.31 C ATOM 1165 CD1 LEU A 75 -6.678 -16.455 -30.807 1.00 1.42 C ATOM 1166 CD2 LEU A 75 -7.993 -15.063 -29.198 1.00 60.14 C ATOM 0 H LEU A 75 -7.016 -19.500 -27.286 1.00 1.40 H new ATOM 0 HA LEU A 75 -5.774 -16.917 -27.060 1.00 45.14 H new ATOM 0 HB2 LEU A 75 -6.883 -18.238 -29.087 1.00 44.43 H new ATOM 0 HB3 LEU A 75 -8.347 -17.460 -28.519 1.00 44.43 H new ATOM 0 HG LEU A 75 -5.975 -15.705 -28.940 1.00 41.31 H new ATOM 0 HD11 LEU A 75 -6.424 -15.549 -31.357 1.00 1.42 H new ATOM 0 HD12 LEU A 75 -5.862 -17.173 -30.893 1.00 1.42 H new ATOM 0 HD13 LEU A 75 -7.588 -16.888 -31.223 1.00 1.42 H new ATOM 0 HD21 LEU A 75 -7.721 -14.176 -29.770 1.00 60.14 H new ATOM 0 HD22 LEU A 75 -8.935 -15.463 -29.574 1.00 60.14 H new ATOM 0 HD23 LEU A 75 -8.105 -14.797 -28.147 1.00 60.14 H new ATOM 1178 N ARG A 76 -8.838 -17.371 -25.904 1.00 53.15 N ATOM 1179 CA ARG A 76 -9.850 -16.806 -25.021 1.00 71.21 C ATOM 1180 C ARG A 76 -9.254 -16.462 -23.659 1.00 5.03 C ATOM 1181 O ARG A 76 -9.447 -15.361 -23.145 1.00 63.04 O ATOM 1182 CB ARG A 76 -11.012 -17.787 -24.848 1.00 50.31 C ATOM 1183 CG ARG A 76 -12.306 -17.126 -24.405 1.00 31.43 C ATOM 1184 CD ARG A 76 -13.474 -18.099 -24.452 1.00 44.41 C ATOM 1185 NE ARG A 76 -13.386 -19.111 -23.402 1.00 52.11 N ATOM 1186 CZ ARG A 76 -14.090 -20.237 -23.406 1.00 63.12 C ATOM 1187 NH1 ARG A 76 -14.930 -20.495 -24.399 1.00 15.42 N ATOM 1188 NH2 ARG A 76 -13.955 -21.108 -22.415 1.00 22.52 N ATOM 0 H ARG A 76 -9.075 -18.287 -26.285 1.00 53.15 H new ATOM 0 HA ARG A 76 -10.222 -15.889 -25.477 1.00 71.21 H new ATOM 0 HB2 ARG A 76 -11.183 -18.305 -25.792 1.00 50.31 H new ATOM 0 HB3 ARG A 76 -10.731 -18.544 -24.116 1.00 50.31 H new ATOM 0 HG2 ARG A 76 -12.191 -16.743 -23.391 1.00 31.43 H new ATOM 0 HG3 ARG A 76 -12.517 -16.271 -25.047 1.00 31.43 H new ATOM 0 HD2 ARG A 76 -14.409 -17.548 -24.347 1.00 44.41 H new ATOM 0 HD3 ARG A 76 -13.499 -18.588 -25.426 1.00 44.41 H new ATOM 0 HE ARG A 76 -12.749 -18.944 -22.623 1.00 52.11 H new ATOM 0 HH11 ARG A 76 -15.037 -19.828 -25.163 1.00 15.42 H new ATOM 0 HH12 ARG A 76 -15.469 -21.361 -24.399 1.00 15.42 H new ATOM 0 HH21 ARG A 76 -13.310 -20.913 -21.649 1.00 22.52 H new ATOM 0 HH22 ARG A 76 -14.496 -21.973 -22.419 1.00 22.52 H new ATOM 1202 N SER A 77 -8.528 -17.413 -23.080 1.00 25.02 N ATOM 1203 CA SER A 77 -7.906 -17.215 -21.776 1.00 75.31 C ATOM 1204 C SER A 77 -7.077 -15.934 -21.761 1.00 2.15 C ATOM 1205 O SER A 77 -7.191 -15.118 -20.846 1.00 15.44 O ATOM 1206 CB SER A 77 -7.024 -18.412 -21.420 1.00 32.42 C ATOM 1207 OG SER A 77 -6.535 -19.050 -22.585 1.00 62.45 O ATOM 0 H SER A 77 -8.356 -18.329 -23.494 1.00 25.02 H new ATOM 0 HA SER A 77 -8.698 -17.125 -21.032 1.00 75.31 H new ATOM 0 HB2 SER A 77 -6.187 -18.081 -20.805 1.00 32.42 H new ATOM 0 HB3 SER A 77 -7.595 -19.124 -20.824 1.00 32.42 H new ATOM 0 HG SER A 77 -7.211 -19.673 -22.925 1.00 62.45 H new ATOM 1213 N LEU A 78 -6.241 -15.766 -22.779 1.00 21.23 N ATOM 1214 CA LEU A 78 -5.390 -14.585 -22.885 1.00 23.35 C ATOM 1215 C LEU A 78 -6.227 -13.309 -22.871 1.00 10.34 C ATOM 1216 O LEU A 78 -6.029 -12.434 -22.027 1.00 44.23 O ATOM 1217 CB LEU A 78 -4.554 -14.647 -24.163 1.00 64.42 C ATOM 1218 CG LEU A 78 -3.084 -15.031 -23.986 1.00 64.40 C ATOM 1219 CD1 LEU A 78 -2.390 -14.063 -23.042 1.00 51.52 C ATOM 1220 CD2 LEU A 78 -2.965 -16.459 -23.473 1.00 12.24 C ATOM 0 H LEU A 78 -6.134 -16.433 -23.544 1.00 21.23 H new ATOM 0 HA LEU A 78 -4.722 -14.569 -22.023 1.00 23.35 H new ATOM 0 HB2 LEU A 78 -5.017 -15.364 -24.842 1.00 64.42 H new ATOM 0 HB3 LEU A 78 -4.598 -13.673 -24.650 1.00 64.42 H new ATOM 0 HG LEU A 78 -2.593 -14.973 -24.957 1.00 64.40 H new ATOM 0 HD11 LEU A 78 -1.345 -14.352 -22.928 1.00 51.52 H new ATOM 0 HD12 LEU A 78 -2.445 -13.054 -23.450 1.00 51.52 H new ATOM 0 HD13 LEU A 78 -2.881 -14.088 -22.069 1.00 51.52 H new ATOM 0 HD21 LEU A 78 -1.913 -16.716 -23.353 1.00 12.24 H new ATOM 0 HD22 LEU A 78 -3.471 -16.544 -22.511 1.00 12.24 H new ATOM 0 HD23 LEU A 78 -3.426 -17.142 -24.187 1.00 12.24 H new ATOM 1232 N TYR A 79 -7.161 -13.210 -23.810 1.00 0.32 N ATOM 1233 CA TYR A 79 -8.027 -12.042 -23.906 1.00 11.52 C ATOM 1234 C TYR A 79 -8.686 -11.740 -22.564 1.00 25.42 C ATOM 1235 O TYR A 79 -8.982 -10.588 -22.250 1.00 51.41 O ATOM 1236 CB TYR A 79 -9.097 -12.261 -24.976 1.00 62.20 C ATOM 1237 CG TYR A 79 -9.708 -10.978 -25.494 1.00 61.43 C ATOM 1238 CD1 TYR A 79 -8.991 -10.134 -26.333 1.00 44.01 C ATOM 1239 CD2 TYR A 79 -11.001 -10.610 -25.143 1.00 65.21 C ATOM 1240 CE1 TYR A 79 -9.545 -8.961 -26.808 1.00 42.31 C ATOM 1241 CE2 TYR A 79 -11.563 -9.440 -25.615 1.00 73.24 C ATOM 1242 CZ TYR A 79 -10.831 -8.618 -26.447 1.00 32.21 C ATOM 1243 OH TYR A 79 -11.387 -7.450 -26.918 1.00 0.41 O ATOM 0 H TYR A 79 -7.338 -13.925 -24.516 1.00 0.32 H new ATOM 0 HA TYR A 79 -7.412 -11.187 -24.187 1.00 11.52 H new ATOM 0 HB2 TYR A 79 -8.658 -12.807 -25.811 1.00 62.20 H new ATOM 0 HB3 TYR A 79 -9.887 -12.889 -24.565 1.00 62.20 H new ATOM 0 HD1 TYR A 79 -7.984 -10.399 -26.619 1.00 44.01 H new ATOM 0 HD2 TYR A 79 -11.576 -11.250 -24.490 1.00 65.21 H new ATOM 0 HE1 TYR A 79 -8.974 -8.316 -27.459 1.00 42.31 H new ATOM 0 HE2 TYR A 79 -12.570 -9.170 -25.334 1.00 73.24 H new ATOM 0 HH TYR A 79 -12.299 -7.358 -26.570 1.00 0.41 H new ATOM 1253 N ASN A 80 -8.915 -12.786 -21.777 1.00 35.51 N ATOM 1254 CA ASN A 80 -9.540 -12.634 -20.468 1.00 4.12 C ATOM 1255 C ASN A 80 -8.622 -11.881 -19.510 1.00 41.05 C ATOM 1256 O ASN A 80 -9.080 -11.083 -18.692 1.00 31.05 O ATOM 1257 CB ASN A 80 -9.889 -14.005 -19.884 1.00 43.30 C ATOM 1258 CG ASN A 80 -11.385 -14.249 -19.836 1.00 2.20 C ATOM 1259 OD1 ASN A 80 -11.952 -14.490 -18.771 1.00 23.43 O ATOM 1260 ND2 ASN A 80 -12.032 -14.189 -20.995 1.00 51.50 N ATOM 0 H ASN A 80 -8.677 -13.747 -22.022 1.00 35.51 H new ATOM 0 HA ASN A 80 -10.455 -12.056 -20.596 1.00 4.12 H new ATOM 0 HB2 ASN A 80 -9.416 -14.783 -20.483 1.00 43.30 H new ATOM 0 HB3 ASN A 80 -9.478 -14.083 -18.877 1.00 43.30 H new ATOM 0 HD21 ASN A 80 -13.039 -14.346 -21.025 1.00 51.50 H new ATOM 0 HD22 ASN A 80 -11.521 -13.986 -21.854 1.00 51.50 H new ATOM 1267 N THR A 81 -7.322 -12.139 -19.619 1.00 21.03 N ATOM 1268 CA THR A 81 -6.339 -11.486 -18.764 1.00 21.25 C ATOM 1269 C THR A 81 -5.984 -10.101 -19.291 1.00 64.12 C ATOM 1270 O THR A 81 -6.044 -9.114 -18.559 1.00 53.13 O ATOM 1271 CB THR A 81 -5.052 -12.325 -18.646 1.00 31.43 C ATOM 1272 OG1 THR A 81 -5.374 -13.666 -18.263 1.00 2.10 O ATOM 1273 CG2 THR A 81 -4.100 -11.715 -17.627 1.00 70.25 C ATOM 0 H THR A 81 -6.926 -12.796 -20.291 1.00 21.03 H new ATOM 0 HA THR A 81 -6.793 -11.390 -17.778 1.00 21.25 H new ATOM 0 HB THR A 81 -4.560 -12.334 -19.619 1.00 31.43 H new ATOM 0 HG1 THR A 81 -4.551 -14.193 -18.192 1.00 2.10 H new ATOM 0 HG21 THR A 81 -3.199 -12.324 -17.561 1.00 70.25 H new ATOM 0 HG22 THR A 81 -3.833 -10.705 -17.938 1.00 70.25 H new ATOM 0 HG23 THR A 81 -4.586 -11.678 -16.652 1.00 70.25 H new ATOM 1281 N ILE A 82 -5.614 -10.036 -20.567 1.00 31.45 N ATOM 1282 CA ILE A 82 -5.252 -8.771 -21.192 1.00 13.15 C ATOM 1283 C ILE A 82 -6.332 -7.717 -20.969 1.00 4.32 C ATOM 1284 O ILE A 82 -6.044 -6.523 -20.903 1.00 32.25 O ATOM 1285 CB ILE A 82 -5.018 -8.938 -22.705 1.00 61.23 C ATOM 1286 CG1 ILE A 82 -3.923 -9.974 -22.963 1.00 25.02 C ATOM 1287 CG2 ILE A 82 -4.649 -7.603 -23.334 1.00 71.25 C ATOM 1288 CD1 ILE A 82 -4.292 -10.993 -24.019 1.00 21.31 C ATOM 0 H ILE A 82 -5.558 -10.844 -21.186 1.00 31.45 H new ATOM 0 HA ILE A 82 -4.325 -8.442 -20.723 1.00 13.15 H new ATOM 0 HB ILE A 82 -5.942 -9.291 -23.163 1.00 61.23 H new ATOM 0 HG12 ILE A 82 -3.012 -9.459 -23.269 1.00 25.02 H new ATOM 0 HG13 ILE A 82 -3.698 -10.493 -22.031 1.00 25.02 H new ATOM 0 HG21 ILE A 82 -4.487 -7.737 -24.403 1.00 71.25 H new ATOM 0 HG22 ILE A 82 -5.459 -6.890 -23.176 1.00 71.25 H new ATOM 0 HG23 ILE A 82 -3.737 -7.224 -22.873 1.00 71.25 H new ATOM 0 HD11 ILE A 82 -3.469 -11.696 -24.150 1.00 21.31 H new ATOM 0 HD12 ILE A 82 -5.185 -11.534 -23.706 1.00 21.31 H new ATOM 0 HD13 ILE A 82 -4.488 -10.484 -24.963 1.00 21.31 H new ATOM 1300 N ALA A 83 -7.577 -8.169 -20.852 1.00 5.41 N ATOM 1301 CA ALA A 83 -8.699 -7.266 -20.632 1.00 23.53 C ATOM 1302 C ALA A 83 -8.645 -6.653 -19.236 1.00 70.54 C ATOM 1303 O ALA A 83 -8.476 -5.443 -19.086 1.00 1.23 O ATOM 1304 CB ALA A 83 -10.015 -8.002 -20.837 1.00 33.42 C ATOM 0 H ALA A 83 -7.833 -9.155 -20.906 1.00 5.41 H new ATOM 0 HA ALA A 83 -8.631 -6.456 -21.358 1.00 23.53 H new ATOM 0 HB1 ALA A 83 -10.845 -7.316 -20.670 1.00 33.42 H new ATOM 0 HB2 ALA A 83 -10.062 -8.387 -21.856 1.00 33.42 H new ATOM 0 HB3 ALA A 83 -10.082 -8.831 -20.133 1.00 33.42 H new ATOM 1310 N VAL A 84 -8.792 -7.495 -18.219 1.00 2.43 N ATOM 1311 CA VAL A 84 -8.759 -7.037 -16.835 1.00 75.44 C ATOM 1312 C VAL A 84 -7.507 -6.211 -16.560 1.00 31.32 C ATOM 1313 O VAL A 84 -7.551 -5.224 -15.823 1.00 43.03 O ATOM 1314 CB VAL A 84 -8.809 -8.218 -15.850 1.00 24.41 C ATOM 1315 CG1 VAL A 84 -8.743 -7.721 -14.414 1.00 53.40 C ATOM 1316 CG2 VAL A 84 -10.063 -9.049 -16.078 1.00 33.44 C ATOM 0 H VAL A 84 -8.935 -8.499 -18.327 1.00 2.43 H new ATOM 0 HA VAL A 84 -9.642 -6.415 -16.687 1.00 75.44 H new ATOM 0 HB VAL A 84 -7.942 -8.853 -16.029 1.00 24.41 H new ATOM 0 HG11 VAL A 84 -8.780 -8.571 -13.733 1.00 53.40 H new ATOM 0 HG12 VAL A 84 -7.813 -7.173 -14.261 1.00 53.40 H new ATOM 0 HG13 VAL A 84 -9.589 -7.062 -14.218 1.00 53.40 H new ATOM 0 HG21 VAL A 84 -10.082 -9.880 -15.373 1.00 33.44 H new ATOM 0 HG22 VAL A 84 -10.945 -8.426 -15.928 1.00 33.44 H new ATOM 0 HG23 VAL A 84 -10.062 -9.437 -17.096 1.00 33.44 H new ATOM 1326 N LEU A 85 -6.393 -6.620 -17.155 1.00 70.22 N ATOM 1327 CA LEU A 85 -5.127 -5.918 -16.975 1.00 45.10 C ATOM 1328 C LEU A 85 -5.152 -4.562 -17.672 1.00 40.24 C ATOM 1329 O LEU A 85 -4.890 -3.530 -17.055 1.00 21.13 O ATOM 1330 CB LEU A 85 -3.972 -6.762 -17.516 1.00 42.11 C ATOM 1331 CG LEU A 85 -2.617 -6.560 -16.837 1.00 1.33 C ATOM 1332 CD1 LEU A 85 -2.599 -7.229 -15.471 1.00 20.34 C ATOM 1333 CD2 LEU A 85 -1.495 -7.101 -17.711 1.00 50.24 C ATOM 0 H LEU A 85 -6.340 -7.435 -17.767 1.00 70.22 H new ATOM 0 HA LEU A 85 -4.980 -5.754 -15.908 1.00 45.10 H new ATOM 0 HB2 LEU A 85 -4.246 -7.814 -17.430 1.00 42.11 H new ATOM 0 HB3 LEU A 85 -3.859 -6.548 -18.579 1.00 42.11 H new ATOM 0 HG LEU A 85 -2.459 -5.490 -16.698 1.00 1.33 H new ATOM 0 HD11 LEU A 85 -1.627 -7.075 -15.003 1.00 20.34 H new ATOM 0 HD12 LEU A 85 -3.377 -6.795 -14.843 1.00 20.34 H new ATOM 0 HD13 LEU A 85 -2.780 -8.298 -15.587 1.00 20.34 H new ATOM 0 HD21 LEU A 85 -0.539 -6.948 -17.211 1.00 50.24 H new ATOM 0 HD22 LEU A 85 -1.649 -8.166 -17.882 1.00 50.24 H new ATOM 0 HD23 LEU A 85 -1.493 -6.576 -18.666 1.00 50.24 H new ATOM 1345 N TYR A 86 -5.470 -4.572 -18.962 1.00 12.30 N ATOM 1346 CA TYR A 86 -5.528 -3.343 -19.745 1.00 21.52 C ATOM 1347 C TYR A 86 -6.412 -2.304 -19.061 1.00 1.12 C ATOM 1348 O TYR A 86 -6.029 -1.143 -18.921 1.00 55.40 O ATOM 1349 CB TYR A 86 -6.058 -3.634 -21.150 1.00 35.22 C ATOM 1350 CG TYR A 86 -6.344 -2.388 -21.959 1.00 25.35 C ATOM 1351 CD1 TYR A 86 -5.309 -1.612 -22.465 1.00 32.45 C ATOM 1352 CD2 TYR A 86 -7.650 -1.989 -22.217 1.00 12.54 C ATOM 1353 CE1 TYR A 86 -5.566 -0.472 -23.203 1.00 24.41 C ATOM 1354 CE2 TYR A 86 -7.917 -0.852 -22.955 1.00 52.43 C ATOM 1355 CZ TYR A 86 -6.872 -0.098 -23.446 1.00 15.51 C ATOM 1356 OH TYR A 86 -7.132 1.036 -24.182 1.00 21.03 O ATOM 0 H TYR A 86 -5.692 -5.418 -19.488 1.00 12.30 H new ATOM 0 HA TYR A 86 -4.518 -2.941 -19.821 1.00 21.52 H new ATOM 0 HB2 TYR A 86 -5.331 -4.245 -21.684 1.00 35.22 H new ATOM 0 HB3 TYR A 86 -6.972 -4.223 -21.070 1.00 35.22 H new ATOM 0 HD1 TYR A 86 -4.286 -1.904 -22.279 1.00 32.45 H new ATOM 0 HD2 TYR A 86 -8.470 -2.578 -21.834 1.00 12.54 H new ATOM 0 HE1 TYR A 86 -4.750 0.122 -23.587 1.00 24.41 H new ATOM 0 HE2 TYR A 86 -8.938 -0.556 -23.146 1.00 52.43 H new ATOM 0 HH TYR A 86 -8.101 1.158 -24.263 1.00 21.03 H new ATOM 1366 N CYS A 87 -7.596 -2.731 -18.637 1.00 0.42 N ATOM 1367 CA CYS A 87 -8.536 -1.839 -17.967 1.00 24.21 C ATOM 1368 C CYS A 87 -7.864 -1.112 -16.807 1.00 0.02 C ATOM 1369 O CYS A 87 -8.229 0.013 -16.471 1.00 75.32 O ATOM 1370 CB CYS A 87 -9.745 -2.626 -17.460 1.00 22.14 C ATOM 1371 SG CYS A 87 -11.019 -2.910 -18.711 1.00 65.45 S ATOM 0 H CYS A 87 -7.928 -3.689 -18.745 1.00 0.42 H new ATOM 0 HA CYS A 87 -8.872 -1.097 -18.691 1.00 24.21 H new ATOM 0 HB2 CYS A 87 -9.404 -3.589 -17.079 1.00 22.14 H new ATOM 0 HB3 CYS A 87 -10.188 -2.090 -16.621 1.00 22.14 H new ATOM 0 HG CYS A 87 -10.700 -3.947 -19.428 1.00 65.45 H new ATOM 1377 N VAL A 88 -6.880 -1.766 -16.198 1.00 12.41 N ATOM 1378 CA VAL A 88 -6.155 -1.182 -15.074 1.00 22.51 C ATOM 1379 C VAL A 88 -5.143 -0.147 -15.551 1.00 32.01 C ATOM 1380 O VAL A 88 -4.941 0.882 -14.905 1.00 75.31 O ATOM 1381 CB VAL A 88 -5.422 -2.263 -14.257 1.00 12.22 C ATOM 1382 CG1 VAL A 88 -4.792 -1.655 -13.013 1.00 64.02 C ATOM 1383 CG2 VAL A 88 -6.376 -3.388 -13.886 1.00 50.41 C ATOM 0 H VAL A 88 -6.566 -2.700 -16.463 1.00 12.41 H new ATOM 0 HA VAL A 88 -6.895 -0.696 -14.438 1.00 22.51 H new ATOM 0 HB VAL A 88 -4.625 -2.681 -14.872 1.00 12.22 H new ATOM 0 HG11 VAL A 88 -4.279 -2.433 -12.448 1.00 64.02 H new ATOM 0 HG12 VAL A 88 -4.076 -0.887 -13.306 1.00 64.02 H new ATOM 0 HG13 VAL A 88 -5.569 -1.209 -12.392 1.00 64.02 H new ATOM 0 HG21 VAL A 88 -5.842 -4.143 -13.309 1.00 50.41 H new ATOM 0 HG22 VAL A 88 -7.196 -2.988 -13.289 1.00 50.41 H new ATOM 0 HG23 VAL A 88 -6.775 -3.840 -14.794 1.00 50.41 H new ATOM 1393 N HIS A 89 -4.509 -0.425 -16.685 1.00 65.02 N ATOM 1394 CA HIS A 89 -3.517 0.483 -17.251 1.00 33.23 C ATOM 1395 C HIS A 89 -4.193 1.675 -17.921 1.00 74.52 C ATOM 1396 O HIS A 89 -3.480 2.630 -18.228 1.00 31.30 O ATOM 1397 CB HIS A 89 -2.637 -0.253 -18.261 1.00 71.42 C ATOM 1398 CG HIS A 89 -1.813 -1.346 -17.654 1.00 30.11 C ATOM 1399 ND1 HIS A 89 -1.494 -1.392 -16.313 1.00 73.33 N ATOM 1400 CD2 HIS A 89 -1.241 -2.438 -18.212 1.00 32.34 C ATOM 1401 CE1 HIS A 89 -0.763 -2.465 -16.073 1.00 54.43 C ATOM 1402 NE2 HIS A 89 -0.595 -3.118 -17.209 1.00 34.02 N ATOM 0 H HIS A 89 -4.664 -1.272 -17.231 1.00 65.02 H new ATOM 0 HA HIS A 89 -2.892 0.851 -16.438 1.00 33.23 H new ATOM 0 HB2 HIS A 89 -3.270 -0.677 -19.041 1.00 71.42 H new ATOM 0 HB3 HIS A 89 -1.974 0.465 -18.744 1.00 71.42 H new ATOM 0 HD1 HIS A 89 -1.778 -0.704 -15.615 1.00 73.33 H new ATOM 0 HD2 HIS A 89 -1.284 -2.722 -19.253 1.00 32.34 H new ATOM 0 HE1 HIS A 89 -0.369 -2.759 -15.111 1.00 54.43 H new ATOM 1411 N GLN A 90 -5.503 1.647 -18.148 1.00 11.20 N ATOM 1412 CA GLN A 90 -6.192 2.762 -18.786 1.00 72.03 C ATOM 1413 C GLN A 90 -6.933 3.607 -17.755 1.00 34.01 C ATOM 1414 O GLN A 90 -6.513 4.719 -17.432 1.00 62.14 O ATOM 1415 CB GLN A 90 -7.173 2.247 -19.840 1.00 74.03 C ATOM 1416 CG GLN A 90 -6.664 2.386 -21.266 1.00 3.43 C ATOM 1417 CD GLN A 90 -6.339 3.821 -21.633 1.00 2.23 C ATOM 1418 OE1 GLN A 90 -6.725 4.756 -20.930 1.00 5.41 O ATOM 1419 NE2 GLN A 90 -5.626 4.002 -22.738 1.00 12.44 N ATOM 0 H GLN A 90 -6.108 0.864 -17.899 1.00 11.20 H new ATOM 0 HA GLN A 90 -5.443 3.388 -19.271 1.00 72.03 H new ATOM 0 HB2 GLN A 90 -7.389 1.197 -19.641 1.00 74.03 H new ATOM 0 HB3 GLN A 90 -8.114 2.789 -19.744 1.00 74.03 H new ATOM 0 HG2 GLN A 90 -5.772 1.772 -21.391 1.00 3.43 H new ATOM 0 HG3 GLN A 90 -7.415 2.000 -21.955 1.00 3.43 H new ATOM 0 HE21 GLN A 90 -5.328 3.198 -23.290 1.00 12.44 H new ATOM 0 HE22 GLN A 90 -5.377 4.945 -23.035 1.00 12.44 H new ATOM 1428 N ARG A 91 -8.036 3.072 -17.240 1.00 53.45 N ATOM 1429 CA ARG A 91 -8.835 3.778 -16.246 1.00 42.44 C ATOM 1430 C ARG A 91 -10.032 2.936 -15.813 1.00 42.25 C ATOM 1431 O ARG A 91 -10.439 2.969 -14.652 1.00 31.31 O ATOM 1432 CB ARG A 91 -9.317 5.118 -16.806 1.00 50.50 C ATOM 1433 CG ARG A 91 -9.100 6.287 -15.859 1.00 5.31 C ATOM 1434 CD ARG A 91 -8.700 7.546 -16.612 1.00 70.30 C ATOM 1435 NE ARG A 91 -9.839 8.165 -17.286 1.00 65.04 N ATOM 1436 CZ ARG A 91 -9.719 9.026 -18.291 1.00 41.50 C ATOM 1437 NH1 ARG A 91 -8.517 9.369 -18.734 1.00 34.24 N ATOM 1438 NH2 ARG A 91 -10.801 9.546 -18.854 1.00 25.43 N ATOM 0 H ARG A 91 -8.396 2.152 -17.495 1.00 53.45 H new ATOM 0 HA ARG A 91 -8.206 3.961 -15.374 1.00 42.44 H new ATOM 0 HB2 ARG A 91 -8.797 5.319 -17.743 1.00 50.50 H new ATOM 0 HB3 ARG A 91 -10.379 5.043 -17.040 1.00 50.50 H new ATOM 0 HG2 ARG A 91 -10.013 6.474 -15.294 1.00 5.31 H new ATOM 0 HG3 ARG A 91 -8.325 6.032 -15.136 1.00 5.31 H new ATOM 0 HD2 ARG A 91 -8.258 8.260 -15.916 1.00 70.30 H new ATOM 0 HD3 ARG A 91 -7.933 7.301 -17.347 1.00 70.30 H new ATOM 0 HE ARG A 91 -10.777 7.923 -16.968 1.00 65.04 H new ATOM 0 HH11 ARG A 91 -7.682 8.972 -18.303 1.00 34.24 H new ATOM 0 HH12 ARG A 91 -8.427 10.030 -19.506 1.00 34.24 H new ATOM 0 HH21 ARG A 91 -11.727 9.285 -18.516 1.00 25.43 H new ATOM 0 HH22 ARG A 91 -10.707 10.207 -19.625 1.00 25.43 H new ATOM 1452 N ILE A 92 -10.589 2.182 -16.755 1.00 3.21 N ATOM 1453 CA ILE A 92 -11.737 1.330 -16.470 1.00 73.41 C ATOM 1454 C ILE A 92 -11.476 0.440 -15.261 1.00 20.33 C ATOM 1455 O ILE A 92 -10.487 -0.290 -15.216 1.00 44.21 O ATOM 1456 CB ILE A 92 -12.094 0.444 -17.679 1.00 11.43 C ATOM 1457 CG1 ILE A 92 -12.349 1.307 -18.916 1.00 14.25 C ATOM 1458 CG2 ILE A 92 -13.311 -0.415 -17.365 1.00 74.10 C ATOM 1459 CD1 ILE A 92 -11.244 1.228 -19.946 1.00 32.22 C ATOM 0 H ILE A 92 -10.264 2.144 -17.721 1.00 3.21 H new ATOM 0 HA ILE A 92 -12.575 1.993 -16.255 1.00 73.41 H new ATOM 0 HB ILE A 92 -11.252 -0.215 -17.888 1.00 11.43 H new ATOM 0 HG12 ILE A 92 -13.287 0.999 -19.377 1.00 14.25 H new ATOM 0 HG13 ILE A 92 -12.472 2.345 -18.606 1.00 14.25 H new ATOM 0 HG21 ILE A 92 -13.551 -1.035 -18.228 1.00 74.10 H new ATOM 0 HG22 ILE A 92 -13.095 -1.053 -16.508 1.00 74.10 H new ATOM 0 HG23 ILE A 92 -14.160 0.228 -17.133 1.00 74.10 H new ATOM 0 HD11 ILE A 92 -11.492 1.865 -20.795 1.00 32.22 H new ATOM 0 HD12 ILE A 92 -10.307 1.565 -19.501 1.00 32.22 H new ATOM 0 HD13 ILE A 92 -11.135 0.198 -20.285 1.00 32.22 H new ATOM 1471 N ASP A 93 -12.371 0.506 -14.280 1.00 53.41 N ATOM 1472 CA ASP A 93 -12.239 -0.296 -13.070 1.00 11.13 C ATOM 1473 C ASP A 93 -13.308 -1.383 -13.018 1.00 70.11 C ATOM 1474 O ASP A 93 -14.131 -1.416 -12.103 1.00 53.12 O ATOM 1475 CB ASP A 93 -12.339 0.594 -11.830 1.00 3.13 C ATOM 1476 CG ASP A 93 -11.932 -0.131 -10.562 1.00 2.30 C ATOM 1477 OD1 ASP A 93 -11.355 -1.235 -10.668 1.00 34.32 O ATOM 1478 OD2 ASP A 93 -12.190 0.403 -9.463 1.00 53.14 O ATOM 0 H ASP A 93 -13.195 1.107 -14.300 1.00 53.41 H new ATOM 0 HA ASP A 93 -11.260 -0.775 -13.087 1.00 11.13 H new ATOM 0 HB2 ASP A 93 -11.705 1.470 -11.963 1.00 3.13 H new ATOM 0 HB3 ASP A 93 -13.363 0.954 -11.726 1.00 3.13 H new ATOM 1483 N VAL A 94 -13.290 -2.270 -14.008 1.00 34.32 N ATOM 1484 CA VAL A 94 -14.258 -3.358 -14.077 1.00 2.33 C ATOM 1485 C VAL A 94 -14.176 -4.245 -12.839 1.00 20.35 C ATOM 1486 O VAL A 94 -13.179 -4.231 -12.116 1.00 61.32 O ATOM 1487 CB VAL A 94 -14.040 -4.225 -15.330 1.00 52.11 C ATOM 1488 CG1 VAL A 94 -14.331 -3.424 -16.591 1.00 1.53 C ATOM 1489 CG2 VAL A 94 -12.623 -4.779 -15.356 1.00 24.02 C ATOM 0 H VAL A 94 -12.616 -2.256 -14.773 1.00 34.32 H new ATOM 0 HA VAL A 94 -15.246 -2.900 -14.129 1.00 2.33 H new ATOM 0 HB VAL A 94 -14.733 -5.065 -15.293 1.00 52.11 H new ATOM 0 HG11 VAL A 94 -14.172 -4.053 -17.467 1.00 1.53 H new ATOM 0 HG12 VAL A 94 -15.366 -3.082 -16.574 1.00 1.53 H new ATOM 0 HG13 VAL A 94 -13.664 -2.563 -16.637 1.00 1.53 H new ATOM 0 HG21 VAL A 94 -12.487 -5.389 -16.249 1.00 24.02 H new ATOM 0 HG22 VAL A 94 -11.910 -3.955 -15.368 1.00 24.02 H new ATOM 0 HG23 VAL A 94 -12.455 -5.391 -14.469 1.00 24.02 H new ATOM 1499 N LYS A 95 -15.231 -5.016 -12.599 1.00 35.41 N ATOM 1500 CA LYS A 95 -15.281 -5.912 -11.450 1.00 14.33 C ATOM 1501 C LYS A 95 -14.959 -7.344 -11.863 1.00 20.03 C ATOM 1502 O LYS A 95 -14.484 -8.141 -11.053 1.00 44.44 O ATOM 1503 CB LYS A 95 -16.661 -5.856 -10.793 1.00 0.21 C ATOM 1504 CG LYS A 95 -16.782 -4.788 -9.719 1.00 43.34 C ATOM 1505 CD LYS A 95 -18.118 -4.870 -9.000 1.00 13.45 C ATOM 1506 CE LYS A 95 -18.293 -3.721 -8.018 1.00 51.14 C ATOM 1507 NZ LYS A 95 -18.527 -4.207 -6.630 1.00 51.14 N ATOM 0 H LYS A 95 -16.065 -5.038 -13.186 1.00 35.41 H new ATOM 0 HA LYS A 95 -14.531 -5.583 -10.731 1.00 14.33 H new ATOM 0 HB2 LYS A 95 -17.412 -5.673 -11.561 1.00 0.21 H new ATOM 0 HB3 LYS A 95 -16.884 -6.828 -10.353 1.00 0.21 H new ATOM 0 HG2 LYS A 95 -15.972 -4.902 -8.998 1.00 43.34 H new ATOM 0 HG3 LYS A 95 -16.671 -3.802 -10.171 1.00 43.34 H new ATOM 0 HD2 LYS A 95 -18.927 -4.853 -9.730 1.00 13.45 H new ATOM 0 HD3 LYS A 95 -18.189 -5.819 -8.468 1.00 13.45 H new ATOM 0 HE2 LYS A 95 -17.405 -3.089 -8.036 1.00 51.14 H new ATOM 0 HE3 LYS A 95 -19.132 -3.100 -8.332 1.00 51.14 H new ATOM 0 HZ1 LYS A 95 -18.641 -3.394 -5.992 1.00 51.14 H new ATOM 0 HZ2 LYS A 95 -19.389 -4.789 -6.607 1.00 51.14 H new ATOM 0 HZ3 LYS A 95 -17.715 -4.778 -6.321 1.00 51.14 H new ATOM 1521 N ASP A 96 -15.218 -7.664 -13.125 1.00 75.14 N ATOM 1522 CA ASP A 96 -14.954 -9.000 -13.646 1.00 52.41 C ATOM 1523 C ASP A 96 -14.398 -8.931 -15.065 1.00 74.51 C ATOM 1524 O ASP A 96 -14.423 -7.877 -15.703 1.00 24.42 O ATOM 1525 CB ASP A 96 -16.232 -9.841 -13.626 1.00 54.21 C ATOM 1526 CG ASP A 96 -17.414 -9.110 -14.234 1.00 44.41 C ATOM 1527 OD1 ASP A 96 -18.047 -8.307 -13.518 1.00 43.33 O ATOM 1528 OD2 ASP A 96 -17.707 -9.343 -15.426 1.00 4.25 O ATOM 0 H ASP A 96 -15.611 -7.016 -13.807 1.00 75.14 H new ATOM 0 HA ASP A 96 -14.208 -9.471 -13.006 1.00 52.41 H new ATOM 0 HB2 ASP A 96 -16.062 -10.769 -14.172 1.00 54.21 H new ATOM 0 HB3 ASP A 96 -16.467 -10.115 -12.598 1.00 54.21 H new ATOM 1533 N THR A 97 -13.895 -10.059 -15.554 1.00 54.42 N ATOM 1534 CA THR A 97 -13.330 -10.126 -16.896 1.00 72.43 C ATOM 1535 C THR A 97 -14.376 -9.781 -17.951 1.00 21.44 C ATOM 1536 O THR A 97 -14.111 -9.011 -18.873 1.00 61.34 O ATOM 1537 CB THR A 97 -12.757 -11.524 -17.196 1.00 33.41 C ATOM 1538 OG1 THR A 97 -11.917 -11.951 -16.118 1.00 55.11 O ATOM 1539 CG2 THR A 97 -11.962 -11.517 -18.492 1.00 55.33 C ATOM 0 H THR A 97 -13.867 -10.940 -15.041 1.00 54.42 H new ATOM 0 HA THR A 97 -12.523 -9.395 -16.935 1.00 72.43 H new ATOM 0 HB THR A 97 -13.591 -12.218 -17.304 1.00 33.41 H new ATOM 0 HG1 THR A 97 -11.007 -12.097 -16.451 1.00 55.11 H new ATOM 0 HG21 THR A 97 -11.568 -12.515 -18.682 1.00 55.33 H new ATOM 0 HG22 THR A 97 -12.611 -11.220 -19.316 1.00 55.33 H new ATOM 0 HG23 THR A 97 -11.136 -10.810 -18.408 1.00 55.33 H new ATOM 1547 N LYS A 98 -15.566 -10.356 -17.807 1.00 0.12 N ATOM 1548 CA LYS A 98 -16.654 -10.108 -18.745 1.00 11.54 C ATOM 1549 C LYS A 98 -16.888 -8.612 -18.924 1.00 55.14 C ATOM 1550 O LYS A 98 -16.940 -8.113 -20.048 1.00 43.21 O ATOM 1551 CB LYS A 98 -17.938 -10.781 -18.258 1.00 24.55 C ATOM 1552 CG LYS A 98 -18.885 -11.171 -19.379 1.00 52.23 C ATOM 1553 CD LYS A 98 -20.332 -10.882 -19.014 1.00 52.44 C ATOM 1554 CE LYS A 98 -20.716 -9.449 -19.349 1.00 43.24 C ATOM 1555 NZ LYS A 98 -22.062 -9.098 -18.820 1.00 32.24 N ATOM 0 H LYS A 98 -15.801 -10.997 -17.049 1.00 0.12 H new ATOM 0 HA LYS A 98 -16.372 -10.531 -19.709 1.00 11.54 H new ATOM 0 HB2 LYS A 98 -17.677 -11.673 -17.688 1.00 24.55 H new ATOM 0 HB3 LYS A 98 -18.455 -10.107 -17.575 1.00 24.55 H new ATOM 0 HG2 LYS A 98 -18.622 -10.625 -20.285 1.00 52.23 H new ATOM 0 HG3 LYS A 98 -18.770 -12.232 -19.601 1.00 52.23 H new ATOM 0 HD2 LYS A 98 -20.987 -11.570 -19.548 1.00 52.44 H new ATOM 0 HD3 LYS A 98 -20.482 -11.061 -17.949 1.00 52.44 H new ATOM 0 HE2 LYS A 98 -19.974 -8.767 -18.934 1.00 43.24 H new ATOM 0 HE3 LYS A 98 -20.704 -9.313 -20.430 1.00 43.24 H new ATOM 0 HZ1 LYS A 98 -22.287 -8.114 -19.069 1.00 32.24 H new ATOM 0 HZ2 LYS A 98 -22.774 -9.732 -19.235 1.00 32.24 H new ATOM 0 HZ3 LYS A 98 -22.067 -9.203 -17.785 1.00 32.24 H new ATOM 1569 N GLU A 99 -17.026 -7.901 -17.810 1.00 21.24 N ATOM 1570 CA GLU A 99 -17.254 -6.461 -17.845 1.00 63.24 C ATOM 1571 C GLU A 99 -16.146 -5.754 -18.621 1.00 43.00 C ATOM 1572 O GLU A 99 -16.395 -4.779 -19.329 1.00 42.41 O ATOM 1573 CB GLU A 99 -17.335 -5.900 -16.424 1.00 63.42 C ATOM 1574 CG GLU A 99 -18.713 -5.378 -16.054 1.00 34.34 C ATOM 1575 CD GLU A 99 -18.671 -4.377 -14.914 1.00 64.01 C ATOM 1576 OE1 GLU A 99 -17.556 -4.039 -14.464 1.00 23.30 O ATOM 1577 OE2 GLU A 99 -19.751 -3.935 -14.473 1.00 71.44 O ATOM 0 H GLU A 99 -16.984 -8.299 -16.872 1.00 21.24 H new ATOM 0 HA GLU A 99 -18.202 -6.281 -18.353 1.00 63.24 H new ATOM 0 HB2 GLU A 99 -17.049 -6.680 -15.718 1.00 63.42 H new ATOM 0 HB3 GLU A 99 -16.610 -5.093 -16.319 1.00 63.42 H new ATOM 0 HG2 GLU A 99 -19.167 -4.910 -16.927 1.00 34.34 H new ATOM 0 HG3 GLU A 99 -19.352 -6.216 -15.774 1.00 34.34 H new ATOM 1584 N ALA A 100 -14.923 -6.254 -18.481 1.00 14.10 N ATOM 1585 CA ALA A 100 -13.777 -5.672 -19.168 1.00 74.22 C ATOM 1586 C ALA A 100 -13.935 -5.774 -20.681 1.00 51.02 C ATOM 1587 O ALA A 100 -13.448 -4.921 -21.426 1.00 42.40 O ATOM 1588 CB ALA A 100 -12.491 -6.353 -18.723 1.00 24.30 C ATOM 0 H ALA A 100 -14.700 -7.061 -17.898 1.00 14.10 H new ATOM 0 HA ALA A 100 -13.725 -4.616 -18.904 1.00 74.22 H new ATOM 0 HB1 ALA A 100 -11.644 -5.908 -19.245 1.00 24.30 H new ATOM 0 HB2 ALA A 100 -12.364 -6.224 -17.648 1.00 24.30 H new ATOM 0 HB3 ALA A 100 -12.543 -7.416 -18.957 1.00 24.30 H new ATOM 1594 N LEU A 101 -14.618 -6.821 -21.131 1.00 71.05 N ATOM 1595 CA LEU A 101 -14.840 -7.035 -22.557 1.00 2.22 C ATOM 1596 C LEU A 101 -15.908 -6.086 -23.090 1.00 73.15 C ATOM 1597 O LEU A 101 -15.720 -5.440 -24.121 1.00 52.33 O ATOM 1598 CB LEU A 101 -15.254 -8.484 -22.816 1.00 41.33 C ATOM 1599 CG LEU A 101 -14.372 -9.558 -22.179 1.00 4.34 C ATOM 1600 CD1 LEU A 101 -14.835 -10.946 -22.596 1.00 21.20 C ATOM 1601 CD2 LEU A 101 -12.913 -9.345 -22.556 1.00 60.21 C ATOM 0 H LEU A 101 -15.028 -7.535 -20.529 1.00 71.05 H new ATOM 0 HA LEU A 101 -13.906 -6.831 -23.080 1.00 2.22 H new ATOM 0 HB2 LEU A 101 -16.274 -8.619 -22.456 1.00 41.33 H new ATOM 0 HB3 LEU A 101 -15.272 -8.649 -23.893 1.00 41.33 H new ATOM 0 HG LEU A 101 -14.461 -9.477 -21.096 1.00 4.34 H new ATOM 0 HD11 LEU A 101 -14.195 -11.697 -22.133 1.00 21.20 H new ATOM 0 HD12 LEU A 101 -15.865 -11.098 -22.274 1.00 21.20 H new ATOM 0 HD13 LEU A 101 -14.777 -11.038 -23.681 1.00 21.20 H new ATOM 0 HD21 LEU A 101 -12.301 -10.119 -22.093 1.00 60.21 H new ATOM 0 HD22 LEU A 101 -12.806 -9.397 -23.639 1.00 60.21 H new ATOM 0 HD23 LEU A 101 -12.586 -8.366 -22.206 1.00 60.21 H new ATOM 1613 N ASP A 102 -17.028 -6.004 -22.380 1.00 3.52 N ATOM 1614 CA ASP A 102 -18.125 -5.131 -22.780 1.00 41.11 C ATOM 1615 C ASP A 102 -17.651 -3.687 -22.908 1.00 53.12 C ATOM 1616 O ASP A 102 -18.021 -2.982 -23.847 1.00 71.40 O ATOM 1617 CB ASP A 102 -19.269 -5.217 -21.767 1.00 44.33 C ATOM 1618 CG ASP A 102 -20.610 -4.865 -22.379 1.00 23.54 C ATOM 1619 OD1 ASP A 102 -20.651 -3.962 -23.240 1.00 32.00 O ATOM 1620 OD2 ASP A 102 -21.619 -5.493 -21.996 1.00 24.35 O ATOM 0 H ASP A 102 -17.200 -6.532 -21.524 1.00 3.52 H new ATOM 0 HA ASP A 102 -18.486 -5.464 -23.753 1.00 41.11 H new ATOM 0 HB2 ASP A 102 -19.313 -6.226 -21.358 1.00 44.33 H new ATOM 0 HB3 ASP A 102 -19.065 -4.544 -20.934 1.00 44.33 H new ATOM 1625 N LYS A 103 -16.830 -3.252 -21.958 1.00 10.02 N ATOM 1626 CA LYS A 103 -16.304 -1.892 -21.964 1.00 32.40 C ATOM 1627 C LYS A 103 -15.460 -1.641 -23.209 1.00 12.21 C ATOM 1628 O LYS A 103 -15.742 -0.729 -23.987 1.00 51.52 O ATOM 1629 CB LYS A 103 -15.467 -1.642 -20.707 1.00 54.14 C ATOM 1630 CG LYS A 103 -15.840 -0.365 -19.972 1.00 43.13 C ATOM 1631 CD LYS A 103 -15.494 0.868 -20.789 1.00 55.12 C ATOM 1632 CE LYS A 103 -16.717 1.425 -21.503 1.00 1.21 C ATOM 1633 NZ LYS A 103 -16.595 2.887 -21.755 1.00 52.54 N ATOM 0 H LYS A 103 -16.514 -3.822 -21.173 1.00 10.02 H new ATOM 0 HA LYS A 103 -17.148 -1.202 -21.974 1.00 32.40 H new ATOM 0 HB2 LYS A 103 -15.582 -2.488 -20.030 1.00 54.14 H new ATOM 0 HB3 LYS A 103 -14.414 -1.597 -20.985 1.00 54.14 H new ATOM 0 HG2 LYS A 103 -16.907 -0.369 -19.752 1.00 43.13 H new ATOM 0 HG3 LYS A 103 -15.317 -0.328 -19.016 1.00 43.13 H new ATOM 0 HD2 LYS A 103 -15.073 1.632 -20.136 1.00 55.12 H new ATOM 0 HD3 LYS A 103 -14.727 0.617 -21.521 1.00 55.12 H new ATOM 0 HE2 LYS A 103 -16.853 0.903 -22.450 1.00 1.21 H new ATOM 0 HE3 LYS A 103 -17.606 1.233 -20.903 1.00 1.21 H new ATOM 0 HZ1 LYS A 103 -17.448 3.228 -22.243 1.00 52.54 H new ATOM 0 HZ2 LYS A 103 -16.491 3.388 -20.850 1.00 52.54 H new ATOM 0 HZ3 LYS A 103 -15.761 3.068 -22.349 1.00 52.54 H new ATOM 1647 N ILE A 104 -14.425 -2.454 -23.391 1.00 63.21 N ATOM 1648 CA ILE A 104 -13.543 -2.321 -24.543 1.00 53.23 C ATOM 1649 C ILE A 104 -14.316 -2.471 -25.848 1.00 51.13 C ATOM 1650 O ILE A 104 -13.971 -1.859 -26.859 1.00 71.33 O ATOM 1651 CB ILE A 104 -12.410 -3.362 -24.508 1.00 11.32 C ATOM 1652 CG1 ILE A 104 -11.595 -3.218 -23.220 1.00 24.41 C ATOM 1653 CG2 ILE A 104 -11.513 -3.211 -25.727 1.00 12.02 C ATOM 1654 CD1 ILE A 104 -10.751 -4.433 -22.900 1.00 75.42 C ATOM 0 H ILE A 104 -14.177 -3.212 -22.755 1.00 63.21 H new ATOM 0 HA ILE A 104 -13.109 -1.322 -24.494 1.00 53.23 H new ATOM 0 HB ILE A 104 -12.852 -4.358 -24.528 1.00 11.32 H new ATOM 0 HG12 ILE A 104 -10.946 -2.347 -23.306 1.00 24.41 H new ATOM 0 HG13 ILE A 104 -12.274 -3.028 -22.389 1.00 24.41 H new ATOM 0 HG21 ILE A 104 -10.717 -3.954 -25.687 1.00 12.02 H new ATOM 0 HG22 ILE A 104 -12.102 -3.358 -26.632 1.00 12.02 H new ATOM 0 HG23 ILE A 104 -11.077 -2.212 -25.736 1.00 12.02 H new ATOM 0 HD11 ILE A 104 -10.201 -4.261 -21.975 1.00 75.42 H new ATOM 0 HD12 ILE A 104 -11.396 -5.303 -22.782 1.00 75.42 H new ATOM 0 HD13 ILE A 104 -10.047 -4.611 -23.713 1.00 75.42 H new ATOM 1666 N GLU A 105 -15.364 -3.289 -25.818 1.00 44.12 N ATOM 1667 CA GLU A 105 -16.187 -3.520 -27.001 1.00 14.54 C ATOM 1668 C GLU A 105 -16.937 -2.251 -27.396 1.00 3.03 C ATOM 1669 O GLU A 105 -17.198 -2.015 -28.576 1.00 11.14 O ATOM 1670 CB GLU A 105 -17.180 -4.654 -26.744 1.00 23.43 C ATOM 1671 CG GLU A 105 -16.591 -6.038 -26.957 1.00 2.43 C ATOM 1672 CD GLU A 105 -16.183 -6.284 -28.396 1.00 24.22 C ATOM 1673 OE1 GLU A 105 -16.525 -5.450 -29.260 1.00 45.10 O ATOM 1674 OE2 GLU A 105 -15.521 -7.311 -28.658 1.00 74.44 O ATOM 0 H GLU A 105 -15.663 -3.802 -24.989 1.00 44.12 H new ATOM 0 HA GLU A 105 -15.529 -3.803 -27.822 1.00 14.54 H new ATOM 0 HB2 GLU A 105 -17.548 -4.578 -25.721 1.00 23.43 H new ATOM 0 HB3 GLU A 105 -18.040 -4.529 -27.402 1.00 23.43 H new ATOM 0 HG2 GLU A 105 -15.722 -6.162 -26.311 1.00 2.43 H new ATOM 0 HG3 GLU A 105 -17.321 -6.789 -26.657 1.00 2.43 H new ATOM 1681 N GLU A 106 -17.282 -1.439 -26.401 1.00 44.21 N ATOM 1682 CA GLU A 106 -18.004 -0.196 -26.645 1.00 52.21 C ATOM 1683 C GLU A 106 -17.047 0.914 -27.070 1.00 4.42 C ATOM 1684 O GLU A 106 -17.384 1.751 -27.906 1.00 5.20 O ATOM 1685 CB GLU A 106 -18.771 0.229 -25.391 1.00 51.45 C ATOM 1686 CG GLU A 106 -19.900 1.206 -25.671 1.00 20.32 C ATOM 1687 CD GLU A 106 -21.076 1.023 -24.731 1.00 52.42 C ATOM 1688 OE1 GLU A 106 -21.698 -0.059 -24.764 1.00 30.52 O ATOM 1689 OE2 GLU A 106 -21.373 1.961 -23.963 1.00 54.51 O ATOM 0 H GLU A 106 -17.073 -1.620 -25.419 1.00 44.21 H new ATOM 0 HA GLU A 106 -18.713 -0.370 -27.454 1.00 52.21 H new ATOM 0 HB2 GLU A 106 -19.181 -0.658 -24.908 1.00 51.45 H new ATOM 0 HB3 GLU A 106 -18.075 0.683 -24.686 1.00 51.45 H new ATOM 0 HG2 GLU A 106 -19.524 2.225 -25.582 1.00 20.32 H new ATOM 0 HG3 GLU A 106 -20.238 1.079 -26.699 1.00 20.32 H new ATOM 1696 N GLU A 107 -15.852 0.913 -26.486 1.00 70.33 N ATOM 1697 CA GLU A 107 -14.847 1.921 -26.803 1.00 73.22 C ATOM 1698 C GLU A 107 -14.328 1.743 -28.227 1.00 62.24 C ATOM 1699 O GLU A 107 -14.202 2.711 -28.978 1.00 4.22 O ATOM 1700 CB GLU A 107 -13.685 1.844 -25.812 1.00 1.42 C ATOM 1701 CG GLU A 107 -12.533 2.776 -26.150 1.00 21.11 C ATOM 1702 CD GLU A 107 -11.346 2.596 -25.225 1.00 5.32 C ATOM 1703 OE1 GLU A 107 -10.549 1.662 -25.455 1.00 75.21 O ATOM 1704 OE2 GLU A 107 -11.214 3.389 -24.270 1.00 11.34 O ATOM 0 H GLU A 107 -15.557 0.226 -25.792 1.00 70.33 H new ATOM 0 HA GLU A 107 -15.316 2.902 -26.726 1.00 73.22 H new ATOM 0 HB2 GLU A 107 -14.053 2.082 -24.814 1.00 1.42 H new ATOM 0 HB3 GLU A 107 -13.314 0.819 -25.779 1.00 1.42 H new ATOM 0 HG2 GLU A 107 -12.217 2.599 -27.178 1.00 21.11 H new ATOM 0 HG3 GLU A 107 -12.878 3.809 -26.095 1.00 21.11 H new ATOM 1711 N GLN A 108 -14.030 0.500 -28.591 1.00 22.12 N ATOM 1712 CA GLN A 108 -13.525 0.196 -29.925 1.00 4.32 C ATOM 1713 C GLN A 108 -14.462 0.735 -30.999 1.00 0.13 C ATOM 1714 O GLN A 108 -14.017 1.261 -32.018 1.00 3.01 O ATOM 1715 CB GLN A 108 -13.350 -1.315 -30.094 1.00 13.24 C ATOM 1716 CG GLN A 108 -11.902 -1.772 -30.027 1.00 74.12 C ATOM 1717 CD GLN A 108 -11.215 -1.732 -31.377 1.00 55.42 C ATOM 1718 OE1 GLN A 108 -11.865 -1.600 -32.415 1.00 22.00 O ATOM 1719 NE2 GLN A 108 -9.891 -1.844 -31.372 1.00 32.10 N ATOM 0 H GLN A 108 -14.129 -0.312 -27.982 1.00 22.12 H new ATOM 0 HA GLN A 108 -12.556 0.682 -30.039 1.00 4.32 H new ATOM 0 HB2 GLN A 108 -13.920 -1.827 -29.319 1.00 13.24 H new ATOM 0 HB3 GLN A 108 -13.773 -1.616 -31.052 1.00 13.24 H new ATOM 0 HG2 GLN A 108 -11.357 -1.138 -29.327 1.00 74.12 H new ATOM 0 HG3 GLN A 108 -11.863 -2.788 -29.634 1.00 74.12 H new ATOM 0 HE21 GLN A 108 -9.392 -1.952 -30.489 1.00 32.10 H new ATOM 0 HE22 GLN A 108 -9.374 -1.822 -32.251 1.00 32.10 H new ATOM 1728 N ASN A 109 -15.763 0.600 -30.764 1.00 34.15 N ATOM 1729 CA ASN A 109 -16.765 1.074 -31.713 1.00 31.03 C ATOM 1730 C ASN A 109 -16.673 2.587 -31.892 1.00 45.43 C ATOM 1731 O ASN A 109 -16.935 3.111 -32.974 1.00 74.52 O ATOM 1732 CB ASN A 109 -18.168 0.690 -31.240 1.00 13.34 C ATOM 1733 CG ASN A 109 -18.467 -0.782 -31.452 1.00 35.13 C ATOM 1734 OD1 ASN A 109 -17.562 -1.584 -31.682 1.00 61.34 O ATOM 1735 ND2 ASN A 109 -19.742 -1.143 -31.373 1.00 74.45 N ATOM 0 H ASN A 109 -16.149 0.166 -29.925 1.00 34.15 H new ATOM 0 HA ASN A 109 -16.571 0.600 -32.675 1.00 31.03 H new ATOM 0 HB2 ASN A 109 -18.270 0.930 -30.182 1.00 13.34 H new ATOM 0 HB3 ASN A 109 -18.905 1.288 -31.775 1.00 13.34 H new ATOM 0 HD21 ASN A 109 -20.005 -2.120 -31.505 1.00 74.45 H new ATOM 0 HD22 ASN A 109 -20.459 -0.444 -31.180 1.00 74.45 H new ATOM 1742 N LYS A 110 -16.297 3.281 -30.824 1.00 50.51 N ATOM 1743 CA LYS A 110 -16.166 4.733 -30.861 1.00 61.44 C ATOM 1744 C LYS A 110 -14.720 5.143 -31.119 1.00 22.32 C ATOM 1745 O LYS A 110 -14.291 6.225 -30.716 1.00 0.13 O ATOM 1746 CB LYS A 110 -16.656 5.343 -29.547 1.00 51.11 C ATOM 1747 CG LYS A 110 -18.131 5.102 -29.275 1.00 54.10 C ATOM 1748 CD LYS A 110 -18.956 6.354 -29.528 1.00 3.42 C ATOM 1749 CE LYS A 110 -20.322 6.263 -28.866 1.00 40.31 C ATOM 1750 NZ LYS A 110 -21.210 5.289 -29.560 1.00 11.33 N ATOM 0 H LYS A 110 -16.077 2.861 -29.921 1.00 50.51 H new ATOM 0 HA LYS A 110 -16.781 5.108 -31.679 1.00 61.44 H new ATOM 0 HB2 LYS A 110 -16.072 4.930 -28.725 1.00 51.11 H new ATOM 0 HB3 LYS A 110 -16.469 6.417 -29.563 1.00 51.11 H new ATOM 0 HG2 LYS A 110 -18.492 4.293 -29.910 1.00 54.10 H new ATOM 0 HG3 LYS A 110 -18.264 4.780 -28.242 1.00 54.10 H new ATOM 0 HD2 LYS A 110 -18.423 7.225 -29.147 1.00 3.42 H new ATOM 0 HD3 LYS A 110 -19.079 6.499 -30.601 1.00 3.42 H new ATOM 0 HE2 LYS A 110 -20.202 5.967 -27.824 1.00 40.31 H new ATOM 0 HE3 LYS A 110 -20.792 7.247 -28.865 1.00 40.31 H new ATOM 0 HZ1 LYS A 110 -22.132 5.256 -29.079 1.00 11.33 H new ATOM 0 HZ2 LYS A 110 -21.345 5.585 -30.548 1.00 11.33 H new ATOM 0 HZ3 LYS A 110 -20.774 4.345 -29.538 1.00 11.33 H new ATOM 1764 N SER A 111 -13.973 4.274 -31.792 1.00 22.04 N ATOM 1765 CA SER A 111 -12.575 4.545 -32.100 1.00 53.51 C ATOM 1766 C SER A 111 -12.109 3.716 -33.293 1.00 71.41 C ATOM 1767 O SER A 111 -10.958 3.284 -33.354 1.00 62.21 O ATOM 1768 CB SER A 111 -11.695 4.248 -30.884 1.00 21.34 C ATOM 1769 OG SER A 111 -11.943 5.171 -29.838 1.00 5.43 O ATOM 0 H SER A 111 -14.313 3.376 -32.134 1.00 22.04 H new ATOM 0 HA SER A 111 -12.485 5.601 -32.356 1.00 53.51 H new ATOM 0 HB2 SER A 111 -11.886 3.234 -30.532 1.00 21.34 H new ATOM 0 HB3 SER A 111 -10.645 4.293 -31.172 1.00 21.34 H new ATOM 0 HG SER A 111 -12.698 5.746 -30.081 1.00 5.43 H new ATOM 1775 N LYS A 112 -13.014 3.497 -34.241 1.00 63.21 N ATOM 1776 CA LYS A 112 -12.700 2.720 -35.434 1.00 60.45 C ATOM 1777 C LYS A 112 -12.322 3.636 -36.595 1.00 4.32 C ATOM 1778 O LYS A 112 -11.498 3.279 -37.438 1.00 64.11 O ATOM 1779 CB LYS A 112 -13.893 1.846 -35.829 1.00 4.15 C ATOM 1780 CG LYS A 112 -13.509 0.421 -36.190 1.00 24.33 C ATOM 1781 CD LYS A 112 -13.148 0.297 -37.660 1.00 1.15 C ATOM 1782 CE LYS A 112 -13.013 -1.159 -38.080 1.00 15.22 C ATOM 1783 NZ LYS A 112 -14.336 -1.782 -38.356 1.00 71.34 N ATOM 0 H LYS A 112 -13.971 3.847 -34.206 1.00 63.21 H new ATOM 0 HA LYS A 112 -11.848 2.079 -35.206 1.00 60.45 H new ATOM 0 HB2 LYS A 112 -14.605 1.824 -35.004 1.00 4.15 H new ATOM 0 HB3 LYS A 112 -14.402 2.303 -36.678 1.00 4.15 H new ATOM 0 HG2 LYS A 112 -12.664 0.105 -35.579 1.00 24.33 H new ATOM 0 HG3 LYS A 112 -14.337 -0.249 -35.960 1.00 24.33 H new ATOM 0 HD2 LYS A 112 -13.913 0.782 -38.266 1.00 1.15 H new ATOM 0 HD3 LYS A 112 -12.211 0.820 -37.851 1.00 1.15 H new ATOM 0 HE2 LYS A 112 -12.388 -1.223 -38.971 1.00 15.22 H new ATOM 0 HE3 LYS A 112 -12.505 -1.718 -37.294 1.00 15.22 H new ATOM 0 HZ1 LYS A 112 -14.201 -2.774 -38.639 1.00 71.34 H new ATOM 0 HZ2 LYS A 112 -14.923 -1.744 -37.499 1.00 71.34 H new ATOM 0 HZ3 LYS A 112 -14.810 -1.265 -39.124 1.00 71.34 H new ATOM 1797 N LYS A 113 -12.928 4.817 -36.632 1.00 64.05 N ATOM 1798 CA LYS A 113 -12.654 5.785 -37.688 1.00 1.10 C ATOM 1799 C LYS A 113 -11.808 6.940 -37.161 1.00 3.00 C ATOM 1800 O LYS A 113 -11.919 8.071 -37.633 1.00 71.35 O ATOM 1801 CB LYS A 113 -13.964 6.323 -38.269 1.00 24.23 C ATOM 1802 CG LYS A 113 -14.951 5.234 -38.653 1.00 12.21 C ATOM 1803 CD LYS A 113 -15.944 4.961 -37.535 1.00 54.33 C ATOM 1804 CE LYS A 113 -17.379 5.051 -38.031 1.00 21.32 C ATOM 1805 NZ LYS A 113 -18.240 3.996 -37.428 1.00 20.14 N ATOM 0 H LYS A 113 -13.613 5.128 -35.943 1.00 64.05 H new ATOM 0 HA LYS A 113 -12.096 5.278 -38.475 1.00 1.10 H new ATOM 0 HB2 LYS A 113 -14.431 6.984 -37.539 1.00 24.23 H new ATOM 0 HB3 LYS A 113 -13.741 6.926 -39.149 1.00 24.23 H new ATOM 0 HG2 LYS A 113 -15.488 5.530 -39.554 1.00 12.21 H new ATOM 0 HG3 LYS A 113 -14.409 4.319 -38.891 1.00 12.21 H new ATOM 0 HD2 LYS A 113 -15.763 3.970 -37.120 1.00 54.33 H new ATOM 0 HD3 LYS A 113 -15.791 5.677 -36.728 1.00 54.33 H new ATOM 0 HE2 LYS A 113 -17.786 6.033 -37.791 1.00 21.32 H new ATOM 0 HE3 LYS A 113 -17.395 4.956 -39.117 1.00 21.32 H new ATOM 0 HZ1 LYS A 113 -19.210 4.090 -37.791 1.00 20.14 H new ATOM 0 HZ2 LYS A 113 -17.867 3.058 -37.678 1.00 20.14 H new ATOM 0 HZ3 LYS A 113 -18.245 4.102 -36.393 1.00 20.14 H new ATOM 1819 N LYS A 114 -10.960 6.646 -36.180 1.00 33.32 N ATOM 1820 CA LYS A 114 -10.093 7.658 -35.590 1.00 14.13 C ATOM 1821 C LYS A 114 -8.987 7.011 -34.762 1.00 25.43 C ATOM 1822 O LYS A 114 -8.520 7.584 -33.778 1.00 74.15 O ATOM 1823 CB LYS A 114 -10.909 8.612 -34.715 1.00 3.11 C ATOM 1824 CG LYS A 114 -10.600 10.078 -34.962 1.00 71.35 C ATOM 1825 CD LYS A 114 -11.673 10.980 -34.375 1.00 35.23 C ATOM 1826 CE LYS A 114 -11.315 11.428 -32.966 1.00 72.02 C ATOM 1827 NZ LYS A 114 -12.526 11.753 -32.162 1.00 54.34 N ATOM 0 H LYS A 114 -10.855 5.715 -35.777 1.00 33.32 H new ATOM 0 HA LYS A 114 -9.633 8.223 -36.400 1.00 14.13 H new ATOM 0 HB2 LYS A 114 -11.970 8.438 -34.894 1.00 3.11 H new ATOM 0 HB3 LYS A 114 -10.720 8.381 -33.667 1.00 3.11 H new ATOM 0 HG2 LYS A 114 -9.634 10.326 -34.522 1.00 71.35 H new ATOM 0 HG3 LYS A 114 -10.518 10.258 -36.034 1.00 71.35 H new ATOM 0 HD2 LYS A 114 -11.805 11.854 -35.013 1.00 35.23 H new ATOM 0 HD3 LYS A 114 -12.626 10.451 -34.359 1.00 35.23 H new ATOM 0 HE2 LYS A 114 -10.749 10.641 -32.468 1.00 72.02 H new ATOM 0 HE3 LYS A 114 -10.667 12.303 -33.017 1.00 72.02 H new ATOM 0 HZ1 LYS A 114 -12.239 12.054 -31.209 1.00 54.34 H new ATOM 0 HZ2 LYS A 114 -13.053 12.521 -32.624 1.00 54.34 H new ATOM 0 HZ3 LYS A 114 -13.132 10.911 -32.091 1.00 54.34 H new ATOM 1841 N ALA A 115 -8.574 5.815 -35.166 1.00 40.23 N ATOM 1842 CA ALA A 115 -7.521 5.092 -34.464 1.00 33.02 C ATOM 1843 C ALA A 115 -6.142 5.500 -34.971 1.00 32.14 C ATOM 1844 O ALA A 115 -5.157 5.435 -34.235 1.00 40.25 O ATOM 1845 CB ALA A 115 -7.719 3.591 -34.616 1.00 2.40 C ATOM 0 H ALA A 115 -8.953 5.326 -35.977 1.00 40.23 H new ATOM 0 HA ALA A 115 -7.581 5.350 -33.407 1.00 33.02 H new ATOM 0 HB1 ALA A 115 -6.925 3.064 -34.087 1.00 2.40 H new ATOM 0 HB2 ALA A 115 -8.685 3.307 -34.198 1.00 2.40 H new ATOM 0 HB3 ALA A 115 -7.689 3.325 -35.673 1.00 2.40 H new ATOM 1851 N GLN A 116 -6.079 5.919 -36.230 1.00 73.43 N ATOM 1852 CA GLN A 116 -4.820 6.336 -36.835 1.00 53.03 C ATOM 1853 C GLN A 116 -4.881 7.798 -37.265 1.00 52.43 C ATOM 1854 O GLN A 116 -4.353 8.167 -38.314 1.00 70.12 O ATOM 1855 CB GLN A 116 -4.490 5.451 -38.038 1.00 14.54 C ATOM 1856 CG GLN A 116 -5.657 5.264 -38.995 1.00 14.34 C ATOM 1857 CD GLN A 116 -6.515 4.066 -38.641 1.00 35.44 C ATOM 1858 OE1 GLN A 116 -6.007 3.024 -38.227 1.00 1.14 O ATOM 1859 NE2 GLN A 116 -7.826 4.209 -38.801 1.00 13.32 N ATOM 0 H GLN A 116 -6.886 5.979 -36.851 1.00 73.43 H new ATOM 0 HA GLN A 116 -4.034 6.229 -36.088 1.00 53.03 H new ATOM 0 HB2 GLN A 116 -3.652 5.888 -38.581 1.00 14.54 H new ATOM 0 HB3 GLN A 116 -4.164 4.474 -37.681 1.00 14.54 H new ATOM 0 HG2 GLN A 116 -6.274 6.162 -38.989 1.00 14.34 H new ATOM 0 HG3 GLN A 116 -5.275 5.146 -40.009 1.00 14.34 H new ATOM 0 HE21 GLN A 116 -8.204 5.091 -39.147 1.00 13.32 H new ATOM 0 HE22 GLN A 116 -8.454 3.437 -38.578 1.00 13.32 H new ATOM 1868 N GLN A 117 -5.527 8.624 -36.449 1.00 63.11 N ATOM 1869 CA GLN A 117 -5.657 10.045 -36.748 1.00 14.02 C ATOM 1870 C GLN A 117 -5.235 10.893 -35.552 1.00 54.25 C ATOM 1871 O GLN A 117 -4.535 11.894 -35.706 1.00 11.52 O ATOM 1872 CB GLN A 117 -7.099 10.377 -37.139 1.00 11.23 C ATOM 1873 CG GLN A 117 -7.243 10.868 -38.570 1.00 2.33 C ATOM 1874 CD GLN A 117 -8.691 11.062 -38.977 1.00 61.11 C ATOM 1875 OE1 GLN A 117 -9.605 10.576 -38.311 1.00 61.54 O ATOM 1876 NE2 GLN A 117 -8.906 11.777 -40.075 1.00 44.31 N ATOM 0 H GLN A 117 -5.968 8.334 -35.576 1.00 63.11 H new ATOM 0 HA GLN A 117 -4.999 10.276 -37.586 1.00 14.02 H new ATOM 0 HB2 GLN A 117 -7.717 9.489 -37.004 1.00 11.23 H new ATOM 0 HB3 GLN A 117 -7.484 11.139 -36.462 1.00 11.23 H new ATOM 0 HG2 GLN A 117 -6.708 11.811 -38.682 1.00 2.33 H new ATOM 0 HG3 GLN A 117 -6.772 10.153 -39.245 1.00 2.33 H new ATOM 0 HE21 GLN A 117 -8.118 12.161 -40.596 1.00 44.31 H new ATOM 0 HE22 GLN A 117 -9.859 11.942 -40.397 1.00 44.31 H new ATOM 1885 N ALA A 118 -5.665 10.487 -34.363 1.00 12.21 N ATOM 1886 CA ALA A 118 -5.330 11.208 -33.142 1.00 13.23 C ATOM 1887 C ALA A 118 -3.991 10.744 -32.580 1.00 12.25 C ATOM 1888 O ALA A 118 -3.181 11.554 -32.129 1.00 44.45 O ATOM 1889 CB ALA A 118 -6.430 11.031 -32.105 1.00 44.03 C ATOM 0 H ALA A 118 -6.247 9.662 -34.219 1.00 12.21 H new ATOM 0 HA ALA A 118 -5.244 12.267 -33.387 1.00 13.23 H new ATOM 0 HB1 ALA A 118 -6.166 11.575 -31.198 1.00 44.03 H new ATOM 0 HB2 ALA A 118 -7.369 11.419 -32.501 1.00 44.03 H new ATOM 0 HB3 ALA A 118 -6.544 9.972 -31.873 1.00 44.03 H new ATOM 1895 N ALA A 119 -3.765 9.434 -32.609 1.00 0.34 N ATOM 1896 CA ALA A 119 -2.523 8.863 -32.103 1.00 43.22 C ATOM 1897 C ALA A 119 -1.313 9.468 -32.806 1.00 54.04 C ATOM 1898 O ALA A 119 -0.237 9.585 -32.222 1.00 13.33 O ATOM 1899 CB ALA A 119 -2.531 7.351 -32.270 1.00 45.21 C ATOM 0 H ALA A 119 -4.425 8.749 -32.977 1.00 0.34 H new ATOM 0 HA ALA A 119 -2.449 9.100 -31.042 1.00 43.22 H new ATOM 0 HB1 ALA A 119 -1.597 6.938 -31.888 1.00 45.21 H new ATOM 0 HB2 ALA A 119 -3.369 6.928 -31.716 1.00 45.21 H new ATOM 0 HB3 ALA A 119 -2.632 7.102 -33.326 1.00 45.21 H new ATOM 1905 N ALA A 120 -1.497 9.850 -34.066 1.00 44.44 N ATOM 1906 CA ALA A 120 -0.421 10.445 -34.849 1.00 41.55 C ATOM 1907 C ALA A 120 -0.500 11.967 -34.825 1.00 23.45 C ATOM 1908 O ALA A 120 -1.510 12.539 -34.411 1.00 43.44 O ATOM 1909 CB ALA A 120 -0.467 9.934 -36.282 1.00 35.04 C ATOM 0 H ALA A 120 -2.381 9.758 -34.566 1.00 44.44 H new ATOM 0 HA ALA A 120 0.527 10.151 -34.400 1.00 41.55 H new ATOM 0 HB1 ALA A 120 0.342 10.386 -36.856 1.00 35.04 H new ATOM 0 HB2 ALA A 120 -0.352 8.850 -36.286 1.00 35.04 H new ATOM 0 HB3 ALA A 120 -1.424 10.199 -36.732 1.00 35.04 H new ATOM 1915 N ASP A 121 0.569 12.618 -35.268 1.00 45.21 N ATOM 1916 CA ASP A 121 0.620 14.076 -35.298 1.00 5.04 C ATOM 1917 C ASP A 121 0.366 14.656 -33.910 1.00 24.14 C ATOM 1918 O ASP A 121 -0.105 15.785 -33.774 1.00 73.14 O ATOM 1919 CB ASP A 121 -0.407 14.623 -36.289 1.00 64.34 C ATOM 1920 CG ASP A 121 -0.168 16.081 -36.625 1.00 52.12 C ATOM 1921 OD1 ASP A 121 0.965 16.562 -36.409 1.00 34.23 O ATOM 1922 OD2 ASP A 121 -1.112 16.743 -37.104 1.00 60.34 O ATOM 0 H ASP A 121 1.413 12.160 -35.612 1.00 45.21 H new ATOM 0 HA ASP A 121 1.618 14.374 -35.620 1.00 5.04 H new ATOM 0 HB2 ASP A 121 -0.375 14.032 -37.204 1.00 64.34 H new ATOM 0 HB3 ASP A 121 -1.407 14.509 -35.871 1.00 64.34 H new ATOM 1927 N THR A 122 0.680 13.875 -32.881 1.00 20.22 N ATOM 1928 CA THR A 122 0.483 14.310 -31.503 1.00 42.43 C ATOM 1929 C THR A 122 1.816 14.596 -30.822 1.00 21.23 C ATOM 1930 O THR A 122 2.725 13.767 -30.841 1.00 21.21 O ATOM 1931 CB THR A 122 -0.283 13.254 -30.685 1.00 62.13 C ATOM 1932 OG1 THR A 122 -0.588 12.122 -31.508 1.00 33.44 O ATOM 1933 CG2 THR A 122 -1.570 13.837 -30.119 1.00 51.32 C ATOM 0 H THR A 122 1.072 12.938 -32.976 1.00 20.22 H new ATOM 0 HA THR A 122 -0.106 15.226 -31.541 1.00 42.43 H new ATOM 0 HB THR A 122 0.351 12.939 -29.856 1.00 62.13 H new ATOM 0 HG1 THR A 122 -1.533 12.149 -31.765 1.00 33.44 H new ATOM 0 HG21 THR A 122 -2.094 13.073 -29.545 1.00 51.32 H new ATOM 0 HG22 THR A 122 -1.333 14.680 -29.470 1.00 51.32 H new ATOM 0 HG23 THR A 122 -2.206 14.177 -30.936 1.00 51.32 H new ATOM 1941 N GLY A 123 1.926 15.775 -30.218 1.00 13.43 N ATOM 1942 CA GLY A 123 3.152 16.149 -29.537 1.00 72.15 C ATOM 1943 C GLY A 123 2.986 16.202 -28.032 1.00 43.51 C ATOM 1944 O GLY A 123 2.320 17.091 -27.505 1.00 23.13 O ATOM 0 H GLY A 123 1.188 16.478 -30.188 1.00 13.43 H new ATOM 0 HA2 GLY A 123 3.936 15.434 -29.788 1.00 72.15 H new ATOM 0 HA3 GLY A 123 3.482 17.123 -29.898 1.00 72.15 H new ATOM 1948 N ASN A 124 3.594 15.245 -27.337 1.00 44.35 N ATOM 1949 CA ASN A 124 3.509 15.184 -25.883 1.00 54.41 C ATOM 1950 C ASN A 124 4.871 14.865 -25.271 1.00 61.34 C ATOM 1951 O ASN A 124 5.837 14.602 -25.986 1.00 32.22 O ATOM 1952 CB ASN A 124 2.485 14.131 -25.455 1.00 52.32 C ATOM 1953 CG ASN A 124 2.780 12.765 -26.044 1.00 72.10 C ATOM 1954 OD1 ASN A 124 2.783 12.590 -27.263 1.00 33.33 O ATOM 1955 ND2 ASN A 124 3.028 11.789 -25.179 1.00 43.52 N ATOM 0 H ASN A 124 4.151 14.501 -27.758 1.00 44.35 H new ATOM 0 HA ASN A 124 3.188 16.161 -25.521 1.00 54.41 H new ATOM 0 HB2 ASN A 124 2.474 14.060 -24.367 1.00 52.32 H new ATOM 0 HB3 ASN A 124 1.489 14.450 -25.764 1.00 52.32 H new ATOM 0 HD21 ASN A 124 3.232 10.848 -25.516 1.00 43.52 H new ATOM 0 HD22 ASN A 124 3.015 11.980 -24.177 1.00 43.52 H new ATOM 1962 N ASN A 125 4.937 14.890 -23.944 1.00 73.21 N ATOM 1963 CA ASN A 125 6.178 14.603 -23.236 1.00 51.52 C ATOM 1964 C ASN A 125 5.916 13.749 -22.000 1.00 24.55 C ATOM 1965 O ASN A 125 6.636 12.788 -21.731 1.00 52.21 O ATOM 1966 CB ASN A 125 6.872 15.905 -22.830 1.00 74.02 C ATOM 1967 CG ASN A 125 5.904 16.917 -22.246 1.00 1.43 C ATOM 1968 OD1 ASN A 125 5.085 17.494 -22.961 1.00 22.21 O ATOM 1969 ND2 ASN A 125 5.997 17.137 -20.939 1.00 50.14 N ATOM 0 H ASN A 125 4.146 15.106 -23.338 1.00 73.21 H new ATOM 0 HA ASN A 125 6.829 14.046 -23.910 1.00 51.52 H new ATOM 0 HB2 ASN A 125 7.650 15.686 -22.099 1.00 74.02 H new ATOM 0 HB3 ASN A 125 7.365 16.338 -23.700 1.00 74.02 H new ATOM 0 HD21 ASN A 125 5.374 17.808 -20.489 1.00 50.14 H new ATOM 0 HD22 ASN A 125 6.692 16.635 -20.386 1.00 50.14 H new ATOM 1976 N SER A 126 4.877 14.105 -21.251 1.00 61.45 N ATOM 1977 CA SER A 126 4.518 13.374 -20.042 1.00 5.44 C ATOM 1978 C SER A 126 3.901 12.022 -20.387 1.00 31.13 C ATOM 1979 O SER A 126 2.961 11.941 -21.177 1.00 51.22 O ATOM 1980 CB SER A 126 3.542 14.192 -19.195 1.00 42.22 C ATOM 1981 OG SER A 126 2.886 13.375 -18.241 1.00 61.41 O ATOM 0 H SER A 126 4.269 14.896 -21.461 1.00 61.45 H new ATOM 0 HA SER A 126 5.429 13.202 -19.468 1.00 5.44 H new ATOM 0 HB2 SER A 126 4.080 14.992 -18.685 1.00 42.22 H new ATOM 0 HB3 SER A 126 2.804 14.666 -19.842 1.00 42.22 H new ATOM 0 HG SER A 126 2.269 13.922 -17.711 1.00 61.41 H new ATOM 1987 N GLN A 127 4.437 10.963 -19.789 1.00 1.42 N ATOM 1988 CA GLN A 127 3.939 9.615 -20.034 1.00 4.41 C ATOM 1989 C GLN A 127 4.632 8.605 -19.124 1.00 42.41 C ATOM 1990 O GLN A 127 5.829 8.351 -19.259 1.00 51.12 O ATOM 1991 CB GLN A 127 4.151 9.228 -21.499 1.00 32.13 C ATOM 1992 CG GLN A 127 3.098 8.270 -22.033 1.00 31.43 C ATOM 1993 CD GLN A 127 3.520 7.602 -23.326 1.00 45.44 C ATOM 1994 OE1 GLN A 127 4.564 7.926 -23.895 1.00 60.21 O ATOM 1995 NE2 GLN A 127 2.711 6.661 -23.799 1.00 10.32 N ATOM 0 H GLN A 127 5.216 11.012 -19.132 1.00 1.42 H new ATOM 0 HA GLN A 127 2.872 9.604 -19.813 1.00 4.41 H new ATOM 0 HB2 GLN A 127 4.151 10.132 -22.109 1.00 32.13 H new ATOM 0 HB3 GLN A 127 5.135 8.771 -21.607 1.00 32.13 H new ATOM 0 HG2 GLN A 127 2.894 7.506 -21.283 1.00 31.43 H new ATOM 0 HG3 GLN A 127 2.167 8.813 -22.196 1.00 31.43 H new ATOM 0 HE21 GLN A 127 1.856 6.424 -23.296 1.00 10.32 H new ATOM 0 HE22 GLN A 127 2.945 6.176 -24.665 1.00 10.32 H new ATOM 2004 N VAL A 128 3.872 8.031 -18.197 1.00 72.12 N ATOM 2005 CA VAL A 128 4.413 7.049 -17.265 1.00 60.34 C ATOM 2006 C VAL A 128 5.526 7.652 -16.414 1.00 62.45 C ATOM 2007 O VAL A 128 6.708 7.485 -16.713 1.00 4.12 O ATOM 2008 CB VAL A 128 4.960 5.815 -18.006 1.00 20.54 C ATOM 2009 CG1 VAL A 128 5.467 4.778 -17.015 1.00 21.32 C ATOM 2010 CG2 VAL A 128 3.890 5.220 -18.911 1.00 14.42 C ATOM 0 H VAL A 128 2.879 8.229 -18.071 1.00 72.12 H new ATOM 0 HA VAL A 128 3.592 6.741 -16.618 1.00 60.34 H new ATOM 0 HB VAL A 128 5.798 6.128 -18.628 1.00 20.54 H new ATOM 0 HG11 VAL A 128 5.850 3.913 -17.557 1.00 21.32 H new ATOM 0 HG12 VAL A 128 6.265 5.211 -16.412 1.00 21.32 H new ATOM 0 HG13 VAL A 128 4.650 4.466 -16.365 1.00 21.32 H new ATOM 0 HG21 VAL A 128 4.293 4.349 -19.427 1.00 14.42 H new ATOM 0 HG22 VAL A 128 3.031 4.921 -18.311 1.00 14.42 H new ATOM 0 HG23 VAL A 128 3.579 5.964 -19.644 1.00 14.42 H new ATOM 2020 N SER A 129 5.138 8.355 -15.355 1.00 42.52 N ATOM 2021 CA SER A 129 6.104 8.985 -14.462 1.00 75.43 C ATOM 2022 C SER A 129 5.926 8.488 -13.032 1.00 2.44 C ATOM 2023 O SER A 129 6.781 7.779 -12.500 1.00 30.13 O ATOM 2024 CB SER A 129 5.952 10.508 -14.507 1.00 63.34 C ATOM 2025 OG SER A 129 7.107 11.119 -15.057 1.00 20.24 O ATOM 0 H SER A 129 4.163 8.503 -15.094 1.00 42.52 H new ATOM 0 HA SER A 129 7.105 8.715 -14.800 1.00 75.43 H new ATOM 0 HB2 SER A 129 5.078 10.772 -15.103 1.00 63.34 H new ATOM 0 HB3 SER A 129 5.779 10.889 -13.501 1.00 63.34 H new ATOM 0 HG SER A 129 6.985 12.091 -15.077 1.00 20.24 H new ATOM 2031 N GLN A 130 4.811 8.866 -12.414 1.00 65.23 N ATOM 2032 CA GLN A 130 4.522 8.458 -11.044 1.00 33.42 C ATOM 2033 C GLN A 130 3.607 7.238 -11.020 1.00 62.23 C ATOM 2034 O GLN A 130 2.636 7.164 -11.772 1.00 52.10 O ATOM 2035 CB GLN A 130 3.876 9.610 -10.273 1.00 75.20 C ATOM 2036 CG GLN A 130 4.798 10.802 -10.074 1.00 64.14 C ATOM 2037 CD GLN A 130 4.065 12.127 -10.154 1.00 3.11 C ATOM 2038 OE1 GLN A 130 4.067 12.909 -9.204 1.00 34.15 O ATOM 2039 NE2 GLN A 130 3.431 12.385 -11.293 1.00 13.51 N ATOM 0 H GLN A 130 4.094 9.453 -12.840 1.00 65.23 H new ATOM 0 HA GLN A 130 5.464 8.192 -10.565 1.00 33.42 H new ATOM 0 HB2 GLN A 130 2.983 9.937 -10.806 1.00 75.20 H new ATOM 0 HB3 GLN A 130 3.550 9.246 -9.298 1.00 75.20 H new ATOM 0 HG2 GLN A 130 5.287 10.720 -9.103 1.00 64.14 H new ATOM 0 HG3 GLN A 130 5.583 10.779 -10.830 1.00 64.14 H new ATOM 0 HE21 GLN A 130 3.456 11.708 -12.055 1.00 13.51 H new ATOM 0 HE22 GLN A 130 2.920 13.260 -11.405 1.00 13.51 H new ATOM 2048 N ASN A 131 3.925 6.283 -10.153 1.00 73.31 N ATOM 2049 CA ASN A 131 3.131 5.065 -10.032 1.00 42.20 C ATOM 2050 C ASN A 131 2.761 4.799 -8.576 1.00 61.41 C ATOM 2051 O ASN A 131 3.482 5.193 -7.659 1.00 24.31 O ATOM 2052 CB ASN A 131 3.900 3.871 -10.600 1.00 53.41 C ATOM 2053 CG ASN A 131 3.804 3.787 -12.111 1.00 55.12 C ATOM 2054 OD1 ASN A 131 2.835 3.256 -12.654 1.00 2.14 O ATOM 2055 ND2 ASN A 131 4.812 4.312 -12.799 1.00 31.44 N ATOM 0 H ASN A 131 4.727 6.328 -9.524 1.00 73.31 H new ATOM 0 HA ASN A 131 2.213 5.202 -10.603 1.00 42.20 H new ATOM 0 HB2 ASN A 131 4.948 3.945 -10.309 1.00 53.41 H new ATOM 0 HB3 ASN A 131 3.512 2.951 -10.162 1.00 53.41 H new ATOM 0 HD21 ASN A 131 4.802 4.285 -13.819 1.00 31.44 H new ATOM 0 HD22 ASN A 131 5.595 4.742 -12.308 1.00 31.44 H new ATOM 2062 N TYR A 132 1.632 4.129 -8.371 1.00 44.05 N ATOM 2063 CA TYR A 132 1.164 3.812 -7.027 1.00 43.05 C ATOM 2064 C TYR A 132 1.700 2.459 -6.570 1.00 21.10 C ATOM 2065 O TYR A 132 2.895 2.205 -6.707 1.00 41.42 O ATOM 2066 CB TYR A 132 -0.364 3.809 -6.984 1.00 32.40 C ATOM 2067 CG TYR A 132 -0.990 5.042 -7.596 1.00 32.22 C ATOM 2068 CD1 TYR A 132 -1.044 6.240 -6.894 1.00 62.02 C ATOM 2069 CD2 TYR A 132 -1.525 5.010 -8.878 1.00 63.21 C ATOM 2070 CE1 TYR A 132 -1.616 7.368 -7.449 1.00 41.43 C ATOM 2071 CE2 TYR A 132 -2.098 6.134 -9.442 1.00 54.52 C ATOM 2072 CZ TYR A 132 -2.140 7.311 -8.723 1.00 24.11 C ATOM 2073 OH TYR A 132 -2.708 8.433 -9.280 1.00 62.21 O ATOM 0 H TYR A 132 1.024 3.795 -9.119 1.00 44.05 H new ATOM 0 HA TYR A 132 1.538 4.579 -6.349 1.00 43.05 H new ATOM 0 HB2 TYR A 132 -0.732 2.927 -7.508 1.00 32.40 H new ATOM 0 HB3 TYR A 132 -0.690 3.723 -5.947 1.00 32.40 H new ATOM 0 HD1 TYR A 132 -0.632 6.290 -5.897 1.00 62.02 H new ATOM 0 HD2 TYR A 132 -1.492 4.091 -9.444 1.00 63.21 H new ATOM 0 HE1 TYR A 132 -1.653 8.290 -6.888 1.00 41.43 H new ATOM 0 HE2 TYR A 132 -2.510 6.091 -10.439 1.00 54.52 H new ATOM 0 HH TYR A 132 -3.028 8.224 -10.182 1.00 62.21 H new TER 2083 TYR A 132 HETATM 2084 C1 MYR A 1 9.082 3.228 -22.486 1.00 63.22 C HETATM 2085 O1 MYR A 1 8.620 3.999 -21.645 1.00 64.42 O HETATM 2086 C2 MYR A 1 9.749 3.822 -23.728 1.00 20.05 C HETATM 2087 C3 MYR A 1 8.899 3.737 -25.017 1.00 3.51 C HETATM 2088 C4 MYR A 1 7.915 4.914 -25.140 1.00 62.14 C HETATM 2089 C5 MYR A 1 6.889 4.697 -26.269 1.00 31.14 C HETATM 2090 C6 MYR A 1 6.625 5.985 -27.072 1.00 3.01 C HETATM 2091 C7 MYR A 1 5.285 5.933 -27.832 1.00 2.44 C HETATM 2092 C8 MYR A 1 5.390 5.127 -29.140 1.00 71.11 C HETATM 2093 C9 MYR A 1 4.101 5.211 -29.980 1.00 13.34 C HETATM 2094 C10 MYR A 1 4.343 4.851 -31.460 1.00 53.21 C HETATM 2095 C11 MYR A 1 4.264 6.051 -32.426 1.00 71.25 C HETATM 2096 C12 MYR A 1 3.380 5.810 -33.669 1.00 10.30 C HETATM 2097 C13 MYR A 1 2.934 7.124 -34.331 1.00 33.10 C HETATM 2098 C14 MYR A 1 1.412 7.313 -34.258 1.00 14.12 C HETATM 0 H143 MYR A 1 0.918 6.488 -34.771 1.00 14.12 H new HETATM 0 H142 MYR A 1 1.097 7.333 -33.215 1.00 14.12 H new HETATM 0 H141 MYR A 1 1.139 8.253 -34.737 1.00 14.12 H new HETATM 0 H132 MYR A 1 3.428 7.963 -33.842 1.00 33.10 H new HETATM 0 H131 MYR A 1 3.251 7.131 -35.374 1.00 33.10 H new HETATM 0 H122 MYR A 1 3.931 5.210 -34.393 1.00 10.30 H new HETATM 0 H121 MYR A 1 2.501 5.234 -33.381 1.00 10.30 H new HETATM 0 H112 MYR A 1 3.879 6.914 -31.883 1.00 71.25 H new HETATM 0 H111 MYR A 1 5.272 6.304 -32.755 1.00 71.25 H new HETATM 0 H102 MYR A 1 5.326 4.388 -31.553 1.00 53.21 H new HETATM 0 H101 MYR A 1 3.609 4.105 -31.765 1.00 53.21 H new HETATM 0 H92 MYR A 1 3.353 4.537 -29.562 1.00 13.34 H new HETATM 0 H91 MYR A 1 3.693 6.220 -29.916 1.00 13.34 H new HETATM 0 H82 MYR A 1 6.229 5.499 -29.728 1.00 71.11 H new HETATM 0 H81 MYR A 1 5.602 4.084 -28.906 1.00 71.11 H new HETATM 0 H72 MYR A 1 4.523 5.487 -27.192 1.00 2.44 H new HETATM 0 H71 MYR A 1 4.957 6.948 -28.058 1.00 2.44 H new HETATM 0 H62 MYR A 1 6.624 6.839 -26.395 1.00 3.01 H new HETATM 0 H61 MYR A 1 7.437 6.142 -27.782 1.00 3.01 H new HETATM 0 H52 MYR A 1 7.251 3.919 -26.942 1.00 31.14 H new HETATM 0 H51 MYR A 1 5.952 4.339 -25.842 1.00 31.14 H new HETATM 0 H42 MYR A 1 7.390 5.047 -24.194 1.00 62.14 H new HETATM 0 H41 MYR A 1 8.471 5.833 -25.328 1.00 62.14 H new HETATM 0 H32 MYR A 1 9.558 3.724 -25.885 1.00 3.51 H new HETATM 0 H31 MYR A 1 8.344 2.799 -25.024 1.00 3.51 H new HETATM 0 H22 MYR A 1 9.985 4.868 -23.532 1.00 20.05 H new HETATM 0 H21 MYR A 1 10.695 3.308 -23.898 1.00 20.05 H new HETATM 2126 P1 PBU A 300 -6.389 -22.287 -13.790 1.00 60.21 P HETATM 2127 P4 PBU A 300 -14.760 -21.132 -14.973 1.00 73.22 P HETATM 2128 P5 PBU A 300 -11.679 -21.748 -19.358 1.00 50.41 P HETATM 2129 C3' PBU A 300 -4.779 -22.047 -15.701 1.00 62.14 C HETATM 2130 C2' PBU A 300 -4.346 -20.568 -15.551 1.00 44.32 C HETATM 2131 O2' PBU A 300 -4.088 -20.040 -16.841 1.00 64.12 O HETATM 2132 C1' PBU A 300 -3.072 -20.423 -14.683 1.00 41.23 C HETATM 2133 O1' PBU A 300 -2.174 -21.468 -14.999 1.00 22.14 O HETATM 2134 C1 PBU A 300 -8.928 -21.620 -15.099 1.00 31.02 C HETATM 2135 O1 PBU A 300 -7.563 -22.311 -14.979 1.00 71.44 O HETATM 2136 C2 PBU A 300 -9.845 -21.719 -13.831 1.00 44.44 C HETATM 2137 O2 PBU A 300 -10.080 -23.062 -13.418 1.00 21.24 O HETATM 2138 C3 PBU A 300 -11.201 -21.025 -14.087 1.00 32.13 C HETATM 2139 O3 PBU A 300 -11.992 -21.157 -12.896 1.00 41.43 O HETATM 2140 C4 PBU A 300 -11.928 -21.632 -15.348 1.00 42.15 C HETATM 2141 O4 PBU A 300 -13.231 -20.888 -15.589 1.00 3.34 O HETATM 2142 C5 PBU A 300 -10.969 -21.503 -16.598 1.00 33.14 C HETATM 2143 O5 PBU A 300 -11.620 -22.122 -17.754 1.00 0.54 O HETATM 2144 C6 PBU A 300 -9.597 -22.183 -16.366 1.00 23.04 C HETATM 2145 O6 PBU A 300 -8.688 -21.964 -17.455 1.00 73.44 O HETATM 2146 C7 PBU A 300 -5.177 -19.464 -17.540 1.00 61.04 C HETATM 2147 O7 PBU A 300 -5.623 -20.000 -18.531 1.00 40.45 O HETATM 2148 C8 PBU A 300 -5.809 -18.159 -17.028 1.00 71.11 C HETATM 2149 C9 PBU A 300 -6.144 -17.230 -18.210 1.00 32.34 C HETATM 2150 C10 PBU A 300 -6.960 -16.027 -17.701 1.00 21.44 C HETATM 2151 C11 PBU A 300 -1.596 -22.282 -14.002 1.00 62.44 C HETATM 2152 O11 PBU A 300 -1.409 -21.935 -12.852 1.00 51.33 O HETATM 2153 C12 PBU A 300 -1.135 -23.689 -14.476 1.00 14.42 C HETATM 2154 C13 PBU A 300 0.075 -23.648 -15.424 1.00 45.14 C HETATM 2155 C14 PBU A 300 0.330 -25.027 -16.058 1.00 2.32 C HETATM 2156 O41 PBU A 300 -15.536 -21.163 -16.288 1.00 53.24 O HETATM 2157 O42 PBU A 300 -14.699 -22.450 -14.250 1.00 55.14 O HETATM 2158 O43 PBU A 300 -15.121 -19.999 -14.025 1.00 64.03 O HETATM 2159 O51 PBU A 300 -13.178 -21.674 -19.565 1.00 73.15 O HETATM 2160 O52 PBU A 300 -10.891 -20.451 -19.446 1.00 63.31 O HETATM 2161 O53 PBU A 300 -11.018 -22.939 -20.016 1.00 34.35 O HETATM 2162 OP1 PBU A 300 -5.086 -22.628 -14.452 1.00 32.04 O HETATM 2163 OP2 PBU A 300 -6.459 -20.851 -13.267 1.00 14.33 O HETATM 2164 OP3 PBU A 300 -6.802 -23.385 -12.845 1.00 72.13 O HETATM 0 H3'2 PBU A 300 -5.649 -22.107 -16.355 1.00 62.14 H new HETATM 0 H3'1 PBU A 300 -3.981 -22.614 -16.180 1.00 62.14 H new HETATM 0 H143 PBU A 300 0.527 -25.757 -15.273 1.00 2.32 H new HETATM 0 H142 PBU A 300 -0.548 -25.334 -16.627 1.00 2.32 H new HETATM 0 H141 PBU A 300 1.191 -24.968 -16.723 1.00 2.32 H new HETATM 0 H132 PBU A 300 -0.098 -22.911 -16.208 1.00 45.14 H new HETATM 0 H131 PBU A 300 0.960 -23.328 -14.875 1.00 45.14 H new HETATM 0 H122 PBU A 300 -0.884 -24.294 -13.604 1.00 14.42 H new HETATM 0 H121 PBU A 300 -1.965 -24.185 -14.979 1.00 14.42 H new HETATM 0 H1'2 PBU A 300 -2.602 -19.456 -14.864 1.00 41.23 H new HETATM 0 H1'1 PBU A 300 -3.332 -20.458 -13.625 1.00 41.23 H new HETATM 0 H92 PBU A 300 -5.227 -16.885 -18.687 1.00 32.34 H new HETATM 0 H91 PBU A 300 -6.711 -17.774 -18.965 1.00 32.34 H new HETATM 0 H82 PBU A 300 -6.714 -18.382 -16.463 1.00 71.11 H new HETATM 0 H81 PBU A 300 -5.123 -17.658 -16.345 1.00 71.11 H new HETATM 0 H6 PBU A 300 -9.800 -23.250 -16.271 1.00 23.04 H new HETATM 0 H5 PBU A 300 -10.783 -20.442 -16.768 1.00 33.14 H new HETATM 0 H4 PBU A 300 -12.159 -22.684 -15.183 1.00 42.15 H new HETATM 0 H3 PBU A 300 -11.048 -19.969 -14.310 1.00 32.13 H new HETATM 0 H2' PBU A 300 -5.151 -20.025 -15.056 1.00 44.32 H new HETATM 0 H2 PBU A 300 -9.308 -21.214 -13.028 1.00 44.44 H new HETATM 0 H13 PBU A 300 -7.884 -16.381 -17.244 1.00 21.44 H new HETATM 0 H12 PBU A 300 -6.377 -15.478 -16.962 1.00 21.44 H new HETATM 0 H11 PBU A 300 -7.198 -15.369 -18.537 1.00 21.44 H new HETATM 0 H1 PBU A 300 -8.769 -20.544 -15.177 1.00 31.02 H new HETATM 0 H06 PBU A 300 -7.774 -21.894 -17.109 1.00 73.44 H new HETATM 0 H03 PBU A 300 -12.790 -20.592 -12.969 1.00 41.43 H new HETATM 0 H02 PBU A 300 -10.913 -23.105 -12.904 1.00 21.24 H new