USER MOD reduce.3.24.130724 H: found=0, std=0, add=1207, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1208 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 35 MET CE :methyl 138:sc= -3.13! (180deg=-4.51!) USER MOD Set 1.2: A 86 ASN : amide:sc= -0.291 K(o=-3.4,f=-7.4) USER MOD Set 2.1: A 18 HIS : no HE2:sc= 0.00494 K(o=1.3,f=-8.6!) USER MOD Set 2.2: A 81 SER OG : rot -20:sc= 1.29 USER MOD Set 3.1: A 46 THR OG1 : rot -11:sc=-0.00342 USER MOD Set 3.2: A 72 HIS : no HD1:sc= 0.165 K(o=0.16,f=-9.1!) USER MOD Set 3.3: A 136 LYS NZ :NH3+ -164:sc=-0.00436 (180deg=-0.128) USER MOD Set 4.1: A 33 ASN : amide:sc= -0.202 K(o=-0.22,f=1.7) USER MOD Set 4.2: A 39 THR OG1 : rot -157:sc= -0.0198 USER MOD Single : A 10 CYS SG : rot -61:sc= 0.184 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 ASN : amide:sc= -0.698 X(o=-0.7,f=-1) USER MOD Single : A 23 TYR OH : rot 89:sc= 1.23 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 27 GLN : amide:sc= -4.95! C(o=-5!,f=-6.6!) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= -1.73! K(o=-1.7!,f=-0.046) USER MOD Single : A 56 LYS NZ :NH3+ -167:sc= -0.0145 (180deg=-0.167) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 CYS SG : rot 98:sc= -0.24 USER MOD Single : A 66 SER OG : rot 170:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ -170:sc=-0.00888 (180deg=-0.118) USER MOD Single : A 74 LYS NZ :NH3+ 172:sc= 0.539 (180deg=0.439) USER MOD Single : A 77 MET CE :methyl 169:sc= -3.82! (180deg=-4.05!) USER MOD Single : A 80 THR OG1 : rot 120:sc= 1.4 USER MOD Single : A 93 ASN : amide:sc= -0.0022 K(o=-0.0022,f=0.51) USER MOD Single : A 95 TYR OH : rot 30:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 ASN : amide:sc= -0.497 K(o=-0.5,f=-4.6!) USER MOD Single : A 108 SER OG : rot -37:sc= 0.489 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 MET CE :methyl 142:sc= -0.135 (180deg=-0.782) USER MOD Single : A 114 LYS NZ :NH3+ 173:sc= -0.0025 (180deg=-0.0991) USER MOD Single : A 115 THR OG1 : rot 70:sc= 1 USER MOD Single : A 116 TYR OH : rot 0:sc= 0 USER MOD Single : A 117 MET CE :methyl -109:sc= -0.884 (180deg=-4.48!) USER MOD Single : A 120 ASN : amide:sc= 0.832 K(o=0.83,f=-0.51) USER MOD Single : A 121 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0792) USER MOD Single : A 126 MET CE :methyl -119:sc= -0.212 (180deg=-0.438) USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=-0.0011) USER MOD Single : A 139 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 140 LYS NZ :NH3+ -122:sc= 1.2 (180deg=0.126) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ 157:sc= 1.16 (180deg=0.75) USER MOD Single : A 146 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 LYS NZ :NH3+ -170:sc=-0.00647 (180deg=-0.107) USER MOD Single : A 151 MET CE :methyl -161:sc= -0.105 (180deg=-0.548) USER MOD Single : A 153 CYS SG : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 158 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 10 -34.069 -16.494 -22.895 1.00 14.30 N ATOM 2 CA CYS A 10 -33.828 -15.970 -21.580 1.00 62.24 C ATOM 3 C CYS A 10 -34.484 -14.608 -21.461 1.00 41.11 C ATOM 4 O CYS A 10 -34.519 -13.850 -22.435 1.00 22.25 O ATOM 5 CB CYS A 10 -32.315 -15.862 -21.308 1.00 2.24 C ATOM 6 SG CYS A 10 -31.881 -15.186 -19.678 1.00 34.10 S ATOM 0 HA CYS A 10 -34.255 -16.646 -20.839 1.00 62.24 H new ATOM 0 HB2 CYS A 10 -31.871 -16.853 -21.405 1.00 2.24 H new ATOM 0 HB3 CYS A 10 -31.865 -15.234 -22.078 1.00 2.24 H new ATOM 0 HG CYS A 10 -32.349 -13.978 -19.571 1.00 34.10 H new ATOM 12 N SER A 11 -35.017 -14.315 -20.299 1.00 55.32 N ATOM 13 CA SER A 11 -35.633 -13.038 -20.029 1.00 34.13 C ATOM 14 C SER A 11 -34.601 -11.904 -20.129 1.00 30.04 C ATOM 15 O SER A 11 -33.384 -12.131 -19.955 1.00 15.35 O ATOM 16 CB SER A 11 -36.265 -13.072 -18.638 1.00 41.52 C ATOM 17 OG SER A 11 -37.220 -14.125 -18.551 1.00 64.10 O ATOM 0 H SER A 11 -35.036 -14.960 -19.509 1.00 55.32 H new ATOM 0 HA SER A 11 -36.407 -12.847 -20.773 1.00 34.13 H new ATOM 0 HB2 SER A 11 -35.491 -13.212 -17.883 1.00 41.52 H new ATOM 0 HB3 SER A 11 -36.747 -12.117 -18.427 1.00 41.52 H new ATOM 0 HG SER A 11 -37.615 -14.135 -17.654 1.00 64.10 H new ATOM 23 N SER A 12 -35.079 -10.704 -20.429 1.00 51.11 N ATOM 24 CA SER A 12 -34.230 -9.547 -20.552 1.00 12.10 C ATOM 25 C SER A 12 -33.578 -9.260 -19.199 1.00 42.21 C ATOM 26 O SER A 12 -32.363 -9.077 -19.108 1.00 51.44 O ATOM 27 CB SER A 12 -35.047 -8.336 -21.054 1.00 40.45 C ATOM 28 OG SER A 12 -34.224 -7.201 -21.275 1.00 33.30 O ATOM 0 H SER A 12 -36.068 -10.515 -20.592 1.00 51.11 H new ATOM 0 HA SER A 12 -33.445 -9.738 -21.284 1.00 12.10 H new ATOM 0 HB2 SER A 12 -35.558 -8.601 -21.980 1.00 40.45 H new ATOM 0 HB3 SER A 12 -35.818 -8.090 -20.324 1.00 40.45 H new ATOM 0 HG SER A 12 -34.774 -6.455 -21.593 1.00 33.30 H new ATOM 34 N ASP A 13 -34.386 -9.259 -18.156 1.00 43.32 N ATOM 35 CA ASP A 13 -33.882 -9.086 -16.811 1.00 54.11 C ATOM 36 C ASP A 13 -33.685 -10.429 -16.168 1.00 31.41 C ATOM 37 O ASP A 13 -34.627 -11.035 -15.651 1.00 4.34 O ATOM 38 CB ASP A 13 -34.790 -8.204 -15.932 1.00 15.03 C ATOM 39 CG ASP A 13 -34.803 -6.745 -16.325 1.00 34.10 C ATOM 40 OD1 ASP A 13 -35.602 -6.353 -17.190 1.00 75.54 O ATOM 41 OD2 ASP A 13 -34.031 -5.952 -15.741 1.00 30.45 O ATOM 0 H ASP A 13 -35.397 -9.377 -18.217 1.00 43.32 H new ATOM 0 HA ASP A 13 -32.929 -8.564 -16.892 1.00 54.11 H new ATOM 0 HB2 ASP A 13 -35.808 -8.590 -15.978 1.00 15.03 H new ATOM 0 HB3 ASP A 13 -34.464 -8.287 -14.895 1.00 15.03 H new ATOM 46 N SER A 14 -32.485 -10.913 -16.247 1.00 34.32 N ATOM 47 CA SER A 14 -32.119 -12.160 -15.660 1.00 42.03 C ATOM 48 C SER A 14 -31.337 -11.863 -14.403 1.00 63.34 C ATOM 49 O SER A 14 -30.598 -10.867 -14.350 1.00 44.23 O ATOM 50 CB SER A 14 -31.260 -12.983 -16.656 1.00 35.43 C ATOM 51 OG SER A 14 -30.869 -14.260 -16.122 1.00 2.33 O ATOM 0 H SER A 14 -31.720 -10.443 -16.730 1.00 34.32 H new ATOM 0 HA SER A 14 -33.005 -12.748 -15.420 1.00 42.03 H new ATOM 0 HB2 SER A 14 -31.823 -13.135 -17.577 1.00 35.43 H new ATOM 0 HB3 SER A 14 -30.368 -12.414 -16.918 1.00 35.43 H new ATOM 0 HG SER A 14 -30.332 -14.741 -16.785 1.00 2.33 H new ATOM 57 N LEU A 15 -31.518 -12.669 -13.386 1.00 12.43 N ATOM 58 CA LEU A 15 -30.788 -12.508 -12.178 1.00 64.34 C ATOM 59 C LEU A 15 -29.337 -12.874 -12.410 1.00 54.43 C ATOM 60 O LEU A 15 -29.006 -14.038 -12.664 1.00 55.12 O ATOM 61 CB LEU A 15 -31.395 -13.344 -11.037 1.00 52.45 C ATOM 62 CG LEU A 15 -32.748 -12.884 -10.447 1.00 15.13 C ATOM 63 CD1 LEU A 15 -32.664 -11.453 -9.944 1.00 35.12 C ATOM 64 CD2 LEU A 15 -33.904 -13.053 -11.432 1.00 41.10 C ATOM 0 H LEU A 15 -32.176 -13.449 -13.384 1.00 12.43 H new ATOM 0 HA LEU A 15 -30.846 -11.463 -11.873 1.00 64.34 H new ATOM 0 HB2 LEU A 15 -31.517 -14.365 -11.398 1.00 52.45 H new ATOM 0 HB3 LEU A 15 -30.669 -13.378 -10.224 1.00 52.45 H new ATOM 0 HG LEU A 15 -32.960 -13.535 -9.599 1.00 15.13 H new ATOM 0 HD11 LEU A 15 -33.629 -11.154 -9.534 1.00 35.12 H new ATOM 0 HD12 LEU A 15 -31.903 -11.385 -9.167 1.00 35.12 H new ATOM 0 HD13 LEU A 15 -32.400 -10.792 -10.770 1.00 35.12 H new ATOM 0 HD21 LEU A 15 -34.830 -12.715 -10.967 1.00 41.10 H new ATOM 0 HD22 LEU A 15 -33.710 -12.461 -12.326 1.00 41.10 H new ATOM 0 HD23 LEU A 15 -33.998 -14.104 -11.706 1.00 41.10 H new ATOM 76 N GLN A 16 -28.490 -11.888 -12.376 1.00 64.12 N ATOM 77 CA GLN A 16 -27.085 -12.085 -12.592 1.00 63.51 C ATOM 78 C GLN A 16 -26.305 -11.359 -11.531 1.00 11.25 C ATOM 79 O GLN A 16 -26.801 -10.391 -10.939 1.00 32.43 O ATOM 80 CB GLN A 16 -26.668 -11.606 -13.993 1.00 54.13 C ATOM 81 CG GLN A 16 -26.936 -10.129 -14.268 1.00 34.52 C ATOM 82 CD GLN A 16 -26.430 -9.697 -15.630 1.00 44.22 C ATOM 83 OE1 GLN A 16 -25.276 -9.267 -15.769 1.00 60.43 O ATOM 84 NE2 GLN A 16 -27.270 -9.799 -16.634 1.00 41.24 N ATOM 0 H GLN A 16 -28.754 -10.919 -12.197 1.00 64.12 H new ATOM 0 HA GLN A 16 -26.868 -13.151 -12.529 1.00 63.51 H new ATOM 0 HB2 GLN A 16 -25.604 -11.799 -14.126 1.00 54.13 H new ATOM 0 HB3 GLN A 16 -27.196 -12.202 -14.738 1.00 54.13 H new ATOM 0 HG2 GLN A 16 -28.007 -9.938 -14.203 1.00 34.52 H new ATOM 0 HG3 GLN A 16 -26.458 -9.525 -13.497 1.00 34.52 H new ATOM 0 HE21 GLN A 16 -28.212 -10.158 -16.477 1.00 41.24 H new ATOM 0 HE22 GLN A 16 -26.981 -9.519 -17.571 1.00 41.24 H new ATOM 93 N LEU A 17 -25.115 -11.813 -11.280 1.00 61.35 N ATOM 94 CA LEU A 17 -24.279 -11.207 -10.292 1.00 10.11 C ATOM 95 C LEU A 17 -23.285 -10.272 -10.947 1.00 3.41 C ATOM 96 O LEU A 17 -22.957 -10.420 -12.125 1.00 4.44 O ATOM 97 CB LEU A 17 -23.602 -12.245 -9.429 1.00 53.00 C ATOM 98 CG LEU A 17 -24.545 -13.184 -8.652 1.00 23.53 C ATOM 99 CD1 LEU A 17 -23.764 -14.201 -7.836 1.00 4.13 C ATOM 100 CD2 LEU A 17 -25.484 -12.386 -7.752 1.00 64.12 C ATOM 0 H LEU A 17 -24.697 -12.613 -11.754 1.00 61.35 H new ATOM 0 HA LEU A 17 -24.905 -10.613 -9.627 1.00 10.11 H new ATOM 0 HB2 LEU A 17 -22.955 -12.852 -10.062 1.00 53.00 H new ATOM 0 HB3 LEU A 17 -22.958 -11.733 -8.714 1.00 53.00 H new ATOM 0 HG LEU A 17 -25.144 -13.728 -9.383 1.00 23.53 H new ATOM 0 HD11 LEU A 17 -24.458 -14.848 -7.300 1.00 4.13 H new ATOM 0 HD12 LEU A 17 -23.146 -14.804 -8.501 1.00 4.13 H new ATOM 0 HD13 LEU A 17 -23.127 -13.681 -7.121 1.00 4.13 H new ATOM 0 HD21 LEU A 17 -26.140 -13.070 -7.214 1.00 64.12 H new ATOM 0 HD22 LEU A 17 -24.899 -11.807 -7.038 1.00 64.12 H new ATOM 0 HD23 LEU A 17 -26.085 -11.711 -8.361 1.00 64.12 H new ATOM 112 N HIS A 18 -22.849 -9.297 -10.202 1.00 20.21 N ATOM 113 CA HIS A 18 -22.025 -8.227 -10.724 1.00 14.13 C ATOM 114 C HIS A 18 -20.781 -8.041 -9.886 1.00 61.03 C ATOM 115 O HIS A 18 -20.701 -8.548 -8.750 1.00 52.51 O ATOM 116 CB HIS A 18 -22.814 -6.911 -10.733 1.00 15.34 C ATOM 117 CG HIS A 18 -24.114 -6.971 -11.476 1.00 32.54 C ATOM 118 ND1 HIS A 18 -24.301 -6.446 -12.727 1.00 52.02 N ATOM 119 CD2 HIS A 18 -25.310 -7.491 -11.112 1.00 44.14 C ATOM 120 CE1 HIS A 18 -25.544 -6.630 -13.097 1.00 71.34 C ATOM 121 NE2 HIS A 18 -26.180 -7.264 -12.134 1.00 33.21 N ATOM 0 H HIS A 18 -23.053 -9.215 -9.206 1.00 20.21 H new ATOM 0 HA HIS A 18 -21.734 -8.497 -11.739 1.00 14.13 H new ATOM 0 HB2 HIS A 18 -23.012 -6.614 -9.703 1.00 15.34 H new ATOM 0 HB3 HIS A 18 -22.193 -6.133 -11.176 1.00 15.34 H new ATOM 0 HD1 HIS A 18 -23.583 -5.983 -13.285 1.00 52.02 H new ATOM 0 HD2 HIS A 18 -25.533 -7.993 -10.182 1.00 44.14 H new ATOM 0 HE1 HIS A 18 -25.975 -6.314 -14.035 1.00 71.34 H new ATOM 130 N ASN A 19 -19.804 -7.376 -10.463 1.00 33.24 N ATOM 131 CA ASN A 19 -18.581 -7.000 -9.776 1.00 24.43 C ATOM 132 C ASN A 19 -18.378 -5.492 -9.756 1.00 45.44 C ATOM 133 O ASN A 19 -18.467 -4.810 -10.787 1.00 61.23 O ATOM 134 CB ASN A 19 -17.346 -7.763 -10.293 1.00 20.41 C ATOM 135 CG ASN A 19 -17.246 -7.868 -11.804 1.00 54.20 C ATOM 136 OD1 ASN A 19 -17.655 -6.980 -12.554 1.00 52.43 O ATOM 137 ND2 ASN A 19 -16.749 -8.990 -12.256 1.00 3.32 N ATOM 0 H ASN A 19 -19.834 -7.075 -11.437 1.00 33.24 H new ATOM 0 HA ASN A 19 -18.702 -7.309 -8.738 1.00 24.43 H new ATOM 0 HB2 ASN A 19 -16.449 -7.270 -9.917 1.00 20.41 H new ATOM 0 HB3 ASN A 19 -17.357 -8.769 -9.873 1.00 20.41 H new ATOM 0 HD21 ASN A 19 -16.690 -9.153 -13.261 1.00 3.32 H new ATOM 0 HD22 ASN A 19 -16.420 -9.702 -11.603 1.00 3.32 H new ATOM 144 N VAL A 20 -18.137 -4.972 -8.573 1.00 32.34 N ATOM 145 CA VAL A 20 -17.987 -3.543 -8.350 1.00 2.14 C ATOM 146 C VAL A 20 -16.739 -3.302 -7.521 1.00 4.24 C ATOM 147 O VAL A 20 -16.440 -4.074 -6.615 1.00 51.21 O ATOM 148 CB VAL A 20 -19.230 -2.955 -7.587 1.00 20.04 C ATOM 149 CG1 VAL A 20 -19.085 -1.454 -7.337 1.00 21.41 C ATOM 150 CG2 VAL A 20 -20.518 -3.233 -8.345 1.00 15.42 C ATOM 0 H VAL A 20 -18.038 -5.532 -7.726 1.00 32.34 H new ATOM 0 HA VAL A 20 -17.909 -3.047 -9.318 1.00 2.14 H new ATOM 0 HB VAL A 20 -19.275 -3.456 -6.620 1.00 20.04 H new ATOM 0 HG11 VAL A 20 -19.964 -1.087 -6.808 1.00 21.41 H new ATOM 0 HG12 VAL A 20 -18.196 -1.270 -6.734 1.00 21.41 H new ATOM 0 HG13 VAL A 20 -18.992 -0.934 -8.290 1.00 21.41 H new ATOM 0 HG21 VAL A 20 -21.361 -2.815 -7.795 1.00 15.42 H new ATOM 0 HG22 VAL A 20 -20.466 -2.774 -9.332 1.00 15.42 H new ATOM 0 HG23 VAL A 20 -20.652 -4.309 -8.452 1.00 15.42 H new ATOM 160 N PHE A 21 -16.014 -2.266 -7.840 1.00 61.32 N ATOM 161 CA PHE A 21 -14.826 -1.916 -7.112 1.00 64.54 C ATOM 162 C PHE A 21 -15.165 -0.819 -6.121 1.00 74.51 C ATOM 163 O PHE A 21 -15.636 0.261 -6.508 1.00 62.33 O ATOM 164 CB PHE A 21 -13.756 -1.441 -8.117 1.00 65.42 C ATOM 165 CG PHE A 21 -12.425 -0.985 -7.553 1.00 23.50 C ATOM 166 CD1 PHE A 21 -11.483 -1.903 -7.120 1.00 22.12 C ATOM 167 CD2 PHE A 21 -12.106 0.368 -7.487 1.00 44.42 C ATOM 168 CE1 PHE A 21 -10.266 -1.488 -6.634 1.00 13.13 C ATOM 169 CE2 PHE A 21 -10.885 0.783 -7.004 1.00 73.00 C ATOM 170 CZ PHE A 21 -9.966 -0.146 -6.574 1.00 74.41 C ATOM 0 H PHE A 21 -16.231 -1.639 -8.614 1.00 61.32 H new ATOM 0 HA PHE A 21 -14.437 -2.773 -6.562 1.00 64.54 H new ATOM 0 HB2 PHE A 21 -13.565 -2.255 -8.816 1.00 65.42 H new ATOM 0 HB3 PHE A 21 -14.177 -0.618 -8.694 1.00 65.42 H new ATOM 0 HD1 PHE A 21 -11.707 -2.958 -7.165 1.00 22.12 H new ATOM 0 HD2 PHE A 21 -12.825 1.102 -7.819 1.00 44.42 H new ATOM 0 HE1 PHE A 21 -9.543 -2.217 -6.298 1.00 13.13 H new ATOM 0 HE2 PHE A 21 -10.649 1.836 -6.963 1.00 73.00 H new ATOM 0 HZ PHE A 21 -9.010 0.177 -6.190 1.00 74.41 H new ATOM 180 N VAL A 22 -14.928 -1.087 -4.864 1.00 14.22 N ATOM 181 CA VAL A 22 -15.157 -0.115 -3.828 1.00 23.45 C ATOM 182 C VAL A 22 -13.893 0.638 -3.551 1.00 11.52 C ATOM 183 O VAL A 22 -12.782 0.108 -3.721 1.00 13.14 O ATOM 184 CB VAL A 22 -15.759 -0.700 -2.523 1.00 73.22 C ATOM 185 CG1 VAL A 22 -17.205 -1.119 -2.738 1.00 73.24 C ATOM 186 CG2 VAL A 22 -14.940 -1.877 -2.036 1.00 1.45 C ATOM 0 H VAL A 22 -14.572 -1.983 -4.530 1.00 14.22 H new ATOM 0 HA VAL A 22 -15.919 0.566 -4.207 1.00 23.45 H new ATOM 0 HB VAL A 22 -15.734 0.079 -1.761 1.00 73.22 H new ATOM 0 HG11 VAL A 22 -17.608 -1.526 -1.811 1.00 73.24 H new ATOM 0 HG12 VAL A 22 -17.794 -0.253 -3.040 1.00 73.24 H new ATOM 0 HG13 VAL A 22 -17.252 -1.879 -3.518 1.00 73.24 H new ATOM 0 HG21 VAL A 22 -15.379 -2.272 -1.120 1.00 1.45 H new ATOM 0 HG22 VAL A 22 -14.932 -2.655 -2.799 1.00 1.45 H new ATOM 0 HG23 VAL A 22 -13.919 -1.552 -1.838 1.00 1.45 H new ATOM 196 N TYR A 23 -14.043 1.840 -3.100 1.00 75.31 N ATOM 197 CA TYR A 23 -12.930 2.727 -3.014 1.00 44.52 C ATOM 198 C TYR A 23 -12.618 3.271 -1.619 1.00 45.21 C ATOM 199 O TYR A 23 -11.471 3.180 -1.177 1.00 0.34 O ATOM 200 CB TYR A 23 -13.048 3.815 -4.091 1.00 61.15 C ATOM 201 CG TYR A 23 -14.375 4.587 -4.142 1.00 10.24 C ATOM 202 CD1 TYR A 23 -15.580 3.953 -4.457 1.00 21.34 C ATOM 203 CD2 TYR A 23 -14.410 5.939 -3.910 1.00 31.14 C ATOM 204 CE1 TYR A 23 -16.761 4.653 -4.522 1.00 25.42 C ATOM 205 CE2 TYR A 23 -15.592 6.650 -3.973 1.00 75.34 C ATOM 206 CZ TYR A 23 -16.758 6.004 -4.276 1.00 62.21 C ATOM 207 OH TYR A 23 -17.921 6.711 -4.337 1.00 25.12 O ATOM 0 H TYR A 23 -14.930 2.232 -2.784 1.00 75.31 H new ATOM 0 HA TYR A 23 -12.043 2.127 -3.218 1.00 44.52 H new ATOM 0 HB2 TYR A 23 -12.241 4.533 -3.941 1.00 61.15 H new ATOM 0 HB3 TYR A 23 -12.885 3.351 -5.064 1.00 61.15 H new ATOM 0 HD1 TYR A 23 -15.583 2.891 -4.653 1.00 21.34 H new ATOM 0 HD2 TYR A 23 -13.493 6.458 -3.673 1.00 31.14 H new ATOM 0 HE1 TYR A 23 -17.683 4.145 -4.764 1.00 25.42 H new ATOM 0 HE2 TYR A 23 -15.595 7.713 -3.783 1.00 75.34 H new ATOM 0 HH TYR A 23 -18.352 6.708 -3.457 1.00 25.12 H new ATOM 217 N GLY A 24 -13.595 3.830 -0.925 1.00 63.44 N ATOM 218 CA GLY A 24 -13.293 4.373 0.386 1.00 3.41 C ATOM 219 C GLY A 24 -14.232 3.919 1.482 1.00 51.24 C ATOM 220 O GLY A 24 -13.879 3.064 2.285 1.00 21.40 O ATOM 0 H GLY A 24 -14.564 3.918 -1.231 1.00 63.44 H new ATOM 0 HA2 GLY A 24 -12.275 4.092 0.657 1.00 3.41 H new ATOM 0 HA3 GLY A 24 -13.319 5.461 0.330 1.00 3.41 H new ATOM 224 N SER A 25 -15.429 4.472 1.488 1.00 71.22 N ATOM 225 CA SER A 25 -16.424 4.239 2.537 1.00 33.41 C ATOM 226 C SER A 25 -16.789 2.750 2.683 1.00 13.53 C ATOM 227 O SER A 25 -16.980 2.256 3.783 1.00 4.21 O ATOM 228 CB SER A 25 -17.682 5.088 2.227 1.00 12.24 C ATOM 229 OG SER A 25 -18.686 4.962 3.224 1.00 34.03 O ATOM 0 H SER A 25 -15.750 5.107 0.757 1.00 71.22 H new ATOM 0 HA SER A 25 -15.994 4.541 3.492 1.00 33.41 H new ATOM 0 HB2 SER A 25 -17.395 6.136 2.136 1.00 12.24 H new ATOM 0 HB3 SER A 25 -18.092 4.785 1.264 1.00 12.24 H new ATOM 0 HG SER A 25 -19.457 5.517 2.984 1.00 34.03 H new ATOM 235 N PHE A 26 -16.839 2.037 1.576 1.00 54.24 N ATOM 236 CA PHE A 26 -17.249 0.639 1.605 1.00 62.34 C ATOM 237 C PHE A 26 -16.077 -0.280 1.303 1.00 62.34 C ATOM 238 O PHE A 26 -16.249 -1.374 0.807 1.00 15.24 O ATOM 239 CB PHE A 26 -18.371 0.410 0.601 1.00 72.34 C ATOM 240 CG PHE A 26 -19.561 1.292 0.826 1.00 43.42 C ATOM 241 CD1 PHE A 26 -20.410 1.095 1.913 1.00 2.34 C ATOM 242 CD2 PHE A 26 -19.827 2.326 -0.041 1.00 12.20 C ATOM 243 CE1 PHE A 26 -21.486 1.921 2.118 1.00 44.23 C ATOM 244 CE2 PHE A 26 -20.910 3.150 0.162 1.00 34.32 C ATOM 245 CZ PHE A 26 -21.736 2.947 1.245 1.00 15.34 C ATOM 0 H PHE A 26 -16.604 2.394 0.650 1.00 54.24 H new ATOM 0 HA PHE A 26 -17.609 0.406 2.607 1.00 62.34 H new ATOM 0 HB2 PHE A 26 -17.988 0.579 -0.405 1.00 72.34 H new ATOM 0 HB3 PHE A 26 -18.686 -0.632 0.651 1.00 72.34 H new ATOM 0 HD1 PHE A 26 -20.219 0.284 2.601 1.00 2.34 H new ATOM 0 HD2 PHE A 26 -19.180 2.493 -0.889 1.00 12.20 H new ATOM 0 HE1 PHE A 26 -22.135 1.763 2.966 1.00 44.23 H new ATOM 0 HE2 PHE A 26 -21.112 3.956 -0.528 1.00 34.32 H new ATOM 0 HZ PHE A 26 -22.583 3.598 1.407 1.00 15.34 H new ATOM 255 N GLN A 27 -14.882 0.161 1.664 1.00 22.11 N ATOM 256 CA GLN A 27 -13.648 -0.595 1.434 1.00 23.03 C ATOM 257 C GLN A 27 -13.571 -1.782 2.428 1.00 4.01 C ATOM 258 O GLN A 27 -12.705 -2.671 2.322 1.00 32.12 O ATOM 259 CB GLN A 27 -12.463 0.355 1.667 1.00 34.51 C ATOM 260 CG GLN A 27 -11.103 -0.156 1.249 1.00 60.54 C ATOM 261 CD GLN A 27 -10.839 -0.090 -0.254 1.00 62.00 C ATOM 262 OE1 GLN A 27 -9.707 0.056 -0.673 1.00 22.34 O ATOM 263 NE2 GLN A 27 -11.864 -0.169 -1.067 1.00 14.43 N ATOM 0 H GLN A 27 -14.734 1.057 2.128 1.00 22.11 H new ATOM 0 HA GLN A 27 -13.625 -0.989 0.418 1.00 23.03 H new ATOM 0 HB2 GLN A 27 -12.659 1.284 1.132 1.00 34.51 H new ATOM 0 HB3 GLN A 27 -12.425 0.601 2.728 1.00 34.51 H new ATOM 0 HG2 GLN A 27 -10.337 0.422 1.766 1.00 60.54 H new ATOM 0 HG3 GLN A 27 -11.000 -1.190 1.579 1.00 60.54 H new ATOM 0 HE21 GLN A 27 -12.804 -0.292 -0.692 1.00 14.43 H new ATOM 0 HE22 GLN A 27 -11.721 -0.108 -2.075 1.00 14.43 H new ATOM 272 N ASP A 28 -14.499 -1.776 3.346 1.00 25.40 N ATOM 273 CA ASP A 28 -14.591 -2.718 4.429 1.00 21.31 C ATOM 274 C ASP A 28 -15.853 -3.596 4.293 1.00 22.35 C ATOM 275 O ASP A 28 -16.929 -3.091 3.997 1.00 75.41 O ATOM 276 CB ASP A 28 -14.629 -1.918 5.731 1.00 74.53 C ATOM 277 CG ASP A 28 -14.965 -2.737 6.928 1.00 74.14 C ATOM 278 OD1 ASP A 28 -14.074 -3.428 7.469 1.00 70.13 O ATOM 279 OD2 ASP A 28 -16.115 -2.692 7.350 1.00 31.04 O ATOM 0 H ASP A 28 -15.246 -1.082 3.360 1.00 25.40 H new ATOM 0 HA ASP A 28 -13.733 -3.390 4.417 1.00 21.31 H new ATOM 0 HB2 ASP A 28 -13.659 -1.446 5.885 1.00 74.53 H new ATOM 0 HB3 ASP A 28 -15.361 -1.116 5.633 1.00 74.53 H new ATOM 284 N PRO A 29 -15.728 -4.921 4.482 1.00 75.30 N ATOM 285 CA PRO A 29 -16.869 -5.845 4.392 1.00 14.04 C ATOM 286 C PRO A 29 -17.830 -5.725 5.580 1.00 73.22 C ATOM 287 O PRO A 29 -19.018 -6.031 5.464 1.00 3.42 O ATOM 288 CB PRO A 29 -16.215 -7.222 4.381 1.00 43.41 C ATOM 289 CG PRO A 29 -14.909 -7.039 5.058 1.00 53.24 C ATOM 290 CD PRO A 29 -14.465 -5.633 4.764 1.00 63.54 C ATOM 0 HA PRO A 29 -17.481 -5.637 3.514 1.00 14.04 H new ATOM 0 HB2 PRO A 29 -16.830 -7.954 4.904 1.00 43.41 H new ATOM 0 HB3 PRO A 29 -16.083 -7.587 3.362 1.00 43.41 H new ATOM 0 HG2 PRO A 29 -15.004 -7.199 6.132 1.00 53.24 H new ATOM 0 HG3 PRO A 29 -14.179 -7.760 4.692 1.00 53.24 H new ATOM 0 HD2 PRO A 29 -13.938 -5.194 5.611 1.00 63.54 H new ATOM 0 HD3 PRO A 29 -13.786 -5.597 3.912 1.00 63.54 H new ATOM 298 N ASP A 30 -17.331 -5.264 6.709 1.00 15.42 N ATOM 299 CA ASP A 30 -18.163 -5.124 7.899 1.00 1.01 C ATOM 300 C ASP A 30 -19.255 -4.104 7.664 1.00 64.30 C ATOM 301 O ASP A 30 -20.424 -4.344 7.999 1.00 22.54 O ATOM 302 CB ASP A 30 -17.337 -4.765 9.136 1.00 13.31 C ATOM 303 CG ASP A 30 -18.191 -4.499 10.352 1.00 32.44 C ATOM 304 OD1 ASP A 30 -18.570 -5.455 11.050 1.00 51.03 O ATOM 305 OD2 ASP A 30 -18.498 -3.327 10.626 1.00 14.31 O ATOM 0 H ASP A 30 -16.359 -4.980 6.833 1.00 15.42 H new ATOM 0 HA ASP A 30 -18.625 -6.092 8.093 1.00 1.01 H new ATOM 0 HB2 ASP A 30 -16.645 -5.579 9.354 1.00 13.31 H new ATOM 0 HB3 ASP A 30 -16.734 -3.883 8.921 1.00 13.31 H new ATOM 310 N VAL A 31 -18.893 -2.991 7.045 1.00 72.11 N ATOM 311 CA VAL A 31 -19.861 -1.959 6.741 1.00 3.24 C ATOM 312 C VAL A 31 -20.826 -2.447 5.656 1.00 63.42 C ATOM 313 O VAL A 31 -21.988 -2.068 5.640 1.00 33.33 O ATOM 314 CB VAL A 31 -19.209 -0.579 6.364 1.00 61.55 C ATOM 315 CG1 VAL A 31 -18.398 -0.649 5.090 1.00 14.04 C ATOM 316 CG2 VAL A 31 -20.256 0.530 6.288 1.00 11.31 C ATOM 0 H VAL A 31 -17.940 -2.783 6.746 1.00 72.11 H new ATOM 0 HA VAL A 31 -20.423 -1.768 7.655 1.00 3.24 H new ATOM 0 HB VAL A 31 -18.514 -0.335 7.168 1.00 61.55 H new ATOM 0 HG11 VAL A 31 -17.971 0.331 4.877 1.00 14.04 H new ATOM 0 HG12 VAL A 31 -17.596 -1.377 5.209 1.00 14.04 H new ATOM 0 HG13 VAL A 31 -19.042 -0.951 4.265 1.00 14.04 H new ATOM 0 HG21 VAL A 31 -19.772 1.470 6.025 1.00 11.31 H new ATOM 0 HG22 VAL A 31 -20.997 0.279 5.529 1.00 11.31 H new ATOM 0 HG23 VAL A 31 -20.748 0.633 7.255 1.00 11.31 H new ATOM 326 N ILE A 32 -20.350 -3.331 4.779 1.00 60.13 N ATOM 327 CA ILE A 32 -21.191 -3.896 3.749 1.00 52.10 C ATOM 328 C ILE A 32 -22.292 -4.768 4.365 1.00 40.34 C ATOM 329 O ILE A 32 -23.467 -4.614 4.027 1.00 1.42 O ATOM 330 CB ILE A 32 -20.365 -4.667 2.689 1.00 40.23 C ATOM 331 CG1 ILE A 32 -19.502 -3.699 1.886 1.00 63.31 C ATOM 332 CG2 ILE A 32 -21.265 -5.446 1.743 1.00 63.44 C ATOM 333 CD1 ILE A 32 -20.322 -2.686 1.110 1.00 24.32 C ATOM 0 H ILE A 32 -19.386 -3.665 4.769 1.00 60.13 H new ATOM 0 HA ILE A 32 -21.676 -3.073 3.224 1.00 52.10 H new ATOM 0 HB ILE A 32 -19.727 -5.374 3.219 1.00 40.23 H new ATOM 0 HG12 ILE A 32 -18.828 -3.173 2.562 1.00 63.31 H new ATOM 0 HG13 ILE A 32 -18.880 -4.264 1.192 1.00 63.31 H new ATOM 0 HG21 ILE A 32 -20.653 -5.975 1.012 1.00 63.44 H new ATOM 0 HG22 ILE A 32 -21.855 -6.165 2.311 1.00 63.44 H new ATOM 0 HG23 ILE A 32 -21.933 -4.757 1.226 1.00 63.44 H new ATOM 0 HD11 ILE A 32 -19.655 -2.024 0.558 1.00 24.32 H new ATOM 0 HD12 ILE A 32 -20.977 -3.207 0.411 1.00 24.32 H new ATOM 0 HD13 ILE A 32 -20.925 -2.098 1.803 1.00 24.32 H new ATOM 345 N ASN A 33 -21.920 -5.648 5.297 1.00 24.24 N ATOM 346 CA ASN A 33 -22.914 -6.469 6.013 1.00 31.24 C ATOM 347 C ASN A 33 -23.968 -5.603 6.690 1.00 44.04 C ATOM 348 O ASN A 33 -25.125 -5.993 6.801 1.00 1.33 O ATOM 349 CB ASN A 33 -22.284 -7.401 7.064 1.00 22.13 C ATOM 350 CG ASN A 33 -21.566 -8.616 6.503 1.00 34.14 C ATOM 351 OD1 ASN A 33 -22.182 -9.647 6.268 1.00 5.45 O ATOM 352 ND2 ASN A 33 -20.279 -8.524 6.322 1.00 40.41 N ATOM 0 H ASN A 33 -20.953 -5.814 5.575 1.00 24.24 H new ATOM 0 HA ASN A 33 -23.381 -7.089 5.248 1.00 31.24 H new ATOM 0 HB2 ASN A 33 -21.577 -6.824 7.660 1.00 22.13 H new ATOM 0 HB3 ASN A 33 -23.068 -7.742 7.740 1.00 22.13 H new ATOM 0 HD21 ASN A 33 -19.754 -9.327 5.974 1.00 40.41 H new ATOM 0 HD22 ASN A 33 -19.796 -7.649 6.528 1.00 40.41 H new ATOM 359 N VAL A 34 -23.568 -4.431 7.132 1.00 33.13 N ATOM 360 CA VAL A 34 -24.484 -3.521 7.792 1.00 42.40 C ATOM 361 C VAL A 34 -25.318 -2.725 6.774 1.00 20.21 C ATOM 362 O VAL A 34 -26.502 -2.469 7.000 1.00 45.52 O ATOM 363 CB VAL A 34 -23.747 -2.552 8.767 1.00 60.10 C ATOM 364 CG1 VAL A 34 -24.722 -1.613 9.469 1.00 65.45 C ATOM 365 CG2 VAL A 34 -22.936 -3.331 9.789 1.00 41.12 C ATOM 0 H VAL A 34 -22.613 -4.083 7.047 1.00 33.13 H new ATOM 0 HA VAL A 34 -25.161 -4.137 8.384 1.00 42.40 H new ATOM 0 HB VAL A 34 -23.068 -1.943 8.170 1.00 60.10 H new ATOM 0 HG11 VAL A 34 -24.172 -0.953 10.140 1.00 65.45 H new ATOM 0 HG12 VAL A 34 -25.251 -1.016 8.726 1.00 65.45 H new ATOM 0 HG13 VAL A 34 -25.441 -2.198 10.043 1.00 65.45 H new ATOM 0 HG21 VAL A 34 -22.430 -2.636 10.459 1.00 41.12 H new ATOM 0 HG22 VAL A 34 -23.600 -3.974 10.367 1.00 41.12 H new ATOM 0 HG23 VAL A 34 -22.195 -3.943 9.275 1.00 41.12 H new ATOM 375 N MET A 35 -24.700 -2.350 5.652 1.00 75.21 N ATOM 376 CA MET A 35 -25.372 -1.555 4.639 1.00 11.54 C ATOM 377 C MET A 35 -26.537 -2.337 4.043 1.00 42.43 C ATOM 378 O MET A 35 -27.596 -1.768 3.746 1.00 21.34 O ATOM 379 CB MET A 35 -24.402 -1.160 3.523 1.00 5.25 C ATOM 380 CG MET A 35 -24.973 -0.124 2.575 1.00 25.33 C ATOM 381 SD MET A 35 -23.955 0.198 1.156 1.00 20.44 S ATOM 382 CE MET A 35 -24.116 -1.338 0.309 1.00 54.44 C ATOM 0 H MET A 35 -23.734 -2.588 5.428 1.00 75.21 H new ATOM 0 HA MET A 35 -25.747 -0.650 5.116 1.00 11.54 H new ATOM 0 HB2 MET A 35 -23.486 -0.771 3.967 1.00 5.25 H new ATOM 0 HB3 MET A 35 -24.128 -2.050 2.956 1.00 5.25 H new ATOM 0 HG2 MET A 35 -25.954 -0.458 2.237 1.00 25.33 H new ATOM 0 HG3 MET A 35 -25.124 0.808 3.120 1.00 25.33 H new ATOM 0 HE1 MET A 35 -24.240 -1.154 -0.758 1.00 54.44 H new ATOM 0 HE2 MET A 35 -23.221 -1.939 0.472 1.00 54.44 H new ATOM 0 HE3 MET A 35 -24.987 -1.873 0.688 1.00 54.44 H new ATOM 392 N LEU A 36 -26.355 -3.637 3.892 1.00 11.03 N ATOM 393 CA LEU A 36 -27.425 -4.477 3.412 1.00 14.53 C ATOM 394 C LEU A 36 -27.729 -5.643 4.346 1.00 60.53 C ATOM 395 O LEU A 36 -28.678 -5.582 5.121 1.00 65.24 O ATOM 396 CB LEU A 36 -27.252 -4.967 1.934 1.00 40.34 C ATOM 397 CG LEU A 36 -25.943 -5.701 1.547 1.00 53.14 C ATOM 398 CD1 LEU A 36 -26.145 -6.476 0.276 1.00 13.24 C ATOM 399 CD2 LEU A 36 -24.832 -4.706 1.313 1.00 14.23 C ATOM 0 H LEU A 36 -25.483 -4.126 4.094 1.00 11.03 H new ATOM 0 HA LEU A 36 -28.293 -3.818 3.409 1.00 14.53 H new ATOM 0 HB2 LEU A 36 -28.085 -5.632 1.706 1.00 40.34 H new ATOM 0 HB3 LEU A 36 -27.350 -4.098 1.283 1.00 40.34 H new ATOM 0 HG LEU A 36 -25.679 -6.372 2.364 1.00 53.14 H new ATOM 0 HD11 LEU A 36 -25.220 -6.989 0.012 1.00 13.24 H new ATOM 0 HD12 LEU A 36 -26.938 -7.210 0.419 1.00 13.24 H new ATOM 0 HD13 LEU A 36 -26.423 -5.793 -0.526 1.00 13.24 H new ATOM 0 HD21 LEU A 36 -23.919 -5.237 1.042 1.00 14.23 H new ATOM 0 HD22 LEU A 36 -25.113 -4.031 0.505 1.00 14.23 H new ATOM 0 HD23 LEU A 36 -24.661 -4.131 2.223 1.00 14.23 H new ATOM 411 N ASP A 37 -26.879 -6.663 4.316 1.00 42.51 N ATOM 412 CA ASP A 37 -27.124 -7.951 4.991 1.00 33.20 C ATOM 413 C ASP A 37 -25.860 -8.759 4.954 1.00 11.32 C ATOM 414 O ASP A 37 -25.338 -9.198 5.975 1.00 53.43 O ATOM 415 CB ASP A 37 -28.196 -8.824 4.247 1.00 62.20 C ATOM 416 CG ASP A 37 -29.586 -8.253 4.158 1.00 35.12 C ATOM 417 OD1 ASP A 37 -30.327 -8.322 5.160 1.00 30.43 O ATOM 418 OD2 ASP A 37 -29.960 -7.740 3.082 1.00 25.03 O ATOM 0 H ASP A 37 -25.989 -6.628 3.820 1.00 42.51 H new ATOM 0 HA ASP A 37 -27.467 -7.718 5.999 1.00 33.20 H new ATOM 0 HB2 ASP A 37 -27.839 -9.012 3.234 1.00 62.20 H new ATOM 0 HB3 ASP A 37 -28.256 -9.790 4.748 1.00 62.20 H new ATOM 423 N ARG A 38 -25.380 -8.950 3.745 1.00 35.43 N ATOM 424 CA ARG A 38 -24.223 -9.778 3.475 1.00 61.54 C ATOM 425 C ARG A 38 -23.153 -8.966 2.797 1.00 71.21 C ATOM 426 O ARG A 38 -23.307 -7.764 2.600 1.00 14.52 O ATOM 427 CB ARG A 38 -24.604 -10.920 2.535 1.00 52.34 C ATOM 428 CG ARG A 38 -25.631 -11.901 3.058 1.00 75.24 C ATOM 429 CD ARG A 38 -25.925 -12.949 1.996 1.00 62.44 C ATOM 430 NE ARG A 38 -24.704 -13.658 1.589 1.00 73.03 N ATOM 431 CZ ARG A 38 -24.328 -13.877 0.317 1.00 2.13 C ATOM 432 NH1 ARG A 38 -25.128 -13.535 -0.695 1.00 34.01 N ATOM 433 NH2 ARG A 38 -23.163 -14.459 0.065 1.00 73.44 N ATOM 0 H ARG A 38 -25.787 -8.529 2.910 1.00 35.43 H new ATOM 0 HA ARG A 38 -23.859 -10.171 4.424 1.00 61.54 H new ATOM 0 HB2 ARG A 38 -24.983 -10.489 1.608 1.00 52.34 H new ATOM 0 HB3 ARG A 38 -23.699 -11.473 2.283 1.00 52.34 H new ATOM 0 HG2 ARG A 38 -25.261 -12.381 3.964 1.00 75.24 H new ATOM 0 HG3 ARG A 38 -26.547 -11.375 3.327 1.00 75.24 H new ATOM 0 HD2 ARG A 38 -26.652 -13.665 2.380 1.00 62.44 H new ATOM 0 HD3 ARG A 38 -26.377 -12.471 1.127 1.00 62.44 H new ATOM 0 HE ARG A 38 -24.095 -14.011 2.328 1.00 73.03 H new ATOM 0 HH11 ARG A 38 -26.033 -13.104 -0.506 1.00 34.01 H new ATOM 0 HH12 ARG A 38 -24.835 -13.705 -1.657 1.00 34.01 H new ATOM 0 HH21 ARG A 38 -22.556 -14.739 0.835 1.00 73.44 H new ATOM 0 HH22 ARG A 38 -22.875 -14.627 -0.899 1.00 73.44 H new ATOM 447 N THR A 39 -22.078 -9.620 2.452 1.00 23.12 N ATOM 448 CA THR A 39 -21.005 -9.023 1.720 1.00 53.44 C ATOM 449 C THR A 39 -20.563 -9.961 0.603 1.00 31.01 C ATOM 450 O THR A 39 -20.209 -11.113 0.865 1.00 10.33 O ATOM 451 CB THR A 39 -19.826 -8.723 2.658 1.00 73.24 C ATOM 452 OG1 THR A 39 -20.299 -7.865 3.671 1.00 61.32 O ATOM 453 CG2 THR A 39 -18.686 -8.026 1.934 1.00 40.34 C ATOM 0 H THR A 39 -21.924 -10.603 2.678 1.00 23.12 H new ATOM 0 HA THR A 39 -21.349 -8.085 1.284 1.00 53.44 H new ATOM 0 HB THR A 39 -19.445 -9.664 3.055 1.00 73.24 H new ATOM 0 HG1 THR A 39 -19.546 -7.374 4.062 1.00 61.32 H new ATOM 0 HG21 THR A 39 -17.874 -7.833 2.635 1.00 40.34 H new ATOM 0 HG22 THR A 39 -18.325 -8.663 1.126 1.00 40.34 H new ATOM 0 HG23 THR A 39 -19.041 -7.082 1.521 1.00 40.34 H new ATOM 461 N PRO A 40 -20.639 -9.503 -0.660 1.00 53.02 N ATOM 462 CA PRO A 40 -20.166 -10.273 -1.813 1.00 72.11 C ATOM 463 C PRO A 40 -18.686 -10.610 -1.677 1.00 2.53 C ATOM 464 O PRO A 40 -17.937 -9.860 -1.046 1.00 32.03 O ATOM 465 CB PRO A 40 -20.384 -9.324 -2.994 1.00 0.14 C ATOM 466 CG PRO A 40 -21.449 -8.401 -2.532 1.00 62.24 C ATOM 467 CD PRO A 40 -21.202 -8.205 -1.071 1.00 53.04 C ATOM 0 HA PRO A 40 -20.687 -11.225 -1.921 1.00 72.11 H new ATOM 0 HB2 PRO A 40 -19.471 -8.784 -3.244 1.00 0.14 H new ATOM 0 HB3 PRO A 40 -20.689 -9.866 -3.889 1.00 0.14 H new ATOM 0 HG2 PRO A 40 -21.406 -7.453 -3.068 1.00 62.24 H new ATOM 0 HG3 PRO A 40 -22.438 -8.823 -2.710 1.00 62.24 H new ATOM 0 HD2 PRO A 40 -20.508 -7.385 -0.884 1.00 53.04 H new ATOM 0 HD3 PRO A 40 -22.121 -7.974 -0.533 1.00 53.04 H new ATOM 475 N GLU A 41 -18.285 -11.724 -2.262 1.00 32.25 N ATOM 476 CA GLU A 41 -16.913 -12.210 -2.190 1.00 15.21 C ATOM 477 C GLU A 41 -15.950 -11.142 -2.715 1.00 2.13 C ATOM 478 O GLU A 41 -15.996 -10.765 -3.893 1.00 35.14 O ATOM 479 CB GLU A 41 -16.777 -13.484 -3.013 1.00 23.43 C ATOM 480 CG GLU A 41 -15.433 -14.172 -2.883 1.00 74.21 C ATOM 481 CD GLU A 41 -15.326 -15.360 -3.788 1.00 52.34 C ATOM 482 OE1 GLU A 41 -15.881 -16.427 -3.453 1.00 43.32 O ATOM 483 OE2 GLU A 41 -14.713 -15.241 -4.867 1.00 12.01 O ATOM 0 H GLU A 41 -18.905 -12.324 -2.806 1.00 32.25 H new ATOM 0 HA GLU A 41 -16.665 -12.427 -1.151 1.00 15.21 H new ATOM 0 HB2 GLU A 41 -17.559 -14.181 -2.713 1.00 23.43 H new ATOM 0 HB3 GLU A 41 -16.949 -13.244 -4.062 1.00 23.43 H new ATOM 0 HG2 GLU A 41 -14.638 -13.464 -3.117 1.00 74.21 H new ATOM 0 HG3 GLU A 41 -15.285 -14.487 -1.850 1.00 74.21 H new ATOM 490 N ILE A 42 -15.099 -10.680 -1.855 1.00 41.44 N ATOM 491 CA ILE A 42 -14.208 -9.583 -2.156 1.00 0.13 C ATOM 492 C ILE A 42 -12.846 -10.094 -2.574 1.00 71.21 C ATOM 493 O ILE A 42 -12.340 -11.084 -2.029 1.00 72.42 O ATOM 494 CB ILE A 42 -14.006 -8.691 -0.897 1.00 24.43 C ATOM 495 CG1 ILE A 42 -15.340 -8.201 -0.346 1.00 63.11 C ATOM 496 CG2 ILE A 42 -13.103 -7.513 -1.208 1.00 42.44 C ATOM 497 CD1 ILE A 42 -15.214 -7.313 0.875 1.00 43.20 C ATOM 0 H ILE A 42 -14.995 -11.052 -0.911 1.00 41.44 H new ATOM 0 HA ILE A 42 -14.660 -9.011 -2.966 1.00 0.13 H new ATOM 0 HB ILE A 42 -13.527 -9.305 -0.134 1.00 24.43 H new ATOM 0 HG12 ILE A 42 -15.865 -7.653 -1.128 1.00 63.11 H new ATOM 0 HG13 ILE A 42 -15.956 -9.064 -0.093 1.00 63.11 H new ATOM 0 HG21 ILE A 42 -12.977 -6.905 -0.312 1.00 42.44 H new ATOM 0 HG22 ILE A 42 -12.130 -7.877 -1.539 1.00 42.44 H new ATOM 0 HG23 ILE A 42 -13.552 -6.909 -1.997 1.00 42.44 H new ATOM 0 HD11 ILE A 42 -16.206 -7.006 1.206 1.00 43.20 H new ATOM 0 HD12 ILE A 42 -14.718 -7.863 1.675 1.00 43.20 H new ATOM 0 HD13 ILE A 42 -14.626 -6.430 0.624 1.00 43.20 H new ATOM 509 N VAL A 43 -12.275 -9.438 -3.539 1.00 30.12 N ATOM 510 CA VAL A 43 -10.932 -9.695 -3.949 1.00 35.13 C ATOM 511 C VAL A 43 -10.161 -8.374 -3.943 1.00 2.25 C ATOM 512 O VAL A 43 -10.738 -7.307 -4.219 1.00 40.50 O ATOM 513 CB VAL A 43 -10.860 -10.365 -5.360 1.00 72.42 C ATOM 514 CG1 VAL A 43 -11.462 -9.479 -6.440 1.00 14.31 C ATOM 515 CG2 VAL A 43 -9.430 -10.743 -5.711 1.00 75.11 C ATOM 0 H VAL A 43 -12.737 -8.700 -4.069 1.00 30.12 H new ATOM 0 HA VAL A 43 -10.484 -10.400 -3.249 1.00 35.13 H new ATOM 0 HB VAL A 43 -11.456 -11.276 -5.314 1.00 72.42 H new ATOM 0 HG11 VAL A 43 -11.392 -9.982 -7.404 1.00 14.31 H new ATOM 0 HG12 VAL A 43 -12.509 -9.283 -6.208 1.00 14.31 H new ATOM 0 HG13 VAL A 43 -10.917 -8.536 -6.482 1.00 14.31 H new ATOM 0 HG21 VAL A 43 -9.408 -11.207 -6.697 1.00 75.11 H new ATOM 0 HG22 VAL A 43 -8.808 -9.848 -5.717 1.00 75.11 H new ATOM 0 HG23 VAL A 43 -9.047 -11.446 -4.971 1.00 75.11 H new ATOM 525 N SER A 44 -8.905 -8.428 -3.590 1.00 31.03 N ATOM 526 CA SER A 44 -8.067 -7.265 -3.607 1.00 41.31 C ATOM 527 C SER A 44 -7.685 -6.957 -5.042 1.00 75.02 C ATOM 528 O SER A 44 -7.126 -7.809 -5.751 1.00 13.02 O ATOM 529 CB SER A 44 -6.825 -7.531 -2.779 1.00 54.45 C ATOM 530 OG SER A 44 -7.172 -7.834 -1.433 1.00 2.34 O ATOM 0 H SER A 44 -8.436 -9.280 -3.283 1.00 31.03 H new ATOM 0 HA SER A 44 -8.597 -6.411 -3.184 1.00 41.31 H new ATOM 0 HB2 SER A 44 -6.265 -8.361 -3.211 1.00 54.45 H new ATOM 0 HB3 SER A 44 -6.172 -6.659 -2.804 1.00 54.45 H new ATOM 0 HG SER A 44 -6.357 -8.004 -0.916 1.00 2.34 H new ATOM 536 N ALA A 45 -7.999 -5.774 -5.480 1.00 70.40 N ATOM 537 CA ALA A 45 -7.724 -5.379 -6.828 1.00 54.32 C ATOM 538 C ALA A 45 -7.114 -4.006 -6.889 1.00 71.44 C ATOM 539 O ALA A 45 -7.283 -3.181 -5.988 1.00 0.14 O ATOM 540 CB ALA A 45 -8.982 -5.426 -7.656 1.00 31.52 C ATOM 0 H ALA A 45 -8.452 -5.057 -4.913 1.00 70.40 H new ATOM 0 HA ALA A 45 -7.001 -6.084 -7.237 1.00 54.32 H new ATOM 0 HB1 ALA A 45 -8.756 -5.123 -8.678 1.00 31.52 H new ATOM 0 HB2 ALA A 45 -9.379 -6.441 -7.658 1.00 31.52 H new ATOM 0 HB3 ALA A 45 -9.722 -4.748 -7.232 1.00 31.52 H new ATOM 546 N THR A 46 -6.415 -3.785 -7.943 1.00 51.42 N ATOM 547 CA THR A 46 -5.768 -2.557 -8.220 1.00 72.33 C ATOM 548 C THR A 46 -6.434 -1.928 -9.421 1.00 20.34 C ATOM 549 O THR A 46 -6.623 -2.579 -10.431 1.00 62.03 O ATOM 550 CB THR A 46 -4.279 -2.799 -8.541 1.00 60.32 C ATOM 551 OG1 THR A 46 -3.665 -3.479 -7.445 1.00 4.13 O ATOM 552 CG2 THR A 46 -3.549 -1.485 -8.794 1.00 15.03 C ATOM 0 H THR A 46 -6.273 -4.488 -8.668 1.00 51.42 H new ATOM 0 HA THR A 46 -5.841 -1.903 -7.351 1.00 72.33 H new ATOM 0 HB THR A 46 -4.216 -3.405 -9.445 1.00 60.32 H new ATOM 0 HG1 THR A 46 -4.277 -3.486 -6.680 1.00 4.13 H new ATOM 0 HG21 THR A 46 -2.502 -1.688 -9.018 1.00 15.03 H new ATOM 0 HG22 THR A 46 -4.007 -0.971 -9.639 1.00 15.03 H new ATOM 0 HG23 THR A 46 -3.615 -0.855 -7.907 1.00 15.03 H new ATOM 560 N LEU A 47 -6.805 -0.706 -9.289 1.00 71.44 N ATOM 561 CA LEU A 47 -7.389 0.043 -10.354 1.00 34.52 C ATOM 562 C LEU A 47 -6.345 1.002 -10.912 1.00 52.34 C ATOM 563 O LEU A 47 -6.063 2.027 -10.308 1.00 64.10 O ATOM 564 CB LEU A 47 -8.619 0.804 -9.839 1.00 34.03 C ATOM 565 CG LEU A 47 -9.298 1.751 -10.817 1.00 53.41 C ATOM 566 CD1 LEU A 47 -9.728 1.028 -12.065 1.00 62.13 C ATOM 567 CD2 LEU A 47 -10.483 2.438 -10.165 1.00 3.11 C ATOM 0 H LEU A 47 -6.711 -0.182 -8.419 1.00 71.44 H new ATOM 0 HA LEU A 47 -7.716 -0.625 -11.151 1.00 34.52 H new ATOM 0 HB2 LEU A 47 -9.356 0.073 -9.506 1.00 34.03 H new ATOM 0 HB3 LEU A 47 -8.321 1.378 -8.962 1.00 34.03 H new ATOM 0 HG LEU A 47 -8.572 2.512 -11.102 1.00 53.41 H new ATOM 0 HD11 LEU A 47 -10.210 1.731 -12.745 1.00 62.13 H new ATOM 0 HD12 LEU A 47 -8.856 0.592 -12.552 1.00 62.13 H new ATOM 0 HD13 LEU A 47 -10.430 0.237 -11.803 1.00 62.13 H new ATOM 0 HD21 LEU A 47 -10.954 3.110 -10.882 1.00 3.11 H new ATOM 0 HD22 LEU A 47 -11.206 1.689 -9.842 1.00 3.11 H new ATOM 0 HD23 LEU A 47 -10.142 3.009 -9.301 1.00 3.11 H new ATOM 579 N PRO A 48 -5.708 0.650 -12.027 1.00 43.24 N ATOM 580 CA PRO A 48 -4.709 1.495 -12.637 1.00 35.43 C ATOM 581 C PRO A 48 -5.351 2.535 -13.550 1.00 51.22 C ATOM 582 O PRO A 48 -6.405 2.284 -14.153 1.00 42.31 O ATOM 583 CB PRO A 48 -3.862 0.509 -13.441 1.00 44.21 C ATOM 584 CG PRO A 48 -4.799 -0.600 -13.815 1.00 62.34 C ATOM 585 CD PRO A 48 -5.909 -0.606 -12.785 1.00 32.30 C ATOM 0 HA PRO A 48 -4.130 2.064 -11.909 1.00 35.43 H new ATOM 0 HB2 PRO A 48 -3.440 0.984 -14.327 1.00 44.21 H new ATOM 0 HB3 PRO A 48 -3.026 0.135 -12.850 1.00 44.21 H new ATOM 0 HG2 PRO A 48 -5.202 -0.444 -14.816 1.00 62.34 H new ATOM 0 HG3 PRO A 48 -4.278 -1.558 -13.827 1.00 62.34 H new ATOM 0 HD2 PRO A 48 -6.891 -0.633 -13.258 1.00 32.30 H new ATOM 0 HD3 PRO A 48 -5.844 -1.478 -12.135 1.00 32.30 H new ATOM 593 N GLY A 49 -4.752 3.702 -13.620 1.00 73.43 N ATOM 594 CA GLY A 49 -5.274 4.738 -14.474 1.00 44.53 C ATOM 595 C GLY A 49 -6.274 5.604 -13.754 1.00 65.01 C ATOM 596 O GLY A 49 -6.954 6.434 -14.358 1.00 53.05 O ATOM 0 H GLY A 49 -3.911 3.954 -13.100 1.00 73.43 H new ATOM 0 HA2 GLY A 49 -4.454 5.356 -14.839 1.00 44.53 H new ATOM 0 HA3 GLY A 49 -5.746 4.287 -15.347 1.00 44.53 H new ATOM 600 N PHE A 50 -6.359 5.424 -12.469 1.00 51.40 N ATOM 601 CA PHE A 50 -7.260 6.164 -11.628 1.00 64.24 C ATOM 602 C PHE A 50 -6.587 6.367 -10.324 1.00 62.34 C ATOM 603 O PHE A 50 -5.676 5.639 -10.002 1.00 55.25 O ATOM 604 CB PHE A 50 -8.609 5.434 -11.434 1.00 34.15 C ATOM 605 CG PHE A 50 -9.480 5.379 -12.669 1.00 62.13 C ATOM 606 CD1 PHE A 50 -9.357 4.355 -13.596 1.00 62.03 C ATOM 607 CD2 PHE A 50 -10.415 6.371 -12.899 1.00 32.23 C ATOM 608 CE1 PHE A 50 -10.147 4.330 -14.728 1.00 74.22 C ATOM 609 CE2 PHE A 50 -11.208 6.355 -14.025 1.00 34.34 C ATOM 610 CZ PHE A 50 -11.075 5.334 -14.944 1.00 32.42 C ATOM 0 H PHE A 50 -5.792 4.744 -11.963 1.00 51.40 H new ATOM 0 HA PHE A 50 -7.494 7.118 -12.100 1.00 64.24 H new ATOM 0 HB2 PHE A 50 -8.411 4.416 -11.100 1.00 34.15 H new ATOM 0 HB3 PHE A 50 -9.163 5.929 -10.637 1.00 34.15 H new ATOM 0 HD1 PHE A 50 -8.635 3.569 -13.431 1.00 62.03 H new ATOM 0 HD2 PHE A 50 -10.526 7.172 -12.183 1.00 32.23 H new ATOM 0 HE1 PHE A 50 -10.041 3.528 -15.444 1.00 74.22 H new ATOM 0 HE2 PHE A 50 -11.932 7.139 -14.188 1.00 34.34 H new ATOM 0 HZ PHE A 50 -11.693 5.318 -15.829 1.00 32.42 H new ATOM 620 N GLN A 51 -7.009 7.324 -9.571 1.00 1.54 N ATOM 621 CA GLN A 51 -6.374 7.583 -8.325 1.00 44.24 C ATOM 622 C GLN A 51 -7.408 7.897 -7.290 1.00 3.11 C ATOM 623 O GLN A 51 -8.407 8.553 -7.565 1.00 32.21 O ATOM 624 CB GLN A 51 -5.392 8.753 -8.469 1.00 10.30 C ATOM 625 CG GLN A 51 -4.514 9.029 -7.250 1.00 72.32 C ATOM 626 CD GLN A 51 -3.640 7.839 -6.884 1.00 21.22 C ATOM 627 OE1 GLN A 51 -2.544 7.678 -7.404 1.00 62.02 O ATOM 628 NE2 GLN A 51 -4.076 7.063 -5.930 1.00 32.54 N ATOM 0 H GLN A 51 -7.790 7.940 -9.796 1.00 1.54 H new ATOM 0 HA GLN A 51 -5.818 6.699 -8.014 1.00 44.24 H new ATOM 0 HB2 GLN A 51 -4.745 8.558 -9.324 1.00 10.30 H new ATOM 0 HB3 GLN A 51 -5.960 9.655 -8.698 1.00 10.30 H new ATOM 0 HG2 GLN A 51 -3.881 9.894 -7.450 1.00 72.32 H new ATOM 0 HG3 GLN A 51 -5.147 9.287 -6.401 1.00 72.32 H new ATOM 0 HE21 GLN A 51 -4.995 7.227 -5.519 1.00 32.54 H new ATOM 0 HE22 GLN A 51 -3.498 6.293 -5.595 1.00 32.54 H new ATOM 637 N ARG A 52 -7.184 7.377 -6.123 1.00 3.43 N ATOM 638 CA ARG A 52 -8.019 7.617 -4.994 1.00 30.25 C ATOM 639 C ARG A 52 -7.373 8.662 -4.142 1.00 62.11 C ATOM 640 O ARG A 52 -6.157 8.611 -3.899 1.00 70.44 O ATOM 641 CB ARG A 52 -8.187 6.330 -4.184 1.00 54.31 C ATOM 642 CG ARG A 52 -9.005 6.471 -2.902 1.00 75.22 C ATOM 643 CD ARG A 52 -9.049 5.154 -2.141 1.00 54.44 C ATOM 644 NE ARG A 52 -7.697 4.670 -1.808 1.00 10.43 N ATOM 645 CZ ARG A 52 -7.409 3.421 -1.411 1.00 31.44 C ATOM 646 NH1 ARG A 52 -8.389 2.547 -1.209 1.00 3.22 N ATOM 647 NH2 ARG A 52 -6.138 3.060 -1.201 1.00 73.03 N ATOM 0 H ARG A 52 -6.396 6.760 -5.928 1.00 3.43 H new ATOM 0 HA ARG A 52 -9.001 7.953 -5.326 1.00 30.25 H new ATOM 0 HB2 ARG A 52 -8.661 5.580 -4.818 1.00 54.31 H new ATOM 0 HB3 ARG A 52 -7.198 5.951 -3.925 1.00 54.31 H new ATOM 0 HG2 ARG A 52 -8.570 7.246 -2.271 1.00 75.22 H new ATOM 0 HG3 ARG A 52 -10.019 6.790 -3.145 1.00 75.22 H new ATOM 0 HD2 ARG A 52 -9.625 5.282 -1.225 1.00 54.44 H new ATOM 0 HD3 ARG A 52 -9.566 4.405 -2.740 1.00 54.44 H new ATOM 0 HE ARG A 52 -6.925 5.332 -1.885 1.00 10.43 H new ATOM 0 HH11 ARG A 52 -9.359 2.826 -1.356 1.00 3.22 H new ATOM 0 HH12 ARG A 52 -8.171 1.597 -0.907 1.00 3.22 H new ATOM 0 HH21 ARG A 52 -5.386 3.735 -1.343 1.00 73.03 H new ATOM 0 HH22 ARG A 52 -5.921 2.110 -0.899 1.00 73.03 H new ATOM 661 N PHE A 53 -8.144 9.580 -3.701 1.00 50.15 N ATOM 662 CA PHE A 53 -7.681 10.618 -2.836 1.00 73.04 C ATOM 663 C PHE A 53 -8.240 10.404 -1.445 1.00 74.00 C ATOM 664 O PHE A 53 -9.078 9.541 -1.261 1.00 41.51 O ATOM 665 CB PHE A 53 -8.008 11.982 -3.416 1.00 65.25 C ATOM 666 CG PHE A 53 -7.148 12.342 -4.602 1.00 70.44 C ATOM 667 CD1 PHE A 53 -7.386 11.802 -5.857 1.00 32.53 C ATOM 668 CD2 PHE A 53 -6.082 13.213 -4.448 1.00 55.41 C ATOM 669 CE1 PHE A 53 -6.582 12.125 -6.927 1.00 34.54 C ATOM 670 CE2 PHE A 53 -5.274 13.540 -5.516 1.00 14.24 C ATOM 671 CZ PHE A 53 -5.524 12.994 -6.759 1.00 14.24 C ATOM 0 H PHE A 53 -9.136 9.641 -3.930 1.00 50.15 H new ATOM 0 HA PHE A 53 -6.595 10.581 -2.753 1.00 73.04 H new ATOM 0 HB2 PHE A 53 -9.056 12.001 -3.715 1.00 65.25 H new ATOM 0 HB3 PHE A 53 -7.884 12.739 -2.642 1.00 65.25 H new ATOM 0 HD1 PHE A 53 -8.212 11.120 -5.997 1.00 32.53 H new ATOM 0 HD2 PHE A 53 -5.881 13.642 -3.477 1.00 55.41 H new ATOM 0 HE1 PHE A 53 -6.780 11.698 -7.899 1.00 34.54 H new ATOM 0 HE2 PHE A 53 -4.447 14.222 -5.381 1.00 14.24 H new ATOM 0 HZ PHE A 53 -4.893 13.247 -7.598 1.00 14.24 H new ATOM 681 N ARG A 54 -7.738 11.129 -0.467 1.00 53.23 N ATOM 682 CA ARG A 54 -8.129 10.894 0.916 1.00 42.02 C ATOM 683 C ARG A 54 -9.186 11.814 1.442 1.00 2.24 C ATOM 684 O ARG A 54 -9.494 12.854 0.862 1.00 34.05 O ATOM 685 CB ARG A 54 -6.978 10.919 1.895 1.00 33.33 C ATOM 686 CG ARG A 54 -6.086 9.690 1.979 1.00 1.13 C ATOM 687 CD ARG A 54 -5.140 9.500 0.840 1.00 20.53 C ATOM 688 NE ARG A 54 -5.686 8.872 -0.352 1.00 41.31 N ATOM 689 CZ ARG A 54 -5.544 7.571 -0.560 1.00 41.11 C ATOM 690 NH1 ARG A 54 -5.563 6.732 0.481 1.00 44.04 N ATOM 691 NH2 ARG A 54 -5.496 7.084 -1.791 1.00 33.51 N ATOM 0 H ARG A 54 -7.063 11.882 -0.598 1.00 53.23 H new ATOM 0 HA ARG A 54 -8.541 9.887 0.853 1.00 42.02 H new ATOM 0 HB2 ARG A 54 -6.348 11.773 1.648 1.00 33.33 H new ATOM 0 HB3 ARG A 54 -7.388 11.103 2.888 1.00 33.33 H new ATOM 0 HG2 ARG A 54 -5.509 9.745 2.902 1.00 1.13 H new ATOM 0 HG3 ARG A 54 -6.721 8.807 2.052 1.00 1.13 H new ATOM 0 HD2 ARG A 54 -4.740 10.475 0.561 1.00 20.53 H new ATOM 0 HD3 ARG A 54 -4.300 8.899 1.189 1.00 20.53 H new ATOM 0 HE ARG A 54 -6.185 9.440 -1.037 1.00 41.31 H new ATOM 0 HH11 ARG A 54 -5.686 7.095 1.426 1.00 44.04 H new ATOM 0 HH12 ARG A 54 -5.454 5.729 0.330 1.00 44.04 H new ATOM 0 HH21 ARG A 54 -5.569 7.712 -2.591 1.00 33.51 H new ATOM 0 HH22 ARG A 54 -5.386 6.081 -1.939 1.00 33.51 H new ATOM 705 N LEU A 55 -9.719 11.411 2.571 1.00 71.30 N ATOM 706 CA LEU A 55 -10.682 12.162 3.306 1.00 72.30 C ATOM 707 C LEU A 55 -9.957 12.952 4.389 1.00 5.31 C ATOM 708 O LEU A 55 -9.149 12.392 5.147 1.00 52.21 O ATOM 709 CB LEU A 55 -11.764 11.232 3.936 1.00 32.53 C ATOM 710 CG LEU A 55 -11.378 10.257 5.102 1.00 42.13 C ATOM 711 CD1 LEU A 55 -12.598 9.468 5.539 1.00 24.14 C ATOM 712 CD2 LEU A 55 -10.255 9.286 4.732 1.00 44.11 C ATOM 0 H LEU A 55 -9.480 10.521 3.009 1.00 71.30 H new ATOM 0 HA LEU A 55 -11.198 12.844 2.630 1.00 72.30 H new ATOM 0 HB2 LEU A 55 -12.568 11.871 4.301 1.00 32.53 H new ATOM 0 HB3 LEU A 55 -12.179 10.626 3.131 1.00 32.53 H new ATOM 0 HG LEU A 55 -11.008 10.880 5.917 1.00 42.13 H new ATOM 0 HD11 LEU A 55 -12.323 8.792 6.349 1.00 24.14 H new ATOM 0 HD12 LEU A 55 -13.371 10.155 5.885 1.00 24.14 H new ATOM 0 HD13 LEU A 55 -12.978 8.889 4.697 1.00 24.14 H new ATOM 0 HD21 LEU A 55 -10.037 8.640 5.583 1.00 44.11 H new ATOM 0 HD22 LEU A 55 -10.566 8.676 3.884 1.00 44.11 H new ATOM 0 HD23 LEU A 55 -9.360 9.849 4.465 1.00 44.11 H new ATOM 724 N LYS A 56 -10.185 14.232 4.424 1.00 52.53 N ATOM 725 CA LYS A 56 -9.582 15.084 5.428 1.00 14.00 C ATOM 726 C LYS A 56 -10.604 15.980 6.097 1.00 23.05 C ATOM 727 O LYS A 56 -10.253 16.991 6.726 1.00 44.53 O ATOM 728 CB LYS A 56 -8.392 15.892 4.870 1.00 11.52 C ATOM 729 CG LYS A 56 -7.136 15.056 4.603 1.00 62.33 C ATOM 730 CD LYS A 56 -5.975 15.917 4.110 1.00 14.22 C ATOM 731 CE LYS A 56 -4.667 15.121 4.018 1.00 32.00 C ATOM 732 NZ LYS A 56 -4.181 14.655 5.347 1.00 12.43 N ATOM 0 H LYS A 56 -10.790 14.721 3.764 1.00 52.53 H new ATOM 0 HA LYS A 56 -9.181 14.423 6.197 1.00 14.00 H new ATOM 0 HB2 LYS A 56 -8.698 16.374 3.942 1.00 11.52 H new ATOM 0 HB3 LYS A 56 -8.144 16.686 5.575 1.00 11.52 H new ATOM 0 HG2 LYS A 56 -6.843 14.539 5.517 1.00 62.33 H new ATOM 0 HG3 LYS A 56 -7.361 14.290 3.861 1.00 62.33 H new ATOM 0 HD2 LYS A 56 -6.219 16.328 3.130 1.00 14.22 H new ATOM 0 HD3 LYS A 56 -5.838 16.762 4.785 1.00 14.22 H new ATOM 0 HE2 LYS A 56 -4.816 14.259 3.368 1.00 32.00 H new ATOM 0 HE3 LYS A 56 -3.901 15.742 3.553 1.00 32.00 H new ATOM 0 HZ1 LYS A 56 -3.200 14.321 5.260 1.00 12.43 H new ATOM 0 HZ2 LYS A 56 -4.220 15.442 6.026 1.00 12.43 H new ATOM 0 HZ3 LYS A 56 -4.783 13.877 5.683 1.00 12.43 H new ATOM 746 N GLY A 57 -11.865 15.611 5.995 1.00 42.25 N ATOM 747 CA GLY A 57 -12.870 16.349 6.697 1.00 31.24 C ATOM 748 C GLY A 57 -14.099 16.639 5.897 1.00 52.52 C ATOM 749 O GLY A 57 -15.204 16.282 6.301 1.00 63.20 O ATOM 0 H GLY A 57 -12.203 14.822 5.444 1.00 42.25 H new ATOM 0 HA2 GLY A 57 -13.156 15.791 7.589 1.00 31.24 H new ATOM 0 HA3 GLY A 57 -12.441 17.292 7.035 1.00 31.24 H new ATOM 753 N ARG A 58 -13.932 17.273 4.769 1.00 4.33 N ATOM 754 CA ARG A 58 -15.064 17.690 3.997 1.00 21.02 C ATOM 755 C ARG A 58 -15.445 16.617 3.005 1.00 4.41 C ATOM 756 O ARG A 58 -16.613 16.248 2.901 1.00 60.02 O ATOM 757 CB ARG A 58 -14.783 19.064 3.322 1.00 45.43 C ATOM 758 CG ARG A 58 -15.972 19.728 2.604 1.00 43.50 C ATOM 759 CD ARG A 58 -16.329 19.075 1.277 1.00 71.33 C ATOM 760 NE ARG A 58 -17.545 19.644 0.702 1.00 45.22 N ATOM 761 CZ ARG A 58 -17.595 20.478 -0.340 1.00 3.24 C ATOM 762 NH1 ARG A 58 -16.477 20.954 -0.876 1.00 51.32 N ATOM 763 NH2 ARG A 58 -18.768 20.865 -0.817 1.00 32.03 N ATOM 0 H ARG A 58 -13.025 17.510 4.367 1.00 4.33 H new ATOM 0 HA ARG A 58 -15.921 17.832 4.655 1.00 21.02 H new ATOM 0 HB2 ARG A 58 -14.417 19.751 4.085 1.00 45.43 H new ATOM 0 HB3 ARG A 58 -13.978 18.932 2.599 1.00 45.43 H new ATOM 0 HG2 ARG A 58 -16.843 19.698 3.259 1.00 43.50 H new ATOM 0 HG3 ARG A 58 -15.739 20.779 2.431 1.00 43.50 H new ATOM 0 HD2 ARG A 58 -15.503 19.200 0.577 1.00 71.33 H new ATOM 0 HD3 ARG A 58 -16.463 18.003 1.424 1.00 71.33 H new ATOM 0 HE ARG A 58 -18.432 19.382 1.133 1.00 45.22 H new ATOM 0 HH11 ARG A 58 -15.572 20.683 -0.492 1.00 51.32 H new ATOM 0 HH12 ARG A 58 -16.524 21.590 -1.672 1.00 51.32 H new ATOM 0 HH21 ARG A 58 -19.630 20.526 -0.389 1.00 32.03 H new ATOM 0 HH22 ARG A 58 -18.810 21.502 -1.613 1.00 32.03 H new ATOM 777 N LEU A 59 -14.486 16.097 2.302 1.00 10.11 N ATOM 778 CA LEU A 59 -14.789 15.115 1.312 1.00 41.13 C ATOM 779 C LEU A 59 -14.206 13.761 1.695 1.00 72.04 C ATOM 780 O LEU A 59 -13.342 13.671 2.566 1.00 23.53 O ATOM 781 CB LEU A 59 -14.345 15.579 -0.087 1.00 54.20 C ATOM 782 CG LEU A 59 -14.745 14.683 -1.258 1.00 71.43 C ATOM 783 CD1 LEU A 59 -16.256 14.525 -1.310 1.00 62.21 C ATOM 784 CD2 LEU A 59 -14.254 15.270 -2.546 1.00 72.32 C ATOM 0 H LEU A 59 -13.498 16.334 2.395 1.00 10.11 H new ATOM 0 HA LEU A 59 -15.871 14.992 1.267 1.00 41.13 H new ATOM 0 HB2 LEU A 59 -14.754 16.574 -0.263 1.00 54.20 H new ATOM 0 HB3 LEU A 59 -13.259 15.676 -0.086 1.00 54.20 H new ATOM 0 HG LEU A 59 -14.291 13.702 -1.115 1.00 71.43 H new ATOM 0 HD11 LEU A 59 -16.526 13.884 -2.149 1.00 62.21 H new ATOM 0 HD12 LEU A 59 -16.607 14.074 -0.382 1.00 62.21 H new ATOM 0 HD13 LEU A 59 -16.720 15.503 -1.436 1.00 62.21 H new ATOM 0 HD21 LEU A 59 -14.544 14.624 -3.374 1.00 72.32 H new ATOM 0 HD22 LEU A 59 -14.692 16.258 -2.686 1.00 72.32 H new ATOM 0 HD23 LEU A 59 -13.168 15.356 -2.516 1.00 72.32 H new ATOM 796 N TYR A 60 -14.700 12.738 1.050 1.00 21.42 N ATOM 797 CA TYR A 60 -14.361 11.363 1.322 1.00 32.34 C ATOM 798 C TYR A 60 -13.406 10.852 0.244 1.00 1.01 C ATOM 799 O TYR A 60 -13.175 11.556 -0.741 1.00 32.03 O ATOM 800 CB TYR A 60 -15.666 10.543 1.326 1.00 14.22 C ATOM 801 CG TYR A 60 -16.650 10.980 2.389 1.00 53.12 C ATOM 802 CD1 TYR A 60 -17.537 12.032 2.161 1.00 53.11 C ATOM 803 CD2 TYR A 60 -16.690 10.343 3.621 1.00 13.53 C ATOM 804 CE1 TYR A 60 -18.431 12.432 3.139 1.00 1.44 C ATOM 805 CE2 TYR A 60 -17.579 10.735 4.599 1.00 73.05 C ATOM 806 CZ TYR A 60 -18.447 11.776 4.355 1.00 71.11 C ATOM 807 OH TYR A 60 -19.332 12.167 5.338 1.00 1.24 O ATOM 0 H TYR A 60 -15.375 12.841 0.292 1.00 21.42 H new ATOM 0 HA TYR A 60 -13.866 11.269 2.288 1.00 32.34 H new ATOM 0 HB2 TYR A 60 -16.140 10.624 0.348 1.00 14.22 H new ATOM 0 HB3 TYR A 60 -15.424 9.491 1.476 1.00 14.22 H new ATOM 0 HD1 TYR A 60 -17.526 12.541 1.209 1.00 53.11 H new ATOM 0 HD2 TYR A 60 -16.012 9.525 3.817 1.00 13.53 H new ATOM 0 HE1 TYR A 60 -19.111 13.250 2.953 1.00 1.44 H new ATOM 0 HE2 TYR A 60 -17.595 10.228 5.552 1.00 73.05 H new ATOM 0 HH TYR A 60 -19.213 11.601 6.129 1.00 1.24 H new ATOM 817 N PRO A 61 -12.829 9.625 0.392 1.00 23.34 N ATOM 818 CA PRO A 61 -11.918 9.081 -0.600 1.00 2.10 C ATOM 819 C PRO A 61 -12.657 8.740 -1.871 1.00 21.11 C ATOM 820 O PRO A 61 -13.500 7.847 -1.875 1.00 52.30 O ATOM 821 CB PRO A 61 -11.373 7.792 0.056 1.00 32.23 C ATOM 822 CG PRO A 61 -11.750 7.903 1.487 1.00 4.04 C ATOM 823 CD PRO A 61 -13.024 8.678 1.502 1.00 5.43 C ATOM 0 HA PRO A 61 -11.132 9.786 -0.873 1.00 2.10 H new ATOM 0 HB2 PRO A 61 -11.808 6.902 -0.399 1.00 32.23 H new ATOM 0 HB3 PRO A 61 -10.292 7.715 -0.063 1.00 32.23 H new ATOM 0 HG2 PRO A 61 -11.884 6.919 1.936 1.00 4.04 H new ATOM 0 HG3 PRO A 61 -10.974 8.411 2.059 1.00 4.04 H new ATOM 0 HD2 PRO A 61 -13.891 8.037 1.342 1.00 5.43 H new ATOM 0 HD3 PRO A 61 -13.177 9.191 2.452 1.00 5.43 H new ATOM 831 N CYS A 62 -12.374 9.465 -2.919 1.00 71.31 N ATOM 832 CA CYS A 62 -13.019 9.263 -4.184 1.00 14.34 C ATOM 833 C CYS A 62 -12.025 8.838 -5.262 1.00 21.54 C ATOM 834 O CYS A 62 -10.804 9.019 -5.106 1.00 41.43 O ATOM 835 CB CYS A 62 -13.767 10.537 -4.578 1.00 72.11 C ATOM 836 SG CYS A 62 -12.739 12.021 -4.596 1.00 3.43 S ATOM 0 H CYS A 62 -11.685 10.217 -2.917 1.00 71.31 H new ATOM 0 HA CYS A 62 -13.736 8.448 -4.088 1.00 14.34 H new ATOM 0 HB2 CYS A 62 -14.203 10.398 -5.567 1.00 72.11 H new ATOM 0 HB3 CYS A 62 -14.594 10.689 -3.884 1.00 72.11 H new ATOM 0 HG CYS A 62 -12.361 12.272 -5.814 1.00 3.43 H new ATOM 842 N ILE A 63 -12.546 8.246 -6.328 1.00 35.21 N ATOM 843 CA ILE A 63 -11.752 7.810 -7.471 1.00 42.15 C ATOM 844 C ILE A 63 -11.822 8.882 -8.530 1.00 71.42 C ATOM 845 O ILE A 63 -12.854 9.520 -8.678 1.00 72.13 O ATOM 846 CB ILE A 63 -12.344 6.495 -8.094 1.00 44.35 C ATOM 847 CG1 ILE A 63 -12.390 5.374 -7.071 1.00 62.34 C ATOM 848 CG2 ILE A 63 -11.558 6.048 -9.325 1.00 22.40 C ATOM 849 CD1 ILE A 63 -11.035 4.949 -6.570 1.00 61.34 C ATOM 0 H ILE A 63 -13.543 8.052 -6.426 1.00 35.21 H new ATOM 0 HA ILE A 63 -10.730 7.628 -7.138 1.00 42.15 H new ATOM 0 HB ILE A 63 -13.363 6.724 -8.407 1.00 44.35 H new ATOM 0 HG12 ILE A 63 -12.996 5.694 -6.223 1.00 62.34 H new ATOM 0 HG13 ILE A 63 -12.890 4.512 -7.513 1.00 62.34 H new ATOM 0 HG21 ILE A 63 -11.999 5.135 -9.726 1.00 22.40 H new ATOM 0 HG22 ILE A 63 -11.592 6.831 -10.082 1.00 22.40 H new ATOM 0 HG23 ILE A 63 -10.522 5.858 -9.046 1.00 22.40 H new ATOM 0 HD11 ILE A 63 -11.152 4.145 -5.843 1.00 61.34 H new ATOM 0 HD12 ILE A 63 -10.432 4.597 -7.407 1.00 61.34 H new ATOM 0 HD13 ILE A 63 -10.540 5.797 -6.097 1.00 61.34 H new ATOM 861 N VAL A 64 -10.739 9.113 -9.224 1.00 45.31 N ATOM 862 CA VAL A 64 -10.725 10.018 -10.362 1.00 4.24 C ATOM 863 C VAL A 64 -9.726 9.457 -11.377 1.00 14.22 C ATOM 864 O VAL A 64 -8.793 8.764 -10.982 1.00 35.01 O ATOM 865 CB VAL A 64 -10.280 11.482 -9.975 1.00 12.35 C ATOM 866 CG1 VAL A 64 -11.153 12.083 -8.889 1.00 23.31 C ATOM 867 CG2 VAL A 64 -8.812 11.540 -9.570 1.00 51.10 C ATOM 0 H VAL A 64 -9.836 8.683 -9.023 1.00 45.31 H new ATOM 0 HA VAL A 64 -11.737 10.085 -10.761 1.00 4.24 H new ATOM 0 HB VAL A 64 -10.409 12.085 -10.874 1.00 12.35 H new ATOM 0 HG11 VAL A 64 -10.806 13.090 -8.659 1.00 23.31 H new ATOM 0 HG12 VAL A 64 -12.186 12.125 -9.234 1.00 23.31 H new ATOM 0 HG13 VAL A 64 -11.095 11.466 -7.993 1.00 23.31 H new ATOM 0 HG21 VAL A 64 -8.546 12.565 -9.311 1.00 51.10 H new ATOM 0 HG22 VAL A 64 -8.647 10.894 -8.708 1.00 51.10 H new ATOM 0 HG23 VAL A 64 -8.192 11.203 -10.401 1.00 51.10 H new ATOM 877 N PRO A 65 -9.917 9.697 -12.673 1.00 10.05 N ATOM 878 CA PRO A 65 -8.965 9.244 -13.705 1.00 33.13 C ATOM 879 C PRO A 65 -7.596 9.933 -13.577 1.00 73.04 C ATOM 880 O PRO A 65 -7.498 11.172 -13.558 1.00 64.12 O ATOM 881 CB PRO A 65 -9.650 9.617 -15.027 1.00 64.42 C ATOM 882 CG PRO A 65 -10.659 10.658 -14.664 1.00 63.42 C ATOM 883 CD PRO A 65 -11.083 10.376 -13.255 1.00 54.45 C ATOM 0 HA PRO A 65 -8.750 8.179 -13.621 1.00 33.13 H new ATOM 0 HB2 PRO A 65 -8.930 10.001 -15.749 1.00 64.42 H new ATOM 0 HB3 PRO A 65 -10.126 8.749 -15.483 1.00 64.42 H new ATOM 0 HG2 PRO A 65 -10.231 11.657 -14.746 1.00 63.42 H new ATOM 0 HG3 PRO A 65 -11.513 10.621 -15.340 1.00 63.42 H new ATOM 0 HD2 PRO A 65 -11.323 11.293 -12.717 1.00 54.45 H new ATOM 0 HD3 PRO A 65 -11.972 9.746 -13.222 1.00 54.45 H new ATOM 891 N SER A 66 -6.561 9.127 -13.476 1.00 31.44 N ATOM 892 CA SER A 66 -5.210 9.604 -13.318 1.00 4.32 C ATOM 893 C SER A 66 -4.332 9.010 -14.422 1.00 22.33 C ATOM 894 O SER A 66 -4.547 7.877 -14.852 1.00 50.01 O ATOM 895 CB SER A 66 -4.688 9.215 -11.924 1.00 50.32 C ATOM 896 OG SER A 66 -3.370 9.694 -11.685 1.00 25.43 O ATOM 0 H SER A 66 -6.638 8.110 -13.502 1.00 31.44 H new ATOM 0 HA SER A 66 -5.183 10.690 -13.402 1.00 4.32 H new ATOM 0 HB2 SER A 66 -5.360 9.613 -11.163 1.00 50.32 H new ATOM 0 HB3 SER A 66 -4.701 8.130 -11.824 1.00 50.32 H new ATOM 0 HG SER A 66 -3.142 9.566 -10.741 1.00 25.43 H new ATOM 902 N GLU A 67 -3.369 9.761 -14.887 1.00 2.41 N ATOM 903 CA GLU A 67 -2.516 9.302 -15.963 1.00 2.13 C ATOM 904 C GLU A 67 -1.505 8.245 -15.499 1.00 62.31 C ATOM 905 O GLU A 67 -1.219 7.301 -16.221 1.00 64.30 O ATOM 906 CB GLU A 67 -1.818 10.476 -16.621 1.00 33.41 C ATOM 907 CG GLU A 67 -2.785 11.516 -17.151 1.00 40.20 C ATOM 908 CD GLU A 67 -2.096 12.680 -17.784 1.00 11.23 C ATOM 909 OE1 GLU A 67 -1.505 13.503 -17.048 1.00 14.42 O ATOM 910 OE2 GLU A 67 -2.129 12.801 -19.018 1.00 12.14 O ATOM 0 H GLU A 67 -3.152 10.695 -14.540 1.00 2.41 H new ATOM 0 HA GLU A 67 -3.155 8.817 -16.700 1.00 2.13 H new ATOM 0 HB2 GLU A 67 -1.148 10.944 -15.900 1.00 33.41 H new ATOM 0 HB3 GLU A 67 -1.199 10.111 -17.441 1.00 33.41 H new ATOM 0 HG2 GLU A 67 -3.447 11.051 -17.881 1.00 40.20 H new ATOM 0 HG3 GLU A 67 -3.412 11.872 -16.334 1.00 40.20 H new ATOM 917 N LYS A 68 -0.987 8.394 -14.291 1.00 14.04 N ATOM 918 CA LYS A 68 0.007 7.446 -13.773 1.00 10.44 C ATOM 919 C LYS A 68 -0.319 6.963 -12.362 1.00 74.31 C ATOM 920 O LYS A 68 0.527 6.367 -11.684 1.00 33.42 O ATOM 921 CB LYS A 68 1.417 8.047 -13.827 1.00 0.33 C ATOM 922 CG LYS A 68 1.937 8.276 -15.247 1.00 5.51 C ATOM 923 CD LYS A 68 3.376 8.761 -15.249 1.00 32.15 C ATOM 924 CE LYS A 68 3.526 10.158 -14.653 1.00 21.13 C ATOM 925 NZ LYS A 68 2.853 11.192 -15.478 1.00 53.11 N ATOM 0 H LYS A 68 -1.229 9.150 -13.651 1.00 14.04 H new ATOM 0 HA LYS A 68 -0.028 6.572 -14.423 1.00 10.44 H new ATOM 0 HB2 LYS A 68 1.418 8.997 -13.292 1.00 0.33 H new ATOM 0 HB3 LYS A 68 2.104 7.385 -13.301 1.00 0.33 H new ATOM 0 HG2 LYS A 68 1.865 7.348 -15.814 1.00 5.51 H new ATOM 0 HG3 LYS A 68 1.306 9.008 -15.752 1.00 5.51 H new ATOM 0 HD2 LYS A 68 3.992 8.061 -14.684 1.00 32.15 H new ATOM 0 HD3 LYS A 68 3.753 8.764 -16.272 1.00 32.15 H new ATOM 0 HE2 LYS A 68 3.108 10.169 -13.646 1.00 21.13 H new ATOM 0 HE3 LYS A 68 4.585 10.401 -14.561 1.00 21.13 H new ATOM 0 HZ1 LYS A 68 3.119 12.137 -15.135 1.00 53.11 H new ATOM 0 HZ2 LYS A 68 3.146 11.089 -16.471 1.00 53.11 H new ATOM 0 HZ3 LYS A 68 1.822 11.076 -15.407 1.00 53.11 H new ATOM 939 N GLY A 69 -1.543 7.179 -11.938 1.00 72.43 N ATOM 940 CA GLY A 69 -1.948 6.754 -10.612 1.00 53.04 C ATOM 941 C GLY A 69 -2.633 5.399 -10.623 1.00 71.11 C ATOM 942 O GLY A 69 -2.926 4.844 -11.701 1.00 14.30 O ATOM 0 H GLY A 69 -2.271 7.641 -12.483 1.00 72.43 H new ATOM 0 HA2 GLY A 69 -1.073 6.710 -9.964 1.00 53.04 H new ATOM 0 HA3 GLY A 69 -2.623 7.496 -10.186 1.00 53.04 H new ATOM 946 N GLU A 70 -2.899 4.875 -9.441 1.00 2.04 N ATOM 947 CA GLU A 70 -3.556 3.598 -9.279 1.00 40.23 C ATOM 948 C GLU A 70 -4.258 3.579 -7.924 1.00 5.11 C ATOM 949 O GLU A 70 -3.889 4.336 -7.015 1.00 61.40 O ATOM 950 CB GLU A 70 -2.555 2.441 -9.364 1.00 43.23 C ATOM 951 CG GLU A 70 -1.569 2.372 -8.203 1.00 12.05 C ATOM 952 CD GLU A 70 -0.538 1.314 -8.382 1.00 12.44 C ATOM 953 OE1 GLU A 70 -0.785 0.158 -8.010 1.00 13.04 O ATOM 954 OE2 GLU A 70 0.542 1.619 -8.864 1.00 21.11 O ATOM 0 H GLU A 70 -2.661 5.331 -8.560 1.00 2.04 H new ATOM 0 HA GLU A 70 -4.280 3.468 -10.084 1.00 40.23 H new ATOM 0 HB2 GLU A 70 -3.107 1.502 -9.412 1.00 43.23 H new ATOM 0 HB3 GLU A 70 -1.995 2.529 -10.295 1.00 43.23 H new ATOM 0 HG2 GLU A 70 -1.076 3.338 -8.093 1.00 12.05 H new ATOM 0 HG3 GLU A 70 -2.116 2.187 -7.279 1.00 12.05 H new ATOM 961 N VAL A 71 -5.256 2.757 -7.799 1.00 72.52 N ATOM 962 CA VAL A 71 -5.988 2.630 -6.565 1.00 52.45 C ATOM 963 C VAL A 71 -5.979 1.191 -6.133 1.00 2.52 C ATOM 964 O VAL A 71 -6.122 0.303 -6.948 1.00 21.42 O ATOM 965 CB VAL A 71 -7.466 3.059 -6.736 1.00 74.02 C ATOM 966 CG1 VAL A 71 -8.200 3.034 -5.404 1.00 63.14 C ATOM 967 CG2 VAL A 71 -7.561 4.414 -7.392 1.00 55.11 C ATOM 0 H VAL A 71 -5.590 2.152 -8.549 1.00 72.52 H new ATOM 0 HA VAL A 71 -5.510 3.274 -5.827 1.00 52.45 H new ATOM 0 HB VAL A 71 -7.953 2.338 -7.393 1.00 74.02 H new ATOM 0 HG11 VAL A 71 -9.236 3.340 -5.553 1.00 63.14 H new ATOM 0 HG12 VAL A 71 -8.175 2.024 -4.994 1.00 63.14 H new ATOM 0 HG13 VAL A 71 -7.716 3.720 -4.709 1.00 63.14 H new ATOM 0 HG21 VAL A 71 -8.609 4.693 -7.501 1.00 55.11 H new ATOM 0 HG22 VAL A 71 -7.051 5.154 -6.775 1.00 55.11 H new ATOM 0 HG23 VAL A 71 -7.092 4.376 -8.375 1.00 55.11 H new ATOM 977 N HIS A 72 -5.784 0.960 -4.885 1.00 35.11 N ATOM 978 CA HIS A 72 -5.886 -0.371 -4.366 1.00 22.42 C ATOM 979 C HIS A 72 -7.122 -0.468 -3.563 1.00 54.31 C ATOM 980 O HIS A 72 -7.271 0.222 -2.557 1.00 21.14 O ATOM 981 CB HIS A 72 -4.656 -0.758 -3.558 1.00 42.13 C ATOM 982 CG HIS A 72 -3.447 -0.869 -4.406 1.00 13.43 C ATOM 983 ND1 HIS A 72 -2.903 -2.063 -4.773 1.00 1.40 N ATOM 984 CD2 HIS A 72 -2.687 0.079 -4.990 1.00 35.32 C ATOM 985 CE1 HIS A 72 -1.864 -1.848 -5.541 1.00 41.22 C ATOM 986 NE2 HIS A 72 -1.713 -0.561 -5.687 1.00 73.54 N ATOM 0 H HIS A 72 -5.551 1.674 -4.195 1.00 35.11 H new ATOM 0 HA HIS A 72 -5.936 -1.079 -5.193 1.00 22.42 H new ATOM 0 HB2 HIS A 72 -4.485 -0.015 -2.779 1.00 42.13 H new ATOM 0 HB3 HIS A 72 -4.836 -1.709 -3.057 1.00 42.13 H new ATOM 0 HD2 HIS A 72 -2.827 1.147 -4.917 1.00 35.32 H new ATOM 0 HE1 HIS A 72 -1.237 -2.610 -5.980 1.00 41.22 H new ATOM 0 HE2 HIS A 72 -0.982 -0.108 -6.236 1.00 73.54 H new ATOM 995 N GLY A 73 -8.016 -1.288 -4.009 1.00 63.14 N ATOM 996 CA GLY A 73 -9.257 -1.392 -3.360 1.00 50.21 C ATOM 997 C GLY A 73 -9.746 -2.787 -3.312 1.00 72.41 C ATOM 998 O GLY A 73 -8.951 -3.743 -3.315 1.00 35.33 O ATOM 0 H GLY A 73 -7.899 -1.892 -4.823 1.00 63.14 H new ATOM 0 HA2 GLY A 73 -9.168 -1.005 -2.345 1.00 50.21 H new ATOM 0 HA3 GLY A 73 -9.988 -0.770 -3.876 1.00 50.21 H new ATOM 1002 N LYS A 74 -11.033 -2.924 -3.311 1.00 65.53 N ATOM 1003 CA LYS A 74 -11.662 -4.197 -3.152 1.00 73.24 C ATOM 1004 C LYS A 74 -12.715 -4.359 -4.235 1.00 35.13 C ATOM 1005 O LYS A 74 -13.392 -3.393 -4.584 1.00 4.31 O ATOM 1006 CB LYS A 74 -12.370 -4.226 -1.783 1.00 13.34 C ATOM 1007 CG LYS A 74 -11.504 -3.878 -0.571 1.00 60.44 C ATOM 1008 CD LYS A 74 -10.381 -4.872 -0.349 1.00 61.13 C ATOM 1009 CE LYS A 74 -9.526 -4.467 0.849 1.00 24.20 C ATOM 1010 NZ LYS A 74 -10.305 -4.387 2.107 1.00 52.34 N ATOM 0 H LYS A 74 -11.685 -2.147 -3.422 1.00 65.53 H new ATOM 0 HA LYS A 74 -10.921 -4.994 -3.219 1.00 73.24 H new ATOM 0 HB2 LYS A 74 -13.209 -3.531 -1.816 1.00 13.34 H new ATOM 0 HB3 LYS A 74 -12.786 -5.222 -1.633 1.00 13.34 H new ATOM 0 HG2 LYS A 74 -11.081 -2.882 -0.706 1.00 60.44 H new ATOM 0 HG3 LYS A 74 -12.131 -3.840 0.320 1.00 60.44 H new ATOM 0 HD2 LYS A 74 -10.797 -5.866 -0.185 1.00 61.13 H new ATOM 0 HD3 LYS A 74 -9.759 -4.930 -1.242 1.00 61.13 H new ATOM 0 HE2 LYS A 74 -8.717 -5.187 0.973 1.00 24.20 H new ATOM 0 HE3 LYS A 74 -9.064 -3.500 0.650 1.00 24.20 H new ATOM 0 HZ1 LYS A 74 -9.657 -4.242 2.908 1.00 52.34 H new ATOM 0 HZ2 LYS A 74 -10.972 -3.591 2.053 1.00 52.34 H new ATOM 0 HZ3 LYS A 74 -10.834 -5.272 2.245 1.00 52.34 H new ATOM 1024 N VAL A 75 -12.842 -5.544 -4.767 1.00 63.30 N ATOM 1025 CA VAL A 75 -13.880 -5.842 -5.723 1.00 20.31 C ATOM 1026 C VAL A 75 -14.911 -6.772 -5.107 1.00 10.10 C ATOM 1027 O VAL A 75 -14.562 -7.790 -4.520 1.00 51.22 O ATOM 1028 CB VAL A 75 -13.301 -6.490 -7.004 1.00 4.43 C ATOM 1029 CG1 VAL A 75 -14.409 -7.041 -7.884 1.00 11.32 C ATOM 1030 CG2 VAL A 75 -12.493 -5.472 -7.777 1.00 11.53 C ATOM 0 H VAL A 75 -12.231 -6.332 -4.552 1.00 63.30 H new ATOM 0 HA VAL A 75 -14.354 -4.900 -5.998 1.00 20.31 H new ATOM 0 HB VAL A 75 -12.656 -7.316 -6.706 1.00 4.43 H new ATOM 0 HG11 VAL A 75 -13.975 -7.491 -8.777 1.00 11.32 H new ATOM 0 HG12 VAL A 75 -14.969 -7.796 -7.333 1.00 11.32 H new ATOM 0 HG13 VAL A 75 -15.079 -6.232 -8.174 1.00 11.32 H new ATOM 0 HG21 VAL A 75 -12.089 -5.936 -8.677 1.00 11.53 H new ATOM 0 HG22 VAL A 75 -13.133 -4.635 -8.056 1.00 11.53 H new ATOM 0 HG23 VAL A 75 -11.673 -5.110 -7.156 1.00 11.53 H new ATOM 1040 N LEU A 76 -16.166 -6.407 -5.253 1.00 55.13 N ATOM 1041 CA LEU A 76 -17.274 -7.171 -4.739 1.00 10.14 C ATOM 1042 C LEU A 76 -17.811 -8.077 -5.830 1.00 2.20 C ATOM 1043 O LEU A 76 -18.441 -7.608 -6.776 1.00 72.20 O ATOM 1044 CB LEU A 76 -18.409 -6.232 -4.289 1.00 24.22 C ATOM 1045 CG LEU A 76 -18.073 -5.173 -3.239 1.00 72.23 C ATOM 1046 CD1 LEU A 76 -19.306 -4.359 -2.895 1.00 2.43 C ATOM 1047 CD2 LEU A 76 -17.491 -5.811 -1.998 1.00 44.45 C ATOM 0 H LEU A 76 -16.446 -5.556 -5.741 1.00 55.13 H new ATOM 0 HA LEU A 76 -16.925 -7.759 -3.890 1.00 10.14 H new ATOM 0 HB2 LEU A 76 -18.793 -5.721 -5.172 1.00 24.22 H new ATOM 0 HB3 LEU A 76 -19.220 -6.847 -3.899 1.00 24.22 H new ATOM 0 HG LEU A 76 -17.322 -4.503 -3.657 1.00 72.23 H new ATOM 0 HD11 LEU A 76 -19.050 -3.609 -2.146 1.00 2.43 H new ATOM 0 HD12 LEU A 76 -19.677 -3.864 -3.792 1.00 2.43 H new ATOM 0 HD13 LEU A 76 -20.078 -5.018 -2.499 1.00 2.43 H new ATOM 0 HD21 LEU A 76 -17.260 -5.038 -1.265 1.00 44.45 H new ATOM 0 HD22 LEU A 76 -18.214 -6.508 -1.574 1.00 44.45 H new ATOM 0 HD23 LEU A 76 -16.579 -6.348 -2.259 1.00 44.45 H new ATOM 1059 N MET A 77 -17.526 -9.345 -5.727 1.00 34.42 N ATOM 1060 CA MET A 77 -18.028 -10.323 -6.648 1.00 70.34 C ATOM 1061 C MET A 77 -19.212 -11.031 -6.116 1.00 10.34 C ATOM 1062 O MET A 77 -19.191 -11.598 -5.027 1.00 1.43 O ATOM 1063 CB MET A 77 -16.954 -11.301 -7.076 1.00 51.43 C ATOM 1064 CG MET A 77 -16.081 -10.772 -8.176 1.00 31.43 C ATOM 1065 SD MET A 77 -16.596 -11.324 -9.839 1.00 30.53 S ATOM 1066 CE MET A 77 -18.369 -11.031 -9.838 1.00 15.33 C ATOM 0 H MET A 77 -16.932 -9.732 -4.993 1.00 34.42 H new ATOM 0 HA MET A 77 -18.347 -9.777 -7.536 1.00 70.34 H new ATOM 0 HB2 MET A 77 -16.333 -11.549 -6.215 1.00 51.43 H new ATOM 0 HB3 MET A 77 -17.425 -12.227 -7.407 1.00 51.43 H new ATOM 0 HG2 MET A 77 -16.089 -9.682 -8.144 1.00 31.43 H new ATOM 0 HG3 MET A 77 -15.053 -11.088 -7.998 1.00 31.43 H new ATOM 0 HE1 MET A 77 -18.757 -11.142 -10.851 1.00 15.33 H new ATOM 0 HE2 MET A 77 -18.856 -11.752 -9.181 1.00 15.33 H new ATOM 0 HE3 MET A 77 -18.571 -10.021 -9.481 1.00 15.33 H new ATOM 1076 N GLY A 78 -20.237 -10.994 -6.881 1.00 71.01 N ATOM 1077 CA GLY A 78 -21.446 -11.648 -6.503 1.00 25.21 C ATOM 1078 C GLY A 78 -22.492 -10.692 -5.985 1.00 34.22 C ATOM 1079 O GLY A 78 -23.345 -11.078 -5.190 1.00 51.10 O ATOM 0 H GLY A 78 -20.270 -10.516 -7.781 1.00 71.01 H new ATOM 0 HA2 GLY A 78 -21.846 -12.186 -7.362 1.00 25.21 H new ATOM 0 HA3 GLY A 78 -21.227 -12.390 -5.735 1.00 25.21 H new ATOM 1083 N VAL A 79 -22.436 -9.442 -6.412 1.00 52.24 N ATOM 1084 CA VAL A 79 -23.439 -8.484 -5.992 1.00 51.53 C ATOM 1085 C VAL A 79 -24.623 -8.558 -6.970 1.00 32.33 C ATOM 1086 O VAL A 79 -24.437 -8.471 -8.186 1.00 51.31 O ATOM 1087 CB VAL A 79 -22.856 -7.016 -5.869 1.00 31.23 C ATOM 1088 CG1 VAL A 79 -22.434 -6.420 -7.191 1.00 73.41 C ATOM 1089 CG2 VAL A 79 -23.801 -6.098 -5.143 1.00 53.42 C ATOM 0 H VAL A 79 -21.720 -9.073 -7.038 1.00 52.24 H new ATOM 0 HA VAL A 79 -23.782 -8.741 -4.990 1.00 51.53 H new ATOM 0 HB VAL A 79 -21.948 -7.115 -5.273 1.00 31.23 H new ATOM 0 HG11 VAL A 79 -22.045 -5.415 -7.029 1.00 73.41 H new ATOM 0 HG12 VAL A 79 -21.659 -7.041 -7.639 1.00 73.41 H new ATOM 0 HG13 VAL A 79 -23.293 -6.373 -7.860 1.00 73.41 H new ATOM 0 HG21 VAL A 79 -23.364 -5.102 -5.080 1.00 53.42 H new ATOM 0 HG22 VAL A 79 -24.746 -6.046 -5.684 1.00 53.42 H new ATOM 0 HG23 VAL A 79 -23.979 -6.480 -4.138 1.00 53.42 H new ATOM 1099 N THR A 80 -25.811 -8.775 -6.458 1.00 64.23 N ATOM 1100 CA THR A 80 -26.971 -8.933 -7.282 1.00 34.00 C ATOM 1101 C THR A 80 -27.378 -7.563 -7.861 1.00 61.41 C ATOM 1102 O THR A 80 -26.920 -6.520 -7.376 1.00 12.43 O ATOM 1103 CB THR A 80 -28.110 -9.495 -6.429 1.00 11.02 C ATOM 1104 OG1 THR A 80 -27.534 -10.282 -5.368 1.00 20.23 O ATOM 1105 CG2 THR A 80 -28.952 -10.421 -7.260 1.00 41.50 C ATOM 0 H THR A 80 -25.994 -8.846 -5.457 1.00 64.23 H new ATOM 0 HA THR A 80 -26.756 -9.617 -8.103 1.00 34.00 H new ATOM 0 HB THR A 80 -28.713 -8.674 -6.042 1.00 11.02 H new ATOM 0 HG1 THR A 80 -27.791 -9.902 -4.502 1.00 20.23 H new ATOM 0 HG21 THR A 80 -29.763 -10.821 -6.651 1.00 41.50 H new ATOM 0 HG22 THR A 80 -29.369 -9.874 -8.105 1.00 41.50 H new ATOM 0 HG23 THR A 80 -28.336 -11.242 -7.627 1.00 41.50 H new ATOM 1113 N SER A 81 -28.219 -7.564 -8.882 1.00 31.25 N ATOM 1114 CA SER A 81 -28.623 -6.339 -9.563 1.00 14.33 C ATOM 1115 C SER A 81 -29.290 -5.316 -8.613 1.00 14.25 C ATOM 1116 O SER A 81 -29.060 -4.114 -8.737 1.00 55.01 O ATOM 1117 CB SER A 81 -29.529 -6.670 -10.751 1.00 1.15 C ATOM 1118 OG SER A 81 -28.865 -7.562 -11.654 1.00 3.53 O ATOM 0 H SER A 81 -28.642 -8.410 -9.264 1.00 31.25 H new ATOM 0 HA SER A 81 -27.717 -5.859 -9.933 1.00 14.33 H new ATOM 0 HB2 SER A 81 -30.454 -7.125 -10.395 1.00 1.15 H new ATOM 0 HB3 SER A 81 -29.804 -5.753 -11.273 1.00 1.15 H new ATOM 0 HG SER A 81 -27.897 -7.518 -11.505 1.00 3.53 H new ATOM 1124 N ASP A 82 -30.074 -5.794 -7.655 1.00 32.14 N ATOM 1125 CA ASP A 82 -30.757 -4.900 -6.715 1.00 52.20 C ATOM 1126 C ASP A 82 -29.740 -4.191 -5.816 1.00 3.04 C ATOM 1127 O ASP A 82 -29.820 -2.980 -5.611 1.00 31.42 O ATOM 1128 CB ASP A 82 -31.794 -5.654 -5.874 1.00 11.22 C ATOM 1129 CG ASP A 82 -32.650 -4.726 -5.032 1.00 55.02 C ATOM 1130 OD1 ASP A 82 -32.278 -4.420 -3.881 1.00 44.34 O ATOM 1131 OD2 ASP A 82 -33.724 -4.290 -5.515 1.00 72.20 O ATOM 0 H ASP A 82 -30.255 -6.787 -7.505 1.00 32.14 H new ATOM 0 HA ASP A 82 -31.291 -4.149 -7.297 1.00 52.20 H new ATOM 0 HB2 ASP A 82 -32.437 -6.236 -6.534 1.00 11.22 H new ATOM 0 HB3 ASP A 82 -31.282 -6.362 -5.222 1.00 11.22 H new ATOM 1136 N GLU A 83 -28.768 -4.950 -5.306 1.00 24.03 N ATOM 1137 CA GLU A 83 -27.678 -4.387 -4.499 1.00 64.53 C ATOM 1138 C GLU A 83 -26.760 -3.516 -5.377 1.00 63.31 C ATOM 1139 O GLU A 83 -26.168 -2.564 -4.906 1.00 41.44 O ATOM 1140 CB GLU A 83 -26.831 -5.479 -3.812 1.00 50.54 C ATOM 1141 CG GLU A 83 -27.528 -6.343 -2.765 1.00 2.02 C ATOM 1142 CD GLU A 83 -28.523 -7.322 -3.312 1.00 3.12 C ATOM 1143 OE1 GLU A 83 -29.699 -6.968 -3.463 1.00 43.21 O ATOM 1144 OE2 GLU A 83 -28.130 -8.478 -3.579 1.00 12.53 O ATOM 0 H GLU A 83 -28.712 -5.960 -5.437 1.00 24.03 H new ATOM 0 HA GLU A 83 -28.142 -3.781 -3.721 1.00 64.53 H new ATOM 0 HB2 GLU A 83 -26.436 -6.138 -4.586 1.00 50.54 H new ATOM 0 HB3 GLU A 83 -25.977 -4.996 -3.338 1.00 50.54 H new ATOM 0 HG2 GLU A 83 -26.770 -6.892 -2.206 1.00 2.02 H new ATOM 0 HG3 GLU A 83 -28.036 -5.689 -2.056 1.00 2.02 H new ATOM 1151 N LEU A 84 -26.647 -3.865 -6.657 1.00 43.21 N ATOM 1152 CA LEU A 84 -25.895 -3.051 -7.618 1.00 13.32 C ATOM 1153 C LEU A 84 -26.534 -1.678 -7.681 1.00 74.03 C ATOM 1154 O LEU A 84 -25.874 -0.651 -7.550 1.00 15.43 O ATOM 1155 CB LEU A 84 -25.951 -3.682 -9.016 1.00 71.42 C ATOM 1156 CG LEU A 84 -25.245 -2.907 -10.135 1.00 3.43 C ATOM 1157 CD1 LEU A 84 -23.745 -2.921 -9.958 1.00 14.04 C ATOM 1158 CD2 LEU A 84 -25.639 -3.433 -11.491 1.00 72.44 C ATOM 0 H LEU A 84 -27.066 -4.705 -7.056 1.00 43.21 H new ATOM 0 HA LEU A 84 -24.855 -2.986 -7.299 1.00 13.32 H new ATOM 0 HB2 LEU A 84 -25.513 -4.679 -8.960 1.00 71.42 H new ATOM 0 HB3 LEU A 84 -26.997 -3.808 -9.294 1.00 71.42 H new ATOM 0 HG LEU A 84 -25.571 -1.869 -10.071 1.00 3.43 H new ATOM 0 HD11 LEU A 84 -23.278 -2.362 -10.769 1.00 14.04 H new ATOM 0 HD12 LEU A 84 -23.487 -2.461 -9.004 1.00 14.04 H new ATOM 0 HD13 LEU A 84 -23.386 -3.950 -9.973 1.00 14.04 H new ATOM 0 HD21 LEU A 84 -25.123 -2.865 -12.265 1.00 72.44 H new ATOM 0 HD22 LEU A 84 -25.363 -4.485 -11.568 1.00 72.44 H new ATOM 0 HD23 LEU A 84 -26.716 -3.330 -11.622 1.00 72.44 H new ATOM 1170 N GLU A 85 -27.838 -1.687 -7.863 1.00 42.21 N ATOM 1171 CA GLU A 85 -28.634 -0.493 -7.897 1.00 41.33 C ATOM 1172 C GLU A 85 -28.625 0.214 -6.550 1.00 34.22 C ATOM 1173 O GLU A 85 -28.776 1.419 -6.481 1.00 72.52 O ATOM 1174 CB GLU A 85 -30.032 -0.794 -8.387 1.00 12.02 C ATOM 1175 CG GLU A 85 -30.041 -1.266 -9.825 1.00 42.13 C ATOM 1176 CD GLU A 85 -31.410 -1.561 -10.350 1.00 31.54 C ATOM 1177 OE1 GLU A 85 -32.231 -0.615 -10.449 1.00 64.24 O ATOM 1178 OE2 GLU A 85 -31.690 -2.726 -10.680 1.00 74.42 O ATOM 0 H GLU A 85 -28.377 -2.543 -7.993 1.00 42.21 H new ATOM 0 HA GLU A 85 -28.189 0.199 -8.612 1.00 41.33 H new ATOM 0 HB2 GLU A 85 -30.482 -1.558 -7.752 1.00 12.02 H new ATOM 0 HB3 GLU A 85 -30.648 0.100 -8.295 1.00 12.02 H new ATOM 0 HG2 GLU A 85 -29.577 -0.504 -10.452 1.00 42.13 H new ATOM 0 HG3 GLU A 85 -29.428 -2.163 -9.908 1.00 42.13 H new ATOM 1185 N ASN A 86 -28.455 -0.558 -5.497 1.00 43.31 N ATOM 1186 CA ASN A 86 -28.301 -0.043 -4.144 1.00 21.30 C ATOM 1187 C ASN A 86 -27.068 0.815 -4.040 1.00 73.35 C ATOM 1188 O ASN A 86 -27.128 1.926 -3.572 1.00 4.33 O ATOM 1189 CB ASN A 86 -28.224 -1.210 -3.163 1.00 3.13 C ATOM 1190 CG ASN A 86 -27.655 -0.860 -1.829 1.00 61.21 C ATOM 1191 OD1 ASN A 86 -26.481 -1.030 -1.591 1.00 35.32 O ATOM 1192 ND2 ASN A 86 -28.438 -0.324 -0.990 1.00 10.04 N ATOM 0 H ASN A 86 -28.419 -1.576 -5.553 1.00 43.31 H new ATOM 0 HA ASN A 86 -29.163 0.577 -3.898 1.00 21.30 H new ATOM 0 HB2 ASN A 86 -29.226 -1.616 -3.022 1.00 3.13 H new ATOM 0 HB3 ASN A 86 -27.619 -2.001 -3.606 1.00 3.13 H new ATOM 0 HD21 ASN A 86 -28.084 -0.021 -0.083 1.00 10.04 H new ATOM 0 HD22 ASN A 86 -29.423 -0.195 -1.222 1.00 10.04 H new ATOM 1199 N LEU A 87 -25.969 0.295 -4.522 1.00 31.03 N ATOM 1200 CA LEU A 87 -24.696 1.006 -4.526 1.00 1.33 C ATOM 1201 C LEU A 87 -24.807 2.218 -5.413 1.00 44.11 C ATOM 1202 O LEU A 87 -24.299 3.292 -5.103 1.00 3.24 O ATOM 1203 CB LEU A 87 -23.589 0.087 -5.040 1.00 35.45 C ATOM 1204 CG LEU A 87 -23.346 -1.179 -4.224 1.00 63.22 C ATOM 1205 CD1 LEU A 87 -22.290 -2.050 -4.884 1.00 1.04 C ATOM 1206 CD2 LEU A 87 -22.923 -0.824 -2.811 1.00 72.12 C ATOM 0 H LEU A 87 -25.921 -0.640 -4.928 1.00 31.03 H new ATOM 0 HA LEU A 87 -24.452 1.319 -3.511 1.00 1.33 H new ATOM 0 HB2 LEU A 87 -23.829 -0.203 -6.063 1.00 35.45 H new ATOM 0 HB3 LEU A 87 -22.660 0.655 -5.079 1.00 35.45 H new ATOM 0 HG LEU A 87 -24.279 -1.741 -4.181 1.00 63.22 H new ATOM 0 HD11 LEU A 87 -22.132 -2.947 -4.286 1.00 1.04 H new ATOM 0 HD12 LEU A 87 -22.624 -2.334 -5.882 1.00 1.04 H new ATOM 0 HD13 LEU A 87 -21.355 -1.495 -4.958 1.00 1.04 H new ATOM 0 HD21 LEU A 87 -22.753 -1.738 -2.242 1.00 72.12 H new ATOM 0 HD22 LEU A 87 -22.003 -0.240 -2.842 1.00 72.12 H new ATOM 0 HD23 LEU A 87 -23.708 -0.239 -2.332 1.00 72.12 H new ATOM 1218 N ASP A 88 -25.504 2.031 -6.503 1.00 34.32 N ATOM 1219 CA ASP A 88 -25.762 3.075 -7.470 1.00 61.54 C ATOM 1220 C ASP A 88 -26.623 4.178 -6.861 1.00 12.42 C ATOM 1221 O ASP A 88 -26.462 5.341 -7.164 1.00 11.31 O ATOM 1222 CB ASP A 88 -26.444 2.471 -8.684 1.00 32.30 C ATOM 1223 CG ASP A 88 -26.757 3.470 -9.744 1.00 53.03 C ATOM 1224 OD1 ASP A 88 -25.871 3.766 -10.558 1.00 33.24 O ATOM 1225 OD2 ASP A 88 -27.915 3.932 -9.810 1.00 52.04 O ATOM 0 H ASP A 88 -25.918 1.133 -6.752 1.00 34.32 H new ATOM 0 HA ASP A 88 -24.816 3.525 -7.773 1.00 61.54 H new ATOM 0 HB2 ASP A 88 -25.803 1.696 -9.104 1.00 32.30 H new ATOM 0 HB3 ASP A 88 -27.367 1.985 -8.369 1.00 32.30 H new ATOM 1230 N ALA A 89 -27.532 3.791 -6.007 1.00 12.21 N ATOM 1231 CA ALA A 89 -28.383 4.722 -5.296 1.00 40.30 C ATOM 1232 C ALA A 89 -27.599 5.401 -4.178 1.00 53.32 C ATOM 1233 O ALA A 89 -27.617 6.625 -4.038 1.00 73.23 O ATOM 1234 CB ALA A 89 -29.564 3.970 -4.718 1.00 41.40 C ATOM 0 H ALA A 89 -27.709 2.813 -5.779 1.00 12.21 H new ATOM 0 HA ALA A 89 -28.739 5.488 -5.985 1.00 40.30 H new ATOM 0 HB1 ALA A 89 -30.210 4.664 -4.181 1.00 41.40 H new ATOM 0 HB2 ALA A 89 -30.127 3.501 -5.525 1.00 41.40 H new ATOM 0 HB3 ALA A 89 -29.206 3.203 -4.032 1.00 41.40 H new ATOM 1240 N VAL A 90 -26.908 4.585 -3.413 1.00 63.24 N ATOM 1241 CA VAL A 90 -26.117 4.996 -2.271 1.00 73.44 C ATOM 1242 C VAL A 90 -24.935 5.940 -2.651 1.00 15.11 C ATOM 1243 O VAL A 90 -24.842 7.052 -2.135 1.00 70.14 O ATOM 1244 CB VAL A 90 -25.670 3.726 -1.442 1.00 15.22 C ATOM 1245 CG1 VAL A 90 -24.548 4.024 -0.484 1.00 62.12 C ATOM 1246 CG2 VAL A 90 -26.851 3.216 -0.626 1.00 1.41 C ATOM 0 H VAL A 90 -26.880 3.578 -3.574 1.00 63.24 H new ATOM 0 HA VAL A 90 -26.746 5.609 -1.625 1.00 73.44 H new ATOM 0 HB VAL A 90 -25.323 2.985 -2.162 1.00 15.22 H new ATOM 0 HG11 VAL A 90 -24.282 3.117 0.058 1.00 62.12 H new ATOM 0 HG12 VAL A 90 -23.681 4.382 -1.039 1.00 62.12 H new ATOM 0 HG13 VAL A 90 -24.867 4.789 0.224 1.00 62.12 H new ATOM 0 HG21 VAL A 90 -26.546 2.340 -0.053 1.00 1.41 H new ATOM 0 HG22 VAL A 90 -27.186 3.997 0.056 1.00 1.41 H new ATOM 0 HG23 VAL A 90 -27.667 2.945 -1.296 1.00 1.41 H new ATOM 1256 N GLU A 91 -24.056 5.508 -3.535 1.00 75.21 N ATOM 1257 CA GLU A 91 -22.942 6.357 -3.990 1.00 2.11 C ATOM 1258 C GLU A 91 -23.373 7.369 -5.057 1.00 41.31 C ATOM 1259 O GLU A 91 -22.770 8.427 -5.214 1.00 15.23 O ATOM 1260 CB GLU A 91 -21.763 5.511 -4.461 1.00 74.34 C ATOM 1261 CG GLU A 91 -21.124 4.703 -3.345 1.00 65.50 C ATOM 1262 CD GLU A 91 -20.535 5.586 -2.257 1.00 23.33 C ATOM 1263 OE1 GLU A 91 -21.285 6.028 -1.350 1.00 53.52 O ATOM 1264 OE2 GLU A 91 -19.324 5.856 -2.296 1.00 4.43 O ATOM 0 H GLU A 91 -24.081 4.580 -3.958 1.00 75.21 H new ATOM 0 HA GLU A 91 -22.614 6.939 -3.129 1.00 2.11 H new ATOM 0 HB2 GLU A 91 -22.101 4.833 -5.245 1.00 74.34 H new ATOM 0 HB3 GLU A 91 -21.011 6.163 -4.906 1.00 74.34 H new ATOM 0 HG2 GLU A 91 -21.870 4.040 -2.907 1.00 65.50 H new ATOM 0 HG3 GLU A 91 -20.340 4.071 -3.761 1.00 65.50 H new ATOM 1271 N GLY A 92 -24.435 7.042 -5.748 1.00 5.21 N ATOM 1272 CA GLY A 92 -24.939 7.832 -6.876 1.00 64.33 C ATOM 1273 C GLY A 92 -25.284 9.284 -6.574 1.00 71.32 C ATOM 1274 O GLY A 92 -25.438 10.083 -7.499 1.00 63.20 O ATOM 0 H GLY A 92 -24.992 6.210 -5.551 1.00 5.21 H new ATOM 0 HA2 GLY A 92 -24.191 7.815 -7.669 1.00 64.33 H new ATOM 0 HA3 GLY A 92 -25.830 7.342 -7.268 1.00 64.33 H new ATOM 1278 N ASN A 93 -25.420 9.628 -5.305 1.00 73.40 N ATOM 1279 CA ASN A 93 -25.799 10.991 -4.914 1.00 51.52 C ATOM 1280 C ASN A 93 -24.823 12.038 -5.441 1.00 11.11 C ATOM 1281 O ASN A 93 -25.245 13.129 -5.836 1.00 61.30 O ATOM 1282 CB ASN A 93 -25.931 11.135 -3.395 1.00 61.33 C ATOM 1283 CG ASN A 93 -26.978 10.228 -2.801 1.00 61.22 C ATOM 1284 OD1 ASN A 93 -26.683 9.120 -2.410 1.00 15.10 O ATOM 1285 ND2 ASN A 93 -28.193 10.690 -2.727 1.00 41.41 N ATOM 0 H ASN A 93 -25.276 8.989 -4.523 1.00 73.40 H new ATOM 0 HA ASN A 93 -26.773 11.169 -5.370 1.00 51.52 H new ATOM 0 HB2 ASN A 93 -24.968 10.920 -2.931 1.00 61.33 H new ATOM 0 HB3 ASN A 93 -26.177 12.169 -3.155 1.00 61.33 H new ATOM 0 HD21 ASN A 93 -28.934 10.113 -2.329 1.00 41.41 H new ATOM 0 HD22 ASN A 93 -28.403 11.628 -3.067 1.00 41.41 H new ATOM 1292 N GLU A 94 -23.528 11.718 -5.449 1.00 45.30 N ATOM 1293 CA GLU A 94 -22.515 12.662 -5.946 1.00 10.52 C ATOM 1294 C GLU A 94 -21.484 11.968 -6.829 1.00 3.32 C ATOM 1295 O GLU A 94 -20.472 12.565 -7.212 1.00 63.40 O ATOM 1296 CB GLU A 94 -21.823 13.398 -4.786 1.00 65.32 C ATOM 1297 CG GLU A 94 -22.773 14.243 -3.963 1.00 10.32 C ATOM 1298 CD GLU A 94 -22.100 15.026 -2.878 1.00 34.24 C ATOM 1299 OE1 GLU A 94 -21.672 16.164 -3.136 1.00 21.02 O ATOM 1300 OE2 GLU A 94 -22.018 14.538 -1.737 1.00 54.11 O ATOM 0 H GLU A 94 -23.155 10.826 -5.123 1.00 45.30 H new ATOM 0 HA GLU A 94 -23.036 13.399 -6.557 1.00 10.52 H new ATOM 0 HB2 GLU A 94 -21.342 12.667 -4.136 1.00 65.32 H new ATOM 0 HB3 GLU A 94 -21.035 14.035 -5.187 1.00 65.32 H new ATOM 0 HG2 GLU A 94 -23.297 14.933 -4.625 1.00 10.32 H new ATOM 0 HG3 GLU A 94 -23.527 13.595 -3.516 1.00 10.32 H new ATOM 1307 N TYR A 95 -21.761 10.730 -7.176 1.00 62.11 N ATOM 1308 CA TYR A 95 -20.865 9.925 -7.996 1.00 73.23 C ATOM 1309 C TYR A 95 -21.666 9.267 -9.110 1.00 71.24 C ATOM 1310 O TYR A 95 -22.898 9.270 -9.071 1.00 63.43 O ATOM 1311 CB TYR A 95 -20.198 8.821 -7.163 1.00 3.51 C ATOM 1312 CG TYR A 95 -19.378 9.284 -5.973 1.00 5.31 C ATOM 1313 CD1 TYR A 95 -19.972 9.498 -4.733 1.00 63.14 C ATOM 1314 CD2 TYR A 95 -18.015 9.479 -6.083 1.00 1.02 C ATOM 1315 CE1 TYR A 95 -19.231 9.891 -3.643 1.00 24.14 C ATOM 1316 CE2 TYR A 95 -17.265 9.877 -4.997 1.00 52.24 C ATOM 1317 CZ TYR A 95 -17.879 10.079 -3.778 1.00 25.32 C ATOM 1318 OH TYR A 95 -17.130 10.469 -2.686 1.00 20.53 O ATOM 0 H TYR A 95 -22.615 10.246 -6.899 1.00 62.11 H new ATOM 0 HA TYR A 95 -20.094 10.579 -8.403 1.00 73.23 H new ATOM 0 HB2 TYR A 95 -20.975 8.147 -6.802 1.00 3.51 H new ATOM 0 HB3 TYR A 95 -19.551 8.240 -7.820 1.00 3.51 H new ATOM 0 HD1 TYR A 95 -21.037 9.353 -4.624 1.00 63.14 H new ATOM 0 HD2 TYR A 95 -17.530 9.317 -7.034 1.00 1.02 H new ATOM 0 HE1 TYR A 95 -19.710 10.050 -2.688 1.00 24.14 H new ATOM 0 HE2 TYR A 95 -16.201 10.030 -5.100 1.00 52.24 H new ATOM 0 HH TYR A 95 -17.541 10.122 -1.867 1.00 20.53 H new ATOM 1328 N GLU A 96 -20.985 8.715 -10.084 1.00 54.24 N ATOM 1329 CA GLU A 96 -21.634 8.015 -11.173 1.00 2.15 C ATOM 1330 C GLU A 96 -20.927 6.688 -11.369 1.00 4.50 C ATOM 1331 O GLU A 96 -19.726 6.569 -11.079 1.00 63.34 O ATOM 1332 CB GLU A 96 -21.604 8.866 -12.454 1.00 73.14 C ATOM 1333 CG GLU A 96 -22.352 8.295 -13.647 1.00 5.51 C ATOM 1334 CD GLU A 96 -22.303 9.227 -14.832 1.00 23.32 C ATOM 1335 OE1 GLU A 96 -23.126 10.159 -14.906 1.00 44.54 O ATOM 1336 OE2 GLU A 96 -21.423 9.062 -15.707 1.00 1.11 O ATOM 0 H GLU A 96 -19.967 8.736 -10.147 1.00 54.24 H new ATOM 0 HA GLU A 96 -22.683 7.834 -10.937 1.00 2.15 H new ATOM 0 HB2 GLU A 96 -22.019 9.847 -12.225 1.00 73.14 H new ATOM 0 HB3 GLU A 96 -20.564 9.019 -12.741 1.00 73.14 H new ATOM 0 HG2 GLU A 96 -21.919 7.333 -13.922 1.00 5.51 H new ATOM 0 HG3 GLU A 96 -23.390 8.110 -13.372 1.00 5.51 H new ATOM 1343 N ARG A 97 -21.652 5.714 -11.838 1.00 22.22 N ATOM 1344 CA ARG A 97 -21.148 4.377 -12.006 1.00 71.05 C ATOM 1345 C ARG A 97 -20.496 4.259 -13.371 1.00 73.24 C ATOM 1346 O ARG A 97 -21.164 4.358 -14.395 1.00 21.03 O ATOM 1347 CB ARG A 97 -22.331 3.412 -11.930 1.00 55.34 C ATOM 1348 CG ARG A 97 -21.987 1.940 -11.918 1.00 65.24 C ATOM 1349 CD ARG A 97 -23.259 1.100 -11.992 1.00 2.31 C ATOM 1350 NE ARG A 97 -23.897 1.158 -13.326 1.00 32.51 N ATOM 1351 CZ ARG A 97 -25.188 1.469 -13.580 1.00 31.21 C ATOM 1352 NH1 ARG A 97 -25.939 2.075 -12.663 1.00 52.54 N ATOM 1353 NH2 ARG A 97 -25.690 1.251 -14.789 1.00 41.40 N ATOM 0 H ARG A 97 -22.626 5.826 -12.120 1.00 22.22 H new ATOM 0 HA ARG A 97 -20.416 4.145 -11.233 1.00 71.05 H new ATOM 0 HB2 ARG A 97 -22.902 3.639 -11.029 1.00 55.34 H new ATOM 0 HB3 ARG A 97 -22.986 3.605 -12.779 1.00 55.34 H new ATOM 0 HG2 ARG A 97 -21.337 1.704 -12.761 1.00 65.24 H new ATOM 0 HG3 ARG A 97 -21.434 1.696 -11.011 1.00 65.24 H new ATOM 0 HD2 ARG A 97 -23.021 0.064 -11.751 1.00 2.31 H new ATOM 0 HD3 ARG A 97 -23.966 1.449 -11.239 1.00 2.31 H new ATOM 0 HE ARG A 97 -23.307 0.943 -14.130 1.00 32.51 H new ATOM 0 HH11 ARG A 97 -25.542 2.311 -11.754 1.00 52.54 H new ATOM 0 HH12 ARG A 97 -26.911 2.303 -12.870 1.00 52.54 H new ATOM 0 HH21 ARG A 97 -25.103 0.851 -15.521 1.00 41.40 H new ATOM 0 HH22 ARG A 97 -26.663 1.484 -14.987 1.00 41.40 H new ATOM 1367 N VAL A 98 -19.212 4.058 -13.389 1.00 70.03 N ATOM 1368 CA VAL A 98 -18.498 3.909 -14.626 1.00 24.32 C ATOM 1369 C VAL A 98 -17.787 2.572 -14.690 1.00 63.20 C ATOM 1370 O VAL A 98 -17.575 1.924 -13.656 1.00 55.23 O ATOM 1371 CB VAL A 98 -17.514 5.066 -14.871 1.00 64.34 C ATOM 1372 CG1 VAL A 98 -18.299 6.371 -14.987 1.00 71.52 C ATOM 1373 CG2 VAL A 98 -16.487 5.145 -13.741 1.00 50.34 C ATOM 0 H VAL A 98 -18.631 3.993 -12.553 1.00 70.03 H new ATOM 0 HA VAL A 98 -19.239 3.941 -15.425 1.00 24.32 H new ATOM 0 HB VAL A 98 -16.970 4.892 -15.799 1.00 64.34 H new ATOM 0 HG11 VAL A 98 -17.609 7.197 -15.161 1.00 71.52 H new ATOM 0 HG12 VAL A 98 -18.999 6.302 -15.820 1.00 71.52 H new ATOM 0 HG13 VAL A 98 -18.850 6.547 -14.063 1.00 71.52 H new ATOM 0 HG21 VAL A 98 -15.799 5.969 -13.931 1.00 50.34 H new ATOM 0 HG22 VAL A 98 -17.000 5.312 -12.794 1.00 50.34 H new ATOM 0 HG23 VAL A 98 -15.928 4.210 -13.691 1.00 50.34 H new ATOM 1383 N THR A 99 -17.445 2.157 -15.877 1.00 50.35 N ATOM 1384 CA THR A 99 -16.779 0.893 -16.079 1.00 52.21 C ATOM 1385 C THR A 99 -15.266 1.110 -16.066 1.00 64.50 C ATOM 1386 O THR A 99 -14.757 2.059 -16.673 1.00 13.33 O ATOM 1387 CB THR A 99 -17.230 0.209 -17.417 1.00 43.41 C ATOM 1388 OG1 THR A 99 -16.619 -1.087 -17.572 1.00 33.53 O ATOM 1389 CG2 THR A 99 -16.896 1.067 -18.636 1.00 45.55 C ATOM 0 H THR A 99 -17.618 2.682 -16.734 1.00 50.35 H new ATOM 0 HA THR A 99 -17.057 0.222 -15.266 1.00 52.21 H new ATOM 0 HB THR A 99 -18.312 0.095 -17.356 1.00 43.41 H new ATOM 0 HG1 THR A 99 -16.919 -1.491 -18.413 1.00 33.53 H new ATOM 0 HG21 THR A 99 -17.225 0.557 -19.541 1.00 45.55 H new ATOM 0 HG22 THR A 99 -17.405 2.027 -18.555 1.00 45.55 H new ATOM 0 HG23 THR A 99 -15.819 1.230 -18.682 1.00 45.55 H new ATOM 1397 N VAL A 100 -14.560 0.269 -15.356 1.00 52.03 N ATOM 1398 CA VAL A 100 -13.123 0.378 -15.242 1.00 44.51 C ATOM 1399 C VAL A 100 -12.469 -0.993 -15.292 1.00 42.32 C ATOM 1400 O VAL A 100 -13.135 -2.020 -15.081 1.00 25.41 O ATOM 1401 CB VAL A 100 -12.695 1.087 -13.925 1.00 55.13 C ATOM 1402 CG1 VAL A 100 -13.169 2.532 -13.884 1.00 15.52 C ATOM 1403 CG2 VAL A 100 -13.209 0.323 -12.707 1.00 51.41 C ATOM 0 H VAL A 100 -14.962 -0.513 -14.839 1.00 52.03 H new ATOM 0 HA VAL A 100 -12.791 0.979 -16.088 1.00 44.51 H new ATOM 0 HB VAL A 100 -11.605 1.094 -13.899 1.00 55.13 H new ATOM 0 HG11 VAL A 100 -12.851 2.993 -12.949 1.00 15.52 H new ATOM 0 HG12 VAL A 100 -12.740 3.080 -14.723 1.00 15.52 H new ATOM 0 HG13 VAL A 100 -14.257 2.560 -13.951 1.00 15.52 H new ATOM 0 HG21 VAL A 100 -12.898 0.837 -11.797 1.00 51.41 H new ATOM 0 HG22 VAL A 100 -14.297 0.273 -12.741 1.00 51.41 H new ATOM 0 HG23 VAL A 100 -12.799 -0.687 -12.711 1.00 51.41 H new ATOM 1413 N GLY A 101 -11.193 -1.009 -15.576 1.00 41.44 N ATOM 1414 CA GLY A 101 -10.446 -2.231 -15.585 1.00 73.24 C ATOM 1415 C GLY A 101 -9.579 -2.332 -14.359 1.00 41.34 C ATOM 1416 O GLY A 101 -8.779 -1.431 -14.087 1.00 21.35 O ATOM 0 H GLY A 101 -10.648 -0.178 -15.806 1.00 41.44 H new ATOM 0 HA2 GLY A 101 -11.128 -3.080 -15.625 1.00 73.24 H new ATOM 0 HA3 GLY A 101 -9.826 -2.278 -16.480 1.00 73.24 H new ATOM 1420 N ILE A 102 -9.740 -3.392 -13.615 1.00 14.30 N ATOM 1421 CA ILE A 102 -8.984 -3.604 -12.403 1.00 61.00 C ATOM 1422 C ILE A 102 -8.110 -4.823 -12.536 1.00 72.10 C ATOM 1423 O ILE A 102 -8.360 -5.677 -13.373 1.00 12.54 O ATOM 1424 CB ILE A 102 -9.896 -3.675 -11.114 1.00 75.04 C ATOM 1425 CG1 ILE A 102 -11.000 -4.766 -11.175 1.00 10.31 C ATOM 1426 CG2 ILE A 102 -10.517 -2.340 -10.821 1.00 20.11 C ATOM 1427 CD1 ILE A 102 -10.551 -6.189 -10.926 1.00 42.32 C ATOM 0 H ILE A 102 -10.401 -4.138 -13.830 1.00 14.30 H new ATOM 0 HA ILE A 102 -8.344 -2.733 -12.265 1.00 61.00 H new ATOM 0 HB ILE A 102 -9.224 -3.960 -10.304 1.00 75.04 H new ATOM 0 HG12 ILE A 102 -11.768 -4.517 -10.443 1.00 10.31 H new ATOM 0 HG13 ILE A 102 -11.470 -4.723 -12.158 1.00 10.31 H new ATOM 0 HG21 ILE A 102 -11.140 -2.416 -9.930 1.00 20.11 H new ATOM 0 HG22 ILE A 102 -9.732 -1.602 -10.654 1.00 20.11 H new ATOM 0 HG23 ILE A 102 -11.131 -2.031 -11.667 1.00 20.11 H new ATOM 0 HD11 ILE A 102 -11.408 -6.858 -10.995 1.00 42.32 H new ATOM 0 HD12 ILE A 102 -9.809 -6.472 -11.672 1.00 42.32 H new ATOM 0 HD13 ILE A 102 -10.112 -6.263 -9.931 1.00 42.32 H new ATOM 1439 N VAL A 103 -7.095 -4.899 -11.738 1.00 14.25 N ATOM 1440 CA VAL A 103 -6.202 -6.018 -11.762 1.00 43.24 C ATOM 1441 C VAL A 103 -6.188 -6.641 -10.394 1.00 21.03 C ATOM 1442 O VAL A 103 -5.937 -5.966 -9.405 1.00 64.23 O ATOM 1443 CB VAL A 103 -4.762 -5.605 -12.173 1.00 33.42 C ATOM 1444 CG1 VAL A 103 -3.834 -6.813 -12.240 1.00 44.14 C ATOM 1445 CG2 VAL A 103 -4.754 -4.845 -13.495 1.00 63.21 C ATOM 0 H VAL A 103 -6.859 -4.186 -11.048 1.00 14.25 H new ATOM 0 HA VAL A 103 -6.554 -6.731 -12.508 1.00 43.24 H new ATOM 0 HB VAL A 103 -4.387 -4.935 -11.399 1.00 33.42 H new ATOM 0 HG11 VAL A 103 -2.835 -6.489 -12.530 1.00 44.14 H new ATOM 0 HG12 VAL A 103 -3.790 -7.293 -11.262 1.00 44.14 H new ATOM 0 HG13 VAL A 103 -4.213 -7.523 -12.975 1.00 44.14 H new ATOM 0 HG21 VAL A 103 -3.730 -4.572 -13.751 1.00 63.21 H new ATOM 0 HG22 VAL A 103 -5.169 -5.477 -14.280 1.00 63.21 H new ATOM 0 HG23 VAL A 103 -5.357 -3.942 -13.399 1.00 63.21 H new ATOM 1455 N ARG A 104 -6.489 -7.898 -10.336 1.00 23.15 N ATOM 1456 CA ARG A 104 -6.531 -8.632 -9.100 1.00 33.52 C ATOM 1457 C ARG A 104 -5.145 -8.788 -8.532 1.00 35.34 C ATOM 1458 O ARG A 104 -4.277 -9.355 -9.167 1.00 14.13 O ATOM 1459 CB ARG A 104 -7.125 -10.016 -9.331 1.00 61.22 C ATOM 1460 CG ARG A 104 -8.583 -10.031 -9.734 1.00 33.40 C ATOM 1461 CD ARG A 104 -9.032 -11.434 -10.133 1.00 30.10 C ATOM 1462 NE ARG A 104 -8.762 -12.454 -9.099 1.00 31.25 N ATOM 1463 CZ ARG A 104 -9.482 -13.572 -8.922 1.00 23.25 C ATOM 1464 NH1 ARG A 104 -10.575 -13.788 -9.644 1.00 33.33 N ATOM 1465 NH2 ARG A 104 -9.103 -14.475 -8.023 1.00 53.31 N ATOM 0 H ARG A 104 -6.717 -8.459 -11.157 1.00 23.15 H new ATOM 0 HA ARG A 104 -7.152 -8.076 -8.397 1.00 33.52 H new ATOM 0 HB2 ARG A 104 -6.545 -10.518 -10.105 1.00 61.22 H new ATOM 0 HB3 ARG A 104 -7.011 -10.600 -8.418 1.00 61.22 H new ATOM 0 HG2 ARG A 104 -9.195 -9.672 -8.907 1.00 33.40 H new ATOM 0 HG3 ARG A 104 -8.740 -9.346 -10.567 1.00 33.40 H new ATOM 0 HD2 ARG A 104 -10.101 -11.418 -10.346 1.00 30.10 H new ATOM 0 HD3 ARG A 104 -8.527 -11.720 -11.056 1.00 30.10 H new ATOM 0 HE ARG A 104 -7.971 -12.297 -8.475 1.00 31.25 H new ATOM 0 HH11 ARG A 104 -10.872 -13.102 -10.338 1.00 33.33 H new ATOM 0 HH12 ARG A 104 -11.118 -14.640 -9.505 1.00 33.33 H new ATOM 0 HH21 ARG A 104 -8.263 -14.319 -7.466 1.00 53.31 H new ATOM 0 HH22 ARG A 104 -9.652 -15.324 -7.890 1.00 53.31 H new ATOM 1479 N GLU A 105 -4.947 -8.311 -7.330 1.00 24.32 N ATOM 1480 CA GLU A 105 -3.671 -8.462 -6.639 1.00 54.23 C ATOM 1481 C GLU A 105 -3.514 -9.907 -6.214 1.00 54.53 C ATOM 1482 O GLU A 105 -2.410 -10.410 -5.991 1.00 51.43 O ATOM 1483 CB GLU A 105 -3.623 -7.538 -5.433 1.00 52.34 C ATOM 1484 CG GLU A 105 -3.690 -6.082 -5.812 1.00 43.24 C ATOM 1485 CD GLU A 105 -3.601 -5.156 -4.636 1.00 33.13 C ATOM 1486 OE1 GLU A 105 -2.614 -5.222 -3.889 1.00 62.21 O ATOM 1487 OE2 GLU A 105 -4.478 -4.296 -4.482 1.00 33.23 O ATOM 0 H GLU A 105 -5.655 -7.808 -6.796 1.00 24.32 H new ATOM 0 HA GLU A 105 -2.851 -8.193 -7.305 1.00 54.23 H new ATOM 0 HB2 GLU A 105 -4.453 -7.774 -4.767 1.00 52.34 H new ATOM 0 HB3 GLU A 105 -2.704 -7.722 -4.876 1.00 52.34 H new ATOM 0 HG2 GLU A 105 -2.879 -5.857 -6.505 1.00 43.24 H new ATOM 0 HG3 GLU A 105 -4.624 -5.895 -6.343 1.00 43.24 H new ATOM 1494 N ASP A 106 -4.648 -10.551 -6.145 1.00 33.42 N ATOM 1495 CA ASP A 106 -4.798 -11.946 -5.801 1.00 52.10 C ATOM 1496 C ASP A 106 -4.031 -12.877 -6.757 1.00 62.35 C ATOM 1497 O ASP A 106 -3.431 -13.862 -6.317 1.00 14.50 O ATOM 1498 CB ASP A 106 -6.287 -12.273 -5.828 1.00 25.31 C ATOM 1499 CG ASP A 106 -6.598 -13.720 -5.591 1.00 3.30 C ATOM 1500 OD1 ASP A 106 -6.624 -14.148 -4.429 1.00 30.15 O ATOM 1501 OD2 ASP A 106 -6.855 -14.437 -6.567 1.00 12.41 O ATOM 0 H ASP A 106 -5.541 -10.096 -6.337 1.00 33.42 H new ATOM 0 HA ASP A 106 -4.375 -12.111 -4.810 1.00 52.10 H new ATOM 0 HB2 ASP A 106 -6.794 -11.674 -5.071 1.00 25.31 H new ATOM 0 HB3 ASP A 106 -6.696 -11.978 -6.794 1.00 25.31 H new ATOM 1506 N ASN A 107 -4.040 -12.568 -8.053 1.00 14.33 N ATOM 1507 CA ASN A 107 -3.389 -13.457 -9.031 1.00 51.01 C ATOM 1508 C ASN A 107 -2.778 -12.701 -10.233 1.00 23.24 C ATOM 1509 O ASN A 107 -2.314 -13.325 -11.180 1.00 45.15 O ATOM 1510 CB ASN A 107 -4.384 -14.524 -9.521 1.00 74.04 C ATOM 1511 CG ASN A 107 -5.540 -13.959 -10.326 1.00 33.54 C ATOM 1512 OD1 ASN A 107 -5.935 -12.804 -10.148 1.00 13.43 O ATOM 1513 ND2 ASN A 107 -6.097 -14.761 -11.189 1.00 12.33 N ATOM 0 H ASN A 107 -4.476 -11.735 -8.448 1.00 14.33 H new ATOM 0 HA ASN A 107 -2.558 -13.936 -8.513 1.00 51.01 H new ATOM 0 HB2 ASN A 107 -3.850 -15.252 -10.131 1.00 74.04 H new ATOM 0 HB3 ASN A 107 -4.781 -15.060 -8.659 1.00 74.04 H new ATOM 0 HD21 ASN A 107 -6.889 -14.440 -11.746 1.00 12.33 H new ATOM 0 HD22 ASN A 107 -5.741 -15.710 -11.307 1.00 12.33 H new ATOM 1520 N SER A 108 -2.800 -11.364 -10.180 1.00 14.23 N ATOM 1521 CA SER A 108 -2.209 -10.471 -11.206 1.00 62.14 C ATOM 1522 C SER A 108 -3.046 -10.442 -12.518 1.00 70.41 C ATOM 1523 O SER A 108 -2.613 -9.903 -13.549 1.00 24.12 O ATOM 1524 CB SER A 108 -0.709 -10.829 -11.461 1.00 33.34 C ATOM 1525 OG SER A 108 -0.067 -9.904 -12.340 1.00 71.33 O ATOM 0 H SER A 108 -3.236 -10.854 -9.411 1.00 14.23 H new ATOM 0 HA SER A 108 -2.238 -9.455 -10.813 1.00 62.14 H new ATOM 0 HB2 SER A 108 -0.177 -10.850 -10.510 1.00 33.34 H new ATOM 0 HB3 SER A 108 -0.645 -11.831 -11.884 1.00 33.34 H new ATOM 0 HG SER A 108 -0.698 -9.619 -13.033 1.00 71.33 H new ATOM 1531 N GLU A 109 -4.251 -10.973 -12.468 1.00 31.21 N ATOM 1532 CA GLU A 109 -5.109 -10.983 -13.642 1.00 14.41 C ATOM 1533 C GLU A 109 -6.082 -9.821 -13.631 1.00 73.14 C ATOM 1534 O GLU A 109 -6.507 -9.363 -12.573 1.00 34.32 O ATOM 1535 CB GLU A 109 -5.832 -12.305 -13.776 1.00 13.15 C ATOM 1536 CG GLU A 109 -4.898 -13.471 -14.046 1.00 51.12 C ATOM 1537 CD GLU A 109 -4.147 -13.301 -15.348 1.00 24.13 C ATOM 1538 OE1 GLU A 109 -4.745 -13.523 -16.416 1.00 24.22 O ATOM 1539 OE2 GLU A 109 -2.950 -12.943 -15.334 1.00 64.50 O ATOM 0 H GLU A 109 -4.658 -11.400 -11.636 1.00 31.21 H new ATOM 0 HA GLU A 109 -4.470 -10.862 -14.517 1.00 14.41 H new ATOM 0 HB2 GLU A 109 -6.392 -12.500 -12.861 1.00 13.15 H new ATOM 0 HB3 GLU A 109 -6.558 -12.234 -14.586 1.00 13.15 H new ATOM 0 HG2 GLU A 109 -4.186 -13.564 -13.226 1.00 51.12 H new ATOM 0 HG3 GLU A 109 -5.472 -14.397 -14.076 1.00 51.12 H new ATOM 1546 N LYS A 110 -6.431 -9.356 -14.802 1.00 30.12 N ATOM 1547 CA LYS A 110 -7.282 -8.196 -14.945 1.00 4.33 C ATOM 1548 C LYS A 110 -8.736 -8.557 -15.148 1.00 62.44 C ATOM 1549 O LYS A 110 -9.068 -9.617 -15.685 1.00 23.35 O ATOM 1550 CB LYS A 110 -6.771 -7.205 -16.017 1.00 51.30 C ATOM 1551 CG LYS A 110 -6.615 -7.749 -17.431 1.00 50.50 C ATOM 1552 CD LYS A 110 -7.932 -8.054 -18.121 1.00 64.23 C ATOM 1553 CE LYS A 110 -7.709 -8.653 -19.490 1.00 20.03 C ATOM 1554 NZ LYS A 110 -8.983 -8.956 -20.171 1.00 64.20 N ATOM 0 H LYS A 110 -6.135 -9.769 -15.686 1.00 30.12 H new ATOM 0 HA LYS A 110 -7.226 -7.672 -13.991 1.00 4.33 H new ATOM 0 HB2 LYS A 110 -7.456 -6.358 -16.052 1.00 51.30 H new ATOM 0 HB3 LYS A 110 -5.804 -6.820 -15.692 1.00 51.30 H new ATOM 0 HG2 LYS A 110 -6.062 -7.025 -18.029 1.00 50.50 H new ATOM 0 HG3 LYS A 110 -6.015 -8.658 -17.396 1.00 50.50 H new ATOM 0 HD2 LYS A 110 -8.514 -8.744 -17.510 1.00 64.23 H new ATOM 0 HD3 LYS A 110 -8.517 -7.139 -18.213 1.00 64.23 H new ATOM 0 HE2 LYS A 110 -7.127 -7.961 -20.099 1.00 20.03 H new ATOM 0 HE3 LYS A 110 -7.121 -9.566 -19.396 1.00 20.03 H new ATOM 0 HZ1 LYS A 110 -8.788 -9.365 -21.107 1.00 64.20 H new ATOM 0 HZ2 LYS A 110 -9.527 -9.636 -19.603 1.00 64.20 H new ATOM 0 HZ3 LYS A 110 -9.533 -8.081 -20.284 1.00 64.20 H new ATOM 1568 N MET A 111 -9.573 -7.696 -14.698 1.00 21.35 N ATOM 1569 CA MET A 111 -11.020 -7.838 -14.784 1.00 64.05 C ATOM 1570 C MET A 111 -11.652 -6.512 -15.033 1.00 44.33 C ATOM 1571 O MET A 111 -11.054 -5.469 -14.789 1.00 72.55 O ATOM 1572 CB MET A 111 -11.625 -8.434 -13.511 1.00 41.51 C ATOM 1573 CG MET A 111 -11.271 -9.870 -13.275 1.00 24.31 C ATOM 1574 SD MET A 111 -11.872 -10.514 -11.694 1.00 43.13 S ATOM 1575 CE MET A 111 -13.637 -10.299 -11.889 1.00 20.40 C ATOM 0 H MET A 111 -9.281 -6.833 -14.239 1.00 21.35 H new ATOM 0 HA MET A 111 -11.219 -8.521 -15.610 1.00 64.05 H new ATOM 0 HB2 MET A 111 -11.295 -7.845 -12.655 1.00 41.51 H new ATOM 0 HB3 MET A 111 -12.710 -8.343 -13.561 1.00 41.51 H new ATOM 0 HG2 MET A 111 -11.682 -10.474 -14.084 1.00 24.31 H new ATOM 0 HG3 MET A 111 -10.187 -9.980 -13.314 1.00 24.31 H new ATOM 0 HE1 MET A 111 -14.158 -11.146 -11.443 1.00 20.40 H new ATOM 0 HE2 MET A 111 -13.949 -9.380 -11.393 1.00 20.40 H new ATOM 0 HE3 MET A 111 -13.881 -10.240 -12.950 1.00 20.40 H new ATOM 1585 N ALA A 112 -12.842 -6.550 -15.505 1.00 54.13 N ATOM 1586 CA ALA A 112 -13.602 -5.346 -15.756 1.00 51.15 C ATOM 1587 C ALA A 112 -14.682 -5.228 -14.711 1.00 13.52 C ATOM 1588 O ALA A 112 -15.398 -6.193 -14.453 1.00 33.10 O ATOM 1589 CB ALA A 112 -14.208 -5.363 -17.148 1.00 54.54 C ATOM 0 H ALA A 112 -13.334 -7.413 -15.735 1.00 54.13 H new ATOM 0 HA ALA A 112 -12.938 -4.484 -15.700 1.00 51.15 H new ATOM 0 HB1 ALA A 112 -14.774 -4.446 -17.310 1.00 54.54 H new ATOM 0 HB2 ALA A 112 -13.413 -5.434 -17.890 1.00 54.54 H new ATOM 0 HB3 ALA A 112 -14.873 -6.221 -17.245 1.00 54.54 H new ATOM 1595 N VAL A 113 -14.793 -4.077 -14.101 1.00 44.30 N ATOM 1596 CA VAL A 113 -15.769 -3.864 -13.039 1.00 71.31 C ATOM 1597 C VAL A 113 -16.359 -2.468 -13.130 1.00 45.12 C ATOM 1598 O VAL A 113 -15.940 -1.655 -13.961 1.00 60.24 O ATOM 1599 CB VAL A 113 -15.146 -4.044 -11.615 1.00 60.21 C ATOM 1600 CG1 VAL A 113 -14.621 -5.452 -11.393 1.00 11.43 C ATOM 1601 CG2 VAL A 113 -14.046 -3.032 -11.385 1.00 55.03 C ATOM 0 H VAL A 113 -14.220 -3.261 -14.316 1.00 44.30 H new ATOM 0 HA VAL A 113 -16.545 -4.617 -13.178 1.00 71.31 H new ATOM 0 HB VAL A 113 -15.944 -3.875 -10.892 1.00 60.21 H new ATOM 0 HG11 VAL A 113 -14.198 -5.529 -10.391 1.00 11.43 H new ATOM 0 HG12 VAL A 113 -15.438 -6.166 -11.498 1.00 11.43 H new ATOM 0 HG13 VAL A 113 -13.849 -5.673 -12.130 1.00 11.43 H new ATOM 0 HG21 VAL A 113 -13.625 -3.173 -10.390 1.00 55.03 H new ATOM 0 HG22 VAL A 113 -13.264 -3.168 -12.132 1.00 55.03 H new ATOM 0 HG23 VAL A 113 -14.455 -2.025 -11.467 1.00 55.03 H new ATOM 1611 N LYS A 114 -17.337 -2.203 -12.303 1.00 53.41 N ATOM 1612 CA LYS A 114 -17.928 -0.885 -12.215 1.00 32.30 C ATOM 1613 C LYS A 114 -17.415 -0.211 -10.949 1.00 55.25 C ATOM 1614 O LYS A 114 -17.153 -0.887 -9.956 1.00 1.20 O ATOM 1615 CB LYS A 114 -19.484 -0.939 -12.167 1.00 35.31 C ATOM 1616 CG LYS A 114 -20.211 -1.492 -13.417 1.00 64.23 C ATOM 1617 CD LYS A 114 -19.938 -2.973 -13.667 1.00 61.31 C ATOM 1618 CE LYS A 114 -20.739 -3.506 -14.851 1.00 64.54 C ATOM 1619 NZ LYS A 114 -20.434 -2.804 -16.113 1.00 15.24 N ATOM 0 H LYS A 114 -17.748 -2.890 -11.671 1.00 53.41 H new ATOM 0 HA LYS A 114 -17.646 -0.325 -13.107 1.00 32.30 H new ATOM 0 HB2 LYS A 114 -19.775 -1.547 -11.310 1.00 35.31 H new ATOM 0 HB3 LYS A 114 -19.852 0.070 -11.981 1.00 35.31 H new ATOM 0 HG2 LYS A 114 -21.284 -1.342 -13.301 1.00 64.23 H new ATOM 0 HG3 LYS A 114 -19.902 -0.920 -14.292 1.00 64.23 H new ATOM 0 HD2 LYS A 114 -18.874 -3.120 -13.853 1.00 61.31 H new ATOM 0 HD3 LYS A 114 -20.188 -3.544 -12.773 1.00 61.31 H new ATOM 0 HE2 LYS A 114 -20.533 -4.569 -14.974 1.00 64.54 H new ATOM 0 HE3 LYS A 114 -21.803 -3.410 -14.636 1.00 64.54 H new ATOM 0 HZ1 LYS A 114 -20.915 -3.282 -16.901 1.00 15.24 H new ATOM 0 HZ2 LYS A 114 -20.765 -1.820 -16.051 1.00 15.24 H new ATOM 0 HZ3 LYS A 114 -19.407 -2.815 -16.277 1.00 15.24 H new ATOM 1633 N THR A 115 -17.246 1.084 -10.983 1.00 71.22 N ATOM 1634 CA THR A 115 -16.829 1.813 -9.809 1.00 50.51 C ATOM 1635 C THR A 115 -17.421 3.219 -9.866 1.00 64.42 C ATOM 1636 O THR A 115 -18.030 3.603 -10.879 1.00 72.35 O ATOM 1637 CB THR A 115 -15.277 1.873 -9.640 1.00 72.22 C ATOM 1638 OG1 THR A 115 -14.948 2.329 -8.314 1.00 34.33 O ATOM 1639 CG2 THR A 115 -14.655 2.834 -10.644 1.00 11.21 C ATOM 0 H THR A 115 -17.391 1.660 -11.812 1.00 71.22 H new ATOM 0 HA THR A 115 -17.202 1.278 -8.935 1.00 50.51 H new ATOM 0 HB THR A 115 -14.884 0.870 -9.809 1.00 72.22 H new ATOM 0 HG1 THR A 115 -15.177 1.633 -7.663 1.00 34.33 H new ATOM 0 HG21 THR A 115 -13.574 2.857 -10.504 1.00 11.21 H new ATOM 0 HG22 THR A 115 -14.883 2.501 -11.656 1.00 11.21 H new ATOM 0 HG23 THR A 115 -15.062 3.834 -10.491 1.00 11.21 H new ATOM 1647 N TYR A 116 -17.263 3.960 -8.802 1.00 73.04 N ATOM 1648 CA TYR A 116 -17.822 5.279 -8.689 1.00 1.52 C ATOM 1649 C TYR A 116 -16.713 6.299 -8.537 1.00 70.25 C ATOM 1650 O TYR A 116 -15.972 6.293 -7.551 1.00 23.20 O ATOM 1651 CB TYR A 116 -18.797 5.337 -7.505 1.00 65.44 C ATOM 1652 CG TYR A 116 -19.942 4.360 -7.644 1.00 12.43 C ATOM 1653 CD1 TYR A 116 -19.808 3.039 -7.227 1.00 30.21 C ATOM 1654 CD2 TYR A 116 -21.146 4.747 -8.213 1.00 74.22 C ATOM 1655 CE1 TYR A 116 -20.834 2.137 -7.379 1.00 13.42 C ATOM 1656 CE2 TYR A 116 -22.180 3.849 -8.362 1.00 4.00 C ATOM 1657 CZ TYR A 116 -22.016 2.544 -7.947 1.00 62.15 C ATOM 1658 OH TYR A 116 -23.036 1.643 -8.108 1.00 63.13 O ATOM 0 H TYR A 116 -16.737 3.661 -7.981 1.00 73.04 H new ATOM 0 HA TYR A 116 -18.378 5.515 -9.596 1.00 1.52 H new ATOM 0 HB2 TYR A 116 -18.255 5.127 -6.583 1.00 65.44 H new ATOM 0 HB3 TYR A 116 -19.196 6.348 -7.417 1.00 65.44 H new ATOM 0 HD1 TYR A 116 -18.881 2.717 -6.776 1.00 30.21 H new ATOM 0 HD2 TYR A 116 -21.275 5.767 -8.544 1.00 74.22 H new ATOM 0 HE1 TYR A 116 -20.711 1.115 -7.054 1.00 13.42 H new ATOM 0 HE2 TYR A 116 -23.114 4.165 -8.802 1.00 4.00 H new ATOM 0 HH TYR A 116 -22.755 0.767 -7.769 1.00 63.13 H new ATOM 1668 N MET A 117 -16.576 7.142 -9.524 1.00 54.14 N ATOM 1669 CA MET A 117 -15.553 8.179 -9.501 1.00 34.11 C ATOM 1670 C MET A 117 -16.174 9.539 -9.312 1.00 4.02 C ATOM 1671 O MET A 117 -17.366 9.735 -9.595 1.00 31.45 O ATOM 1672 CB MET A 117 -14.636 8.173 -10.745 1.00 33.34 C ATOM 1673 CG MET A 117 -15.342 8.419 -12.040 1.00 60.33 C ATOM 1674 SD MET A 117 -14.245 8.504 -13.458 1.00 32.22 S ATOM 1675 CE MET A 117 -15.462 8.632 -14.767 1.00 33.53 C ATOM 0 H MET A 117 -17.157 7.140 -10.362 1.00 54.14 H new ATOM 0 HA MET A 117 -14.914 7.950 -8.648 1.00 34.11 H new ATOM 0 HB2 MET A 117 -13.866 8.933 -10.616 1.00 33.34 H new ATOM 0 HB3 MET A 117 -14.127 7.210 -10.801 1.00 33.34 H new ATOM 0 HG2 MET A 117 -16.070 7.624 -12.203 1.00 60.33 H new ATOM 0 HG3 MET A 117 -15.900 9.353 -11.967 1.00 60.33 H new ATOM 0 HE1 MET A 117 -15.485 7.702 -15.334 1.00 33.53 H new ATOM 0 HE2 MET A 117 -16.445 8.817 -14.333 1.00 33.53 H new ATOM 0 HE3 MET A 117 -15.197 9.455 -15.431 1.00 33.53 H new ATOM 1685 N TRP A 118 -15.383 10.454 -8.804 1.00 70.22 N ATOM 1686 CA TRP A 118 -15.799 11.807 -8.564 1.00 72.34 C ATOM 1687 C TRP A 118 -16.017 12.465 -9.917 1.00 41.25 C ATOM 1688 O TRP A 118 -15.140 12.415 -10.782 1.00 5.02 O ATOM 1689 CB TRP A 118 -14.713 12.531 -7.767 1.00 65.51 C ATOM 1690 CG TRP A 118 -15.120 13.857 -7.232 1.00 40.41 C ATOM 1691 CD1 TRP A 118 -14.621 15.074 -7.563 1.00 35.53 C ATOM 1692 CD2 TRP A 118 -16.129 14.085 -6.263 1.00 70.50 C ATOM 1693 NE1 TRP A 118 -15.254 16.046 -6.842 1.00 74.04 N ATOM 1694 CE2 TRP A 118 -16.189 15.461 -6.036 1.00 65.12 C ATOM 1695 CE3 TRP A 118 -16.986 13.248 -5.566 1.00 33.45 C ATOM 1696 CZ2 TRP A 118 -17.077 16.022 -5.128 1.00 0.04 C ATOM 1697 CZ3 TRP A 118 -17.865 13.794 -4.676 1.00 11.32 C ATOM 1698 CH2 TRP A 118 -17.910 15.172 -4.457 1.00 41.31 C ATOM 0 H TRP A 118 -14.414 10.271 -8.542 1.00 70.22 H new ATOM 0 HA TRP A 118 -16.722 11.846 -7.986 1.00 72.34 H new ATOM 0 HB2 TRP A 118 -14.407 11.896 -6.935 1.00 65.51 H new ATOM 0 HB3 TRP A 118 -13.839 12.664 -8.405 1.00 65.51 H new ATOM 0 HD1 TRP A 118 -13.840 15.248 -8.288 1.00 35.53 H new ATOM 0 HE1 TRP A 118 -15.060 17.046 -6.896 1.00 74.04 H new ATOM 0 HE3 TRP A 118 -16.959 12.180 -5.725 1.00 33.45 H new ATOM 0 HZ2 TRP A 118 -17.108 17.088 -4.959 1.00 0.04 H new ATOM 0 HZ3 TRP A 118 -18.538 13.148 -4.131 1.00 11.32 H new ATOM 0 HH2 TRP A 118 -18.616 15.573 -3.745 1.00 41.31 H new ATOM 1709 N ILE A 119 -17.162 13.074 -10.093 1.00 13.43 N ATOM 1710 CA ILE A 119 -17.579 13.557 -11.410 1.00 15.30 C ATOM 1711 C ILE A 119 -16.801 14.779 -11.857 1.00 62.20 C ATOM 1712 O ILE A 119 -16.450 14.912 -13.033 1.00 32.15 O ATOM 1713 CB ILE A 119 -19.098 13.857 -11.454 1.00 33.33 C ATOM 1714 CG1 ILE A 119 -19.883 12.648 -10.944 1.00 62.10 C ATOM 1715 CG2 ILE A 119 -19.531 14.201 -12.874 1.00 54.13 C ATOM 1716 CD1 ILE A 119 -19.590 11.376 -11.694 1.00 3.11 C ATOM 0 H ILE A 119 -17.833 13.254 -9.346 1.00 13.43 H new ATOM 0 HA ILE A 119 -17.359 12.748 -12.107 1.00 15.30 H new ATOM 0 HB ILE A 119 -19.305 14.713 -10.811 1.00 33.33 H new ATOM 0 HG12 ILE A 119 -19.656 12.498 -9.889 1.00 62.10 H new ATOM 0 HG13 ILE A 119 -20.949 12.863 -11.013 1.00 62.10 H new ATOM 0 HG21 ILE A 119 -20.601 14.409 -12.888 1.00 54.13 H new ATOM 0 HG22 ILE A 119 -18.986 15.080 -13.218 1.00 54.13 H new ATOM 0 HG23 ILE A 119 -19.316 13.360 -13.534 1.00 54.13 H new ATOM 0 HD11 ILE A 119 -20.183 10.562 -11.276 1.00 3.11 H new ATOM 0 HD12 ILE A 119 -19.844 11.507 -12.746 1.00 3.11 H new ATOM 0 HD13 ILE A 119 -18.531 11.136 -11.604 1.00 3.11 H new ATOM 1728 N ASN A 120 -16.521 15.655 -10.937 1.00 23.51 N ATOM 1729 CA ASN A 120 -15.818 16.880 -11.270 1.00 4.43 C ATOM 1730 C ASN A 120 -14.330 16.621 -11.488 1.00 41.35 C ATOM 1731 O ASN A 120 -13.731 17.177 -12.397 1.00 70.52 O ATOM 1732 CB ASN A 120 -16.010 17.922 -10.165 1.00 32.53 C ATOM 1733 CG ASN A 120 -15.341 19.256 -10.472 1.00 35.44 C ATOM 1734 OD1 ASN A 120 -15.245 19.675 -11.621 1.00 40.03 O ATOM 1735 ND2 ASN A 120 -14.863 19.917 -9.461 1.00 73.11 N ATOM 0 H ASN A 120 -16.763 15.554 -9.951 1.00 23.51 H new ATOM 0 HA ASN A 120 -16.238 17.263 -12.200 1.00 4.43 H new ATOM 0 HB2 ASN A 120 -17.077 18.085 -10.011 1.00 32.53 H new ATOM 0 HB3 ASN A 120 -15.609 17.529 -9.231 1.00 32.53 H new ATOM 0 HD21 ASN A 120 -14.393 20.810 -9.612 1.00 73.11 H new ATOM 0 HD22 ASN A 120 -14.958 19.543 -8.517 1.00 73.11 H new ATOM 1742 N LYS A 121 -13.770 15.718 -10.675 1.00 51.30 N ATOM 1743 CA LYS A 121 -12.326 15.432 -10.626 1.00 70.11 C ATOM 1744 C LYS A 121 -11.443 16.660 -10.790 1.00 61.23 C ATOM 1745 O LYS A 121 -10.731 16.804 -11.785 1.00 72.41 O ATOM 1746 CB LYS A 121 -11.827 14.214 -11.460 1.00 41.22 C ATOM 1747 CG LYS A 121 -12.152 14.180 -12.953 1.00 75.41 C ATOM 1748 CD LYS A 121 -13.573 13.747 -13.239 1.00 62.45 C ATOM 1749 CE LYS A 121 -13.816 13.560 -14.732 1.00 21.53 C ATOM 1750 NZ LYS A 121 -13.583 14.796 -15.505 1.00 31.44 N ATOM 0 H LYS A 121 -14.314 15.155 -10.021 1.00 51.30 H new ATOM 0 HA LYS A 121 -12.204 15.097 -9.596 1.00 70.11 H new ATOM 0 HB2 LYS A 121 -10.744 14.159 -11.354 1.00 41.22 H new ATOM 0 HB3 LYS A 121 -12.238 13.311 -11.009 1.00 41.22 H new ATOM 0 HG2 LYS A 121 -11.987 15.170 -13.378 1.00 75.41 H new ATOM 0 HG3 LYS A 121 -11.463 13.500 -13.454 1.00 75.41 H new ATOM 0 HD2 LYS A 121 -13.781 12.813 -12.717 1.00 62.45 H new ATOM 0 HD3 LYS A 121 -14.266 14.492 -12.848 1.00 62.45 H new ATOM 0 HE2 LYS A 121 -13.162 12.773 -15.107 1.00 21.53 H new ATOM 0 HE3 LYS A 121 -14.841 13.225 -14.890 1.00 21.53 H new ATOM 0 HZ1 LYS A 121 -13.859 14.643 -16.496 1.00 31.44 H new ATOM 0 HZ2 LYS A 121 -14.151 15.569 -15.103 1.00 31.44 H new ATOM 0 HZ3 LYS A 121 -12.575 15.048 -15.462 1.00 31.44 H new ATOM 1764 N ALA A 122 -11.528 17.558 -9.825 1.00 72.03 N ATOM 1765 CA ALA A 122 -10.781 18.811 -9.872 1.00 24.44 C ATOM 1766 C ALA A 122 -10.743 19.480 -8.507 1.00 34.12 C ATOM 1767 O ALA A 122 -9.819 20.234 -8.209 1.00 11.41 O ATOM 1768 CB ALA A 122 -11.393 19.757 -10.898 1.00 12.23 C ATOM 0 H ALA A 122 -12.109 17.446 -8.994 1.00 72.03 H new ATOM 0 HA ALA A 122 -9.758 18.578 -10.167 1.00 24.44 H new ATOM 0 HB1 ALA A 122 -10.824 20.687 -10.921 1.00 12.23 H new ATOM 0 HB2 ALA A 122 -11.367 19.292 -11.883 1.00 12.23 H new ATOM 0 HB3 ALA A 122 -12.426 19.971 -10.625 1.00 12.23 H new ATOM 1774 N ASP A 123 -11.757 19.201 -7.686 1.00 13.44 N ATOM 1775 CA ASP A 123 -11.874 19.775 -6.333 1.00 32.22 C ATOM 1776 C ASP A 123 -10.625 19.547 -5.509 1.00 61.11 C ATOM 1777 O ASP A 123 -10.067 18.439 -5.497 1.00 32.04 O ATOM 1778 CB ASP A 123 -13.054 19.161 -5.572 1.00 52.41 C ATOM 1779 CG ASP A 123 -14.375 19.410 -6.220 1.00 23.23 C ATOM 1780 OD1 ASP A 123 -14.750 18.638 -7.112 1.00 12.22 O ATOM 1781 OD2 ASP A 123 -15.069 20.369 -5.843 1.00 34.43 O ATOM 0 H ASP A 123 -12.521 18.573 -7.934 1.00 13.44 H new ATOM 0 HA ASP A 123 -12.027 20.845 -6.473 1.00 32.22 H new ATOM 0 HB2 ASP A 123 -12.899 18.086 -5.483 1.00 52.41 H new ATOM 0 HB3 ASP A 123 -13.073 19.565 -4.560 1.00 52.41 H new ATOM 1786 N PRO A 124 -10.169 20.578 -4.789 1.00 62.02 N ATOM 1787 CA PRO A 124 -9.020 20.468 -3.901 1.00 5.45 C ATOM 1788 C PRO A 124 -9.424 19.829 -2.572 1.00 5.14 C ATOM 1789 O PRO A 124 -8.597 19.610 -1.689 1.00 14.13 O ATOM 1790 CB PRO A 124 -8.599 21.919 -3.691 1.00 71.44 C ATOM 1791 CG PRO A 124 -9.863 22.698 -3.810 1.00 21.25 C ATOM 1792 CD PRO A 124 -10.726 21.957 -4.799 1.00 24.31 C ATOM 0 HA PRO A 124 -8.224 19.844 -4.308 1.00 5.45 H new ATOM 0 HB2 PRO A 124 -8.137 22.060 -2.714 1.00 71.44 H new ATOM 0 HB3 PRO A 124 -7.869 22.232 -4.437 1.00 71.44 H new ATOM 0 HG2 PRO A 124 -10.361 22.780 -2.844 1.00 21.25 H new ATOM 0 HG3 PRO A 124 -9.663 23.713 -4.153 1.00 21.25 H new ATOM 0 HD2 PRO A 124 -11.775 21.967 -4.502 1.00 24.31 H new ATOM 0 HD3 PRO A 124 -10.671 22.404 -5.792 1.00 24.31 H new ATOM 1800 N ASP A 125 -10.717 19.539 -2.441 1.00 55.32 N ATOM 1801 CA ASP A 125 -11.249 18.901 -1.248 1.00 23.30 C ATOM 1802 C ASP A 125 -10.678 17.524 -1.077 1.00 74.21 C ATOM 1803 O ASP A 125 -10.241 17.163 0.005 1.00 24.03 O ATOM 1804 CB ASP A 125 -12.783 18.823 -1.257 1.00 73.02 C ATOM 1805 CG ASP A 125 -13.469 20.162 -1.168 1.00 70.11 C ATOM 1806 OD1 ASP A 125 -13.759 20.763 -2.214 1.00 43.22 O ATOM 1807 OD2 ASP A 125 -13.772 20.616 -0.044 1.00 4.41 O ATOM 0 H ASP A 125 -11.417 19.739 -3.155 1.00 55.32 H new ATOM 0 HA ASP A 125 -10.951 19.526 -0.406 1.00 23.30 H new ATOM 0 HB2 ASP A 125 -13.105 18.322 -2.170 1.00 73.02 H new ATOM 0 HB3 ASP A 125 -13.109 18.204 -0.422 1.00 73.02 H new ATOM 1812 N MET A 126 -10.645 16.765 -2.158 1.00 3.32 N ATOM 1813 CA MET A 126 -10.151 15.390 -2.113 1.00 30.22 C ATOM 1814 C MET A 126 -8.631 15.365 -2.033 1.00 13.24 C ATOM 1815 O MET A 126 -8.042 14.367 -1.645 1.00 52.30 O ATOM 1816 CB MET A 126 -10.621 14.626 -3.356 1.00 32.24 C ATOM 1817 CG MET A 126 -10.138 15.241 -4.654 1.00 72.50 C ATOM 1818 SD MET A 126 -10.757 14.430 -6.125 1.00 30.12 S ATOM 1819 CE MET A 126 -10.013 15.476 -7.353 1.00 3.12 C ATOM 0 H MET A 126 -10.953 17.073 -3.080 1.00 3.32 H new ATOM 0 HA MET A 126 -10.551 14.909 -1.221 1.00 30.22 H new ATOM 0 HB2 MET A 126 -10.268 13.596 -3.296 1.00 32.24 H new ATOM 0 HB3 MET A 126 -11.710 14.590 -3.362 1.00 32.24 H new ATOM 0 HG2 MET A 126 -10.435 16.290 -4.679 1.00 72.50 H new ATOM 0 HG3 MET A 126 -9.048 15.217 -4.671 1.00 72.50 H new ATOM 0 HE1 MET A 126 -10.793 15.946 -7.952 1.00 3.12 H new ATOM 0 HE2 MET A 126 -9.418 16.247 -6.863 1.00 3.12 H new ATOM 0 HE3 MET A 126 -9.370 14.878 -7.999 1.00 3.12 H new ATOM 1829 N PHE A 127 -8.013 16.484 -2.383 1.00 32.50 N ATOM 1830 CA PHE A 127 -6.570 16.585 -2.432 1.00 63.51 C ATOM 1831 C PHE A 127 -5.966 16.362 -1.050 1.00 73.32 C ATOM 1832 O PHE A 127 -6.103 17.195 -0.139 1.00 61.15 O ATOM 1833 CB PHE A 127 -6.142 17.940 -3.019 1.00 0.14 C ATOM 1834 CG PHE A 127 -4.655 18.100 -3.187 1.00 64.32 C ATOM 1835 CD1 PHE A 127 -3.997 17.480 -4.233 1.00 45.44 C ATOM 1836 CD2 PHE A 127 -3.920 18.861 -2.297 1.00 74.43 C ATOM 1837 CE1 PHE A 127 -2.635 17.617 -4.389 1.00 74.43 C ATOM 1838 CE2 PHE A 127 -2.559 19.001 -2.447 1.00 53.43 C ATOM 1839 CZ PHE A 127 -1.914 18.379 -3.495 1.00 53.01 C ATOM 0 H PHE A 127 -8.500 17.343 -2.639 1.00 32.50 H new ATOM 0 HA PHE A 127 -6.191 15.802 -3.089 1.00 63.51 H new ATOM 0 HB2 PHE A 127 -6.622 18.070 -3.989 1.00 0.14 H new ATOM 0 HB3 PHE A 127 -6.511 18.736 -2.372 1.00 0.14 H new ATOM 0 HD1 PHE A 127 -4.557 16.881 -4.936 1.00 45.44 H new ATOM 0 HD2 PHE A 127 -4.420 19.351 -1.475 1.00 74.43 H new ATOM 0 HE1 PHE A 127 -2.133 17.128 -5.211 1.00 74.43 H new ATOM 0 HE2 PHE A 127 -1.997 19.598 -1.744 1.00 53.43 H new ATOM 0 HZ PHE A 127 -0.846 18.489 -3.615 1.00 53.01 H new ATOM 1849 N GLY A 128 -5.344 15.230 -0.893 1.00 72.54 N ATOM 1850 CA GLY A 128 -4.733 14.888 0.335 1.00 4.31 C ATOM 1851 C GLY A 128 -4.221 13.482 0.308 1.00 11.44 C ATOM 1852 O GLY A 128 -4.915 12.567 -0.170 1.00 20.25 O ATOM 0 H GLY A 128 -5.252 14.523 -1.622 1.00 72.54 H new ATOM 0 HA2 GLY A 128 -3.911 15.574 0.539 1.00 4.31 H new ATOM 0 HA3 GLY A 128 -5.452 15.001 1.147 1.00 4.31 H new ATOM 1856 N GLU A 129 -3.026 13.296 0.794 1.00 42.52 N ATOM 1857 CA GLU A 129 -2.410 12.002 0.836 1.00 65.44 C ATOM 1858 C GLU A 129 -2.150 11.569 2.269 1.00 70.31 C ATOM 1859 O GLU A 129 -1.863 12.389 3.137 1.00 64.23 O ATOM 1860 CB GLU A 129 -1.118 11.971 -0.006 1.00 0.31 C ATOM 1861 CG GLU A 129 -0.120 13.062 0.340 1.00 31.23 C ATOM 1862 CD GLU A 129 1.163 12.960 -0.452 1.00 40.34 C ATOM 1863 OE1 GLU A 129 1.158 13.253 -1.667 1.00 13.10 O ATOM 1864 OE2 GLU A 129 2.208 12.604 0.129 1.00 35.12 O ATOM 0 H GLU A 129 -2.448 14.045 1.175 1.00 42.52 H new ATOM 0 HA GLU A 129 -3.104 11.286 0.395 1.00 65.44 H new ATOM 0 HB2 GLU A 129 -0.637 11.001 0.123 1.00 0.31 H new ATOM 0 HB3 GLU A 129 -1.383 12.058 -1.060 1.00 0.31 H new ATOM 0 HG2 GLU A 129 -0.576 14.035 0.159 1.00 31.23 H new ATOM 0 HG3 GLU A 129 0.111 13.012 1.404 1.00 31.23 H new ATOM 1871 N TRP A 130 -2.298 10.288 2.509 1.00 63.42 N ATOM 1872 CA TRP A 130 -2.031 9.698 3.803 1.00 70.24 C ATOM 1873 C TRP A 130 -0.722 8.950 3.773 1.00 4.44 C ATOM 1874 O TRP A 130 -0.274 8.507 2.705 1.00 23.10 O ATOM 1875 CB TRP A 130 -3.154 8.767 4.267 1.00 22.12 C ATOM 1876 CG TRP A 130 -4.354 9.450 4.884 1.00 55.31 C ATOM 1877 CD1 TRP A 130 -4.841 10.706 4.631 1.00 52.32 C ATOM 1878 CD2 TRP A 130 -5.225 8.881 5.859 1.00 3.43 C ATOM 1879 NE1 TRP A 130 -5.968 10.934 5.380 1.00 64.20 N ATOM 1880 CE2 TRP A 130 -6.218 9.834 6.151 1.00 41.30 C ATOM 1881 CE3 TRP A 130 -5.260 7.653 6.510 1.00 11.11 C ATOM 1882 CZ2 TRP A 130 -7.233 9.591 7.070 1.00 64.34 C ATOM 1883 CZ3 TRP A 130 -6.258 7.410 7.419 1.00 11.13 C ATOM 1884 CH2 TRP A 130 -7.237 8.375 7.695 1.00 75.54 C ATOM 0 H TRP A 130 -2.610 9.618 1.806 1.00 63.42 H new ATOM 0 HA TRP A 130 -1.972 10.516 4.521 1.00 70.24 H new ATOM 0 HB2 TRP A 130 -3.492 8.180 3.413 1.00 22.12 H new ATOM 0 HB3 TRP A 130 -2.744 8.066 4.994 1.00 22.12 H new ATOM 0 HD1 TRP A 130 -4.402 11.413 3.943 1.00 52.32 H new ATOM 0 HE1 TRP A 130 -6.528 11.786 5.364 1.00 64.20 H new ATOM 0 HE3 TRP A 130 -4.512 6.902 6.303 1.00 11.11 H new ATOM 0 HZ2 TRP A 130 -7.988 10.333 7.282 1.00 64.34 H new ATOM 0 HZ3 TRP A 130 -6.290 6.459 7.931 1.00 11.13 H new ATOM 0 HH2 TRP A 130 -8.010 8.153 8.416 1.00 75.54 H new ATOM 1895 N ASN A 131 -0.135 8.787 4.937 1.00 71.44 N ATOM 1896 CA ASN A 131 1.170 8.145 5.114 1.00 30.11 C ATOM 1897 C ASN A 131 1.196 6.713 4.565 1.00 42.54 C ATOM 1898 O ASN A 131 2.230 6.243 4.086 1.00 44.51 O ATOM 1899 CB ASN A 131 1.572 8.178 6.596 1.00 32.23 C ATOM 1900 CG ASN A 131 2.918 7.535 6.885 1.00 40.12 C ATOM 1901 OD1 ASN A 131 3.001 6.343 7.184 1.00 52.42 O ATOM 1902 ND2 ASN A 131 3.968 8.305 6.807 1.00 43.23 N ATOM 0 H ASN A 131 -0.552 9.100 5.813 1.00 71.44 H new ATOM 0 HA ASN A 131 1.900 8.710 4.534 1.00 30.11 H new ATOM 0 HB2 ASN A 131 1.596 9.214 6.932 1.00 32.23 H new ATOM 0 HB3 ASN A 131 0.805 7.671 7.181 1.00 32.23 H new ATOM 0 HD21 ASN A 131 4.895 7.924 6.996 1.00 43.23 H new ATOM 0 HD22 ASN A 131 3.862 9.288 6.556 1.00 43.23 H new ATOM 1909 N PHE A 132 0.056 6.036 4.611 1.00 5.20 N ATOM 1910 CA PHE A 132 -0.051 4.670 4.099 1.00 44.21 C ATOM 1911 C PHE A 132 0.234 4.624 2.593 1.00 52.01 C ATOM 1912 O PHE A 132 1.037 3.812 2.123 1.00 33.01 O ATOM 1913 CB PHE A 132 -1.432 4.077 4.417 1.00 63.35 C ATOM 1914 CG PHE A 132 -1.718 3.996 5.895 1.00 21.15 C ATOM 1915 CD1 PHE A 132 -1.191 2.965 6.657 1.00 15.11 C ATOM 1916 CD2 PHE A 132 -2.513 4.948 6.523 1.00 71.54 C ATOM 1917 CE1 PHE A 132 -1.443 2.886 8.012 1.00 14.01 C ATOM 1918 CE2 PHE A 132 -2.771 4.873 7.877 1.00 42.42 C ATOM 1919 CZ PHE A 132 -2.234 3.840 8.622 1.00 61.24 C ATOM 0 H PHE A 132 -0.811 6.409 4.998 1.00 5.20 H new ATOM 0 HA PHE A 132 0.702 4.061 4.599 1.00 44.21 H new ATOM 0 HB2 PHE A 132 -2.200 4.684 3.938 1.00 63.35 H new ATOM 0 HB3 PHE A 132 -1.500 3.078 3.985 1.00 63.35 H new ATOM 0 HD1 PHE A 132 -0.575 2.214 6.185 1.00 15.11 H new ATOM 0 HD2 PHE A 132 -2.934 5.757 5.944 1.00 71.54 H new ATOM 0 HE1 PHE A 132 -1.022 2.079 8.594 1.00 14.01 H new ATOM 0 HE2 PHE A 132 -3.390 5.619 8.353 1.00 42.42 H new ATOM 0 HZ PHE A 132 -2.433 3.779 9.682 1.00 61.24 H new ATOM 1929 N GLU A 133 -0.393 5.530 1.859 1.00 50.33 N ATOM 1930 CA GLU A 133 -0.203 5.634 0.410 1.00 3.52 C ATOM 1931 C GLU A 133 1.151 6.252 0.113 1.00 2.24 C ATOM 1932 O GLU A 133 1.777 5.940 -0.893 1.00 50.22 O ATOM 1933 CB GLU A 133 -1.298 6.498 -0.194 1.00 71.32 C ATOM 1934 CG GLU A 133 -2.693 5.955 0.013 1.00 11.55 C ATOM 1935 CD GLU A 133 -3.054 4.743 -0.843 1.00 4.43 C ATOM 1936 OE1 GLU A 133 -2.416 3.694 -0.712 1.00 12.33 O ATOM 1937 OE2 GLU A 133 -4.060 4.831 -1.629 1.00 40.44 O ATOM 0 H GLU A 133 -1.046 6.213 2.243 1.00 50.33 H new ATOM 0 HA GLU A 133 -0.249 4.636 -0.027 1.00 3.52 H new ATOM 0 HB2 GLU A 133 -1.240 7.496 0.240 1.00 71.32 H new ATOM 0 HB3 GLU A 133 -1.115 6.604 -1.263 1.00 71.32 H new ATOM 0 HG2 GLU A 133 -2.808 5.685 1.063 1.00 11.55 H new ATOM 0 HG3 GLU A 133 -3.409 6.751 -0.192 1.00 11.55 H new ATOM 1944 N GLU A 134 1.590 7.143 1.003 1.00 5.34 N ATOM 1945 CA GLU A 134 2.884 7.788 0.881 1.00 44.41 C ATOM 1946 C GLU A 134 3.993 6.758 0.866 1.00 64.33 C ATOM 1947 O GLU A 134 4.799 6.728 -0.065 1.00 51.12 O ATOM 1948 CB GLU A 134 3.107 8.791 2.014 1.00 3.43 C ATOM 1949 CG GLU A 134 4.483 9.436 1.995 1.00 23.23 C ATOM 1950 CD GLU A 134 4.657 10.461 3.070 1.00 64.10 C ATOM 1951 OE1 GLU A 134 4.934 10.092 4.220 1.00 22.32 O ATOM 1952 OE2 GLU A 134 4.533 11.658 2.775 1.00 21.21 O ATOM 0 H GLU A 134 1.056 7.432 1.823 1.00 5.34 H new ATOM 0 HA GLU A 134 2.899 8.332 -0.063 1.00 44.41 H new ATOM 0 HB2 GLU A 134 2.349 9.571 1.951 1.00 3.43 H new ATOM 0 HB3 GLU A 134 2.966 8.285 2.969 1.00 3.43 H new ATOM 0 HG2 GLU A 134 5.243 8.663 2.110 1.00 23.23 H new ATOM 0 HG3 GLU A 134 4.647 9.903 1.024 1.00 23.23 H new ATOM 1959 N TRP A 135 4.023 5.897 1.872 1.00 24.22 N ATOM 1960 CA TRP A 135 5.036 4.878 1.912 1.00 2.23 C ATOM 1961 C TRP A 135 4.871 3.903 0.770 1.00 12.14 C ATOM 1962 O TRP A 135 5.850 3.519 0.150 1.00 64.04 O ATOM 1963 CB TRP A 135 5.120 4.153 3.260 1.00 64.32 C ATOM 1964 CG TRP A 135 6.142 3.051 3.241 1.00 75.41 C ATOM 1965 CD1 TRP A 135 5.914 1.718 3.409 1.00 33.23 C ATOM 1966 CD2 TRP A 135 7.547 3.189 2.977 1.00 72.25 C ATOM 1967 NE1 TRP A 135 7.089 1.022 3.284 1.00 4.33 N ATOM 1968 CE2 TRP A 135 8.106 1.901 3.021 1.00 23.45 C ATOM 1969 CE3 TRP A 135 8.385 4.278 2.718 1.00 63.34 C ATOM 1970 CZ2 TRP A 135 9.459 1.668 2.809 1.00 52.12 C ATOM 1971 CZ3 TRP A 135 9.728 4.047 2.507 1.00 21.25 C ATOM 1972 CH2 TRP A 135 10.253 2.754 2.553 1.00 13.24 C ATOM 0 H TRP A 135 3.367 5.890 2.653 1.00 24.22 H new ATOM 0 HA TRP A 135 5.990 5.392 1.792 1.00 2.23 H new ATOM 0 HB2 TRP A 135 5.373 4.869 4.042 1.00 64.32 H new ATOM 0 HB3 TRP A 135 4.144 3.738 3.511 1.00 64.32 H new ATOM 0 HD1 TRP A 135 4.950 1.275 3.611 1.00 33.23 H new ATOM 0 HE1 TRP A 135 7.190 0.011 3.373 1.00 4.33 H new ATOM 0 HE3 TRP A 135 7.988 5.282 2.684 1.00 63.34 H new ATOM 0 HZ2 TRP A 135 9.869 0.669 2.845 1.00 52.12 H new ATOM 0 HZ3 TRP A 135 10.385 4.880 2.303 1.00 21.25 H new ATOM 0 HH2 TRP A 135 11.309 2.607 2.383 1.00 13.24 H new ATOM 1983 N LYS A 136 3.628 3.531 0.469 1.00 23.51 N ATOM 1984 CA LYS A 136 3.364 2.635 -0.648 1.00 14.11 C ATOM 1985 C LYS A 136 3.957 3.209 -1.938 1.00 31.43 C ATOM 1986 O LYS A 136 4.553 2.489 -2.735 1.00 21.03 O ATOM 1987 CB LYS A 136 1.862 2.380 -0.822 1.00 24.45 C ATOM 1988 CG LYS A 136 1.538 1.489 -2.010 1.00 4.13 C ATOM 1989 CD LYS A 136 2.145 0.103 -1.857 1.00 14.03 C ATOM 1990 CE LYS A 136 1.985 -0.709 -3.127 1.00 61.31 C ATOM 1991 NZ LYS A 136 0.582 -0.821 -3.544 1.00 1.40 N ATOM 0 H LYS A 136 2.798 3.834 0.979 1.00 23.51 H new ATOM 0 HA LYS A 136 3.841 1.679 -0.429 1.00 14.11 H new ATOM 0 HB2 LYS A 136 1.471 1.920 0.086 1.00 24.45 H new ATOM 0 HB3 LYS A 136 1.350 3.335 -0.942 1.00 24.45 H new ATOM 0 HG2 LYS A 136 0.457 1.403 -2.116 1.00 4.13 H new ATOM 0 HG3 LYS A 136 1.912 1.951 -2.924 1.00 4.13 H new ATOM 0 HD2 LYS A 136 3.203 0.192 -1.610 1.00 14.03 H new ATOM 0 HD3 LYS A 136 1.666 -0.417 -1.027 1.00 14.03 H new ATOM 0 HE2 LYS A 136 2.563 -0.246 -3.927 1.00 61.31 H new ATOM 0 HE3 LYS A 136 2.396 -1.706 -2.972 1.00 61.31 H new ATOM 0 HZ1 LYS A 136 0.487 -1.589 -4.239 1.00 1.40 H new ATOM 0 HZ2 LYS A 136 -0.011 -1.028 -2.715 1.00 1.40 H new ATOM 0 HZ3 LYS A 136 0.275 0.075 -3.974 1.00 1.40 H new ATOM 2005 N ARG A 137 3.802 4.504 -2.114 1.00 51.23 N ATOM 2006 CA ARG A 137 4.342 5.215 -3.244 1.00 11.12 C ATOM 2007 C ARG A 137 5.861 5.103 -3.315 1.00 72.12 C ATOM 2008 O ARG A 137 6.401 4.707 -4.337 1.00 71.14 O ATOM 2009 CB ARG A 137 3.933 6.663 -3.155 1.00 62.44 C ATOM 2010 CG ARG A 137 4.596 7.543 -4.162 1.00 61.24 C ATOM 2011 CD ARG A 137 4.071 8.948 -4.049 1.00 1.44 C ATOM 2012 NE ARG A 137 4.368 9.539 -2.737 1.00 15.24 N ATOM 2013 CZ ARG A 137 3.652 10.511 -2.152 1.00 10.32 C ATOM 2014 NH1 ARG A 137 2.584 11.020 -2.754 1.00 75.35 N ATOM 2015 NH2 ARG A 137 4.006 10.974 -0.972 1.00 33.30 N ATOM 0 H ARG A 137 3.288 5.098 -1.463 1.00 51.23 H new ATOM 0 HA ARG A 137 3.943 4.766 -4.153 1.00 11.12 H new ATOM 0 HB2 ARG A 137 2.853 6.733 -3.281 1.00 62.44 H new ATOM 0 HB3 ARG A 137 4.162 7.034 -2.156 1.00 62.44 H new ATOM 0 HG2 ARG A 137 5.675 7.537 -4.007 1.00 61.24 H new ATOM 0 HG3 ARG A 137 4.416 7.159 -5.166 1.00 61.24 H new ATOM 0 HD2 ARG A 137 4.511 9.564 -4.833 1.00 1.44 H new ATOM 0 HD3 ARG A 137 2.993 8.947 -4.211 1.00 1.44 H new ATOM 0 HE ARG A 137 5.180 9.183 -2.233 1.00 15.24 H new ATOM 0 HH11 ARG A 137 2.301 10.672 -3.670 1.00 75.35 H new ATOM 0 HH12 ARG A 137 2.047 11.759 -2.300 1.00 75.35 H new ATOM 0 HH21 ARG A 137 4.826 10.594 -0.500 1.00 33.30 H new ATOM 0 HH22 ARG A 137 3.460 11.713 -0.529 1.00 33.30 H new ATOM 2029 N LEU A 138 6.538 5.418 -2.224 1.00 21.41 N ATOM 2030 CA LEU A 138 7.998 5.355 -2.189 1.00 40.44 C ATOM 2031 C LEU A 138 8.506 3.919 -2.209 1.00 33.33 C ATOM 2032 O LEU A 138 9.660 3.655 -2.562 1.00 14.11 O ATOM 2033 CB LEU A 138 8.585 6.135 -0.996 1.00 53.02 C ATOM 2034 CG LEU A 138 8.607 7.683 -1.076 1.00 25.13 C ATOM 2035 CD1 LEU A 138 9.360 8.154 -2.299 1.00 21.13 C ATOM 2036 CD2 LEU A 138 7.222 8.293 -1.032 1.00 65.15 C ATOM 0 H LEU A 138 6.106 5.720 -1.351 1.00 21.41 H new ATOM 0 HA LEU A 138 8.349 5.841 -3.099 1.00 40.44 H new ATOM 0 HB2 LEU A 138 8.023 5.855 -0.105 1.00 53.02 H new ATOM 0 HB3 LEU A 138 9.609 5.794 -0.846 1.00 53.02 H new ATOM 0 HG LEU A 138 9.133 8.030 -0.187 1.00 25.13 H new ATOM 0 HD11 LEU A 138 9.359 9.244 -2.329 1.00 21.13 H new ATOM 0 HD12 LEU A 138 10.387 7.793 -2.255 1.00 21.13 H new ATOM 0 HD13 LEU A 138 8.877 7.766 -3.196 1.00 21.13 H new ATOM 0 HD21 LEU A 138 7.300 9.379 -1.091 1.00 65.15 H new ATOM 0 HD22 LEU A 138 6.635 7.925 -1.874 1.00 65.15 H new ATOM 0 HD23 LEU A 138 6.732 8.015 -0.099 1.00 65.15 H new ATOM 2048 N HIS A 139 7.648 3.006 -1.843 1.00 12.30 N ATOM 2049 CA HIS A 139 7.984 1.596 -1.857 1.00 30.53 C ATOM 2050 C HIS A 139 7.842 1.066 -3.279 1.00 72.33 C ATOM 2051 O HIS A 139 8.668 0.296 -3.746 1.00 15.53 O ATOM 2052 CB HIS A 139 7.069 0.817 -0.892 1.00 73.21 C ATOM 2053 CG HIS A 139 7.394 -0.644 -0.761 1.00 65.14 C ATOM 2054 ND1 HIS A 139 6.708 -1.631 -1.424 1.00 43.44 N ATOM 2055 CD2 HIS A 139 8.321 -1.278 -0.015 1.00 3.02 C ATOM 2056 CE1 HIS A 139 7.197 -2.804 -1.094 1.00 1.12 C ATOM 2057 NE2 HIS A 139 8.178 -2.620 -0.242 1.00 62.20 N ATOM 0 H HIS A 139 6.700 3.210 -1.527 1.00 12.30 H new ATOM 0 HA HIS A 139 9.013 1.462 -1.524 1.00 30.53 H new ATOM 0 HB2 HIS A 139 7.127 1.278 0.094 1.00 73.21 H new ATOM 0 HB3 HIS A 139 6.038 0.917 -1.230 1.00 73.21 H new ATOM 0 HD2 HIS A 139 9.043 -0.813 0.640 1.00 3.02 H new ATOM 0 HE1 HIS A 139 6.851 -3.759 -1.462 1.00 1.12 H new ATOM 0 HE2 HIS A 139 8.742 -3.357 0.182 1.00 62.20 H new ATOM 2066 N LYS A 140 6.799 1.514 -3.974 1.00 2.34 N ATOM 2067 CA LYS A 140 6.592 1.138 -5.362 1.00 74.31 C ATOM 2068 C LYS A 140 7.645 1.779 -6.225 1.00 72.33 C ATOM 2069 O LYS A 140 8.175 1.157 -7.136 1.00 60.52 O ATOM 2070 CB LYS A 140 5.194 1.549 -5.869 1.00 0.10 C ATOM 2071 CG LYS A 140 4.973 1.198 -7.343 1.00 64.01 C ATOM 2072 CD LYS A 140 3.624 1.642 -7.886 1.00 42.13 C ATOM 2073 CE LYS A 140 3.437 3.151 -7.798 1.00 13.10 C ATOM 2074 NZ LYS A 140 2.222 3.588 -8.501 1.00 22.10 N ATOM 0 H LYS A 140 6.086 2.138 -3.595 1.00 2.34 H new ATOM 0 HA LYS A 140 6.665 0.052 -5.423 1.00 74.31 H new ATOM 0 HB2 LYS A 140 4.433 1.055 -5.264 1.00 0.10 H new ATOM 0 HB3 LYS A 140 5.063 2.622 -5.732 1.00 0.10 H new ATOM 0 HG2 LYS A 140 5.762 1.657 -7.938 1.00 64.01 H new ATOM 0 HG3 LYS A 140 5.067 0.119 -7.468 1.00 64.01 H new ATOM 0 HD2 LYS A 140 3.531 1.326 -8.925 1.00 42.13 H new ATOM 0 HD3 LYS A 140 2.829 1.146 -7.329 1.00 42.13 H new ATOM 0 HE2 LYS A 140 3.380 3.451 -6.752 1.00 13.10 H new ATOM 0 HE3 LYS A 140 4.306 3.651 -8.226 1.00 13.10 H new ATOM 0 HZ1 LYS A 140 2.476 4.279 -9.236 1.00 22.10 H new ATOM 0 HZ2 LYS A 140 1.762 2.766 -8.942 1.00 22.10 H new ATOM 0 HZ3 LYS A 140 1.568 4.028 -7.823 1.00 22.10 H new ATOM 2088 N LYS A 141 7.954 3.023 -5.900 1.00 42.32 N ATOM 2089 CA LYS A 141 8.903 3.852 -6.628 1.00 62.43 C ATOM 2090 C LYS A 141 10.261 3.160 -6.782 1.00 64.35 C ATOM 2091 O LYS A 141 10.955 3.357 -7.777 1.00 31.04 O ATOM 2092 CB LYS A 141 9.047 5.198 -5.910 1.00 44.10 C ATOM 2093 CG LYS A 141 9.880 6.233 -6.634 1.00 42.31 C ATOM 2094 CD LYS A 141 9.890 7.531 -5.853 1.00 20.32 C ATOM 2095 CE LYS A 141 10.665 8.609 -6.571 1.00 54.11 C ATOM 2096 NZ LYS A 141 10.648 9.886 -5.824 1.00 34.44 N ATOM 0 H LYS A 141 7.540 3.499 -5.099 1.00 42.32 H new ATOM 0 HA LYS A 141 8.522 4.018 -7.636 1.00 62.43 H new ATOM 0 HB2 LYS A 141 8.052 5.610 -5.742 1.00 44.10 H new ATOM 0 HB3 LYS A 141 9.489 5.022 -4.929 1.00 44.10 H new ATOM 0 HG2 LYS A 141 10.899 5.868 -6.760 1.00 42.31 H new ATOM 0 HG3 LYS A 141 9.476 6.403 -7.632 1.00 42.31 H new ATOM 0 HD2 LYS A 141 8.865 7.866 -5.691 1.00 20.32 H new ATOM 0 HD3 LYS A 141 10.329 7.361 -4.870 1.00 20.32 H new ATOM 0 HE2 LYS A 141 11.696 8.284 -6.712 1.00 54.11 H new ATOM 0 HE3 LYS A 141 10.241 8.762 -7.563 1.00 54.11 H new ATOM 0 HZ1 LYS A 141 11.190 10.602 -6.348 1.00 34.44 H new ATOM 0 HZ2 LYS A 141 9.666 10.209 -5.712 1.00 34.44 H new ATOM 0 HZ3 LYS A 141 11.076 9.745 -4.886 1.00 34.44 H new ATOM 2110 N LYS A 142 10.615 2.333 -5.807 1.00 65.51 N ATOM 2111 CA LYS A 142 11.865 1.609 -5.848 1.00 13.22 C ATOM 2112 C LYS A 142 11.854 0.602 -7.028 1.00 70.41 C ATOM 2113 O LYS A 142 12.857 0.422 -7.718 1.00 52.21 O ATOM 2114 CB LYS A 142 12.106 0.872 -4.522 1.00 20.34 C ATOM 2115 CG LYS A 142 13.488 0.256 -4.419 1.00 34.14 C ATOM 2116 CD LYS A 142 14.561 1.341 -4.351 1.00 73.23 C ATOM 2117 CE LYS A 142 15.953 0.761 -4.462 1.00 1.22 C ATOM 2118 NZ LYS A 142 16.160 0.127 -5.777 1.00 71.53 N ATOM 0 H LYS A 142 10.048 2.151 -4.979 1.00 65.51 H new ATOM 0 HA LYS A 142 12.676 2.321 -5.997 1.00 13.22 H new ATOM 0 HB2 LYS A 142 11.964 1.569 -3.696 1.00 20.34 H new ATOM 0 HB3 LYS A 142 11.357 0.088 -4.409 1.00 20.34 H new ATOM 0 HG2 LYS A 142 13.545 -0.374 -3.532 1.00 34.14 H new ATOM 0 HG3 LYS A 142 13.669 -0.388 -5.280 1.00 34.14 H new ATOM 0 HD2 LYS A 142 14.402 2.061 -5.154 1.00 73.23 H new ATOM 0 HD3 LYS A 142 14.468 1.886 -3.412 1.00 73.23 H new ATOM 0 HE2 LYS A 142 16.692 1.549 -4.314 1.00 1.22 H new ATOM 0 HE3 LYS A 142 16.108 0.026 -3.672 1.00 1.22 H new ATOM 0 HZ1 LYS A 142 17.178 0.089 -5.988 1.00 71.53 H new ATOM 0 HZ2 LYS A 142 15.773 -0.838 -5.762 1.00 71.53 H new ATOM 0 HZ3 LYS A 142 15.675 0.682 -6.510 1.00 71.53 H new ATOM 2132 N PHE A 143 10.706 -0.034 -7.250 1.00 31.55 N ATOM 2133 CA PHE A 143 10.534 -0.973 -8.368 1.00 42.04 C ATOM 2134 C PHE A 143 10.363 -0.191 -9.658 1.00 62.03 C ATOM 2135 O PHE A 143 10.779 -0.619 -10.727 1.00 52.01 O ATOM 2136 CB PHE A 143 9.295 -1.861 -8.173 1.00 34.31 C ATOM 2137 CG PHE A 143 9.298 -2.691 -6.925 1.00 63.05 C ATOM 2138 CD1 PHE A 143 9.958 -3.905 -6.881 1.00 33.31 C ATOM 2139 CD2 PHE A 143 8.626 -2.259 -5.800 1.00 53.34 C ATOM 2140 CE1 PHE A 143 9.948 -4.673 -5.734 1.00 45.10 C ATOM 2141 CE2 PHE A 143 8.609 -3.019 -4.649 1.00 22.03 C ATOM 2142 CZ PHE A 143 9.271 -4.230 -4.616 1.00 74.31 C ATOM 0 H PHE A 143 9.875 0.081 -6.670 1.00 31.55 H new ATOM 0 HA PHE A 143 11.419 -1.608 -8.410 1.00 42.04 H new ATOM 0 HB2 PHE A 143 8.409 -1.226 -8.166 1.00 34.31 H new ATOM 0 HB3 PHE A 143 9.204 -2.525 -9.032 1.00 34.31 H new ATOM 0 HD1 PHE A 143 10.488 -4.257 -7.754 1.00 33.31 H new ATOM 0 HD2 PHE A 143 8.106 -1.313 -5.821 1.00 53.34 H new ATOM 0 HE1 PHE A 143 10.469 -5.619 -5.712 1.00 45.10 H new ATOM 0 HE2 PHE A 143 8.079 -2.668 -3.776 1.00 22.03 H new ATOM 0 HZ PHE A 143 9.259 -4.829 -3.718 1.00 74.31 H new ATOM 2152 N ILE A 144 9.744 0.964 -9.527 1.00 71.03 N ATOM 2153 CA ILE A 144 9.471 1.857 -10.641 1.00 74.32 C ATOM 2154 C ILE A 144 10.746 2.273 -11.353 1.00 40.13 C ATOM 2155 O ILE A 144 10.725 2.490 -12.538 1.00 13.05 O ATOM 2156 CB ILE A 144 8.611 3.098 -10.229 1.00 15.23 C ATOM 2157 CG1 ILE A 144 7.279 2.643 -9.645 1.00 12.13 C ATOM 2158 CG2 ILE A 144 8.356 4.039 -11.398 1.00 53.34 C ATOM 2159 CD1 ILE A 144 6.450 1.758 -10.570 1.00 12.34 C ATOM 0 H ILE A 144 9.410 1.317 -8.630 1.00 71.03 H new ATOM 0 HA ILE A 144 8.868 1.287 -11.348 1.00 74.32 H new ATOM 0 HB ILE A 144 9.181 3.646 -9.479 1.00 15.23 H new ATOM 0 HG12 ILE A 144 7.469 2.100 -8.719 1.00 12.13 H new ATOM 0 HG13 ILE A 144 6.692 3.523 -9.384 1.00 12.13 H new ATOM 0 HG21 ILE A 144 7.755 4.884 -11.061 1.00 53.34 H new ATOM 0 HG22 ILE A 144 9.307 4.402 -11.787 1.00 53.34 H new ATOM 0 HG23 ILE A 144 7.822 3.506 -12.185 1.00 53.34 H new ATOM 0 HD11 ILE A 144 5.520 1.482 -10.073 1.00 12.34 H new ATOM 0 HD12 ILE A 144 6.224 2.302 -11.487 1.00 12.34 H new ATOM 0 HD13 ILE A 144 7.013 0.857 -10.812 1.00 12.34 H new ATOM 2171 N GLU A 145 11.857 2.365 -10.619 1.00 33.53 N ATOM 2172 CA GLU A 145 13.140 2.781 -11.201 1.00 34.01 C ATOM 2173 C GLU A 145 13.492 1.984 -12.464 1.00 23.50 C ATOM 2174 O GLU A 145 13.912 2.571 -13.466 1.00 11.02 O ATOM 2175 CB GLU A 145 14.279 2.612 -10.220 1.00 32.53 C ATOM 2176 CG GLU A 145 14.163 3.386 -8.938 1.00 14.24 C ATOM 2177 CD GLU A 145 15.410 3.235 -8.126 1.00 63.45 C ATOM 2178 OE1 GLU A 145 15.558 2.216 -7.417 1.00 35.03 O ATOM 2179 OE2 GLU A 145 16.300 4.113 -8.233 1.00 14.04 O ATOM 0 H GLU A 145 11.897 2.158 -9.621 1.00 33.53 H new ATOM 0 HA GLU A 145 13.015 3.833 -11.456 1.00 34.01 H new ATOM 0 HB2 GLU A 145 14.368 1.553 -9.976 1.00 32.53 H new ATOM 0 HB3 GLU A 145 15.205 2.904 -10.715 1.00 32.53 H new ATOM 0 HG2 GLU A 145 13.988 4.440 -9.156 1.00 14.24 H new ATOM 0 HG3 GLU A 145 13.304 3.032 -8.368 1.00 14.24 H new ATOM 2186 N THR A 146 13.314 0.666 -12.428 1.00 71.33 N ATOM 2187 CA THR A 146 13.621 -0.141 -13.586 1.00 3.45 C ATOM 2188 C THR A 146 12.616 0.150 -14.722 1.00 21.34 C ATOM 2189 O THR A 146 13.004 0.305 -15.877 1.00 23.10 O ATOM 2190 CB THR A 146 13.723 -1.676 -13.255 1.00 14.41 C ATOM 2191 OG1 THR A 146 14.148 -2.414 -14.406 1.00 64.23 O ATOM 2192 CG2 THR A 146 12.406 -2.245 -12.768 1.00 63.52 C ATOM 0 H THR A 146 12.965 0.149 -11.621 1.00 71.33 H new ATOM 0 HA THR A 146 14.615 0.143 -13.930 1.00 3.45 H new ATOM 0 HB THR A 146 14.458 -1.773 -12.456 1.00 14.41 H new ATOM 0 HG1 THR A 146 14.207 -3.366 -14.181 1.00 64.23 H new ATOM 0 HG21 THR A 146 12.526 -3.307 -12.552 1.00 63.52 H new ATOM 0 HG22 THR A 146 12.097 -1.723 -11.862 1.00 63.52 H new ATOM 0 HG23 THR A 146 11.646 -2.115 -13.539 1.00 63.52 H new ATOM 2200 N PHE A 147 11.338 0.305 -14.369 1.00 63.52 N ATOM 2201 CA PHE A 147 10.302 0.616 -15.348 1.00 32.41 C ATOM 2202 C PHE A 147 10.421 2.001 -15.903 1.00 43.24 C ATOM 2203 O PHE A 147 10.039 2.248 -17.037 1.00 14.52 O ATOM 2204 CB PHE A 147 8.899 0.316 -14.847 1.00 3.01 C ATOM 2205 CG PHE A 147 8.613 -1.140 -14.849 1.00 44.24 C ATOM 2206 CD1 PHE A 147 8.429 -1.780 -16.053 1.00 41.45 C ATOM 2207 CD2 PHE A 147 8.551 -1.876 -13.679 1.00 51.00 C ATOM 2208 CE1 PHE A 147 8.184 -3.117 -16.117 1.00 12.23 C ATOM 2209 CE2 PHE A 147 8.303 -3.237 -13.726 1.00 20.23 C ATOM 2210 CZ PHE A 147 8.119 -3.861 -14.952 1.00 3.04 C ATOM 0 H PHE A 147 10.999 0.220 -13.411 1.00 63.52 H new ATOM 0 HA PHE A 147 10.479 -0.065 -16.181 1.00 32.41 H new ATOM 0 HB2 PHE A 147 8.782 0.708 -13.837 1.00 3.01 H new ATOM 0 HB3 PHE A 147 8.171 0.830 -15.475 1.00 3.01 H new ATOM 0 HD1 PHE A 147 8.480 -1.208 -16.968 1.00 41.45 H new ATOM 0 HD2 PHE A 147 8.696 -1.387 -12.727 1.00 51.00 H new ATOM 0 HE1 PHE A 147 8.041 -3.596 -17.074 1.00 12.23 H new ATOM 0 HE2 PHE A 147 8.253 -3.811 -12.812 1.00 20.23 H new ATOM 0 HZ PHE A 147 7.926 -4.923 -14.997 1.00 3.04 H new ATOM 2220 N LYS A 148 10.941 2.899 -15.105 1.00 72.45 N ATOM 2221 CA LYS A 148 11.215 4.246 -15.525 1.00 33.13 C ATOM 2222 C LYS A 148 12.195 4.200 -16.690 1.00 35.34 C ATOM 2223 O LYS A 148 12.010 4.855 -17.692 1.00 3.34 O ATOM 2224 CB LYS A 148 11.812 5.047 -14.362 1.00 12.14 C ATOM 2225 CG LYS A 148 12.113 6.506 -14.687 1.00 61.53 C ATOM 2226 CD LYS A 148 12.773 7.232 -13.514 1.00 24.23 C ATOM 2227 CE LYS A 148 14.097 6.577 -13.128 1.00 72.42 C ATOM 2228 NZ LYS A 148 14.820 7.333 -12.082 1.00 30.34 N ATOM 0 H LYS A 148 11.188 2.711 -14.134 1.00 72.45 H new ATOM 0 HA LYS A 148 10.292 4.734 -15.838 1.00 33.13 H new ATOM 0 HB2 LYS A 148 11.121 5.011 -13.520 1.00 12.14 H new ATOM 0 HB3 LYS A 148 12.733 4.562 -14.039 1.00 12.14 H new ATOM 0 HG2 LYS A 148 12.767 6.556 -15.558 1.00 61.53 H new ATOM 0 HG3 LYS A 148 11.187 7.016 -14.954 1.00 61.53 H new ATOM 0 HD2 LYS A 148 12.945 8.275 -13.780 1.00 24.23 H new ATOM 0 HD3 LYS A 148 12.100 7.229 -12.657 1.00 24.23 H new ATOM 0 HE2 LYS A 148 13.908 5.564 -12.774 1.00 72.42 H new ATOM 0 HE3 LYS A 148 14.728 6.493 -14.013 1.00 72.42 H new ATOM 0 HZ1 LYS A 148 15.711 6.847 -11.856 1.00 30.34 H new ATOM 0 HZ2 LYS A 148 15.026 8.292 -12.427 1.00 30.34 H new ATOM 0 HZ3 LYS A 148 14.231 7.392 -11.227 1.00 30.34 H new ATOM 2242 N LYS A 149 13.202 3.352 -16.562 1.00 64.23 N ATOM 2243 CA LYS A 149 14.226 3.207 -17.585 1.00 54.23 C ATOM 2244 C LYS A 149 13.656 2.475 -18.806 1.00 1.35 C ATOM 2245 O LYS A 149 14.100 2.678 -19.944 1.00 34.43 O ATOM 2246 CB LYS A 149 15.440 2.470 -17.016 1.00 1.13 C ATOM 2247 CG LYS A 149 16.092 3.188 -15.835 1.00 34.02 C ATOM 2248 CD LYS A 149 17.272 2.403 -15.279 1.00 54.31 C ATOM 2249 CE LYS A 149 17.932 3.127 -14.106 1.00 45.11 C ATOM 2250 NZ LYS A 149 18.532 4.425 -14.502 1.00 11.13 N ATOM 0 H LYS A 149 13.333 2.747 -15.751 1.00 64.23 H new ATOM 0 HA LYS A 149 14.551 4.197 -17.906 1.00 54.23 H new ATOM 0 HB2 LYS A 149 15.134 1.473 -16.700 1.00 1.13 H new ATOM 0 HB3 LYS A 149 16.180 2.341 -17.806 1.00 1.13 H new ATOM 0 HG2 LYS A 149 16.428 4.176 -16.151 1.00 34.02 H new ATOM 0 HG3 LYS A 149 15.353 3.339 -15.048 1.00 34.02 H new ATOM 0 HD2 LYS A 149 16.934 1.419 -14.955 1.00 54.31 H new ATOM 0 HD3 LYS A 149 18.007 2.244 -16.068 1.00 54.31 H new ATOM 0 HE2 LYS A 149 17.191 3.297 -13.325 1.00 45.11 H new ATOM 0 HE3 LYS A 149 18.705 2.489 -13.678 1.00 45.11 H new ATOM 0 HZ1 LYS A 149 19.109 4.794 -13.719 1.00 11.13 H new ATOM 0 HZ2 LYS A 149 19.133 4.289 -15.340 1.00 11.13 H new ATOM 0 HZ3 LYS A 149 17.776 5.103 -14.725 1.00 11.13 H new ATOM 2264 N ILE A 150 12.673 1.632 -18.561 1.00 44.45 N ATOM 2265 CA ILE A 150 11.994 0.910 -19.622 1.00 75.15 C ATOM 2266 C ILE A 150 11.062 1.858 -20.407 1.00 33.14 C ATOM 2267 O ILE A 150 11.045 1.845 -21.639 1.00 53.23 O ATOM 2268 CB ILE A 150 11.202 -0.325 -19.060 1.00 2.21 C ATOM 2269 CG1 ILE A 150 12.182 -1.291 -18.392 1.00 72.44 C ATOM 2270 CG2 ILE A 150 10.431 -1.036 -20.170 1.00 63.01 C ATOM 2271 CD1 ILE A 150 11.527 -2.464 -17.710 1.00 35.11 C ATOM 0 H ILE A 150 12.322 1.428 -17.625 1.00 44.45 H new ATOM 0 HA ILE A 150 12.750 0.526 -20.307 1.00 75.15 H new ATOM 0 HB ILE A 150 10.477 0.027 -18.326 1.00 2.21 H new ATOM 0 HG12 ILE A 150 12.876 -1.664 -19.145 1.00 72.44 H new ATOM 0 HG13 ILE A 150 12.772 -0.742 -17.658 1.00 72.44 H new ATOM 0 HG21 ILE A 150 9.893 -1.886 -19.752 1.00 63.01 H new ATOM 0 HG22 ILE A 150 9.721 -0.343 -20.621 1.00 63.01 H new ATOM 0 HG23 ILE A 150 11.129 -1.387 -20.930 1.00 63.01 H new ATOM 0 HD11 ILE A 150 12.292 -3.099 -17.263 1.00 35.11 H new ATOM 0 HD12 ILE A 150 10.854 -2.103 -16.932 1.00 35.11 H new ATOM 0 HD13 ILE A 150 10.960 -3.040 -18.441 1.00 35.11 H new ATOM 2283 N MET A 151 10.328 2.709 -19.694 1.00 44.32 N ATOM 2284 CA MET A 151 9.408 3.643 -20.345 1.00 51.25 C ATOM 2285 C MET A 151 10.158 4.741 -21.090 1.00 34.13 C ATOM 2286 O MET A 151 9.674 5.237 -22.085 1.00 42.23 O ATOM 2287 CB MET A 151 8.374 4.252 -19.371 1.00 64.01 C ATOM 2288 CG MET A 151 8.963 5.119 -18.269 1.00 21.24 C ATOM 2289 SD MET A 151 7.713 5.823 -17.163 1.00 61.44 S ATOM 2290 CE MET A 151 6.782 6.855 -18.306 1.00 2.33 C ATOM 0 H MET A 151 10.350 2.773 -18.676 1.00 44.32 H new ATOM 0 HA MET A 151 8.849 3.053 -21.071 1.00 51.25 H new ATOM 0 HB2 MET A 151 7.666 4.850 -19.944 1.00 64.01 H new ATOM 0 HB3 MET A 151 7.808 3.441 -18.912 1.00 64.01 H new ATOM 0 HG2 MET A 151 9.662 4.523 -17.683 1.00 21.24 H new ATOM 0 HG3 MET A 151 9.535 5.929 -18.721 1.00 21.24 H new ATOM 0 HE1 MET A 151 6.213 7.596 -17.746 1.00 2.33 H new ATOM 0 HE2 MET A 151 7.471 7.362 -18.982 1.00 2.33 H new ATOM 0 HE3 MET A 151 6.098 6.233 -18.883 1.00 2.33 H new ATOM 2300 N GLU A 152 11.346 5.102 -20.609 1.00 25.34 N ATOM 2301 CA GLU A 152 12.176 6.101 -21.295 1.00 11.22 C ATOM 2302 C GLU A 152 12.642 5.579 -22.641 1.00 53.22 C ATOM 2303 O GLU A 152 12.803 6.335 -23.591 1.00 12.20 O ATOM 2304 CB GLU A 152 13.383 6.505 -20.439 1.00 4.20 C ATOM 2305 CG GLU A 152 13.020 7.247 -19.169 1.00 13.02 C ATOM 2306 CD GLU A 152 12.367 8.575 -19.440 1.00 11.03 C ATOM 2307 OE1 GLU A 152 11.165 8.620 -19.745 1.00 75.21 O ATOM 2308 OE2 GLU A 152 13.066 9.616 -19.365 1.00 43.23 O ATOM 0 H GLU A 152 11.756 4.724 -19.755 1.00 25.34 H new ATOM 0 HA GLU A 152 11.561 6.986 -21.455 1.00 11.22 H new ATOM 0 HB2 GLU A 152 13.944 5.609 -20.175 1.00 4.20 H new ATOM 0 HB3 GLU A 152 14.045 7.132 -21.037 1.00 4.20 H new ATOM 0 HG2 GLU A 152 12.347 6.631 -18.573 1.00 13.02 H new ATOM 0 HG3 GLU A 152 13.920 7.404 -18.575 1.00 13.02 H new ATOM 2315 N CYS A 153 12.868 4.285 -22.712 1.00 72.32 N ATOM 2316 CA CYS A 153 13.270 3.658 -23.948 1.00 15.35 C ATOM 2317 C CYS A 153 12.082 3.613 -24.929 1.00 53.10 C ATOM 2318 O CYS A 153 12.255 3.739 -26.140 1.00 11.22 O ATOM 2319 CB CYS A 153 13.830 2.252 -23.680 1.00 2.12 C ATOM 2320 SG CYS A 153 14.462 1.402 -25.144 1.00 44.42 S ATOM 0 H CYS A 153 12.779 3.645 -21.922 1.00 72.32 H new ATOM 0 HA CYS A 153 14.064 4.249 -24.405 1.00 15.35 H new ATOM 0 HB2 CYS A 153 14.632 2.329 -22.946 1.00 2.12 H new ATOM 0 HB3 CYS A 153 13.045 1.642 -23.232 1.00 2.12 H new ATOM 0 HG CYS A 153 14.910 0.230 -24.805 1.00 44.42 H new ATOM 2326 N LYS A 154 10.876 3.451 -24.383 1.00 11.35 N ATOM 2327 CA LYS A 154 9.653 3.404 -25.184 1.00 61.41 C ATOM 2328 C LYS A 154 9.245 4.795 -25.642 1.00 72.11 C ATOM 2329 O LYS A 154 8.885 5.015 -26.809 1.00 55.43 O ATOM 2330 CB LYS A 154 8.519 2.831 -24.366 1.00 44.13 C ATOM 2331 CG LYS A 154 8.705 1.405 -23.919 1.00 71.41 C ATOM 2332 CD LYS A 154 7.470 0.958 -23.196 1.00 42.43 C ATOM 2333 CE LYS A 154 7.548 -0.484 -22.737 1.00 3.30 C ATOM 2334 NZ LYS A 154 6.315 -0.892 -22.018 1.00 12.43 N ATOM 0 H LYS A 154 10.720 3.349 -23.380 1.00 11.35 H new ATOM 0 HA LYS A 154 9.855 2.778 -26.053 1.00 61.41 H new ATOM 0 HB2 LYS A 154 8.377 3.455 -23.484 1.00 44.13 H new ATOM 0 HB3 LYS A 154 7.602 2.894 -24.952 1.00 44.13 H new ATOM 0 HG2 LYS A 154 8.892 0.762 -24.779 1.00 71.41 H new ATOM 0 HG3 LYS A 154 9.574 1.325 -23.266 1.00 71.41 H new ATOM 0 HD2 LYS A 154 7.308 1.601 -22.331 1.00 42.43 H new ATOM 0 HD3 LYS A 154 6.607 1.080 -23.851 1.00 42.43 H new ATOM 0 HE2 LYS A 154 7.700 -1.134 -23.599 1.00 3.30 H new ATOM 0 HE3 LYS A 154 8.411 -0.613 -22.084 1.00 3.30 H new ATOM 0 HZ1 LYS A 154 6.401 -1.884 -21.717 1.00 12.43 H new ATOM 0 HZ2 LYS A 154 6.184 -0.287 -21.182 1.00 12.43 H new ATOM 0 HZ3 LYS A 154 5.495 -0.791 -22.650 1.00 12.43 H new ATOM 2348 N LYS A 155 9.305 5.721 -24.723 1.00 62.40 N ATOM 2349 CA LYS A 155 8.956 7.077 -24.963 1.00 43.41 C ATOM 2350 C LYS A 155 10.209 7.898 -25.102 1.00 63.12 C ATOM 2351 O LYS A 155 10.751 8.437 -24.130 1.00 53.22 O ATOM 2352 CB LYS A 155 8.019 7.626 -23.863 1.00 44.23 C ATOM 2353 CG LYS A 155 7.711 9.116 -23.971 1.00 33.13 C ATOM 2354 CD LYS A 155 7.078 9.481 -25.299 1.00 74.40 C ATOM 2355 CE LYS A 155 6.877 10.975 -25.394 1.00 25.54 C ATOM 2356 NZ LYS A 155 6.295 11.371 -26.683 1.00 23.12 N ATOM 0 H LYS A 155 9.607 5.539 -23.766 1.00 62.40 H new ATOM 0 HA LYS A 155 8.397 7.141 -25.896 1.00 43.41 H new ATOM 0 HB2 LYS A 155 7.081 7.072 -23.895 1.00 44.23 H new ATOM 0 HB3 LYS A 155 8.471 7.432 -22.890 1.00 44.23 H new ATOM 0 HG2 LYS A 155 7.042 9.405 -23.161 1.00 33.13 H new ATOM 0 HG3 LYS A 155 8.632 9.685 -23.842 1.00 33.13 H new ATOM 0 HD2 LYS A 155 7.712 9.140 -26.117 1.00 74.40 H new ATOM 0 HD3 LYS A 155 6.120 8.971 -25.405 1.00 74.40 H new ATOM 0 HE2 LYS A 155 6.225 11.305 -24.585 1.00 25.54 H new ATOM 0 HE3 LYS A 155 7.834 11.479 -25.258 1.00 25.54 H new ATOM 0 HZ1 LYS A 155 6.174 12.404 -26.707 1.00 23.12 H new ATOM 0 HZ2 LYS A 155 6.929 11.079 -27.454 1.00 23.12 H new ATOM 0 HZ3 LYS A 155 5.370 10.911 -26.802 1.00 23.12 H new ATOM 2370 N LYS A 156 10.697 7.910 -26.288 1.00 50.42 N ATOM 2371 CA LYS A 156 11.879 8.644 -26.631 1.00 75.41 C ATOM 2372 C LYS A 156 11.579 10.133 -26.769 1.00 45.02 C ATOM 2373 O LYS A 156 10.500 10.517 -27.241 1.00 60.10 O ATOM 2374 CB LYS A 156 12.457 8.121 -27.952 1.00 62.32 C ATOM 2375 CG LYS A 156 11.494 8.213 -29.138 1.00 31.03 C ATOM 2376 CD LYS A 156 12.137 7.727 -30.419 1.00 11.21 C ATOM 2377 CE LYS A 156 11.167 7.814 -31.590 1.00 3.22 C ATOM 2378 NZ LYS A 156 11.781 7.362 -32.858 1.00 13.41 N ATOM 0 H LYS A 156 10.284 7.402 -27.070 1.00 50.42 H new ATOM 0 HA LYS A 156 12.604 8.505 -25.829 1.00 75.41 H new ATOM 0 HB2 LYS A 156 13.361 8.683 -28.188 1.00 62.32 H new ATOM 0 HB3 LYS A 156 12.754 7.081 -27.819 1.00 62.32 H new ATOM 0 HG2 LYS A 156 10.603 7.620 -28.930 1.00 31.03 H new ATOM 0 HG3 LYS A 156 11.168 9.246 -29.263 1.00 31.03 H new ATOM 0 HD2 LYS A 156 13.024 8.324 -30.633 1.00 11.21 H new ATOM 0 HD3 LYS A 156 12.469 6.696 -30.294 1.00 11.21 H new ATOM 0 HE2 LYS A 156 10.287 7.206 -31.377 1.00 3.22 H new ATOM 0 HE3 LYS A 156 10.824 8.843 -31.700 1.00 3.22 H new ATOM 0 HZ1 LYS A 156 11.085 7.438 -33.627 1.00 13.41 H new ATOM 0 HZ2 LYS A 156 12.605 7.958 -33.076 1.00 13.41 H new ATOM 0 HZ3 LYS A 156 12.085 6.372 -32.763 1.00 13.41 H new ATOM 2392 N PRO A 157 12.498 10.992 -26.312 1.00 53.01 N ATOM 2393 CA PRO A 157 12.416 12.420 -26.565 1.00 61.45 C ATOM 2394 C PRO A 157 12.566 12.658 -28.059 1.00 74.34 C ATOM 2395 O PRO A 157 13.521 12.147 -28.691 1.00 35.12 O ATOM 2396 CB PRO A 157 13.629 13.000 -25.822 1.00 71.32 C ATOM 2397 CG PRO A 157 14.014 11.955 -24.847 1.00 44.21 C ATOM 2398 CD PRO A 157 13.657 10.647 -25.484 1.00 4.45 C ATOM 0 HA PRO A 157 11.476 12.867 -26.242 1.00 61.45 H new ATOM 0 HB2 PRO A 157 14.446 13.219 -26.510 1.00 71.32 H new ATOM 0 HB3 PRO A 157 13.376 13.934 -25.321 1.00 71.32 H new ATOM 0 HG2 PRO A 157 15.080 12.003 -24.624 1.00 44.21 H new ATOM 0 HG3 PRO A 157 13.485 12.087 -23.903 1.00 44.21 H new ATOM 0 HD2 PRO A 157 14.478 10.252 -26.082 1.00 4.45 H new ATOM 0 HD3 PRO A 157 13.411 9.889 -24.740 1.00 4.45 H new ATOM 2406 N GLN A 158 11.652 13.382 -28.621 1.00 51.41 N ATOM 2407 CA GLN A 158 11.648 13.617 -30.037 1.00 21.44 C ATOM 2408 C GLN A 158 12.023 15.050 -30.338 1.00 21.10 C ATOM 2409 O GLN A 158 12.217 15.865 -29.416 1.00 50.22 O ATOM 2410 CB GLN A 158 10.269 13.289 -30.630 1.00 2.40 C ATOM 2411 CG GLN A 158 9.126 14.119 -30.053 1.00 2.41 C ATOM 2412 CD GLN A 158 7.781 13.783 -30.664 1.00 23.13 C ATOM 2413 OE1 GLN A 158 7.531 12.654 -31.082 1.00 62.23 O ATOM 2414 NE2 GLN A 158 6.908 14.750 -30.723 1.00 13.24 N ATOM 0 H GLN A 158 10.886 13.828 -28.116 1.00 51.41 H new ATOM 0 HA GLN A 158 12.389 12.963 -30.497 1.00 21.44 H new ATOM 0 HB2 GLN A 158 10.305 13.441 -31.709 1.00 2.40 H new ATOM 0 HB3 GLN A 158 10.056 12.233 -30.463 1.00 2.40 H new ATOM 0 HG2 GLN A 158 9.078 13.962 -28.975 1.00 2.41 H new ATOM 0 HG3 GLN A 158 9.337 15.177 -30.212 1.00 2.41 H new ATOM 0 HE21 GLN A 158 7.147 15.675 -30.367 1.00 13.24 H new ATOM 0 HE22 GLN A 158 5.986 14.581 -31.125 1.00 13.24 H new TER 2423 GLN A 158