USER MOD reduce.3.24.130724 H: found=0, std=0, add=1126, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1122 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 129 ASN : amide:sc= -2.85 K(o=-3.8,f=-5.7) USER MOD Set 1.2: A 132 GLN : amide:sc= -0.949 K(o=-3.8,f=-6!) USER MOD Set 2.1: A 65 SER OG : rot -179:sc= 0.0224 USER MOD Set 2.2: A 108 TYR OH : rot 180:sc= 0.0228 USER MOD Set 3.1: A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 93 THR OG1 : rot -51:sc= 0.0131 USER MOD Set 4.1: A 27 THR OG1 : rot 120:sc= -1.31 USER MOD Set 4.2: A 59 ASN : amide:sc= -1.43 X(o=-2.7,f=-2.4) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 166:sc= -0.0533 (180deg=-0.275) USER MOD Single : A 4 HIS : no HD1:sc= -0.246 K(o=-0.25,f=-1) USER MOD Single : A 5 THR OG1 : rot -170:sc= -0.634 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 150:sc= 1.17 USER MOD Single : A 11 THR OG1 : rot -72:sc= -0.01 USER MOD Single : A 14 ASN : amide:sc= -0.119 K(o=-0.12,f=-2!) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 30:sc= -0.143 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.00995) USER MOD Single : A 30 LYS NZ :NH3+ -171:sc=-0.00277 (180deg=-0.108) USER MOD Single : A 34 SER OG : rot -84:sc= 1.46 USER MOD Single : A 41 SER OG : rot 97:sc= 0.224 USER MOD Single : A 45 GLN : amide:sc= -0.0634 X(o=-0.063,f=-0.017) USER MOD Single : A 46 THR OG1 : rot 71:sc= -0.382 USER MOD Single : A 48 LYS NZ :NH3+ 147:sc= -0.124 (180deg=-0.892) USER MOD Single : A 51 GLN : amide:sc= 0 X(o=0,f=-0.085) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot -83:sc= 1.2 USER MOD Single : A 57 SER OG : rot 140:sc= 0 USER MOD Single : A 62 THR OG1 : rot -59:sc= 1.32 USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 72 LYS NZ :NH3+ 148:sc= -0.133 (180deg=-0.893) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= -0.326 K(o=-0.33,f=-2.6!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 114:sc= -0.114 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=-0.057) USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 THR OG1 : rot -89:sc= 1.23 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -0.405 K(o=-0.41,f=-0.97) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 79:sc= 1.07 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 GLN : amide:sc= -0.0131 X(o=-0.013,f=-0.35) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot -118:sc= -0.866 USER MOD Single : A 141 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.501 1.971 4.943 1.00 24.34 N ATOM 2 CA MET A 1 -2.809 0.695 4.796 1.00 2.42 C ATOM 3 C MET A 1 -1.377 0.906 4.314 1.00 50.21 C ATOM 4 O MET A 1 -0.798 0.039 3.659 1.00 0.23 O ATOM 5 CB MET A 1 -3.561 -0.207 3.817 1.00 34.50 C ATOM 6 CG MET A 1 -3.890 -1.579 4.385 1.00 51.34 C ATOM 7 SD MET A 1 -3.534 -2.914 3.226 1.00 53.42 S ATOM 8 CE MET A 1 -4.736 -4.138 3.741 1.00 60.05 C ATOM 0 H1 MET A 1 -4.523 1.803 5.038 1.00 24.34 H new ATOM 0 H2 MET A 1 -3.150 2.460 5.791 1.00 24.34 H new ATOM 0 H3 MET A 1 -3.324 2.561 4.105 1.00 24.34 H new ATOM 0 HA MET A 1 -2.778 0.212 5.773 1.00 2.42 H new ATOM 0 HB2 MET A 1 -4.487 0.286 3.519 1.00 34.50 H new ATOM 0 HB3 MET A 1 -2.961 -0.330 2.915 1.00 34.50 H new ATOM 0 HG2 MET A 1 -3.319 -1.736 5.300 1.00 51.34 H new ATOM 0 HG3 MET A 1 -4.945 -1.612 4.658 1.00 51.34 H new ATOM 0 HE1 MET A 1 -4.641 -5.026 3.116 1.00 60.05 H new ATOM 0 HE2 MET A 1 -4.559 -4.406 4.783 1.00 60.05 H new ATOM 0 HE3 MET A 1 -5.740 -3.727 3.638 1.00 60.05 H new ATOM 18 N VAL A 2 -0.811 2.064 4.641 1.00 33.33 N ATOM 19 CA VAL A 2 0.553 2.388 4.242 1.00 21.31 C ATOM 20 C VAL A 2 1.267 3.190 5.325 1.00 73.53 C ATOM 21 O VAL A 2 0.643 3.856 6.151 1.00 23.54 O ATOM 22 CB VAL A 2 0.578 3.187 2.926 1.00 52.41 C ATOM 23 CG1 VAL A 2 0.351 2.266 1.737 1.00 52.31 C ATOM 24 CG2 VAL A 2 -0.462 4.297 2.958 1.00 74.14 C ATOM 0 H VAL A 2 -1.277 2.793 5.181 1.00 33.33 H new ATOM 0 HA VAL A 2 1.072 1.441 4.093 1.00 21.31 H new ATOM 0 HB VAL A 2 1.561 3.644 2.817 1.00 52.41 H new ATOM 0 HG11 VAL A 2 0.372 2.849 0.816 1.00 52.31 H new ATOM 0 HG12 VAL A 2 1.136 1.511 1.707 1.00 52.31 H new ATOM 0 HG13 VAL A 2 -0.618 1.777 1.835 1.00 52.31 H new ATOM 0 HG21 VAL A 2 -0.431 4.852 2.020 1.00 74.14 H new ATOM 0 HG22 VAL A 2 -1.453 3.863 3.090 1.00 74.14 H new ATOM 0 HG23 VAL A 2 -0.248 4.972 3.786 1.00 74.14 H new ATOM 34 N PRO A 3 2.607 3.126 5.322 1.00 55.25 N ATOM 35 CA PRO A 3 3.435 3.841 6.297 1.00 41.44 C ATOM 36 C PRO A 3 3.408 5.351 6.084 1.00 42.13 C ATOM 37 O PRO A 3 4.342 5.926 5.523 1.00 72.22 O ATOM 38 CB PRO A 3 4.840 3.290 6.040 1.00 11.15 C ATOM 39 CG PRO A 3 4.816 2.837 4.622 1.00 70.44 C ATOM 40 CD PRO A 3 3.416 2.352 4.365 1.00 13.04 C ATOM 0 HA PRO A 3 3.083 3.692 7.318 1.00 41.44 H new ATOM 0 HB2 PRO A 3 5.600 4.055 6.198 1.00 11.15 H new ATOM 0 HB3 PRO A 3 5.072 2.466 6.715 1.00 11.15 H new ATOM 0 HG2 PRO A 3 5.076 3.653 3.947 1.00 70.44 H new ATOM 0 HG3 PRO A 3 5.542 2.041 4.454 1.00 70.44 H new ATOM 0 HD2 PRO A 3 3.109 2.538 3.336 1.00 13.04 H new ATOM 0 HD3 PRO A 3 3.324 1.279 4.536 1.00 13.04 H new ATOM 48 N HIS A 4 2.333 5.989 6.535 1.00 32.22 N ATOM 49 CA HIS A 4 2.185 7.433 6.395 1.00 43.12 C ATOM 50 C HIS A 4 3.151 8.170 7.318 1.00 41.12 C ATOM 51 O HIS A 4 3.534 9.310 7.052 1.00 60.14 O ATOM 52 CB HIS A 4 0.748 7.852 6.702 1.00 15.52 C ATOM 53 CG HIS A 4 0.542 9.336 6.694 1.00 34.13 C ATOM 54 ND1 HIS A 4 1.177 10.179 5.807 1.00 11.24 N ATOM 55 CD2 HIS A 4 -0.236 10.126 7.471 1.00 72.10 C ATOM 56 CE1 HIS A 4 0.800 11.424 6.040 1.00 62.10 C ATOM 57 NE2 HIS A 4 -0.058 11.419 7.044 1.00 25.14 N ATOM 0 H HIS A 4 1.551 5.528 7.001 1.00 32.22 H new ATOM 0 HA HIS A 4 2.420 7.699 5.365 1.00 43.12 H new ATOM 0 HB2 HIS A 4 0.081 7.397 5.970 1.00 15.52 H new ATOM 0 HB3 HIS A 4 0.464 7.459 7.678 1.00 15.52 H new ATOM 0 HD2 HIS A 4 -0.877 9.800 8.277 1.00 72.10 H new ATOM 0 HE1 HIS A 4 1.136 12.297 5.501 1.00 62.10 H new ATOM 0 HE2 HIS A 4 -0.514 12.242 7.438 1.00 25.14 H new ATOM 65 N THR A 5 3.542 7.512 8.405 1.00 15.22 N ATOM 66 CA THR A 5 4.460 8.105 9.368 1.00 4.15 C ATOM 67 C THR A 5 5.795 7.368 9.381 1.00 51.31 C ATOM 68 O THR A 5 6.856 7.987 9.469 1.00 25.24 O ATOM 69 CB THR A 5 3.868 8.094 10.790 1.00 12.52 C ATOM 70 OG1 THR A 5 2.777 7.169 10.859 1.00 2.25 O ATOM 71 CG2 THR A 5 3.388 9.482 11.187 1.00 51.51 C ATOM 0 H THR A 5 3.237 6.568 8.640 1.00 15.22 H new ATOM 0 HA THR A 5 4.620 9.137 9.057 1.00 4.15 H new ATOM 0 HB THR A 5 4.650 7.785 11.483 1.00 12.52 H new ATOM 0 HG1 THR A 5 2.307 7.280 11.712 1.00 2.25 H new ATOM 0 HG21 THR A 5 2.974 9.449 12.195 1.00 51.51 H new ATOM 0 HG22 THR A 5 4.226 10.178 11.161 1.00 51.51 H new ATOM 0 HG23 THR A 5 2.619 9.814 10.490 1.00 51.51 H new ATOM 79 N LEU A 6 5.735 6.044 9.291 1.00 40.30 N ATOM 80 CA LEU A 6 6.940 5.222 9.291 1.00 42.22 C ATOM 81 C LEU A 6 7.864 5.611 8.141 1.00 22.31 C ATOM 82 O LEU A 6 9.079 5.710 8.314 1.00 11.02 O ATOM 83 CB LEU A 6 6.571 3.741 9.186 1.00 41.54 C ATOM 84 CG LEU A 6 7.712 2.789 8.827 1.00 5.11 C ATOM 85 CD1 LEU A 6 8.748 2.754 9.940 1.00 31.04 C ATOM 86 CD2 LEU A 6 7.175 1.392 8.552 1.00 40.32 C ATOM 0 H LEU A 6 4.865 5.517 9.217 1.00 40.30 H new ATOM 0 HA LEU A 6 7.467 5.393 10.230 1.00 42.22 H new ATOM 0 HB2 LEU A 6 6.147 3.424 10.139 1.00 41.54 H new ATOM 0 HB3 LEU A 6 5.787 3.635 8.437 1.00 41.54 H new ATOM 0 HG LEU A 6 8.194 3.156 7.921 1.00 5.11 H new ATOM 0 HD11 LEU A 6 9.553 2.071 9.667 1.00 31.04 H new ATOM 0 HD12 LEU A 6 9.156 3.754 10.089 1.00 31.04 H new ATOM 0 HD13 LEU A 6 8.279 2.412 10.863 1.00 31.04 H new ATOM 0 HD21 LEU A 6 8.001 0.728 8.298 1.00 40.32 H new ATOM 0 HD22 LEU A 6 6.667 1.016 9.440 1.00 40.32 H new ATOM 0 HD23 LEU A 6 6.471 1.430 7.720 1.00 40.32 H new ATOM 98 N SER A 7 7.280 5.831 6.968 1.00 50.32 N ATOM 99 CA SER A 7 8.051 6.208 5.789 1.00 70.23 C ATOM 100 C SER A 7 8.012 7.718 5.574 1.00 70.35 C ATOM 101 O SER A 7 8.231 8.205 4.464 1.00 53.11 O ATOM 102 CB SER A 7 7.511 5.491 4.550 1.00 62.41 C ATOM 103 OG SER A 7 7.831 4.110 4.580 1.00 44.54 O ATOM 0 H SER A 7 6.275 5.755 6.808 1.00 50.32 H new ATOM 0 HA SER A 7 9.086 5.908 5.951 1.00 70.23 H new ATOM 0 HB2 SER A 7 6.430 5.616 4.496 1.00 62.41 H new ATOM 0 HB3 SER A 7 7.929 5.945 3.652 1.00 62.41 H new ATOM 0 HG SER A 7 7.474 3.674 3.778 1.00 44.54 H new ATOM 109 N THR A 8 7.731 8.455 6.644 1.00 64.21 N ATOM 110 CA THR A 8 7.662 9.909 6.574 1.00 61.22 C ATOM 111 C THR A 8 8.202 10.547 7.848 1.00 2.14 C ATOM 112 O THR A 8 7.907 11.705 8.149 1.00 72.43 O ATOM 113 CB THR A 8 6.218 10.392 6.344 1.00 73.14 C ATOM 114 OG1 THR A 8 5.551 9.521 5.423 1.00 52.21 O ATOM 115 CG2 THR A 8 6.202 11.815 5.806 1.00 62.24 C ATOM 0 H THR A 8 7.547 8.068 7.570 1.00 64.21 H new ATOM 0 HA THR A 8 8.279 10.214 5.729 1.00 61.22 H new ATOM 0 HB THR A 8 5.697 10.377 7.301 1.00 73.14 H new ATOM 0 HG1 THR A 8 4.592 9.504 5.625 1.00 52.21 H new ATOM 0 HG21 THR A 8 5.171 12.134 5.652 1.00 62.24 H new ATOM 0 HG22 THR A 8 6.684 12.480 6.522 1.00 62.24 H new ATOM 0 HG23 THR A 8 6.739 11.852 4.858 1.00 62.24 H new ATOM 123 N LEU A 9 8.995 9.787 8.595 1.00 64.31 N ATOM 124 CA LEU A 9 9.578 10.279 9.838 1.00 23.24 C ATOM 125 C LEU A 9 11.095 10.394 9.721 1.00 53.02 C ATOM 126 O LEU A 9 11.717 9.727 8.893 1.00 12.45 O ATOM 127 CB LEU A 9 9.214 9.350 10.998 1.00 63.10 C ATOM 128 CG LEU A 9 7.899 9.656 11.715 1.00 20.44 C ATOM 129 CD1 LEU A 9 7.569 8.559 12.716 1.00 63.31 C ATOM 130 CD2 LEU A 9 7.971 11.008 12.409 1.00 45.23 C ATOM 0 H LEU A 9 9.249 8.827 8.361 1.00 64.31 H new ATOM 0 HA LEU A 9 9.171 11.271 10.033 1.00 23.24 H new ATOM 0 HB2 LEU A 9 9.169 8.329 10.619 1.00 63.10 H new ATOM 0 HB3 LEU A 9 10.020 9.383 11.731 1.00 63.10 H new ATOM 0 HG LEU A 9 7.103 9.694 10.971 1.00 20.44 H new ATOM 0 HD11 LEU A 9 6.630 8.794 13.217 1.00 63.31 H new ATOM 0 HD12 LEU A 9 7.474 7.607 12.194 1.00 63.31 H new ATOM 0 HD13 LEU A 9 8.367 8.489 13.455 1.00 63.31 H new ATOM 0 HD21 LEU A 9 7.026 11.209 12.914 1.00 45.23 H new ATOM 0 HD22 LEU A 9 8.779 10.999 13.141 1.00 45.23 H new ATOM 0 HD23 LEU A 9 8.160 11.787 11.670 1.00 45.23 H new ATOM 142 N LYS A 10 11.685 11.243 10.555 1.00 32.25 N ATOM 143 CA LYS A 10 13.129 11.444 10.549 1.00 70.23 C ATOM 144 C LYS A 10 13.786 10.709 11.713 1.00 40.12 C ATOM 145 O LYS A 10 13.108 10.248 12.632 1.00 64.42 O ATOM 146 CB LYS A 10 13.457 12.937 10.624 1.00 61.33 C ATOM 147 CG LYS A 10 13.219 13.544 11.996 1.00 63.34 C ATOM 148 CD LYS A 10 12.689 14.964 11.893 1.00 44.03 C ATOM 149 CE LYS A 10 13.191 15.830 13.038 1.00 52.31 C ATOM 150 NZ LYS A 10 12.549 15.466 14.331 1.00 15.22 N ATOM 0 H LYS A 10 11.185 11.804 11.245 1.00 32.25 H new ATOM 0 HA LYS A 10 13.523 11.038 9.617 1.00 70.23 H new ATOM 0 HB2 LYS A 10 14.501 13.086 10.346 1.00 61.33 H new ATOM 0 HB3 LYS A 10 12.853 13.470 9.890 1.00 61.33 H new ATOM 0 HG2 LYS A 10 12.509 12.929 12.549 1.00 63.34 H new ATOM 0 HG3 LYS A 10 14.150 13.542 12.562 1.00 63.34 H new ATOM 0 HD2 LYS A 10 12.997 15.401 10.943 1.00 44.03 H new ATOM 0 HD3 LYS A 10 11.599 14.948 11.898 1.00 44.03 H new ATOM 0 HE2 LYS A 10 14.272 15.724 13.127 1.00 52.31 H new ATOM 0 HE3 LYS A 10 12.991 16.878 12.815 1.00 52.31 H new ATOM 0 HZ1 LYS A 10 12.918 16.079 15.086 1.00 15.22 H new ATOM 0 HZ2 LYS A 10 11.519 15.591 14.255 1.00 15.22 H new ATOM 0 HZ3 LYS A 10 12.761 14.473 14.556 1.00 15.22 H new ATOM 164 N THR A 11 15.111 10.605 11.669 1.00 73.30 N ATOM 165 CA THR A 11 15.859 9.927 12.720 1.00 62.33 C ATOM 166 C THR A 11 16.677 10.918 13.540 1.00 51.14 C ATOM 167 O THR A 11 16.832 12.077 13.155 1.00 64.40 O ATOM 168 CB THR A 11 16.803 8.858 12.137 1.00 41.00 C ATOM 169 OG1 THR A 11 17.923 9.487 11.503 1.00 75.43 O ATOM 170 CG2 THR A 11 16.072 7.980 11.133 1.00 60.12 C ATOM 0 H THR A 11 15.688 10.982 10.917 1.00 73.30 H new ATOM 0 HA THR A 11 15.127 9.442 13.366 1.00 62.33 H new ATOM 0 HB THR A 11 17.155 8.230 12.955 1.00 41.00 H new ATOM 0 HG1 THR A 11 17.631 9.910 10.668 1.00 75.43 H new ATOM 0 HG21 THR A 11 16.759 7.233 10.735 1.00 60.12 H new ATOM 0 HG22 THR A 11 15.238 7.480 11.626 1.00 60.12 H new ATOM 0 HG23 THR A 11 15.694 8.597 10.317 1.00 60.12 H new ATOM 178 N ALA A 12 17.198 10.455 14.671 1.00 43.20 N ATOM 179 CA ALA A 12 18.003 11.301 15.544 1.00 53.22 C ATOM 180 C ALA A 12 19.361 11.601 14.918 1.00 13.13 C ATOM 181 O ALA A 12 20.104 12.454 15.404 1.00 13.20 O ATOM 182 CB ALA A 12 18.180 10.640 16.903 1.00 52.23 C ATOM 0 H ALA A 12 17.077 9.499 15.005 1.00 43.20 H new ATOM 0 HA ALA A 12 17.477 12.246 15.678 1.00 53.22 H new ATOM 0 HB1 ALA A 12 18.783 11.283 17.544 1.00 52.23 H new ATOM 0 HB2 ALA A 12 17.204 10.483 17.361 1.00 52.23 H new ATOM 0 HB3 ALA A 12 18.680 9.680 16.778 1.00 52.23 H new ATOM 188 N ASP A 13 19.679 10.894 13.839 1.00 12.44 N ATOM 189 CA ASP A 13 20.948 11.085 13.147 1.00 10.40 C ATOM 190 C ASP A 13 20.812 12.128 12.042 1.00 65.03 C ATOM 191 O ASP A 13 21.688 12.259 11.188 1.00 62.33 O ATOM 192 CB ASP A 13 21.437 9.761 12.559 1.00 71.12 C ATOM 193 CG ASP A 13 22.174 8.913 13.576 1.00 25.21 C ATOM 194 OD1 ASP A 13 22.255 9.330 14.751 1.00 55.13 O ATOM 195 OD2 ASP A 13 22.671 7.831 13.198 1.00 10.41 O ATOM 0 H ASP A 13 19.075 10.184 13.425 1.00 12.44 H new ATOM 0 HA ASP A 13 21.679 11.443 13.872 1.00 10.40 H new ATOM 0 HB2 ASP A 13 20.585 9.202 12.173 1.00 71.12 H new ATOM 0 HB3 ASP A 13 22.095 9.963 11.714 1.00 71.12 H new ATOM 200 N ASN A 14 19.708 12.867 12.064 1.00 0.04 N ATOM 201 CA ASN A 14 19.457 13.897 11.063 1.00 52.10 C ATOM 202 C ASN A 14 19.318 13.282 9.673 1.00 0.55 C ATOM 203 O ASN A 14 19.608 13.928 8.666 1.00 15.42 O ATOM 204 CB ASN A 14 20.588 14.928 11.066 1.00 32.44 C ATOM 205 CG ASN A 14 20.151 16.267 10.506 1.00 51.23 C ATOM 206 OD1 ASN A 14 18.962 16.507 10.298 1.00 54.55 O ATOM 207 ND2 ASN A 14 21.114 17.147 10.258 1.00 1.33 N ATOM 0 H ASN A 14 18.973 12.772 12.764 1.00 0.04 H new ATOM 0 HA ASN A 14 18.521 14.394 11.317 1.00 52.10 H new ATOM 0 HB2 ASN A 14 20.949 15.064 12.085 1.00 32.44 H new ATOM 0 HB3 ASN A 14 21.424 14.548 10.480 1.00 32.44 H new ATOM 0 HD21 ASN A 14 20.881 18.065 9.880 1.00 1.33 H new ATOM 0 HD22 ASN A 14 22.087 16.905 10.446 1.00 1.33 H new ATOM 214 N ARG A 15 18.873 12.031 9.628 1.00 53.13 N ATOM 215 CA ARG A 15 18.696 11.329 8.362 1.00 31.14 C ATOM 216 C ARG A 15 17.304 10.710 8.274 1.00 71.00 C ATOM 217 O ARG A 15 16.650 10.447 9.283 1.00 34.41 O ATOM 218 CB ARG A 15 19.760 10.241 8.205 1.00 2.32 C ATOM 219 CG ARG A 15 19.966 9.405 9.458 1.00 44.42 C ATOM 220 CD ARG A 15 21.151 8.463 9.310 1.00 74.01 C ATOM 221 NE ARG A 15 22.406 9.186 9.123 1.00 13.14 N ATOM 222 CZ ARG A 15 23.598 8.601 9.128 1.00 44.44 C ATOM 223 NH1 ARG A 15 23.698 7.292 9.307 1.00 34.54 N ATOM 224 NH2 ARG A 15 24.695 9.327 8.951 1.00 1.22 N ATOM 0 H ARG A 15 18.628 11.483 10.453 1.00 53.13 H new ATOM 0 HA ARG A 15 18.805 12.054 7.555 1.00 31.14 H new ATOM 0 HB2 ARG A 15 19.477 9.584 7.383 1.00 2.32 H new ATOM 0 HB3 ARG A 15 20.706 10.707 7.930 1.00 2.32 H new ATOM 0 HG2 ARG A 15 20.126 10.062 10.313 1.00 44.42 H new ATOM 0 HG3 ARG A 15 19.065 8.828 9.664 1.00 44.42 H new ATOM 0 HD2 ARG A 15 21.225 7.832 10.196 1.00 74.01 H new ATOM 0 HD3 ARG A 15 20.984 7.801 8.460 1.00 74.01 H new ATOM 0 HE ARG A 15 22.365 10.195 8.981 1.00 13.14 H new ATOM 0 HH11 ARG A 15 22.858 6.730 9.442 1.00 34.54 H new ATOM 0 HH12 ARG A 15 24.615 6.846 9.310 1.00 34.54 H new ATOM 0 HH21 ARG A 15 24.623 10.335 8.811 1.00 1.22 H new ATOM 0 HH22 ARG A 15 25.610 8.877 8.955 1.00 1.22 H new ATOM 238 N PRO A 16 16.839 10.472 7.038 1.00 1.44 N ATOM 239 CA PRO A 16 15.521 9.882 6.789 1.00 72.04 C ATOM 240 C PRO A 16 15.455 8.416 7.201 1.00 33.44 C ATOM 241 O PRO A 16 16.337 7.626 6.865 1.00 11.14 O ATOM 242 CB PRO A 16 15.352 10.019 5.273 1.00 2.14 C ATOM 243 CG PRO A 16 16.742 10.067 4.740 1.00 24.22 C ATOM 244 CD PRO A 16 17.565 10.761 5.790 1.00 11.32 C ATOM 0 HA PRO A 16 14.738 10.375 7.366 1.00 72.04 H new ATOM 0 HB2 PRO A 16 14.798 9.177 4.859 1.00 2.14 H new ATOM 0 HB3 PRO A 16 14.798 10.922 5.016 1.00 2.14 H new ATOM 0 HG2 PRO A 16 17.121 9.063 4.548 1.00 24.22 H new ATOM 0 HG3 PRO A 16 16.779 10.608 3.795 1.00 24.22 H new ATOM 0 HD2 PRO A 16 18.585 10.377 5.820 1.00 11.32 H new ATOM 0 HD3 PRO A 16 17.633 11.833 5.604 1.00 11.32 H new ATOM 252 N ALA A 17 14.403 8.058 7.931 1.00 23.13 N ATOM 253 CA ALA A 17 14.221 6.686 8.388 1.00 63.55 C ATOM 254 C ALA A 17 13.980 5.744 7.213 1.00 73.23 C ATOM 255 O ALA A 17 14.094 4.526 7.348 1.00 63.34 O ATOM 256 CB ALA A 17 13.067 6.607 9.376 1.00 61.43 C ATOM 0 H ALA A 17 13.664 8.700 8.218 1.00 23.13 H new ATOM 0 HA ALA A 17 15.136 6.372 8.890 1.00 63.55 H new ATOM 0 HB1 ALA A 17 12.943 5.576 9.709 1.00 61.43 H new ATOM 0 HB2 ALA A 17 13.280 7.243 10.236 1.00 61.43 H new ATOM 0 HB3 ALA A 17 12.150 6.945 8.893 1.00 61.43 H new ATOM 262 N SER A 18 13.644 6.316 6.061 1.00 43.11 N ATOM 263 CA SER A 18 13.382 5.527 4.863 1.00 31.21 C ATOM 264 C SER A 18 14.618 4.731 4.455 1.00 2.41 C ATOM 265 O SER A 18 14.530 3.546 4.135 1.00 62.03 O ATOM 266 CB SER A 18 12.944 6.436 3.713 1.00 2.12 C ATOM 267 OG SER A 18 11.943 5.816 2.925 1.00 64.30 O ATOM 0 H SER A 18 13.547 7.323 5.932 1.00 43.11 H new ATOM 0 HA SER A 18 12.578 4.826 5.089 1.00 31.21 H new ATOM 0 HB2 SER A 18 12.565 7.377 4.113 1.00 2.12 H new ATOM 0 HB3 SER A 18 13.804 6.678 3.089 1.00 2.12 H new ATOM 0 HG SER A 18 11.679 6.418 2.198 1.00 64.30 H new ATOM 273 N VAL A 19 15.771 5.393 4.469 1.00 21.14 N ATOM 274 CA VAL A 19 17.027 4.749 4.102 1.00 33.13 C ATOM 275 C VAL A 19 17.315 3.553 5.003 1.00 74.24 C ATOM 276 O VAL A 19 18.088 2.664 4.644 1.00 53.23 O ATOM 277 CB VAL A 19 18.208 5.734 4.183 1.00 14.42 C ATOM 278 CG1 VAL A 19 19.505 5.047 3.788 1.00 63.44 C ATOM 279 CG2 VAL A 19 17.949 6.949 3.304 1.00 33.23 C ATOM 0 H VAL A 19 15.861 6.375 4.731 1.00 21.14 H new ATOM 0 HA VAL A 19 16.918 4.408 3.073 1.00 33.13 H new ATOM 0 HB VAL A 19 18.305 6.074 5.214 1.00 14.42 H new ATOM 0 HG11 VAL A 19 20.328 5.759 3.851 1.00 63.44 H new ATOM 0 HG12 VAL A 19 19.695 4.212 4.463 1.00 63.44 H new ATOM 0 HG13 VAL A 19 19.424 4.676 2.766 1.00 63.44 H new ATOM 0 HG21 VAL A 19 18.793 7.635 3.373 1.00 33.23 H new ATOM 0 HG22 VAL A 19 17.825 6.630 2.269 1.00 33.23 H new ATOM 0 HG23 VAL A 19 17.043 7.454 3.639 1.00 33.23 H new ATOM 289 N TYR A 20 16.687 3.536 6.173 1.00 5.34 N ATOM 290 CA TYR A 20 16.878 2.450 7.127 1.00 35.20 C ATOM 291 C TYR A 20 15.923 1.296 6.836 1.00 15.20 C ATOM 292 O TYR A 20 15.857 0.324 7.589 1.00 32.31 O ATOM 293 CB TYR A 20 16.666 2.954 8.555 1.00 13.05 C ATOM 294 CG TYR A 20 17.886 3.621 9.149 1.00 32.25 C ATOM 295 CD1 TYR A 20 19.050 2.900 9.385 1.00 1.42 C ATOM 296 CD2 TYR A 20 17.874 4.972 9.474 1.00 24.10 C ATOM 297 CE1 TYR A 20 20.167 3.505 9.929 1.00 52.55 C ATOM 298 CE2 TYR A 20 18.987 5.586 10.016 1.00 31.33 C ATOM 299 CZ TYR A 20 20.130 4.848 10.242 1.00 4.21 C ATOM 300 OH TYR A 20 21.241 5.455 10.782 1.00 22.11 O ATOM 0 H TYR A 20 16.041 4.262 6.484 1.00 5.34 H new ATOM 0 HA TYR A 20 17.901 2.087 7.025 1.00 35.20 H new ATOM 0 HB2 TYR A 20 15.836 3.661 8.562 1.00 13.05 H new ATOM 0 HB3 TYR A 20 16.376 2.115 9.188 1.00 13.05 H new ATOM 0 HD1 TYR A 20 19.082 1.849 9.139 1.00 1.42 H new ATOM 0 HD2 TYR A 20 16.980 5.552 9.300 1.00 24.10 H new ATOM 0 HE1 TYR A 20 21.063 2.930 10.108 1.00 52.55 H new ATOM 0 HE2 TYR A 20 18.962 6.638 10.261 1.00 31.33 H new ATOM 0 HH TYR A 20 22.049 5.006 10.457 1.00 22.11 H new ATOM 310 N LEU A 21 15.184 1.411 5.738 1.00 51.21 N ATOM 311 CA LEU A 21 14.232 0.378 5.345 1.00 53.34 C ATOM 312 C LEU A 21 14.541 -0.142 3.945 1.00 74.44 C ATOM 313 O LEU A 21 15.437 0.361 3.267 1.00 71.42 O ATOM 314 CB LEU A 21 12.805 0.927 5.394 1.00 53.13 C ATOM 315 CG LEU A 21 12.110 0.869 6.754 1.00 34.44 C ATOM 316 CD1 LEU A 21 12.977 1.512 7.825 1.00 23.42 C ATOM 317 CD2 LEU A 21 10.750 1.548 6.688 1.00 13.32 C ATOM 0 H LEU A 21 15.226 2.209 5.104 1.00 51.21 H new ATOM 0 HA LEU A 21 14.320 -0.450 6.048 1.00 53.34 H new ATOM 0 HB2 LEU A 21 12.825 1.965 5.063 1.00 53.13 H new ATOM 0 HB3 LEU A 21 12.200 0.375 4.675 1.00 53.13 H new ATOM 0 HG LEU A 21 11.959 -0.178 7.018 1.00 34.44 H new ATOM 0 HD11 LEU A 21 12.465 1.461 8.786 1.00 23.42 H new ATOM 0 HD12 LEU A 21 13.927 0.982 7.891 1.00 23.42 H new ATOM 0 HD13 LEU A 21 13.161 2.555 7.567 1.00 23.42 H new ATOM 0 HD21 LEU A 21 10.270 1.497 7.665 1.00 13.32 H new ATOM 0 HD22 LEU A 21 10.878 2.592 6.401 1.00 13.32 H new ATOM 0 HD23 LEU A 21 10.126 1.043 5.951 1.00 13.32 H new ATOM 329 N LYS A 22 13.791 -1.152 3.516 1.00 71.21 N ATOM 330 CA LYS A 22 13.981 -1.740 2.195 1.00 30.02 C ATOM 331 C LYS A 22 12.639 -2.047 1.538 1.00 21.32 C ATOM 332 O LYS A 22 11.828 -2.798 2.081 1.00 53.23 O ATOM 333 CB LYS A 22 14.815 -3.019 2.299 1.00 50.03 C ATOM 334 CG LYS A 22 16.025 -3.032 1.381 1.00 71.14 C ATOM 335 CD LYS A 22 16.641 -4.418 1.290 1.00 71.23 C ATOM 336 CE LYS A 22 17.656 -4.651 2.399 1.00 54.13 C ATOM 337 NZ LYS A 22 18.995 -4.101 2.049 1.00 32.25 N ATOM 0 H LYS A 22 13.045 -1.581 4.065 1.00 71.21 H new ATOM 0 HA LYS A 22 14.512 -1.017 1.575 1.00 30.02 H new ATOM 0 HB2 LYS A 22 15.150 -3.142 3.329 1.00 50.03 H new ATOM 0 HB3 LYS A 22 14.183 -3.875 2.065 1.00 50.03 H new ATOM 0 HG2 LYS A 22 15.732 -2.697 0.386 1.00 71.14 H new ATOM 0 HG3 LYS A 22 16.769 -2.325 1.748 1.00 71.14 H new ATOM 0 HD2 LYS A 22 15.855 -5.171 1.350 1.00 71.23 H new ATOM 0 HD3 LYS A 22 17.125 -4.539 0.321 1.00 71.23 H new ATOM 0 HE2 LYS A 22 17.302 -4.187 3.319 1.00 54.13 H new ATOM 0 HE3 LYS A 22 17.742 -5.720 2.594 1.00 54.13 H new ATOM 0 HZ1 LYS A 22 19.659 -4.280 2.830 1.00 32.25 H new ATOM 0 HZ2 LYS A 22 19.345 -4.562 1.185 1.00 32.25 H new ATOM 0 HZ3 LYS A 22 18.918 -3.076 1.888 1.00 32.25 H new ATOM 351 N LYS A 23 12.412 -1.464 0.366 1.00 10.12 N ATOM 352 CA LYS A 23 11.170 -1.677 -0.367 1.00 71.11 C ATOM 353 C LYS A 23 11.149 -3.060 -1.011 1.00 15.31 C ATOM 354 O LYS A 23 11.136 -3.184 -2.236 1.00 32.44 O ATOM 355 CB LYS A 23 10.996 -0.600 -1.441 1.00 22.34 C ATOM 356 CG LYS A 23 12.175 -0.495 -2.392 1.00 41.55 C ATOM 357 CD LYS A 23 12.748 0.912 -2.416 1.00 4.41 C ATOM 358 CE LYS A 23 14.086 0.957 -3.139 1.00 12.31 C ATOM 359 NZ LYS A 23 14.258 2.221 -3.908 1.00 62.44 N ATOM 0 H LYS A 23 13.073 -0.840 -0.097 1.00 10.12 H new ATOM 0 HA LYS A 23 10.344 -1.612 0.341 1.00 71.11 H new ATOM 0 HB2 LYS A 23 10.094 -0.813 -2.015 1.00 22.34 H new ATOM 0 HB3 LYS A 23 10.844 0.364 -0.956 1.00 22.34 H new ATOM 0 HG2 LYS A 23 12.950 -1.200 -2.091 1.00 41.55 H new ATOM 0 HG3 LYS A 23 11.860 -0.778 -3.396 1.00 41.55 H new ATOM 0 HD2 LYS A 23 12.045 1.584 -2.908 1.00 4.41 H new ATOM 0 HD3 LYS A 23 12.873 1.273 -1.395 1.00 4.41 H new ATOM 0 HE2 LYS A 23 14.894 0.860 -2.414 1.00 12.31 H new ATOM 0 HE3 LYS A 23 14.162 0.106 -3.816 1.00 12.31 H new ATOM 0 HZ1 LYS A 23 15.181 2.213 -4.386 1.00 62.44 H new ATOM 0 HZ2 LYS A 23 13.501 2.302 -4.617 1.00 62.44 H new ATOM 0 HZ3 LYS A 23 14.211 3.032 -3.258 1.00 62.44 H new ATOM 373 N ASP A 24 11.143 -4.095 -0.178 1.00 44.23 N ATOM 374 CA ASP A 24 11.121 -5.469 -0.667 1.00 13.24 C ATOM 375 C ASP A 24 11.002 -6.455 0.491 1.00 35.00 C ATOM 376 O ASP A 24 10.381 -7.511 0.361 1.00 43.45 O ATOM 377 CB ASP A 24 12.383 -5.765 -1.478 1.00 21.23 C ATOM 378 CG ASP A 24 12.133 -6.758 -2.595 1.00 62.54 C ATOM 379 OD1 ASP A 24 11.357 -7.713 -2.378 1.00 45.53 O ATOM 380 OD2 ASP A 24 12.714 -6.582 -3.687 1.00 70.31 O ATOM 0 H ASP A 24 11.153 -4.009 0.838 1.00 44.23 H new ATOM 0 HA ASP A 24 10.250 -5.586 -1.311 1.00 13.24 H new ATOM 0 HB2 ASP A 24 12.766 -4.836 -1.900 1.00 21.23 H new ATOM 0 HB3 ASP A 24 13.155 -6.156 -0.814 1.00 21.23 H new ATOM 385 N LYS A 25 11.601 -6.105 1.624 1.00 13.30 N ATOM 386 CA LYS A 25 11.563 -6.958 2.806 1.00 54.21 C ATOM 387 C LYS A 25 10.812 -6.276 3.945 1.00 35.00 C ATOM 388 O LYS A 25 10.740 -5.050 4.027 1.00 0.41 O ATOM 389 CB LYS A 25 12.984 -7.307 3.254 1.00 15.34 C ATOM 390 CG LYS A 25 13.959 -7.481 2.103 1.00 2.14 C ATOM 391 CD LYS A 25 14.968 -8.581 2.389 1.00 53.01 C ATOM 392 CE LYS A 25 14.889 -9.692 1.353 1.00 35.13 C ATOM 393 NZ LYS A 25 15.345 -9.234 0.012 1.00 1.20 N ATOM 0 H LYS A 25 12.119 -5.235 1.749 1.00 13.30 H new ATOM 0 HA LYS A 25 11.036 -7.875 2.545 1.00 54.21 H new ATOM 0 HB2 LYS A 25 13.351 -6.521 3.914 1.00 15.34 H new ATOM 0 HB3 LYS A 25 12.956 -8.227 3.838 1.00 15.34 H new ATOM 0 HG2 LYS A 25 13.409 -7.718 1.192 1.00 2.14 H new ATOM 0 HG3 LYS A 25 14.483 -6.542 1.924 1.00 2.14 H new ATOM 0 HD2 LYS A 25 15.974 -8.161 2.397 1.00 53.01 H new ATOM 0 HD3 LYS A 25 14.787 -8.994 3.381 1.00 53.01 H new ATOM 0 HE2 LYS A 25 15.501 -10.534 1.676 1.00 35.13 H new ATOM 0 HE3 LYS A 25 13.862 -10.052 1.284 1.00 35.13 H new ATOM 0 HZ1 LYS A 25 15.421 -10.051 -0.627 1.00 1.20 H new ATOM 0 HZ2 LYS A 25 14.659 -8.555 -0.375 1.00 1.20 H new ATOM 0 HZ3 LYS A 25 16.274 -8.775 0.099 1.00 1.20 H new ATOM 407 N PRO A 26 10.239 -7.087 4.847 1.00 72.34 N ATOM 408 CA PRO A 26 9.485 -6.584 5.999 1.00 51.25 C ATOM 409 C PRO A 26 10.384 -5.910 7.030 1.00 34.51 C ATOM 410 O PRO A 26 11.445 -6.429 7.377 1.00 3.14 O ATOM 411 CB PRO A 26 8.849 -7.846 6.586 1.00 64.41 C ATOM 412 CG PRO A 26 9.747 -8.956 6.158 1.00 34.23 C ATOM 413 CD PRO A 26 10.284 -8.559 4.811 1.00 13.22 C ATOM 0 HA PRO A 26 8.762 -5.821 5.711 1.00 51.25 H new ATOM 0 HB2 PRO A 26 8.782 -7.787 7.672 1.00 64.41 H new ATOM 0 HB3 PRO A 26 7.835 -7.990 6.212 1.00 64.41 H new ATOM 0 HG2 PRO A 26 10.556 -9.101 6.873 1.00 34.23 H new ATOM 0 HG3 PRO A 26 9.202 -9.898 6.098 1.00 34.23 H new ATOM 0 HD2 PRO A 26 11.299 -8.927 4.659 1.00 13.22 H new ATOM 0 HD3 PRO A 26 9.675 -8.960 4.001 1.00 13.22 H new ATOM 421 N THR A 27 9.952 -4.752 7.518 1.00 13.42 N ATOM 422 CA THR A 27 10.717 -4.007 8.510 1.00 45.03 C ATOM 423 C THR A 27 10.097 -4.138 9.896 1.00 71.52 C ATOM 424 O THR A 27 8.874 -4.169 10.039 1.00 31.44 O ATOM 425 CB THR A 27 10.812 -2.514 8.141 1.00 31.34 C ATOM 426 OG1 THR A 27 11.343 -2.368 6.820 1.00 65.42 O ATOM 427 CG2 THR A 27 11.691 -1.767 9.133 1.00 63.04 C ATOM 0 H THR A 27 9.076 -4.309 7.242 1.00 13.42 H new ATOM 0 HA THR A 27 11.719 -4.435 8.522 1.00 45.03 H new ATOM 0 HB THR A 27 9.809 -2.089 8.177 1.00 31.34 H new ATOM 0 HG1 THR A 27 10.691 -1.904 6.255 1.00 65.42 H new ATOM 0 HG21 THR A 27 11.743 -0.715 8.852 1.00 63.04 H new ATOM 0 HG22 THR A 27 11.267 -1.855 10.133 1.00 63.04 H new ATOM 0 HG23 THR A 27 12.693 -2.195 9.125 1.00 63.04 H new ATOM 435 N LEU A 28 10.946 -4.215 10.914 1.00 4.12 N ATOM 436 CA LEU A 28 10.481 -4.342 12.291 1.00 71.31 C ATOM 437 C LEU A 28 10.657 -3.030 13.049 1.00 74.32 C ATOM 438 O LEU A 28 11.771 -2.522 13.179 1.00 34.14 O ATOM 439 CB LEU A 28 11.239 -5.462 13.005 1.00 64.40 C ATOM 440 CG LEU A 28 10.646 -6.865 12.873 1.00 73.33 C ATOM 441 CD1 LEU A 28 11.590 -7.774 12.101 1.00 21.25 C ATOM 442 CD2 LEU A 28 10.344 -7.448 14.246 1.00 70.34 C ATOM 0 H LEU A 28 11.961 -4.192 10.812 1.00 4.12 H new ATOM 0 HA LEU A 28 9.419 -4.587 12.268 1.00 71.31 H new ATOM 0 HB2 LEU A 28 12.260 -5.483 12.623 1.00 64.40 H new ATOM 0 HB3 LEU A 28 11.300 -5.214 14.065 1.00 64.40 H new ATOM 0 HG LEU A 28 9.711 -6.792 12.318 1.00 73.33 H new ATOM 0 HD11 LEU A 28 11.151 -8.768 12.017 1.00 21.25 H new ATOM 0 HD12 LEU A 28 11.755 -7.365 11.104 1.00 21.25 H new ATOM 0 HD13 LEU A 28 12.542 -7.841 12.627 1.00 21.25 H new ATOM 0 HD21 LEU A 28 9.923 -8.447 14.132 1.00 70.34 H new ATOM 0 HD22 LEU A 28 11.264 -7.506 14.827 1.00 70.34 H new ATOM 0 HD23 LEU A 28 9.628 -6.809 14.763 1.00 70.34 H new ATOM 454 N ILE A 29 9.551 -2.489 13.548 1.00 53.53 N ATOM 455 CA ILE A 29 9.584 -1.238 14.295 1.00 14.34 C ATOM 456 C ILE A 29 9.419 -1.487 15.791 1.00 43.31 C ATOM 457 O ILE A 29 8.409 -2.034 16.233 1.00 22.34 O ATOM 458 CB ILE A 29 8.482 -0.271 13.823 1.00 11.44 C ATOM 459 CG1 ILE A 29 8.692 0.098 12.353 1.00 32.32 C ATOM 460 CG2 ILE A 29 8.467 0.979 14.691 1.00 35.12 C ATOM 461 CD1 ILE A 29 7.430 0.013 11.523 1.00 63.42 C ATOM 0 H ILE A 29 8.621 -2.897 13.449 1.00 53.53 H new ATOM 0 HA ILE A 29 10.558 -0.785 14.109 1.00 14.34 H new ATOM 0 HB ILE A 29 7.517 -0.769 13.919 1.00 11.44 H new ATOM 0 HG12 ILE A 29 9.088 1.112 12.294 1.00 32.32 H new ATOM 0 HG13 ILE A 29 9.445 -0.564 11.924 1.00 32.32 H new ATOM 0 HG21 ILE A 29 7.683 1.653 14.345 1.00 35.12 H new ATOM 0 HG22 ILE A 29 8.275 0.700 15.727 1.00 35.12 H new ATOM 0 HG23 ILE A 29 9.432 1.481 14.623 1.00 35.12 H new ATOM 0 HD11 ILE A 29 7.653 0.288 10.492 1.00 63.42 H new ATOM 0 HD12 ILE A 29 7.044 -1.006 11.551 1.00 63.42 H new ATOM 0 HD13 ILE A 29 6.682 0.696 11.927 1.00 63.42 H new ATOM 473 N LYS A 30 10.418 -1.079 16.566 1.00 25.31 N ATOM 474 CA LYS A 30 10.385 -1.254 18.013 1.00 21.43 C ATOM 475 C LYS A 30 10.349 0.095 18.724 1.00 62.21 C ATOM 476 O LYS A 30 11.165 0.975 18.448 1.00 21.33 O ATOM 477 CB LYS A 30 11.603 -2.056 18.479 1.00 51.31 C ATOM 478 CG LYS A 30 12.917 -1.554 17.905 1.00 73.31 C ATOM 479 CD LYS A 30 14.082 -2.431 18.331 1.00 3.35 C ATOM 480 CE LYS A 30 14.184 -2.524 19.846 1.00 23.12 C ATOM 481 NZ LYS A 30 14.389 -1.188 20.472 1.00 72.23 N ATOM 0 H LYS A 30 11.261 -0.624 16.216 1.00 25.31 H new ATOM 0 HA LYS A 30 9.478 -1.803 18.266 1.00 21.43 H new ATOM 0 HB2 LYS A 30 11.655 -2.023 19.567 1.00 51.31 H new ATOM 0 HB3 LYS A 30 11.469 -3.101 18.198 1.00 51.31 H new ATOM 0 HG2 LYS A 30 12.855 -1.532 16.817 1.00 73.31 H new ATOM 0 HG3 LYS A 30 13.092 -0.530 18.235 1.00 73.31 H new ATOM 0 HD2 LYS A 30 13.960 -3.430 17.911 1.00 3.35 H new ATOM 0 HD3 LYS A 30 15.010 -2.027 17.927 1.00 3.35 H new ATOM 0 HE2 LYS A 30 13.275 -2.976 20.244 1.00 23.12 H new ATOM 0 HE3 LYS A 30 15.011 -3.181 20.115 1.00 23.12 H new ATOM 0 HZ1 LYS A 30 14.605 -1.307 21.482 1.00 72.23 H new ATOM 0 HZ2 LYS A 30 15.181 -0.703 20.004 1.00 72.23 H new ATOM 0 HZ3 LYS A 30 13.524 -0.619 20.368 1.00 72.23 H new ATOM 495 N PHE A 31 9.400 0.251 19.640 1.00 35.33 N ATOM 496 CA PHE A 31 9.258 1.493 20.391 1.00 70.10 C ATOM 497 C PHE A 31 9.924 1.380 21.759 1.00 0.42 C ATOM 498 O PHE A 31 9.568 0.521 22.566 1.00 50.33 O ATOM 499 CB PHE A 31 7.779 1.846 20.559 1.00 52.42 C ATOM 500 CG PHE A 31 7.027 1.913 19.260 1.00 3.10 C ATOM 501 CD1 PHE A 31 6.999 3.084 18.520 1.00 12.32 C ATOM 502 CD2 PHE A 31 6.349 0.805 18.779 1.00 31.33 C ATOM 503 CE1 PHE A 31 6.309 3.149 17.324 1.00 35.04 C ATOM 504 CE2 PHE A 31 5.657 0.863 17.584 1.00 4.41 C ATOM 505 CZ PHE A 31 5.636 2.037 16.856 1.00 1.24 C ATOM 0 H PHE A 31 8.717 -0.467 19.881 1.00 35.33 H new ATOM 0 HA PHE A 31 9.752 2.286 19.830 1.00 70.10 H new ATOM 0 HB2 PHE A 31 7.308 1.105 21.204 1.00 52.42 H new ATOM 0 HB3 PHE A 31 7.699 2.807 21.066 1.00 52.42 H new ATOM 0 HD1 PHE A 31 7.523 3.956 18.882 1.00 12.32 H new ATOM 0 HD2 PHE A 31 6.361 -0.115 19.344 1.00 31.33 H new ATOM 0 HE1 PHE A 31 6.296 4.068 16.756 1.00 35.04 H new ATOM 0 HE2 PHE A 31 5.133 -0.008 17.220 1.00 4.41 H new ATOM 0 HZ PHE A 31 5.094 2.085 15.923 1.00 1.24 H new ATOM 515 N TRP A 32 10.892 2.253 22.012 1.00 2.44 N ATOM 516 CA TRP A 32 11.609 2.252 23.283 1.00 42.34 C ATOM 517 C TRP A 32 11.595 3.639 23.917 1.00 63.24 C ATOM 518 O TRP A 32 10.928 4.549 23.426 1.00 31.12 O ATOM 519 CB TRP A 32 13.051 1.786 23.077 1.00 4.22 C ATOM 520 CG TRP A 32 13.794 2.587 22.050 1.00 32.52 C ATOM 521 CD1 TRP A 32 13.583 2.586 20.701 1.00 72.41 C ATOM 522 CD2 TRP A 32 14.867 3.503 22.290 1.00 43.01 C ATOM 523 NE1 TRP A 32 14.461 3.446 20.087 1.00 14.53 N ATOM 524 CE2 TRP A 32 15.259 4.022 21.040 1.00 15.32 C ATOM 525 CE3 TRP A 32 15.535 3.937 23.438 1.00 14.23 C ATOM 526 CZ2 TRP A 32 16.287 4.951 20.910 1.00 42.43 C ATOM 527 CZ3 TRP A 32 16.556 4.859 23.307 1.00 55.20 C ATOM 528 CH2 TRP A 32 16.923 5.359 22.051 1.00 64.14 C ATOM 0 H TRP A 32 11.199 2.970 21.355 1.00 2.44 H new ATOM 0 HA TRP A 32 11.104 1.560 23.957 1.00 42.34 H new ATOM 0 HB2 TRP A 32 13.583 1.844 24.027 1.00 4.22 H new ATOM 0 HB3 TRP A 32 13.047 0.738 22.777 1.00 4.22 H new ATOM 0 HD1 TRP A 32 12.836 1.996 20.191 1.00 72.41 H new ATOM 0 HE1 TRP A 32 14.511 3.626 19.084 1.00 14.53 H new ATOM 0 HE3 TRP A 32 15.258 3.558 24.411 1.00 14.23 H new ATOM 0 HZ2 TRP A 32 16.573 5.336 19.942 1.00 42.43 H new ATOM 0 HZ3 TRP A 32 17.080 5.200 24.188 1.00 55.20 H new ATOM 0 HH2 TRP A 32 17.724 6.081 21.982 1.00 64.14 H new ATOM 539 N ALA A 33 12.336 3.793 25.009 1.00 24.41 N ATOM 540 CA ALA A 33 12.410 5.069 25.708 1.00 4.44 C ATOM 541 C ALA A 33 13.683 5.165 26.543 1.00 32.14 C ATOM 542 O ALA A 33 14.240 4.150 26.961 1.00 43.00 O ATOM 543 CB ALA A 33 11.184 5.261 26.588 1.00 11.31 C ATOM 0 H ALA A 33 12.894 3.049 25.429 1.00 24.41 H new ATOM 0 HA ALA A 33 12.436 5.863 24.961 1.00 4.44 H new ATOM 0 HB1 ALA A 33 11.253 6.219 27.104 1.00 11.31 H new ATOM 0 HB2 ALA A 33 10.286 5.246 25.970 1.00 11.31 H new ATOM 0 HB3 ALA A 33 11.133 4.456 27.321 1.00 11.31 H new ATOM 549 N SER A 34 14.138 6.391 26.783 1.00 75.15 N ATOM 550 CA SER A 34 15.347 6.618 27.564 1.00 4.50 C ATOM 551 C SER A 34 15.092 6.366 29.047 1.00 52.32 C ATOM 552 O SER A 34 16.026 6.293 29.845 1.00 0.01 O ATOM 553 CB SER A 34 15.852 8.048 27.358 1.00 52.02 C ATOM 554 OG SER A 34 15.771 8.425 25.994 1.00 4.42 O ATOM 0 H SER A 34 13.687 7.242 26.447 1.00 75.15 H new ATOM 0 HA SER A 34 16.108 5.918 27.220 1.00 4.50 H new ATOM 0 HB2 SER A 34 15.263 8.736 27.965 1.00 52.02 H new ATOM 0 HB3 SER A 34 16.884 8.125 27.699 1.00 52.02 H new ATOM 0 HG SER A 34 16.569 8.111 25.520 1.00 4.42 H new ATOM 560 N TRP A 35 13.820 6.235 29.407 1.00 24.51 N ATOM 561 CA TRP A 35 13.441 5.991 30.794 1.00 34.50 C ATOM 562 C TRP A 35 13.060 4.529 31.005 1.00 12.32 C ATOM 563 O TRP A 35 12.236 4.210 31.863 1.00 73.25 O ATOM 564 CB TRP A 35 12.275 6.897 31.192 1.00 35.10 C ATOM 565 CG TRP A 35 11.087 6.769 30.287 1.00 33.51 C ATOM 566 CD1 TRP A 35 10.894 7.402 29.092 1.00 24.43 C ATOM 567 CD2 TRP A 35 9.927 5.958 30.505 1.00 13.34 C ATOM 568 NE1 TRP A 35 9.685 7.034 28.555 1.00 75.32 N ATOM 569 CE2 TRP A 35 9.072 6.148 29.402 1.00 40.52 C ATOM 570 CE3 TRP A 35 9.528 5.089 31.524 1.00 14.23 C ATOM 571 CZ2 TRP A 35 7.844 5.502 29.292 1.00 52.01 C ATOM 572 CZ3 TRP A 35 8.308 4.449 31.414 1.00 62.42 C ATOM 573 CH2 TRP A 35 7.478 4.657 30.304 1.00 23.21 C ATOM 0 H TRP A 35 13.035 6.294 28.759 1.00 24.51 H new ATOM 0 HA TRP A 35 14.300 6.218 31.425 1.00 34.50 H new ATOM 0 HB2 TRP A 35 11.973 6.661 32.212 1.00 35.10 H new ATOM 0 HB3 TRP A 35 12.613 7.933 31.192 1.00 35.10 H new ATOM 0 HD1 TRP A 35 11.590 8.091 28.636 1.00 24.43 H new ATOM 0 HE1 TRP A 35 9.305 7.366 27.669 1.00 75.32 H new ATOM 0 HE3 TRP A 35 10.162 4.921 32.382 1.00 14.23 H new ATOM 0 HZ2 TRP A 35 7.203 5.662 28.438 1.00 52.01 H new ATOM 0 HZ3 TRP A 35 7.989 3.777 32.197 1.00 62.42 H new ATOM 0 HH2 TRP A 35 6.531 4.140 30.246 1.00 23.21 H new ATOM 584 N CYS A 36 13.665 3.645 30.219 1.00 54.21 N ATOM 585 CA CYS A 36 13.389 2.217 30.319 1.00 10.25 C ATOM 586 C CYS A 36 14.685 1.420 30.431 1.00 61.50 C ATOM 587 O CYS A 36 15.558 1.482 29.565 1.00 22.01 O ATOM 588 CB CYS A 36 12.589 1.744 29.104 1.00 1.11 C ATOM 589 SG CYS A 36 12.347 -0.060 29.029 1.00 4.05 S ATOM 0 H CYS A 36 14.350 3.893 29.505 1.00 54.21 H new ATOM 0 HA CYS A 36 12.800 2.048 31.220 1.00 10.25 H new ATOM 0 HB2 CYS A 36 11.614 2.231 29.113 1.00 1.11 H new ATOM 0 HB3 CYS A 36 13.099 2.069 28.197 1.00 1.11 H new ATOM 594 N PRO A 37 14.815 0.651 31.523 1.00 73.15 N ATOM 595 CA PRO A 37 16.000 -0.175 31.773 1.00 11.53 C ATOM 596 C PRO A 37 16.099 -1.353 30.811 1.00 24.54 C ATOM 597 O PRO A 37 17.188 -1.706 30.355 1.00 0.33 O ATOM 598 CB PRO A 37 15.790 -0.670 33.206 1.00 4.24 C ATOM 599 CG PRO A 37 14.315 -0.634 33.408 1.00 73.45 C ATOM 600 CD PRO A 37 13.814 0.528 32.596 1.00 51.03 C ATOM 0 HA PRO A 37 16.925 0.385 31.632 1.00 11.53 H new ATOM 0 HB2 PRO A 37 16.183 -1.678 33.338 1.00 4.24 H new ATOM 0 HB3 PRO A 37 16.303 -0.031 33.925 1.00 4.24 H new ATOM 0 HG2 PRO A 37 13.854 -1.566 33.082 1.00 73.45 H new ATOM 0 HG3 PRO A 37 14.068 -0.508 34.462 1.00 73.45 H new ATOM 0 HD2 PRO A 37 12.818 0.339 32.196 1.00 51.03 H new ATOM 0 HD3 PRO A 37 13.751 1.438 33.193 1.00 51.03 H new ATOM 608 N LEU A 38 14.958 -1.960 30.506 1.00 15.22 N ATOM 609 CA LEU A 38 14.916 -3.100 29.597 1.00 31.01 C ATOM 610 C LEU A 38 15.045 -2.645 28.147 1.00 72.21 C ATOM 611 O LEU A 38 15.121 -3.466 27.232 1.00 41.20 O ATOM 612 CB LEU A 38 13.614 -3.880 29.785 1.00 15.01 C ATOM 613 CG LEU A 38 13.547 -5.248 29.106 1.00 33.41 C ATOM 614 CD1 LEU A 38 13.803 -6.358 30.114 1.00 12.34 C ATOM 615 CD2 LEU A 38 12.198 -5.442 28.428 1.00 21.23 C ATOM 0 H LEU A 38 14.049 -1.682 30.875 1.00 15.22 H new ATOM 0 HA LEU A 38 15.759 -3.751 29.831 1.00 31.01 H new ATOM 0 HB2 LEU A 38 13.448 -4.018 30.853 1.00 15.01 H new ATOM 0 HB3 LEU A 38 12.791 -3.270 29.411 1.00 15.01 H new ATOM 0 HG LEU A 38 14.324 -5.291 28.343 1.00 33.41 H new ATOM 0 HD11 LEU A 38 13.751 -7.324 29.612 1.00 12.34 H new ATOM 0 HD12 LEU A 38 14.792 -6.230 30.553 1.00 12.34 H new ATOM 0 HD13 LEU A 38 13.049 -6.317 30.900 1.00 12.34 H new ATOM 0 HD21 LEU A 38 12.168 -6.421 27.950 1.00 21.23 H new ATOM 0 HD22 LEU A 38 11.404 -5.377 29.172 1.00 21.23 H new ATOM 0 HD23 LEU A 38 12.054 -4.667 27.676 1.00 21.23 H new ATOM 627 N CYS A 39 15.071 -1.332 27.944 1.00 35.21 N ATOM 628 CA CYS A 39 15.192 -0.767 26.606 1.00 44.21 C ATOM 629 C CYS A 39 16.554 -0.104 26.417 1.00 13.34 C ATOM 630 O CYS A 39 17.277 -0.405 25.467 1.00 41.51 O ATOM 631 CB CYS A 39 14.078 0.251 26.356 1.00 11.22 C ATOM 632 SG CYS A 39 12.426 -0.311 26.880 1.00 3.24 S ATOM 0 H CYS A 39 15.010 -0.639 28.690 1.00 35.21 H new ATOM 0 HA CYS A 39 15.100 -1.580 25.886 1.00 44.21 H new ATOM 0 HB2 CYS A 39 14.320 1.175 26.882 1.00 11.22 H new ATOM 0 HB3 CYS A 39 14.049 0.488 25.292 1.00 11.22 H new ATOM 637 N LEU A 40 16.897 0.800 27.329 1.00 34.30 N ATOM 638 CA LEU A 40 18.171 1.506 27.264 1.00 3.25 C ATOM 639 C LEU A 40 19.338 0.524 27.239 1.00 33.43 C ATOM 640 O LEU A 40 20.310 0.717 26.509 1.00 12.13 O ATOM 641 CB LEU A 40 18.313 2.453 28.457 1.00 0.14 C ATOM 642 CG LEU A 40 18.185 3.945 28.149 1.00 42.33 C ATOM 643 CD1 LEU A 40 18.452 4.773 29.396 1.00 3.22 C ATOM 644 CD2 LEU A 40 19.137 4.342 27.029 1.00 31.24 C ATOM 0 H LEU A 40 16.310 1.061 28.122 1.00 34.30 H new ATOM 0 HA LEU A 40 18.189 2.087 26.342 1.00 3.25 H new ATOM 0 HB2 LEU A 40 17.557 2.189 29.197 1.00 0.14 H new ATOM 0 HB3 LEU A 40 19.285 2.280 28.919 1.00 0.14 H new ATOM 0 HG LEU A 40 17.165 4.142 27.819 1.00 42.33 H new ATOM 0 HD11 LEU A 40 18.356 5.832 29.157 1.00 3.22 H new ATOM 0 HD12 LEU A 40 17.731 4.509 30.169 1.00 3.22 H new ATOM 0 HD13 LEU A 40 19.461 4.572 29.757 1.00 3.22 H new ATOM 0 HD21 LEU A 40 19.032 5.407 26.823 1.00 31.24 H new ATOM 0 HD22 LEU A 40 20.163 4.130 27.331 1.00 31.24 H new ATOM 0 HD23 LEU A 40 18.898 3.774 26.130 1.00 31.24 H new ATOM 656 N SER A 41 19.233 -0.532 28.040 1.00 72.20 N ATOM 657 CA SER A 41 20.280 -1.545 28.111 1.00 53.22 C ATOM 658 C SER A 41 20.225 -2.468 26.898 1.00 61.43 C ATOM 659 O SER A 41 21.180 -3.190 26.611 1.00 54.01 O ATOM 660 CB SER A 41 20.141 -2.363 29.396 1.00 73.42 C ATOM 661 OG SER A 41 20.164 -1.526 30.539 1.00 71.11 O ATOM 0 H SER A 41 18.434 -0.708 28.649 1.00 72.20 H new ATOM 0 HA SER A 41 21.244 -1.037 28.115 1.00 53.22 H new ATOM 0 HB2 SER A 41 19.208 -2.926 29.373 1.00 73.42 H new ATOM 0 HB3 SER A 41 20.951 -3.090 29.457 1.00 73.42 H new ATOM 0 HG SER A 41 19.246 -1.332 30.821 1.00 71.11 H new ATOM 667 N GLU A 42 19.100 -2.439 26.190 1.00 63.14 N ATOM 668 CA GLU A 42 18.921 -3.274 25.008 1.00 75.31 C ATOM 669 C GLU A 42 19.398 -2.551 23.752 1.00 4.53 C ATOM 670 O GLU A 42 19.427 -3.125 22.663 1.00 20.53 O ATOM 671 CB GLU A 42 17.450 -3.669 24.854 1.00 42.11 C ATOM 672 CG GLU A 42 17.143 -5.075 25.341 1.00 0.25 C ATOM 673 CD GLU A 42 16.283 -5.855 24.367 1.00 72.42 C ATOM 674 OE1 GLU A 42 16.474 -5.690 23.144 1.00 54.43 O ATOM 675 OE2 GLU A 42 15.419 -6.631 24.826 1.00 22.34 O ATOM 0 H GLU A 42 18.300 -1.847 26.414 1.00 63.14 H new ATOM 0 HA GLU A 42 19.521 -4.175 25.137 1.00 75.31 H new ATOM 0 HB2 GLU A 42 16.833 -2.960 25.405 1.00 42.11 H new ATOM 0 HB3 GLU A 42 17.169 -3.588 23.804 1.00 42.11 H new ATOM 0 HG2 GLU A 42 18.078 -5.611 25.504 1.00 0.25 H new ATOM 0 HG3 GLU A 42 16.635 -5.019 26.304 1.00 0.25 H new ATOM 682 N LEU A 43 19.772 -1.286 23.912 1.00 43.10 N ATOM 683 CA LEU A 43 20.249 -0.482 22.792 1.00 50.30 C ATOM 684 C LEU A 43 21.307 -1.235 21.992 1.00 2.13 C ATOM 685 O LEU A 43 21.121 -1.519 20.810 1.00 42.52 O ATOM 686 CB LEU A 43 20.822 0.843 23.297 1.00 4.25 C ATOM 687 CG LEU A 43 19.915 2.066 23.154 1.00 62.35 C ATOM 688 CD1 LEU A 43 18.494 1.729 23.577 1.00 21.44 C ATOM 689 CD2 LEU A 43 20.456 3.230 23.971 1.00 55.01 C ATOM 0 H LEU A 43 19.754 -0.795 24.806 1.00 43.10 H new ATOM 0 HA LEU A 43 19.402 -0.278 22.137 1.00 50.30 H new ATOM 0 HB2 LEU A 43 21.078 0.727 24.350 1.00 4.25 H new ATOM 0 HB3 LEU A 43 21.751 1.041 22.763 1.00 4.25 H new ATOM 0 HG LEU A 43 19.899 2.362 22.105 1.00 62.35 H new ATOM 0 HD11 LEU A 43 17.863 2.611 23.468 1.00 21.44 H new ATOM 0 HD12 LEU A 43 18.108 0.927 22.948 1.00 21.44 H new ATOM 0 HD13 LEU A 43 18.491 1.407 24.618 1.00 21.44 H new ATOM 0 HD21 LEU A 43 19.798 4.091 23.857 1.00 55.01 H new ATOM 0 HD22 LEU A 43 20.503 2.946 25.022 1.00 55.01 H new ATOM 0 HD23 LEU A 43 21.455 3.488 23.620 1.00 55.01 H new ATOM 701 N GLY A 44 22.418 -1.558 22.648 1.00 43.05 N ATOM 702 CA GLY A 44 23.489 -2.277 21.983 1.00 60.34 C ATOM 703 C GLY A 44 23.007 -3.553 21.321 1.00 20.34 C ATOM 704 O GLY A 44 23.364 -3.840 20.179 1.00 32.32 O ATOM 0 H GLY A 44 22.595 -1.335 23.627 1.00 43.05 H new ATOM 0 HA2 GLY A 44 23.944 -1.631 21.232 1.00 60.34 H new ATOM 0 HA3 GLY A 44 24.266 -2.519 22.709 1.00 60.34 H new ATOM 708 N GLN A 45 22.196 -4.321 22.042 1.00 74.13 N ATOM 709 CA GLN A 45 21.667 -5.575 21.518 1.00 54.11 C ATOM 710 C GLN A 45 21.007 -5.362 20.159 1.00 30.14 C ATOM 711 O GLN A 45 21.349 -6.026 19.180 1.00 51.42 O ATOM 712 CB GLN A 45 20.659 -6.177 22.499 1.00 50.03 C ATOM 713 CG GLN A 45 19.852 -7.325 21.914 1.00 51.33 C ATOM 714 CD GLN A 45 19.238 -8.210 22.981 1.00 41.25 C ATOM 715 OE1 GLN A 45 19.948 -8.831 23.772 1.00 11.12 O ATOM 716 NE2 GLN A 45 17.912 -8.272 23.008 1.00 71.15 N ATOM 0 H GLN A 45 21.891 -4.097 22.989 1.00 74.13 H new ATOM 0 HA GLN A 45 22.500 -6.267 21.393 1.00 54.11 H new ATOM 0 HB2 GLN A 45 21.191 -6.531 23.382 1.00 50.03 H new ATOM 0 HB3 GLN A 45 19.976 -5.395 22.830 1.00 50.03 H new ATOM 0 HG2 GLN A 45 19.061 -6.923 21.282 1.00 51.33 H new ATOM 0 HG3 GLN A 45 20.496 -7.928 21.274 1.00 51.33 H new ATOM 0 HE21 GLN A 45 17.363 -7.740 22.333 1.00 71.15 H new ATOM 0 HE22 GLN A 45 17.443 -8.851 23.704 1.00 71.15 H new ATOM 725 N THR A 46 20.058 -4.432 20.107 1.00 63.13 N ATOM 726 CA THR A 46 19.349 -4.133 18.869 1.00 45.30 C ATOM 727 C THR A 46 20.298 -3.576 17.813 1.00 13.02 C ATOM 728 O THR A 46 20.181 -3.896 16.631 1.00 71.31 O ATOM 729 CB THR A 46 18.211 -3.122 19.104 1.00 72.30 C ATOM 730 OG1 THR A 46 17.334 -3.602 20.129 1.00 32.32 O ATOM 731 CG2 THR A 46 17.423 -2.888 17.824 1.00 14.12 C ATOM 0 H THR A 46 19.763 -3.873 20.908 1.00 63.13 H new ATOM 0 HA THR A 46 18.924 -5.072 18.513 1.00 45.30 H new ATOM 0 HB THR A 46 18.653 -2.176 19.418 1.00 72.30 H new ATOM 0 HG1 THR A 46 17.790 -3.560 20.996 1.00 32.32 H new ATOM 0 HG21 THR A 46 16.625 -2.171 18.014 1.00 14.12 H new ATOM 0 HG22 THR A 46 18.088 -2.496 17.054 1.00 14.12 H new ATOM 0 HG23 THR A 46 16.991 -3.830 17.485 1.00 14.12 H new ATOM 739 N GLU A 47 21.237 -2.741 18.249 1.00 75.55 N ATOM 740 CA GLU A 47 22.205 -2.141 17.339 1.00 51.41 C ATOM 741 C GLU A 47 22.885 -3.208 16.486 1.00 2.41 C ATOM 742 O GLU A 47 23.262 -2.957 15.341 1.00 4.22 O ATOM 743 CB GLU A 47 23.256 -1.353 18.125 1.00 72.54 C ATOM 744 CG GLU A 47 24.516 -1.058 17.328 1.00 13.34 C ATOM 745 CD GLU A 47 25.049 0.339 17.578 1.00 3.55 C ATOM 746 OE1 GLU A 47 24.514 1.296 16.980 1.00 35.35 O ATOM 747 OE2 GLU A 47 26.003 0.476 18.373 1.00 1.11 O ATOM 0 H GLU A 47 21.347 -2.466 19.225 1.00 75.55 H new ATOM 0 HA GLU A 47 21.670 -1.460 16.678 1.00 51.41 H new ATOM 0 HB2 GLU A 47 22.818 -0.412 18.459 1.00 72.54 H new ATOM 0 HB3 GLU A 47 23.525 -1.914 19.020 1.00 72.54 H new ATOM 0 HG2 GLU A 47 25.284 -1.788 17.586 1.00 13.34 H new ATOM 0 HG3 GLU A 47 24.306 -1.178 16.265 1.00 13.34 H new ATOM 754 N LYS A 48 23.039 -4.400 17.053 1.00 45.44 N ATOM 755 CA LYS A 48 23.673 -5.507 16.346 1.00 2.33 C ATOM 756 C LYS A 48 22.657 -6.264 15.498 1.00 34.22 C ATOM 757 O LYS A 48 22.968 -6.716 14.396 1.00 33.02 O ATOM 758 CB LYS A 48 24.335 -6.462 17.342 1.00 1.32 C ATOM 759 CG LYS A 48 25.146 -5.756 18.415 1.00 42.31 C ATOM 760 CD LYS A 48 26.456 -6.476 18.688 1.00 42.52 C ATOM 761 CE LYS A 48 26.221 -7.845 19.307 1.00 44.14 C ATOM 762 NZ LYS A 48 26.203 -8.922 18.279 1.00 74.33 N ATOM 0 H LYS A 48 22.733 -4.624 18.000 1.00 45.44 H new ATOM 0 HA LYS A 48 24.436 -5.095 15.685 1.00 2.33 H new ATOM 0 HB2 LYS A 48 23.564 -7.067 17.820 1.00 1.32 H new ATOM 0 HB3 LYS A 48 24.986 -7.147 16.798 1.00 1.32 H new ATOM 0 HG2 LYS A 48 25.351 -4.732 18.103 1.00 42.31 H new ATOM 0 HG3 LYS A 48 24.563 -5.698 19.334 1.00 42.31 H new ATOM 0 HD2 LYS A 48 27.012 -6.587 17.757 1.00 42.52 H new ATOM 0 HD3 LYS A 48 27.071 -5.874 19.357 1.00 42.52 H new ATOM 0 HE2 LYS A 48 27.003 -8.053 20.037 1.00 44.14 H new ATOM 0 HE3 LYS A 48 25.274 -7.842 19.847 1.00 44.14 H new ATOM 0 HZ1 LYS A 48 26.593 -9.796 18.685 1.00 74.33 H new ATOM 0 HZ2 LYS A 48 25.224 -9.090 17.970 1.00 74.33 H new ATOM 0 HZ3 LYS A 48 26.779 -8.633 17.463 1.00 74.33 H new ATOM 776 N TRP A 49 21.442 -6.398 16.018 1.00 11.31 N ATOM 777 CA TRP A 49 20.379 -7.099 15.307 1.00 62.40 C ATOM 778 C TRP A 49 20.190 -6.526 13.907 1.00 1.41 C ATOM 779 O TRP A 49 20.146 -7.265 12.924 1.00 1.13 O ATOM 780 CB TRP A 49 19.068 -7.010 16.090 1.00 42.23 C ATOM 781 CG TRP A 49 19.044 -7.881 17.309 1.00 13.21 C ATOM 782 CD1 TRP A 49 20.110 -8.500 17.896 1.00 45.41 C ATOM 783 CD2 TRP A 49 17.895 -8.231 18.089 1.00 4.02 C ATOM 784 NE1 TRP A 49 19.694 -9.213 18.994 1.00 64.31 N ATOM 785 CE2 TRP A 49 18.340 -9.064 19.134 1.00 21.15 C ATOM 786 CE3 TRP A 49 16.535 -7.920 18.008 1.00 64.31 C ATOM 787 CZ2 TRP A 49 17.472 -9.589 20.088 1.00 71.31 C ATOM 788 CZ3 TRP A 49 15.675 -8.443 18.955 1.00 40.42 C ATOM 789 CH2 TRP A 49 16.146 -9.269 19.984 1.00 14.10 C ATOM 0 H TRP A 49 21.169 -6.030 16.929 1.00 11.31 H new ATOM 0 HA TRP A 49 20.668 -8.146 15.214 1.00 62.40 H new ATOM 0 HB2 TRP A 49 18.901 -5.975 16.388 1.00 42.23 H new ATOM 0 HB3 TRP A 49 18.243 -7.290 15.436 1.00 42.23 H new ATOM 0 HD1 TRP A 49 21.131 -8.438 17.548 1.00 45.41 H new ATOM 0 HE1 TRP A 49 20.296 -9.764 19.606 1.00 64.31 H new ATOM 0 HE3 TRP A 49 16.163 -7.283 17.220 1.00 64.31 H new ATOM 0 HZ2 TRP A 49 17.833 -10.226 20.882 1.00 71.31 H new ATOM 0 HZ3 TRP A 49 14.622 -8.211 18.901 1.00 40.42 H new ATOM 0 HH2 TRP A 49 15.448 -9.661 20.709 1.00 14.10 H new ATOM 800 N ALA A 50 20.079 -5.204 13.824 1.00 40.11 N ATOM 801 CA ALA A 50 19.897 -4.532 12.543 1.00 10.34 C ATOM 802 C ALA A 50 21.084 -4.781 11.619 1.00 52.11 C ATOM 803 O ALA A 50 21.016 -4.509 10.421 1.00 51.33 O ATOM 804 CB ALA A 50 19.695 -3.039 12.755 1.00 12.42 C ATOM 0 H ALA A 50 20.112 -4.578 14.628 1.00 40.11 H new ATOM 0 HA ALA A 50 19.007 -4.944 12.067 1.00 10.34 H new ATOM 0 HB1 ALA A 50 19.560 -2.549 11.790 1.00 12.42 H new ATOM 0 HB2 ALA A 50 18.811 -2.875 13.372 1.00 12.42 H new ATOM 0 HB3 ALA A 50 20.569 -2.621 13.255 1.00 12.42 H new ATOM 810 N GLN A 51 22.170 -5.299 12.184 1.00 54.10 N ATOM 811 CA GLN A 51 23.372 -5.583 11.409 1.00 12.23 C ATOM 812 C GLN A 51 23.583 -7.086 11.263 1.00 20.14 C ATOM 813 O GLN A 51 24.464 -7.531 10.527 1.00 3.55 O ATOM 814 CB GLN A 51 24.594 -4.946 12.073 1.00 20.12 C ATOM 815 CG GLN A 51 24.535 -3.428 12.128 1.00 70.10 C ATOM 816 CD GLN A 51 25.132 -2.776 10.896 1.00 31.04 C ATOM 817 OE1 GLN A 51 24.531 -2.785 9.822 1.00 73.32 O ATOM 818 NE2 GLN A 51 26.321 -2.205 11.046 1.00 2.33 N ATOM 0 H GLN A 51 22.242 -5.530 13.175 1.00 54.10 H new ATOM 0 HA GLN A 51 23.243 -5.155 10.415 1.00 12.23 H new ATOM 0 HB2 GLN A 51 24.690 -5.334 13.087 1.00 20.12 H new ATOM 0 HB3 GLN A 51 25.490 -5.247 11.530 1.00 20.12 H new ATOM 0 HG2 GLN A 51 23.497 -3.112 12.235 1.00 70.10 H new ATOM 0 HG3 GLN A 51 25.067 -3.079 13.013 1.00 70.10 H new ATOM 0 HE21 GLN A 51 26.783 -2.221 11.955 1.00 2.33 H new ATOM 0 HE22 GLN A 51 26.772 -1.750 10.252 1.00 2.33 H new ATOM 827 N ASP A 52 22.770 -7.864 11.969 1.00 15.10 N ATOM 828 CA ASP A 52 22.867 -9.318 11.918 1.00 72.14 C ATOM 829 C ASP A 52 22.535 -9.836 10.522 1.00 53.13 C ATOM 830 O ASP A 52 21.463 -9.557 9.984 1.00 23.43 O ATOM 831 CB ASP A 52 21.928 -9.950 12.946 1.00 13.03 C ATOM 832 CG ASP A 52 22.483 -11.237 13.524 1.00 43.12 C ATOM 833 OD1 ASP A 52 23.700 -11.287 13.801 1.00 43.43 O ATOM 834 OD2 ASP A 52 21.701 -12.194 13.700 1.00 61.13 O ATOM 0 H ASP A 52 22.036 -7.512 12.584 1.00 15.10 H new ATOM 0 HA ASP A 52 23.894 -9.597 12.155 1.00 72.14 H new ATOM 0 HB2 ASP A 52 21.748 -9.240 13.754 1.00 13.03 H new ATOM 0 HB3 ASP A 52 20.964 -10.151 12.478 1.00 13.03 H new ATOM 839 N ALA A 53 23.462 -10.590 9.940 1.00 54.02 N ATOM 840 CA ALA A 53 23.267 -11.147 8.607 1.00 31.31 C ATOM 841 C ALA A 53 21.962 -11.932 8.525 1.00 14.53 C ATOM 842 O ALA A 53 21.294 -11.940 7.491 1.00 14.31 O ATOM 843 CB ALA A 53 24.443 -12.036 8.230 1.00 41.44 C ATOM 0 H ALA A 53 24.355 -10.829 10.371 1.00 54.02 H new ATOM 0 HA ALA A 53 23.208 -10.320 7.900 1.00 31.31 H new ATOM 0 HB1 ALA A 53 24.284 -12.445 7.232 1.00 41.44 H new ATOM 0 HB2 ALA A 53 25.361 -11.448 8.239 1.00 41.44 H new ATOM 0 HB3 ALA A 53 24.527 -12.852 8.948 1.00 41.44 H new ATOM 849 N LYS A 54 21.603 -12.591 9.622 1.00 44.02 N ATOM 850 CA LYS A 54 20.377 -13.379 9.675 1.00 5.43 C ATOM 851 C LYS A 54 19.149 -12.477 9.614 1.00 74.15 C ATOM 852 O LYS A 54 18.086 -12.890 9.147 1.00 5.21 O ATOM 853 CB LYS A 54 20.343 -14.219 10.954 1.00 74.45 C ATOM 854 CG LYS A 54 20.948 -15.603 10.788 1.00 12.33 C ATOM 855 CD LYS A 54 19.993 -16.548 10.079 1.00 32.22 C ATOM 856 CE LYS A 54 19.035 -17.211 11.058 1.00 42.42 C ATOM 857 NZ LYS A 54 19.610 -18.455 11.639 1.00 34.34 N ATOM 0 H LYS A 54 22.144 -12.595 10.487 1.00 44.02 H new ATOM 0 HA LYS A 54 20.362 -14.043 8.811 1.00 5.43 H new ATOM 0 HB2 LYS A 54 20.879 -13.689 11.741 1.00 74.45 H new ATOM 0 HB3 LYS A 54 19.309 -14.321 11.285 1.00 74.45 H new ATOM 0 HG2 LYS A 54 21.876 -15.530 10.221 1.00 12.33 H new ATOM 0 HG3 LYS A 54 21.203 -16.009 11.767 1.00 12.33 H new ATOM 0 HD2 LYS A 54 19.425 -15.998 9.329 1.00 32.22 H new ATOM 0 HD3 LYS A 54 20.562 -17.313 9.550 1.00 32.22 H new ATOM 0 HE2 LYS A 54 18.794 -16.513 11.860 1.00 42.42 H new ATOM 0 HE3 LYS A 54 18.100 -17.446 10.549 1.00 42.42 H new ATOM 0 HZ1 LYS A 54 18.927 -18.877 12.301 1.00 34.34 H new ATOM 0 HZ2 LYS A 54 19.816 -19.131 10.876 1.00 34.34 H new ATOM 0 HZ3 LYS A 54 20.489 -18.227 12.147 1.00 34.34 H new ATOM 871 N PHE A 55 19.300 -11.244 10.086 1.00 64.25 N ATOM 872 CA PHE A 55 18.203 -10.284 10.083 1.00 33.22 C ATOM 873 C PHE A 55 18.022 -9.669 8.699 1.00 55.52 C ATOM 874 O PHE A 55 17.041 -8.970 8.442 1.00 71.43 O ATOM 875 CB PHE A 55 18.458 -9.183 11.114 1.00 3.31 C ATOM 876 CG PHE A 55 17.694 -9.370 12.393 1.00 14.23 C ATOM 877 CD1 PHE A 55 16.308 -9.347 12.397 1.00 2.53 C ATOM 878 CD2 PHE A 55 18.360 -9.569 13.591 1.00 21.44 C ATOM 879 CE1 PHE A 55 15.602 -9.518 13.573 1.00 3.42 C ATOM 880 CE2 PHE A 55 17.659 -9.742 14.770 1.00 5.45 C ATOM 881 CZ PHE A 55 16.279 -9.717 14.761 1.00 53.41 C ATOM 0 H PHE A 55 20.172 -10.886 10.476 1.00 64.25 H new ATOM 0 HA PHE A 55 17.288 -10.815 10.347 1.00 33.22 H new ATOM 0 HB2 PHE A 55 19.524 -9.147 11.339 1.00 3.31 H new ATOM 0 HB3 PHE A 55 18.191 -8.220 10.679 1.00 3.31 H new ATOM 0 HD1 PHE A 55 15.774 -9.194 11.471 1.00 2.53 H new ATOM 0 HD2 PHE A 55 19.440 -9.589 13.604 1.00 21.44 H new ATOM 0 HE1 PHE A 55 14.522 -9.496 13.563 1.00 3.42 H new ATOM 0 HE2 PHE A 55 18.191 -9.897 15.697 1.00 5.45 H new ATOM 0 HZ PHE A 55 15.729 -9.853 15.681 1.00 53.41 H new ATOM 891 N SER A 56 18.975 -9.932 7.811 1.00 30.31 N ATOM 892 CA SER A 56 18.924 -9.401 6.454 1.00 70.10 C ATOM 893 C SER A 56 17.617 -9.788 5.768 1.00 63.11 C ATOM 894 O SER A 56 17.188 -9.138 4.815 1.00 74.10 O ATOM 895 CB SER A 56 20.113 -9.913 5.638 1.00 34.32 C ATOM 896 OG SER A 56 19.948 -11.279 5.300 1.00 61.43 O ATOM 0 H SER A 56 19.792 -10.510 8.007 1.00 30.31 H new ATOM 0 HA SER A 56 18.975 -8.314 6.513 1.00 70.10 H new ATOM 0 HB2 SER A 56 20.217 -9.320 4.729 1.00 34.32 H new ATOM 0 HB3 SER A 56 21.032 -9.785 6.209 1.00 34.32 H new ATOM 0 HG SER A 56 20.233 -11.839 6.052 1.00 61.43 H new ATOM 902 N SER A 57 16.990 -10.852 6.260 1.00 2.32 N ATOM 903 CA SER A 57 15.734 -11.329 5.693 1.00 4.12 C ATOM 904 C SER A 57 14.605 -10.340 5.966 1.00 32.30 C ATOM 905 O SER A 57 13.619 -10.290 5.232 1.00 53.34 O ATOM 906 CB SER A 57 15.378 -12.700 6.271 1.00 50.02 C ATOM 907 OG SER A 57 14.662 -12.571 7.487 1.00 5.31 O ATOM 0 H SER A 57 17.331 -11.400 7.050 1.00 2.32 H new ATOM 0 HA SER A 57 15.861 -11.419 4.614 1.00 4.12 H new ATOM 0 HB2 SER A 57 14.780 -13.258 5.550 1.00 50.02 H new ATOM 0 HB3 SER A 57 16.289 -13.274 6.441 1.00 50.02 H new ATOM 0 HG SER A 57 13.946 -13.239 7.517 1.00 5.31 H new ATOM 913 N ALA A 58 14.757 -9.556 7.028 1.00 1.10 N ATOM 914 CA ALA A 58 13.752 -8.567 7.398 1.00 70.31 C ATOM 915 C ALA A 58 14.392 -7.362 8.078 1.00 11.22 C ATOM 916 O ALA A 58 15.088 -7.501 9.083 1.00 61.52 O ATOM 917 CB ALA A 58 12.705 -9.194 8.306 1.00 15.13 C ATOM 0 H ALA A 58 15.567 -9.587 7.648 1.00 1.10 H new ATOM 0 HA ALA A 58 13.266 -8.220 6.486 1.00 70.31 H new ATOM 0 HB1 ALA A 58 11.961 -8.444 8.575 1.00 15.13 H new ATOM 0 HB2 ALA A 58 12.218 -10.018 7.785 1.00 15.13 H new ATOM 0 HB3 ALA A 58 13.185 -9.569 9.210 1.00 15.13 H new ATOM 923 N ASN A 59 14.152 -6.178 7.523 1.00 34.32 N ATOM 924 CA ASN A 59 14.706 -4.948 8.076 1.00 30.04 C ATOM 925 C ASN A 59 14.322 -4.790 9.544 1.00 32.25 C ATOM 926 O ASN A 59 13.277 -5.276 9.980 1.00 22.31 O ATOM 927 CB ASN A 59 14.217 -3.739 7.277 1.00 53.22 C ATOM 928 CG ASN A 59 14.262 -3.979 5.780 1.00 4.40 C ATOM 929 OD1 ASN A 59 13.330 -3.630 5.056 1.00 60.14 O ATOM 930 ND2 ASN A 59 15.351 -4.577 5.310 1.00 53.12 N ATOM 0 H ASN A 59 13.578 -6.045 6.691 1.00 34.32 H new ATOM 0 HA ASN A 59 15.792 -5.006 8.007 1.00 30.04 H new ATOM 0 HB2 ASN A 59 13.196 -3.500 7.573 1.00 53.22 H new ATOM 0 HB3 ASN A 59 14.831 -2.872 7.522 1.00 53.22 H new ATOM 0 HD21 ASN A 59 15.439 -4.764 4.311 1.00 53.12 H new ATOM 0 HD22 ASN A 59 16.099 -4.849 5.948 1.00 53.12 H new ATOM 937 N LEU A 60 15.172 -4.107 10.303 1.00 64.24 N ATOM 938 CA LEU A 60 14.923 -3.884 11.722 1.00 35.05 C ATOM 939 C LEU A 60 15.372 -2.488 12.142 1.00 50.04 C ATOM 940 O LEU A 60 16.534 -2.121 11.966 1.00 2.14 O ATOM 941 CB LEU A 60 15.648 -4.939 12.560 1.00 11.41 C ATOM 942 CG LEU A 60 15.074 -5.201 13.953 1.00 52.21 C ATOM 943 CD1 LEU A 60 15.727 -6.424 14.578 1.00 2.50 C ATOM 944 CD2 LEU A 60 15.258 -3.981 14.844 1.00 62.11 C ATOM 0 H LEU A 60 16.041 -3.698 9.958 1.00 64.24 H new ATOM 0 HA LEU A 60 13.850 -3.967 11.894 1.00 35.05 H new ATOM 0 HB2 LEU A 60 15.647 -5.878 12.006 1.00 11.41 H new ATOM 0 HB3 LEU A 60 16.689 -4.635 12.669 1.00 11.41 H new ATOM 0 HG LEU A 60 14.006 -5.396 13.854 1.00 52.21 H new ATOM 0 HD11 LEU A 60 15.306 -6.595 15.569 1.00 2.50 H new ATOM 0 HD12 LEU A 60 15.543 -7.296 13.950 1.00 2.50 H new ATOM 0 HD13 LEU A 60 16.801 -6.259 14.664 1.00 2.50 H new ATOM 0 HD21 LEU A 60 14.844 -4.186 15.831 1.00 62.11 H new ATOM 0 HD22 LEU A 60 16.320 -3.755 14.936 1.00 62.11 H new ATOM 0 HD23 LEU A 60 14.742 -3.128 14.404 1.00 62.11 H new ATOM 956 N ILE A 61 14.445 -1.716 12.697 1.00 13.53 N ATOM 957 CA ILE A 61 14.747 -0.361 13.144 1.00 33.54 C ATOM 958 C ILE A 61 13.975 -0.017 14.413 1.00 12.45 C ATOM 959 O ILE A 61 12.955 -0.634 14.721 1.00 74.21 O ATOM 960 CB ILE A 61 14.415 0.678 12.057 1.00 22.40 C ATOM 961 CG1 ILE A 61 12.929 0.617 11.699 1.00 71.31 C ATOM 962 CG2 ILE A 61 15.273 0.444 10.822 1.00 1.34 C ATOM 963 CD1 ILE A 61 12.343 1.959 11.323 1.00 54.44 C ATOM 0 H ILE A 61 13.478 -2.005 12.848 1.00 13.53 H new ATOM 0 HA ILE A 61 15.817 -0.328 13.351 1.00 33.54 H new ATOM 0 HB ILE A 61 14.635 1.672 12.446 1.00 22.40 H new ATOM 0 HG12 ILE A 61 12.792 -0.076 10.869 1.00 71.31 H new ATOM 0 HG13 ILE A 61 12.376 0.213 12.547 1.00 71.31 H new ATOM 0 HG21 ILE A 61 15.027 1.186 10.062 1.00 1.34 H new ATOM 0 HG22 ILE A 61 16.326 0.533 11.089 1.00 1.34 H new ATOM 0 HG23 ILE A 61 15.081 -0.555 10.429 1.00 1.34 H new ATOM 0 HD11 ILE A 61 11.287 1.840 11.082 1.00 54.44 H new ATOM 0 HD12 ILE A 61 12.448 2.649 12.160 1.00 54.44 H new ATOM 0 HD13 ILE A 61 12.871 2.356 10.456 1.00 54.44 H new ATOM 975 N THR A 62 14.467 0.976 15.148 1.00 43.20 N ATOM 976 CA THR A 62 13.824 1.405 16.384 1.00 62.44 C ATOM 977 C THR A 62 13.114 2.741 16.199 1.00 32.31 C ATOM 978 O THR A 62 13.293 3.416 15.185 1.00 34.51 O ATOM 979 CB THR A 62 14.843 1.532 17.532 1.00 13.01 C ATOM 980 OG1 THR A 62 15.532 2.783 17.439 1.00 44.43 O ATOM 981 CG2 THR A 62 15.847 0.390 17.494 1.00 33.23 C ATOM 0 H THR A 62 15.310 1.498 14.908 1.00 43.20 H new ATOM 0 HA THR A 62 13.091 0.640 16.642 1.00 62.44 H new ATOM 0 HB THR A 62 14.300 1.486 18.476 1.00 13.01 H new ATOM 0 HG1 THR A 62 15.996 2.838 16.578 1.00 44.43 H new ATOM 0 HG21 THR A 62 16.556 0.502 18.314 1.00 33.23 H new ATOM 0 HG22 THR A 62 15.322 -0.560 17.595 1.00 33.23 H new ATOM 0 HG23 THR A 62 16.384 0.409 16.545 1.00 33.23 H new ATOM 989 N VAL A 63 12.307 3.118 17.186 1.00 42.10 N ATOM 990 CA VAL A 63 11.571 4.375 17.133 1.00 52.40 C ATOM 991 C VAL A 63 11.398 4.970 18.526 1.00 42.30 C ATOM 992 O VAL A 63 11.080 4.261 19.480 1.00 71.01 O ATOM 993 CB VAL A 63 10.183 4.186 16.492 1.00 41.31 C ATOM 994 CG1 VAL A 63 9.462 5.521 16.375 1.00 23.34 C ATOM 995 CG2 VAL A 63 10.312 3.520 15.130 1.00 30.05 C ATOM 0 H VAL A 63 12.147 2.571 18.032 1.00 42.10 H new ATOM 0 HA VAL A 63 12.157 5.059 16.519 1.00 52.40 H new ATOM 0 HB VAL A 63 9.591 3.535 17.135 1.00 41.31 H new ATOM 0 HG11 VAL A 63 8.483 5.367 15.920 1.00 23.34 H new ATOM 0 HG12 VAL A 63 9.337 5.955 17.367 1.00 23.34 H new ATOM 0 HG13 VAL A 63 10.049 6.198 15.754 1.00 23.34 H new ATOM 0 HG21 VAL A 63 9.322 3.394 14.691 1.00 30.05 H new ATOM 0 HG22 VAL A 63 10.922 4.144 14.476 1.00 30.05 H new ATOM 0 HG23 VAL A 63 10.785 2.545 15.245 1.00 30.05 H new ATOM 1005 N ALA A 64 11.610 6.278 18.635 1.00 20.34 N ATOM 1006 CA ALA A 64 11.475 6.969 19.911 1.00 5.25 C ATOM 1007 C ALA A 64 10.321 7.965 19.877 1.00 5.50 C ATOM 1008 O ALA A 64 10.058 8.590 18.849 1.00 21.52 O ATOM 1009 CB ALA A 64 12.775 7.676 20.268 1.00 32.24 C ATOM 0 H ALA A 64 11.876 6.879 17.855 1.00 20.34 H new ATOM 0 HA ALA A 64 11.256 6.226 20.677 1.00 5.25 H new ATOM 0 HB1 ALA A 64 12.660 8.188 21.223 1.00 32.24 H new ATOM 0 HB2 ALA A 64 13.579 6.944 20.343 1.00 32.24 H new ATOM 0 HB3 ALA A 64 13.018 8.403 19.493 1.00 32.24 H new ATOM 1015 N SER A 65 9.636 8.109 21.007 1.00 52.24 N ATOM 1016 CA SER A 65 8.507 9.027 21.104 1.00 33.30 C ATOM 1017 C SER A 65 8.858 10.231 21.972 1.00 25.24 C ATOM 1018 O SER A 65 8.608 10.254 23.178 1.00 74.24 O ATOM 1019 CB SER A 65 7.286 8.307 21.680 1.00 12.14 C ATOM 1020 OG SER A 65 7.479 6.903 21.691 1.00 50.35 O ATOM 0 H SER A 65 9.843 7.602 21.868 1.00 52.24 H new ATOM 0 HA SER A 65 8.272 9.382 20.101 1.00 33.30 H new ATOM 0 HB2 SER A 65 7.097 8.659 22.694 1.00 12.14 H new ATOM 0 HB3 SER A 65 6.404 8.551 21.089 1.00 12.14 H new ATOM 0 HG SER A 65 6.680 6.466 22.052 1.00 50.35 H new ATOM 1026 N PRO A 66 9.454 11.257 21.347 1.00 63.34 N ATOM 1027 CA PRO A 66 9.853 12.484 22.042 1.00 65.11 C ATOM 1028 C PRO A 66 8.655 13.319 22.479 1.00 74.15 C ATOM 1029 O PRO A 66 7.805 13.676 21.664 1.00 51.32 O ATOM 1030 CB PRO A 66 10.675 13.236 20.991 1.00 34.33 C ATOM 1031 CG PRO A 66 10.167 12.734 19.684 1.00 63.33 C ATOM 1032 CD PRO A 66 9.784 11.298 19.912 1.00 74.20 C ATOM 0 HA PRO A 66 10.401 12.272 22.960 1.00 65.11 H new ATOM 0 HB2 PRO A 66 10.541 14.314 21.080 1.00 34.33 H new ATOM 0 HB3 PRO A 66 11.741 13.037 21.105 1.00 34.33 H new ATOM 0 HG2 PRO A 66 9.310 13.318 19.348 1.00 63.33 H new ATOM 0 HG3 PRO A 66 10.931 12.816 18.911 1.00 63.33 H new ATOM 0 HD2 PRO A 66 8.934 11.006 19.296 1.00 74.20 H new ATOM 0 HD3 PRO A 66 10.602 10.620 19.668 1.00 74.20 H new ATOM 1040 N GLY A 67 8.593 13.627 23.770 1.00 12.35 N ATOM 1041 CA GLY A 67 7.494 14.419 24.292 1.00 31.45 C ATOM 1042 C GLY A 67 6.248 13.591 24.536 1.00 32.32 C ATOM 1043 O GLY A 67 5.144 14.129 24.626 1.00 20.41 O ATOM 0 H GLY A 67 9.284 13.343 24.464 1.00 12.35 H new ATOM 0 HA2 GLY A 67 7.801 14.891 25.225 1.00 31.45 H new ATOM 0 HA3 GLY A 67 7.262 15.220 23.591 1.00 31.45 H new ATOM 1047 N PHE A 68 6.423 12.278 24.642 1.00 21.40 N ATOM 1048 CA PHE A 68 5.303 11.373 24.874 1.00 40.10 C ATOM 1049 C PHE A 68 5.625 10.384 25.991 1.00 53.33 C ATOM 1050 O PHE A 68 6.767 9.947 26.139 1.00 52.31 O ATOM 1051 CB PHE A 68 4.958 10.615 23.590 1.00 14.44 C ATOM 1052 CG PHE A 68 3.727 9.763 23.710 1.00 32.23 C ATOM 1053 CD1 PHE A 68 2.597 10.241 24.354 1.00 53.24 C ATOM 1054 CD2 PHE A 68 3.700 8.483 23.179 1.00 12.42 C ATOM 1055 CE1 PHE A 68 1.463 9.458 24.466 1.00 43.41 C ATOM 1056 CE2 PHE A 68 2.569 7.696 23.288 1.00 10.11 C ATOM 1057 CZ PHE A 68 1.449 8.185 23.932 1.00 71.25 C ATOM 0 H PHE A 68 7.330 11.817 24.571 1.00 21.40 H new ATOM 0 HA PHE A 68 4.443 11.970 25.178 1.00 40.10 H new ATOM 0 HB2 PHE A 68 4.817 11.332 22.781 1.00 14.44 H new ATOM 0 HB3 PHE A 68 5.802 9.983 23.312 1.00 14.44 H new ATOM 0 HD1 PHE A 68 2.602 11.236 24.773 1.00 53.24 H new ATOM 0 HD2 PHE A 68 4.573 8.096 22.674 1.00 12.42 H new ATOM 0 HE1 PHE A 68 0.589 9.842 24.971 1.00 43.41 H new ATOM 0 HE2 PHE A 68 2.561 6.700 22.870 1.00 10.11 H new ATOM 0 HZ PHE A 68 0.564 7.572 24.018 1.00 71.25 H new ATOM 1067 N LEU A 69 4.610 10.036 26.775 1.00 43.05 N ATOM 1068 CA LEU A 69 4.784 9.099 27.879 1.00 14.02 C ATOM 1069 C LEU A 69 5.712 9.677 28.943 1.00 72.32 C ATOM 1070 O LEU A 69 5.257 10.227 29.946 1.00 1.31 O ATOM 1071 CB LEU A 69 5.343 7.771 27.365 1.00 54.43 C ATOM 1072 CG LEU A 69 4.324 6.649 27.158 1.00 44.51 C ATOM 1073 CD1 LEU A 69 3.996 5.976 28.481 1.00 15.43 C ATOM 1074 CD2 LEU A 69 3.061 7.190 26.504 1.00 62.33 C ATOM 0 H LEU A 69 3.659 10.388 26.667 1.00 43.05 H new ATOM 0 HA LEU A 69 3.808 8.924 28.331 1.00 14.02 H new ATOM 0 HB2 LEU A 69 5.848 7.955 26.417 1.00 54.43 H new ATOM 0 HB3 LEU A 69 6.100 7.422 28.067 1.00 54.43 H new ATOM 0 HG LEU A 69 4.762 5.904 26.494 1.00 44.51 H new ATOM 0 HD11 LEU A 69 3.270 5.181 28.314 1.00 15.43 H new ATOM 0 HD12 LEU A 69 4.905 5.554 28.909 1.00 15.43 H new ATOM 0 HD13 LEU A 69 3.578 6.711 29.169 1.00 15.43 H new ATOM 0 HD21 LEU A 69 2.347 6.378 26.364 1.00 62.33 H new ATOM 0 HD22 LEU A 69 2.620 7.955 27.143 1.00 62.33 H new ATOM 0 HD23 LEU A 69 3.310 7.625 25.536 1.00 62.33 H new ATOM 1086 N HIS A 70 7.015 9.549 28.716 1.00 44.54 N ATOM 1087 CA HIS A 70 8.008 10.062 29.653 1.00 24.43 C ATOM 1088 C HIS A 70 9.351 10.274 28.960 1.00 11.44 C ATOM 1089 O HIS A 70 10.399 10.272 29.605 1.00 61.02 O ATOM 1090 CB HIS A 70 8.175 9.098 30.829 1.00 40.41 C ATOM 1091 CG HIS A 70 7.832 9.706 32.154 1.00 31.12 C ATOM 1092 ND1 HIS A 70 8.555 10.734 32.721 1.00 63.02 N ATOM 1093 CD2 HIS A 70 6.834 9.426 33.025 1.00 61.42 C ATOM 1094 CE1 HIS A 70 8.018 11.059 33.883 1.00 25.44 C ATOM 1095 NE2 HIS A 70 6.972 10.280 34.091 1.00 21.22 N ATOM 0 H HIS A 70 7.408 9.095 27.892 1.00 44.54 H new ATOM 0 HA HIS A 70 7.656 11.024 30.027 1.00 24.43 H new ATOM 0 HB2 HIS A 70 7.544 8.225 30.665 1.00 40.41 H new ATOM 0 HB3 HIS A 70 9.206 8.746 30.856 1.00 40.41 H new ATOM 0 HD2 HIS A 70 6.071 8.671 32.904 1.00 61.42 H new ATOM 0 HE1 HIS A 70 8.374 11.831 34.550 1.00 25.44 H new ATOM 0 HE2 HIS A 70 6.365 10.308 34.910 1.00 21.22 H new ATOM 1103 N GLU A 71 9.310 10.457 27.644 1.00 11.32 N ATOM 1104 CA GLU A 71 10.524 10.670 26.865 1.00 30.40 C ATOM 1105 C GLU A 71 10.843 12.157 26.749 1.00 53.41 C ATOM 1106 O GLU A 71 9.942 12.993 26.673 1.00 51.32 O ATOM 1107 CB GLU A 71 10.375 10.058 25.470 1.00 13.52 C ATOM 1108 CG GLU A 71 11.120 8.745 25.298 1.00 14.41 C ATOM 1109 CD GLU A 71 12.616 8.939 25.148 1.00 21.13 C ATOM 1110 OE1 GLU A 71 13.180 9.788 25.869 1.00 42.20 O ATOM 1111 OE2 GLU A 71 13.223 8.240 24.310 1.00 70.03 O ATOM 0 H GLU A 71 8.450 10.462 27.095 1.00 11.32 H new ATOM 0 HA GLU A 71 11.348 10.180 27.383 1.00 30.40 H new ATOM 0 HB2 GLU A 71 9.317 9.895 25.265 1.00 13.52 H new ATOM 0 HB3 GLU A 71 10.737 10.771 24.729 1.00 13.52 H new ATOM 0 HG2 GLU A 71 10.925 8.105 26.159 1.00 14.41 H new ATOM 0 HG3 GLU A 71 10.735 8.225 24.421 1.00 14.41 H new ATOM 1118 N LYS A 72 12.131 12.481 26.737 1.00 43.14 N ATOM 1119 CA LYS A 72 12.572 13.867 26.629 1.00 34.04 C ATOM 1120 C LYS A 72 11.896 14.563 25.453 1.00 55.24 C ATOM 1121 O LYS A 72 11.257 13.919 24.620 1.00 62.01 O ATOM 1122 CB LYS A 72 14.092 13.930 26.468 1.00 61.44 C ATOM 1123 CG LYS A 72 14.852 13.238 27.586 1.00 32.04 C ATOM 1124 CD LYS A 72 16.153 12.633 27.086 1.00 74.30 C ATOM 1125 CE LYS A 72 17.352 13.186 27.841 1.00 55.23 C ATOM 1126 NZ LYS A 72 17.193 13.045 29.315 1.00 74.24 N ATOM 0 H LYS A 72 12.889 11.802 26.801 1.00 43.14 H new ATOM 0 HA LYS A 72 12.289 14.384 27.546 1.00 34.04 H new ATOM 0 HB2 LYS A 72 14.367 13.474 25.517 1.00 61.44 H new ATOM 0 HB3 LYS A 72 14.401 14.974 26.422 1.00 61.44 H new ATOM 0 HG2 LYS A 72 15.064 13.954 28.380 1.00 32.04 H new ATOM 0 HG3 LYS A 72 14.229 12.456 28.020 1.00 32.04 H new ATOM 0 HD2 LYS A 72 16.119 11.549 27.199 1.00 74.30 H new ATOM 0 HD3 LYS A 72 16.266 12.839 26.022 1.00 74.30 H new ATOM 0 HE2 LYS A 72 18.254 12.664 27.522 1.00 55.23 H new ATOM 0 HE3 LYS A 72 17.486 14.238 27.589 1.00 55.23 H new ATOM 0 HZ1 LYS A 72 18.126 12.903 29.753 1.00 74.24 H new ATOM 0 HZ2 LYS A 72 16.757 13.907 29.701 1.00 74.24 H new ATOM 0 HZ3 LYS A 72 16.585 12.227 29.522 1.00 74.24 H new ATOM 1140 N LYS A 73 12.041 15.882 25.389 1.00 52.44 N ATOM 1141 CA LYS A 73 11.447 16.667 24.312 1.00 31.34 C ATOM 1142 C LYS A 73 12.328 16.638 23.068 1.00 62.32 C ATOM 1143 O LYS A 73 13.521 16.343 23.147 1.00 71.10 O ATOM 1144 CB LYS A 73 11.233 18.113 24.765 1.00 23.24 C ATOM 1145 CG LYS A 73 12.499 18.786 25.268 1.00 33.11 C ATOM 1146 CD LYS A 73 12.307 19.365 26.660 1.00 62.12 C ATOM 1147 CE LYS A 73 12.553 18.320 27.737 1.00 33.50 C ATOM 1148 NZ LYS A 73 12.566 18.920 29.100 1.00 65.13 N ATOM 0 H LYS A 73 12.565 16.431 26.071 1.00 52.44 H new ATOM 0 HA LYS A 73 10.483 16.224 24.063 1.00 31.34 H new ATOM 0 HB2 LYS A 73 10.831 18.690 23.932 1.00 23.24 H new ATOM 0 HB3 LYS A 73 10.483 18.130 25.556 1.00 23.24 H new ATOM 0 HG2 LYS A 73 13.315 18.064 25.283 1.00 33.11 H new ATOM 0 HG3 LYS A 73 12.788 19.580 24.579 1.00 33.11 H new ATOM 0 HD2 LYS A 73 12.988 20.204 26.803 1.00 62.12 H new ATOM 0 HD3 LYS A 73 11.294 19.756 26.756 1.00 62.12 H new ATOM 0 HE2 LYS A 73 11.778 17.555 27.684 1.00 33.50 H new ATOM 0 HE3 LYS A 73 13.505 17.823 27.550 1.00 33.50 H new ATOM 0 HZ1 LYS A 73 12.736 18.175 29.806 1.00 65.13 H new ATOM 0 HZ2 LYS A 73 13.322 19.632 29.159 1.00 65.13 H new ATOM 0 HZ3 LYS A 73 11.649 19.372 29.289 1.00 65.13 H new ATOM 1162 N ASP A 74 11.734 16.947 21.921 1.00 60.55 N ATOM 1163 CA ASP A 74 12.466 16.958 20.659 1.00 0.33 C ATOM 1164 C ASP A 74 13.741 17.787 20.779 1.00 64.41 C ATOM 1165 O ASP A 74 13.782 18.782 21.501 1.00 52.15 O ATOM 1166 CB ASP A 74 11.585 17.514 19.539 1.00 3.01 C ATOM 1167 CG ASP A 74 12.269 17.466 18.187 1.00 4.10 C ATOM 1168 OD1 ASP A 74 12.426 16.354 17.640 1.00 52.21 O ATOM 1169 OD2 ASP A 74 12.648 18.541 17.676 1.00 74.54 O ATOM 0 H ASP A 74 10.748 17.193 21.838 1.00 60.55 H new ATOM 0 HA ASP A 74 12.742 15.932 20.418 1.00 0.33 H new ATOM 0 HB2 ASP A 74 10.657 16.944 19.494 1.00 3.01 H new ATOM 0 HB3 ASP A 74 11.315 18.545 19.770 1.00 3.01 H new ATOM 1174 N GLY A 75 14.783 17.367 20.066 1.00 32.04 N ATOM 1175 CA GLY A 75 16.046 18.081 20.108 1.00 72.43 C ATOM 1176 C GLY A 75 16.945 17.604 21.231 1.00 33.32 C ATOM 1177 O GLY A 75 18.126 17.330 21.017 1.00 52.52 O ATOM 0 H GLY A 75 14.775 16.546 19.461 1.00 32.04 H new ATOM 0 HA2 GLY A 75 16.562 17.956 19.156 1.00 72.43 H new ATOM 0 HA3 GLY A 75 15.853 19.147 20.229 1.00 72.43 H new ATOM 1181 N ASP A 76 16.386 17.505 22.432 1.00 32.23 N ATOM 1182 CA ASP A 76 17.145 17.058 23.595 1.00 42.55 C ATOM 1183 C ASP A 76 17.438 15.564 23.511 1.00 71.31 C ATOM 1184 O ASP A 76 18.578 15.133 23.686 1.00 0.00 O ATOM 1185 CB ASP A 76 16.379 17.370 24.881 1.00 30.42 C ATOM 1186 CG ASP A 76 17.159 18.274 25.815 1.00 53.20 C ATOM 1187 OD1 ASP A 76 17.461 19.418 25.417 1.00 50.33 O ATOM 1188 OD2 ASP A 76 17.468 17.838 26.944 1.00 74.22 O ATOM 0 H ASP A 76 15.410 17.728 22.626 1.00 32.23 H new ATOM 0 HA ASP A 76 18.093 17.595 23.608 1.00 42.55 H new ATOM 0 HB2 ASP A 76 15.430 17.844 24.629 1.00 30.42 H new ATOM 0 HB3 ASP A 76 16.143 16.438 25.395 1.00 30.42 H new ATOM 1193 N PHE A 77 16.401 14.777 23.243 1.00 30.14 N ATOM 1194 CA PHE A 77 16.546 13.330 23.139 1.00 63.43 C ATOM 1195 C PHE A 77 17.656 12.964 22.157 1.00 53.12 C ATOM 1196 O PHE A 77 18.471 12.083 22.427 1.00 61.22 O ATOM 1197 CB PHE A 77 15.227 12.694 22.695 1.00 41.11 C ATOM 1198 CG PHE A 77 15.357 11.246 22.317 1.00 54.21 C ATOM 1199 CD1 PHE A 77 15.557 10.278 23.288 1.00 53.22 C ATOM 1200 CD2 PHE A 77 15.279 10.853 20.990 1.00 13.24 C ATOM 1201 CE1 PHE A 77 15.676 8.945 22.943 1.00 31.14 C ATOM 1202 CE2 PHE A 77 15.397 9.522 20.640 1.00 33.51 C ATOM 1203 CZ PHE A 77 15.597 8.566 21.618 1.00 52.34 C ATOM 0 H PHE A 77 15.451 15.117 23.094 1.00 30.14 H new ATOM 0 HA PHE A 77 16.813 12.945 24.123 1.00 63.43 H new ATOM 0 HB2 PHE A 77 14.499 12.787 23.501 1.00 41.11 H new ATOM 0 HB3 PHE A 77 14.833 13.250 21.844 1.00 41.11 H new ATOM 0 HD1 PHE A 77 15.621 10.568 24.326 1.00 53.22 H new ATOM 0 HD2 PHE A 77 15.124 11.596 20.221 1.00 13.24 H new ATOM 0 HE1 PHE A 77 15.831 8.200 23.710 1.00 31.14 H new ATOM 0 HE2 PHE A 77 15.333 9.228 19.603 1.00 33.51 H new ATOM 0 HZ PHE A 77 15.691 7.525 21.346 1.00 52.34 H new ATOM 1213 N GLN A 78 17.678 13.648 21.017 1.00 30.42 N ATOM 1214 CA GLN A 78 18.686 13.394 19.995 1.00 51.15 C ATOM 1215 C GLN A 78 20.080 13.745 20.505 1.00 34.10 C ATOM 1216 O GLN A 78 21.057 13.064 20.193 1.00 34.42 O ATOM 1217 CB GLN A 78 18.375 14.199 18.731 1.00 30.14 C ATOM 1218 CG GLN A 78 16.958 14.002 18.218 1.00 13.12 C ATOM 1219 CD GLN A 78 16.564 15.035 17.181 1.00 12.42 C ATOM 1220 OE1 GLN A 78 15.755 15.924 17.450 1.00 41.32 O ATOM 1221 NE2 GLN A 78 17.135 14.924 15.988 1.00 52.15 N ATOM 0 H GLN A 78 17.010 14.381 20.779 1.00 30.42 H new ATOM 0 HA GLN A 78 18.664 12.331 19.756 1.00 51.15 H new ATOM 0 HB2 GLN A 78 18.534 15.258 18.936 1.00 30.14 H new ATOM 0 HB3 GLN A 78 19.079 13.916 17.948 1.00 30.14 H new ATOM 0 HG2 GLN A 78 16.868 13.006 17.785 1.00 13.12 H new ATOM 0 HG3 GLN A 78 16.262 14.050 19.056 1.00 13.12 H new ATOM 0 HE21 GLN A 78 17.800 14.172 15.809 1.00 52.15 H new ATOM 0 HE22 GLN A 78 16.909 15.591 15.250 1.00 52.15 H new ATOM 1230 N LYS A 79 20.165 14.813 21.291 1.00 32.54 N ATOM 1231 CA LYS A 79 21.438 15.255 21.847 1.00 65.43 C ATOM 1232 C LYS A 79 21.935 14.282 22.912 1.00 72.35 C ATOM 1233 O LYS A 79 23.139 14.084 23.072 1.00 2.40 O ATOM 1234 CB LYS A 79 21.298 16.656 22.446 1.00 30.55 C ATOM 1235 CG LYS A 79 22.360 16.983 23.482 1.00 40.22 C ATOM 1236 CD LYS A 79 21.886 16.658 24.889 1.00 44.45 C ATOM 1237 CE LYS A 79 21.803 17.908 25.751 1.00 0.41 C ATOM 1238 NZ LYS A 79 22.137 17.624 27.174 1.00 23.20 N ATOM 0 H LYS A 79 19.366 15.389 21.557 1.00 32.54 H new ATOM 0 HA LYS A 79 22.168 15.284 21.038 1.00 65.43 H new ATOM 0 HB2 LYS A 79 21.347 17.392 21.643 1.00 30.55 H new ATOM 0 HB3 LYS A 79 20.314 16.749 22.905 1.00 30.55 H new ATOM 0 HG2 LYS A 79 23.268 16.420 23.264 1.00 40.22 H new ATOM 0 HG3 LYS A 79 22.618 18.040 23.419 1.00 40.22 H new ATOM 0 HD2 LYS A 79 20.907 16.181 24.843 1.00 44.45 H new ATOM 0 HD3 LYS A 79 22.568 15.943 25.348 1.00 44.45 H new ATOM 0 HE2 LYS A 79 22.485 18.663 25.362 1.00 0.41 H new ATOM 0 HE3 LYS A 79 20.798 18.325 25.690 1.00 0.41 H new ATOM 0 HZ1 LYS A 79 22.069 18.501 27.728 1.00 23.20 H new ATOM 0 HZ2 LYS A 79 21.470 16.922 27.554 1.00 23.20 H new ATOM 0 HZ3 LYS A 79 23.106 17.250 27.235 1.00 23.20 H new ATOM 1252 N TRP A 80 21.000 13.676 23.635 1.00 52.14 N ATOM 1253 CA TRP A 80 21.343 12.722 24.683 1.00 2.32 C ATOM 1254 C TRP A 80 21.625 11.344 24.095 1.00 41.33 C ATOM 1255 O TRP A 80 22.497 10.620 24.575 1.00 2.25 O ATOM 1256 CB TRP A 80 20.212 12.631 25.708 1.00 31.05 C ATOM 1257 CG TRP A 80 20.208 11.343 26.476 1.00 51.44 C ATOM 1258 CD1 TRP A 80 20.781 11.113 27.693 1.00 4.24 C ATOM 1259 CD2 TRP A 80 19.603 10.109 26.075 1.00 12.20 C ATOM 1260 NE1 TRP A 80 20.569 9.810 28.074 1.00 24.01 N ATOM 1261 CE2 TRP A 80 19.848 9.173 27.099 1.00 41.40 C ATOM 1262 CE3 TRP A 80 18.876 9.704 24.952 1.00 21.14 C ATOM 1263 CZ2 TRP A 80 19.393 7.859 27.031 1.00 40.33 C ATOM 1264 CZ3 TRP A 80 18.425 8.399 24.886 1.00 44.30 C ATOM 1265 CH2 TRP A 80 18.684 7.490 25.920 1.00 22.20 C ATOM 0 H TRP A 80 19.999 13.828 23.515 1.00 52.14 H new ATOM 0 HA TRP A 80 22.247 13.076 25.180 1.00 2.32 H new ATOM 0 HB2 TRP A 80 20.298 13.463 26.408 1.00 31.05 H new ATOM 0 HB3 TRP A 80 19.257 12.743 25.195 1.00 31.05 H new ATOM 0 HD1 TRP A 80 21.322 11.847 28.272 1.00 4.24 H new ATOM 0 HE1 TRP A 80 20.896 9.386 28.942 1.00 24.01 H new ATOM 0 HE3 TRP A 80 18.670 10.398 24.150 1.00 21.14 H new ATOM 0 HZ2 TRP A 80 19.592 7.156 27.826 1.00 40.33 H new ATOM 0 HZ3 TRP A 80 17.863 8.075 24.022 1.00 44.30 H new ATOM 0 HH2 TRP A 80 18.317 6.478 25.839 1.00 22.20 H new ATOM 1276 N TYR A 81 20.883 10.988 23.053 1.00 73.14 N ATOM 1277 CA TYR A 81 21.052 9.695 22.400 1.00 31.01 C ATOM 1278 C TYR A 81 22.376 9.635 21.645 1.00 50.14 C ATOM 1279 O TYR A 81 22.901 8.555 21.374 1.00 12.51 O ATOM 1280 CB TYR A 81 19.891 9.429 21.440 1.00 45.14 C ATOM 1281 CG TYR A 81 20.256 8.523 20.286 1.00 62.24 C ATOM 1282 CD1 TYR A 81 20.406 7.154 20.472 1.00 44.23 C ATOM 1283 CD2 TYR A 81 20.450 9.035 19.009 1.00 55.44 C ATOM 1284 CE1 TYR A 81 20.740 6.323 19.420 1.00 23.22 C ATOM 1285 CE2 TYR A 81 20.782 8.211 17.951 1.00 41.21 C ATOM 1286 CZ TYR A 81 20.927 6.856 18.162 1.00 71.12 C ATOM 1287 OH TYR A 81 21.258 6.031 17.112 1.00 61.24 O ATOM 0 H TYR A 81 20.158 11.576 22.642 1.00 73.14 H new ATOM 0 HA TYR A 81 21.060 8.925 23.172 1.00 31.01 H new ATOM 0 HB2 TYR A 81 19.066 8.982 21.995 1.00 45.14 H new ATOM 0 HB3 TYR A 81 19.532 10.379 21.045 1.00 45.14 H new ATOM 0 HD1 TYR A 81 20.259 6.733 21.455 1.00 44.23 H new ATOM 0 HD2 TYR A 81 20.339 10.096 18.840 1.00 55.44 H new ATOM 0 HE1 TYR A 81 20.854 5.261 19.582 1.00 23.22 H new ATOM 0 HE2 TYR A 81 20.927 8.626 16.964 1.00 41.21 H new ATOM 0 HH TYR A 81 20.527 6.022 16.460 1.00 61.24 H new ATOM 1297 N ALA A 82 22.911 10.804 21.308 1.00 53.24 N ATOM 1298 CA ALA A 82 24.174 10.887 20.586 1.00 64.41 C ATOM 1299 C ALA A 82 25.350 10.554 21.498 1.00 3.23 C ATOM 1300 O ALA A 82 26.494 10.479 21.051 1.00 52.31 O ATOM 1301 CB ALA A 82 24.348 12.272 19.982 1.00 51.22 C ATOM 0 H ALA A 82 22.489 11.707 21.524 1.00 53.24 H new ATOM 0 HA ALA A 82 24.152 10.153 19.781 1.00 64.41 H new ATOM 0 HB1 ALA A 82 25.296 12.319 19.446 1.00 51.22 H new ATOM 0 HB2 ALA A 82 23.530 12.473 19.290 1.00 51.22 H new ATOM 0 HB3 ALA A 82 24.343 13.019 20.776 1.00 51.22 H new ATOM 1307 N GLY A 83 25.061 10.356 22.781 1.00 51.31 N ATOM 1308 CA GLY A 83 26.105 10.035 23.736 1.00 3.30 C ATOM 1309 C GLY A 83 25.976 8.628 24.285 1.00 3.43 C ATOM 1310 O GLY A 83 26.576 8.296 25.309 1.00 60.15 O ATOM 0 H GLY A 83 24.122 10.412 23.176 1.00 51.31 H new ATOM 0 HA2 GLY A 83 27.078 10.147 23.257 1.00 3.30 H new ATOM 0 HA3 GLY A 83 26.071 10.748 24.560 1.00 3.30 H new ATOM 1314 N LEU A 84 25.191 7.800 23.606 1.00 31.22 N ATOM 1315 CA LEU A 84 24.983 6.420 24.033 1.00 44.31 C ATOM 1316 C LEU A 84 25.968 5.483 23.342 1.00 24.42 C ATOM 1317 O LEU A 84 25.983 4.281 23.603 1.00 21.51 O ATOM 1318 CB LEU A 84 23.549 5.983 23.732 1.00 33.01 C ATOM 1319 CG LEU A 84 22.443 6.874 24.298 1.00 13.22 C ATOM 1320 CD1 LEU A 84 21.074 6.350 23.892 1.00 22.30 C ATOM 1321 CD2 LEU A 84 22.553 6.964 25.813 1.00 3.13 C ATOM 0 H LEU A 84 24.688 8.059 22.758 1.00 31.22 H new ATOM 0 HA LEU A 84 25.153 6.368 25.108 1.00 44.31 H new ATOM 0 HB2 LEU A 84 23.426 5.929 22.650 1.00 33.01 H new ATOM 0 HB3 LEU A 84 23.409 4.974 24.120 1.00 33.01 H new ATOM 0 HG LEU A 84 22.563 7.875 23.885 1.00 13.22 H new ATOM 0 HD11 LEU A 84 20.300 6.997 24.304 1.00 22.30 H new ATOM 0 HD12 LEU A 84 20.997 6.339 22.805 1.00 22.30 H new ATOM 0 HD13 LEU A 84 20.943 5.338 24.276 1.00 22.30 H new ATOM 0 HD21 LEU A 84 21.758 7.602 26.198 1.00 3.13 H new ATOM 0 HD22 LEU A 84 22.460 5.967 26.244 1.00 3.13 H new ATOM 0 HD23 LEU A 84 23.521 7.387 26.083 1.00 3.13 H new ATOM 1333 N ASN A 85 26.791 6.042 22.461 1.00 24.02 N ATOM 1334 CA ASN A 85 27.781 5.256 21.734 1.00 65.10 C ATOM 1335 C ASN A 85 27.104 4.276 20.781 1.00 64.32 C ATOM 1336 O ASN A 85 27.582 3.159 20.580 1.00 71.30 O ATOM 1337 CB ASN A 85 28.679 4.496 22.713 1.00 74.42 C ATOM 1338 CG ASN A 85 30.149 4.811 22.514 1.00 74.51 C ATOM 1339 OD1 ASN A 85 30.558 5.971 22.560 1.00 61.41 O ATOM 1340 ND2 ASN A 85 30.950 3.776 22.291 1.00 64.30 N ATOM 0 H ASN A 85 26.792 7.036 22.233 1.00 24.02 H new ATOM 0 HA ASN A 85 28.393 5.941 21.148 1.00 65.10 H new ATOM 0 HB2 ASN A 85 28.392 4.746 23.734 1.00 74.42 H new ATOM 0 HB3 ASN A 85 28.520 3.425 22.591 1.00 74.42 H new ATOM 0 HD21 ASN A 85 31.949 3.925 22.149 1.00 64.30 H new ATOM 0 HD22 ASN A 85 30.566 2.831 22.261 1.00 64.30 H new ATOM 1347 N TYR A 86 25.990 4.702 20.196 1.00 24.21 N ATOM 1348 CA TYR A 86 25.246 3.862 19.265 1.00 23.43 C ATOM 1349 C TYR A 86 24.919 4.624 17.985 1.00 44.10 C ATOM 1350 O TYR A 86 23.758 4.858 17.650 1.00 32.42 O ATOM 1351 CB TYR A 86 23.956 3.360 19.917 1.00 5.52 C ATOM 1352 CG TYR A 86 24.176 2.678 21.249 1.00 43.44 C ATOM 1353 CD1 TYR A 86 25.053 1.606 21.366 1.00 54.44 C ATOM 1354 CD2 TYR A 86 23.507 3.105 22.389 1.00 3.00 C ATOM 1355 CE1 TYR A 86 25.256 0.980 22.580 1.00 61.52 C ATOM 1356 CE2 TYR A 86 23.706 2.485 23.607 1.00 12.25 C ATOM 1357 CZ TYR A 86 24.581 1.423 23.698 1.00 71.12 C ATOM 1358 OH TYR A 86 24.780 0.802 24.909 1.00 23.15 O ATOM 0 H TYR A 86 25.582 5.624 20.350 1.00 24.21 H new ATOM 0 HA TYR A 86 25.872 3.007 19.007 1.00 23.43 H new ATOM 0 HB2 TYR A 86 23.278 4.202 20.057 1.00 5.52 H new ATOM 0 HB3 TYR A 86 23.463 2.663 19.239 1.00 5.52 H new ATOM 0 HD1 TYR A 86 25.584 1.257 20.493 1.00 54.44 H new ATOM 0 HD2 TYR A 86 22.820 3.936 22.322 1.00 3.00 H new ATOM 0 HE1 TYR A 86 25.940 0.148 22.654 1.00 61.52 H new ATOM 0 HE2 TYR A 86 23.179 2.830 24.484 1.00 12.25 H new ATOM 0 HH TYR A 86 24.230 1.237 25.594 1.00 23.15 H new ATOM 1368 N PRO A 87 25.969 5.022 17.250 1.00 33.22 N ATOM 1369 CA PRO A 87 25.820 5.763 15.994 1.00 21.11 C ATOM 1370 C PRO A 87 25.240 4.901 14.878 1.00 42.23 C ATOM 1371 O PRO A 87 24.848 5.409 13.827 1.00 44.12 O ATOM 1372 CB PRO A 87 27.254 6.181 15.657 1.00 34.22 C ATOM 1373 CG PRO A 87 28.112 5.169 16.334 1.00 2.03 C ATOM 1374 CD PRO A 87 27.381 4.778 17.589 1.00 51.13 C ATOM 0 HA PRO A 87 25.130 6.600 16.094 1.00 21.11 H new ATOM 0 HB2 PRO A 87 27.422 6.186 14.580 1.00 34.22 H new ATOM 0 HB3 PRO A 87 27.468 7.187 16.018 1.00 34.22 H new ATOM 0 HG2 PRO A 87 28.275 4.303 15.692 1.00 2.03 H new ATOM 0 HG3 PRO A 87 29.093 5.583 16.567 1.00 2.03 H new ATOM 0 HD2 PRO A 87 27.558 3.734 17.848 1.00 51.13 H new ATOM 0 HD3 PRO A 87 27.699 5.377 18.443 1.00 51.13 H new ATOM 1382 N LYS A 88 25.187 3.594 15.112 1.00 4.30 N ATOM 1383 CA LYS A 88 24.654 2.661 14.127 1.00 34.13 C ATOM 1384 C LYS A 88 23.282 2.147 14.552 1.00 13.24 C ATOM 1385 O LYS A 88 22.865 1.058 14.156 1.00 61.03 O ATOM 1386 CB LYS A 88 25.614 1.485 13.936 1.00 33.43 C ATOM 1387 CG LYS A 88 26.718 1.758 12.929 1.00 34.24 C ATOM 1388 CD LYS A 88 27.993 2.222 13.612 1.00 11.45 C ATOM 1389 CE LYS A 88 29.217 1.951 12.751 1.00 20.15 C ATOM 1390 NZ LYS A 88 29.999 3.192 12.492 1.00 31.51 N ATOM 0 H LYS A 88 25.507 3.157 15.976 1.00 4.30 H new ATOM 0 HA LYS A 88 24.547 3.192 13.181 1.00 34.13 H new ATOM 0 HB2 LYS A 88 26.064 1.234 14.897 1.00 33.43 H new ATOM 0 HB3 LYS A 88 25.046 0.612 13.613 1.00 33.43 H new ATOM 0 HG2 LYS A 88 26.920 0.854 12.355 1.00 34.24 H new ATOM 0 HG3 LYS A 88 26.386 2.517 12.221 1.00 34.24 H new ATOM 0 HD2 LYS A 88 27.925 3.289 13.825 1.00 11.45 H new ATOM 0 HD3 LYS A 88 28.100 1.712 14.569 1.00 11.45 H new ATOM 0 HE2 LYS A 88 29.854 1.217 13.245 1.00 20.15 H new ATOM 0 HE3 LYS A 88 28.904 1.514 11.803 1.00 20.15 H new ATOM 0 HZ1 LYS A 88 30.825 2.965 11.902 1.00 31.51 H new ATOM 0 HZ2 LYS A 88 29.400 3.883 11.997 1.00 31.51 H new ATOM 0 HZ3 LYS A 88 30.319 3.595 13.395 1.00 31.51 H new ATOM 1404 N LEU A 89 22.583 2.938 15.360 1.00 63.41 N ATOM 1405 CA LEU A 89 21.257 2.563 15.838 1.00 53.34 C ATOM 1406 C LEU A 89 20.177 3.394 15.152 1.00 74.31 C ATOM 1407 O LEU A 89 20.117 4.616 15.291 1.00 74.43 O ATOM 1408 CB LEU A 89 21.169 2.744 17.354 1.00 3.20 C ATOM 1409 CG LEU A 89 20.010 2.029 18.050 1.00 44.34 C ATOM 1410 CD1 LEU A 89 20.099 0.528 17.826 1.00 35.43 C ATOM 1411 CD2 LEU A 89 20.002 2.350 19.537 1.00 21.43 C ATOM 0 H LEU A 89 22.913 3.842 15.697 1.00 63.41 H new ATOM 0 HA LEU A 89 21.093 1.513 15.594 1.00 53.34 H new ATOM 0 HB2 LEU A 89 22.102 2.395 17.796 1.00 3.20 H new ATOM 0 HB3 LEU A 89 21.093 3.810 17.569 1.00 3.20 H new ATOM 0 HG LEU A 89 19.075 2.385 17.618 1.00 44.34 H new ATOM 0 HD11 LEU A 89 19.267 0.035 18.328 1.00 35.43 H new ATOM 0 HD12 LEU A 89 20.055 0.316 16.758 1.00 35.43 H new ATOM 0 HD13 LEU A 89 21.039 0.155 18.231 1.00 35.43 H new ATOM 0 HD21 LEU A 89 19.171 1.833 20.016 1.00 21.43 H new ATOM 0 HD22 LEU A 89 20.940 2.022 19.985 1.00 21.43 H new ATOM 0 HD23 LEU A 89 19.889 3.425 19.677 1.00 21.43 H new ATOM 1423 N PRO A 90 19.300 2.717 14.395 1.00 24.51 N ATOM 1424 CA PRO A 90 18.204 3.371 13.675 1.00 44.51 C ATOM 1425 C PRO A 90 17.129 3.904 14.616 1.00 42.42 C ATOM 1426 O PRO A 90 16.169 3.204 14.937 1.00 11.33 O ATOM 1427 CB PRO A 90 17.639 2.253 12.796 1.00 41.01 C ATOM 1428 CG PRO A 90 17.995 0.994 13.509 1.00 12.41 C ATOM 1429 CD PRO A 90 19.312 1.259 14.185 1.00 52.14 C ATOM 0 HA PRO A 90 18.547 4.240 13.114 1.00 44.51 H new ATOM 0 HB2 PRO A 90 16.560 2.349 12.678 1.00 41.01 H new ATOM 0 HB3 PRO A 90 18.073 2.278 11.796 1.00 41.01 H new ATOM 0 HG2 PRO A 90 17.229 0.728 14.237 1.00 12.41 H new ATOM 0 HG3 PRO A 90 18.075 0.160 12.812 1.00 12.41 H new ATOM 0 HD2 PRO A 90 19.396 0.718 15.127 1.00 52.14 H new ATOM 0 HD3 PRO A 90 20.152 0.949 13.564 1.00 52.14 H new ATOM 1437 N VAL A 91 17.296 5.148 15.054 1.00 5.13 N ATOM 1438 CA VAL A 91 16.339 5.775 15.957 1.00 2.55 C ATOM 1439 C VAL A 91 15.457 6.773 15.216 1.00 14.21 C ATOM 1440 O VAL A 91 15.893 7.874 14.880 1.00 53.23 O ATOM 1441 CB VAL A 91 17.051 6.499 17.116 1.00 63.40 C ATOM 1442 CG1 VAL A 91 16.036 7.061 18.099 1.00 41.40 C ATOM 1443 CG2 VAL A 91 18.019 5.557 17.817 1.00 70.03 C ATOM 0 H VAL A 91 18.085 5.741 14.798 1.00 5.13 H new ATOM 0 HA VAL A 91 15.718 4.977 16.363 1.00 2.55 H new ATOM 0 HB VAL A 91 17.622 7.332 16.705 1.00 63.40 H new ATOM 0 HG11 VAL A 91 16.558 7.569 18.910 1.00 41.40 H new ATOM 0 HG12 VAL A 91 15.386 7.770 17.586 1.00 41.40 H new ATOM 0 HG13 VAL A 91 15.435 6.248 18.507 1.00 41.40 H new ATOM 0 HG21 VAL A 91 18.513 6.084 18.633 1.00 70.03 H new ATOM 0 HG22 VAL A 91 17.471 4.703 18.216 1.00 70.03 H new ATOM 0 HG23 VAL A 91 18.767 5.208 17.105 1.00 70.03 H new ATOM 1453 N VAL A 92 14.212 6.381 14.964 1.00 33.23 N ATOM 1454 CA VAL A 92 13.266 7.241 14.264 1.00 52.32 C ATOM 1455 C VAL A 92 12.332 7.943 15.243 1.00 1.52 C ATOM 1456 O VAL A 92 11.713 7.305 16.095 1.00 10.23 O ATOM 1457 CB VAL A 92 12.423 6.442 13.252 1.00 45.34 C ATOM 1458 CG1 VAL A 92 11.594 7.381 12.389 1.00 74.32 C ATOM 1459 CG2 VAL A 92 13.318 5.564 12.390 1.00 3.11 C ATOM 0 H VAL A 92 13.835 5.473 15.235 1.00 33.23 H new ATOM 0 HA VAL A 92 13.854 7.987 13.728 1.00 52.32 H new ATOM 0 HB VAL A 92 11.740 5.796 13.804 1.00 45.34 H new ATOM 0 HG11 VAL A 92 11.005 6.799 11.680 1.00 74.32 H new ATOM 0 HG12 VAL A 92 10.926 7.964 13.023 1.00 74.32 H new ATOM 0 HG13 VAL A 92 12.256 8.054 11.844 1.00 74.32 H new ATOM 0 HG21 VAL A 92 12.706 5.006 11.681 1.00 3.11 H new ATOM 0 HG22 VAL A 92 14.026 6.189 11.846 1.00 3.11 H new ATOM 0 HG23 VAL A 92 13.864 4.866 13.025 1.00 3.11 H new ATOM 1469 N THR A 93 12.234 9.263 15.117 1.00 42.35 N ATOM 1470 CA THR A 93 11.377 10.054 15.991 1.00 74.55 C ATOM 1471 C THR A 93 9.906 9.857 15.641 1.00 13.34 C ATOM 1472 O THR A 93 9.549 9.719 14.471 1.00 13.53 O ATOM 1473 CB THR A 93 11.717 11.553 15.905 1.00 10.43 C ATOM 1474 OG1 THR A 93 11.460 12.040 14.583 1.00 34.23 O ATOM 1475 CG2 THR A 93 13.174 11.799 16.267 1.00 61.03 C ATOM 0 H THR A 93 12.738 9.807 14.417 1.00 42.35 H new ATOM 0 HA THR A 93 11.556 9.707 17.009 1.00 74.55 H new ATOM 0 HB THR A 93 11.087 12.087 16.616 1.00 10.43 H new ATOM 0 HG1 THR A 93 11.897 11.456 13.929 1.00 34.23 H new ATOM 0 HG21 THR A 93 13.391 12.865 16.199 1.00 61.03 H new ATOM 0 HG22 THR A 93 13.359 11.455 17.285 1.00 61.03 H new ATOM 0 HG23 THR A 93 13.817 11.253 15.577 1.00 61.03 H new ATOM 1483 N ASP A 94 9.057 9.846 16.663 1.00 55.31 N ATOM 1484 CA ASP A 94 7.623 9.669 16.464 1.00 71.45 C ATOM 1485 C ASP A 94 6.869 10.961 16.760 1.00 33.15 C ATOM 1486 O ASP A 94 5.639 10.995 16.727 1.00 44.35 O ATOM 1487 CB ASP A 94 7.098 8.541 17.354 1.00 4.21 C ATOM 1488 CG ASP A 94 6.077 7.672 16.647 1.00 41.22 C ATOM 1489 OD1 ASP A 94 6.189 7.510 15.414 1.00 53.32 O ATOM 1490 OD2 ASP A 94 5.166 7.155 17.326 1.00 34.32 O ATOM 0 H ASP A 94 9.337 9.958 17.637 1.00 55.31 H new ATOM 0 HA ASP A 94 7.456 9.404 15.420 1.00 71.45 H new ATOM 0 HB2 ASP A 94 7.933 7.922 17.681 1.00 4.21 H new ATOM 0 HB3 ASP A 94 6.648 8.969 18.250 1.00 4.21 H new ATOM 1495 N ASN A 95 7.614 12.022 17.053 1.00 64.45 N ATOM 1496 CA ASN A 95 7.016 13.316 17.357 1.00 11.14 C ATOM 1497 C ASN A 95 5.830 13.158 18.304 1.00 22.23 C ATOM 1498 O ASN A 95 4.676 13.292 17.899 1.00 5.42 O ATOM 1499 CB ASN A 95 6.566 14.009 16.070 1.00 53.12 C ATOM 1500 CG ASN A 95 7.631 14.930 15.506 1.00 73.43 C ATOM 1501 OD1 ASN A 95 8.626 14.474 14.943 1.00 61.34 O ATOM 1502 ND2 ASN A 95 7.426 16.233 15.655 1.00 15.01 N ATOM 0 H ASN A 95 8.633 12.011 17.086 1.00 64.45 H new ATOM 0 HA ASN A 95 7.771 13.931 17.847 1.00 11.14 H new ATOM 0 HB2 ASN A 95 6.310 13.255 15.325 1.00 53.12 H new ATOM 0 HB3 ASN A 95 5.661 14.583 16.267 1.00 53.12 H new ATOM 0 HD21 ASN A 95 8.108 16.901 15.296 1.00 15.01 H new ATOM 0 HD22 ASN A 95 6.586 16.566 16.129 1.00 15.01 H new ATOM 1509 N GLY A 96 6.124 12.871 19.569 1.00 11.32 N ATOM 1510 CA GLY A 96 5.072 12.700 20.554 1.00 22.13 C ATOM 1511 C GLY A 96 4.362 11.368 20.418 1.00 21.45 C ATOM 1512 O GLY A 96 3.265 11.184 20.945 1.00 43.32 O ATOM 0 H GLY A 96 7.071 12.754 19.929 1.00 11.32 H new ATOM 0 HA2 GLY A 96 5.498 12.781 21.554 1.00 22.13 H new ATOM 0 HA3 GLY A 96 4.347 13.507 20.450 1.00 22.13 H new ATOM 1516 N GLY A 97 4.989 10.434 19.708 1.00 14.32 N ATOM 1517 CA GLY A 97 4.394 9.125 19.516 1.00 72.42 C ATOM 1518 C GLY A 97 3.249 9.148 18.523 1.00 52.03 C ATOM 1519 O GLY A 97 2.089 8.966 18.895 1.00 2.22 O ATOM 0 H GLY A 97 5.898 10.561 19.263 1.00 14.32 H new ATOM 0 HA2 GLY A 97 5.158 8.430 19.169 1.00 72.42 H new ATOM 0 HA3 GLY A 97 4.033 8.750 20.473 1.00 72.42 H new ATOM 1523 N THR A 98 3.573 9.374 17.253 1.00 11.43 N ATOM 1524 CA THR A 98 2.563 9.424 16.204 1.00 51.02 C ATOM 1525 C THR A 98 2.093 8.024 15.826 1.00 63.11 C ATOM 1526 O THR A 98 0.899 7.726 15.873 1.00 25.31 O ATOM 1527 CB THR A 98 3.096 10.132 14.944 1.00 62.21 C ATOM 1528 OG1 THR A 98 4.465 9.775 14.724 1.00 62.42 O ATOM 1529 CG2 THR A 98 2.976 11.642 15.080 1.00 5.21 C ATOM 0 H THR A 98 4.528 9.525 16.927 1.00 11.43 H new ATOM 0 HA THR A 98 1.722 9.991 16.602 1.00 51.02 H new ATOM 0 HB THR A 98 2.496 9.811 14.093 1.00 62.21 H new ATOM 0 HG1 THR A 98 5.047 10.397 15.209 1.00 62.42 H new ATOM 0 HG21 THR A 98 3.359 12.120 14.178 1.00 5.21 H new ATOM 0 HG22 THR A 98 1.929 11.913 15.218 1.00 5.21 H new ATOM 0 HG23 THR A 98 3.554 11.977 15.941 1.00 5.21 H new ATOM 1537 N ILE A 99 3.039 7.169 15.452 1.00 31.40 N ATOM 1538 CA ILE A 99 2.721 5.799 15.068 1.00 71.01 C ATOM 1539 C ILE A 99 2.218 4.996 16.263 1.00 61.34 C ATOM 1540 O ILE A 99 1.270 4.220 16.147 1.00 62.50 O ATOM 1541 CB ILE A 99 3.944 5.086 14.462 1.00 22.32 C ATOM 1542 CG1 ILE A 99 4.561 5.939 13.352 1.00 62.31 C ATOM 1543 CG2 ILE A 99 3.549 3.717 13.928 1.00 14.13 C ATOM 1544 CD1 ILE A 99 5.876 5.398 12.835 1.00 51.24 C ATOM 0 H ILE A 99 4.031 7.401 15.407 1.00 31.40 H new ATOM 0 HA ILE A 99 1.935 5.856 14.315 1.00 71.01 H new ATOM 0 HB ILE A 99 4.690 4.947 15.245 1.00 22.32 H new ATOM 0 HG12 ILE A 99 3.856 6.009 12.524 1.00 62.31 H new ATOM 0 HG13 ILE A 99 4.716 6.951 13.726 1.00 62.31 H new ATOM 0 HG21 ILE A 99 4.424 3.226 13.503 1.00 14.13 H new ATOM 0 HG22 ILE A 99 3.151 3.110 14.741 1.00 14.13 H new ATOM 0 HG23 ILE A 99 2.788 3.833 13.157 1.00 14.13 H new ATOM 0 HD11 ILE A 99 6.255 6.053 12.050 1.00 51.24 H new ATOM 0 HD12 ILE A 99 6.597 5.354 13.651 1.00 51.24 H new ATOM 0 HD13 ILE A 99 5.724 4.397 12.431 1.00 51.24 H new ATOM 1556 N ALA A 100 2.859 5.189 17.411 1.00 50.23 N ATOM 1557 CA ALA A 100 2.474 4.486 18.628 1.00 25.21 C ATOM 1558 C ALA A 100 1.001 4.711 18.950 1.00 20.21 C ATOM 1559 O ALA A 100 0.262 3.762 19.209 1.00 74.21 O ATOM 1560 CB ALA A 100 3.345 4.932 19.793 1.00 4.41 C ATOM 0 H ALA A 100 3.647 5.826 17.523 1.00 50.23 H new ATOM 0 HA ALA A 100 2.624 3.419 18.464 1.00 25.21 H new ATOM 0 HB1 ALA A 100 3.046 4.399 20.696 1.00 4.41 H new ATOM 0 HB2 ALA A 100 4.389 4.713 19.571 1.00 4.41 H new ATOM 0 HB3 ALA A 100 3.224 6.004 19.948 1.00 4.41 H new ATOM 1566 N GLN A 101 0.582 5.972 18.933 1.00 42.13 N ATOM 1567 CA GLN A 101 -0.803 6.320 19.224 1.00 13.54 C ATOM 1568 C GLN A 101 -1.754 5.640 18.245 1.00 64.13 C ATOM 1569 O GLN A 101 -2.831 5.182 18.626 1.00 3.00 O ATOM 1570 CB GLN A 101 -0.993 7.837 19.167 1.00 41.21 C ATOM 1571 CG GLN A 101 -1.564 8.428 20.446 1.00 60.10 C ATOM 1572 CD GLN A 101 -3.058 8.669 20.361 1.00 52.51 C ATOM 1573 OE1 GLN A 101 -3.511 9.607 19.703 1.00 63.32 O ATOM 1574 NE2 GLN A 101 -3.834 7.823 21.028 1.00 61.12 N ATOM 0 H GLN A 101 1.182 6.769 18.721 1.00 42.13 H new ATOM 0 HA GLN A 101 -1.035 5.969 20.230 1.00 13.54 H new ATOM 0 HB2 GLN A 101 -0.032 8.307 18.957 1.00 41.21 H new ATOM 0 HB3 GLN A 101 -1.656 8.081 18.337 1.00 41.21 H new ATOM 0 HG2 GLN A 101 -1.355 7.755 21.278 1.00 60.10 H new ATOM 0 HG3 GLN A 101 -1.060 9.370 20.663 1.00 60.10 H new ATOM 0 HE21 GLN A 101 -3.417 7.060 21.560 1.00 61.12 H new ATOM 0 HE22 GLN A 101 -4.847 7.936 21.008 1.00 61.12 H new ATOM 1583 N SER A 102 -1.348 5.578 16.981 1.00 64.54 N ATOM 1584 CA SER A 102 -2.165 4.956 15.945 1.00 40.41 C ATOM 1585 C SER A 102 -2.141 3.436 16.072 1.00 4.34 C ATOM 1586 O SER A 102 -3.059 2.749 15.623 1.00 22.02 O ATOM 1587 CB SER A 102 -1.670 5.371 14.558 1.00 52.21 C ATOM 1588 OG SER A 102 -2.755 5.685 13.702 1.00 33.21 O ATOM 0 H SER A 102 -0.458 5.951 16.649 1.00 64.54 H new ATOM 0 HA SER A 102 -3.192 5.297 16.074 1.00 40.41 H new ATOM 0 HB2 SER A 102 -1.011 6.235 14.647 1.00 52.21 H new ATOM 0 HB3 SER A 102 -1.081 4.564 14.122 1.00 52.21 H new ATOM 0 HG SER A 102 -2.412 5.949 12.823 1.00 33.21 H new ATOM 1594 N LEU A 103 -1.084 2.918 16.688 1.00 62.42 N ATOM 1595 CA LEU A 103 -0.938 1.478 16.876 1.00 42.34 C ATOM 1596 C LEU A 103 -1.361 1.067 18.282 1.00 4.02 C ATOM 1597 O LEU A 103 -1.252 -0.099 18.657 1.00 20.54 O ATOM 1598 CB LEU A 103 0.510 1.055 16.622 1.00 41.23 C ATOM 1599 CG LEU A 103 0.778 0.340 15.297 1.00 40.52 C ATOM 1600 CD1 LEU A 103 1.821 1.093 14.486 1.00 50.45 C ATOM 1601 CD2 LEU A 103 1.225 -1.093 15.545 1.00 43.32 C ATOM 0 H LEU A 103 -0.316 3.473 17.066 1.00 62.42 H new ATOM 0 HA LEU A 103 -1.588 0.975 16.160 1.00 42.34 H new ATOM 0 HB2 LEU A 103 1.140 1.943 16.666 1.00 41.23 H new ATOM 0 HB3 LEU A 103 0.824 0.401 17.435 1.00 41.23 H new ATOM 0 HG LEU A 103 -0.150 0.316 14.725 1.00 40.52 H new ATOM 0 HD11 LEU A 103 1.999 0.570 13.547 1.00 50.45 H new ATOM 0 HD12 LEU A 103 1.462 2.101 14.278 1.00 50.45 H new ATOM 0 HD13 LEU A 103 2.751 1.149 15.052 1.00 50.45 H new ATOM 0 HD21 LEU A 103 1.411 -1.586 14.591 1.00 43.32 H new ATOM 0 HD22 LEU A 103 2.140 -1.091 16.137 1.00 43.32 H new ATOM 0 HD23 LEU A 103 0.444 -1.629 16.085 1.00 43.32 H new ATOM 1613 N ASN A 104 -1.845 2.034 19.055 1.00 31.43 N ATOM 1614 CA ASN A 104 -2.286 1.772 20.421 1.00 71.45 C ATOM 1615 C ASN A 104 -1.142 1.220 21.265 1.00 22.05 C ATOM 1616 O ASN A 104 -1.299 0.216 21.961 1.00 65.11 O ATOM 1617 CB ASN A 104 -3.456 0.786 20.420 1.00 31.43 C ATOM 1618 CG ASN A 104 -4.349 0.948 19.205 1.00 11.45 C ATOM 1619 OD1 ASN A 104 -4.194 0.243 18.209 1.00 74.15 O ATOM 1620 ND2 ASN A 104 -5.290 1.882 19.284 1.00 40.21 N ATOM 0 H ASN A 104 -1.942 3.005 18.759 1.00 31.43 H new ATOM 0 HA ASN A 104 -2.614 2.715 20.858 1.00 71.45 H new ATOM 0 HB2 ASN A 104 -3.069 -0.233 20.450 1.00 31.43 H new ATOM 0 HB3 ASN A 104 -4.048 0.928 21.324 1.00 31.43 H new ATOM 0 HD21 ASN A 104 -5.921 2.038 18.498 1.00 40.21 H new ATOM 0 HD22 ASN A 104 -5.382 2.443 20.131 1.00 40.21 H new ATOM 1627 N ILE A 105 0.008 1.883 21.200 1.00 14.32 N ATOM 1628 CA ILE A 105 1.177 1.460 21.960 1.00 3.52 C ATOM 1629 C ILE A 105 1.418 2.378 23.154 1.00 32.35 C ATOM 1630 O ILE A 105 1.882 3.507 22.999 1.00 13.32 O ATOM 1631 CB ILE A 105 2.442 1.438 21.081 1.00 12.24 C ATOM 1632 CG1 ILE A 105 2.217 0.561 19.848 1.00 30.12 C ATOM 1633 CG2 ILE A 105 3.635 0.939 21.883 1.00 50.33 C ATOM 1634 CD1 ILE A 105 2.064 -0.909 20.172 1.00 43.20 C ATOM 0 H ILE A 105 0.155 2.715 20.629 1.00 14.32 H new ATOM 0 HA ILE A 105 0.974 0.450 22.316 1.00 3.52 H new ATOM 0 HB ILE A 105 2.653 2.454 20.747 1.00 12.24 H new ATOM 0 HG12 ILE A 105 1.324 0.905 19.326 1.00 30.12 H new ATOM 0 HG13 ILE A 105 3.056 0.689 19.163 1.00 30.12 H new ATOM 0 HG21 ILE A 105 4.521 0.929 21.249 1.00 50.33 H new ATOM 0 HG22 ILE A 105 3.804 1.600 22.733 1.00 50.33 H new ATOM 0 HG23 ILE A 105 3.435 -0.070 22.243 1.00 50.33 H new ATOM 0 HD11 ILE A 105 1.908 -1.470 19.251 1.00 43.20 H new ATOM 0 HD12 ILE A 105 2.966 -1.268 20.667 1.00 43.20 H new ATOM 0 HD13 ILE A 105 1.208 -1.049 20.832 1.00 43.20 H new ATOM 1646 N SER A 106 1.101 1.883 24.347 1.00 52.12 N ATOM 1647 CA SER A 106 1.281 2.659 25.568 1.00 33.25 C ATOM 1648 C SER A 106 2.304 1.997 26.487 1.00 73.24 C ATOM 1649 O SER A 106 2.853 2.634 27.385 1.00 43.41 O ATOM 1650 CB SER A 106 -0.054 2.813 26.301 1.00 43.43 C ATOM 1651 OG SER A 106 -0.967 1.801 25.915 1.00 13.11 O ATOM 0 H SER A 106 0.719 0.949 24.493 1.00 52.12 H new ATOM 0 HA SER A 106 1.652 3.646 25.290 1.00 33.25 H new ATOM 0 HB2 SER A 106 0.111 2.767 27.377 1.00 43.43 H new ATOM 0 HB3 SER A 106 -0.480 3.793 26.086 1.00 43.43 H new ATOM 0 HG SER A 106 -1.811 1.920 26.398 1.00 13.11 H new ATOM 1657 N VAL A 107 2.554 0.712 26.254 1.00 45.20 N ATOM 1658 CA VAL A 107 3.512 -0.038 27.058 1.00 12.33 C ATOM 1659 C VAL A 107 4.799 -0.294 26.283 1.00 4.21 C ATOM 1660 O VAL A 107 4.767 -0.716 25.127 1.00 33.41 O ATOM 1661 CB VAL A 107 2.925 -1.386 27.517 1.00 0.22 C ATOM 1662 CG1 VAL A 107 1.879 -1.172 28.601 1.00 42.12 C ATOM 1663 CG2 VAL A 107 2.334 -2.139 26.335 1.00 33.03 C ATOM 0 H VAL A 107 2.107 0.169 25.515 1.00 45.20 H new ATOM 0 HA VAL A 107 3.735 0.570 27.935 1.00 12.33 H new ATOM 0 HB VAL A 107 3.730 -1.989 27.937 1.00 0.22 H new ATOM 0 HG11 VAL A 107 1.476 -2.135 28.913 1.00 42.12 H new ATOM 0 HG12 VAL A 107 2.338 -0.677 29.457 1.00 42.12 H new ATOM 0 HG13 VAL A 107 1.073 -0.550 28.211 1.00 42.12 H new ATOM 0 HG21 VAL A 107 1.924 -3.089 26.677 1.00 33.03 H new ATOM 0 HG22 VAL A 107 1.541 -1.543 25.884 1.00 33.03 H new ATOM 0 HG23 VAL A 107 3.113 -2.325 25.596 1.00 33.03 H new ATOM 1673 N TYR A 108 5.932 -0.036 26.927 1.00 41.30 N ATOM 1674 CA TYR A 108 7.232 -0.237 26.298 1.00 51.55 C ATOM 1675 C TYR A 108 8.087 -1.205 27.110 1.00 52.53 C ATOM 1676 O TYR A 108 7.919 -1.356 28.320 1.00 3.00 O ATOM 1677 CB TYR A 108 7.960 1.100 26.145 1.00 21.11 C ATOM 1678 CG TYR A 108 7.238 2.085 25.254 1.00 71.24 C ATOM 1679 CD1 TYR A 108 6.801 1.715 23.988 1.00 72.54 C ATOM 1680 CD2 TYR A 108 6.993 3.385 25.676 1.00 5.45 C ATOM 1681 CE1 TYR A 108 6.141 2.611 23.169 1.00 1.02 C ATOM 1682 CE2 TYR A 108 6.333 4.288 24.866 1.00 43.05 C ATOM 1683 CZ TYR A 108 5.909 3.896 23.613 1.00 43.32 C ATOM 1684 OH TYR A 108 5.253 4.793 22.801 1.00 33.14 O ATOM 0 H TYR A 108 5.976 0.313 27.884 1.00 41.30 H new ATOM 0 HA TYR A 108 7.067 -0.668 25.311 1.00 51.55 H new ATOM 0 HB2 TYR A 108 8.094 1.546 27.131 1.00 21.11 H new ATOM 0 HB3 TYR A 108 8.955 0.918 25.739 1.00 21.11 H new ATOM 0 HD1 TYR A 108 6.980 0.709 23.638 1.00 72.54 H new ATOM 0 HD2 TYR A 108 7.325 3.696 26.656 1.00 5.45 H new ATOM 0 HE1 TYR A 108 5.809 2.307 22.187 1.00 1.02 H new ATOM 0 HE2 TYR A 108 6.150 5.295 25.211 1.00 43.05 H new ATOM 0 HH TYR A 108 5.170 5.653 23.264 1.00 33.14 H new ATOM 1694 N PRO A 109 9.027 -1.876 26.429 1.00 61.23 N ATOM 1695 CA PRO A 109 9.235 -1.705 24.988 1.00 43.42 C ATOM 1696 C PRO A 109 8.088 -2.280 24.164 1.00 44.22 C ATOM 1697 O PRO A 109 7.125 -2.815 24.712 1.00 22.41 O ATOM 1698 CB PRO A 109 10.527 -2.481 24.721 1.00 22.11 C ATOM 1699 CG PRO A 109 10.589 -3.498 25.808 1.00 3.11 C ATOM 1700 CD PRO A 109 9.959 -2.855 27.013 1.00 61.43 C ATOM 0 HA PRO A 109 9.288 -0.653 24.706 1.00 43.42 H new ATOM 0 HB2 PRO A 109 10.510 -2.952 23.738 1.00 22.11 H new ATOM 0 HB3 PRO A 109 11.396 -1.823 24.744 1.00 22.11 H new ATOM 0 HG2 PRO A 109 10.054 -4.405 25.525 1.00 3.11 H new ATOM 0 HG3 PRO A 109 11.620 -3.787 26.014 1.00 3.11 H new ATOM 0 HD2 PRO A 109 9.438 -3.586 27.632 1.00 61.43 H new ATOM 0 HD3 PRO A 109 10.703 -2.373 27.647 1.00 61.43 H new ATOM 1708 N SER A 110 8.199 -2.166 22.844 1.00 14.21 N ATOM 1709 CA SER A 110 7.169 -2.672 21.944 1.00 14.15 C ATOM 1710 C SER A 110 7.759 -3.014 20.580 1.00 43.31 C ATOM 1711 O SER A 110 8.900 -2.662 20.280 1.00 42.02 O ATOM 1712 CB SER A 110 6.050 -1.641 21.785 1.00 53.23 C ATOM 1713 OG SER A 110 5.061 -1.801 22.787 1.00 23.34 O ATOM 0 H SER A 110 8.991 -1.728 22.374 1.00 14.21 H new ATOM 0 HA SER A 110 6.756 -3.582 22.379 1.00 14.15 H new ATOM 0 HB2 SER A 110 6.468 -0.636 21.839 1.00 53.23 H new ATOM 0 HB3 SER A 110 5.594 -1.744 20.800 1.00 53.23 H new ATOM 0 HG SER A 110 5.373 -1.395 23.623 1.00 23.34 H new ATOM 1719 N TRP A 111 6.974 -3.701 19.758 1.00 25.13 N ATOM 1720 CA TRP A 111 7.419 -4.091 18.425 1.00 30.21 C ATOM 1721 C TRP A 111 6.279 -3.985 17.418 1.00 33.55 C ATOM 1722 O TRP A 111 5.122 -3.799 17.795 1.00 71.13 O ATOM 1723 CB TRP A 111 7.967 -5.519 18.445 1.00 21.03 C ATOM 1724 CG TRP A 111 9.347 -5.618 19.023 1.00 15.41 C ATOM 1725 CD1 TRP A 111 9.680 -5.655 20.347 1.00 72.11 C ATOM 1726 CD2 TRP A 111 10.577 -5.689 18.295 1.00 24.22 C ATOM 1727 NE1 TRP A 111 11.044 -5.746 20.486 1.00 52.41 N ATOM 1728 CE2 TRP A 111 11.617 -5.769 19.242 1.00 22.12 C ATOM 1729 CE3 TRP A 111 10.902 -5.696 16.936 1.00 3.32 C ATOM 1730 CZ2 TRP A 111 12.957 -5.853 18.871 1.00 14.02 C ATOM 1731 CZ3 TRP A 111 12.232 -5.779 16.570 1.00 40.34 C ATOM 1732 CH2 TRP A 111 13.246 -5.857 17.534 1.00 71.23 C ATOM 0 H TRP A 111 6.027 -3.999 19.991 1.00 25.13 H new ATOM 0 HA TRP A 111 8.213 -3.409 18.120 1.00 30.21 H new ATOM 0 HB2 TRP A 111 7.293 -6.151 19.023 1.00 21.03 H new ATOM 0 HB3 TRP A 111 7.978 -5.911 17.428 1.00 21.03 H new ATOM 0 HD1 TRP A 111 8.975 -5.618 21.164 1.00 72.11 H new ATOM 0 HE1 TRP A 111 11.548 -5.789 21.372 1.00 52.41 H new ATOM 0 HE3 TRP A 111 10.128 -5.638 16.185 1.00 3.32 H new ATOM 0 HZ2 TRP A 111 13.740 -5.913 19.613 1.00 14.02 H new ATOM 0 HZ3 TRP A 111 12.495 -5.784 15.522 1.00 40.34 H new ATOM 0 HH2 TRP A 111 14.276 -5.922 17.215 1.00 71.23 H new ATOM 1743 N ALA A 112 6.613 -4.106 16.138 1.00 54.23 N ATOM 1744 CA ALA A 112 5.615 -4.026 15.078 1.00 44.14 C ATOM 1745 C ALA A 112 6.244 -4.283 13.712 1.00 31.12 C ATOM 1746 O ALA A 112 7.016 -3.466 13.209 1.00 51.02 O ATOM 1747 CB ALA A 112 4.931 -2.667 15.098 1.00 30.11 C ATOM 0 H ALA A 112 7.566 -4.260 15.810 1.00 54.23 H new ATOM 0 HA ALA A 112 4.868 -4.799 15.257 1.00 44.14 H new ATOM 0 HB1 ALA A 112 4.189 -2.622 14.301 1.00 30.11 H new ATOM 0 HB2 ALA A 112 4.440 -2.521 16.060 1.00 30.11 H new ATOM 0 HB3 ALA A 112 5.674 -1.884 14.947 1.00 30.11 H new ATOM 1753 N LEU A 113 5.909 -5.423 13.118 1.00 65.03 N ATOM 1754 CA LEU A 113 6.442 -5.789 11.810 1.00 40.43 C ATOM 1755 C LEU A 113 5.594 -5.193 10.691 1.00 50.24 C ATOM 1756 O LEU A 113 4.371 -5.107 10.804 1.00 11.42 O ATOM 1757 CB LEU A 113 6.498 -7.311 11.667 1.00 3.43 C ATOM 1758 CG LEU A 113 7.645 -7.864 10.820 1.00 53.41 C ATOM 1759 CD1 LEU A 113 8.412 -8.928 11.589 1.00 73.00 C ATOM 1760 CD2 LEU A 113 7.115 -8.427 9.509 1.00 24.33 C ATOM 0 H LEU A 113 5.271 -6.110 13.521 1.00 65.03 H new ATOM 0 HA LEU A 113 7.452 -5.386 11.731 1.00 40.43 H new ATOM 0 HB2 LEU A 113 6.566 -7.747 12.664 1.00 3.43 H new ATOM 0 HB3 LEU A 113 5.557 -7.650 11.234 1.00 3.43 H new ATOM 0 HG LEU A 113 8.330 -7.047 10.591 1.00 53.41 H new ATOM 0 HD11 LEU A 113 9.224 -9.310 10.970 1.00 73.00 H new ATOM 0 HD12 LEU A 113 8.823 -8.493 12.500 1.00 73.00 H new ATOM 0 HD13 LEU A 113 7.739 -9.745 11.849 1.00 73.00 H new ATOM 0 HD21 LEU A 113 7.944 -8.816 8.918 1.00 24.33 H new ATOM 0 HD22 LEU A 113 6.409 -9.231 9.717 1.00 24.33 H new ATOM 0 HD23 LEU A 113 6.612 -7.637 8.951 1.00 24.33 H new ATOM 1772 N ILE A 114 6.251 -4.785 9.610 1.00 23.22 N ATOM 1773 CA ILE A 114 5.557 -4.201 8.469 1.00 1.14 C ATOM 1774 C ILE A 114 6.008 -4.845 7.163 1.00 74.22 C ATOM 1775 O ILE A 114 7.121 -4.611 6.695 1.00 71.34 O ATOM 1776 CB ILE A 114 5.791 -2.681 8.386 1.00 11.15 C ATOM 1777 CG1 ILE A 114 5.486 -2.022 9.733 1.00 11.32 C ATOM 1778 CG2 ILE A 114 4.934 -2.072 7.287 1.00 73.44 C ATOM 1779 CD1 ILE A 114 4.035 -2.134 10.146 1.00 21.43 C ATOM 0 H ILE A 114 7.263 -4.848 9.501 1.00 23.22 H new ATOM 0 HA ILE A 114 4.494 -4.390 8.616 1.00 1.14 H new ATOM 0 HB ILE A 114 6.839 -2.502 8.144 1.00 11.15 H new ATOM 0 HG12 ILE A 114 6.110 -2.478 10.501 1.00 11.32 H new ATOM 0 HG13 ILE A 114 5.761 -0.968 9.683 1.00 11.32 H new ATOM 0 HG21 ILE A 114 5.111 -0.997 7.241 1.00 73.44 H new ATOM 0 HG22 ILE A 114 5.195 -2.524 6.330 1.00 73.44 H new ATOM 0 HG23 ILE A 114 3.882 -2.258 7.501 1.00 73.44 H new ATOM 0 HD11 ILE A 114 3.892 -1.645 11.110 1.00 21.43 H new ATOM 0 HD12 ILE A 114 3.406 -1.652 9.398 1.00 21.43 H new ATOM 0 HD13 ILE A 114 3.760 -3.186 10.228 1.00 21.43 H new ATOM 1791 N GLY A 115 5.133 -5.657 6.577 1.00 33.52 N ATOM 1792 CA GLY A 115 5.458 -6.322 5.329 1.00 71.02 C ATOM 1793 C GLY A 115 5.988 -5.362 4.282 1.00 75.21 C ATOM 1794 O GLY A 115 5.801 -4.150 4.389 1.00 44.21 O ATOM 0 H GLY A 115 4.205 -5.866 6.945 1.00 33.52 H new ATOM 0 HA2 GLY A 115 6.201 -7.097 5.517 1.00 71.02 H new ATOM 0 HA3 GLY A 115 4.568 -6.820 4.944 1.00 71.02 H new ATOM 1798 N LYS A 116 6.651 -5.904 3.267 1.00 65.14 N ATOM 1799 CA LYS A 116 7.211 -5.089 2.195 1.00 11.42 C ATOM 1800 C LYS A 116 6.132 -4.224 1.549 1.00 24.54 C ATOM 1801 O LYS A 116 6.402 -3.110 1.102 1.00 2.54 O ATOM 1802 CB LYS A 116 7.867 -5.979 1.138 1.00 73.34 C ATOM 1803 CG LYS A 116 6.870 -6.705 0.251 1.00 70.42 C ATOM 1804 CD LYS A 116 7.492 -7.927 -0.403 1.00 65.45 C ATOM 1805 CE LYS A 116 6.513 -8.618 -1.341 1.00 2.54 C ATOM 1806 NZ LYS A 116 6.599 -8.080 -2.727 1.00 11.34 N ATOM 0 H LYS A 116 6.814 -6.906 3.164 1.00 65.14 H new ATOM 0 HA LYS A 116 7.967 -4.434 2.628 1.00 11.42 H new ATOM 0 HB2 LYS A 116 8.518 -5.368 0.514 1.00 73.34 H new ATOM 0 HB3 LYS A 116 8.500 -6.714 1.636 1.00 73.34 H new ATOM 0 HG2 LYS A 116 6.007 -7.008 0.844 1.00 70.42 H new ATOM 0 HG3 LYS A 116 6.504 -6.026 -0.519 1.00 70.42 H new ATOM 0 HD2 LYS A 116 8.382 -7.630 -0.959 1.00 65.45 H new ATOM 0 HD3 LYS A 116 7.816 -8.628 0.367 1.00 65.45 H new ATOM 0 HE2 LYS A 116 6.717 -9.689 -1.354 1.00 2.54 H new ATOM 0 HE3 LYS A 116 5.498 -8.491 -0.964 1.00 2.54 H new ATOM 0 HZ1 LYS A 116 5.917 -8.576 -3.335 1.00 11.34 H new ATOM 0 HZ2 LYS A 116 6.380 -7.063 -2.719 1.00 11.34 H new ATOM 0 HZ3 LYS A 116 7.561 -8.224 -3.096 1.00 11.34 H new ATOM 1820 N ASP A 117 4.911 -4.745 1.505 1.00 22.43 N ATOM 1821 CA ASP A 117 3.791 -4.020 0.917 1.00 64.25 C ATOM 1822 C ASP A 117 3.480 -2.759 1.716 1.00 2.22 C ATOM 1823 O ASP A 117 2.769 -1.873 1.245 1.00 51.41 O ATOM 1824 CB ASP A 117 2.554 -4.916 0.852 1.00 75.15 C ATOM 1825 CG ASP A 117 1.624 -4.538 -0.285 1.00 63.01 C ATOM 1826 OD1 ASP A 117 2.104 -4.430 -1.433 1.00 41.23 O ATOM 1827 OD2 ASP A 117 0.417 -4.351 -0.027 1.00 21.22 O ATOM 0 H ASP A 117 4.672 -5.667 1.870 1.00 22.43 H new ATOM 0 HA ASP A 117 4.071 -3.727 -0.095 1.00 64.25 H new ATOM 0 HB2 ASP A 117 2.866 -5.953 0.732 1.00 75.15 H new ATOM 0 HB3 ASP A 117 2.013 -4.853 1.796 1.00 75.15 H new ATOM 1832 N GLY A 118 4.018 -2.686 2.930 1.00 12.12 N ATOM 1833 CA GLY A 118 3.785 -1.530 3.776 1.00 21.13 C ATOM 1834 C GLY A 118 2.618 -1.730 4.723 1.00 24.32 C ATOM 1835 O GLY A 118 2.113 -0.772 5.307 1.00 11.24 O ATOM 0 H GLY A 118 4.611 -3.406 3.342 1.00 12.12 H new ATOM 0 HA2 GLY A 118 4.685 -1.319 4.353 1.00 21.13 H new ATOM 0 HA3 GLY A 118 3.596 -0.658 3.150 1.00 21.13 H new ATOM 1839 N ASP A 119 2.189 -2.978 4.874 1.00 32.24 N ATOM 1840 CA ASP A 119 1.073 -3.301 5.757 1.00 64.25 C ATOM 1841 C ASP A 119 1.563 -4.012 7.014 1.00 4.12 C ATOM 1842 O ASP A 119 2.630 -4.627 7.017 1.00 72.12 O ATOM 1843 CB ASP A 119 0.054 -4.176 5.026 1.00 61.45 C ATOM 1844 CG ASP A 119 -1.254 -4.298 5.783 1.00 25.00 C ATOM 1845 OD1 ASP A 119 -1.588 -3.366 6.544 1.00 42.51 O ATOM 1846 OD2 ASP A 119 -1.943 -5.325 5.614 1.00 30.24 O ATOM 0 H ASP A 119 2.596 -3.782 4.397 1.00 32.24 H new ATOM 0 HA ASP A 119 0.594 -2.368 6.053 1.00 64.25 H new ATOM 0 HB2 ASP A 119 -0.139 -3.756 4.039 1.00 61.45 H new ATOM 0 HB3 ASP A 119 0.476 -5.169 4.873 1.00 61.45 H new ATOM 1851 N VAL A 120 0.778 -3.922 8.083 1.00 71.12 N ATOM 1852 CA VAL A 120 1.131 -4.556 9.347 1.00 25.41 C ATOM 1853 C VAL A 120 1.258 -6.067 9.187 1.00 30.34 C ATOM 1854 O VAL A 120 0.424 -6.705 8.545 1.00 11.23 O ATOM 1855 CB VAL A 120 0.088 -4.252 10.439 1.00 64.13 C ATOM 1856 CG1 VAL A 120 0.536 -4.818 11.778 1.00 73.43 C ATOM 1857 CG2 VAL A 120 -0.156 -2.754 10.539 1.00 42.00 C ATOM 0 H VAL A 120 -0.107 -3.416 8.098 1.00 71.12 H new ATOM 0 HA VAL A 120 2.093 -4.143 9.650 1.00 25.41 H new ATOM 0 HB VAL A 120 -0.851 -4.733 10.165 1.00 64.13 H new ATOM 0 HG11 VAL A 120 -0.213 -4.593 12.537 1.00 73.43 H new ATOM 0 HG12 VAL A 120 0.656 -5.898 11.695 1.00 73.43 H new ATOM 0 HG13 VAL A 120 1.487 -4.369 12.063 1.00 73.43 H new ATOM 0 HG21 VAL A 120 -0.895 -2.557 11.315 1.00 42.00 H new ATOM 0 HG22 VAL A 120 0.777 -2.249 10.790 1.00 42.00 H new ATOM 0 HG23 VAL A 120 -0.525 -2.381 9.584 1.00 42.00 H new ATOM 1867 N GLN A 121 2.306 -6.633 9.776 1.00 23.35 N ATOM 1868 CA GLN A 121 2.542 -8.070 9.699 1.00 31.20 C ATOM 1869 C GLN A 121 2.465 -8.710 11.081 1.00 3.35 C ATOM 1870 O GLN A 121 2.218 -9.909 11.208 1.00 14.14 O ATOM 1871 CB GLN A 121 3.907 -8.351 9.069 1.00 61.30 C ATOM 1872 CG GLN A 121 3.876 -8.407 7.550 1.00 4.41 C ATOM 1873 CD GLN A 121 3.443 -9.761 7.024 1.00 10.31 C ATOM 1874 OE1 GLN A 121 3.931 -10.799 7.472 1.00 13.20 O ATOM 1875 NE2 GLN A 121 2.521 -9.757 6.068 1.00 65.30 N ATOM 0 H GLN A 121 3.005 -6.119 10.312 1.00 23.35 H new ATOM 0 HA GLN A 121 1.764 -8.507 9.073 1.00 31.20 H new ATOM 0 HB2 GLN A 121 4.608 -7.577 9.382 1.00 61.30 H new ATOM 0 HB3 GLN A 121 4.286 -9.299 9.452 1.00 61.30 H new ATOM 0 HG2 GLN A 121 3.196 -7.642 7.176 1.00 4.41 H new ATOM 0 HG3 GLN A 121 4.867 -8.170 7.161 1.00 4.41 H new ATOM 0 HE21 GLN A 121 2.144 -8.873 5.727 1.00 65.30 H new ATOM 0 HE22 GLN A 121 2.190 -10.638 5.675 1.00 65.30 H new ATOM 1884 N ARG A 122 2.680 -7.902 12.115 1.00 53.45 N ATOM 1885 CA ARG A 122 2.637 -8.389 13.488 1.00 74.22 C ATOM 1886 C ARG A 122 2.864 -7.250 14.477 1.00 43.32 C ATOM 1887 O ARG A 122 3.515 -6.255 14.154 1.00 73.32 O ATOM 1888 CB ARG A 122 3.689 -9.479 13.698 1.00 64.01 C ATOM 1889 CG ARG A 122 3.145 -10.732 14.364 1.00 14.11 C ATOM 1890 CD ARG A 122 2.960 -10.532 15.860 1.00 11.22 C ATOM 1891 NE ARG A 122 1.554 -10.373 16.222 1.00 71.22 N ATOM 1892 CZ ARG A 122 1.084 -10.571 17.448 1.00 13.33 C ATOM 1893 NH1 ARG A 122 1.903 -10.932 18.426 1.00 43.01 N ATOM 1894 NH2 ARG A 122 -0.209 -10.406 17.699 1.00 21.22 N ATOM 0 H ARG A 122 2.886 -6.907 12.027 1.00 53.45 H new ATOM 0 HA ARG A 122 1.647 -8.810 13.667 1.00 74.22 H new ATOM 0 HB2 ARG A 122 4.118 -9.748 12.733 1.00 64.01 H new ATOM 0 HB3 ARG A 122 4.499 -9.077 14.306 1.00 64.01 H new ATOM 0 HG2 ARG A 122 2.191 -11.001 13.911 1.00 14.11 H new ATOM 0 HG3 ARG A 122 3.827 -11.564 14.189 1.00 14.11 H new ATOM 0 HD2 ARG A 122 3.377 -11.386 16.394 1.00 11.22 H new ATOM 0 HD3 ARG A 122 3.518 -9.652 16.180 1.00 11.22 H new ATOM 0 HE ARG A 122 0.897 -10.095 15.493 1.00 71.22 H new ATOM 0 HH11 ARG A 122 2.897 -11.058 18.238 1.00 43.01 H new ATOM 0 HH12 ARG A 122 1.539 -11.083 19.367 1.00 43.01 H new ATOM 0 HH21 ARG A 122 -0.842 -10.127 16.950 1.00 21.22 H new ATOM 0 HH22 ARG A 122 -0.569 -10.558 18.641 1.00 21.22 H new ATOM 1908 N ILE A 123 2.324 -7.402 15.681 1.00 2.32 N ATOM 1909 CA ILE A 123 2.469 -6.386 16.717 1.00 71.05 C ATOM 1910 C ILE A 123 2.648 -7.023 18.090 1.00 34.04 C ATOM 1911 O ILE A 123 1.883 -7.905 18.482 1.00 65.42 O ATOM 1912 CB ILE A 123 1.252 -5.443 16.755 1.00 74.44 C ATOM 1913 CG1 ILE A 123 1.166 -4.633 15.459 1.00 32.15 C ATOM 1914 CG2 ILE A 123 1.335 -4.519 17.960 1.00 42.32 C ATOM 1915 CD1 ILE A 123 -0.171 -3.954 15.259 1.00 2.11 C ATOM 0 H ILE A 123 1.782 -8.219 15.964 1.00 2.32 H new ATOM 0 HA ILE A 123 3.359 -5.807 16.469 1.00 71.05 H new ATOM 0 HB ILE A 123 0.348 -6.044 16.846 1.00 74.44 H new ATOM 0 HG12 ILE A 123 1.952 -3.878 15.459 1.00 32.15 H new ATOM 0 HG13 ILE A 123 1.359 -5.293 14.614 1.00 32.15 H new ATOM 0 HG21 ILE A 123 0.468 -3.859 17.973 1.00 42.32 H new ATOM 0 HG22 ILE A 123 1.352 -5.113 18.874 1.00 42.32 H new ATOM 0 HG23 ILE A 123 2.245 -3.922 17.899 1.00 42.32 H new ATOM 0 HD11 ILE A 123 -0.160 -3.398 14.321 1.00 2.11 H new ATOM 0 HD12 ILE A 123 -0.960 -4.706 15.226 1.00 2.11 H new ATOM 0 HD13 ILE A 123 -0.358 -3.268 16.085 1.00 2.11 H new ATOM 1927 N VAL A 124 3.662 -6.569 18.820 1.00 14.41 N ATOM 1928 CA VAL A 124 3.940 -7.092 20.152 1.00 15.44 C ATOM 1929 C VAL A 124 4.175 -5.962 21.148 1.00 15.44 C ATOM 1930 O VAL A 124 4.752 -4.929 20.808 1.00 14.30 O ATOM 1931 CB VAL A 124 5.169 -8.019 20.146 1.00 60.42 C ATOM 1932 CG1 VAL A 124 5.533 -8.434 21.563 1.00 1.34 C ATOM 1933 CG2 VAL A 124 4.911 -9.239 19.275 1.00 74.43 C ATOM 0 H VAL A 124 4.305 -5.840 18.511 1.00 14.41 H new ATOM 0 HA VAL A 124 3.064 -7.665 20.456 1.00 15.44 H new ATOM 0 HB VAL A 124 6.013 -7.472 19.726 1.00 60.42 H new ATOM 0 HG11 VAL A 124 6.404 -9.089 21.538 1.00 1.34 H new ATOM 0 HG12 VAL A 124 5.762 -7.547 22.154 1.00 1.34 H new ATOM 0 HG13 VAL A 124 4.694 -8.964 22.014 1.00 1.34 H new ATOM 0 HG21 VAL A 124 5.790 -9.884 19.282 1.00 74.43 H new ATOM 0 HG22 VAL A 124 4.054 -9.789 19.664 1.00 74.43 H new ATOM 0 HG23 VAL A 124 4.704 -8.920 18.254 1.00 74.43 H new ATOM 1943 N LYS A 125 3.724 -6.164 22.382 1.00 71.42 N ATOM 1944 CA LYS A 125 3.886 -5.164 23.430 1.00 33.01 C ATOM 1945 C LYS A 125 4.921 -5.614 24.456 1.00 13.14 C ATOM 1946 O LYS A 125 4.578 -5.969 25.583 1.00 11.13 O ATOM 1947 CB LYS A 125 2.547 -4.900 24.123 1.00 52.35 C ATOM 1948 CG LYS A 125 1.783 -6.165 24.473 1.00 51.05 C ATOM 1949 CD LYS A 125 0.596 -6.374 23.547 1.00 41.11 C ATOM 1950 CE LYS A 125 0.325 -7.852 23.313 1.00 30.23 C ATOM 1951 NZ LYS A 125 -0.589 -8.418 24.344 1.00 61.21 N ATOM 0 H LYS A 125 3.243 -7.012 22.680 1.00 71.42 H new ATOM 0 HA LYS A 125 4.237 -4.242 22.967 1.00 33.01 H new ATOM 0 HB2 LYS A 125 2.726 -4.330 25.035 1.00 52.35 H new ATOM 0 HB3 LYS A 125 1.928 -4.280 23.475 1.00 52.35 H new ATOM 0 HG2 LYS A 125 2.451 -7.024 24.409 1.00 51.05 H new ATOM 0 HG3 LYS A 125 1.435 -6.108 25.504 1.00 51.05 H new ATOM 0 HD2 LYS A 125 -0.289 -5.904 23.976 1.00 41.11 H new ATOM 0 HD3 LYS A 125 0.787 -5.882 22.593 1.00 41.11 H new ATOM 0 HE2 LYS A 125 -0.113 -7.989 22.324 1.00 30.23 H new ATOM 0 HE3 LYS A 125 1.267 -8.400 23.323 1.00 30.23 H new ATOM 0 HZ1 LYS A 125 -0.749 -9.427 24.150 1.00 61.21 H new ATOM 0 HZ2 LYS A 125 -0.160 -8.310 25.285 1.00 61.21 H new ATOM 0 HZ3 LYS A 125 -1.497 -7.912 24.318 1.00 61.21 H new ATOM 1965 N GLY A 126 6.189 -5.595 24.059 1.00 43.04 N ATOM 1966 CA GLY A 126 7.254 -6.002 24.956 1.00 4.03 C ATOM 1967 C GLY A 126 8.616 -5.975 24.290 1.00 32.34 C ATOM 1968 O GLY A 126 8.860 -5.167 23.395 1.00 65.45 O ATOM 0 H GLY A 126 6.498 -5.305 23.131 1.00 43.04 H new ATOM 0 HA2 GLY A 126 7.265 -5.343 25.825 1.00 4.03 H new ATOM 0 HA3 GLY A 126 7.052 -7.009 25.322 1.00 4.03 H new ATOM 1972 N SER A 127 9.505 -6.860 24.730 1.00 43.02 N ATOM 1973 CA SER A 127 10.852 -6.931 24.174 1.00 15.00 C ATOM 1974 C SER A 127 11.236 -8.374 23.863 1.00 34.54 C ATOM 1975 O SER A 127 11.753 -9.089 24.722 1.00 4.14 O ATOM 1976 CB SER A 127 11.861 -6.321 25.148 1.00 21.14 C ATOM 1977 OG SER A 127 12.556 -5.239 24.552 1.00 35.13 O ATOM 0 H SER A 127 9.317 -7.537 25.469 1.00 43.02 H new ATOM 0 HA SER A 127 10.865 -6.362 23.245 1.00 15.00 H new ATOM 0 HB2 SER A 127 11.344 -5.976 26.043 1.00 21.14 H new ATOM 0 HB3 SER A 127 12.572 -7.084 25.465 1.00 21.14 H new ATOM 0 HG SER A 127 13.512 -5.449 24.508 1.00 35.13 H new ATOM 1983 N ILE A 128 10.978 -8.796 22.630 1.00 31.21 N ATOM 1984 CA ILE A 128 11.297 -10.153 22.205 1.00 21.40 C ATOM 1985 C ILE A 128 12.802 -10.399 22.234 1.00 52.00 C ATOM 1986 O ILE A 128 13.590 -9.468 22.394 1.00 52.14 O ATOM 1987 CB ILE A 128 10.769 -10.438 20.787 1.00 61.04 C ATOM 1988 CG1 ILE A 128 11.228 -9.345 19.819 1.00 22.21 C ATOM 1989 CG2 ILE A 128 9.251 -10.540 20.797 1.00 22.21 C ATOM 1990 CD1 ILE A 128 11.689 -9.878 18.480 1.00 0.14 C ATOM 0 H ILE A 128 10.549 -8.218 21.908 1.00 31.21 H new ATOM 0 HA ILE A 128 10.807 -10.827 22.908 1.00 21.40 H new ATOM 0 HB ILE A 128 11.176 -11.391 20.449 1.00 61.04 H new ATOM 0 HG12 ILE A 128 10.408 -8.645 19.659 1.00 22.21 H new ATOM 0 HG13 ILE A 128 12.042 -8.784 20.277 1.00 22.21 H new ATOM 0 HG21 ILE A 128 8.893 -10.742 19.787 1.00 22.21 H new ATOM 0 HG22 ILE A 128 8.945 -11.350 21.459 1.00 22.21 H new ATOM 0 HG23 ILE A 128 8.826 -9.601 21.152 1.00 22.21 H new ATOM 0 HD11 ILE A 128 12.000 -9.048 17.845 1.00 0.14 H new ATOM 0 HD12 ILE A 128 12.530 -10.556 18.628 1.00 0.14 H new ATOM 0 HD13 ILE A 128 10.870 -10.415 18.001 1.00 0.14 H new ATOM 2002 N ASN A 129 13.193 -11.659 22.077 1.00 64.33 N ATOM 2003 CA ASN A 129 14.604 -12.028 22.083 1.00 4.24 C ATOM 2004 C ASN A 129 15.083 -12.375 20.677 1.00 52.32 C ATOM 2005 O ASN A 129 14.308 -12.341 19.722 1.00 72.13 O ATOM 2006 CB ASN A 129 14.839 -13.214 23.021 1.00 73.01 C ATOM 2007 CG ASN A 129 13.667 -14.176 23.040 1.00 73.20 C ATOM 2008 OD1 ASN A 129 12.621 -13.887 23.622 1.00 41.11 O ATOM 2009 ND2 ASN A 129 13.837 -15.328 22.402 1.00 72.23 N ATOM 0 H ASN A 129 12.553 -12.442 21.944 1.00 64.33 H new ATOM 0 HA ASN A 129 15.175 -11.171 22.441 1.00 4.24 H new ATOM 0 HB2 ASN A 129 15.738 -13.747 22.711 1.00 73.01 H new ATOM 0 HB3 ASN A 129 15.019 -12.845 24.031 1.00 73.01 H new ATOM 0 HD21 ASN A 129 13.084 -16.015 22.381 1.00 72.23 H new ATOM 0 HD22 ASN A 129 14.721 -15.526 21.933 1.00 72.23 H new ATOM 2016 N GLU A 130 16.364 -12.708 20.559 1.00 62.32 N ATOM 2017 CA GLU A 130 16.945 -13.061 19.269 1.00 63.32 C ATOM 2018 C GLU A 130 16.169 -14.201 18.616 1.00 30.30 C ATOM 2019 O GLU A 130 15.483 -14.005 17.614 1.00 53.14 O ATOM 2020 CB GLU A 130 18.413 -13.460 19.438 1.00 71.05 C ATOM 2021 CG GLU A 130 19.386 -12.489 18.790 1.00 12.23 C ATOM 2022 CD GLU A 130 20.569 -12.168 19.682 1.00 45.50 C ATOM 2023 OE1 GLU A 130 20.348 -11.826 20.862 1.00 23.04 O ATOM 2024 OE2 GLU A 130 21.717 -12.258 19.198 1.00 25.14 O ATOM 0 H GLU A 130 17.019 -12.741 21.340 1.00 62.32 H new ATOM 0 HA GLU A 130 16.886 -12.186 18.621 1.00 63.32 H new ATOM 0 HB2 GLU A 130 18.641 -13.534 20.501 1.00 71.05 H new ATOM 0 HB3 GLU A 130 18.563 -14.451 19.010 1.00 71.05 H new ATOM 0 HG2 GLU A 130 19.747 -12.913 17.853 1.00 12.23 H new ATOM 0 HG3 GLU A 130 18.862 -11.566 18.542 1.00 12.23 H new ATOM 2031 N ALA A 131 16.284 -15.393 19.192 1.00 33.51 N ATOM 2032 CA ALA A 131 15.592 -16.565 18.668 1.00 2.23 C ATOM 2033 C ALA A 131 14.123 -16.259 18.396 1.00 43.11 C ATOM 2034 O ALA A 131 13.532 -16.795 17.459 1.00 22.22 O ATOM 2035 CB ALA A 131 15.720 -17.730 19.638 1.00 74.41 C ATOM 0 H ALA A 131 16.850 -15.573 20.022 1.00 33.51 H new ATOM 0 HA ALA A 131 16.059 -16.840 17.723 1.00 2.23 H new ATOM 0 HB1 ALA A 131 15.199 -18.598 19.235 1.00 74.41 H new ATOM 0 HB2 ALA A 131 16.773 -17.972 19.779 1.00 74.41 H new ATOM 0 HB3 ALA A 131 15.279 -17.456 20.596 1.00 74.41 H new ATOM 2041 N GLN A 132 13.541 -15.395 19.221 1.00 53.22 N ATOM 2042 CA GLN A 132 12.140 -15.019 19.068 1.00 30.55 C ATOM 2043 C GLN A 132 11.926 -14.224 17.785 1.00 41.00 C ATOM 2044 O GLN A 132 11.080 -14.571 16.962 1.00 54.10 O ATOM 2045 CB GLN A 132 11.676 -14.200 20.274 1.00 73.12 C ATOM 2046 CG GLN A 132 10.701 -14.942 21.174 1.00 1.55 C ATOM 2047 CD GLN A 132 9.836 -14.005 21.995 1.00 43.22 C ATOM 2048 OE1 GLN A 132 10.338 -13.082 22.638 1.00 35.44 O ATOM 2049 NE2 GLN A 132 8.529 -14.237 21.976 1.00 10.21 N ATOM 0 H GLN A 132 14.017 -14.942 20.001 1.00 53.22 H new ATOM 0 HA GLN A 132 11.549 -15.933 19.009 1.00 30.55 H new ATOM 0 HB2 GLN A 132 12.547 -13.906 20.860 1.00 73.12 H new ATOM 0 HB3 GLN A 132 11.205 -13.283 19.920 1.00 73.12 H new ATOM 0 HG2 GLN A 132 10.061 -15.579 20.563 1.00 1.55 H new ATOM 0 HG3 GLN A 132 11.257 -15.597 21.844 1.00 1.55 H new ATOM 0 HE21 GLN A 132 8.157 -15.013 21.429 1.00 10.21 H new ATOM 0 HE22 GLN A 132 7.897 -13.639 22.508 1.00 10.21 H new ATOM 2058 N ALA A 133 12.699 -13.155 17.621 1.00 30.24 N ATOM 2059 CA ALA A 133 12.595 -12.311 16.437 1.00 21.43 C ATOM 2060 C ALA A 133 12.658 -13.145 15.162 1.00 45.00 C ATOM 2061 O ALA A 133 11.939 -12.879 14.198 1.00 30.41 O ATOM 2062 CB ALA A 133 13.696 -11.262 16.439 1.00 3.52 C ATOM 0 H ALA A 133 13.404 -12.853 18.293 1.00 30.24 H new ATOM 0 HA ALA A 133 11.629 -11.807 16.463 1.00 21.43 H new ATOM 0 HB1 ALA A 133 13.606 -10.639 15.549 1.00 3.52 H new ATOM 0 HB2 ALA A 133 13.604 -10.639 17.329 1.00 3.52 H new ATOM 0 HB3 ALA A 133 14.668 -11.755 16.440 1.00 3.52 H new ATOM 2068 N LEU A 134 13.524 -14.153 15.162 1.00 35.11 N ATOM 2069 CA LEU A 134 13.681 -15.026 14.004 1.00 45.00 C ATOM 2070 C LEU A 134 12.372 -15.734 13.673 1.00 34.01 C ATOM 2071 O LEU A 134 11.874 -15.648 12.551 1.00 44.13 O ATOM 2072 CB LEU A 134 14.781 -16.058 14.264 1.00 15.42 C ATOM 2073 CG LEU A 134 16.163 -15.496 14.596 1.00 4.13 C ATOM 2074 CD1 LEU A 134 17.015 -16.549 15.288 1.00 44.13 C ATOM 2075 CD2 LEU A 134 16.852 -14.994 13.336 1.00 51.34 C ATOM 0 H LEU A 134 14.128 -14.386 15.951 1.00 35.11 H new ATOM 0 HA LEU A 134 13.964 -14.409 13.151 1.00 45.00 H new ATOM 0 HB2 LEU A 134 14.464 -16.698 15.087 1.00 15.42 H new ATOM 0 HB3 LEU A 134 14.871 -16.693 13.383 1.00 15.42 H new ATOM 0 HG LEU A 134 16.038 -14.654 15.277 1.00 4.13 H new ATOM 0 HD11 LEU A 134 17.995 -16.131 15.517 1.00 44.13 H new ATOM 0 HD12 LEU A 134 16.529 -16.861 16.212 1.00 44.13 H new ATOM 0 HD13 LEU A 134 17.132 -17.411 14.631 1.00 44.13 H new ATOM 0 HD21 LEU A 134 17.835 -14.598 13.592 1.00 51.34 H new ATOM 0 HD22 LEU A 134 16.965 -15.817 12.631 1.00 51.34 H new ATOM 0 HD23 LEU A 134 16.250 -14.207 12.881 1.00 51.34 H new ATOM 2087 N ALA A 135 11.817 -16.432 14.659 1.00 70.14 N ATOM 2088 CA ALA A 135 10.563 -17.151 14.473 1.00 32.44 C ATOM 2089 C ALA A 135 9.407 -16.186 14.232 1.00 30.41 C ATOM 2090 O ALA A 135 8.391 -16.554 13.640 1.00 43.42 O ATOM 2091 CB ALA A 135 10.275 -18.031 15.681 1.00 3.33 C ATOM 0 H ALA A 135 12.216 -16.514 15.594 1.00 70.14 H new ATOM 0 HA ALA A 135 10.663 -17.784 13.591 1.00 32.44 H new ATOM 0 HB1 ALA A 135 9.335 -18.562 15.529 1.00 3.33 H new ATOM 0 HB2 ALA A 135 11.083 -18.752 15.807 1.00 3.33 H new ATOM 0 HB3 ALA A 135 10.200 -17.410 16.574 1.00 3.33 H new ATOM 2097 N LEU A 136 9.567 -14.951 14.695 1.00 62.53 N ATOM 2098 CA LEU A 136 8.536 -13.933 14.530 1.00 50.22 C ATOM 2099 C LEU A 136 8.415 -13.512 13.069 1.00 45.43 C ATOM 2100 O LEU A 136 7.331 -13.166 12.600 1.00 74.12 O ATOM 2101 CB LEU A 136 8.851 -12.714 15.399 1.00 21.54 C ATOM 2102 CG LEU A 136 7.793 -11.611 15.417 1.00 12.05 C ATOM 2103 CD1 LEU A 136 7.871 -10.818 16.713 1.00 52.23 C ATOM 2104 CD2 LEU A 136 7.960 -10.692 14.216 1.00 1.12 C ATOM 0 H LEU A 136 10.401 -14.631 15.188 1.00 62.53 H new ATOM 0 HA LEU A 136 7.584 -14.361 14.846 1.00 50.22 H new ATOM 0 HB2 LEU A 136 9.010 -13.054 16.422 1.00 21.54 H new ATOM 0 HB3 LEU A 136 9.791 -12.282 15.057 1.00 21.54 H new ATOM 0 HG LEU A 136 6.809 -12.076 15.359 1.00 12.05 H new ATOM 0 HD11 LEU A 136 7.111 -10.037 16.708 1.00 52.23 H new ATOM 0 HD12 LEU A 136 7.701 -11.485 17.558 1.00 52.23 H new ATOM 0 HD13 LEU A 136 8.857 -10.363 16.802 1.00 52.23 H new ATOM 0 HD21 LEU A 136 7.198 -9.913 14.245 1.00 1.12 H new ATOM 0 HD22 LEU A 136 8.949 -10.234 14.243 1.00 1.12 H new ATOM 0 HD23 LEU A 136 7.853 -11.270 13.298 1.00 1.12 H new ATOM 2116 N ILE A 137 9.535 -13.545 12.355 1.00 44.24 N ATOM 2117 CA ILE A 137 9.554 -13.170 10.946 1.00 1.21 C ATOM 2118 C ILE A 137 9.316 -14.381 10.051 1.00 31.44 C ATOM 2119 O ILE A 137 8.508 -14.332 9.124 1.00 41.53 O ATOM 2120 CB ILE A 137 10.891 -12.513 10.556 1.00 3.22 C ATOM 2121 CG1 ILE A 137 11.128 -11.252 11.390 1.00 34.15 C ATOM 2122 CG2 ILE A 137 10.906 -12.182 9.071 1.00 31.22 C ATOM 2123 CD1 ILE A 137 12.530 -11.151 11.948 1.00 42.51 C ATOM 0 H ILE A 137 10.441 -13.827 12.729 1.00 44.24 H new ATOM 0 HA ILE A 137 8.749 -12.450 10.801 1.00 1.21 H new ATOM 0 HB ILE A 137 11.697 -13.218 10.760 1.00 3.22 H new ATOM 0 HG12 ILE A 137 10.927 -10.376 10.774 1.00 34.15 H new ATOM 0 HG13 ILE A 137 10.415 -11.232 12.214 1.00 34.15 H new ATOM 0 HG21 ILE A 137 11.858 -11.718 8.811 1.00 31.22 H new ATOM 0 HG22 ILE A 137 10.779 -13.097 8.493 1.00 31.22 H new ATOM 0 HG23 ILE A 137 10.093 -11.493 8.844 1.00 31.22 H new ATOM 0 HD11 ILE A 137 12.626 -10.233 12.528 1.00 42.51 H new ATOM 0 HD12 ILE A 137 12.728 -12.009 12.591 1.00 42.51 H new ATOM 0 HD13 ILE A 137 13.248 -11.139 11.128 1.00 42.51 H new ATOM 2135 N ARG A 138 10.023 -15.470 10.338 1.00 42.44 N ATOM 2136 CA ARG A 138 9.888 -16.695 9.559 1.00 4.02 C ATOM 2137 C ARG A 138 8.457 -17.221 9.617 1.00 42.02 C ATOM 2138 O ARG A 138 7.993 -17.888 8.692 1.00 13.20 O ATOM 2139 CB ARG A 138 10.856 -17.761 10.075 1.00 22.35 C ATOM 2140 CG ARG A 138 12.292 -17.276 10.190 1.00 62.41 C ATOM 2141 CD ARG A 138 13.219 -18.059 9.273 1.00 22.21 C ATOM 2142 NE ARG A 138 13.160 -17.579 7.895 1.00 10.12 N ATOM 2143 CZ ARG A 138 13.810 -16.504 7.463 1.00 14.22 C ATOM 2144 NH1 ARG A 138 14.564 -15.801 8.297 1.00 31.21 N ATOM 2145 NH2 ARG A 138 13.706 -16.130 6.194 1.00 12.33 N ATOM 0 H ARG A 138 10.694 -15.529 11.104 1.00 42.44 H new ATOM 0 HA ARG A 138 10.130 -16.465 8.521 1.00 4.02 H new ATOM 0 HB2 ARG A 138 10.518 -18.104 11.053 1.00 22.35 H new ATOM 0 HB3 ARG A 138 10.825 -18.622 9.407 1.00 22.35 H new ATOM 0 HG2 ARG A 138 12.341 -16.216 9.940 1.00 62.41 H new ATOM 0 HG3 ARG A 138 12.629 -17.376 11.222 1.00 62.41 H new ATOM 0 HD2 ARG A 138 14.242 -17.981 9.640 1.00 22.21 H new ATOM 0 HD3 ARG A 138 12.949 -19.115 9.301 1.00 22.21 H new ATOM 0 HE ARG A 138 12.589 -18.097 7.228 1.00 10.12 H new ATOM 0 HH11 ARG A 138 14.646 -16.085 9.273 1.00 31.21 H new ATOM 0 HH12 ARG A 138 15.062 -14.976 7.962 1.00 31.21 H new ATOM 0 HH21 ARG A 138 13.127 -16.668 5.550 1.00 12.33 H new ATOM 0 HH22 ARG A 138 14.205 -15.304 5.863 1.00 12.33 H new ATOM 2159 N ASP A 139 7.764 -16.917 10.709 1.00 43.03 N ATOM 2160 CA ASP A 139 6.386 -17.358 10.887 1.00 31.41 C ATOM 2161 C ASP A 139 5.409 -16.228 10.578 1.00 61.10 C ATOM 2162 O ASP A 139 5.424 -15.172 11.210 1.00 40.41 O ATOM 2163 CB ASP A 139 6.169 -17.860 12.316 1.00 43.14 C ATOM 2164 CG ASP A 139 5.111 -18.943 12.395 1.00 41.41 C ATOM 2165 OD1 ASP A 139 4.000 -18.727 11.867 1.00 50.42 O ATOM 2166 OD2 ASP A 139 5.394 -20.006 12.984 1.00 22.33 O ATOM 0 H ASP A 139 8.134 -16.367 11.484 1.00 43.03 H new ATOM 0 HA ASP A 139 6.200 -18.176 10.191 1.00 31.41 H new ATOM 0 HB2 ASP A 139 7.110 -18.246 12.709 1.00 43.14 H new ATOM 0 HB3 ASP A 139 5.877 -17.024 12.951 1.00 43.14 H new ATOM 2171 N PRO A 140 4.539 -16.453 9.582 1.00 44.01 N ATOM 2172 CA PRO A 140 3.540 -15.465 9.166 1.00 54.12 C ATOM 2173 C PRO A 140 2.445 -15.273 10.210 1.00 71.03 C ATOM 2174 O PRO A 140 1.857 -14.198 10.316 1.00 41.44 O ATOM 2175 CB PRO A 140 2.957 -16.067 7.885 1.00 63.42 C ATOM 2176 CG PRO A 140 3.179 -17.534 8.021 1.00 21.22 C ATOM 2177 CD PRO A 140 4.465 -17.689 8.785 1.00 32.35 C ATOM 0 HA PRO A 140 3.978 -14.476 9.028 1.00 54.12 H new ATOM 0 HB2 PRO A 140 1.897 -15.835 7.785 1.00 63.42 H new ATOM 0 HB3 PRO A 140 3.455 -15.672 7.000 1.00 63.42 H new ATOM 0 HG2 PRO A 140 2.351 -18.007 8.550 1.00 21.22 H new ATOM 0 HG3 PRO A 140 3.246 -18.011 7.043 1.00 21.22 H new ATOM 0 HD2 PRO A 140 4.452 -18.576 9.419 1.00 32.35 H new ATOM 0 HD3 PRO A 140 5.320 -17.788 8.116 1.00 32.35 H new ATOM 2185 N ASN A 141 2.177 -16.323 10.979 1.00 34.11 N ATOM 2186 CA ASN A 141 1.152 -16.269 12.015 1.00 33.42 C ATOM 2187 C ASN A 141 1.783 -16.145 13.399 1.00 53.33 C ATOM 2188 O ASN A 141 1.161 -16.477 14.408 1.00 44.43 O ATOM 2189 CB ASN A 141 0.270 -17.519 11.955 1.00 3.32 C ATOM 2190 CG ASN A 141 -0.015 -17.957 10.532 1.00 53.23 C ATOM 2191 OD1 ASN A 141 -0.675 -17.247 9.773 1.00 51.05 O ATOM 2192 ND2 ASN A 141 0.482 -19.132 10.164 1.00 75.04 N ATOM 0 H ASN A 141 2.655 -17.221 10.905 1.00 34.11 H new ATOM 0 HA ASN A 141 0.536 -15.388 11.836 1.00 33.42 H new ATOM 0 HB2 ASN A 141 0.759 -18.332 12.491 1.00 3.32 H new ATOM 0 HB3 ASN A 141 -0.672 -17.321 12.467 1.00 3.32 H new ATOM 0 HD21 ASN A 141 0.322 -19.480 9.218 1.00 75.04 H new ATOM 0 HD22 ASN A 141 1.023 -19.687 10.827 1.00 75.04 H new ATOM 2199 N ALA A 142 3.021 -15.663 13.437 1.00 71.30 N ATOM 2200 CA ALA A 142 3.735 -15.492 14.696 1.00 43.01 C ATOM 2201 C ALA A 142 2.900 -14.703 15.698 1.00 33.13 C ATOM 2202 O ALA A 142 2.729 -13.492 15.561 1.00 13.41 O ATOM 2203 CB ALA A 142 5.068 -14.799 14.456 1.00 25.11 C ATOM 0 H ALA A 142 3.550 -15.384 12.611 1.00 71.30 H new ATOM 0 HA ALA A 142 3.921 -16.480 15.117 1.00 43.01 H new ATOM 0 HB1 ALA A 142 5.591 -14.678 15.405 1.00 25.11 H new ATOM 0 HB2 ALA A 142 5.675 -15.402 13.781 1.00 25.11 H new ATOM 0 HB3 ALA A 142 4.894 -13.820 14.010 1.00 25.11 H new ATOM 2209 N ASP A 143 2.381 -15.397 16.705 1.00 21.31 N ATOM 2210 CA ASP A 143 1.563 -14.761 17.731 1.00 21.22 C ATOM 2211 C ASP A 143 1.699 -15.491 19.064 1.00 3.52 C ATOM 2212 O ASP A 143 2.560 -16.357 19.225 1.00 0.10 O ATOM 2213 CB ASP A 143 0.096 -14.732 17.299 1.00 22.40 C ATOM 2214 CG ASP A 143 -0.600 -13.446 17.699 1.00 61.34 C ATOM 2215 OD1 ASP A 143 -0.355 -12.964 18.824 1.00 1.42 O ATOM 2216 OD2 ASP A 143 -1.389 -12.922 16.885 1.00 1.13 O ATOM 0 H ASP A 143 2.512 -16.400 16.833 1.00 21.31 H new ATOM 0 HA ASP A 143 1.916 -13.738 17.859 1.00 21.22 H new ATOM 0 HB2 ASP A 143 0.036 -14.853 16.217 1.00 22.40 H new ATOM 0 HB3 ASP A 143 -0.427 -15.578 17.744 1.00 22.40 H new ATOM 2221 N LEU A 144 0.846 -15.134 20.018 1.00 52.14 N ATOM 2222 CA LEU A 144 0.871 -15.754 21.338 1.00 1.50 C ATOM 2223 C LEU A 144 -0.252 -16.776 21.481 1.00 24.12 C ATOM 2224 O LEU A 144 -0.002 -17.957 21.721 1.00 72.43 O ATOM 2225 CB LEU A 144 0.746 -14.686 22.427 1.00 71.15 C ATOM 2226 CG LEU A 144 2.034 -13.948 22.794 1.00 33.11 C ATOM 2227 CD1 LEU A 144 3.085 -14.926 23.295 1.00 20.20 C ATOM 2228 CD2 LEU A 144 2.558 -13.164 21.600 1.00 2.44 C ATOM 0 H LEU A 144 0.129 -14.418 19.902 1.00 52.14 H new ATOM 0 HA LEU A 144 1.824 -16.271 21.452 1.00 1.50 H new ATOM 0 HB2 LEU A 144 0.009 -13.951 22.104 1.00 71.15 H new ATOM 0 HB3 LEU A 144 0.352 -15.158 23.327 1.00 71.15 H new ATOM 0 HG LEU A 144 1.811 -13.244 23.596 1.00 33.11 H new ATOM 0 HD11 LEU A 144 3.995 -14.383 23.551 1.00 20.20 H new ATOM 0 HD12 LEU A 144 2.710 -15.443 24.178 1.00 20.20 H new ATOM 0 HD13 LEU A 144 3.305 -15.655 22.515 1.00 20.20 H new ATOM 0 HD21 LEU A 144 3.475 -12.645 21.879 1.00 2.44 H new ATOM 0 HD22 LEU A 144 2.765 -13.849 20.778 1.00 2.44 H new ATOM 0 HD23 LEU A 144 1.810 -12.436 21.286 1.00 2.44 H new TER 2240 LEU A 144