USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1057 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 43 ASN : amide:sc= -1.95 K(o=-5.2,f=-4.1) USER MOD Set 1.2: A 44 ASN : amide:sc= -3.27! C(o=-5.2!,f=-6!) USER MOD Set 2.1: A 33 TYR OH : rot 180:sc= 0.0288 USER MOD Set 2.2: A 128 GLN : amide:sc= 0.0277 X(o=0.057,f=0.5) USER MOD Set 3.1: A 19 SER OG : rot -120:sc= 0.474 USER MOD Set 3.2: A 22 GLN : amide:sc= 0.986 K(o=1.5,f=-1.1) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 25:sc= 0.125 USER MOD Single : A 5 SER OG : rot 31:sc= 0.301 USER MOD Single : A 6 SER OG : rot 180:sc= -0.148 USER MOD Single : A 9 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0566) USER MOD Single : A 12 THR OG1 : rot 110:sc=-0.00726 USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 MET CE :methyl 155:sc= -0.747 (180deg=-1.21) USER MOD Single : A 25 ASN : amide:sc=-0.00294 X(o=-0.0029,f=-0.18) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 TYR OH : rot -152:sc= -0.0244 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= -4.91! C(o=-4.9!,f=-3.7!) USER MOD Single : A 53 THR OG1 : rot 61:sc= 1.09 USER MOD Single : A 54 GLN : amide:sc= -0.76 K(o=-0.76,f=-2.5) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= 0.3 K(o=0.3,f=-5.6!) USER MOD Single : A 63 SER OG : rot 180:sc= -0.0416 USER MOD Single : A 66 GLN : amide:sc= -0.0675 K(o=-0.068,f=-0.64) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 ASN : amide:sc= -0.299 K(o=-0.3,f=-0.91) USER MOD Single : A 81 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 GLN : amide:sc= -4.24 K(o=-4.2,f=-9.3!) USER MOD Single : A 85 THR OG1 : rot -160:sc= 0 USER MOD Single : A 86 TYR OH : rot 180:sc= -0.184 USER MOD Single : A 89 ASN : amide:sc= -0.488 K(o=-0.49,f=-1.7!) USER MOD Single : A 93 SER OG : rot -134:sc= 0.887 USER MOD Single : A 94 ASN : amide:sc= -0.119 K(o=-0.12,f=-3!) USER MOD Single : A 97 THR OG1 : rot 180:sc= -0.151 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 TYR OH : rot -39:sc= 0.00195 USER MOD Single : A 107 SER OG : rot -99:sc= 0.0208 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ -153:sc= -0.138 (180deg=-0.597) USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot -90:sc= 0.52 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 150:sc= -0.625 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 HIS : no HD1:sc= -0.615 K(o=-0.61,f=-0.054) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot -55:sc= 0.1 USER MOD Single : A 136 HIS : no HD1:sc= -1.09 K(o=-1.1,f=-1.8) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 ASN : amide:sc= -0.355 X(o=-0.36,f=-0.58) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 145 SER OG : rot 40:sc= 0.705 USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -14.346 22.250 -22.491 1.00 0.00 N ATOM 2 CA GLY A 1 -14.203 22.327 -21.049 1.00 0.00 C ATOM 3 C GLY A 1 -14.900 21.185 -20.336 1.00 0.00 C ATOM 4 O GLY A 1 -15.969 21.368 -19.754 1.00 0.00 O ATOM 0 H1 GLY A 1 -13.853 23.052 -22.932 1.00 0.00 H new ATOM 0 H2 GLY A 1 -13.933 21.359 -22.834 1.00 0.00 H new ATOM 0 H3 GLY A 1 -15.355 22.284 -22.742 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -13.144 22.320 -20.791 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -14.611 23.274 -20.696 1.00 0.00 H new ATOM 8 N SER A 2 -14.294 20.003 -20.382 1.00 0.00 N ATOM 9 CA SER A 2 -14.866 18.826 -19.740 1.00 0.00 C ATOM 10 C SER A 2 -14.051 18.426 -18.513 1.00 0.00 C ATOM 11 O SER A 2 -12.821 18.398 -18.554 1.00 0.00 O ATOM 12 CB SER A 2 -14.927 17.659 -20.728 1.00 0.00 C ATOM 13 OG SER A 2 -16.054 17.771 -21.580 1.00 0.00 O ATOM 0 H SER A 2 -13.407 19.835 -20.857 1.00 0.00 H new ATOM 0 HA SER A 2 -15.877 19.074 -19.418 1.00 0.00 H new ATOM 0 HB2 SER A 2 -14.016 17.637 -21.326 1.00 0.00 H new ATOM 0 HB3 SER A 2 -14.973 16.717 -20.181 1.00 0.00 H new ATOM 0 HG SER A 2 -16.070 17.015 -22.203 1.00 0.00 H new ATOM 19 N SER A 3 -14.747 18.118 -17.423 1.00 0.00 N ATOM 20 CA SER A 3 -14.089 17.723 -16.183 1.00 0.00 C ATOM 21 C SER A 3 -14.942 16.723 -15.410 1.00 0.00 C ATOM 22 O SER A 3 -16.062 17.029 -15.002 1.00 0.00 O ATOM 23 CB SER A 3 -13.812 18.952 -15.315 1.00 0.00 C ATOM 24 OG SER A 3 -12.593 19.574 -15.685 1.00 0.00 O ATOM 0 H SER A 3 -15.766 18.134 -17.374 1.00 0.00 H new ATOM 0 HA SER A 3 -13.143 17.246 -16.438 1.00 0.00 H new ATOM 0 HB2 SER A 3 -14.632 19.664 -15.414 1.00 0.00 H new ATOM 0 HB3 SER A 3 -13.770 18.658 -14.266 1.00 0.00 H new ATOM 0 HG SER A 3 -12.388 19.362 -16.620 1.00 0.00 H new ATOM 30 N GLY A 4 -14.404 15.523 -15.213 1.00 0.00 N ATOM 31 CA GLY A 4 -15.128 14.494 -14.490 1.00 0.00 C ATOM 32 C GLY A 4 -14.298 13.864 -13.390 1.00 0.00 C ATOM 33 O GLY A 4 -13.603 12.874 -13.617 1.00 0.00 O ATOM 0 H GLY A 4 -13.479 15.245 -15.542 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -16.031 14.925 -14.058 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -15.447 13.720 -15.188 1.00 0.00 H new ATOM 37 N SER A 5 -14.367 14.440 -12.194 1.00 0.00 N ATOM 38 CA SER A 5 -13.611 13.932 -11.055 1.00 0.00 C ATOM 39 C SER A 5 -14.394 14.114 -9.759 1.00 0.00 C ATOM 40 O SER A 5 -14.706 15.236 -9.361 1.00 0.00 O ATOM 41 CB SER A 5 -12.261 14.645 -10.953 1.00 0.00 C ATOM 42 OG SER A 5 -12.429 16.052 -10.922 1.00 0.00 O ATOM 0 H SER A 5 -14.939 15.259 -11.989 1.00 0.00 H new ATOM 0 HA SER A 5 -13.440 12.867 -11.210 1.00 0.00 H new ATOM 0 HB2 SER A 5 -11.740 14.318 -10.053 1.00 0.00 H new ATOM 0 HB3 SER A 5 -11.635 14.369 -11.802 1.00 0.00 H new ATOM 0 HG SER A 5 -13.280 16.270 -10.487 1.00 0.00 H new ATOM 48 N SER A 6 -14.708 13.000 -9.104 1.00 0.00 N ATOM 49 CA SER A 6 -15.458 13.035 -7.854 1.00 0.00 C ATOM 50 C SER A 6 -14.651 13.719 -6.754 1.00 0.00 C ATOM 51 O SER A 6 -15.165 14.569 -6.029 1.00 0.00 O ATOM 52 CB SER A 6 -15.832 11.616 -7.419 1.00 0.00 C ATOM 53 OG SER A 6 -14.688 10.892 -7.001 1.00 0.00 O ATOM 0 H SER A 6 -14.455 12.063 -9.418 1.00 0.00 H new ATOM 0 HA SER A 6 -16.369 13.609 -8.023 1.00 0.00 H new ATOM 0 HB2 SER A 6 -16.555 11.661 -6.605 1.00 0.00 H new ATOM 0 HB3 SER A 6 -16.314 11.094 -8.246 1.00 0.00 H new ATOM 0 HG SER A 6 -14.954 9.990 -6.727 1.00 0.00 H new ATOM 59 N GLY A 7 -13.382 13.341 -6.638 1.00 0.00 N ATOM 60 CA GLY A 7 -12.523 13.927 -5.626 1.00 0.00 C ATOM 61 C GLY A 7 -11.070 13.532 -5.799 1.00 0.00 C ATOM 62 O GLY A 7 -10.329 14.175 -6.543 1.00 0.00 O ATOM 0 H GLY A 7 -12.933 12.639 -7.227 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -12.608 15.013 -5.666 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -12.866 13.617 -4.639 1.00 0.00 H new ATOM 66 N VAL A 8 -10.659 12.473 -5.109 1.00 0.00 N ATOM 67 CA VAL A 8 -9.285 11.994 -5.190 1.00 0.00 C ATOM 68 C VAL A 8 -9.077 11.126 -6.426 1.00 0.00 C ATOM 69 O VAL A 8 -9.782 10.138 -6.631 1.00 0.00 O ATOM 70 CB VAL A 8 -8.898 11.184 -3.937 1.00 0.00 C ATOM 71 CG1 VAL A 8 -9.716 9.904 -3.855 1.00 0.00 C ATOM 72 CG2 VAL A 8 -7.409 10.876 -3.942 1.00 0.00 C ATOM 0 H VAL A 8 -11.259 11.930 -4.487 1.00 0.00 H new ATOM 0 HA VAL A 8 -8.647 12.875 -5.256 1.00 0.00 H new ATOM 0 HB VAL A 8 -9.119 11.784 -3.054 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -9.429 9.345 -2.964 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -10.776 10.152 -3.802 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -9.530 9.296 -4.740 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -7.153 10.304 -3.050 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -7.161 10.295 -4.830 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -6.845 11.808 -3.949 1.00 0.00 H new ATOM 82 N LYS A 9 -8.103 11.502 -7.248 1.00 0.00 N ATOM 83 CA LYS A 9 -7.799 10.758 -8.465 1.00 0.00 C ATOM 84 C LYS A 9 -7.360 9.335 -8.137 1.00 0.00 C ATOM 85 O LYS A 9 -6.816 9.074 -7.065 1.00 0.00 O ATOM 86 CB LYS A 9 -6.703 11.470 -9.262 1.00 0.00 C ATOM 87 CG LYS A 9 -7.186 12.721 -9.977 1.00 0.00 C ATOM 88 CD LYS A 9 -6.111 13.295 -10.884 1.00 0.00 C ATOM 89 CE LYS A 9 -6.087 12.594 -12.233 1.00 0.00 C ATOM 90 NZ LYS A 9 -7.219 13.023 -13.101 1.00 0.00 N ATOM 0 H LYS A 9 -7.510 12.318 -7.094 1.00 0.00 H new ATOM 0 HA LYS A 9 -8.706 10.710 -9.068 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -5.890 11.738 -8.587 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -6.292 10.778 -9.997 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -8.072 12.485 -10.566 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -7.481 13.470 -9.242 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -6.287 14.361 -11.030 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -5.137 13.196 -10.404 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -5.143 12.806 -12.736 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -6.133 11.515 -12.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -7.059 12.686 -14.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -8.107 12.622 -12.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -7.282 14.061 -13.101 1.00 0.00 H new ATOM 104 N PHE A 10 -7.600 8.417 -9.069 1.00 0.00 N ATOM 105 CA PHE A 10 -7.229 7.020 -8.879 1.00 0.00 C ATOM 106 C PHE A 10 -6.061 6.639 -9.784 1.00 0.00 C ATOM 107 O PHE A 10 -5.935 7.146 -10.900 1.00 0.00 O ATOM 108 CB PHE A 10 -8.426 6.110 -9.161 1.00 0.00 C ATOM 109 CG PHE A 10 -9.595 6.357 -8.251 1.00 0.00 C ATOM 110 CD1 PHE A 10 -9.510 6.069 -6.898 1.00 0.00 C ATOM 111 CD2 PHE A 10 -10.779 6.878 -8.748 1.00 0.00 C ATOM 112 CE1 PHE A 10 -10.585 6.295 -6.059 1.00 0.00 C ATOM 113 CE2 PHE A 10 -11.857 7.107 -7.914 1.00 0.00 C ATOM 114 CZ PHE A 10 -11.759 6.816 -6.567 1.00 0.00 C ATOM 0 H PHE A 10 -8.050 8.616 -9.963 1.00 0.00 H new ATOM 0 HA PHE A 10 -6.919 6.890 -7.842 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -8.744 6.251 -10.194 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -8.113 5.071 -9.063 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -8.594 5.664 -6.495 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -10.860 7.108 -9.800 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -10.507 6.064 -5.007 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -12.774 7.513 -8.315 1.00 0.00 H new ATOM 0 HZ PHE A 10 -12.599 6.996 -5.912 1.00 0.00 H new ATOM 124 N LEU A 11 -5.210 5.744 -9.296 1.00 0.00 N ATOM 125 CA LEU A 11 -4.051 5.294 -10.060 1.00 0.00 C ATOM 126 C LEU A 11 -3.116 6.459 -10.367 1.00 0.00 C ATOM 127 O LEU A 11 -2.615 6.591 -11.484 1.00 0.00 O ATOM 128 CB LEU A 11 -4.501 4.630 -11.363 1.00 0.00 C ATOM 129 CG LEU A 11 -5.311 3.342 -11.215 1.00 0.00 C ATOM 130 CD1 LEU A 11 -5.824 2.875 -12.568 1.00 0.00 C ATOM 131 CD2 LEU A 11 -4.471 2.256 -10.558 1.00 0.00 C ATOM 0 H LEU A 11 -5.300 5.315 -8.375 1.00 0.00 H new ATOM 0 HA LEU A 11 -3.509 4.566 -9.456 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -5.097 5.348 -11.926 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -3.616 4.412 -11.961 1.00 0.00 H new ATOM 0 HG LEU A 11 -6.169 3.547 -10.575 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -6.398 1.957 -12.442 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -6.462 3.646 -13.001 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -4.980 2.687 -13.232 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -5.064 1.346 -10.461 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -3.593 2.053 -11.172 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -4.153 2.589 -9.570 1.00 0.00 H new ATOM 143 N THR A 12 -2.881 7.302 -9.366 1.00 0.00 N ATOM 144 CA THR A 12 -2.005 8.456 -9.527 1.00 0.00 C ATOM 145 C THR A 12 -1.257 8.763 -8.235 1.00 0.00 C ATOM 146 O THR A 12 -1.843 8.769 -7.153 1.00 0.00 O ATOM 147 CB THR A 12 -2.795 9.705 -9.959 1.00 0.00 C ATOM 148 OG1 THR A 12 -4.078 9.718 -9.323 1.00 0.00 O ATOM 149 CG2 THR A 12 -2.972 9.738 -11.470 1.00 0.00 C ATOM 0 H THR A 12 -3.286 7.207 -8.435 1.00 0.00 H new ATOM 0 HA THR A 12 -1.287 8.202 -10.307 1.00 0.00 H new ATOM 0 HB THR A 12 -2.231 10.587 -9.656 1.00 0.00 H new ATOM 0 HG1 THR A 12 -4.105 10.434 -8.655 1.00 0.00 H new ATOM 0 HG21 THR A 12 -3.533 10.629 -11.751 1.00 0.00 H new ATOM 0 HG22 THR A 12 -1.994 9.758 -11.951 1.00 0.00 H new ATOM 0 HG23 THR A 12 -3.516 8.850 -11.792 1.00 0.00 H new ATOM 157 N VAL A 13 0.042 9.019 -8.355 1.00 0.00 N ATOM 158 CA VAL A 13 0.871 9.329 -7.196 1.00 0.00 C ATOM 159 C VAL A 13 0.535 10.706 -6.633 1.00 0.00 C ATOM 160 O VAL A 13 0.896 11.729 -7.212 1.00 0.00 O ATOM 161 CB VAL A 13 2.369 9.283 -7.549 1.00 0.00 C ATOM 162 CG1 VAL A 13 3.208 9.782 -6.383 1.00 0.00 C ATOM 163 CG2 VAL A 13 2.779 7.874 -7.948 1.00 0.00 C ATOM 0 H VAL A 13 0.543 9.018 -9.243 1.00 0.00 H new ATOM 0 HA VAL A 13 0.659 8.570 -6.443 1.00 0.00 H new ATOM 0 HB VAL A 13 2.545 9.942 -8.399 1.00 0.00 H new ATOM 0 HG11 VAL A 13 4.264 9.742 -6.651 1.00 0.00 H new ATOM 0 HG12 VAL A 13 2.931 10.810 -6.150 1.00 0.00 H new ATOM 0 HG13 VAL A 13 3.031 9.152 -5.511 1.00 0.00 H new ATOM 0 HG21 VAL A 13 3.841 7.860 -8.194 1.00 0.00 H new ATOM 0 HG22 VAL A 13 2.590 7.192 -7.119 1.00 0.00 H new ATOM 0 HG23 VAL A 13 2.201 7.559 -8.817 1.00 0.00 H new ATOM 173 N ASN A 14 -0.159 10.722 -5.500 1.00 0.00 N ATOM 174 CA ASN A 14 -0.545 11.973 -4.857 1.00 0.00 C ATOM 175 C ASN A 14 0.602 12.531 -4.021 1.00 0.00 C ATOM 176 O ASN A 14 1.006 11.932 -3.024 1.00 0.00 O ATOM 177 CB ASN A 14 -1.777 11.759 -3.975 1.00 0.00 C ATOM 178 CG ASN A 14 -2.890 11.031 -4.704 1.00 0.00 C ATOM 179 OD1 ASN A 14 -3.666 11.639 -5.441 1.00 0.00 O ATOM 180 ND2 ASN A 14 -2.974 9.722 -4.499 1.00 0.00 N ATOM 0 H ASN A 14 -0.466 9.883 -5.008 1.00 0.00 H new ATOM 0 HA ASN A 14 -0.787 12.694 -5.638 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -1.493 11.190 -3.090 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -2.144 12.725 -3.628 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -3.704 9.179 -4.961 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -2.309 9.259 -3.879 1.00 0.00 H new ATOM 187 N ASP A 15 1.123 13.681 -4.434 1.00 0.00 N ATOM 188 CA ASP A 15 2.223 14.322 -3.722 1.00 0.00 C ATOM 189 C ASP A 15 2.034 14.206 -2.213 1.00 0.00 C ATOM 190 O ASP A 15 2.925 13.745 -1.499 1.00 0.00 O ATOM 191 CB ASP A 15 2.330 15.794 -4.124 1.00 0.00 C ATOM 192 CG ASP A 15 2.788 15.970 -5.558 1.00 0.00 C ATOM 193 OD1 ASP A 15 1.974 15.729 -6.474 1.00 0.00 O ATOM 194 OD2 ASP A 15 3.960 16.349 -5.765 1.00 0.00 O ATOM 0 H ASP A 15 0.802 14.189 -5.258 1.00 0.00 H new ATOM 0 HA ASP A 15 3.147 13.811 -3.995 1.00 0.00 H new ATOM 0 HB2 ASP A 15 1.360 16.275 -3.994 1.00 0.00 H new ATOM 0 HB3 ASP A 15 3.029 16.300 -3.458 1.00 0.00 H new ATOM 199 N ASP A 16 0.869 14.629 -1.733 1.00 0.00 N ATOM 200 CA ASP A 16 0.564 14.573 -0.309 1.00 0.00 C ATOM 201 C ASP A 16 1.186 13.337 0.333 1.00 0.00 C ATOM 202 O ASP A 16 0.671 12.227 0.193 1.00 0.00 O ATOM 203 CB ASP A 16 -0.950 14.569 -0.090 1.00 0.00 C ATOM 204 CG ASP A 16 -1.562 15.946 -0.251 1.00 0.00 C ATOM 205 OD1 ASP A 16 -1.276 16.824 0.590 1.00 0.00 O ATOM 206 OD2 ASP A 16 -2.329 16.146 -1.217 1.00 0.00 O ATOM 0 H ASP A 16 0.121 15.014 -2.310 1.00 0.00 H new ATOM 0 HA ASP A 16 0.990 15.458 0.163 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.415 13.883 -0.798 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -1.169 14.192 0.909 1.00 0.00 H new ATOM 211 N ILE A 17 2.296 13.536 1.035 1.00 0.00 N ATOM 212 CA ILE A 17 2.988 12.438 1.698 1.00 0.00 C ATOM 213 C ILE A 17 2.296 12.059 3.002 1.00 0.00 C ATOM 214 O ILE A 17 1.992 12.919 3.829 1.00 0.00 O ATOM 215 CB ILE A 17 4.457 12.795 1.994 1.00 0.00 C ATOM 216 CG1 ILE A 17 4.532 14.030 2.894 1.00 0.00 C ATOM 217 CG2 ILE A 17 5.217 13.031 0.698 1.00 0.00 C ATOM 218 CD1 ILE A 17 5.945 14.507 3.149 1.00 0.00 C ATOM 0 H ILE A 17 2.736 14.448 1.159 1.00 0.00 H new ATOM 0 HA ILE A 17 2.959 11.589 1.015 1.00 0.00 H new ATOM 0 HB ILE A 17 4.921 11.958 2.516 1.00 0.00 H new ATOM 0 HG12 ILE A 17 3.961 14.838 2.437 1.00 0.00 H new ATOM 0 HG13 ILE A 17 4.056 13.804 3.848 1.00 0.00 H new ATOM 0 HG21 ILE A 17 6.253 13.282 0.924 1.00 0.00 H new ATOM 0 HG22 ILE A 17 5.187 12.127 0.089 1.00 0.00 H new ATOM 0 HG23 ILE A 17 4.756 13.853 0.150 1.00 0.00 H new ATOM 0 HD11 ILE A 17 5.922 15.385 3.794 1.00 0.00 H new ATOM 0 HD12 ILE A 17 6.514 13.715 3.635 1.00 0.00 H new ATOM 0 HD13 ILE A 17 6.418 14.765 2.202 1.00 0.00 H new ATOM 230 N LEU A 18 2.050 10.765 3.180 1.00 0.00 N ATOM 231 CA LEU A 18 1.394 10.270 4.386 1.00 0.00 C ATOM 232 C LEU A 18 1.881 8.867 4.733 1.00 0.00 C ATOM 233 O LEU A 18 2.088 8.035 3.850 1.00 0.00 O ATOM 234 CB LEU A 18 -0.124 10.264 4.199 1.00 0.00 C ATOM 235 CG LEU A 18 -0.794 11.636 4.106 1.00 0.00 C ATOM 236 CD1 LEU A 18 -2.234 11.496 3.636 1.00 0.00 C ATOM 237 CD2 LEU A 18 -0.737 12.349 5.449 1.00 0.00 C ATOM 0 H LEU A 18 2.295 10.040 2.505 1.00 0.00 H new ATOM 0 HA LEU A 18 1.649 10.937 5.209 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.356 9.706 3.292 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -0.570 9.719 5.031 1.00 0.00 H new ATOM 0 HG LEU A 18 -0.251 12.235 3.375 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -2.695 12.482 3.576 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -2.252 11.027 2.652 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -2.789 10.879 4.343 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -1.218 13.323 5.364 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -1.255 11.752 6.200 1.00 0.00 H new ATOM 0 HD23 LEU A 18 0.303 12.483 5.746 1.00 0.00 H new ATOM 249 N SER A 19 2.060 8.611 6.025 1.00 0.00 N ATOM 250 CA SER A 19 2.523 7.309 6.489 1.00 0.00 C ATOM 251 C SER A 19 1.542 6.210 6.093 1.00 0.00 C ATOM 252 O SER A 19 0.396 6.485 5.737 1.00 0.00 O ATOM 253 CB SER A 19 2.707 7.321 8.008 1.00 0.00 C ATOM 254 OG SER A 19 1.461 7.450 8.671 1.00 0.00 O ATOM 0 H SER A 19 1.891 9.288 6.769 1.00 0.00 H new ATOM 0 HA SER A 19 3.483 7.103 6.015 1.00 0.00 H new ATOM 0 HB2 SER A 19 3.198 6.401 8.325 1.00 0.00 H new ATOM 0 HB3 SER A 19 3.361 8.146 8.292 1.00 0.00 H new ATOM 0 HG SER A 19 1.464 8.264 9.217 1.00 0.00 H new ATOM 260 N MET A 20 2.000 4.964 6.158 1.00 0.00 N ATOM 261 CA MET A 20 1.163 3.823 5.807 1.00 0.00 C ATOM 262 C MET A 20 -0.187 3.901 6.515 1.00 0.00 C ATOM 263 O MET A 20 -1.245 3.783 5.898 1.00 0.00 O ATOM 264 CB MET A 20 1.868 2.515 6.172 1.00 0.00 C ATOM 265 CG MET A 20 1.552 1.370 5.223 1.00 0.00 C ATOM 266 SD MET A 20 0.142 0.386 5.767 1.00 0.00 S ATOM 267 CE MET A 20 -0.442 -0.263 4.203 1.00 0.00 C ATOM 0 H MET A 20 2.946 4.719 6.450 1.00 0.00 H new ATOM 0 HA MET A 20 0.991 3.847 4.731 1.00 0.00 H new ATOM 0 HB2 MET A 20 2.945 2.682 6.181 1.00 0.00 H new ATOM 0 HB3 MET A 20 1.582 2.227 7.184 1.00 0.00 H new ATOM 0 HG2 MET A 20 1.348 1.772 4.230 1.00 0.00 H new ATOM 0 HG3 MET A 20 2.427 0.726 5.133 1.00 0.00 H new ATOM 0 HE1 MET A 20 -0.985 -1.193 4.375 1.00 0.00 H new ATOM 0 HE2 MET A 20 -1.105 0.463 3.733 1.00 0.00 H new ATOM 0 HE3 MET A 20 0.408 -0.455 3.548 1.00 0.00 H new ATOM 277 N PRO A 21 -0.150 4.104 7.840 1.00 0.00 N ATOM 278 CA PRO A 21 -1.362 4.202 8.660 1.00 0.00 C ATOM 279 C PRO A 21 -2.144 5.482 8.386 1.00 0.00 C ATOM 280 O PRO A 21 -3.228 5.686 8.932 1.00 0.00 O ATOM 281 CB PRO A 21 -0.822 4.201 10.092 1.00 0.00 C ATOM 282 CG PRO A 21 0.567 4.727 9.974 1.00 0.00 C ATOM 283 CD PRO A 21 1.077 4.254 8.641 1.00 0.00 C ATOM 0 HA PRO A 21 -2.061 3.392 8.453 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -1.429 4.829 10.744 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -0.830 3.198 10.517 1.00 0.00 H new ATOM 0 HG2 PRO A 21 0.578 5.815 10.032 1.00 0.00 H new ATOM 0 HG3 PRO A 21 1.194 4.358 10.785 1.00 0.00 H new ATOM 0 HD2 PRO A 21 1.763 4.974 8.195 1.00 0.00 H new ATOM 0 HD3 PRO A 21 1.617 3.311 8.729 1.00 0.00 H new ATOM 291 N GLN A 22 -1.588 6.341 7.538 1.00 0.00 N ATOM 292 CA GLN A 22 -2.235 7.601 7.193 1.00 0.00 C ATOM 293 C GLN A 22 -2.772 7.564 5.766 1.00 0.00 C ATOM 294 O GLN A 22 -3.759 8.227 5.447 1.00 0.00 O ATOM 295 CB GLN A 22 -1.252 8.763 7.350 1.00 0.00 C ATOM 296 CG GLN A 22 -1.086 9.229 8.788 1.00 0.00 C ATOM 297 CD GLN A 22 0.047 10.223 8.951 1.00 0.00 C ATOM 298 OE1 GLN A 22 1.162 9.856 9.321 1.00 0.00 O ATOM 299 NE2 GLN A 22 -0.235 11.491 8.677 1.00 0.00 N ATOM 0 H GLN A 22 -0.691 6.187 7.077 1.00 0.00 H new ATOM 0 HA GLN A 22 -3.073 7.748 7.874 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -0.280 8.461 6.960 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -1.593 9.601 6.742 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -2.016 9.685 9.128 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -0.902 8.365 9.427 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -1.173 11.751 8.373 1.00 0.00 H new ATOM 0 HE22 GLN A 22 0.487 12.206 8.770 1.00 0.00 H new ATOM 308 N ALA A 23 -2.116 6.786 4.912 1.00 0.00 N ATOM 309 CA ALA A 23 -2.530 6.662 3.519 1.00 0.00 C ATOM 310 C ALA A 23 -3.750 5.756 3.388 1.00 0.00 C ATOM 311 O ALA A 23 -4.831 6.207 3.008 1.00 0.00 O ATOM 312 CB ALA A 23 -1.382 6.130 2.674 1.00 0.00 C ATOM 0 H ALA A 23 -1.296 6.232 5.160 1.00 0.00 H new ATOM 0 HA ALA A 23 -2.805 7.653 3.157 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -1.704 6.042 1.636 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -0.537 6.816 2.735 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -1.081 5.150 3.045 1.00 0.00 H new ATOM 318 N ARG A 24 -3.569 4.478 3.703 1.00 0.00 N ATOM 319 CA ARG A 24 -4.655 3.509 3.618 1.00 0.00 C ATOM 320 C ARG A 24 -5.937 4.075 4.221 1.00 0.00 C ATOM 321 O ARG A 24 -7.034 3.819 3.726 1.00 0.00 O ATOM 322 CB ARG A 24 -4.269 2.214 4.335 1.00 0.00 C ATOM 323 CG ARG A 24 -4.131 2.370 5.841 1.00 0.00 C ATOM 324 CD ARG A 24 -3.761 1.054 6.506 1.00 0.00 C ATOM 325 NE ARG A 24 -4.940 0.298 6.919 1.00 0.00 N ATOM 326 CZ ARG A 24 -5.592 0.516 8.056 1.00 0.00 C ATOM 327 NH1 ARG A 24 -5.181 1.462 8.888 1.00 0.00 N ATOM 328 NH2 ARG A 24 -6.657 -0.214 8.362 1.00 0.00 N ATOM 0 H ARG A 24 -2.681 4.089 4.019 1.00 0.00 H new ATOM 0 HA ARG A 24 -4.834 3.293 2.565 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -5.021 1.454 4.124 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -3.326 1.850 3.928 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -3.369 3.117 6.062 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -5.069 2.738 6.257 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -3.169 0.453 5.816 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -3.134 1.251 7.376 1.00 0.00 H new ATOM 0 HE ARG A 24 -5.282 -0.438 6.301 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -4.362 2.025 8.656 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -5.683 1.627 9.760 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -6.976 -0.943 7.724 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -7.157 -0.046 9.235 1.00 0.00 H new ATOM 342 N ASN A 25 -5.790 4.846 5.294 1.00 0.00 N ATOM 343 CA ASN A 25 -6.936 5.447 5.966 1.00 0.00 C ATOM 344 C ASN A 25 -7.565 6.535 5.100 1.00 0.00 C ATOM 345 O ASN A 25 -8.776 6.752 5.140 1.00 0.00 O ATOM 346 CB ASN A 25 -6.514 6.034 7.314 1.00 0.00 C ATOM 347 CG ASN A 25 -7.397 7.189 7.745 1.00 0.00 C ATOM 348 OD1 ASN A 25 -8.601 7.024 7.942 1.00 0.00 O ATOM 349 ND2 ASN A 25 -6.801 8.366 7.893 1.00 0.00 N ATOM 0 H ASN A 25 -4.889 5.069 5.716 1.00 0.00 H new ATOM 0 HA ASN A 25 -7.677 4.666 6.134 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -6.547 5.253 8.073 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -5.480 6.374 7.251 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -7.344 9.180 8.181 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -5.800 8.456 7.719 1.00 0.00 H new ATOM 356 N PHE A 26 -6.734 7.215 4.318 1.00 0.00 N ATOM 357 CA PHE A 26 -7.207 8.281 3.443 1.00 0.00 C ATOM 358 C PHE A 26 -7.993 7.710 2.267 1.00 0.00 C ATOM 359 O PHE A 26 -9.166 8.033 2.072 1.00 0.00 O ATOM 360 CB PHE A 26 -6.028 9.110 2.929 1.00 0.00 C ATOM 361 CG PHE A 26 -6.437 10.238 2.026 1.00 0.00 C ATOM 362 CD1 PHE A 26 -6.716 10.006 0.688 1.00 0.00 C ATOM 363 CD2 PHE A 26 -6.544 11.530 2.514 1.00 0.00 C ATOM 364 CE1 PHE A 26 -7.091 11.043 -0.145 1.00 0.00 C ATOM 365 CE2 PHE A 26 -6.919 12.571 1.686 1.00 0.00 C ATOM 366 CZ PHE A 26 -7.194 12.327 0.355 1.00 0.00 C ATOM 0 H PHE A 26 -5.729 7.047 4.272 1.00 0.00 H new ATOM 0 HA PHE A 26 -7.869 8.925 4.022 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -5.481 9.516 3.780 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -5.341 8.456 2.392 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.639 9.004 0.292 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.332 11.726 3.555 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -7.303 10.850 -1.186 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -6.997 13.574 2.079 1.00 0.00 H new ATOM 0 HZ PHE A 26 -7.489 13.138 -0.294 1.00 0.00 H new ATOM 376 N CYS A 27 -7.339 6.858 1.484 1.00 0.00 N ATOM 377 CA CYS A 27 -7.974 6.241 0.325 1.00 0.00 C ATOM 378 C CYS A 27 -9.379 5.754 0.670 1.00 0.00 C ATOM 379 O CYS A 27 -10.290 5.823 -0.153 1.00 0.00 O ATOM 380 CB CYS A 27 -7.128 5.073 -0.184 1.00 0.00 C ATOM 381 SG CYS A 27 -5.599 5.578 -1.035 1.00 0.00 S ATOM 0 H CYS A 27 -6.369 6.579 1.631 1.00 0.00 H new ATOM 0 HA CYS A 27 -8.052 6.994 -0.460 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -6.868 4.433 0.659 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -7.730 4.473 -0.866 1.00 0.00 H new ATOM 386 N ALA A 28 -9.545 5.262 1.894 1.00 0.00 N ATOM 387 CA ALA A 28 -10.837 4.766 2.349 1.00 0.00 C ATOM 388 C ALA A 28 -11.830 5.908 2.532 1.00 0.00 C ATOM 389 O ALA A 28 -12.941 5.869 2.002 1.00 0.00 O ATOM 390 CB ALA A 28 -10.677 3.989 3.647 1.00 0.00 C ATOM 0 H ALA A 28 -8.800 5.197 2.588 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.231 4.096 1.584 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.650 3.624 3.975 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -10.009 3.143 3.485 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -10.257 4.642 4.412 1.00 0.00 H new ATOM 396 N SER A 29 -11.424 6.924 3.286 1.00 0.00 N ATOM 397 CA SER A 29 -12.280 8.076 3.543 1.00 0.00 C ATOM 398 C SER A 29 -12.816 8.657 2.238 1.00 0.00 C ATOM 399 O SER A 29 -13.981 9.044 2.150 1.00 0.00 O ATOM 400 CB SER A 29 -11.509 9.150 4.314 1.00 0.00 C ATOM 401 OG SER A 29 -11.540 8.898 5.708 1.00 0.00 O ATOM 0 H SER A 29 -10.507 6.973 3.730 1.00 0.00 H new ATOM 0 HA SER A 29 -13.125 7.742 4.146 1.00 0.00 H new ATOM 0 HB2 SER A 29 -10.475 9.178 3.969 1.00 0.00 H new ATOM 0 HB3 SER A 29 -11.940 10.130 4.109 1.00 0.00 H new ATOM 0 HG SER A 29 -11.039 9.597 6.178 1.00 0.00 H new ATOM 407 N ALA A 30 -11.956 8.714 1.226 1.00 0.00 N ATOM 408 CA ALA A 30 -12.342 9.245 -0.075 1.00 0.00 C ATOM 409 C ALA A 30 -13.306 8.304 -0.788 1.00 0.00 C ATOM 410 O ALA A 30 -14.246 8.745 -1.448 1.00 0.00 O ATOM 411 CB ALA A 30 -11.108 9.489 -0.932 1.00 0.00 C ATOM 0 H ALA A 30 -10.988 8.399 1.283 1.00 0.00 H new ATOM 0 HA ALA A 30 -12.854 10.194 0.084 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -11.411 9.886 -1.901 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -10.455 10.206 -0.434 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -10.573 8.550 -1.075 1.00 0.00 H new ATOM 417 N GLY A 31 -13.067 7.003 -0.651 1.00 0.00 N ATOM 418 CA GLY A 31 -13.923 6.020 -1.289 1.00 0.00 C ATOM 419 C GLY A 31 -13.137 4.993 -2.080 1.00 0.00 C ATOM 420 O GLY A 31 -13.520 4.629 -3.190 1.00 0.00 O ATOM 0 H GLY A 31 -12.296 6.613 -0.110 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -14.517 5.512 -0.529 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -14.622 6.528 -1.953 1.00 0.00 H new ATOM 424 N GLY A 32 -12.032 4.526 -1.506 1.00 0.00 N ATOM 425 CA GLY A 32 -11.206 3.541 -2.180 1.00 0.00 C ATOM 426 C GLY A 32 -10.186 2.908 -1.255 1.00 0.00 C ATOM 427 O GLY A 32 -10.372 2.886 -0.038 1.00 0.00 O ATOM 0 H GLY A 32 -11.694 4.812 -0.587 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -11.844 2.763 -2.599 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -10.690 4.015 -3.015 1.00 0.00 H new ATOM 431 N TYR A 33 -9.107 2.392 -1.831 1.00 0.00 N ATOM 432 CA TYR A 33 -8.055 1.752 -1.050 1.00 0.00 C ATOM 433 C TYR A 33 -6.736 1.743 -1.816 1.00 0.00 C ATOM 434 O TYR A 33 -6.687 2.093 -2.996 1.00 0.00 O ATOM 435 CB TYR A 33 -8.457 0.321 -0.689 1.00 0.00 C ATOM 436 CG TYR A 33 -8.483 -0.618 -1.874 1.00 0.00 C ATOM 437 CD1 TYR A 33 -9.212 -0.308 -3.015 1.00 0.00 C ATOM 438 CD2 TYR A 33 -7.778 -1.815 -1.852 1.00 0.00 C ATOM 439 CE1 TYR A 33 -9.239 -1.163 -4.100 1.00 0.00 C ATOM 440 CE2 TYR A 33 -7.798 -2.676 -2.932 1.00 0.00 C ATOM 441 CZ TYR A 33 -8.530 -2.345 -4.054 1.00 0.00 C ATOM 442 OH TYR A 33 -8.553 -3.200 -5.132 1.00 0.00 O ATOM 0 H TYR A 33 -8.937 2.404 -2.837 1.00 0.00 H new ATOM 0 HA TYR A 33 -7.918 2.326 -0.134 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -7.761 -0.066 0.055 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -9.444 0.336 -0.226 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -9.767 0.617 -3.055 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -7.204 -2.077 -0.975 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -9.812 -0.907 -4.979 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -7.244 -3.603 -2.898 1.00 0.00 H new ATOM 0 HH TYR A 33 -8.001 -3.986 -4.938 1.00 0.00 H new ATOM 452 N LEU A 34 -5.667 1.340 -1.137 1.00 0.00 N ATOM 453 CA LEU A 34 -4.346 1.284 -1.753 1.00 0.00 C ATOM 454 C LEU A 34 -4.353 0.371 -2.975 1.00 0.00 C ATOM 455 O LEU A 34 -5.036 -0.652 -2.994 1.00 0.00 O ATOM 456 CB LEU A 34 -3.311 0.792 -0.740 1.00 0.00 C ATOM 457 CG LEU A 34 -2.793 1.834 0.251 1.00 0.00 C ATOM 458 CD1 LEU A 34 -2.002 1.166 1.365 1.00 0.00 C ATOM 459 CD2 LEU A 34 -1.939 2.872 -0.463 1.00 0.00 C ATOM 0 H LEU A 34 -5.689 1.047 -0.160 1.00 0.00 H new ATOM 0 HA LEU A 34 -4.080 2.290 -2.077 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -3.748 -0.031 -0.175 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -2.460 0.387 -1.288 1.00 0.00 H new ATOM 0 HG LEU A 34 -3.650 2.341 0.695 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.642 1.924 2.060 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -2.644 0.463 1.896 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.153 0.632 0.939 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -1.579 3.606 0.258 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -1.089 2.381 -0.936 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.537 3.374 -1.224 1.00 0.00 H new ATOM 471 N ALA A 35 -3.586 0.748 -3.993 1.00 0.00 N ATOM 472 CA ALA A 35 -3.500 -0.038 -5.217 1.00 0.00 C ATOM 473 C ALA A 35 -2.509 -1.187 -5.063 1.00 0.00 C ATOM 474 O ALA A 35 -1.389 -0.994 -4.589 1.00 0.00 O ATOM 475 CB ALA A 35 -3.105 0.850 -6.388 1.00 0.00 C ATOM 0 H ALA A 35 -3.015 1.593 -3.994 1.00 0.00 H new ATOM 0 HA ALA A 35 -4.483 -0.465 -5.415 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -3.045 0.250 -7.296 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -3.852 1.632 -6.520 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -2.135 1.305 -6.189 1.00 0.00 H new ATOM 481 N ASP A 36 -2.928 -2.381 -5.466 1.00 0.00 N ATOM 482 CA ASP A 36 -2.076 -3.561 -5.373 1.00 0.00 C ATOM 483 C ASP A 36 -0.904 -3.463 -6.344 1.00 0.00 C ATOM 484 O ASP A 36 -0.917 -2.650 -7.269 1.00 0.00 O ATOM 485 CB ASP A 36 -2.888 -4.826 -5.660 1.00 0.00 C ATOM 486 CG ASP A 36 -3.550 -4.791 -7.024 1.00 0.00 C ATOM 487 OD1 ASP A 36 -2.896 -5.188 -8.012 1.00 0.00 O ATOM 488 OD2 ASP A 36 -4.722 -4.369 -7.103 1.00 0.00 O ATOM 0 H ASP A 36 -3.852 -2.558 -5.860 1.00 0.00 H new ATOM 0 HA ASP A 36 -1.680 -3.614 -4.359 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -2.234 -5.696 -5.599 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -3.652 -4.946 -4.892 1.00 0.00 H new ATOM 493 N ASP A 37 0.109 -4.295 -6.127 1.00 0.00 N ATOM 494 CA ASP A 37 1.290 -4.302 -6.982 1.00 0.00 C ATOM 495 C ASP A 37 1.617 -5.718 -7.445 1.00 0.00 C ATOM 496 O ASP A 37 2.783 -6.069 -7.630 1.00 0.00 O ATOM 497 CB ASP A 37 2.487 -3.705 -6.241 1.00 0.00 C ATOM 498 CG ASP A 37 3.568 -3.216 -7.185 1.00 0.00 C ATOM 499 OD1 ASP A 37 3.285 -3.086 -8.394 1.00 0.00 O ATOM 500 OD2 ASP A 37 4.695 -2.961 -6.713 1.00 0.00 O ATOM 0 H ASP A 37 0.136 -4.973 -5.366 1.00 0.00 H new ATOM 0 HA ASP A 37 1.076 -3.692 -7.860 1.00 0.00 H new ATOM 0 HB2 ASP A 37 2.149 -2.876 -5.620 1.00 0.00 H new ATOM 0 HB3 ASP A 37 2.906 -4.455 -5.571 1.00 0.00 H new ATOM 505 N LEU A 38 0.581 -6.529 -7.630 1.00 0.00 N ATOM 506 CA LEU A 38 0.758 -7.908 -8.071 1.00 0.00 C ATOM 507 C LEU A 38 0.254 -8.093 -9.499 1.00 0.00 C ATOM 508 O LEU A 38 -0.950 -8.063 -9.752 1.00 0.00 O ATOM 509 CB LEU A 38 0.021 -8.863 -7.130 1.00 0.00 C ATOM 510 CG LEU A 38 -1.506 -8.801 -7.172 1.00 0.00 C ATOM 511 CD1 LEU A 38 -2.054 -9.801 -8.179 1.00 0.00 C ATOM 512 CD2 LEU A 38 -2.089 -9.059 -5.790 1.00 0.00 C ATOM 0 H LEU A 38 -0.390 -6.255 -7.481 1.00 0.00 H new ATOM 0 HA LEU A 38 1.824 -8.136 -8.050 1.00 0.00 H new ATOM 0 HB2 LEU A 38 0.330 -9.882 -7.364 1.00 0.00 H new ATOM 0 HB3 LEU A 38 0.345 -8.658 -6.110 1.00 0.00 H new ATOM 0 HG LEU A 38 -1.801 -7.800 -7.488 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -3.142 -9.742 -8.195 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -1.664 -9.570 -9.170 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.749 -10.808 -7.894 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.177 -9.011 -5.839 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.785 -10.047 -5.445 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -1.724 -8.304 -5.094 1.00 0.00 H new ATOM 524 N GLY A 39 1.184 -8.285 -10.429 1.00 0.00 N ATOM 525 CA GLY A 39 0.814 -8.474 -11.820 1.00 0.00 C ATOM 526 C GLY A 39 1.824 -7.870 -12.775 1.00 0.00 C ATOM 527 O GLY A 39 2.002 -6.652 -12.813 1.00 0.00 O ATOM 0 H GLY A 39 2.187 -8.313 -10.245 1.00 0.00 H new ATOM 0 HA2 GLY A 39 0.717 -9.540 -12.025 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -0.163 -8.025 -11.997 1.00 0.00 H new ATOM 531 N ASP A 40 2.488 -8.722 -13.548 1.00 0.00 N ATOM 532 CA ASP A 40 3.486 -8.266 -14.508 1.00 0.00 C ATOM 533 C ASP A 40 3.026 -6.990 -15.206 1.00 0.00 C ATOM 534 O ASP A 40 3.835 -6.120 -15.528 1.00 0.00 O ATOM 535 CB ASP A 40 3.765 -9.356 -15.544 1.00 0.00 C ATOM 536 CG ASP A 40 4.316 -10.622 -14.918 1.00 0.00 C ATOM 537 OD1 ASP A 40 3.643 -11.188 -14.031 1.00 0.00 O ATOM 538 OD2 ASP A 40 5.420 -11.048 -15.317 1.00 0.00 O ATOM 0 H ASP A 40 2.353 -9.733 -13.528 1.00 0.00 H new ATOM 0 HA ASP A 40 4.405 -8.050 -13.963 1.00 0.00 H new ATOM 0 HB2 ASP A 40 2.844 -9.589 -16.079 1.00 0.00 H new ATOM 0 HB3 ASP A 40 4.475 -8.980 -16.281 1.00 0.00 H new ATOM 543 N ASP A 41 1.722 -6.885 -15.436 1.00 0.00 N ATOM 544 CA ASP A 41 1.153 -5.715 -16.096 1.00 0.00 C ATOM 545 C ASP A 41 0.932 -4.583 -15.098 1.00 0.00 C ATOM 546 O ASP A 41 1.096 -3.408 -15.429 1.00 0.00 O ATOM 547 CB ASP A 41 -0.168 -6.078 -16.775 1.00 0.00 C ATOM 548 CG ASP A 41 0.017 -7.066 -17.910 1.00 0.00 C ATOM 549 OD1 ASP A 41 0.984 -6.907 -18.683 1.00 0.00 O ATOM 550 OD2 ASP A 41 -0.807 -7.999 -18.025 1.00 0.00 O ATOM 0 H ASP A 41 1.039 -7.596 -15.175 1.00 0.00 H new ATOM 0 HA ASP A 41 1.860 -5.375 -16.853 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -0.849 -6.501 -16.036 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -0.637 -5.172 -17.159 1.00 0.00 H new ATOM 555 N LYS A 42 0.558 -4.943 -13.875 1.00 0.00 N ATOM 556 CA LYS A 42 0.314 -3.959 -12.827 1.00 0.00 C ATOM 557 C LYS A 42 1.603 -3.235 -12.450 1.00 0.00 C ATOM 558 O LYS A 42 1.665 -2.007 -12.470 1.00 0.00 O ATOM 559 CB LYS A 42 -0.283 -4.636 -11.592 1.00 0.00 C ATOM 560 CG LYS A 42 -1.208 -3.734 -10.792 1.00 0.00 C ATOM 561 CD LYS A 42 -2.544 -3.546 -11.489 1.00 0.00 C ATOM 562 CE LYS A 42 -3.164 -2.199 -11.151 1.00 0.00 C ATOM 563 NZ LYS A 42 -4.200 -1.800 -12.144 1.00 0.00 N ATOM 0 H LYS A 42 0.417 -5.911 -13.585 1.00 0.00 H new ATOM 0 HA LYS A 42 -0.396 -3.226 -13.210 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -0.835 -5.523 -11.905 1.00 0.00 H new ATOM 0 HB3 LYS A 42 0.527 -4.976 -10.947 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -1.370 -4.163 -9.803 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -0.734 -2.764 -10.645 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -2.407 -3.624 -12.568 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -3.225 -4.345 -11.195 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -3.611 -2.244 -10.158 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -2.384 -1.439 -11.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -4.598 -0.877 -11.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -3.768 -1.732 -13.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -4.958 -2.512 -12.160 1.00 0.00 H new ATOM 577 N ASN A 43 2.630 -4.006 -12.107 1.00 0.00 N ATOM 578 CA ASN A 43 3.918 -3.438 -11.726 1.00 0.00 C ATOM 579 C ASN A 43 4.483 -2.570 -12.846 1.00 0.00 C ATOM 580 O ASN A 43 4.811 -1.403 -12.636 1.00 0.00 O ATOM 581 CB ASN A 43 4.909 -4.551 -11.380 1.00 0.00 C ATOM 582 CG ASN A 43 6.350 -4.086 -11.451 1.00 0.00 C ATOM 583 OD1 ASN A 43 6.953 -3.741 -10.435 1.00 0.00 O ATOM 584 ND2 ASN A 43 6.910 -4.075 -12.655 1.00 0.00 N ATOM 0 H ASN A 43 2.595 -5.025 -12.085 1.00 0.00 H new ATOM 0 HA ASN A 43 3.764 -2.812 -10.847 1.00 0.00 H new ATOM 0 HB2 ASN A 43 4.699 -4.922 -10.377 1.00 0.00 H new ATOM 0 HB3 ASN A 43 4.766 -5.387 -12.065 1.00 0.00 H new ATOM 0 HD21 ASN A 43 7.878 -3.772 -12.765 1.00 0.00 H new ATOM 0 HD22 ASN A 43 6.372 -4.370 -13.470 1.00 0.00 H new ATOM 591 N ASN A 44 4.592 -3.148 -14.038 1.00 0.00 N ATOM 592 CA ASN A 44 5.117 -2.428 -15.192 1.00 0.00 C ATOM 593 C ASN A 44 4.425 -1.077 -15.351 1.00 0.00 C ATOM 594 O ASN A 44 5.076 -0.057 -15.577 1.00 0.00 O ATOM 595 CB ASN A 44 4.935 -3.259 -16.464 1.00 0.00 C ATOM 596 CG ASN A 44 5.680 -4.578 -16.404 1.00 0.00 C ATOM 597 OD1 ASN A 44 6.305 -4.906 -15.395 1.00 0.00 O ATOM 598 ND2 ASN A 44 5.616 -5.344 -17.487 1.00 0.00 N ATOM 0 H ASN A 44 4.324 -4.113 -14.230 1.00 0.00 H new ATOM 0 HA ASN A 44 6.181 -2.255 -15.028 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.874 -3.451 -16.620 1.00 0.00 H new ATOM 0 HB3 ASN A 44 5.285 -2.686 -17.322 1.00 0.00 H new ATOM 0 HD21 ASN A 44 6.096 -6.244 -17.505 1.00 0.00 H new ATOM 0 HD22 ASN A 44 5.086 -5.033 -18.301 1.00 0.00 H new ATOM 605 N PHE A 45 3.102 -1.078 -15.230 1.00 0.00 N ATOM 606 CA PHE A 45 2.321 0.146 -15.360 1.00 0.00 C ATOM 607 C PHE A 45 2.765 1.186 -14.335 1.00 0.00 C ATOM 608 O PHE A 45 2.939 2.360 -14.661 1.00 0.00 O ATOM 609 CB PHE A 45 0.831 -0.153 -15.188 1.00 0.00 C ATOM 610 CG PHE A 45 0.034 1.026 -14.706 1.00 0.00 C ATOM 611 CD1 PHE A 45 -0.301 2.053 -15.574 1.00 0.00 C ATOM 612 CD2 PHE A 45 -0.379 1.107 -13.386 1.00 0.00 C ATOM 613 CE1 PHE A 45 -1.034 3.139 -15.134 1.00 0.00 C ATOM 614 CE2 PHE A 45 -1.112 2.191 -12.941 1.00 0.00 C ATOM 615 CZ PHE A 45 -1.439 3.208 -13.816 1.00 0.00 C ATOM 0 H PHE A 45 2.548 -1.913 -15.042 1.00 0.00 H new ATOM 0 HA PHE A 45 2.490 0.550 -16.358 1.00 0.00 H new ATOM 0 HB2 PHE A 45 0.424 -0.491 -16.141 1.00 0.00 H new ATOM 0 HB3 PHE A 45 0.713 -0.975 -14.481 1.00 0.00 H new ATOM 0 HD1 PHE A 45 0.014 2.004 -16.606 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -0.125 0.315 -12.697 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.290 3.933 -15.820 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -1.429 2.243 -11.910 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.011 4.056 -13.470 1.00 0.00 H new ATOM 625 N TYR A 46 2.945 0.745 -13.095 1.00 0.00 N ATOM 626 CA TYR A 46 3.366 1.636 -12.021 1.00 0.00 C ATOM 627 C TYR A 46 4.751 2.211 -12.300 1.00 0.00 C ATOM 628 O TYR A 46 4.947 3.426 -12.281 1.00 0.00 O ATOM 629 CB TYR A 46 3.370 0.892 -10.684 1.00 0.00 C ATOM 630 CG TYR A 46 1.993 0.475 -10.219 1.00 0.00 C ATOM 631 CD1 TYR A 46 0.941 1.382 -10.197 1.00 0.00 C ATOM 632 CD2 TYR A 46 1.745 -0.827 -9.802 1.00 0.00 C ATOM 633 CE1 TYR A 46 -0.318 1.006 -9.771 1.00 0.00 C ATOM 634 CE2 TYR A 46 0.488 -1.213 -9.376 1.00 0.00 C ATOM 635 CZ TYR A 46 -0.539 -0.293 -9.362 1.00 0.00 C ATOM 636 OH TYR A 46 -1.793 -0.672 -8.939 1.00 0.00 O ATOM 0 H TYR A 46 2.806 -0.224 -12.809 1.00 0.00 H new ATOM 0 HA TYR A 46 2.655 2.460 -11.968 1.00 0.00 H new ATOM 0 HB2 TYR A 46 3.998 0.006 -10.773 1.00 0.00 H new ATOM 0 HB3 TYR A 46 3.823 1.529 -9.925 1.00 0.00 H new ATOM 0 HD1 TYR A 46 1.111 2.399 -10.519 1.00 0.00 H new ATOM 0 HD2 TYR A 46 2.548 -1.549 -9.811 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -1.124 1.724 -9.758 1.00 0.00 H new ATOM 0 HE2 TYR A 46 0.311 -2.229 -9.056 1.00 0.00 H new ATOM 0 HH TYR A 46 -1.713 -1.409 -8.298 1.00 0.00 H new ATOM 646 N SER A 47 5.709 1.328 -12.561 1.00 0.00 N ATOM 647 CA SER A 47 7.078 1.746 -12.841 1.00 0.00 C ATOM 648 C SER A 47 7.097 3.064 -13.609 1.00 0.00 C ATOM 649 O SER A 47 7.841 3.983 -13.268 1.00 0.00 O ATOM 650 CB SER A 47 7.809 0.666 -13.641 1.00 0.00 C ATOM 651 OG SER A 47 9.165 1.018 -13.853 1.00 0.00 O ATOM 0 H SER A 47 5.563 0.319 -12.585 1.00 0.00 H new ATOM 0 HA SER A 47 7.589 1.893 -11.890 1.00 0.00 H new ATOM 0 HB2 SER A 47 7.756 -0.284 -13.109 1.00 0.00 H new ATOM 0 HB3 SER A 47 7.313 0.522 -14.601 1.00 0.00 H new ATOM 0 HG SER A 47 9.610 0.311 -14.365 1.00 0.00 H new ATOM 657 N SER A 48 6.273 3.148 -14.649 1.00 0.00 N ATOM 658 CA SER A 48 6.197 4.351 -15.469 1.00 0.00 C ATOM 659 C SER A 48 5.903 5.577 -14.609 1.00 0.00 C ATOM 660 O SER A 48 6.776 6.418 -14.390 1.00 0.00 O ATOM 661 CB SER A 48 5.117 4.196 -16.541 1.00 0.00 C ATOM 662 OG SER A 48 5.554 3.344 -17.586 1.00 0.00 O ATOM 0 H SER A 48 5.649 2.397 -14.943 1.00 0.00 H new ATOM 0 HA SER A 48 7.163 4.492 -15.954 1.00 0.00 H new ATOM 0 HB2 SER A 48 4.210 3.791 -16.092 1.00 0.00 H new ATOM 0 HB3 SER A 48 4.861 5.174 -16.948 1.00 0.00 H new ATOM 0 HG SER A 48 4.845 3.260 -18.258 1.00 0.00 H new ATOM 668 N ILE A 49 4.670 5.670 -14.124 1.00 0.00 N ATOM 669 CA ILE A 49 4.261 6.791 -13.287 1.00 0.00 C ATOM 670 C ILE A 49 5.127 6.888 -12.037 1.00 0.00 C ATOM 671 O ILE A 49 5.150 7.918 -11.363 1.00 0.00 O ATOM 672 CB ILE A 49 2.784 6.671 -12.867 1.00 0.00 C ATOM 673 CG1 ILE A 49 2.593 5.473 -11.934 1.00 0.00 C ATOM 674 CG2 ILE A 49 1.893 6.541 -14.093 1.00 0.00 C ATOM 675 CD1 ILE A 49 1.260 5.472 -11.218 1.00 0.00 C ATOM 0 H ILE A 49 3.936 4.982 -14.296 1.00 0.00 H new ATOM 0 HA ILE A 49 4.388 7.694 -13.885 1.00 0.00 H new ATOM 0 HB ILE A 49 2.500 7.576 -12.330 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.687 4.554 -12.512 1.00 0.00 H new ATOM 0 HG13 ILE A 49 3.394 5.467 -11.194 1.00 0.00 H new ATOM 0 HG21 ILE A 49 0.852 6.457 -13.779 1.00 0.00 H new ATOM 0 HG22 ILE A 49 2.012 7.422 -14.724 1.00 0.00 H new ATOM 0 HG23 ILE A 49 2.175 5.651 -14.655 1.00 0.00 H new ATOM 0 HD11 ILE A 49 1.193 4.595 -10.574 1.00 0.00 H new ATOM 0 HD12 ILE A 49 1.172 6.374 -10.613 1.00 0.00 H new ATOM 0 HD13 ILE A 49 0.453 5.446 -11.951 1.00 0.00 H new ATOM 687 N ALA A 50 5.841 5.809 -11.733 1.00 0.00 N ATOM 688 CA ALA A 50 6.713 5.774 -10.565 1.00 0.00 C ATOM 689 C ALA A 50 8.094 6.332 -10.894 1.00 0.00 C ATOM 690 O ALA A 50 9.068 6.055 -10.194 1.00 0.00 O ATOM 691 CB ALA A 50 6.828 4.353 -10.035 1.00 0.00 C ATOM 0 H ALA A 50 5.833 4.948 -12.279 1.00 0.00 H new ATOM 0 HA ALA A 50 6.271 6.403 -9.793 1.00 0.00 H new ATOM 0 HB1 ALA A 50 7.482 4.342 -9.163 1.00 0.00 H new ATOM 0 HB2 ALA A 50 5.840 3.989 -9.752 1.00 0.00 H new ATOM 0 HB3 ALA A 50 7.244 3.709 -10.809 1.00 0.00 H new ATOM 697 N ALA A 51 8.171 7.117 -11.963 1.00 0.00 N ATOM 698 CA ALA A 51 9.432 7.714 -12.384 1.00 0.00 C ATOM 699 C ALA A 51 10.163 8.343 -11.202 1.00 0.00 C ATOM 700 O ALA A 51 9.799 9.424 -10.740 1.00 0.00 O ATOM 701 CB ALA A 51 9.189 8.751 -13.470 1.00 0.00 C ATOM 0 H ALA A 51 7.374 7.355 -12.554 1.00 0.00 H new ATOM 0 HA ALA A 51 10.063 6.923 -12.788 1.00 0.00 H new ATOM 0 HB1 ALA A 51 10.140 9.188 -13.775 1.00 0.00 H new ATOM 0 HB2 ALA A 51 8.717 8.274 -14.329 1.00 0.00 H new ATOM 0 HB3 ALA A 51 8.536 9.534 -13.085 1.00 0.00 H new ATOM 707 N ASN A 52 11.194 7.659 -10.718 1.00 0.00 N ATOM 708 CA ASN A 52 11.975 8.152 -9.588 1.00 0.00 C ATOM 709 C ASN A 52 11.062 8.617 -8.458 1.00 0.00 C ATOM 710 O ASN A 52 11.342 9.612 -7.788 1.00 0.00 O ATOM 711 CB ASN A 52 12.883 9.300 -10.032 1.00 0.00 C ATOM 712 CG ASN A 52 12.100 10.540 -10.419 1.00 0.00 C ATOM 713 OD1 ASN A 52 11.708 11.333 -9.563 1.00 0.00 O ATOM 714 ND2 ASN A 52 11.869 10.712 -11.716 1.00 0.00 N ATOM 0 H ASN A 52 11.509 6.763 -11.090 1.00 0.00 H new ATOM 0 HA ASN A 52 12.592 7.333 -9.218 1.00 0.00 H new ATOM 0 HB2 ASN A 52 13.573 9.547 -9.225 1.00 0.00 H new ATOM 0 HB3 ASN A 52 13.486 8.975 -10.880 1.00 0.00 H new ATOM 0 HD21 ASN A 52 11.348 11.528 -12.037 1.00 0.00 H new ATOM 0 HD22 ASN A 52 12.213 10.028 -12.390 1.00 0.00 H new ATOM 721 N THR A 53 9.968 7.891 -8.251 1.00 0.00 N ATOM 722 CA THR A 53 9.013 8.229 -7.202 1.00 0.00 C ATOM 723 C THR A 53 8.686 7.013 -6.344 1.00 0.00 C ATOM 724 O THR A 53 8.357 5.947 -6.862 1.00 0.00 O ATOM 725 CB THR A 53 7.707 8.793 -7.793 1.00 0.00 C ATOM 726 OG1 THR A 53 8.001 9.860 -8.701 1.00 0.00 O ATOM 727 CG2 THR A 53 6.788 9.297 -6.690 1.00 0.00 C ATOM 0 H THR A 53 9.721 7.065 -8.796 1.00 0.00 H new ATOM 0 HA THR A 53 9.482 8.992 -6.581 1.00 0.00 H new ATOM 0 HB THR A 53 7.200 7.991 -8.329 1.00 0.00 H new ATOM 0 HG1 THR A 53 8.553 9.521 -9.437 1.00 0.00 H new ATOM 0 HG21 THR A 53 5.872 9.691 -7.131 1.00 0.00 H new ATOM 0 HG22 THR A 53 6.543 8.475 -6.017 1.00 0.00 H new ATOM 0 HG23 THR A 53 7.290 10.087 -6.131 1.00 0.00 H new ATOM 735 N GLN A 54 8.779 7.181 -5.028 1.00 0.00 N ATOM 736 CA GLN A 54 8.492 6.095 -4.098 1.00 0.00 C ATOM 737 C GLN A 54 7.169 6.331 -3.378 1.00 0.00 C ATOM 738 O GLN A 54 6.978 7.359 -2.729 1.00 0.00 O ATOM 739 CB GLN A 54 9.624 5.957 -3.078 1.00 0.00 C ATOM 740 CG GLN A 54 10.993 5.763 -3.711 1.00 0.00 C ATOM 741 CD GLN A 54 12.080 5.513 -2.684 1.00 0.00 C ATOM 742 OE1 GLN A 54 11.913 5.810 -1.501 1.00 0.00 O ATOM 743 NE2 GLN A 54 13.202 4.963 -3.133 1.00 0.00 N ATOM 0 H GLN A 54 9.050 8.058 -4.583 1.00 0.00 H new ATOM 0 HA GLN A 54 8.413 5.171 -4.670 1.00 0.00 H new ATOM 0 HB2 GLN A 54 9.646 6.847 -2.450 1.00 0.00 H new ATOM 0 HB3 GLN A 54 9.412 5.111 -2.424 1.00 0.00 H new ATOM 0 HG2 GLN A 54 10.953 4.923 -4.404 1.00 0.00 H new ATOM 0 HG3 GLN A 54 11.247 6.647 -4.296 1.00 0.00 H new ATOM 0 HE21 GLN A 54 13.297 4.733 -4.122 1.00 0.00 H new ATOM 0 HE22 GLN A 54 13.969 4.770 -2.489 1.00 0.00 H new ATOM 752 N PHE A 55 6.257 5.371 -3.497 1.00 0.00 N ATOM 753 CA PHE A 55 4.951 5.474 -2.858 1.00 0.00 C ATOM 754 C PHE A 55 4.588 4.174 -2.147 1.00 0.00 C ATOM 755 O PHE A 55 5.243 3.148 -2.335 1.00 0.00 O ATOM 756 CB PHE A 55 3.879 5.818 -3.894 1.00 0.00 C ATOM 757 CG PHE A 55 3.804 4.836 -5.028 1.00 0.00 C ATOM 758 CD1 PHE A 55 4.856 4.706 -5.920 1.00 0.00 C ATOM 759 CD2 PHE A 55 2.682 4.041 -5.201 1.00 0.00 C ATOM 760 CE1 PHE A 55 4.789 3.803 -6.964 1.00 0.00 C ATOM 761 CE2 PHE A 55 2.610 3.137 -6.243 1.00 0.00 C ATOM 762 CZ PHE A 55 3.665 3.017 -7.126 1.00 0.00 C ATOM 0 H PHE A 55 6.399 4.513 -4.030 1.00 0.00 H new ATOM 0 HA PHE A 55 5.000 6.271 -2.116 1.00 0.00 H new ATOM 0 HB2 PHE A 55 2.909 5.864 -3.399 1.00 0.00 H new ATOM 0 HB3 PHE A 55 4.079 6.811 -4.296 1.00 0.00 H new ATOM 0 HD1 PHE A 55 5.738 5.317 -5.798 1.00 0.00 H new ATOM 0 HD2 PHE A 55 1.854 4.129 -4.513 1.00 0.00 H new ATOM 0 HE1 PHE A 55 5.616 3.712 -7.653 1.00 0.00 H new ATOM 0 HE2 PHE A 55 1.729 2.524 -6.367 1.00 0.00 H new ATOM 0 HZ PHE A 55 3.611 2.310 -7.941 1.00 0.00 H new ATOM 772 N TRP A 56 3.543 4.225 -1.330 1.00 0.00 N ATOM 773 CA TRP A 56 3.093 3.051 -0.590 1.00 0.00 C ATOM 774 C TRP A 56 2.230 2.151 -1.468 1.00 0.00 C ATOM 775 O TRP A 56 1.643 2.606 -2.450 1.00 0.00 O ATOM 776 CB TRP A 56 2.308 3.476 0.653 1.00 0.00 C ATOM 777 CG TRP A 56 3.156 4.149 1.689 1.00 0.00 C ATOM 778 CD1 TRP A 56 3.076 5.451 2.094 1.00 0.00 C ATOM 779 CD2 TRP A 56 4.213 3.555 2.450 1.00 0.00 C ATOM 780 NE1 TRP A 56 4.020 5.702 3.061 1.00 0.00 N ATOM 781 CE2 TRP A 56 4.729 4.554 3.298 1.00 0.00 C ATOM 782 CE3 TRP A 56 4.772 2.275 2.500 1.00 0.00 C ATOM 783 CZ2 TRP A 56 5.777 4.312 4.182 1.00 0.00 C ATOM 784 CZ3 TRP A 56 5.812 2.036 3.378 1.00 0.00 C ATOM 785 CH2 TRP A 56 6.306 3.050 4.210 1.00 0.00 C ATOM 0 H TRP A 56 2.991 5.066 -1.163 1.00 0.00 H new ATOM 0 HA TRP A 56 3.974 2.488 -0.281 1.00 0.00 H new ATOM 0 HB2 TRP A 56 1.507 4.152 0.354 1.00 0.00 H new ATOM 0 HB3 TRP A 56 1.836 2.598 1.094 1.00 0.00 H new ATOM 0 HD1 TRP A 56 2.374 6.177 1.711 1.00 0.00 H new ATOM 0 HE1 TRP A 56 4.168 6.597 3.526 1.00 0.00 H new ATOM 0 HE3 TRP A 56 4.398 1.487 1.864 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 6.159 5.093 4.823 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 6.252 1.051 3.424 1.00 0.00 H new ATOM 0 HH2 TRP A 56 7.119 2.831 4.886 1.00 0.00 H new ATOM 796 N ILE A 57 2.159 0.874 -1.108 1.00 0.00 N ATOM 797 CA ILE A 57 1.366 -0.088 -1.864 1.00 0.00 C ATOM 798 C ILE A 57 0.402 -0.842 -0.953 1.00 0.00 C ATOM 799 O ILE A 57 0.345 -0.592 0.250 1.00 0.00 O ATOM 800 CB ILE A 57 2.262 -1.103 -2.597 1.00 0.00 C ATOM 801 CG1 ILE A 57 3.265 -1.727 -1.624 1.00 0.00 C ATOM 802 CG2 ILE A 57 2.987 -0.432 -3.754 1.00 0.00 C ATOM 803 CD1 ILE A 57 4.005 -2.915 -2.198 1.00 0.00 C ATOM 0 H ILE A 57 2.640 0.482 -0.299 1.00 0.00 H new ATOM 0 HA ILE A 57 0.797 0.480 -2.600 1.00 0.00 H new ATOM 0 HB ILE A 57 1.632 -1.896 -2.999 1.00 0.00 H new ATOM 0 HG12 ILE A 57 3.988 -0.969 -1.325 1.00 0.00 H new ATOM 0 HG13 ILE A 57 2.738 -2.039 -0.722 1.00 0.00 H new ATOM 0 HG21 ILE A 57 3.616 -1.163 -4.262 1.00 0.00 H new ATOM 0 HG22 ILE A 57 2.257 -0.031 -4.457 1.00 0.00 H new ATOM 0 HG23 ILE A 57 3.608 0.379 -3.373 1.00 0.00 H new ATOM 0 HD11 ILE A 57 4.699 -3.306 -1.454 1.00 0.00 H new ATOM 0 HD12 ILE A 57 3.290 -3.691 -2.471 1.00 0.00 H new ATOM 0 HD13 ILE A 57 4.560 -2.605 -3.083 1.00 0.00 H new ATOM 815 N GLY A 58 -0.353 -1.767 -1.537 1.00 0.00 N ATOM 816 CA GLY A 58 -1.303 -2.545 -0.764 1.00 0.00 C ATOM 817 C GLY A 58 -0.640 -3.667 0.010 1.00 0.00 C ATOM 818 O GLY A 58 -1.309 -4.425 0.715 1.00 0.00 O ATOM 0 H GLY A 58 -0.324 -1.992 -2.532 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -1.826 -1.888 -0.069 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -2.055 -2.964 -1.433 1.00 0.00 H new ATOM 822 N LEU A 59 0.677 -3.776 -0.121 1.00 0.00 N ATOM 823 CA LEU A 59 1.431 -4.816 0.570 1.00 0.00 C ATOM 824 C LEU A 59 1.872 -4.342 1.952 1.00 0.00 C ATOM 825 O LEU A 59 2.660 -3.404 2.075 1.00 0.00 O ATOM 826 CB LEU A 59 2.653 -5.222 -0.256 1.00 0.00 C ATOM 827 CG LEU A 59 3.169 -6.644 -0.035 1.00 0.00 C ATOM 828 CD1 LEU A 59 2.033 -7.648 -0.146 1.00 0.00 C ATOM 829 CD2 LEU A 59 4.272 -6.972 -1.032 1.00 0.00 C ATOM 0 H LEU A 59 1.245 -3.157 -0.699 1.00 0.00 H new ATOM 0 HA LEU A 59 0.780 -5.681 0.693 1.00 0.00 H new ATOM 0 HB2 LEU A 59 2.408 -5.106 -1.312 1.00 0.00 H new ATOM 0 HB3 LEU A 59 3.462 -4.525 -0.038 1.00 0.00 H new ATOM 0 HG LEU A 59 3.584 -6.707 0.971 1.00 0.00 H new ATOM 0 HD11 LEU A 59 2.420 -8.654 0.014 1.00 0.00 H new ATOM 0 HD12 LEU A 59 1.276 -7.426 0.607 1.00 0.00 H new ATOM 0 HD13 LEU A 59 1.587 -7.585 -1.139 1.00 0.00 H new ATOM 0 HD21 LEU A 59 4.628 -7.988 -0.860 1.00 0.00 H new ATOM 0 HD22 LEU A 59 3.881 -6.891 -2.046 1.00 0.00 H new ATOM 0 HD23 LEU A 59 5.098 -6.272 -0.904 1.00 0.00 H new ATOM 841 N PHE A 60 1.359 -4.997 2.988 1.00 0.00 N ATOM 842 CA PHE A 60 1.700 -4.643 4.361 1.00 0.00 C ATOM 843 C PHE A 60 1.888 -5.894 5.214 1.00 0.00 C ATOM 844 O PHE A 60 1.173 -6.884 5.052 1.00 0.00 O ATOM 845 CB PHE A 60 0.611 -3.757 4.967 1.00 0.00 C ATOM 846 CG PHE A 60 -0.720 -4.442 5.089 1.00 0.00 C ATOM 847 CD1 PHE A 60 -0.949 -5.365 6.097 1.00 0.00 C ATOM 848 CD2 PHE A 60 -1.743 -4.162 4.197 1.00 0.00 C ATOM 849 CE1 PHE A 60 -2.173 -5.998 6.211 1.00 0.00 C ATOM 850 CE2 PHE A 60 -2.969 -4.791 4.307 1.00 0.00 C ATOM 851 CZ PHE A 60 -3.184 -5.709 5.315 1.00 0.00 C ATOM 0 H PHE A 60 0.706 -5.776 2.903 1.00 0.00 H new ATOM 0 HA PHE A 60 2.640 -4.091 4.345 1.00 0.00 H new ATOM 0 HB2 PHE A 60 0.932 -3.425 5.954 1.00 0.00 H new ATOM 0 HB3 PHE A 60 0.496 -2.864 4.352 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -0.163 -5.592 6.801 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -1.580 -3.444 3.407 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -2.338 -6.717 6.999 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -3.758 -4.564 3.605 1.00 0.00 H new ATOM 0 HZ PHE A 60 -4.141 -6.201 5.403 1.00 0.00 H new ATOM 861 N LYS A 61 2.855 -5.843 6.124 1.00 0.00 N ATOM 862 CA LYS A 61 3.138 -6.970 7.004 1.00 0.00 C ATOM 863 C LYS A 61 2.256 -6.924 8.248 1.00 0.00 C ATOM 864 O LYS A 61 2.331 -5.985 9.039 1.00 0.00 O ATOM 865 CB LYS A 61 4.613 -6.967 7.412 1.00 0.00 C ATOM 866 CG LYS A 61 4.995 -8.122 8.322 1.00 0.00 C ATOM 867 CD LYS A 61 6.502 -8.228 8.486 1.00 0.00 C ATOM 868 CE LYS A 61 7.141 -8.952 7.311 1.00 0.00 C ATOM 869 NZ LYS A 61 8.621 -8.786 7.295 1.00 0.00 N ATOM 0 H LYS A 61 3.456 -5.032 6.271 1.00 0.00 H new ATOM 0 HA LYS A 61 2.920 -7.888 6.459 1.00 0.00 H new ATOM 0 HB2 LYS A 61 5.230 -7.004 6.514 1.00 0.00 H new ATOM 0 HB3 LYS A 61 4.840 -6.028 7.916 1.00 0.00 H new ATOM 0 HG2 LYS A 61 4.531 -7.986 9.299 1.00 0.00 H new ATOM 0 HG3 LYS A 61 4.606 -9.054 7.911 1.00 0.00 H new ATOM 0 HD2 LYS A 61 6.930 -7.230 8.576 1.00 0.00 H new ATOM 0 HD3 LYS A 61 6.732 -8.758 9.410 1.00 0.00 H new ATOM 0 HE2 LYS A 61 6.895 -10.013 7.361 1.00 0.00 H new ATOM 0 HE3 LYS A 61 6.723 -8.571 6.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 9.019 -9.294 6.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 8.856 -7.776 7.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 9.023 -9.172 8.173 1.00 0.00 H new ATOM 883 N ASN A 62 1.421 -7.945 8.414 1.00 0.00 N ATOM 884 CA ASN A 62 0.525 -8.021 9.562 1.00 0.00 C ATOM 885 C ASN A 62 1.292 -8.397 10.826 1.00 0.00 C ATOM 886 O ASN A 62 2.515 -8.537 10.805 1.00 0.00 O ATOM 887 CB ASN A 62 -0.585 -9.042 9.302 1.00 0.00 C ATOM 888 CG ASN A 62 -1.856 -8.719 10.063 1.00 0.00 C ATOM 889 OD1 ASN A 62 -1.866 -7.855 10.939 1.00 0.00 O ATOM 890 ND2 ASN A 62 -2.937 -9.415 9.730 1.00 0.00 N ATOM 0 H ASN A 62 1.346 -8.731 7.768 1.00 0.00 H new ATOM 0 HA ASN A 62 0.078 -7.038 9.709 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -0.802 -9.075 8.234 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -0.236 -10.035 9.587 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -3.822 -9.242 10.207 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -2.882 -10.122 8.997 1.00 0.00 H new ATOM 897 N SER A 63 0.564 -8.559 11.927 1.00 0.00 N ATOM 898 CA SER A 63 1.176 -8.915 13.202 1.00 0.00 C ATOM 899 C SER A 63 1.919 -10.244 13.095 1.00 0.00 C ATOM 900 O SER A 63 3.117 -10.321 13.367 1.00 0.00 O ATOM 901 CB SER A 63 0.110 -9.000 14.296 1.00 0.00 C ATOM 902 OG SER A 63 -0.968 -9.828 13.895 1.00 0.00 O ATOM 0 H SER A 63 -0.450 -8.449 11.961 1.00 0.00 H new ATOM 0 HA SER A 63 1.894 -8.137 13.463 1.00 0.00 H new ATOM 0 HB2 SER A 63 0.554 -9.393 15.211 1.00 0.00 H new ATOM 0 HB3 SER A 63 -0.261 -8.001 14.525 1.00 0.00 H new ATOM 0 HG SER A 63 -1.635 -9.867 14.612 1.00 0.00 H new ATOM 908 N ASP A 64 1.199 -11.287 12.698 1.00 0.00 N ATOM 909 CA ASP A 64 1.788 -12.613 12.554 1.00 0.00 C ATOM 910 C ASP A 64 3.172 -12.526 11.918 1.00 0.00 C ATOM 911 O ASP A 64 4.076 -13.284 12.266 1.00 0.00 O ATOM 912 CB ASP A 64 0.881 -13.509 11.710 1.00 0.00 C ATOM 913 CG ASP A 64 -0.319 -14.014 12.488 1.00 0.00 C ATOM 914 OD1 ASP A 64 -1.129 -13.176 12.940 1.00 0.00 O ATOM 915 OD2 ASP A 64 -0.449 -15.246 12.644 1.00 0.00 O ATOM 0 H ASP A 64 0.206 -11.240 12.470 1.00 0.00 H new ATOM 0 HA ASP A 64 1.891 -13.048 13.548 1.00 0.00 H new ATOM 0 HB2 ASP A 64 0.537 -12.954 10.837 1.00 0.00 H new ATOM 0 HB3 ASP A 64 1.456 -14.359 11.342 1.00 0.00 H new ATOM 920 N GLY A 65 3.330 -11.596 10.980 1.00 0.00 N ATOM 921 CA GLY A 65 4.605 -11.428 10.309 1.00 0.00 C ATOM 922 C GLY A 65 4.531 -11.759 8.832 1.00 0.00 C ATOM 923 O GLY A 65 5.557 -11.955 8.181 1.00 0.00 O ATOM 0 H GLY A 65 2.597 -10.956 10.673 1.00 0.00 H new ATOM 0 HA2 GLY A 65 4.943 -10.399 10.431 1.00 0.00 H new ATOM 0 HA3 GLY A 65 5.349 -12.067 10.784 1.00 0.00 H new ATOM 927 N GLN A 66 3.314 -11.823 8.302 1.00 0.00 N ATOM 928 CA GLN A 66 3.110 -12.135 6.892 1.00 0.00 C ATOM 929 C GLN A 66 2.576 -10.922 6.137 1.00 0.00 C ATOM 930 O GLN A 66 1.941 -10.044 6.722 1.00 0.00 O ATOM 931 CB GLN A 66 2.143 -13.310 6.742 1.00 0.00 C ATOM 932 CG GLN A 66 2.395 -14.435 7.733 1.00 0.00 C ATOM 933 CD GLN A 66 1.889 -15.775 7.235 1.00 0.00 C ATOM 934 OE1 GLN A 66 2.068 -16.124 6.068 1.00 0.00 O ATOM 935 NE2 GLN A 66 1.254 -16.534 8.120 1.00 0.00 N ATOM 0 H GLN A 66 2.454 -11.663 8.827 1.00 0.00 H new ATOM 0 HA GLN A 66 4.074 -12.410 6.464 1.00 0.00 H new ATOM 0 HB2 GLN A 66 1.122 -12.948 6.867 1.00 0.00 H new ATOM 0 HB3 GLN A 66 2.219 -13.705 5.729 1.00 0.00 H new ATOM 0 HG2 GLN A 66 3.464 -14.506 7.932 1.00 0.00 H new ATOM 0 HG3 GLN A 66 1.909 -14.196 8.679 1.00 0.00 H new ATOM 0 HE21 GLN A 66 1.128 -16.205 9.077 1.00 0.00 H new ATOM 0 HE22 GLN A 66 0.892 -17.446 7.843 1.00 0.00 H new ATOM 944 N PHE A 67 2.838 -10.879 4.835 1.00 0.00 N ATOM 945 CA PHE A 67 2.384 -9.773 4.000 1.00 0.00 C ATOM 946 C PHE A 67 0.972 -10.027 3.480 1.00 0.00 C ATOM 947 O PHE A 67 0.635 -11.145 3.090 1.00 0.00 O ATOM 948 CB PHE A 67 3.343 -9.566 2.826 1.00 0.00 C ATOM 949 CG PHE A 67 4.670 -8.991 3.230 1.00 0.00 C ATOM 950 CD1 PHE A 67 4.761 -7.696 3.715 1.00 0.00 C ATOM 951 CD2 PHE A 67 5.828 -9.745 3.126 1.00 0.00 C ATOM 952 CE1 PHE A 67 5.981 -7.164 4.087 1.00 0.00 C ATOM 953 CE2 PHE A 67 7.051 -9.219 3.497 1.00 0.00 C ATOM 954 CZ PHE A 67 7.127 -7.927 3.979 1.00 0.00 C ATOM 0 H PHE A 67 3.362 -11.597 4.335 1.00 0.00 H new ATOM 0 HA PHE A 67 2.369 -8.871 4.612 1.00 0.00 H new ATOM 0 HB2 PHE A 67 3.507 -10.522 2.328 1.00 0.00 H new ATOM 0 HB3 PHE A 67 2.875 -8.903 2.098 1.00 0.00 H new ATOM 0 HD1 PHE A 67 3.868 -7.095 3.803 1.00 0.00 H new ATOM 0 HD2 PHE A 67 5.774 -10.756 2.750 1.00 0.00 H new ATOM 0 HE1 PHE A 67 6.038 -6.153 4.462 1.00 0.00 H new ATOM 0 HE2 PHE A 67 7.946 -9.817 3.410 1.00 0.00 H new ATOM 0 HZ PHE A 67 8.081 -7.514 4.271 1.00 0.00 H new ATOM 964 N TYR A 68 0.152 -8.983 3.478 1.00 0.00 N ATOM 965 CA TYR A 68 -1.224 -9.092 3.009 1.00 0.00 C ATOM 966 C TYR A 68 -1.541 -8.003 1.990 1.00 0.00 C ATOM 967 O TYR A 68 -0.743 -7.090 1.772 1.00 0.00 O ATOM 968 CB TYR A 68 -2.196 -9.001 4.188 1.00 0.00 C ATOM 969 CG TYR A 68 -2.064 -10.142 5.171 1.00 0.00 C ATOM 970 CD1 TYR A 68 -0.966 -10.233 6.017 1.00 0.00 C ATOM 971 CD2 TYR A 68 -3.038 -11.130 5.253 1.00 0.00 C ATOM 972 CE1 TYR A 68 -0.841 -11.274 6.916 1.00 0.00 C ATOM 973 CE2 TYR A 68 -2.922 -12.174 6.150 1.00 0.00 C ATOM 974 CZ TYR A 68 -1.822 -12.242 6.979 1.00 0.00 C ATOM 975 OH TYR A 68 -1.702 -13.280 7.874 1.00 0.00 O ATOM 0 H TYR A 68 0.416 -8.051 3.796 1.00 0.00 H new ATOM 0 HA TYR A 68 -1.339 -10.062 2.525 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -2.031 -8.060 4.712 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -3.217 -8.978 3.806 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -0.197 -9.476 5.971 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -3.900 -11.081 4.604 1.00 0.00 H new ATOM 0 HE1 TYR A 68 0.020 -11.330 7.566 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -3.689 -12.933 6.202 1.00 0.00 H new ATOM 0 HH TYR A 68 -2.477 -13.874 7.792 1.00 0.00 H new ATOM 985 N TRP A 69 -2.710 -8.105 1.368 1.00 0.00 N ATOM 986 CA TRP A 69 -3.134 -7.128 0.371 1.00 0.00 C ATOM 987 C TRP A 69 -4.353 -6.351 0.855 1.00 0.00 C ATOM 988 O TRP A 69 -5.394 -6.935 1.155 1.00 0.00 O ATOM 989 CB TRP A 69 -3.450 -7.825 -0.953 1.00 0.00 C ATOM 990 CG TRP A 69 -2.230 -8.322 -1.669 1.00 0.00 C ATOM 991 CD1 TRP A 69 -1.902 -9.623 -1.923 1.00 0.00 C ATOM 992 CD2 TRP A 69 -1.177 -7.525 -2.221 1.00 0.00 C ATOM 993 NE1 TRP A 69 -0.707 -9.683 -2.600 1.00 0.00 N ATOM 994 CE2 TRP A 69 -0.243 -8.409 -2.795 1.00 0.00 C ATOM 995 CE3 TRP A 69 -0.933 -6.151 -2.288 1.00 0.00 C ATOM 996 CZ2 TRP A 69 0.915 -7.961 -3.426 1.00 0.00 C ATOM 997 CZ3 TRP A 69 0.217 -5.708 -2.914 1.00 0.00 C ATOM 998 CH2 TRP A 69 1.129 -6.611 -3.477 1.00 0.00 C ATOM 0 H TRP A 69 -3.381 -8.854 1.536 1.00 0.00 H new ATOM 0 HA TRP A 69 -2.316 -6.424 0.217 1.00 0.00 H new ATOM 0 HB2 TRP A 69 -4.118 -8.665 -0.763 1.00 0.00 H new ATOM 0 HB3 TRP A 69 -3.986 -7.132 -1.601 1.00 0.00 H new ATOM 0 HD1 TRP A 69 -2.494 -10.479 -1.635 1.00 0.00 H new ATOM 0 HE1 TRP A 69 -0.242 -10.537 -2.907 1.00 0.00 H new ATOM 0 HE3 TRP A 69 -1.631 -5.447 -1.858 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 1.619 -8.655 -3.860 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 0.416 -4.648 -2.970 1.00 0.00 H new ATOM 0 HH2 TRP A 69 2.018 -6.234 -3.960 1.00 0.00 H new ATOM 1009 N ASP A 70 -4.217 -5.032 0.927 1.00 0.00 N ATOM 1010 CA ASP A 70 -5.309 -4.174 1.373 1.00 0.00 C ATOM 1011 C ASP A 70 -6.497 -4.267 0.421 1.00 0.00 C ATOM 1012 O ASP A 70 -6.333 -4.228 -0.798 1.00 0.00 O ATOM 1013 CB ASP A 70 -4.837 -2.723 1.478 1.00 0.00 C ATOM 1014 CG ASP A 70 -5.029 -1.957 0.184 1.00 0.00 C ATOM 1015 OD1 ASP A 70 -4.475 -2.388 -0.849 1.00 0.00 O ATOM 1016 OD2 ASP A 70 -5.734 -0.927 0.204 1.00 0.00 O ATOM 0 H ASP A 70 -3.362 -4.533 0.682 1.00 0.00 H new ATOM 0 HA ASP A 70 -5.627 -4.516 2.358 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -5.384 -2.223 2.277 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -3.783 -2.706 1.754 1.00 0.00 H new ATOM 1021 N ARG A 71 -7.694 -4.393 0.986 1.00 0.00 N ATOM 1022 CA ARG A 71 -8.909 -4.495 0.187 1.00 0.00 C ATOM 1023 C ARG A 71 -9.961 -3.500 0.669 1.00 0.00 C ATOM 1024 O ARG A 71 -11.144 -3.633 0.359 1.00 0.00 O ATOM 1025 CB ARG A 71 -9.469 -5.917 0.251 1.00 0.00 C ATOM 1026 CG ARG A 71 -8.613 -6.942 -0.473 1.00 0.00 C ATOM 1027 CD ARG A 71 -8.858 -6.914 -1.973 1.00 0.00 C ATOM 1028 NE ARG A 71 -8.393 -8.134 -2.627 1.00 0.00 N ATOM 1029 CZ ARG A 71 -8.547 -8.377 -3.924 1.00 0.00 C ATOM 1030 NH1 ARG A 71 -9.150 -7.488 -4.701 1.00 0.00 N ATOM 1031 NH2 ARG A 71 -8.096 -9.511 -4.445 1.00 0.00 N ATOM 0 H ARG A 71 -7.848 -4.427 1.994 1.00 0.00 H new ATOM 0 HA ARG A 71 -8.656 -4.258 -0.846 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -9.569 -6.212 1.295 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -10.470 -5.924 -0.179 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -7.560 -6.745 -0.272 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -8.831 -7.938 -0.086 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -9.923 -6.784 -2.164 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -8.349 -6.053 -2.407 1.00 0.00 H new ATOM 0 HE ARG A 71 -7.924 -8.838 -2.057 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -9.497 -6.615 -4.303 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -9.267 -7.677 -5.697 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -7.631 -10.196 -3.850 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -8.214 -9.697 -5.441 1.00 0.00 H new ATOM 1045 N GLY A 72 -9.520 -2.502 1.430 1.00 0.00 N ATOM 1046 CA GLY A 72 -10.436 -1.500 1.943 1.00 0.00 C ATOM 1047 C GLY A 72 -10.242 -1.240 3.423 1.00 0.00 C ATOM 1048 O GLY A 72 -9.207 -1.591 3.990 1.00 0.00 O ATOM 0 H GLY A 72 -8.545 -2.370 1.700 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -10.297 -0.569 1.393 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -11.461 -1.825 1.766 1.00 0.00 H new ATOM 1052 N GLN A 73 -11.238 -0.622 4.050 1.00 0.00 N ATOM 1053 CA GLN A 73 -11.169 -0.314 5.473 1.00 0.00 C ATOM 1054 C GLN A 73 -11.678 -1.484 6.309 1.00 0.00 C ATOM 1055 O GLN A 73 -10.928 -2.081 7.080 1.00 0.00 O ATOM 1056 CB GLN A 73 -11.985 0.942 5.784 1.00 0.00 C ATOM 1057 CG GLN A 73 -11.878 1.394 7.232 1.00 0.00 C ATOM 1058 CD GLN A 73 -12.411 2.797 7.446 1.00 0.00 C ATOM 1059 OE1 GLN A 73 -11.654 3.768 7.445 1.00 0.00 O ATOM 1060 NE2 GLN A 73 -13.721 2.911 7.630 1.00 0.00 N ATOM 0 H GLN A 73 -12.101 -0.325 3.595 1.00 0.00 H new ATOM 0 HA GLN A 73 -10.125 -0.134 5.730 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -11.653 1.751 5.134 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -13.032 0.753 5.548 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -12.428 0.700 7.867 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -10.835 1.354 7.545 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -14.311 2.079 7.623 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -14.137 3.830 7.778 1.00 0.00 H new ATOM 1069 N GLY A 74 -12.958 -1.806 6.151 1.00 0.00 N ATOM 1070 CA GLY A 74 -13.544 -2.904 6.897 1.00 0.00 C ATOM 1071 C GLY A 74 -13.600 -4.188 6.094 1.00 0.00 C ATOM 1072 O GLY A 74 -14.369 -5.095 6.413 1.00 0.00 O ATOM 0 H GLY A 74 -13.600 -1.326 5.520 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -12.964 -3.072 7.805 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -14.552 -2.630 7.209 1.00 0.00 H new ATOM 1076 N ILE A 75 -12.784 -4.265 5.048 1.00 0.00 N ATOM 1077 CA ILE A 75 -12.744 -5.447 4.196 1.00 0.00 C ATOM 1078 C ILE A 75 -11.619 -6.388 4.614 1.00 0.00 C ATOM 1079 O ILE A 75 -10.530 -5.946 4.978 1.00 0.00 O ATOM 1080 CB ILE A 75 -12.559 -5.068 2.715 1.00 0.00 C ATOM 1081 CG1 ILE A 75 -13.537 -3.958 2.324 1.00 0.00 C ATOM 1082 CG2 ILE A 75 -12.752 -6.289 1.828 1.00 0.00 C ATOM 1083 CD1 ILE A 75 -14.986 -4.389 2.359 1.00 0.00 C ATOM 0 H ILE A 75 -12.142 -3.523 4.770 1.00 0.00 H new ATOM 0 HA ILE A 75 -13.701 -5.954 4.315 1.00 0.00 H new ATOM 0 HB ILE A 75 -11.544 -4.698 2.574 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -13.402 -3.112 2.998 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -13.295 -3.608 1.320 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -12.618 -6.005 0.784 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -12.019 -7.051 2.094 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -13.757 -6.687 1.970 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -15.622 -3.552 2.071 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -15.137 -5.215 1.664 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -15.246 -4.711 3.367 1.00 0.00 H new ATOM 1095 N ASN A 76 -11.890 -7.688 4.556 1.00 0.00 N ATOM 1096 CA ASN A 76 -10.899 -8.692 4.927 1.00 0.00 C ATOM 1097 C ASN A 76 -9.708 -8.658 3.975 1.00 0.00 C ATOM 1098 O ASN A 76 -9.857 -8.681 2.753 1.00 0.00 O ATOM 1099 CB ASN A 76 -11.530 -10.086 4.924 1.00 0.00 C ATOM 1100 CG ASN A 76 -12.124 -10.449 3.577 1.00 0.00 C ATOM 1101 OD1 ASN A 76 -11.410 -10.858 2.661 1.00 0.00 O ATOM 1102 ND2 ASN A 76 -13.437 -10.299 3.450 1.00 0.00 N ATOM 0 H ASN A 76 -12.787 -8.071 4.256 1.00 0.00 H new ATOM 0 HA ASN A 76 -10.544 -8.463 5.932 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -10.775 -10.824 5.196 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -12.309 -10.131 5.685 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -13.893 -10.526 2.566 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -13.990 -9.957 4.236 1.00 0.00 H new ATOM 1109 N PRO A 77 -8.495 -8.603 4.546 1.00 0.00 N ATOM 1110 CA PRO A 77 -7.254 -8.566 3.767 1.00 0.00 C ATOM 1111 C PRO A 77 -6.971 -9.890 3.065 1.00 0.00 C ATOM 1112 O PRO A 77 -7.352 -10.955 3.551 1.00 0.00 O ATOM 1113 CB PRO A 77 -6.182 -8.280 4.822 1.00 0.00 C ATOM 1114 CG PRO A 77 -6.758 -8.791 6.097 1.00 0.00 C ATOM 1115 CD PRO A 77 -8.243 -8.573 5.997 1.00 0.00 C ATOM 0 HA PRO A 77 -7.295 -7.824 2.969 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -5.246 -8.783 4.581 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -5.964 -7.214 4.886 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -6.527 -9.847 6.234 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -6.342 -8.260 6.953 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -8.800 -9.352 6.518 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -8.540 -7.621 6.437 1.00 0.00 H new ATOM 1123 N ASP A 78 -6.301 -9.815 1.920 1.00 0.00 N ATOM 1124 CA ASP A 78 -5.965 -11.009 1.152 1.00 0.00 C ATOM 1125 C ASP A 78 -4.469 -11.299 1.224 1.00 0.00 C ATOM 1126 O ASP A 78 -3.674 -10.697 0.501 1.00 0.00 O ATOM 1127 CB ASP A 78 -6.395 -10.839 -0.306 1.00 0.00 C ATOM 1128 CG ASP A 78 -7.895 -10.966 -0.486 1.00 0.00 C ATOM 1129 OD1 ASP A 78 -8.642 -10.379 0.324 1.00 0.00 O ATOM 1130 OD2 ASP A 78 -8.322 -11.652 -1.438 1.00 0.00 O ATOM 0 H ASP A 78 -5.980 -8.941 1.503 1.00 0.00 H new ATOM 0 HA ASP A 78 -6.501 -11.853 1.585 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -6.070 -9.863 -0.666 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -5.894 -11.588 -0.919 1.00 0.00 H new ATOM 1135 N LEU A 79 -4.093 -12.222 2.101 1.00 0.00 N ATOM 1136 CA LEU A 79 -2.692 -12.592 2.269 1.00 0.00 C ATOM 1137 C LEU A 79 -1.988 -12.686 0.920 1.00 0.00 C ATOM 1138 O LEU A 79 -2.630 -12.865 -0.117 1.00 0.00 O ATOM 1139 CB LEU A 79 -2.581 -13.927 3.009 1.00 0.00 C ATOM 1140 CG LEU A 79 -1.164 -14.461 3.220 1.00 0.00 C ATOM 1141 CD1 LEU A 79 -0.445 -13.658 4.292 1.00 0.00 C ATOM 1142 CD2 LEU A 79 -1.201 -15.937 3.592 1.00 0.00 C ATOM 0 H LEU A 79 -4.738 -12.728 2.707 1.00 0.00 H new ATOM 0 HA LEU A 79 -2.205 -11.815 2.859 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.056 -13.820 3.984 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.151 -14.674 2.457 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.613 -14.355 2.285 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.562 -14.053 4.428 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.387 -12.613 3.987 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -0.994 -13.731 5.231 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.184 -16.301 3.739 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.769 -16.066 4.513 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -1.677 -16.502 2.791 1.00 0.00 H new ATOM 1154 N LEU A 80 -0.665 -12.567 0.939 1.00 0.00 N ATOM 1155 CA LEU A 80 0.128 -12.640 -0.284 1.00 0.00 C ATOM 1156 C LEU A 80 0.235 -14.080 -0.777 1.00 0.00 C ATOM 1157 O LEU A 80 1.087 -14.841 -0.321 1.00 0.00 O ATOM 1158 CB LEU A 80 1.525 -12.066 -0.044 1.00 0.00 C ATOM 1159 CG LEU A 80 2.563 -12.349 -1.131 1.00 0.00 C ATOM 1160 CD1 LEU A 80 2.529 -11.265 -2.197 1.00 0.00 C ATOM 1161 CD2 LEU A 80 3.954 -12.460 -0.524 1.00 0.00 C ATOM 0 H LEU A 80 -0.119 -12.420 1.788 1.00 0.00 H new ATOM 0 HA LEU A 80 -0.374 -12.049 -1.050 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.437 -10.986 0.074 1.00 0.00 H new ATOM 0 HB3 LEU A 80 1.901 -12.460 0.900 1.00 0.00 H new ATOM 0 HG LEU A 80 2.317 -13.301 -1.602 1.00 0.00 H new ATOM 0 HD11 LEU A 80 3.274 -11.483 -2.962 1.00 0.00 H new ATOM 0 HD12 LEU A 80 1.539 -11.234 -2.653 1.00 0.00 H new ATOM 0 HD13 LEU A 80 2.749 -10.300 -1.741 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.680 -12.662 -1.312 1.00 0.00 H new ATOM 0 HD22 LEU A 80 4.209 -11.525 -0.026 1.00 0.00 H new ATOM 0 HD23 LEU A 80 3.971 -13.273 0.201 1.00 0.00 H new ATOM 1173 N ASN A 81 -0.634 -14.445 -1.714 1.00 0.00 N ATOM 1174 CA ASN A 81 -0.636 -15.793 -2.271 1.00 0.00 C ATOM 1175 C ASN A 81 -0.245 -15.772 -3.746 1.00 0.00 C ATOM 1176 O ASN A 81 -0.788 -16.527 -4.552 1.00 0.00 O ATOM 1177 CB ASN A 81 -2.016 -16.433 -2.107 1.00 0.00 C ATOM 1178 CG ASN A 81 -1.939 -17.940 -1.959 1.00 0.00 C ATOM 1179 OD1 ASN A 81 -1.517 -18.453 -0.922 1.00 0.00 O ATOM 1180 ND2 ASN A 81 -2.349 -18.658 -2.998 1.00 0.00 N ATOM 0 H ASN A 81 -1.346 -13.827 -2.103 1.00 0.00 H new ATOM 0 HA ASN A 81 0.099 -16.386 -1.726 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -2.509 -16.009 -1.232 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -2.633 -16.186 -2.971 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -2.322 -19.677 -2.956 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -2.691 -18.191 -3.838 1.00 0.00 H new ATOM 1187 N GLN A 82 0.701 -14.903 -4.090 1.00 0.00 N ATOM 1188 CA GLN A 82 1.164 -14.785 -5.467 1.00 0.00 C ATOM 1189 C GLN A 82 2.554 -15.391 -5.628 1.00 0.00 C ATOM 1190 O GLN A 82 3.470 -15.120 -4.851 1.00 0.00 O ATOM 1191 CB GLN A 82 1.182 -13.317 -5.897 1.00 0.00 C ATOM 1192 CG GLN A 82 2.070 -12.440 -5.029 1.00 0.00 C ATOM 1193 CD GLN A 82 1.714 -10.970 -5.129 1.00 0.00 C ATOM 1194 OE1 GLN A 82 0.641 -10.548 -4.696 1.00 0.00 O ATOM 1195 NE2 GLN A 82 2.615 -10.180 -5.702 1.00 0.00 N ATOM 0 H GLN A 82 1.161 -14.271 -3.434 1.00 0.00 H new ATOM 0 HA GLN A 82 0.472 -15.335 -6.105 1.00 0.00 H new ATOM 0 HB2 GLN A 82 1.522 -13.254 -6.931 1.00 0.00 H new ATOM 0 HB3 GLN A 82 0.164 -12.927 -5.872 1.00 0.00 H new ATOM 0 HG2 GLN A 82 1.987 -12.760 -3.990 1.00 0.00 H new ATOM 0 HG3 GLN A 82 3.110 -12.579 -5.323 1.00 0.00 H new ATOM 0 HE21 GLN A 82 3.491 -10.572 -6.047 1.00 0.00 H new ATOM 0 HE22 GLN A 82 2.431 -9.181 -5.797 1.00 0.00 H new ATOM 1204 N PRO A 83 2.718 -16.233 -6.659 1.00 0.00 N ATOM 1205 CA PRO A 83 3.994 -16.896 -6.946 1.00 0.00 C ATOM 1206 C PRO A 83 5.053 -15.920 -7.448 1.00 0.00 C ATOM 1207 O PRO A 83 6.252 -16.177 -7.330 1.00 0.00 O ATOM 1208 CB PRO A 83 3.632 -17.902 -8.041 1.00 0.00 C ATOM 1209 CG PRO A 83 2.429 -17.326 -8.703 1.00 0.00 C ATOM 1210 CD PRO A 83 1.669 -16.603 -7.625 1.00 0.00 C ATOM 0 HA PRO A 83 4.427 -17.352 -6.055 1.00 0.00 H new ATOM 0 HB2 PRO A 83 4.451 -18.028 -8.749 1.00 0.00 H new ATOM 0 HB3 PRO A 83 3.420 -18.885 -7.621 1.00 0.00 H new ATOM 0 HG2 PRO A 83 2.714 -16.644 -9.504 1.00 0.00 H new ATOM 0 HG3 PRO A 83 1.819 -18.109 -9.153 1.00 0.00 H new ATOM 0 HD2 PRO A 83 1.154 -15.725 -8.016 1.00 0.00 H new ATOM 0 HD3 PRO A 83 0.911 -17.241 -7.171 1.00 0.00 H new ATOM 1218 N ILE A 84 4.604 -14.801 -8.006 1.00 0.00 N ATOM 1219 CA ILE A 84 5.514 -13.787 -8.523 1.00 0.00 C ATOM 1220 C ILE A 84 5.680 -12.640 -7.532 1.00 0.00 C ATOM 1221 O ILE A 84 4.701 -12.133 -6.983 1.00 0.00 O ATOM 1222 CB ILE A 84 5.022 -13.222 -9.868 1.00 0.00 C ATOM 1223 CG1 ILE A 84 5.048 -14.310 -10.944 1.00 0.00 C ATOM 1224 CG2 ILE A 84 5.874 -12.034 -10.288 1.00 0.00 C ATOM 1225 CD1 ILE A 84 4.448 -13.872 -12.262 1.00 0.00 C ATOM 0 H ILE A 84 3.615 -14.574 -8.112 1.00 0.00 H new ATOM 0 HA ILE A 84 6.477 -14.275 -8.674 1.00 0.00 H new ATOM 0 HB ILE A 84 3.994 -12.882 -9.747 1.00 0.00 H new ATOM 0 HG12 ILE A 84 6.079 -14.621 -11.109 1.00 0.00 H new ATOM 0 HG13 ILE A 84 4.506 -15.183 -10.580 1.00 0.00 H new ATOM 0 HG21 ILE A 84 5.513 -11.646 -11.241 1.00 0.00 H new ATOM 0 HG22 ILE A 84 5.809 -11.253 -9.530 1.00 0.00 H new ATOM 0 HG23 ILE A 84 6.912 -12.350 -10.395 1.00 0.00 H new ATOM 0 HD11 ILE A 84 4.501 -14.693 -12.977 1.00 0.00 H new ATOM 0 HD12 ILE A 84 3.406 -13.588 -12.111 1.00 0.00 H new ATOM 0 HD13 ILE A 84 5.004 -13.018 -12.649 1.00 0.00 H new ATOM 1237 N THR A 85 6.925 -12.233 -7.309 1.00 0.00 N ATOM 1238 CA THR A 85 7.220 -11.145 -6.386 1.00 0.00 C ATOM 1239 C THR A 85 8.350 -10.267 -6.912 1.00 0.00 C ATOM 1240 O THR A 85 9.153 -10.701 -7.738 1.00 0.00 O ATOM 1241 CB THR A 85 7.606 -11.678 -4.993 1.00 0.00 C ATOM 1242 OG1 THR A 85 8.655 -12.646 -5.113 1.00 0.00 O ATOM 1243 CG2 THR A 85 6.405 -12.308 -4.303 1.00 0.00 C ATOM 0 H THR A 85 7.746 -12.641 -7.756 1.00 0.00 H new ATOM 0 HA THR A 85 6.311 -10.550 -6.300 1.00 0.00 H new ATOM 0 HB THR A 85 7.953 -10.839 -4.390 1.00 0.00 H new ATOM 0 HG1 THR A 85 8.681 -13.202 -4.306 1.00 0.00 H new ATOM 0 HG21 THR A 85 6.702 -12.677 -3.321 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.619 -11.562 -4.188 1.00 0.00 H new ATOM 0 HG23 THR A 85 6.033 -13.137 -4.905 1.00 0.00 H new ATOM 1251 N TYR A 86 8.407 -9.032 -6.428 1.00 0.00 N ATOM 1252 CA TYR A 86 9.439 -8.092 -6.852 1.00 0.00 C ATOM 1253 C TYR A 86 10.350 -7.721 -5.685 1.00 0.00 C ATOM 1254 O TYR A 86 11.063 -6.719 -5.735 1.00 0.00 O ATOM 1255 CB TYR A 86 8.801 -6.831 -7.436 1.00 0.00 C ATOM 1256 CG TYR A 86 7.832 -7.109 -8.563 1.00 0.00 C ATOM 1257 CD1 TYR A 86 8.276 -7.612 -9.779 1.00 0.00 C ATOM 1258 CD2 TYR A 86 6.472 -6.867 -8.411 1.00 0.00 C ATOM 1259 CE1 TYR A 86 7.395 -7.867 -10.812 1.00 0.00 C ATOM 1260 CE2 TYR A 86 5.583 -7.120 -9.438 1.00 0.00 C ATOM 1261 CZ TYR A 86 6.049 -7.620 -10.636 1.00 0.00 C ATOM 1262 OH TYR A 86 5.167 -7.872 -11.662 1.00 0.00 O ATOM 0 H TYR A 86 7.751 -8.658 -5.742 1.00 0.00 H new ATOM 0 HA TYR A 86 10.042 -8.576 -7.621 1.00 0.00 H new ATOM 0 HB2 TYR A 86 8.278 -6.297 -6.642 1.00 0.00 H new ATOM 0 HB3 TYR A 86 9.588 -6.171 -7.800 1.00 0.00 H new ATOM 0 HD1 TYR A 86 9.329 -7.807 -9.920 1.00 0.00 H new ATOM 0 HD2 TYR A 86 6.104 -6.475 -7.475 1.00 0.00 H new ATOM 0 HE1 TYR A 86 7.758 -8.257 -11.752 1.00 0.00 H new ATOM 0 HE2 TYR A 86 4.529 -6.927 -9.303 1.00 0.00 H new ATOM 0 HH TYR A 86 4.258 -7.645 -11.375 1.00 0.00 H new ATOM 1272 N TRP A 87 10.321 -8.538 -4.638 1.00 0.00 N ATOM 1273 CA TRP A 87 11.145 -8.297 -3.459 1.00 0.00 C ATOM 1274 C TRP A 87 12.569 -7.926 -3.856 1.00 0.00 C ATOM 1275 O TRP A 87 13.237 -8.671 -4.572 1.00 0.00 O ATOM 1276 CB TRP A 87 11.158 -9.534 -2.560 1.00 0.00 C ATOM 1277 CG TRP A 87 9.814 -9.865 -1.984 1.00 0.00 C ATOM 1278 CD1 TRP A 87 9.050 -10.962 -2.265 1.00 0.00 C ATOM 1279 CD2 TRP A 87 9.076 -9.092 -1.032 1.00 0.00 C ATOM 1280 NE1 TRP A 87 7.881 -10.917 -1.544 1.00 0.00 N ATOM 1281 CE2 TRP A 87 7.873 -9.780 -0.780 1.00 0.00 C ATOM 1282 CE3 TRP A 87 9.315 -7.887 -0.367 1.00 0.00 C ATOM 1283 CZ2 TRP A 87 6.914 -9.301 0.108 1.00 0.00 C ATOM 1284 CZ3 TRP A 87 8.361 -7.412 0.514 1.00 0.00 C ATOM 1285 CH2 TRP A 87 7.174 -8.118 0.746 1.00 0.00 C ATOM 0 H TRP A 87 9.737 -9.372 -4.581 1.00 0.00 H new ATOM 0 HA TRP A 87 10.713 -7.461 -2.909 1.00 0.00 H new ATOM 0 HB2 TRP A 87 11.519 -10.387 -3.134 1.00 0.00 H new ATOM 0 HB3 TRP A 87 11.865 -9.375 -1.746 1.00 0.00 H new ATOM 0 HD1 TRP A 87 9.324 -11.749 -2.952 1.00 0.00 H new ATOM 0 HE1 TRP A 87 7.139 -11.617 -1.573 1.00 0.00 H new ATOM 0 HE3 TRP A 87 10.228 -7.336 -0.538 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 5.997 -9.843 0.287 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 8.534 -6.480 1.032 1.00 0.00 H new ATOM 0 HH2 TRP A 87 6.450 -7.721 1.442 1.00 0.00 H new ATOM 1296 N ALA A 88 13.028 -6.771 -3.386 1.00 0.00 N ATOM 1297 CA ALA A 88 14.375 -6.303 -3.691 1.00 0.00 C ATOM 1298 C ALA A 88 15.422 -7.324 -3.258 1.00 0.00 C ATOM 1299 O ALA A 88 15.093 -8.352 -2.667 1.00 0.00 O ATOM 1300 CB ALA A 88 14.633 -4.963 -3.019 1.00 0.00 C ATOM 0 H ALA A 88 12.487 -6.142 -2.793 1.00 0.00 H new ATOM 0 HA ALA A 88 14.453 -6.177 -4.771 1.00 0.00 H new ATOM 0 HB1 ALA A 88 15.642 -4.626 -3.255 1.00 0.00 H new ATOM 0 HB2 ALA A 88 13.912 -4.230 -3.380 1.00 0.00 H new ATOM 0 HB3 ALA A 88 14.530 -5.072 -1.939 1.00 0.00 H new ATOM 1306 N ASN A 89 16.684 -7.034 -3.558 1.00 0.00 N ATOM 1307 CA ASN A 89 17.779 -7.928 -3.201 1.00 0.00 C ATOM 1308 C ASN A 89 17.804 -8.184 -1.697 1.00 0.00 C ATOM 1309 O ASN A 89 18.200 -7.320 -0.916 1.00 0.00 O ATOM 1310 CB ASN A 89 19.116 -7.336 -3.650 1.00 0.00 C ATOM 1311 CG ASN A 89 19.482 -7.743 -5.065 1.00 0.00 C ATOM 1312 OD1 ASN A 89 19.192 -8.859 -5.496 1.00 0.00 O ATOM 1313 ND2 ASN A 89 20.122 -6.836 -5.794 1.00 0.00 N ATOM 0 H ASN A 89 16.973 -6.187 -4.047 1.00 0.00 H new ATOM 0 HA ASN A 89 17.620 -8.878 -3.711 1.00 0.00 H new ATOM 0 HB2 ASN A 89 19.068 -6.249 -3.588 1.00 0.00 H new ATOM 0 HB3 ASN A 89 19.901 -7.660 -2.967 1.00 0.00 H new ATOM 0 HD21 ASN A 89 20.394 -7.052 -6.753 1.00 0.00 H new ATOM 0 HD22 ASN A 89 20.342 -5.923 -5.395 1.00 0.00 H new ATOM 1320 N GLY A 90 17.378 -9.379 -1.298 1.00 0.00 N ATOM 1321 CA GLY A 90 17.359 -9.728 0.110 1.00 0.00 C ATOM 1322 C GLY A 90 15.975 -9.615 0.718 1.00 0.00 C ATOM 1323 O GLY A 90 15.641 -10.338 1.655 1.00 0.00 O ATOM 0 H GLY A 90 17.046 -10.111 -1.925 1.00 0.00 H new ATOM 0 HA2 GLY A 90 17.724 -10.748 0.233 1.00 0.00 H new ATOM 0 HA3 GLY A 90 18.045 -9.076 0.652 1.00 0.00 H new ATOM 1327 N GLU A 91 15.169 -8.702 0.184 1.00 0.00 N ATOM 1328 CA GLU A 91 13.815 -8.495 0.682 1.00 0.00 C ATOM 1329 C GLU A 91 12.964 -9.747 0.483 1.00 0.00 C ATOM 1330 O GLU A 91 13.207 -10.557 -0.411 1.00 0.00 O ATOM 1331 CB GLU A 91 13.163 -7.305 -0.025 1.00 0.00 C ATOM 1332 CG GLU A 91 13.792 -5.968 0.329 1.00 0.00 C ATOM 1333 CD GLU A 91 13.623 -5.613 1.793 1.00 0.00 C ATOM 1334 OE1 GLU A 91 12.648 -6.091 2.410 1.00 0.00 O ATOM 1335 OE2 GLU A 91 14.466 -4.858 2.322 1.00 0.00 O ATOM 0 H GLU A 91 15.431 -8.095 -0.593 1.00 0.00 H new ATOM 0 HA GLU A 91 13.877 -8.284 1.750 1.00 0.00 H new ATOM 0 HB2 GLU A 91 13.228 -7.453 -1.103 1.00 0.00 H new ATOM 0 HB3 GLU A 91 12.104 -7.278 0.230 1.00 0.00 H new ATOM 0 HG2 GLU A 91 14.854 -5.995 0.086 1.00 0.00 H new ATOM 0 HG3 GLU A 91 13.344 -5.186 -0.285 1.00 0.00 H new ATOM 1342 N PRO A 92 11.943 -9.910 1.337 1.00 0.00 N ATOM 1343 CA PRO A 92 11.645 -8.952 2.406 1.00 0.00 C ATOM 1344 C PRO A 92 12.697 -8.968 3.509 1.00 0.00 C ATOM 1345 O PRO A 92 13.377 -9.973 3.718 1.00 0.00 O ATOM 1346 CB PRO A 92 10.296 -9.434 2.947 1.00 0.00 C ATOM 1347 CG PRO A 92 10.254 -10.887 2.621 1.00 0.00 C ATOM 1348 CD PRO A 92 11.001 -11.042 1.325 1.00 0.00 C ATOM 0 HA PRO A 92 11.632 -7.925 2.041 1.00 0.00 H new ATOM 0 HB2 PRO A 92 10.218 -9.267 4.021 1.00 0.00 H new ATOM 0 HB3 PRO A 92 9.469 -8.900 2.480 1.00 0.00 H new ATOM 0 HG2 PRO A 92 10.717 -11.478 3.411 1.00 0.00 H new ATOM 0 HG3 PRO A 92 9.226 -11.235 2.523 1.00 0.00 H new ATOM 0 HD2 PRO A 92 11.522 -11.998 1.273 1.00 0.00 H new ATOM 0 HD3 PRO A 92 10.330 -10.998 0.467 1.00 0.00 H new ATOM 1356 N SER A 93 12.827 -7.848 4.213 1.00 0.00 N ATOM 1357 CA SER A 93 13.800 -7.733 5.293 1.00 0.00 C ATOM 1358 C SER A 93 13.234 -8.291 6.596 1.00 0.00 C ATOM 1359 O SER A 93 12.071 -8.067 6.926 1.00 0.00 O ATOM 1360 CB SER A 93 14.208 -6.271 5.486 1.00 0.00 C ATOM 1361 OG SER A 93 15.422 -6.172 6.211 1.00 0.00 O ATOM 0 H SER A 93 12.271 -7.008 4.055 1.00 0.00 H new ATOM 0 HA SER A 93 14.680 -8.316 5.020 1.00 0.00 H new ATOM 0 HB2 SER A 93 14.321 -5.790 4.514 1.00 0.00 H new ATOM 0 HB3 SER A 93 13.419 -5.737 6.016 1.00 0.00 H new ATOM 0 HG SER A 93 15.335 -5.483 6.902 1.00 0.00 H new ATOM 1367 N ASN A 94 14.068 -9.019 7.331 1.00 0.00 N ATOM 1368 CA ASN A 94 13.653 -9.611 8.598 1.00 0.00 C ATOM 1369 C ASN A 94 13.836 -8.623 9.746 1.00 0.00 C ATOM 1370 O ASN A 94 14.272 -8.995 10.835 1.00 0.00 O ATOM 1371 CB ASN A 94 14.451 -10.886 8.875 1.00 0.00 C ATOM 1372 CG ASN A 94 15.905 -10.600 9.196 1.00 0.00 C ATOM 1373 OD1 ASN A 94 16.607 -9.951 8.420 1.00 0.00 O ATOM 1374 ND2 ASN A 94 16.364 -11.084 10.344 1.00 0.00 N ATOM 0 H ASN A 94 15.035 -9.213 7.071 1.00 0.00 H new ATOM 0 HA ASN A 94 12.595 -9.862 8.524 1.00 0.00 H new ATOM 0 HB2 ASN A 94 13.996 -11.422 9.708 1.00 0.00 H new ATOM 0 HB3 ASN A 94 14.396 -11.542 8.006 1.00 0.00 H new ATOM 0 HD21 ASN A 94 17.335 -10.923 10.614 1.00 0.00 H new ATOM 0 HD22 ASN A 94 15.746 -11.616 10.956 1.00 0.00 H new ATOM 1381 N ASP A 95 13.500 -7.363 9.494 1.00 0.00 N ATOM 1382 CA ASP A 95 13.625 -6.321 10.507 1.00 0.00 C ATOM 1383 C ASP A 95 12.295 -6.091 11.218 1.00 0.00 C ATOM 1384 O ASP A 95 11.242 -5.966 10.592 1.00 0.00 O ATOM 1385 CB ASP A 95 14.110 -5.017 9.870 1.00 0.00 C ATOM 1386 CG ASP A 95 15.555 -5.096 9.418 1.00 0.00 C ATOM 1387 OD1 ASP A 95 16.353 -5.774 10.098 1.00 0.00 O ATOM 1388 OD2 ASP A 95 15.888 -4.478 8.385 1.00 0.00 O ATOM 0 H ASP A 95 13.139 -7.038 8.597 1.00 0.00 H new ATOM 0 HA ASP A 95 14.357 -6.651 11.244 1.00 0.00 H new ATOM 0 HB2 ASP A 95 13.478 -4.776 9.015 1.00 0.00 H new ATOM 0 HB3 ASP A 95 14.001 -4.203 10.587 1.00 0.00 H new ATOM 1393 N PRO A 96 12.342 -6.033 12.557 1.00 0.00 N ATOM 1394 CA PRO A 96 11.149 -5.818 13.382 1.00 0.00 C ATOM 1395 C PRO A 96 10.595 -4.405 13.243 1.00 0.00 C ATOM 1396 O PRO A 96 9.418 -4.159 13.507 1.00 0.00 O ATOM 1397 CB PRO A 96 11.656 -6.056 14.806 1.00 0.00 C ATOM 1398 CG PRO A 96 13.115 -5.761 14.744 1.00 0.00 C ATOM 1399 CD PRO A 96 13.562 -6.173 13.369 1.00 0.00 C ATOM 0 HA PRO A 96 10.329 -6.474 13.091 1.00 0.00 H new ATOM 0 HB2 PRO A 96 11.151 -5.405 15.520 1.00 0.00 H new ATOM 0 HB3 PRO A 96 11.473 -7.082 15.125 1.00 0.00 H new ATOM 0 HG2 PRO A 96 13.307 -4.702 14.916 1.00 0.00 H new ATOM 0 HG3 PRO A 96 13.658 -6.312 15.512 1.00 0.00 H new ATOM 0 HD2 PRO A 96 14.366 -5.536 13.000 1.00 0.00 H new ATOM 0 HD3 PRO A 96 13.937 -7.197 13.358 1.00 0.00 H new ATOM 1407 N THR A 97 11.451 -3.477 12.825 1.00 0.00 N ATOM 1408 CA THR A 97 11.047 -2.087 12.652 1.00 0.00 C ATOM 1409 C THR A 97 10.277 -1.897 11.349 1.00 0.00 C ATOM 1410 O THR A 97 9.211 -1.282 11.332 1.00 0.00 O ATOM 1411 CB THR A 97 12.264 -1.143 12.658 1.00 0.00 C ATOM 1412 OG1 THR A 97 13.166 -1.500 11.605 1.00 0.00 O ATOM 1413 CG2 THR A 97 12.988 -1.203 13.995 1.00 0.00 C ATOM 0 H THR A 97 12.428 -3.663 12.600 1.00 0.00 H new ATOM 0 HA THR A 97 10.400 -1.839 13.493 1.00 0.00 H new ATOM 0 HB THR A 97 11.908 -0.125 12.501 1.00 0.00 H new ATOM 0 HG1 THR A 97 13.936 -0.894 11.615 1.00 0.00 H new ATOM 0 HG21 THR A 97 13.844 -0.528 13.976 1.00 0.00 H new ATOM 0 HG22 THR A 97 12.307 -0.903 14.791 1.00 0.00 H new ATOM 0 HG23 THR A 97 13.333 -2.221 14.177 1.00 0.00 H new ATOM 1421 N ARG A 98 10.825 -2.428 10.261 1.00 0.00 N ATOM 1422 CA ARG A 98 10.189 -2.316 8.954 1.00 0.00 C ATOM 1423 C ARG A 98 9.164 -3.428 8.750 1.00 0.00 C ATOM 1424 O ARG A 98 9.513 -4.607 8.712 1.00 0.00 O ATOM 1425 CB ARG A 98 11.242 -2.370 7.845 1.00 0.00 C ATOM 1426 CG ARG A 98 12.441 -1.472 8.101 1.00 0.00 C ATOM 1427 CD ARG A 98 13.657 -1.927 7.308 1.00 0.00 C ATOM 1428 NE ARG A 98 13.629 -1.435 5.933 1.00 0.00 N ATOM 1429 CZ ARG A 98 14.654 -1.538 5.095 1.00 0.00 C ATOM 1430 NH1 ARG A 98 15.782 -2.114 5.489 1.00 0.00 N ATOM 1431 NH2 ARG A 98 14.552 -1.066 3.859 1.00 0.00 N ATOM 0 H ARG A 98 11.707 -2.940 10.259 1.00 0.00 H new ATOM 0 HA ARG A 98 9.673 -1.357 8.911 1.00 0.00 H new ATOM 0 HB2 ARG A 98 11.586 -3.398 7.732 1.00 0.00 H new ATOM 0 HB3 ARG A 98 10.779 -2.083 6.901 1.00 0.00 H new ATOM 0 HG2 ARG A 98 12.192 -0.446 7.831 1.00 0.00 H new ATOM 0 HG3 ARG A 98 12.678 -1.474 9.165 1.00 0.00 H new ATOM 0 HD2 ARG A 98 14.563 -1.575 7.801 1.00 0.00 H new ATOM 0 HD3 ARG A 98 13.699 -3.016 7.303 1.00 0.00 H new ATOM 0 HE ARG A 98 12.776 -0.988 5.598 1.00 0.00 H new ATOM 0 HH11 ARG A 98 15.864 -2.479 6.438 1.00 0.00 H new ATOM 0 HH12 ARG A 98 16.568 -2.192 4.843 1.00 0.00 H new ATOM 0 HH21 ARG A 98 13.686 -0.624 3.552 1.00 0.00 H new ATOM 0 HH22 ARG A 98 15.340 -1.146 3.216 1.00 0.00 H new ATOM 1445 N GLN A 99 7.898 -3.043 8.622 1.00 0.00 N ATOM 1446 CA GLN A 99 6.823 -4.007 8.424 1.00 0.00 C ATOM 1447 C GLN A 99 6.076 -3.730 7.124 1.00 0.00 C ATOM 1448 O GLN A 99 5.648 -4.655 6.432 1.00 0.00 O ATOM 1449 CB GLN A 99 5.850 -3.967 9.604 1.00 0.00 C ATOM 1450 CG GLN A 99 6.538 -3.924 10.959 1.00 0.00 C ATOM 1451 CD GLN A 99 5.711 -4.569 12.054 1.00 0.00 C ATOM 1452 OE1 GLN A 99 5.483 -5.779 12.043 1.00 0.00 O ATOM 1453 NE2 GLN A 99 5.259 -3.763 13.007 1.00 0.00 N ATOM 0 H GLN A 99 7.592 -2.070 8.652 1.00 0.00 H new ATOM 0 HA GLN A 99 7.267 -5.001 8.362 1.00 0.00 H new ATOM 0 HB2 GLN A 99 5.207 -3.092 9.504 1.00 0.00 H new ATOM 0 HB3 GLN A 99 5.204 -4.844 9.561 1.00 0.00 H new ATOM 0 HG2 GLN A 99 7.501 -4.431 10.890 1.00 0.00 H new ATOM 0 HG3 GLN A 99 6.742 -2.887 11.226 1.00 0.00 H new ATOM 0 HE21 GLN A 99 5.473 -2.766 12.976 1.00 0.00 H new ATOM 0 HE22 GLN A 99 4.698 -4.141 13.771 1.00 0.00 H new ATOM 1462 N CYS A 100 5.922 -2.452 6.796 1.00 0.00 N ATOM 1463 CA CYS A 100 5.226 -2.052 5.579 1.00 0.00 C ATOM 1464 C CYS A 100 6.187 -1.997 4.396 1.00 0.00 C ATOM 1465 O CYS A 100 7.395 -1.833 4.570 1.00 0.00 O ATOM 1466 CB CYS A 100 4.559 -0.688 5.773 1.00 0.00 C ATOM 1467 SG CYS A 100 3.373 -0.630 7.155 1.00 0.00 S ATOM 0 H CYS A 100 6.270 -1.674 7.357 1.00 0.00 H new ATOM 0 HA CYS A 100 4.459 -2.797 5.367 1.00 0.00 H new ATOM 0 HB2 CYS A 100 5.332 0.062 5.940 1.00 0.00 H new ATOM 0 HB3 CYS A 100 4.042 -0.414 4.853 1.00 0.00 H new ATOM 1472 N VAL A 101 5.643 -2.135 3.191 1.00 0.00 N ATOM 1473 CA VAL A 101 6.451 -2.099 1.978 1.00 0.00 C ATOM 1474 C VAL A 101 6.056 -0.926 1.089 1.00 0.00 C ATOM 1475 O VAL A 101 4.879 -0.579 0.987 1.00 0.00 O ATOM 1476 CB VAL A 101 6.315 -3.406 1.175 1.00 0.00 C ATOM 1477 CG1 VAL A 101 7.147 -3.341 -0.097 1.00 0.00 C ATOM 1478 CG2 VAL A 101 6.721 -4.599 2.027 1.00 0.00 C ATOM 0 H VAL A 101 4.645 -2.273 3.029 1.00 0.00 H new ATOM 0 HA VAL A 101 7.488 -1.980 2.292 1.00 0.00 H new ATOM 0 HB VAL A 101 5.270 -3.530 0.891 1.00 0.00 H new ATOM 0 HG11 VAL A 101 7.038 -4.273 -0.651 1.00 0.00 H new ATOM 0 HG12 VAL A 101 6.804 -2.510 -0.714 1.00 0.00 H new ATOM 0 HG13 VAL A 101 8.196 -3.193 0.161 1.00 0.00 H new ATOM 0 HG21 VAL A 101 6.619 -5.514 1.444 1.00 0.00 H new ATOM 0 HG22 VAL A 101 7.758 -4.484 2.343 1.00 0.00 H new ATOM 0 HG23 VAL A 101 6.078 -4.655 2.905 1.00 0.00 H new ATOM 1488 N TYR A 102 7.047 -0.318 0.447 1.00 0.00 N ATOM 1489 CA TYR A 102 6.804 0.819 -0.433 1.00 0.00 C ATOM 1490 C TYR A 102 7.471 0.611 -1.790 1.00 0.00 C ATOM 1491 O TYR A 102 8.610 0.149 -1.870 1.00 0.00 O ATOM 1492 CB TYR A 102 7.321 2.108 0.209 1.00 0.00 C ATOM 1493 CG TYR A 102 8.822 2.271 0.116 1.00 0.00 C ATOM 1494 CD1 TYR A 102 9.415 2.788 -1.029 1.00 0.00 C ATOM 1495 CD2 TYR A 102 9.646 1.906 1.174 1.00 0.00 C ATOM 1496 CE1 TYR A 102 10.785 2.938 -1.118 1.00 0.00 C ATOM 1497 CE2 TYR A 102 11.017 2.054 1.094 1.00 0.00 C ATOM 1498 CZ TYR A 102 11.582 2.570 -0.054 1.00 0.00 C ATOM 1499 OH TYR A 102 12.948 2.718 -0.138 1.00 0.00 O ATOM 0 H TYR A 102 8.026 -0.593 0.519 1.00 0.00 H new ATOM 0 HA TYR A 102 5.728 0.903 -0.586 1.00 0.00 H new ATOM 0 HB2 TYR A 102 6.841 2.961 -0.271 1.00 0.00 H new ATOM 0 HB3 TYR A 102 7.026 2.125 1.258 1.00 0.00 H new ATOM 0 HD1 TYR A 102 8.794 3.078 -1.864 1.00 0.00 H new ATOM 0 HD2 TYR A 102 9.207 1.500 2.073 1.00 0.00 H new ATOM 0 HE1 TYR A 102 11.230 3.341 -2.016 1.00 0.00 H new ATOM 0 HE2 TYR A 102 11.643 1.767 1.926 1.00 0.00 H new ATOM 0 HH TYR A 102 13.248 2.477 -1.039 1.00 0.00 H new ATOM 1509 N PHE A 103 6.754 0.955 -2.854 1.00 0.00 N ATOM 1510 CA PHE A 103 7.274 0.806 -4.208 1.00 0.00 C ATOM 1511 C PHE A 103 8.453 1.745 -4.444 1.00 0.00 C ATOM 1512 O PHE A 103 8.317 2.966 -4.353 1.00 0.00 O ATOM 1513 CB PHE A 103 6.173 1.084 -5.234 1.00 0.00 C ATOM 1514 CG PHE A 103 6.533 0.660 -6.629 1.00 0.00 C ATOM 1515 CD1 PHE A 103 7.604 1.239 -7.289 1.00 0.00 C ATOM 1516 CD2 PHE A 103 5.799 -0.319 -7.280 1.00 0.00 C ATOM 1517 CE1 PHE A 103 7.938 0.851 -8.573 1.00 0.00 C ATOM 1518 CE2 PHE A 103 6.129 -0.711 -8.564 1.00 0.00 C ATOM 1519 CZ PHE A 103 7.199 -0.125 -9.211 1.00 0.00 C ATOM 0 H PHE A 103 5.810 1.339 -2.805 1.00 0.00 H new ATOM 0 HA PHE A 103 7.620 -0.221 -4.326 1.00 0.00 H new ATOM 0 HB2 PHE A 103 5.264 0.566 -4.929 1.00 0.00 H new ATOM 0 HB3 PHE A 103 5.948 2.151 -5.234 1.00 0.00 H new ATOM 0 HD1 PHE A 103 8.185 2.003 -6.794 1.00 0.00 H new ATOM 0 HD2 PHE A 103 4.961 -0.780 -6.779 1.00 0.00 H new ATOM 0 HE1 PHE A 103 8.776 1.311 -9.076 1.00 0.00 H new ATOM 0 HE2 PHE A 103 5.550 -1.475 -9.061 1.00 0.00 H new ATOM 0 HZ PHE A 103 7.457 -0.430 -10.214 1.00 0.00 H new ATOM 1529 N ASP A 104 9.611 1.167 -4.746 1.00 0.00 N ATOM 1530 CA ASP A 104 10.815 1.951 -4.995 1.00 0.00 C ATOM 1531 C ASP A 104 10.954 2.277 -6.479 1.00 0.00 C ATOM 1532 O ASP A 104 11.600 1.545 -7.228 1.00 0.00 O ATOM 1533 CB ASP A 104 12.052 1.195 -4.508 1.00 0.00 C ATOM 1534 CG ASP A 104 13.207 2.122 -4.183 1.00 0.00 C ATOM 1535 OD1 ASP A 104 13.373 3.135 -4.895 1.00 0.00 O ATOM 1536 OD2 ASP A 104 13.943 1.835 -3.216 1.00 0.00 O ATOM 0 H ASP A 104 9.741 0.158 -4.824 1.00 0.00 H new ATOM 0 HA ASP A 104 10.730 2.887 -4.442 1.00 0.00 H new ATOM 0 HB2 ASP A 104 11.794 0.616 -3.621 1.00 0.00 H new ATOM 0 HB3 ASP A 104 12.365 0.484 -5.273 1.00 0.00 H new ATOM 1541 N GLY A 105 10.341 3.380 -6.898 1.00 0.00 N ATOM 1542 CA GLY A 105 10.407 3.783 -8.290 1.00 0.00 C ATOM 1543 C GLY A 105 11.827 4.042 -8.752 1.00 0.00 C ATOM 1544 O GLY A 105 12.264 3.504 -9.769 1.00 0.00 O ATOM 0 H GLY A 105 9.800 4.002 -6.297 1.00 0.00 H new ATOM 0 HA2 GLY A 105 9.962 3.006 -8.911 1.00 0.00 H new ATOM 0 HA3 GLY A 105 9.812 4.685 -8.433 1.00 0.00 H new ATOM 1548 N ARG A 106 12.549 4.870 -8.004 1.00 0.00 N ATOM 1549 CA ARG A 106 13.927 5.202 -8.344 1.00 0.00 C ATOM 1550 C ARG A 106 14.734 3.940 -8.638 1.00 0.00 C ATOM 1551 O ARG A 106 15.559 3.917 -9.551 1.00 0.00 O ATOM 1552 CB ARG A 106 14.582 5.985 -7.204 1.00 0.00 C ATOM 1553 CG ARG A 106 13.878 7.292 -6.880 1.00 0.00 C ATOM 1554 CD ARG A 106 14.341 7.859 -5.547 1.00 0.00 C ATOM 1555 NE ARG A 106 13.701 9.136 -5.244 1.00 0.00 N ATOM 1556 CZ ARG A 106 13.985 9.863 -4.169 1.00 0.00 C ATOM 1557 NH1 ARG A 106 14.894 9.442 -3.301 1.00 0.00 N ATOM 1558 NH2 ARG A 106 13.360 11.015 -3.962 1.00 0.00 N ATOM 0 H ARG A 106 12.202 5.323 -7.159 1.00 0.00 H new ATOM 0 HA ARG A 106 13.914 5.822 -9.241 1.00 0.00 H new ATOM 0 HB2 ARG A 106 14.601 5.361 -6.310 1.00 0.00 H new ATOM 0 HB3 ARG A 106 15.618 6.196 -7.468 1.00 0.00 H new ATOM 0 HG2 ARG A 106 14.071 8.016 -7.671 1.00 0.00 H new ATOM 0 HG3 ARG A 106 12.801 7.129 -6.853 1.00 0.00 H new ATOM 0 HD2 ARG A 106 14.120 7.145 -4.753 1.00 0.00 H new ATOM 0 HD3 ARG A 106 15.423 7.991 -5.565 1.00 0.00 H new ATOM 0 HE ARG A 106 12.998 9.489 -5.893 1.00 0.00 H new ATOM 0 HH11 ARG A 106 15.378 8.558 -3.458 1.00 0.00 H new ATOM 0 HH12 ARG A 106 15.110 10.002 -2.477 1.00 0.00 H new ATOM 0 HH21 ARG A 106 12.661 11.343 -4.628 1.00 0.00 H new ATOM 0 HH22 ARG A 106 13.579 11.573 -3.136 1.00 0.00 H new ATOM 1572 N SER A 107 14.490 2.893 -7.857 1.00 0.00 N ATOM 1573 CA SER A 107 15.196 1.629 -8.030 1.00 0.00 C ATOM 1574 C SER A 107 15.275 1.249 -9.505 1.00 0.00 C ATOM 1575 O SER A 107 14.274 0.876 -10.116 1.00 0.00 O ATOM 1576 CB SER A 107 14.499 0.519 -7.242 1.00 0.00 C ATOM 1577 OG SER A 107 15.237 -0.689 -7.301 1.00 0.00 O ATOM 0 H SER A 107 13.809 2.895 -7.098 1.00 0.00 H new ATOM 0 HA SER A 107 16.210 1.752 -7.650 1.00 0.00 H new ATOM 0 HB2 SER A 107 14.380 0.826 -6.203 1.00 0.00 H new ATOM 0 HB3 SER A 107 13.498 0.357 -7.643 1.00 0.00 H new ATOM 0 HG SER A 107 14.852 -1.275 -7.986 1.00 0.00 H new ATOM 1583 N GLY A 108 16.474 1.345 -10.072 1.00 0.00 N ATOM 1584 CA GLY A 108 16.662 1.008 -11.471 1.00 0.00 C ATOM 1585 C GLY A 108 16.012 -0.309 -11.843 1.00 0.00 C ATOM 1586 O GLY A 108 15.395 -0.428 -12.902 1.00 0.00 O ATOM 0 H GLY A 108 17.318 1.650 -9.587 1.00 0.00 H new ATOM 0 HA2 GLY A 108 16.247 1.802 -12.092 1.00 0.00 H new ATOM 0 HA3 GLY A 108 17.729 0.957 -11.689 1.00 0.00 H new ATOM 1590 N ASP A 109 16.151 -1.302 -10.972 1.00 0.00 N ATOM 1591 CA ASP A 109 15.572 -2.619 -11.214 1.00 0.00 C ATOM 1592 C ASP A 109 14.107 -2.655 -10.790 1.00 0.00 C ATOM 1593 O ASP A 109 13.790 -2.555 -9.604 1.00 0.00 O ATOM 1594 CB ASP A 109 16.360 -3.693 -10.462 1.00 0.00 C ATOM 1595 CG ASP A 109 17.827 -3.709 -10.846 1.00 0.00 C ATOM 1596 OD1 ASP A 109 18.129 -4.016 -12.018 1.00 0.00 O ATOM 1597 OD2 ASP A 109 18.672 -3.416 -9.974 1.00 0.00 O ATOM 0 H ASP A 109 16.660 -1.220 -10.092 1.00 0.00 H new ATOM 0 HA ASP A 109 15.627 -2.821 -12.284 1.00 0.00 H new ATOM 0 HB2 ASP A 109 16.270 -3.522 -9.389 1.00 0.00 H new ATOM 0 HB3 ASP A 109 15.923 -4.670 -10.666 1.00 0.00 H new ATOM 1602 N LYS A 110 13.217 -2.798 -11.766 1.00 0.00 N ATOM 1603 CA LYS A 110 11.785 -2.847 -11.495 1.00 0.00 C ATOM 1604 C LYS A 110 11.419 -4.117 -10.733 1.00 0.00 C ATOM 1605 O LYS A 110 10.429 -4.150 -10.002 1.00 0.00 O ATOM 1606 CB LYS A 110 10.995 -2.779 -12.804 1.00 0.00 C ATOM 1607 CG LYS A 110 11.471 -3.768 -13.854 1.00 0.00 C ATOM 1608 CD LYS A 110 10.339 -4.194 -14.774 1.00 0.00 C ATOM 1609 CE LYS A 110 9.459 -5.249 -14.123 1.00 0.00 C ATOM 1610 NZ LYS A 110 10.018 -6.619 -14.291 1.00 0.00 N ATOM 0 H LYS A 110 13.462 -2.882 -12.752 1.00 0.00 H new ATOM 0 HA LYS A 110 11.527 -1.987 -10.877 1.00 0.00 H new ATOM 0 HB2 LYS A 110 9.942 -2.965 -12.593 1.00 0.00 H new ATOM 0 HB3 LYS A 110 11.066 -1.770 -13.209 1.00 0.00 H new ATOM 0 HG2 LYS A 110 12.270 -3.318 -14.443 1.00 0.00 H new ATOM 0 HG3 LYS A 110 11.892 -4.646 -13.364 1.00 0.00 H new ATOM 0 HD2 LYS A 110 9.735 -3.325 -15.035 1.00 0.00 H new ATOM 0 HD3 LYS A 110 10.752 -4.586 -15.703 1.00 0.00 H new ATOM 0 HE2 LYS A 110 9.353 -5.028 -13.061 1.00 0.00 H new ATOM 0 HE3 LYS A 110 8.461 -5.208 -14.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 9.389 -7.309 -13.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 10.096 -6.840 -15.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 10.960 -6.666 -13.853 1.00 0.00 H new ATOM 1624 N SER A 111 12.225 -5.160 -10.908 1.00 0.00 N ATOM 1625 CA SER A 111 11.984 -6.432 -10.238 1.00 0.00 C ATOM 1626 C SER A 111 12.414 -6.367 -8.776 1.00 0.00 C ATOM 1627 O SER A 111 12.083 -7.245 -7.979 1.00 0.00 O ATOM 1628 CB SER A 111 12.734 -7.558 -10.952 1.00 0.00 C ATOM 1629 OG SER A 111 12.047 -8.791 -10.823 1.00 0.00 O ATOM 0 H SER A 111 13.050 -5.149 -11.508 1.00 0.00 H new ATOM 0 HA SER A 111 10.914 -6.636 -10.275 1.00 0.00 H new ATOM 0 HB2 SER A 111 12.848 -7.311 -12.007 1.00 0.00 H new ATOM 0 HB3 SER A 111 13.737 -7.652 -10.536 1.00 0.00 H new ATOM 0 HG SER A 111 12.546 -9.494 -11.289 1.00 0.00 H new ATOM 1635 N LYS A 112 13.154 -5.319 -8.430 1.00 0.00 N ATOM 1636 CA LYS A 112 13.630 -5.136 -7.064 1.00 0.00 C ATOM 1637 C LYS A 112 13.102 -3.832 -6.475 1.00 0.00 C ATOM 1638 O LYS A 112 13.781 -3.176 -5.684 1.00 0.00 O ATOM 1639 CB LYS A 112 15.160 -5.140 -7.030 1.00 0.00 C ATOM 1640 CG LYS A 112 15.773 -6.472 -7.425 1.00 0.00 C ATOM 1641 CD LYS A 112 17.282 -6.467 -7.246 1.00 0.00 C ATOM 1642 CE LYS A 112 17.991 -5.999 -8.508 1.00 0.00 C ATOM 1643 NZ LYS A 112 17.773 -6.934 -9.646 1.00 0.00 N ATOM 0 H LYS A 112 13.437 -4.583 -9.077 1.00 0.00 H new ATOM 0 HA LYS A 112 13.257 -5.964 -6.462 1.00 0.00 H new ATOM 0 HB2 LYS A 112 15.532 -4.365 -7.700 1.00 0.00 H new ATOM 0 HB3 LYS A 112 15.494 -4.880 -6.025 1.00 0.00 H new ATOM 0 HG2 LYS A 112 15.337 -7.268 -6.821 1.00 0.00 H new ATOM 0 HG3 LYS A 112 15.530 -6.691 -8.465 1.00 0.00 H new ATOM 0 HD2 LYS A 112 17.549 -5.815 -6.414 1.00 0.00 H new ATOM 0 HD3 LYS A 112 17.622 -7.470 -6.987 1.00 0.00 H new ATOM 0 HE2 LYS A 112 17.632 -5.006 -8.780 1.00 0.00 H new ATOM 0 HE3 LYS A 112 19.059 -5.908 -8.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 18.575 -6.871 -10.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 17.696 -7.907 -9.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 16.896 -6.678 -10.143 1.00 0.00 H new ATOM 1657 N VAL A 113 11.886 -3.461 -6.864 1.00 0.00 N ATOM 1658 CA VAL A 113 11.266 -2.237 -6.371 1.00 0.00 C ATOM 1659 C VAL A 113 10.655 -2.447 -4.991 1.00 0.00 C ATOM 1660 O VAL A 113 10.515 -1.504 -4.212 1.00 0.00 O ATOM 1661 CB VAL A 113 10.173 -1.736 -7.334 1.00 0.00 C ATOM 1662 CG1 VAL A 113 10.771 -1.393 -8.690 1.00 0.00 C ATOM 1663 CG2 VAL A 113 9.070 -2.774 -7.475 1.00 0.00 C ATOM 0 H VAL A 113 11.311 -3.991 -7.519 1.00 0.00 H new ATOM 0 HA VAL A 113 12.054 -1.487 -6.305 1.00 0.00 H new ATOM 0 HB VAL A 113 9.735 -0.829 -6.918 1.00 0.00 H new ATOM 0 HG11 VAL A 113 9.984 -1.041 -9.356 1.00 0.00 H new ATOM 0 HG12 VAL A 113 11.521 -0.611 -8.570 1.00 0.00 H new ATOM 0 HG13 VAL A 113 11.238 -2.281 -9.117 1.00 0.00 H new ATOM 0 HG21 VAL A 113 8.307 -2.403 -8.159 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.490 -3.700 -7.868 1.00 0.00 H new ATOM 0 HG23 VAL A 113 8.622 -2.964 -6.500 1.00 0.00 H new ATOM 1673 N TRP A 114 10.292 -3.690 -4.694 1.00 0.00 N ATOM 1674 CA TRP A 114 9.696 -4.025 -3.405 1.00 0.00 C ATOM 1675 C TRP A 114 10.726 -3.925 -2.286 1.00 0.00 C ATOM 1676 O TRP A 114 11.752 -4.606 -2.310 1.00 0.00 O ATOM 1677 CB TRP A 114 9.102 -5.434 -3.445 1.00 0.00 C ATOM 1678 CG TRP A 114 7.718 -5.479 -4.019 1.00 0.00 C ATOM 1679 CD1 TRP A 114 7.101 -4.504 -4.750 1.00 0.00 C ATOM 1680 CD2 TRP A 114 6.780 -6.555 -3.908 1.00 0.00 C ATOM 1681 NE1 TRP A 114 5.836 -4.909 -5.099 1.00 0.00 N ATOM 1682 CE2 TRP A 114 5.614 -6.163 -4.596 1.00 0.00 C ATOM 1683 CE3 TRP A 114 6.811 -7.811 -3.296 1.00 0.00 C ATOM 1684 CZ2 TRP A 114 4.493 -6.983 -4.686 1.00 0.00 C ATOM 1685 CZ3 TRP A 114 5.697 -8.623 -3.386 1.00 0.00 C ATOM 1686 CH2 TRP A 114 4.551 -8.208 -4.077 1.00 0.00 C ATOM 0 H TRP A 114 10.400 -4.482 -5.328 1.00 0.00 H new ATOM 0 HA TRP A 114 8.899 -3.309 -3.204 1.00 0.00 H new ATOM 0 HB2 TRP A 114 9.753 -6.079 -4.035 1.00 0.00 H new ATOM 0 HB3 TRP A 114 9.082 -5.841 -2.434 1.00 0.00 H new ATOM 0 HD1 TRP A 114 7.543 -3.555 -5.015 1.00 0.00 H new ATOM 0 HE1 TRP A 114 5.169 -4.363 -5.645 1.00 0.00 H new ATOM 0 HE3 TRP A 114 7.690 -8.141 -2.762 1.00 0.00 H new ATOM 0 HZ2 TRP A 114 3.609 -6.664 -5.217 1.00 0.00 H new ATOM 0 HZ3 TRP A 114 5.710 -9.595 -2.915 1.00 0.00 H new ATOM 0 HH2 TRP A 114 3.697 -8.867 -4.130 1.00 0.00 H new ATOM 1697 N THR A 115 10.448 -3.073 -1.305 1.00 0.00 N ATOM 1698 CA THR A 115 11.352 -2.884 -0.177 1.00 0.00 C ATOM 1699 C THR A 115 10.579 -2.585 1.103 1.00 0.00 C ATOM 1700 O THR A 115 9.576 -1.870 1.083 1.00 0.00 O ATOM 1701 CB THR A 115 12.348 -1.739 -0.441 1.00 0.00 C ATOM 1702 OG1 THR A 115 13.116 -2.019 -1.616 1.00 0.00 O ATOM 1703 CG2 THR A 115 13.279 -1.547 0.747 1.00 0.00 C ATOM 0 H THR A 115 9.603 -2.502 -1.269 1.00 0.00 H new ATOM 0 HA THR A 115 11.905 -3.816 -0.055 1.00 0.00 H new ATOM 0 HB THR A 115 11.781 -0.820 -0.589 1.00 0.00 H new ATOM 0 HG1 THR A 115 13.746 -1.286 -1.778 1.00 0.00 H new ATOM 0 HG21 THR A 115 13.973 -0.733 0.537 1.00 0.00 H new ATOM 0 HG22 THR A 115 12.693 -1.305 1.633 1.00 0.00 H new ATOM 0 HG23 THR A 115 13.839 -2.466 0.923 1.00 0.00 H new ATOM 1711 N THR A 116 11.051 -3.137 2.216 1.00 0.00 N ATOM 1712 CA THR A 116 10.404 -2.930 3.506 1.00 0.00 C ATOM 1713 C THR A 116 10.863 -1.626 4.148 1.00 0.00 C ATOM 1714 O THR A 116 11.998 -1.191 3.951 1.00 0.00 O ATOM 1715 CB THR A 116 10.692 -4.094 4.472 1.00 0.00 C ATOM 1716 OG1 THR A 116 12.104 -4.305 4.578 1.00 0.00 O ATOM 1717 CG2 THR A 116 10.017 -5.372 3.996 1.00 0.00 C ATOM 0 H THR A 116 11.879 -3.731 2.250 1.00 0.00 H new ATOM 0 HA THR A 116 9.332 -2.881 3.318 1.00 0.00 H new ATOM 0 HB THR A 116 10.290 -3.833 5.451 1.00 0.00 H new ATOM 0 HG1 THR A 116 12.390 -4.952 3.899 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.235 -6.180 4.694 1.00 0.00 H new ATOM 0 HG22 THR A 116 8.939 -5.217 3.945 1.00 0.00 H new ATOM 0 HG23 THR A 116 10.393 -5.636 3.007 1.00 0.00 H new ATOM 1725 N ASP A 117 9.975 -1.006 4.917 1.00 0.00 N ATOM 1726 CA ASP A 117 10.290 0.249 5.591 1.00 0.00 C ATOM 1727 C ASP A 117 9.295 0.528 6.713 1.00 0.00 C ATOM 1728 O ASP A 117 8.199 -0.034 6.740 1.00 0.00 O ATOM 1729 CB ASP A 117 10.287 1.405 4.589 1.00 0.00 C ATOM 1730 CG ASP A 117 11.237 2.517 4.987 1.00 0.00 C ATOM 1731 OD1 ASP A 117 10.826 3.395 5.774 1.00 0.00 O ATOM 1732 OD2 ASP A 117 12.391 2.511 4.509 1.00 0.00 O ATOM 0 H ASP A 117 9.031 -1.352 5.089 1.00 0.00 H new ATOM 0 HA ASP A 117 11.285 0.159 6.027 1.00 0.00 H new ATOM 0 HB2 ASP A 117 10.564 1.029 3.604 1.00 0.00 H new ATOM 0 HB3 ASP A 117 9.277 1.806 4.504 1.00 0.00 H new ATOM 1737 N THR A 118 9.683 1.400 7.638 1.00 0.00 N ATOM 1738 CA THR A 118 8.827 1.753 8.763 1.00 0.00 C ATOM 1739 C THR A 118 7.506 2.346 8.284 1.00 0.00 C ATOM 1740 O THR A 118 7.462 3.058 7.281 1.00 0.00 O ATOM 1741 CB THR A 118 9.518 2.759 9.702 1.00 0.00 C ATOM 1742 OG1 THR A 118 8.639 3.112 10.776 1.00 0.00 O ATOM 1743 CG2 THR A 118 9.928 4.013 8.944 1.00 0.00 C ATOM 0 H THR A 118 10.586 1.875 7.630 1.00 0.00 H new ATOM 0 HA THR A 118 8.631 0.832 9.312 1.00 0.00 H new ATOM 0 HB THR A 118 10.414 2.288 10.106 1.00 0.00 H new ATOM 0 HG1 THR A 118 9.087 3.751 11.369 1.00 0.00 H new ATOM 0 HG21 THR A 118 10.414 4.709 9.628 1.00 0.00 H new ATOM 0 HG22 THR A 118 10.620 3.746 8.146 1.00 0.00 H new ATOM 0 HG23 THR A 118 9.044 4.484 8.515 1.00 0.00 H new ATOM 1751 N CYS A 119 6.433 2.049 9.009 1.00 0.00 N ATOM 1752 CA CYS A 119 5.110 2.554 8.659 1.00 0.00 C ATOM 1753 C CYS A 119 4.883 3.942 9.249 1.00 0.00 C ATOM 1754 O CYS A 119 3.751 4.327 9.540 1.00 0.00 O ATOM 1755 CB CYS A 119 4.028 1.593 9.154 1.00 0.00 C ATOM 1756 SG CYS A 119 4.379 -0.162 8.816 1.00 0.00 S ATOM 0 H CYS A 119 6.453 1.461 9.842 1.00 0.00 H new ATOM 0 HA CYS A 119 5.052 2.628 7.573 1.00 0.00 H new ATOM 0 HB2 CYS A 119 3.903 1.727 10.228 1.00 0.00 H new ATOM 0 HB3 CYS A 119 3.080 1.859 8.687 1.00 0.00 H new ATOM 1761 N ALA A 120 5.969 4.689 9.425 1.00 0.00 N ATOM 1762 CA ALA A 120 5.888 6.035 9.978 1.00 0.00 C ATOM 1763 C ALA A 120 6.450 7.064 9.003 1.00 0.00 C ATOM 1764 O ALA A 120 6.190 8.261 9.129 1.00 0.00 O ATOM 1765 CB ALA A 120 6.628 6.104 11.306 1.00 0.00 C ATOM 0 H ALA A 120 6.914 4.384 9.193 1.00 0.00 H new ATOM 0 HA ALA A 120 4.837 6.270 10.147 1.00 0.00 H new ATOM 0 HB1 ALA A 120 6.560 7.115 11.708 1.00 0.00 H new ATOM 0 HB2 ALA A 120 6.179 5.402 12.009 1.00 0.00 H new ATOM 0 HB3 ALA A 120 7.675 5.844 11.153 1.00 0.00 H new ATOM 1771 N THR A 121 7.224 6.591 8.031 1.00 0.00 N ATOM 1772 CA THR A 121 7.824 7.470 7.036 1.00 0.00 C ATOM 1773 C THR A 121 6.765 8.054 6.108 1.00 0.00 C ATOM 1774 O THR A 121 6.027 7.332 5.437 1.00 0.00 O ATOM 1775 CB THR A 121 8.877 6.727 6.192 1.00 0.00 C ATOM 1776 OG1 THR A 121 9.886 6.174 7.044 1.00 0.00 O ATOM 1777 CG2 THR A 121 9.518 7.663 5.179 1.00 0.00 C ATOM 0 H THR A 121 7.450 5.603 7.912 1.00 0.00 H new ATOM 0 HA THR A 121 8.311 8.279 7.581 1.00 0.00 H new ATOM 0 HB THR A 121 8.377 5.923 5.653 1.00 0.00 H new ATOM 0 HG1 THR A 121 10.247 5.359 6.637 1.00 0.00 H new ATOM 0 HG21 THR A 121 10.258 7.116 4.595 1.00 0.00 H new ATOM 0 HG22 THR A 121 8.751 8.059 4.513 1.00 0.00 H new ATOM 0 HG23 THR A 121 10.005 8.486 5.702 1.00 0.00 H new ATOM 1785 N PRO A 122 6.688 9.392 6.065 1.00 0.00 N ATOM 1786 CA PRO A 122 5.723 10.103 5.221 1.00 0.00 C ATOM 1787 C PRO A 122 6.048 9.977 3.736 1.00 0.00 C ATOM 1788 O PRO A 122 7.015 10.564 3.251 1.00 0.00 O ATOM 1789 CB PRO A 122 5.857 11.558 5.676 1.00 0.00 C ATOM 1790 CG PRO A 122 7.238 11.656 6.227 1.00 0.00 C ATOM 1791 CD PRO A 122 7.537 10.315 6.837 1.00 0.00 C ATOM 0 HA PRO A 122 4.716 9.700 5.327 1.00 0.00 H new ATOM 0 HB2 PRO A 122 5.712 12.248 4.845 1.00 0.00 H new ATOM 0 HB3 PRO A 122 5.111 11.807 6.431 1.00 0.00 H new ATOM 0 HG2 PRO A 122 7.955 11.896 5.442 1.00 0.00 H new ATOM 0 HG3 PRO A 122 7.305 12.448 6.973 1.00 0.00 H new ATOM 0 HD2 PRO A 122 8.593 10.059 6.748 1.00 0.00 H new ATOM 0 HD3 PRO A 122 7.292 10.293 7.899 1.00 0.00 H new ATOM 1799 N ARG A 123 5.234 9.207 3.020 1.00 0.00 N ATOM 1800 CA ARG A 123 5.436 9.004 1.591 1.00 0.00 C ATOM 1801 C ARG A 123 4.103 9.002 0.848 1.00 0.00 C ATOM 1802 O ARG A 123 3.039 8.797 1.433 1.00 0.00 O ATOM 1803 CB ARG A 123 6.174 7.687 1.341 1.00 0.00 C ATOM 1804 CG ARG A 123 7.688 7.825 1.355 1.00 0.00 C ATOM 1805 CD ARG A 123 8.362 6.521 1.750 1.00 0.00 C ATOM 1806 NE ARG A 123 9.766 6.715 2.101 1.00 0.00 N ATOM 1807 CZ ARG A 123 10.526 5.769 2.642 1.00 0.00 C ATOM 1808 NH1 ARG A 123 10.019 4.569 2.892 1.00 0.00 N ATOM 1809 NH2 ARG A 123 11.795 6.022 2.935 1.00 0.00 N ATOM 0 H ARG A 123 4.429 8.714 3.407 1.00 0.00 H new ATOM 0 HA ARG A 123 6.041 9.829 1.214 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.877 6.964 2.100 1.00 0.00 H new ATOM 0 HB3 ARG A 123 5.863 7.283 0.377 1.00 0.00 H new ATOM 0 HG2 ARG A 123 8.036 8.131 0.368 1.00 0.00 H new ATOM 0 HG3 ARG A 123 7.976 8.611 2.053 1.00 0.00 H new ATOM 0 HD2 ARG A 123 7.834 6.082 2.597 1.00 0.00 H new ATOM 0 HD3 ARG A 123 8.289 5.811 0.926 1.00 0.00 H new ATOM 0 HE ARG A 123 10.186 7.627 1.921 1.00 0.00 H new ATOM 0 HH11 ARG A 123 9.044 4.371 2.669 1.00 0.00 H new ATOM 0 HH12 ARG A 123 10.605 3.844 3.307 1.00 0.00 H new ATOM 0 HH21 ARG A 123 12.188 6.944 2.745 1.00 0.00 H new ATOM 0 HH22 ARG A 123 12.377 5.295 3.350 1.00 0.00 H new ATOM 1823 N PRO A 124 4.160 9.234 -0.471 1.00 0.00 N ATOM 1824 CA PRO A 124 2.967 9.264 -1.322 1.00 0.00 C ATOM 1825 C PRO A 124 2.343 7.883 -1.494 1.00 0.00 C ATOM 1826 O PRO A 124 2.957 6.868 -1.165 1.00 0.00 O ATOM 1827 CB PRO A 124 3.499 9.780 -2.662 1.00 0.00 C ATOM 1828 CG PRO A 124 4.941 9.405 -2.666 1.00 0.00 C ATOM 1829 CD PRO A 124 5.395 9.486 -1.235 1.00 0.00 C ATOM 0 HA PRO A 124 2.178 9.882 -0.895 1.00 0.00 H new ATOM 0 HB2 PRO A 124 2.969 9.326 -3.500 1.00 0.00 H new ATOM 0 HB3 PRO A 124 3.370 10.859 -2.750 1.00 0.00 H new ATOM 0 HG2 PRO A 124 5.081 8.400 -3.063 1.00 0.00 H new ATOM 0 HG3 PRO A 124 5.518 10.081 -3.297 1.00 0.00 H new ATOM 0 HD2 PRO A 124 6.163 8.744 -1.014 1.00 0.00 H new ATOM 0 HD3 PRO A 124 5.819 10.463 -1.003 1.00 0.00 H new ATOM 1837 N PHE A 125 1.119 7.853 -2.010 1.00 0.00 N ATOM 1838 CA PHE A 125 0.411 6.596 -2.224 1.00 0.00 C ATOM 1839 C PHE A 125 -0.428 6.654 -3.498 1.00 0.00 C ATOM 1840 O PHE A 125 -0.442 7.667 -4.198 1.00 0.00 O ATOM 1841 CB PHE A 125 -0.485 6.280 -1.025 1.00 0.00 C ATOM 1842 CG PHE A 125 -1.336 7.439 -0.590 1.00 0.00 C ATOM 1843 CD1 PHE A 125 -0.766 8.539 0.031 1.00 0.00 C ATOM 1844 CD2 PHE A 125 -2.705 7.429 -0.802 1.00 0.00 C ATOM 1845 CE1 PHE A 125 -1.546 9.606 0.433 1.00 0.00 C ATOM 1846 CE2 PHE A 125 -3.490 8.494 -0.402 1.00 0.00 C ATOM 1847 CZ PHE A 125 -2.910 9.584 0.215 1.00 0.00 C ATOM 0 H PHE A 125 0.597 8.684 -2.288 1.00 0.00 H new ATOM 0 HA PHE A 125 1.153 5.805 -2.333 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -1.131 5.439 -1.276 1.00 0.00 H new ATOM 0 HB3 PHE A 125 0.139 5.964 -0.189 1.00 0.00 H new ATOM 0 HD1 PHE A 125 0.300 8.562 0.203 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -3.164 6.579 -1.285 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -1.090 10.457 0.917 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -4.556 8.473 -0.572 1.00 0.00 H new ATOM 0 HZ PHE A 125 -3.521 10.418 0.527 1.00 0.00 H new ATOM 1857 N ILE A 126 -1.123 5.561 -3.792 1.00 0.00 N ATOM 1858 CA ILE A 126 -1.964 5.488 -4.980 1.00 0.00 C ATOM 1859 C ILE A 126 -3.297 4.815 -4.670 1.00 0.00 C ATOM 1860 O ILE A 126 -3.353 3.613 -4.411 1.00 0.00 O ATOM 1861 CB ILE A 126 -1.266 4.719 -6.117 1.00 0.00 C ATOM 1862 CG1 ILE A 126 -0.108 5.543 -6.684 1.00 0.00 C ATOM 1863 CG2 ILE A 126 -2.263 4.372 -7.213 1.00 0.00 C ATOM 1864 CD1 ILE A 126 0.480 4.966 -7.952 1.00 0.00 C ATOM 0 H ILE A 126 -1.120 4.714 -3.224 1.00 0.00 H new ATOM 0 HA ILE A 126 -2.144 6.514 -5.303 1.00 0.00 H new ATOM 0 HB ILE A 126 -0.863 3.790 -5.713 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -0.457 6.556 -6.883 1.00 0.00 H new ATOM 0 HG13 ILE A 126 0.676 5.619 -5.931 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -1.754 3.829 -8.009 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -3.057 3.750 -6.799 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -2.693 5.288 -7.617 1.00 0.00 H new ATOM 0 HD11 ILE A 126 1.296 5.602 -8.297 1.00 0.00 H new ATOM 0 HD12 ILE A 126 0.860 3.964 -7.754 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -0.291 4.916 -8.721 1.00 0.00 H new ATOM 1876 N CYS A 127 -4.370 5.599 -4.700 1.00 0.00 N ATOM 1877 CA CYS A 127 -5.704 5.080 -4.423 1.00 0.00 C ATOM 1878 C CYS A 127 -6.313 4.450 -5.673 1.00 0.00 C ATOM 1879 O CYS A 127 -6.282 5.039 -6.754 1.00 0.00 O ATOM 1880 CB CYS A 127 -6.612 6.198 -3.908 1.00 0.00 C ATOM 1881 SG CYS A 127 -6.027 6.983 -2.372 1.00 0.00 S ATOM 0 H CYS A 127 -4.341 6.596 -4.913 1.00 0.00 H new ATOM 0 HA CYS A 127 -5.615 4.311 -3.656 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -6.705 6.961 -4.681 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -7.610 5.792 -3.739 1.00 0.00 H new ATOM 1886 N GLN A 128 -6.865 3.252 -5.516 1.00 0.00 N ATOM 1887 CA GLN A 128 -7.480 2.542 -6.632 1.00 0.00 C ATOM 1888 C GLN A 128 -8.917 2.153 -6.303 1.00 0.00 C ATOM 1889 O GLN A 128 -9.284 2.017 -5.136 1.00 0.00 O ATOM 1890 CB GLN A 128 -6.667 1.294 -6.981 1.00 0.00 C ATOM 1891 CG GLN A 128 -7.346 0.391 -7.998 1.00 0.00 C ATOM 1892 CD GLN A 128 -6.652 -0.949 -8.144 1.00 0.00 C ATOM 1893 OE1 GLN A 128 -5.646 -1.067 -8.845 1.00 0.00 O ATOM 1894 NE2 GLN A 128 -7.186 -1.968 -7.480 1.00 0.00 N ATOM 0 H GLN A 128 -6.899 2.752 -4.628 1.00 0.00 H new ATOM 0 HA GLN A 128 -7.492 3.210 -7.493 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -5.696 1.600 -7.370 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -6.480 0.725 -6.070 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -8.382 0.229 -7.700 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -7.368 0.892 -8.966 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -8.020 -1.825 -6.911 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -6.762 -2.894 -7.539 1.00 0.00 H new ATOM 1903 N LYS A 129 -9.729 1.974 -7.340 1.00 0.00 N ATOM 1904 CA LYS A 129 -11.126 1.599 -7.163 1.00 0.00 C ATOM 1905 C LYS A 129 -11.247 0.145 -6.718 1.00 0.00 C ATOM 1906 O LYS A 129 -10.429 -0.698 -7.088 1.00 0.00 O ATOM 1907 CB LYS A 129 -11.902 1.811 -8.466 1.00 0.00 C ATOM 1908 CG LYS A 129 -12.319 3.253 -8.697 1.00 0.00 C ATOM 1909 CD LYS A 129 -13.436 3.668 -7.754 1.00 0.00 C ATOM 1910 CE LYS A 129 -14.323 4.735 -8.377 1.00 0.00 C ATOM 1911 NZ LYS A 129 -15.639 4.835 -7.687 1.00 0.00 N ATOM 0 H LYS A 129 -9.442 2.083 -8.313 1.00 0.00 H new ATOM 0 HA LYS A 129 -11.551 2.235 -6.386 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -11.287 1.481 -9.303 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -12.792 1.181 -8.456 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -11.460 3.908 -8.555 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -12.648 3.377 -9.729 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -14.039 2.797 -7.496 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -13.008 4.046 -6.825 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -13.816 5.699 -8.334 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -14.482 4.505 -9.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -16.214 5.573 -8.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -16.134 3.923 -7.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -15.489 5.079 -6.687 1.00 0.00 H new ATOM 1925 N HIS A 130 -12.273 -0.143 -5.924 1.00 0.00 N ATOM 1926 CA HIS A 130 -12.502 -1.496 -5.430 1.00 0.00 C ATOM 1927 C HIS A 130 -13.875 -2.005 -5.858 1.00 0.00 C ATOM 1928 O HIS A 130 -14.705 -1.242 -6.352 1.00 0.00 O ATOM 1929 CB HIS A 130 -12.383 -1.533 -3.906 1.00 0.00 C ATOM 1930 CG HIS A 130 -13.626 -1.089 -3.198 1.00 0.00 C ATOM 1931 ND1 HIS A 130 -13.805 0.193 -2.722 1.00 0.00 N ATOM 1932 CD2 HIS A 130 -14.757 -1.765 -2.886 1.00 0.00 C ATOM 1933 CE1 HIS A 130 -14.991 0.286 -2.148 1.00 0.00 C ATOM 1934 NE2 HIS A 130 -15.589 -0.888 -2.234 1.00 0.00 N ATOM 0 H HIS A 130 -12.959 0.543 -5.609 1.00 0.00 H new ATOM 0 HA HIS A 130 -11.742 -2.147 -5.861 1.00 0.00 H new ATOM 0 HB2 HIS A 130 -12.139 -2.548 -3.593 1.00 0.00 H new ATOM 0 HB3 HIS A 130 -11.553 -0.897 -3.599 1.00 0.00 H new ATOM 0 HD2 HIS A 130 -14.966 -2.801 -3.108 1.00 0.00 H new ATOM 0 HE1 HIS A 130 -15.402 1.172 -1.687 1.00 0.00 H new ATOM 0 HE2 HIS A 130 -16.518 -1.108 -1.875 1.00 0.00 H new ATOM 1943 N ARG A 131 -14.107 -3.300 -5.665 1.00 0.00 N ATOM 1944 CA ARG A 131 -15.379 -3.911 -6.032 1.00 0.00 C ATOM 1945 C ARG A 131 -15.986 -4.656 -4.848 1.00 0.00 C ATOM 1946 O ARG A 131 -15.375 -5.573 -4.298 1.00 0.00 O ATOM 1947 CB ARG A 131 -15.187 -4.871 -7.208 1.00 0.00 C ATOM 1948 CG ARG A 131 -15.087 -4.173 -8.554 1.00 0.00 C ATOM 1949 CD ARG A 131 -15.116 -5.169 -9.702 1.00 0.00 C ATOM 1950 NE ARG A 131 -16.477 -5.584 -10.033 1.00 0.00 N ATOM 1951 CZ ARG A 131 -16.801 -6.210 -11.159 1.00 0.00 C ATOM 1952 NH1 ARG A 131 -15.867 -6.492 -12.057 1.00 0.00 N ATOM 1953 NH2 ARG A 131 -18.061 -6.556 -11.388 1.00 0.00 N ATOM 0 H ARG A 131 -13.431 -3.946 -5.257 1.00 0.00 H new ATOM 0 HA ARG A 131 -16.063 -3.116 -6.328 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -14.282 -5.457 -7.044 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -16.021 -5.573 -7.233 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -15.911 -3.468 -8.662 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -14.165 -3.594 -8.597 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -14.649 -4.723 -10.580 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -14.524 -6.045 -9.437 1.00 0.00 H new ATOM 0 HE ARG A 131 -17.219 -5.382 -9.363 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -14.897 -6.228 -11.884 1.00 0.00 H new ATOM 0 HH12 ARG A 131 -16.119 -6.973 -12.921 1.00 0.00 H new ATOM 0 HH21 ARG A 131 -18.782 -6.341 -10.699 1.00 0.00 H new ATOM 0 HH22 ARG A 131 -18.309 -7.037 -12.253 1.00 0.00 H new ATOM 1967 N TYR A 132 -17.192 -4.256 -4.459 1.00 0.00 N ATOM 1968 CA TYR A 132 -17.881 -4.883 -3.337 1.00 0.00 C ATOM 1969 C TYR A 132 -19.373 -4.566 -3.368 1.00 0.00 C ATOM 1970 O TYR A 132 -19.780 -3.484 -3.792 1.00 0.00 O ATOM 1971 CB TYR A 132 -17.276 -4.414 -2.013 1.00 0.00 C ATOM 1972 CG TYR A 132 -17.443 -5.408 -0.886 1.00 0.00 C ATOM 1973 CD1 TYR A 132 -17.022 -6.724 -1.025 1.00 0.00 C ATOM 1974 CD2 TYR A 132 -18.022 -5.029 0.320 1.00 0.00 C ATOM 1975 CE1 TYR A 132 -17.173 -7.635 0.002 1.00 0.00 C ATOM 1976 CE2 TYR A 132 -18.176 -5.933 1.353 1.00 0.00 C ATOM 1977 CZ TYR A 132 -17.750 -7.235 1.189 1.00 0.00 C ATOM 1978 OH TYR A 132 -17.902 -8.139 2.215 1.00 0.00 O ATOM 0 H TYR A 132 -17.713 -3.500 -4.904 1.00 0.00 H new ATOM 0 HA TYR A 132 -17.755 -5.962 -3.424 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -16.214 -4.217 -2.158 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -17.739 -3.470 -1.726 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -16.568 -7.041 -1.953 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -18.357 -4.011 0.451 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -16.841 -8.655 -0.124 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -18.627 -5.622 2.284 1.00 0.00 H new ATOM 0 HH TYR A 132 -18.324 -7.697 2.981 1.00 0.00 H new ATOM 1988 N ASP A 133 -20.182 -5.517 -2.917 1.00 0.00 N ATOM 1989 CA ASP A 133 -21.630 -5.341 -2.891 1.00 0.00 C ATOM 1990 C ASP A 133 -22.008 -4.065 -2.144 1.00 0.00 C ATOM 1991 O ASP A 133 -22.842 -3.287 -2.607 1.00 0.00 O ATOM 1992 CB ASP A 133 -22.301 -6.549 -2.235 1.00 0.00 C ATOM 1993 CG ASP A 133 -23.699 -6.794 -2.767 1.00 0.00 C ATOM 1994 OD1 ASP A 133 -24.314 -5.838 -3.283 1.00 0.00 O ATOM 1995 OD2 ASP A 133 -24.177 -7.943 -2.668 1.00 0.00 O ATOM 0 H ASP A 133 -19.860 -6.418 -2.564 1.00 0.00 H new ATOM 0 HA ASP A 133 -21.980 -5.256 -3.920 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -21.691 -7.436 -2.404 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -22.347 -6.394 -1.157 1.00 0.00 H new ATOM 2000 N SER A 134 -21.390 -3.858 -0.986 1.00 0.00 N ATOM 2001 CA SER A 134 -21.665 -2.680 -0.172 1.00 0.00 C ATOM 2002 C SER A 134 -23.160 -2.375 -0.146 1.00 0.00 C ATOM 2003 O SER A 134 -23.570 -1.217 -0.225 1.00 0.00 O ATOM 2004 CB SER A 134 -20.897 -1.472 -0.710 1.00 0.00 C ATOM 2005 OG SER A 134 -20.834 -0.436 0.255 1.00 0.00 O ATOM 0 H SER A 134 -20.695 -4.491 -0.590 1.00 0.00 H new ATOM 0 HA SER A 134 -21.336 -2.887 0.846 1.00 0.00 H new ATOM 0 HB2 SER A 134 -19.888 -1.774 -0.990 1.00 0.00 H new ATOM 0 HB3 SER A 134 -21.381 -1.102 -1.614 1.00 0.00 H new ATOM 0 HG SER A 134 -21.740 -0.208 0.550 1.00 0.00 H new ATOM 2011 N ASP A 135 -23.969 -3.423 -0.034 1.00 0.00 N ATOM 2012 CA ASP A 135 -25.419 -3.269 0.004 1.00 0.00 C ATOM 2013 C ASP A 135 -25.943 -3.414 1.430 1.00 0.00 C ATOM 2014 O ASP A 135 -26.459 -4.466 1.809 1.00 0.00 O ATOM 2015 CB ASP A 135 -26.086 -4.302 -0.905 1.00 0.00 C ATOM 2016 CG ASP A 135 -26.208 -3.819 -2.337 1.00 0.00 C ATOM 2017 OD1 ASP A 135 -25.426 -2.929 -2.731 1.00 0.00 O ATOM 2018 OD2 ASP A 135 -27.087 -4.330 -3.063 1.00 0.00 O ATOM 0 H ASP A 135 -23.646 -4.388 0.032 1.00 0.00 H new ATOM 0 HA ASP A 135 -25.664 -2.269 -0.354 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -25.509 -5.227 -0.884 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -27.078 -4.536 -0.518 1.00 0.00 H new ATOM 2023 N HIS A 136 -25.807 -2.351 2.216 1.00 0.00 N ATOM 2024 CA HIS A 136 -26.267 -2.360 3.600 1.00 0.00 C ATOM 2025 C HIS A 136 -26.635 -0.952 4.059 1.00 0.00 C ATOM 2026 O HIS A 136 -26.453 0.019 3.325 1.00 0.00 O ATOM 2027 CB HIS A 136 -25.188 -2.941 4.514 1.00 0.00 C ATOM 2028 CG HIS A 136 -24.854 -4.370 4.214 1.00 0.00 C ATOM 2029 ND1 HIS A 136 -23.879 -4.741 3.312 1.00 0.00 N ATOM 2030 CD2 HIS A 136 -25.370 -5.521 4.702 1.00 0.00 C ATOM 2031 CE1 HIS A 136 -23.811 -6.059 3.258 1.00 0.00 C ATOM 2032 NE2 HIS A 136 -24.706 -6.557 4.092 1.00 0.00 N ATOM 0 H HIS A 136 -25.382 -1.473 1.918 1.00 0.00 H new ATOM 0 HA HIS A 136 -27.157 -2.986 3.657 1.00 0.00 H new ATOM 0 HB2 HIS A 136 -24.284 -2.339 4.424 1.00 0.00 H new ATOM 0 HB3 HIS A 136 -25.520 -2.864 5.549 1.00 0.00 H new ATOM 0 HD2 HIS A 136 -26.158 -5.609 5.435 1.00 0.00 H new ATOM 0 HE1 HIS A 136 -23.138 -6.632 2.637 1.00 0.00 H new ATOM 0 HE2 HIS A 136 -24.876 -7.549 4.256 1.00 0.00 H new ATOM 2041 N LYS A 137 -27.155 -0.850 5.277 1.00 0.00 N ATOM 2042 CA LYS A 137 -27.549 0.438 5.836 1.00 0.00 C ATOM 2043 C LYS A 137 -26.807 0.717 7.139 1.00 0.00 C ATOM 2044 O LYS A 137 -26.471 -0.194 7.897 1.00 0.00 O ATOM 2045 CB LYS A 137 -29.060 0.471 6.080 1.00 0.00 C ATOM 2046 CG LYS A 137 -29.884 0.338 4.811 1.00 0.00 C ATOM 2047 CD LYS A 137 -30.151 1.692 4.175 1.00 0.00 C ATOM 2048 CE LYS A 137 -29.113 2.024 3.115 1.00 0.00 C ATOM 2049 NZ LYS A 137 -29.527 1.551 1.765 1.00 0.00 N ATOM 0 H LYS A 137 -27.314 -1.644 5.897 1.00 0.00 H new ATOM 0 HA LYS A 137 -27.286 1.213 5.116 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -29.327 -0.336 6.763 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -29.319 1.407 6.575 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -29.360 -0.301 4.101 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -30.831 -0.150 5.041 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -31.144 1.695 3.726 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -30.146 2.464 4.945 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -28.953 3.102 3.089 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -28.161 1.567 3.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -28.793 1.797 1.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -29.655 0.519 1.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -30.423 2.007 1.497 1.00 0.00 H new ATOM 2063 N PRO A 138 -26.545 2.004 7.408 1.00 0.00 N ATOM 2064 CA PRO A 138 -25.841 2.432 8.621 1.00 0.00 C ATOM 2065 C PRO A 138 -26.682 2.239 9.878 1.00 0.00 C ATOM 2066 O PRO A 138 -26.217 2.480 10.991 1.00 0.00 O ATOM 2067 CB PRO A 138 -25.582 3.920 8.374 1.00 0.00 C ATOM 2068 CG PRO A 138 -26.648 4.338 7.421 1.00 0.00 C ATOM 2069 CD PRO A 138 -26.915 3.142 6.549 1.00 0.00 C ATOM 0 HA PRO A 138 -24.935 1.850 8.793 1.00 0.00 H new ATOM 0 HB2 PRO A 138 -25.635 4.490 9.302 1.00 0.00 H new ATOM 0 HB3 PRO A 138 -24.589 4.085 7.955 1.00 0.00 H new ATOM 0 HG2 PRO A 138 -27.549 4.643 7.953 1.00 0.00 H new ATOM 0 HG3 PRO A 138 -26.326 5.192 6.825 1.00 0.00 H new ATOM 0 HD2 PRO A 138 -27.960 3.092 6.244 1.00 0.00 H new ATOM 0 HD3 PRO A 138 -26.318 3.168 5.637 1.00 0.00 H new ATOM 2077 N ASN A 139 -27.924 1.802 9.692 1.00 0.00 N ATOM 2078 CA ASN A 139 -28.830 1.576 10.812 1.00 0.00 C ATOM 2079 C ASN A 139 -29.261 2.899 11.438 1.00 0.00 C ATOM 2080 O ASN A 139 -29.533 2.973 12.637 1.00 0.00 O ATOM 2081 CB ASN A 139 -28.161 0.693 11.867 1.00 0.00 C ATOM 2082 CG ASN A 139 -29.150 0.156 12.883 1.00 0.00 C ATOM 2083 OD1 ASN A 139 -30.206 -0.365 12.522 1.00 0.00 O ATOM 2084 ND2 ASN A 139 -28.812 0.280 14.161 1.00 0.00 N ATOM 0 H ASN A 139 -28.325 1.598 8.777 1.00 0.00 H new ATOM 0 HA ASN A 139 -29.717 1.068 10.433 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -27.661 -0.141 11.375 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -27.391 1.267 12.382 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -29.438 -0.063 14.890 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -27.927 0.719 14.414 1.00 0.00 H new ATOM 2091 N THR A 140 -29.321 3.944 10.618 1.00 0.00 N ATOM 2092 CA THR A 140 -29.718 5.264 11.091 1.00 0.00 C ATOM 2093 C THR A 140 -31.137 5.603 10.648 1.00 0.00 C ATOM 2094 O THR A 140 -31.554 5.250 9.545 1.00 0.00 O ATOM 2095 CB THR A 140 -28.759 6.355 10.579 1.00 0.00 C ATOM 2096 OG1 THR A 140 -28.881 7.532 11.386 1.00 0.00 O ATOM 2097 CG2 THR A 140 -29.052 6.697 9.126 1.00 0.00 C ATOM 0 H THR A 140 -29.100 3.901 9.623 1.00 0.00 H new ATOM 0 HA THR A 140 -29.677 5.235 12.180 1.00 0.00 H new ATOM 0 HB THR A 140 -27.741 5.972 10.646 1.00 0.00 H new ATOM 0 HG1 THR A 140 -28.267 8.220 11.055 1.00 0.00 H new ATOM 0 HG21 THR A 140 -28.362 7.470 8.788 1.00 0.00 H new ATOM 0 HG22 THR A 140 -28.929 5.806 8.511 1.00 0.00 H new ATOM 0 HG23 THR A 140 -30.076 7.061 9.037 1.00 0.00 H new ATOM 2105 N ILE A 141 -31.874 6.290 11.515 1.00 0.00 N ATOM 2106 CA ILE A 141 -33.245 6.678 11.211 1.00 0.00 C ATOM 2107 C ILE A 141 -33.398 7.054 9.741 1.00 0.00 C ATOM 2108 O ILE A 141 -32.800 8.021 9.271 1.00 0.00 O ATOM 2109 CB ILE A 141 -33.701 7.864 12.083 1.00 0.00 C ATOM 2110 CG1 ILE A 141 -33.661 7.481 13.564 1.00 0.00 C ATOM 2111 CG2 ILE A 141 -35.100 8.308 11.683 1.00 0.00 C ATOM 2112 CD1 ILE A 141 -32.312 7.710 14.210 1.00 0.00 C ATOM 0 H ILE A 141 -31.544 6.589 12.433 1.00 0.00 H new ATOM 0 HA ILE A 141 -33.873 5.814 11.429 1.00 0.00 H new ATOM 0 HB ILE A 141 -33.017 8.697 11.924 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -34.415 8.057 14.101 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -33.931 6.430 13.667 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -35.408 9.146 12.308 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -35.099 8.616 10.637 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -35.797 7.480 11.817 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -32.356 7.417 15.259 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -31.557 7.113 13.698 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -32.049 8.765 14.139 1.00 0.00 H new ATOM 2124 N GLY A 142 -34.206 6.283 9.020 1.00 0.00 N ATOM 2125 CA GLY A 142 -34.425 6.552 7.611 1.00 0.00 C ATOM 2126 C GLY A 142 -33.356 5.937 6.730 1.00 0.00 C ATOM 2127 O GLY A 142 -33.156 4.722 6.740 1.00 0.00 O ATOM 0 H GLY A 142 -34.713 5.477 9.386 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -35.401 6.164 7.318 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -34.449 7.630 7.450 1.00 0.00 H new ATOM 2131 N ASP A 143 -32.667 6.776 5.965 1.00 0.00 N ATOM 2132 CA ASP A 143 -31.612 6.308 5.074 1.00 0.00 C ATOM 2133 C ASP A 143 -30.704 7.460 4.654 1.00 0.00 C ATOM 2134 O ASP A 143 -31.072 8.628 4.773 1.00 0.00 O ATOM 2135 CB ASP A 143 -32.218 5.643 3.837 1.00 0.00 C ATOM 2136 CG ASP A 143 -33.475 4.860 4.158 1.00 0.00 C ATOM 2137 OD1 ASP A 143 -34.521 5.494 4.413 1.00 0.00 O ATOM 2138 OD2 ASP A 143 -33.414 3.613 4.153 1.00 0.00 O ATOM 0 H ASP A 143 -32.820 7.784 5.944 1.00 0.00 H new ATOM 0 HA ASP A 143 -31.013 5.575 5.614 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -32.449 6.406 3.094 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -31.482 4.975 3.390 1.00 0.00 H new ATOM 2143 N ALA A 144 -29.516 7.122 4.163 1.00 0.00 N ATOM 2144 CA ALA A 144 -28.556 8.128 3.725 1.00 0.00 C ATOM 2145 C ALA A 144 -28.613 8.319 2.213 1.00 0.00 C ATOM 2146 O ALA A 144 -27.580 8.431 1.553 1.00 0.00 O ATOM 2147 CB ALA A 144 -27.150 7.740 4.158 1.00 0.00 C ATOM 0 H ALA A 144 -29.195 6.159 4.059 1.00 0.00 H new ATOM 0 HA ALA A 144 -28.820 9.076 4.195 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -26.444 8.500 3.824 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -27.112 7.662 5.245 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -26.885 6.780 3.716 1.00 0.00 H new ATOM 2153 N SER A 145 -29.825 8.352 1.670 1.00 0.00 N ATOM 2154 CA SER A 145 -30.016 8.525 0.235 1.00 0.00 C ATOM 2155 C SER A 145 -29.326 9.794 -0.257 1.00 0.00 C ATOM 2156 O SER A 145 -29.817 10.902 -0.045 1.00 0.00 O ATOM 2157 CB SER A 145 -31.507 8.579 -0.101 1.00 0.00 C ATOM 2158 OG SER A 145 -32.151 9.626 0.605 1.00 0.00 O ATOM 0 H SER A 145 -30.690 8.261 2.202 1.00 0.00 H new ATOM 0 HA SER A 145 -29.568 7.669 -0.271 1.00 0.00 H new ATOM 0 HB2 SER A 145 -31.636 8.726 -1.173 1.00 0.00 H new ATOM 0 HB3 SER A 145 -31.974 7.626 0.149 1.00 0.00 H new ATOM 0 HG SER A 145 -31.570 10.415 0.622 1.00 0.00 H new ATOM 2164 N GLY A 146 -28.183 9.622 -0.914 1.00 0.00 N ATOM 2165 CA GLY A 146 -27.443 10.762 -1.425 1.00 0.00 C ATOM 2166 C GLY A 146 -27.401 11.914 -0.441 1.00 0.00 C ATOM 2167 O GLY A 146 -28.197 12.850 -0.514 1.00 0.00 O ATOM 0 H GLY A 146 -27.756 8.715 -1.102 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -26.425 10.454 -1.662 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -27.899 11.100 -2.356 1.00 0.00 H new ATOM 2171 N PRO A 147 -26.454 11.854 0.506 1.00 0.00 N ATOM 2172 CA PRO A 147 -26.289 12.893 1.528 1.00 0.00 C ATOM 2173 C PRO A 147 -25.762 14.200 0.946 1.00 0.00 C ATOM 2174 O PRO A 147 -24.588 14.303 0.589 1.00 0.00 O ATOM 2175 CB PRO A 147 -25.265 12.285 2.490 1.00 0.00 C ATOM 2176 CG PRO A 147 -24.497 11.314 1.661 1.00 0.00 C ATOM 2177 CD PRO A 147 -25.470 10.768 0.653 1.00 0.00 C ATOM 0 HA PRO A 147 -27.236 13.154 2.001 1.00 0.00 H new ATOM 0 HB2 PRO A 147 -24.612 13.051 2.909 1.00 0.00 H new ATOM 0 HB3 PRO A 147 -25.755 11.790 3.328 1.00 0.00 H new ATOM 0 HG2 PRO A 147 -23.657 11.802 1.167 1.00 0.00 H new ATOM 0 HG3 PRO A 147 -24.085 10.515 2.278 1.00 0.00 H new ATOM 0 HD2 PRO A 147 -24.981 10.538 -0.294 1.00 0.00 H new ATOM 0 HD3 PRO A 147 -25.937 9.847 1.003 1.00 0.00 H new ATOM 2185 N SER A 148 -26.637 15.196 0.853 1.00 0.00 N ATOM 2186 CA SER A 148 -26.260 16.496 0.311 1.00 0.00 C ATOM 2187 C SER A 148 -25.692 17.397 1.404 1.00 0.00 C ATOM 2188 O SER A 148 -26.356 17.673 2.403 1.00 0.00 O ATOM 2189 CB SER A 148 -27.468 17.169 -0.343 1.00 0.00 C ATOM 2190 OG SER A 148 -27.076 18.310 -1.087 1.00 0.00 O ATOM 0 H SER A 148 -27.612 15.128 1.146 1.00 0.00 H new ATOM 0 HA SER A 148 -25.489 16.338 -0.443 1.00 0.00 H new ATOM 0 HB2 SER A 148 -27.973 16.459 -0.999 1.00 0.00 H new ATOM 0 HB3 SER A 148 -28.185 17.460 0.424 1.00 0.00 H new ATOM 0 HG SER A 148 -27.866 18.721 -1.496 1.00 0.00 H new ATOM 2196 N SER A 149 -24.459 17.851 1.206 1.00 0.00 N ATOM 2197 CA SER A 149 -23.799 18.718 2.176 1.00 0.00 C ATOM 2198 C SER A 149 -24.001 20.187 1.818 1.00 0.00 C ATOM 2199 O SER A 149 -23.291 20.735 0.975 1.00 0.00 O ATOM 2200 CB SER A 149 -22.304 18.398 2.243 1.00 0.00 C ATOM 2201 OG SER A 149 -21.748 18.814 3.478 1.00 0.00 O ATOM 0 H SER A 149 -23.897 17.633 0.383 1.00 0.00 H new ATOM 0 HA SER A 149 -24.247 18.536 3.153 1.00 0.00 H new ATOM 0 HB2 SER A 149 -22.152 17.326 2.115 1.00 0.00 H new ATOM 0 HB3 SER A 149 -21.786 18.894 1.422 1.00 0.00 H new ATOM 0 HG SER A 149 -20.793 18.597 3.496 1.00 0.00 H new ATOM 2207 N GLY A 150 -24.975 20.819 2.466 1.00 0.00 N ATOM 2208 CA GLY A 150 -25.254 22.219 2.203 1.00 0.00 C ATOM 2209 C GLY A 150 -24.305 23.147 2.935 1.00 0.00 C ATOM 2210 O GLY A 150 -23.262 23.526 2.402 1.00 0.00 O ATOM 0 H GLY A 150 -25.576 20.387 3.168 1.00 0.00 H new ATOM 0 HA2 GLY A 150 -25.184 22.405 1.131 1.00 0.00 H new ATOM 0 HA3 GLY A 150 -26.278 22.444 2.500 1.00 0.00 H new TER 2214 GLY A 150