USER MOD reduce.3.24.130724 H: found=0, std=0, add=664, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 662 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 55 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A3301 GLN : amide:sc= -0.589 K(o=-0.59,f=-5!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= -0.0264 X(o=-0.026,f=-0.25) USER MOD Single : A 4 ASN : amide:sc= -0.0577 X(o=-0.058,f=0) USER MOD Single : A 6 GLN : amide:sc= -0.148 X(o=-0.15,f=-0.64) USER MOD Single : A 7 THR OG1 : rot 123:sc= 1.28 USER MOD Single : A 10 LYS NZ :NH3+ -127:sc= -0.0943 (180deg=-1.35!) USER MOD Single : A 13 GLN : amide:sc= 0.642 K(o=0.64,f=-0.11) USER MOD Single : A 17 GLN : amide:sc= 0.308 X(o=0.31,f=0) USER MOD Single : A 18 LYS NZ :NH3+ 168:sc= -0.048 (180deg=-0.251) USER MOD Single : A 19 LYS NZ :NH3+ -162:sc= 0.114 (180deg=-0.0684) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 ASN : amide:sc= 0.598 K(o=0.6,f=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot -47:sc= 0.048 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0.201 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 48:sc= 0.0903 USER MOD Single : A 43 SER OG : rot 19:sc= 0.18 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot -1:sc= 1.09 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A3288 GLN :FLIP amide:sc= -0.0384 F(o=-0.58,f=-0.038) USER MOD Single : A3291 THR OG1 : rot 180:sc= 0 USER MOD Single : A3295 GLN : amide:sc= -0.0282 X(o=-0.028,f=-0.082) USER MOD Single : A3299 SER OG : rot 180:sc= 0 USER MOD Single : A3302 LYS NZ :NH3+ -149:sc= 1.12 (180deg=0.55) USER MOD Single : A3306 ASN : amide:sc= 0.0814 X(o=0.081,f=-0.31) USER MOD Single : A3308 SER OG : rot 180:sc= 0 USER MOD Single : A3315 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A3317 ASN : amide:sc= -0.077 X(o=-0.077,f=0) USER MOD Single : A3320 GLN : amide:sc= -0.492 X(o=-0.49,f=-0.19) USER MOD Single : A3321 GLN : amide:sc= 0.1 K(o=0.1,f=-2.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -21.223 10.778 0.683 1.00 0.00 N ATOM 2 CA MET A 1 -22.677 10.599 0.835 1.00 0.00 C ATOM 3 C MET A 1 -23.423 10.375 -0.490 1.00 0.00 C ATOM 4 O MET A 1 -24.464 9.719 -0.463 1.00 0.00 O ATOM 5 CB MET A 1 -23.282 11.769 1.625 1.00 0.00 C ATOM 6 CG MET A 1 -24.755 11.590 2.002 1.00 0.00 C ATOM 7 SD MET A 1 -25.107 10.171 3.069 1.00 0.00 S ATOM 8 CE MET A 1 -26.878 10.443 3.335 1.00 0.00 C ATOM 0 H1 MET A 1 -20.792 10.923 1.618 1.00 0.00 H new ATOM 0 H2 MET A 1 -20.813 9.931 0.241 1.00 0.00 H new ATOM 0 H3 MET A 1 -21.036 11.607 0.083 1.00 0.00 H new ATOM 0 HA MET A 1 -22.812 9.676 1.399 1.00 0.00 H new ATOM 0 HB2 MET A 1 -22.702 11.913 2.537 1.00 0.00 H new ATOM 0 HB3 MET A 1 -23.180 12.680 1.035 1.00 0.00 H new ATOM 0 HG2 MET A 1 -25.099 12.495 2.502 1.00 0.00 H new ATOM 0 HG3 MET A 1 -25.339 11.491 1.087 1.00 0.00 H new ATOM 0 HE1 MET A 1 -27.274 9.657 3.978 1.00 0.00 H new ATOM 0 HE2 MET A 1 -27.030 11.412 3.811 1.00 0.00 H new ATOM 0 HE3 MET A 1 -27.397 10.424 2.377 1.00 0.00 H new ATOM 18 N ASN A 2 -22.949 10.825 -1.664 1.00 0.00 N ATOM 19 CA ASN A 2 -23.692 10.651 -2.929 1.00 0.00 C ATOM 20 C ASN A 2 -22.798 10.152 -4.068 1.00 0.00 C ATOM 21 O ASN A 2 -22.914 10.625 -5.202 1.00 0.00 O ATOM 22 CB ASN A 2 -24.371 11.986 -3.309 1.00 0.00 C ATOM 23 CG ASN A 2 -25.264 12.558 -2.215 1.00 0.00 C ATOM 24 OD1 ASN A 2 -24.776 13.120 -1.238 1.00 0.00 O ATOM 25 ND2 ASN A 2 -26.572 12.447 -2.332 1.00 0.00 N ATOM 0 H ASN A 2 -22.058 11.311 -1.766 1.00 0.00 H new ATOM 0 HA ASN A 2 -24.450 9.883 -2.773 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -23.601 12.717 -3.555 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -24.967 11.836 -4.209 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -27.183 12.829 -1.610 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -26.973 11.980 -3.145 1.00 0.00 H new ATOM 32 N ILE A 3 -21.855 9.249 -3.779 1.00 0.00 N ATOM 33 CA ILE A 3 -20.932 8.716 -4.783 1.00 0.00 C ATOM 34 C ILE A 3 -20.249 7.442 -4.282 1.00 0.00 C ATOM 35 O ILE A 3 -20.198 7.191 -3.075 1.00 0.00 O ATOM 36 CB ILE A 3 -19.916 9.835 -5.124 1.00 0.00 C ATOM 37 CG1 ILE A 3 -19.005 9.391 -6.275 1.00 0.00 C ATOM 38 CG2 ILE A 3 -19.120 10.338 -3.902 1.00 0.00 C ATOM 39 CD1 ILE A 3 -18.487 10.560 -7.087 1.00 0.00 C ATOM 0 H ILE A 3 -21.711 8.868 -2.844 1.00 0.00 H new ATOM 0 HA ILE A 3 -21.469 8.427 -5.686 1.00 0.00 H new ATOM 0 HB ILE A 3 -20.490 10.701 -5.454 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -18.162 8.831 -5.871 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -19.554 8.713 -6.929 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -18.428 11.120 -4.215 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -19.809 10.739 -3.159 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -18.559 9.511 -3.467 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -17.847 10.191 -7.889 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -19.327 11.106 -7.515 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -17.913 11.225 -6.442 1.00 0.00 H new ATOM 51 N ASN A 4 -19.664 6.663 -5.195 1.00 0.00 N ATOM 52 CA ASN A 4 -18.946 5.428 -4.905 1.00 0.00 C ATOM 53 C ASN A 4 -17.474 5.577 -5.252 1.00 0.00 C ATOM 54 O ASN A 4 -16.669 5.336 -4.364 1.00 0.00 O ATOM 55 CB ASN A 4 -19.593 4.181 -5.525 1.00 0.00 C ATOM 56 CG ASN A 4 -19.877 4.343 -7.003 1.00 0.00 C ATOM 57 OD1 ASN A 4 -20.963 4.777 -7.358 1.00 0.00 O ATOM 58 ND2 ASN A 4 -18.924 4.098 -7.877 1.00 0.00 N ATOM 0 H ASN A 4 -19.680 6.886 -6.190 1.00 0.00 H new ATOM 0 HA ASN A 4 -19.017 5.256 -3.831 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -18.935 3.324 -5.377 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -20.524 3.962 -5.002 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -19.085 4.270 -8.869 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -18.024 3.736 -7.562 1.00 0.00 H new ATOM 65 N GLU A 5 -17.105 6.094 -6.429 1.00 0.00 N ATOM 66 CA GLU A 5 -15.697 6.250 -6.843 1.00 0.00 C ATOM 67 C GLU A 5 -14.913 7.121 -5.864 1.00 0.00 C ATOM 68 O GLU A 5 -13.792 6.815 -5.480 1.00 0.00 O ATOM 69 CB GLU A 5 -15.596 6.827 -8.262 1.00 0.00 C ATOM 70 CG GLU A 5 -15.896 5.734 -9.290 1.00 0.00 C ATOM 71 CD GLU A 5 -15.891 6.218 -10.737 1.00 0.00 C ATOM 72 OE1 GLU A 5 -15.019 7.032 -11.121 1.00 0.00 O ATOM 73 OE2 GLU A 5 -16.734 5.692 -11.503 1.00 0.00 O ATOM 0 H GLU A 5 -17.774 6.419 -7.128 1.00 0.00 H new ATOM 0 HA GLU A 5 -15.253 5.254 -6.840 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -16.299 7.652 -8.380 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -14.598 7.232 -8.429 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -15.159 4.938 -9.182 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -16.870 5.299 -9.067 1.00 0.00 H new ATOM 80 N GLN A 6 -15.526 8.214 -5.432 1.00 0.00 N ATOM 81 CA GLN A 6 -14.921 9.131 -4.477 1.00 0.00 C ATOM 82 C GLN A 6 -14.982 8.531 -3.074 1.00 0.00 C ATOM 83 O GLN A 6 -14.299 9.010 -2.177 1.00 0.00 O ATOM 84 CB GLN A 6 -15.529 10.532 -4.564 1.00 0.00 C ATOM 85 CG GLN A 6 -14.765 11.434 -5.537 1.00 0.00 C ATOM 86 CD GLN A 6 -15.197 11.301 -6.995 1.00 0.00 C ATOM 87 OE1 GLN A 6 -15.868 12.189 -7.524 1.00 0.00 O ATOM 88 NE2 GLN A 6 -14.803 10.262 -7.704 1.00 0.00 N ATOM 0 H GLN A 6 -16.460 8.490 -5.735 1.00 0.00 H new ATOM 0 HA GLN A 6 -13.869 9.263 -4.731 1.00 0.00 H new ATOM 0 HB2 GLN A 6 -16.569 10.456 -4.882 1.00 0.00 H new ATOM 0 HB3 GLN A 6 -15.531 10.988 -3.574 1.00 0.00 H new ATOM 0 HG2 GLN A 6 -14.892 12.471 -5.227 1.00 0.00 H new ATOM 0 HG3 GLN A 6 -13.701 11.207 -5.464 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -14.248 9.527 -7.266 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -15.053 10.193 -8.690 1.00 0.00 H new ATOM 97 N THR A 7 -15.939 7.648 -2.790 1.00 0.00 N ATOM 98 CA THR A 7 -15.997 7.021 -1.472 1.00 0.00 C ATOM 99 C THR A 7 -14.837 6.029 -1.327 1.00 0.00 C ATOM 100 O THR A 7 -14.331 5.896 -0.219 1.00 0.00 O ATOM 101 CB THR A 7 -17.329 6.309 -1.243 1.00 0.00 C ATOM 102 OG1 THR A 7 -18.383 7.254 -1.153 1.00 0.00 O ATOM 103 CG2 THR A 7 -17.311 5.480 0.035 1.00 0.00 C ATOM 0 H THR A 7 -16.669 7.356 -3.439 1.00 0.00 H new ATOM 0 HA THR A 7 -15.910 7.804 -0.719 1.00 0.00 H new ATOM 0 HB THR A 7 -17.488 5.645 -2.093 1.00 0.00 H new ATOM 0 HG1 THR A 7 -19.064 7.050 -1.827 1.00 0.00 H new ATOM 0 HG21 THR A 7 -18.275 4.989 0.164 1.00 0.00 H new ATOM 0 HG22 THR A 7 -16.526 4.727 -0.031 1.00 0.00 H new ATOM 0 HG23 THR A 7 -17.119 6.131 0.888 1.00 0.00 H new ATOM 111 N LEU A 8 -14.343 5.408 -2.406 1.00 0.00 N ATOM 112 CA LEU A 8 -13.246 4.439 -2.383 1.00 0.00 C ATOM 113 C LEU A 8 -12.080 5.086 -1.665 1.00 0.00 C ATOM 114 O LEU A 8 -11.380 4.374 -0.970 1.00 0.00 O ATOM 115 CB LEU A 8 -12.776 4.073 -3.803 1.00 0.00 C ATOM 116 CG LEU A 8 -13.896 3.694 -4.788 1.00 0.00 C ATOM 117 CD1 LEU A 8 -13.402 3.264 -6.160 1.00 0.00 C ATOM 118 CD2 LEU A 8 -14.788 2.600 -4.238 1.00 0.00 C ATOM 0 H LEU A 8 -14.708 5.572 -3.344 1.00 0.00 H new ATOM 0 HA LEU A 8 -13.593 3.532 -1.889 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -12.223 4.918 -4.214 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -12.078 3.239 -3.733 1.00 0.00 H new ATOM 0 HG LEU A 8 -14.461 4.618 -4.911 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -14.254 3.014 -6.792 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -12.839 4.078 -6.616 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -12.758 2.390 -6.058 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -15.565 2.364 -4.965 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -14.192 1.709 -4.041 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -15.250 2.939 -3.311 1.00 0.00 H new ATOM 130 N ASP A 9 -11.925 6.414 -1.742 1.00 0.00 N ATOM 131 CA ASP A 9 -10.854 7.179 -1.104 1.00 0.00 C ATOM 132 C ASP A 9 -10.796 6.824 0.377 1.00 0.00 C ATOM 133 O ASP A 9 -9.715 6.545 0.889 1.00 0.00 O ATOM 134 CB ASP A 9 -11.107 8.691 -1.177 1.00 0.00 C ATOM 135 CG ASP A 9 -10.630 9.410 -2.434 1.00 0.00 C ATOM 136 OD1 ASP A 9 -9.478 9.912 -2.453 1.00 0.00 O ATOM 137 OD2 ASP A 9 -11.444 9.571 -3.366 1.00 0.00 O ATOM 0 H ASP A 9 -12.568 7.004 -2.271 1.00 0.00 H new ATOM 0 HA ASP A 9 -9.931 6.933 -1.628 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -12.179 8.861 -1.075 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -10.627 9.157 -0.317 1.00 0.00 H new ATOM 142 N LYS A 10 -11.937 6.838 1.090 1.00 0.00 N ATOM 143 CA LYS A 10 -11.929 6.513 2.520 1.00 0.00 C ATOM 144 C LYS A 10 -11.550 5.054 2.755 1.00 0.00 C ATOM 145 O LYS A 10 -11.102 4.697 3.848 1.00 0.00 O ATOM 146 CB LYS A 10 -13.222 6.924 3.228 1.00 0.00 C ATOM 147 CG LYS A 10 -14.357 5.913 3.102 1.00 0.00 C ATOM 148 CD LYS A 10 -15.663 6.286 3.780 1.00 0.00 C ATOM 149 CE LYS A 10 -15.571 6.243 5.310 1.00 0.00 C ATOM 150 NZ LYS A 10 -15.027 7.487 5.907 1.00 0.00 N ATOM 0 H LYS A 10 -12.854 7.066 0.707 1.00 0.00 H new ATOM 0 HA LYS A 10 -11.149 7.117 2.984 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -13.009 7.083 4.285 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -13.556 7.879 2.823 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -14.555 5.750 2.043 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -14.017 4.962 3.513 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -15.957 7.288 3.466 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -16.447 5.605 3.448 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -16.564 6.057 5.720 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -14.942 5.403 5.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -14.231 7.252 6.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -14.697 8.120 5.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -15.771 7.963 6.456 1.00 0.00 H new ATOM 164 N LEU A 11 -11.849 4.181 1.798 1.00 0.00 N ATOM 165 CA LEU A 11 -11.523 2.775 1.884 1.00 0.00 C ATOM 166 C LEU A 11 -10.026 2.555 1.618 1.00 0.00 C ATOM 167 O LEU A 11 -9.327 2.005 2.462 1.00 0.00 O ATOM 168 CB LEU A 11 -12.381 1.949 0.909 1.00 0.00 C ATOM 169 CG LEU A 11 -13.872 1.750 1.225 1.00 0.00 C ATOM 170 CD1 LEU A 11 -14.195 1.381 2.670 1.00 0.00 C ATOM 171 CD2 LEU A 11 -14.731 2.947 0.854 1.00 0.00 C ATOM 0 H LEU A 11 -12.329 4.439 0.936 1.00 0.00 H new ATOM 0 HA LEU A 11 -11.747 2.434 2.895 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -12.311 2.418 -0.072 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -11.927 0.962 0.823 1.00 0.00 H new ATOM 0 HG LEU A 11 -14.116 0.894 0.595 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -15.273 1.264 2.784 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -13.700 0.444 2.926 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -13.844 2.170 3.334 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -15.772 2.739 1.103 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -14.393 3.823 1.408 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -14.646 3.139 -0.216 1.00 0.00 H new ATOM 183 N ARG A 12 -9.473 3.012 0.492 1.00 0.00 N ATOM 184 CA ARG A 12 -8.059 2.831 0.134 1.00 0.00 C ATOM 185 C ARG A 12 -7.146 3.419 1.188 1.00 0.00 C ATOM 186 O ARG A 12 -6.192 2.760 1.586 1.00 0.00 O ATOM 187 CB ARG A 12 -7.774 3.370 -1.276 1.00 0.00 C ATOM 188 CG ARG A 12 -8.230 4.817 -1.489 1.00 0.00 C ATOM 189 CD ARG A 12 -7.640 5.425 -2.737 1.00 0.00 C ATOM 190 NE ARG A 12 -7.599 6.885 -2.706 1.00 0.00 N ATOM 191 CZ ARG A 12 -6.795 7.628 -1.943 1.00 0.00 C ATOM 192 NH1 ARG A 12 -5.883 7.075 -1.147 1.00 0.00 N ATOM 193 NH2 ARG A 12 -6.902 8.941 -1.962 1.00 0.00 N ATOM 0 H ARG A 12 -10.002 3.528 -0.211 1.00 0.00 H new ATOM 0 HA ARG A 12 -7.844 1.763 0.107 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -6.704 3.304 -1.471 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -8.271 2.731 -2.006 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -9.318 4.847 -1.552 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -7.944 5.417 -0.625 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -6.629 5.043 -2.875 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -8.223 5.103 -3.600 1.00 0.00 H new ATOM 0 HE ARG A 12 -8.243 7.381 -3.323 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -5.786 6.060 -1.110 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -5.281 7.666 -0.574 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -7.598 9.387 -2.559 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -6.289 9.511 -1.380 1.00 0.00 H new ATOM 207 N GLN A 13 -7.468 4.604 1.702 1.00 0.00 N ATOM 208 CA GLN A 13 -6.675 5.260 2.731 1.00 0.00 C ATOM 209 C GLN A 13 -6.611 4.399 4.007 1.00 0.00 C ATOM 210 O GLN A 13 -5.660 4.491 4.782 1.00 0.00 O ATOM 211 CB GLN A 13 -7.153 6.697 2.973 1.00 0.00 C ATOM 212 CG GLN A 13 -8.541 6.802 3.602 1.00 0.00 C ATOM 213 CD GLN A 13 -8.585 6.796 5.126 1.00 0.00 C ATOM 214 OE1 GLN A 13 -8.044 7.658 5.810 1.00 0.00 O ATOM 215 NE2 GLN A 13 -9.289 5.839 5.699 1.00 0.00 N ATOM 0 H GLN A 13 -8.289 5.135 1.413 1.00 0.00 H new ATOM 0 HA GLN A 13 -5.647 5.352 2.379 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -6.435 7.202 3.619 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -7.157 7.231 2.023 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -9.010 7.720 3.248 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -9.147 5.973 3.237 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -9.738 5.124 5.127 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -9.385 5.814 6.714 1.00 0.00 H new ATOM 224 N ALA A 14 -7.657 3.612 4.288 1.00 0.00 N ATOM 225 CA ALA A 14 -7.708 2.736 5.452 1.00 0.00 C ATOM 226 C ALA A 14 -6.793 1.535 5.206 1.00 0.00 C ATOM 227 O ALA A 14 -5.981 1.184 6.060 1.00 0.00 O ATOM 228 CB ALA A 14 -9.144 2.257 5.684 1.00 0.00 C ATOM 0 H ALA A 14 -8.494 3.569 3.707 1.00 0.00 H new ATOM 0 HA ALA A 14 -7.375 3.280 6.336 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -9.173 1.603 6.556 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -9.791 3.117 5.854 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -9.491 1.709 4.808 1.00 0.00 H new ATOM 234 N VAL A 15 -6.924 0.914 4.032 1.00 0.00 N ATOM 235 CA VAL A 15 -6.124 -0.248 3.652 1.00 0.00 C ATOM 236 C VAL A 15 -4.634 0.137 3.648 1.00 0.00 C ATOM 237 O VAL A 15 -3.810 -0.481 4.325 1.00 0.00 O ATOM 238 CB VAL A 15 -6.611 -0.814 2.293 1.00 0.00 C ATOM 239 CG1 VAL A 15 -5.837 -2.072 1.871 1.00 0.00 C ATOM 240 CG2 VAL A 15 -8.114 -1.149 2.284 1.00 0.00 C ATOM 0 H VAL A 15 -7.591 1.205 3.317 1.00 0.00 H new ATOM 0 HA VAL A 15 -6.249 -1.049 4.381 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.422 -0.011 1.580 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -6.216 -2.428 0.913 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -4.778 -1.833 1.775 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -5.967 -2.849 2.625 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -8.394 -1.541 1.306 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -8.325 -1.897 3.048 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -8.689 -0.247 2.491 1.00 0.00 H new ATOM 250 N LEU A 16 -4.282 1.213 2.937 1.00 0.00 N ATOM 251 CA LEU A 16 -2.910 1.710 2.810 1.00 0.00 C ATOM 252 C LEU A 16 -2.249 1.989 4.154 1.00 0.00 C ATOM 253 O LEU A 16 -1.056 1.749 4.295 1.00 0.00 O ATOM 254 CB LEU A 16 -2.809 2.890 1.821 1.00 0.00 C ATOM 255 CG LEU A 16 -3.096 4.325 2.286 1.00 0.00 C ATOM 256 CD1 LEU A 16 -1.928 4.965 3.041 1.00 0.00 C ATOM 257 CD2 LEU A 16 -3.413 5.178 1.041 1.00 0.00 C ATOM 0 H LEU A 16 -4.960 1.775 2.422 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.327 0.899 2.373 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -1.799 2.881 1.412 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -3.489 2.677 0.996 1.00 0.00 H new ATOM 0 HG LEU A 16 -3.935 4.284 2.981 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -2.199 5.977 3.340 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -1.700 4.373 3.928 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -1.052 5.000 2.393 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -3.621 6.204 1.346 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -2.558 5.167 0.365 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -4.284 4.768 0.531 1.00 0.00 H new ATOM 269 N GLN A 17 -2.996 2.452 5.161 1.00 0.00 N ATOM 270 CA GLN A 17 -2.418 2.729 6.472 1.00 0.00 C ATOM 271 C GLN A 17 -1.783 1.468 7.051 1.00 0.00 C ATOM 272 O GLN A 17 -0.642 1.514 7.512 1.00 0.00 O ATOM 273 CB GLN A 17 -3.488 3.273 7.420 1.00 0.00 C ATOM 274 CG GLN A 17 -3.614 4.792 7.321 1.00 0.00 C ATOM 275 CD GLN A 17 -4.745 5.274 8.202 1.00 0.00 C ATOM 276 OE1 GLN A 17 -4.578 5.397 9.414 1.00 0.00 O ATOM 277 NE2 GLN A 17 -5.895 5.553 7.625 1.00 0.00 N ATOM 0 H GLN A 17 -3.996 2.641 5.091 1.00 0.00 H new ATOM 0 HA GLN A 17 -1.641 3.484 6.357 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -4.448 2.813 7.187 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -3.241 2.995 8.445 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -2.679 5.264 7.624 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -3.797 5.084 6.287 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -6.000 5.440 6.617 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -6.681 5.882 8.186 1.00 0.00 H new ATOM 286 N LYS A 18 -2.495 0.333 7.040 1.00 0.00 N ATOM 287 CA LYS A 18 -1.901 -0.883 7.588 1.00 0.00 C ATOM 288 C LYS A 18 -0.778 -1.393 6.696 1.00 0.00 C ATOM 289 O LYS A 18 0.187 -1.937 7.224 1.00 0.00 O ATOM 290 CB LYS A 18 -2.946 -1.940 7.920 1.00 0.00 C ATOM 291 CG LYS A 18 -3.454 -2.719 6.709 1.00 0.00 C ATOM 292 CD LYS A 18 -4.962 -2.690 6.520 1.00 0.00 C ATOM 293 CE LYS A 18 -5.687 -3.690 7.425 1.00 0.00 C ATOM 294 NZ LYS A 18 -5.630 -3.380 8.872 1.00 0.00 N ATOM 0 H LYS A 18 -3.442 0.235 6.674 1.00 0.00 H new ATOM 0 HA LYS A 18 -1.444 -0.630 8.545 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -2.521 -2.642 8.638 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -3.792 -1.457 8.409 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -2.982 -2.318 5.812 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -3.133 -3.757 6.801 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -5.331 -1.685 6.726 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -5.199 -2.910 5.479 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -6.732 -3.741 7.121 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -5.259 -4.680 7.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -6.306 -3.983 9.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -4.669 -3.559 9.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -5.875 -2.380 9.023 1.00 0.00 H new ATOM 308 N LYS A 19 -0.858 -1.193 5.374 1.00 0.00 N ATOM 309 CA LYS A 19 0.189 -1.641 4.459 1.00 0.00 C ATOM 310 C LYS A 19 1.544 -1.076 4.883 1.00 0.00 C ATOM 311 O LYS A 19 2.539 -1.785 4.746 1.00 0.00 O ATOM 312 CB LYS A 19 -0.117 -1.281 2.997 1.00 0.00 C ATOM 313 CG LYS A 19 -1.151 -2.196 2.311 1.00 0.00 C ATOM 314 CD LYS A 19 -0.917 -2.243 0.792 1.00 0.00 C ATOM 315 CE LYS A 19 -1.851 -3.231 0.080 1.00 0.00 C ATOM 316 NZ LYS A 19 -1.331 -3.646 -1.245 1.00 0.00 N ATOM 0 H LYS A 19 -1.640 -0.723 4.918 1.00 0.00 H new ATOM 0 HA LYS A 19 0.224 -2.729 4.516 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -0.479 -0.254 2.958 1.00 0.00 H new ATOM 0 HB3 LYS A 19 0.812 -1.314 2.427 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -1.084 -3.202 2.725 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -2.158 -1.833 2.517 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -1.063 -1.247 0.375 1.00 0.00 H new ATOM 0 HD3 LYS A 19 0.118 -2.522 0.596 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -1.988 -4.113 0.706 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -2.832 -2.773 -0.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -2.104 -4.053 -1.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -0.940 -2.819 -1.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -0.584 -4.358 -1.117 1.00 0.00 H new ATOM 330 N ILE A 20 1.613 0.127 5.474 1.00 0.00 N ATOM 331 CA ILE A 20 2.895 0.692 5.907 1.00 0.00 C ATOM 332 C ILE A 20 3.510 -0.208 6.993 1.00 0.00 C ATOM 333 O ILE A 20 4.724 -0.410 7.016 1.00 0.00 O ATOM 334 CB ILE A 20 2.776 2.162 6.384 1.00 0.00 C ATOM 335 CG1 ILE A 20 1.820 3.042 5.551 1.00 0.00 C ATOM 336 CG2 ILE A 20 4.174 2.810 6.404 1.00 0.00 C ATOM 337 CD1 ILE A 20 2.150 3.102 4.057 1.00 0.00 C ATOM 0 H ILE A 20 0.804 0.720 5.660 1.00 0.00 H new ATOM 0 HA ILE A 20 3.559 0.718 5.043 1.00 0.00 H new ATOM 0 HB ILE A 20 2.340 2.111 7.382 1.00 0.00 H new ATOM 0 HG12 ILE A 20 0.804 2.666 5.671 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.835 4.055 5.954 1.00 0.00 H new ATOM 0 HG21 ILE A 20 4.091 3.844 6.739 1.00 0.00 H new ATOM 0 HG22 ILE A 20 4.821 2.258 7.086 1.00 0.00 H new ATOM 0 HG23 ILE A 20 4.600 2.787 5.401 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.428 3.742 3.550 1.00 0.00 H new ATOM 0 HD12 ILE A 20 3.152 3.508 3.922 1.00 0.00 H new ATOM 0 HD13 ILE A 20 2.105 2.098 3.634 1.00 0.00 H new ATOM 349 N LYS A 21 2.677 -0.762 7.881 1.00 0.00 N ATOM 350 CA LYS A 21 3.069 -1.659 8.970 1.00 0.00 C ATOM 351 C LYS A 21 3.456 -3.031 8.418 1.00 0.00 C ATOM 352 O LYS A 21 4.275 -3.743 8.990 1.00 0.00 O ATOM 353 CB LYS A 21 1.897 -1.873 9.939 1.00 0.00 C ATOM 354 CG LYS A 21 1.232 -0.555 10.360 1.00 0.00 C ATOM 355 CD LYS A 21 0.463 -0.672 11.675 1.00 0.00 C ATOM 356 CE LYS A 21 -0.845 -1.454 11.591 1.00 0.00 C ATOM 357 NZ LYS A 21 -1.592 -1.311 12.859 1.00 0.00 N ATOM 0 H LYS A 21 1.672 -0.590 7.858 1.00 0.00 H new ATOM 0 HA LYS A 21 3.913 -1.199 9.484 1.00 0.00 H new ATOM 0 HB2 LYS A 21 1.154 -2.517 9.468 1.00 0.00 H new ATOM 0 HB3 LYS A 21 2.255 -2.395 10.826 1.00 0.00 H new ATOM 0 HG2 LYS A 21 1.996 0.216 10.459 1.00 0.00 H new ATOM 0 HG3 LYS A 21 0.551 -0.230 9.574 1.00 0.00 H new ATOM 0 HD2 LYS A 21 1.107 -1.149 12.414 1.00 0.00 H new ATOM 0 HD3 LYS A 21 0.246 0.331 12.042 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -1.447 -1.087 10.760 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -0.639 -2.506 11.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -2.483 -1.845 12.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -1.018 -1.681 13.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -1.801 -0.306 13.027 1.00 0.00 H new ATOM 371 N GLU A 22 2.863 -3.427 7.294 1.00 0.00 N ATOM 372 CA GLU A 22 3.140 -4.712 6.678 1.00 0.00 C ATOM 373 C GLU A 22 4.508 -4.651 6.021 1.00 0.00 C ATOM 374 O GLU A 22 5.352 -5.491 6.318 1.00 0.00 O ATOM 375 CB GLU A 22 2.034 -5.076 5.678 1.00 0.00 C ATOM 376 CG GLU A 22 0.719 -5.312 6.428 1.00 0.00 C ATOM 377 CD GLU A 22 -0.498 -5.570 5.540 1.00 0.00 C ATOM 378 OE1 GLU A 22 -1.518 -6.078 6.077 1.00 0.00 O ATOM 379 OE2 GLU A 22 -0.509 -5.183 4.349 1.00 0.00 O ATOM 0 H GLU A 22 2.179 -2.863 6.789 1.00 0.00 H new ATOM 0 HA GLU A 22 3.152 -5.499 7.432 1.00 0.00 H new ATOM 0 HB2 GLU A 22 1.910 -4.274 4.950 1.00 0.00 H new ATOM 0 HB3 GLU A 22 2.313 -5.971 5.122 1.00 0.00 H new ATOM 0 HG2 GLU A 22 0.848 -6.163 7.097 1.00 0.00 H new ATOM 0 HG3 GLU A 22 0.515 -4.443 7.054 1.00 0.00 H new ATOM 386 N ARG A 23 4.781 -3.626 5.211 1.00 0.00 N ATOM 387 CA ARG A 23 6.076 -3.484 4.544 1.00 0.00 C ATOM 388 C ARG A 23 7.209 -3.257 5.543 1.00 0.00 C ATOM 389 O ARG A 23 8.327 -3.667 5.259 1.00 0.00 O ATOM 390 CB ARG A 23 6.014 -2.445 3.412 1.00 0.00 C ATOM 391 CG ARG A 23 5.533 -1.047 3.824 1.00 0.00 C ATOM 392 CD ARG A 23 6.679 -0.090 4.127 1.00 0.00 C ATOM 393 NE ARG A 23 7.345 0.254 2.866 1.00 0.00 N ATOM 394 CZ ARG A 23 8.635 0.182 2.539 1.00 0.00 C ATOM 395 NH1 ARG A 23 9.595 -0.081 3.414 1.00 0.00 N ATOM 396 NH2 ARG A 23 8.972 0.394 1.283 1.00 0.00 N ATOM 0 H ARG A 23 4.119 -2.879 5.001 1.00 0.00 H new ATOM 0 HA ARG A 23 6.315 -4.430 4.058 1.00 0.00 H new ATOM 0 HB2 ARG A 23 7.007 -2.353 2.972 1.00 0.00 H new ATOM 0 HB3 ARG A 23 5.353 -2.822 2.632 1.00 0.00 H new ATOM 0 HG2 ARG A 23 4.920 -0.630 3.026 1.00 0.00 H new ATOM 0 HG3 ARG A 23 4.896 -1.133 4.704 1.00 0.00 H new ATOM 0 HD2 ARG A 23 6.302 0.810 4.614 1.00 0.00 H new ATOM 0 HD3 ARG A 23 7.387 -0.552 4.815 1.00 0.00 H new ATOM 0 HE ARG A 23 6.729 0.600 2.130 1.00 0.00 H new ATOM 0 HH11 ARG A 23 9.362 -0.240 4.394 1.00 0.00 H new ATOM 0 HH12 ARG A 23 10.567 -0.124 3.107 1.00 0.00 H new ATOM 0 HH21 ARG A 23 8.253 0.606 0.591 1.00 0.00 H new ATOM 0 HH22 ARG A 23 9.952 0.346 1.003 1.00 0.00 H new ATOM 410 N ILE A 24 6.972 -2.618 6.693 1.00 0.00 N ATOM 411 CA ILE A 24 8.036 -2.419 7.682 1.00 0.00 C ATOM 412 C ILE A 24 8.286 -3.726 8.446 1.00 0.00 C ATOM 413 O ILE A 24 9.444 -4.088 8.648 1.00 0.00 O ATOM 414 CB ILE A 24 7.735 -1.233 8.633 1.00 0.00 C ATOM 415 CG1 ILE A 24 8.910 -0.919 9.586 1.00 0.00 C ATOM 416 CG2 ILE A 24 6.460 -1.477 9.435 1.00 0.00 C ATOM 417 CD1 ILE A 24 8.531 0.003 10.750 1.00 0.00 C ATOM 0 H ILE A 24 6.065 -2.234 6.960 1.00 0.00 H new ATOM 0 HA ILE A 24 8.951 -2.150 7.154 1.00 0.00 H new ATOM 0 HB ILE A 24 7.591 -0.361 7.995 1.00 0.00 H new ATOM 0 HG12 ILE A 24 9.300 -1.854 9.987 1.00 0.00 H new ATOM 0 HG13 ILE A 24 9.715 -0.456 9.015 1.00 0.00 H new ATOM 0 HG21 ILE A 24 6.276 -0.628 10.093 1.00 0.00 H new ATOM 0 HG22 ILE A 24 5.618 -1.597 8.753 1.00 0.00 H new ATOM 0 HG23 ILE A 24 6.574 -2.381 10.033 1.00 0.00 H new ATOM 0 HD11 ILE A 24 9.406 0.178 11.375 1.00 0.00 H new ATOM 0 HD12 ILE A 24 8.169 0.954 10.358 1.00 0.00 H new ATOM 0 HD13 ILE A 24 7.748 -0.466 11.345 1.00 0.00 H new ATOM 429 N GLN A 25 7.235 -4.448 8.862 1.00 0.00 N ATOM 430 CA GLN A 25 7.419 -5.676 9.627 1.00 0.00 C ATOM 431 C GLN A 25 7.866 -6.857 8.774 1.00 0.00 C ATOM 432 O GLN A 25 8.821 -7.545 9.120 1.00 0.00 O ATOM 433 CB GLN A 25 6.082 -6.017 10.305 1.00 0.00 C ATOM 434 CG GLN A 25 6.211 -7.125 11.351 1.00 0.00 C ATOM 435 CD GLN A 25 4.822 -7.641 11.701 1.00 0.00 C ATOM 436 OE1 GLN A 25 3.891 -6.887 11.983 1.00 0.00 O ATOM 437 NE2 GLN A 25 4.589 -8.931 11.618 1.00 0.00 N ATOM 0 H GLN A 25 6.262 -4.201 8.681 1.00 0.00 H new ATOM 0 HA GLN A 25 8.212 -5.501 10.354 1.00 0.00 H new ATOM 0 HB2 GLN A 25 5.682 -5.121 10.780 1.00 0.00 H new ATOM 0 HB3 GLN A 25 5.363 -6.323 9.545 1.00 0.00 H new ATOM 0 HG2 GLN A 25 6.828 -7.937 10.965 1.00 0.00 H new ATOM 0 HG3 GLN A 25 6.707 -6.744 12.244 1.00 0.00 H new ATOM 0 HE21 GLN A 25 5.347 -9.572 11.385 1.00 0.00 H new ATOM 0 HE22 GLN A 25 3.650 -9.291 11.786 1.00 0.00 H new ATOM 446 N ASN A 26 7.178 -7.090 7.658 1.00 0.00 N ATOM 447 CA ASN A 26 7.487 -8.196 6.770 1.00 0.00 C ATOM 448 C ASN A 26 8.691 -7.846 5.910 1.00 0.00 C ATOM 449 O ASN A 26 9.666 -8.588 5.866 1.00 0.00 O ATOM 450 CB ASN A 26 6.266 -8.528 5.882 1.00 0.00 C ATOM 451 CG ASN A 26 5.054 -8.989 6.678 1.00 0.00 C ATOM 452 OD1 ASN A 26 4.800 -10.184 6.775 1.00 0.00 O ATOM 453 ND2 ASN A 26 4.280 -8.061 7.220 1.00 0.00 N ATOM 0 H ASN A 26 6.394 -6.516 7.349 1.00 0.00 H new ATOM 0 HA ASN A 26 7.726 -9.076 7.368 1.00 0.00 H new ATOM 0 HB2 ASN A 26 5.997 -7.646 5.301 1.00 0.00 H new ATOM 0 HB3 ASN A 26 6.543 -9.306 5.171 1.00 0.00 H new ATOM 0 HD21 ASN A 26 3.444 -8.333 7.737 1.00 0.00 H new ATOM 0 HD22 ASN A 26 4.520 -7.075 7.121 1.00 0.00 H new ATOM 460 N SER A 27 8.647 -6.688 5.243 1.00 0.00 N ATOM 461 CA SER A 27 9.686 -6.186 4.343 1.00 0.00 C ATOM 462 C SER A 27 10.109 -7.227 3.285 1.00 0.00 C ATOM 463 O SER A 27 11.192 -7.137 2.703 1.00 0.00 O ATOM 464 CB SER A 27 10.854 -5.615 5.172 1.00 0.00 C ATOM 465 OG SER A 27 11.461 -4.506 4.523 1.00 0.00 O ATOM 0 H SER A 27 7.854 -6.051 5.320 1.00 0.00 H new ATOM 0 HA SER A 27 9.279 -5.366 3.751 1.00 0.00 H new ATOM 0 HB2 SER A 27 10.490 -5.309 6.153 1.00 0.00 H new ATOM 0 HB3 SER A 27 11.599 -6.393 5.337 1.00 0.00 H new ATOM 0 HG SER A 27 12.196 -4.166 5.075 1.00 0.00 H new ATOM 471 N LEU A 28 9.244 -8.193 2.970 1.00 0.00 N ATOM 472 CA LEU A 28 9.446 -9.296 2.035 1.00 0.00 C ATOM 473 C LEU A 28 8.238 -9.475 1.121 1.00 0.00 C ATOM 474 O LEU A 28 7.275 -8.708 1.184 1.00 0.00 O ATOM 475 CB LEU A 28 9.719 -10.574 2.868 1.00 0.00 C ATOM 476 CG LEU A 28 8.636 -10.955 3.903 1.00 0.00 C ATOM 477 CD1 LEU A 28 7.354 -11.522 3.310 1.00 0.00 C ATOM 478 CD2 LEU A 28 9.177 -11.943 4.926 1.00 0.00 C ATOM 0 H LEU A 28 8.317 -8.225 3.394 1.00 0.00 H new ATOM 0 HA LEU A 28 10.295 -9.086 1.384 1.00 0.00 H new ATOM 0 HB2 LEU A 28 9.847 -11.411 2.181 1.00 0.00 H new ATOM 0 HB3 LEU A 28 10.665 -10.446 3.393 1.00 0.00 H new ATOM 0 HG LEU A 28 8.375 -10.008 4.375 1.00 0.00 H new ATOM 0 HD11 LEU A 28 6.656 -11.759 4.113 1.00 0.00 H new ATOM 0 HD12 LEU A 28 6.905 -10.786 2.644 1.00 0.00 H new ATOM 0 HD13 LEU A 28 7.582 -12.428 2.748 1.00 0.00 H new ATOM 0 HD21 LEU A 28 8.393 -12.192 5.641 1.00 0.00 H new ATOM 0 HD22 LEU A 28 9.506 -12.849 4.418 1.00 0.00 H new ATOM 0 HD23 LEU A 28 10.020 -11.496 5.453 1.00 0.00 H new ATOM 490 N SER A 29 8.292 -10.532 0.316 1.00 0.00 N ATOM 491 CA SER A 29 7.262 -10.948 -0.621 1.00 0.00 C ATOM 492 C SER A 29 6.921 -12.421 -0.431 1.00 0.00 C ATOM 493 O SER A 29 5.750 -12.796 -0.483 1.00 0.00 O ATOM 494 CB SER A 29 7.772 -10.778 -2.050 1.00 0.00 C ATOM 495 OG SER A 29 7.722 -9.421 -2.448 1.00 0.00 O ATOM 0 H SER A 29 9.101 -11.153 0.302 1.00 0.00 H new ATOM 0 HA SER A 29 6.379 -10.335 -0.441 1.00 0.00 H new ATOM 0 HB2 SER A 29 8.796 -11.144 -2.120 1.00 0.00 H new ATOM 0 HB3 SER A 29 7.170 -11.382 -2.729 1.00 0.00 H new ATOM 0 HG SER A 29 8.055 -9.337 -3.366 1.00 0.00 H new ATOM 501 N THR A 30 7.934 -13.258 -0.202 1.00 0.00 N ATOM 502 CA THR A 30 7.766 -14.695 -0.040 1.00 0.00 C ATOM 503 C THR A 30 8.908 -15.265 0.817 1.00 0.00 C ATOM 504 O THR A 30 9.392 -16.361 0.557 1.00 0.00 O ATOM 505 CB THR A 30 7.626 -15.282 -1.469 1.00 0.00 C ATOM 506 OG1 THR A 30 7.264 -16.644 -1.514 1.00 0.00 O ATOM 507 CG2 THR A 30 8.912 -15.109 -2.284 1.00 0.00 C ATOM 0 H THR A 30 8.903 -12.950 -0.124 1.00 0.00 H new ATOM 0 HA THR A 30 6.870 -14.973 0.514 1.00 0.00 H new ATOM 0 HB THR A 30 6.809 -14.706 -1.903 1.00 0.00 H new ATOM 0 HG1 THR A 30 7.820 -17.151 -0.886 1.00 0.00 H new ATOM 0 HG21 THR A 30 8.772 -15.533 -3.278 1.00 0.00 H new ATOM 0 HG22 THR A 30 9.147 -14.048 -2.372 1.00 0.00 H new ATOM 0 HG23 THR A 30 9.732 -15.622 -1.782 1.00 0.00 H new ATOM 515 N GLU A 31 9.406 -14.500 1.799 1.00 0.00 N ATOM 516 CA GLU A 31 10.480 -14.954 2.699 1.00 0.00 C ATOM 517 C GLU A 31 11.761 -15.332 1.929 1.00 0.00 C ATOM 518 O GLU A 31 12.500 -16.234 2.337 1.00 0.00 O ATOM 519 CB GLU A 31 9.957 -16.119 3.578 1.00 0.00 C ATOM 520 CG GLU A 31 8.550 -15.904 4.178 1.00 0.00 C ATOM 521 CD GLU A 31 8.040 -17.101 4.987 1.00 0.00 C ATOM 522 OE1 GLU A 31 7.155 -16.897 5.850 1.00 0.00 O ATOM 523 OE2 GLU A 31 8.535 -18.243 4.808 1.00 0.00 O ATOM 0 H GLU A 31 9.079 -13.554 1.993 1.00 0.00 H new ATOM 0 HA GLU A 31 10.763 -14.128 3.351 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.945 -17.029 2.978 1.00 0.00 H new ATOM 0 HB3 GLU A 31 10.662 -16.284 4.393 1.00 0.00 H new ATOM 0 HG2 GLU A 31 8.568 -15.023 4.820 1.00 0.00 H new ATOM 0 HG3 GLU A 31 7.848 -15.696 3.371 1.00 0.00 H new ATOM 530 N LYS A 32 12.013 -14.655 0.800 1.00 0.00 N ATOM 531 CA LYS A 32 13.158 -14.888 -0.078 1.00 0.00 C ATOM 532 C LYS A 32 14.495 -14.912 0.663 1.00 0.00 C ATOM 533 O LYS A 32 14.720 -14.077 1.539 1.00 0.00 O ATOM 534 CB LYS A 32 13.192 -13.784 -1.150 1.00 0.00 C ATOM 535 CG LYS A 32 13.467 -14.299 -2.569 1.00 0.00 C ATOM 536 CD LYS A 32 12.202 -14.442 -3.419 1.00 0.00 C ATOM 537 CE LYS A 32 11.527 -13.100 -3.736 1.00 0.00 C ATOM 538 NZ LYS A 32 12.310 -12.287 -4.684 1.00 0.00 N ATOM 0 H LYS A 32 11.404 -13.908 0.466 1.00 0.00 H new ATOM 0 HA LYS A 32 13.028 -15.874 -0.524 1.00 0.00 H new ATOM 0 HB2 LYS A 32 12.238 -13.257 -1.144 1.00 0.00 H new ATOM 0 HB3 LYS A 32 13.959 -13.057 -0.884 1.00 0.00 H new ATOM 0 HG2 LYS A 32 14.156 -13.617 -3.068 1.00 0.00 H new ATOM 0 HG3 LYS A 32 13.965 -15.266 -2.506 1.00 0.00 H new ATOM 0 HD2 LYS A 32 12.455 -14.943 -4.353 1.00 0.00 H new ATOM 0 HD3 LYS A 32 11.492 -15.083 -2.896 1.00 0.00 H new ATOM 0 HE2 LYS A 32 10.536 -13.284 -4.151 1.00 0.00 H new ATOM 0 HE3 LYS A 32 11.386 -12.540 -2.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 11.813 -11.392 -4.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 13.247 -12.087 -4.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 12.423 -12.808 -5.577 1.00 0.00 H new ATOM 552 N TYR A 33 15.409 -15.800 0.257 1.00 0.00 N ATOM 553 CA TYR A 33 16.736 -15.904 0.867 1.00 0.00 C ATOM 554 C TYR A 33 17.464 -14.568 0.753 1.00 0.00 C ATOM 555 O TYR A 33 18.062 -14.101 1.725 1.00 0.00 O ATOM 556 CB TYR A 33 17.595 -16.960 0.160 1.00 0.00 C ATOM 557 CG TYR A 33 17.288 -18.395 0.510 1.00 0.00 C ATOM 558 CD1 TYR A 33 18.034 -19.032 1.519 1.00 0.00 C ATOM 559 CD2 TYR A 33 16.312 -19.112 -0.207 1.00 0.00 C ATOM 560 CE1 TYR A 33 17.826 -20.392 1.792 1.00 0.00 C ATOM 561 CE2 TYR A 33 16.066 -20.460 0.101 1.00 0.00 C ATOM 562 CZ TYR A 33 16.820 -21.104 1.106 1.00 0.00 C ATOM 563 OH TYR A 33 16.623 -22.420 1.383 1.00 0.00 O ATOM 0 H TYR A 33 15.249 -16.464 -0.501 1.00 0.00 H new ATOM 0 HA TYR A 33 16.593 -16.187 1.910 1.00 0.00 H new ATOM 0 HB2 TYR A 33 17.478 -16.835 -0.917 1.00 0.00 H new ATOM 0 HB3 TYR A 33 18.642 -16.765 0.392 1.00 0.00 H new ATOM 0 HD1 TYR A 33 18.767 -18.474 2.083 1.00 0.00 H new ATOM 0 HD2 TYR A 33 15.753 -18.626 -0.993 1.00 0.00 H new ATOM 0 HE1 TYR A 33 18.436 -20.894 2.528 1.00 0.00 H new ATOM 0 HE2 TYR A 33 15.300 -21.004 -0.431 1.00 0.00 H new ATOM 0 HH TYR A 33 15.893 -22.766 0.827 1.00 0.00 H new ATOM 573 N GLY A 34 17.365 -13.932 -0.417 1.00 0.00 N ATOM 574 CA GLY A 34 18.014 -12.664 -0.674 1.00 0.00 C ATOM 575 C GLY A 34 19.500 -12.904 -0.927 1.00 0.00 C ATOM 576 O GLY A 34 19.903 -13.979 -1.387 1.00 0.00 O ATOM 0 H GLY A 34 16.830 -14.290 -1.208 1.00 0.00 H new ATOM 0 HA2 GLY A 34 17.560 -12.178 -1.537 1.00 0.00 H new ATOM 0 HA3 GLY A 34 17.881 -11.995 0.176 1.00 0.00 H new ATOM 580 N SER A 35 20.326 -11.895 -0.679 1.00 0.00 N ATOM 581 CA SER A 35 21.767 -11.943 -0.868 1.00 0.00 C ATOM 582 C SER A 35 22.448 -10.992 0.116 1.00 0.00 C ATOM 583 O SER A 35 21.803 -10.472 1.029 1.00 0.00 O ATOM 584 CB SER A 35 22.078 -11.611 -2.334 1.00 0.00 C ATOM 585 OG SER A 35 21.501 -10.373 -2.717 1.00 0.00 O ATOM 0 H SER A 35 19.999 -10.994 -0.330 1.00 0.00 H new ATOM 0 HA SER A 35 22.159 -12.939 -0.661 1.00 0.00 H new ATOM 0 HB2 SER A 35 23.158 -11.571 -2.479 1.00 0.00 H new ATOM 0 HB3 SER A 35 21.699 -12.405 -2.977 1.00 0.00 H new ATOM 0 HG SER A 35 21.717 -10.187 -3.655 1.00 0.00 H new ATOM 591 N GLY A 36 23.752 -10.794 -0.050 1.00 0.00 N ATOM 592 CA GLY A 36 24.595 -9.928 0.750 1.00 0.00 C ATOM 593 C GLY A 36 25.782 -9.474 -0.096 1.00 0.00 C ATOM 594 O GLY A 36 25.827 -9.729 -1.309 1.00 0.00 O ATOM 0 H GLY A 36 24.273 -11.263 -0.791 1.00 0.00 H new ATOM 0 HA2 GLY A 36 24.027 -9.065 1.097 1.00 0.00 H new ATOM 0 HA3 GLY A 36 24.944 -10.457 1.637 1.00 0.00 H new ATOM 598 N SER A 37 26.716 -8.767 0.533 1.00 0.00 N ATOM 599 CA SER A 37 27.927 -8.256 -0.092 1.00 0.00 C ATOM 600 C SER A 37 29.094 -8.379 0.900 1.00 0.00 C ATOM 601 O SER A 37 28.975 -9.037 1.938 1.00 0.00 O ATOM 602 CB SER A 37 27.694 -6.824 -0.602 1.00 0.00 C ATOM 603 OG SER A 37 28.714 -6.484 -1.521 1.00 0.00 O ATOM 0 H SER A 37 26.647 -8.528 1.522 1.00 0.00 H new ATOM 0 HA SER A 37 28.191 -8.846 -0.969 1.00 0.00 H new ATOM 0 HB2 SER A 37 26.718 -6.750 -1.081 1.00 0.00 H new ATOM 0 HB3 SER A 37 27.693 -6.124 0.233 1.00 0.00 H new ATOM 0 HG SER A 37 28.568 -5.572 -1.850 1.00 0.00 H new ATOM 609 N GLY A 38 30.224 -7.765 0.558 1.00 0.00 N ATOM 610 CA GLY A 38 31.471 -7.742 1.316 1.00 0.00 C ATOM 611 C GLY A 38 32.685 -7.916 0.399 1.00 0.00 C ATOM 612 O GLY A 38 33.820 -7.884 0.866 1.00 0.00 O ATOM 0 H GLY A 38 30.297 -7.237 -0.312 1.00 0.00 H new ATOM 0 HA2 GLY A 38 31.553 -6.799 1.856 1.00 0.00 H new ATOM 0 HA3 GLY A 38 31.460 -8.536 2.062 1.00 0.00 H new ATOM 616 N SER A 39 32.459 -8.097 -0.902 1.00 0.00 N ATOM 617 CA SER A 39 33.461 -8.284 -1.936 1.00 0.00 C ATOM 618 C SER A 39 32.958 -7.585 -3.211 1.00 0.00 C ATOM 619 O SER A 39 32.043 -6.757 -3.149 1.00 0.00 O ATOM 620 CB SER A 39 33.712 -9.795 -2.090 1.00 0.00 C ATOM 621 OG SER A 39 32.496 -10.507 -2.234 1.00 0.00 O ATOM 0 H SER A 39 31.511 -8.117 -1.279 1.00 0.00 H new ATOM 0 HA SER A 39 34.424 -7.835 -1.692 1.00 0.00 H new ATOM 0 HB2 SER A 39 34.346 -9.974 -2.959 1.00 0.00 H new ATOM 0 HB3 SER A 39 34.252 -10.167 -1.219 1.00 0.00 H new ATOM 0 HG SER A 39 32.686 -11.463 -2.332 1.00 0.00 H new ATOM 627 N GLY A 40 33.603 -7.828 -4.356 1.00 0.00 N ATOM 628 CA GLY A 40 33.216 -7.243 -5.635 1.00 0.00 C ATOM 629 C GLY A 40 31.984 -7.950 -6.209 1.00 0.00 C ATOM 630 O GLY A 40 31.334 -8.737 -5.522 1.00 0.00 O ATOM 0 H GLY A 40 34.415 -8.442 -4.417 1.00 0.00 H new ATOM 0 HA2 GLY A 40 33.004 -6.182 -5.505 1.00 0.00 H new ATOM 0 HA3 GLY A 40 34.044 -7.318 -6.339 1.00 0.00 H new ATOM 634 N SER A 41 31.686 -7.685 -7.485 1.00 0.00 N ATOM 635 CA SER A 41 30.563 -8.253 -8.237 1.00 0.00 C ATOM 636 C SER A 41 29.216 -8.115 -7.511 1.00 0.00 C ATOM 637 O SER A 41 28.714 -9.066 -6.908 1.00 0.00 O ATOM 638 CB SER A 41 30.876 -9.690 -8.708 1.00 0.00 C ATOM 639 OG SER A 41 31.586 -10.446 -7.743 1.00 0.00 O ATOM 0 H SER A 41 32.245 -7.041 -8.046 1.00 0.00 H new ATOM 0 HA SER A 41 30.441 -7.653 -9.138 1.00 0.00 H new ATOM 0 HB2 SER A 41 29.943 -10.200 -8.946 1.00 0.00 H new ATOM 0 HB3 SER A 41 31.459 -9.646 -9.628 1.00 0.00 H new ATOM 0 HG SER A 41 31.155 -10.347 -6.868 1.00 0.00 H new ATOM 645 N GLY A 42 28.656 -6.902 -7.524 1.00 0.00 N ATOM 646 CA GLY A 42 27.366 -6.629 -6.906 1.00 0.00 C ATOM 647 C GLY A 42 26.263 -7.190 -7.804 1.00 0.00 C ATOM 648 O GLY A 42 26.483 -7.420 -9.000 1.00 0.00 O ATOM 0 H GLY A 42 29.086 -6.088 -7.963 1.00 0.00 H new ATOM 0 HA2 GLY A 42 27.317 -7.085 -5.917 1.00 0.00 H new ATOM 0 HA3 GLY A 42 27.232 -5.556 -6.769 1.00 0.00 H new ATOM 652 N SER A 43 25.077 -7.403 -7.238 1.00 0.00 N ATOM 653 CA SER A 43 23.926 -7.934 -7.948 1.00 0.00 C ATOM 654 C SER A 43 22.642 -7.380 -7.337 1.00 0.00 C ATOM 655 O SER A 43 22.588 -7.119 -6.131 1.00 0.00 O ATOM 656 CB SER A 43 23.969 -9.465 -7.852 1.00 0.00 C ATOM 657 OG SER A 43 24.788 -9.979 -8.882 1.00 0.00 O ATOM 0 H SER A 43 24.890 -7.206 -6.255 1.00 0.00 H new ATOM 0 HA SER A 43 23.949 -7.637 -8.997 1.00 0.00 H new ATOM 0 HB2 SER A 43 24.356 -9.768 -6.879 1.00 0.00 H new ATOM 0 HB3 SER A 43 22.962 -9.874 -7.936 1.00 0.00 H new ATOM 0 HG SER A 43 25.367 -9.267 -9.226 1.00 0.00 H new ATOM 663 N GLY A 44 21.602 -7.246 -8.159 1.00 0.00 N ATOM 664 CA GLY A 44 20.295 -6.745 -7.767 1.00 0.00 C ATOM 665 C GLY A 44 19.419 -6.493 -8.988 1.00 0.00 C ATOM 666 O GLY A 44 19.925 -6.316 -10.102 1.00 0.00 O ATOM 0 H GLY A 44 21.653 -7.493 -9.147 1.00 0.00 H new ATOM 0 HA2 GLY A 44 19.808 -7.464 -7.108 1.00 0.00 H new ATOM 0 HA3 GLY A 44 20.411 -5.821 -7.201 1.00 0.00 H new ATOM 670 N SER A 45 18.106 -6.477 -8.768 1.00 0.00 N ATOM 671 CA SER A 45 17.059 -6.249 -9.755 1.00 0.00 C ATOM 672 C SER A 45 15.849 -5.650 -9.027 1.00 0.00 C ATOM 673 O SER A 45 15.735 -5.785 -7.802 1.00 0.00 O ATOM 674 CB SER A 45 16.640 -7.582 -10.393 1.00 0.00 C ATOM 675 OG SER A 45 17.699 -8.246 -11.065 1.00 0.00 O ATOM 0 H SER A 45 17.723 -6.633 -7.835 1.00 0.00 H new ATOM 0 HA SER A 45 17.422 -5.579 -10.534 1.00 0.00 H new ATOM 0 HB2 SER A 45 16.244 -8.238 -9.618 1.00 0.00 H new ATOM 0 HB3 SER A 45 15.830 -7.399 -11.099 1.00 0.00 H new ATOM 0 HG SER A 45 17.369 -9.086 -11.447 1.00 0.00 H new ATOM 681 N GLY A 46 14.928 -5.025 -9.758 1.00 0.00 N ATOM 682 CA GLY A 46 13.716 -4.415 -9.230 1.00 0.00 C ATOM 683 C GLY A 46 12.736 -4.195 -10.376 1.00 0.00 C ATOM 684 O GLY A 46 13.135 -4.232 -11.544 1.00 0.00 O ATOM 0 H GLY A 46 15.011 -4.928 -10.770 1.00 0.00 H new ATOM 0 HA2 GLY A 46 13.270 -5.058 -8.471 1.00 0.00 H new ATOM 0 HA3 GLY A 46 13.951 -3.466 -8.747 1.00 0.00 H new ATOM 688 N SER A 47 11.459 -3.996 -10.057 1.00 0.00 N ATOM 689 CA SER A 47 10.399 -3.769 -11.021 1.00 0.00 C ATOM 690 C SER A 47 9.239 -3.060 -10.333 1.00 0.00 C ATOM 691 O SER A 47 8.996 -3.261 -9.138 1.00 0.00 O ATOM 692 CB SER A 47 9.946 -5.125 -11.569 1.00 0.00 C ATOM 693 OG SER A 47 9.323 -5.005 -12.828 1.00 0.00 O ATOM 0 H SER A 47 11.130 -3.989 -9.092 1.00 0.00 H new ATOM 0 HA SER A 47 10.752 -3.145 -11.842 1.00 0.00 H new ATOM 0 HB2 SER A 47 10.807 -5.788 -11.652 1.00 0.00 H new ATOM 0 HB3 SER A 47 9.254 -5.588 -10.865 1.00 0.00 H new ATOM 0 HG SER A 47 9.050 -5.892 -13.144 1.00 0.00 H new ATOM 699 N GLY A 48 8.500 -2.268 -11.102 1.00 0.00 N ATOM 700 CA GLY A 48 7.344 -1.503 -10.680 1.00 0.00 C ATOM 701 C GLY A 48 6.924 -0.613 -11.843 1.00 0.00 C ATOM 702 O GLY A 48 7.687 -0.431 -12.798 1.00 0.00 O ATOM 0 H GLY A 48 8.708 -2.139 -12.092 1.00 0.00 H new ATOM 0 HA2 GLY A 48 6.529 -2.168 -10.395 1.00 0.00 H new ATOM 0 HA3 GLY A 48 7.584 -0.900 -9.805 1.00 0.00 H new ATOM 706 N SER A 49 5.701 -0.090 -11.812 1.00 0.00 N ATOM 707 CA SER A 49 5.123 0.789 -12.825 1.00 0.00 C ATOM 708 C SER A 49 3.903 1.462 -12.190 1.00 0.00 C ATOM 709 O SER A 49 4.037 2.546 -11.621 1.00 0.00 O ATOM 710 CB SER A 49 4.774 0.012 -14.112 1.00 0.00 C ATOM 711 OG SER A 49 5.948 -0.458 -14.752 1.00 0.00 O ATOM 0 H SER A 49 5.056 -0.276 -11.044 1.00 0.00 H new ATOM 0 HA SER A 49 5.839 1.549 -13.138 1.00 0.00 H new ATOM 0 HB2 SER A 49 4.125 -0.830 -13.869 1.00 0.00 H new ATOM 0 HB3 SER A 49 4.218 0.657 -14.792 1.00 0.00 H new ATOM 0 HG SER A 49 6.735 -0.170 -14.244 1.00 0.00 H new ATOM 717 N GLY A 50 2.740 0.810 -12.203 1.00 0.00 N ATOM 718 CA GLY A 50 1.505 1.338 -11.644 1.00 0.00 C ATOM 719 C GLY A 50 0.961 2.512 -12.460 1.00 0.00 C ATOM 720 O GLY A 50 1.644 3.093 -13.308 1.00 0.00 O ATOM 0 H GLY A 50 2.633 -0.118 -12.612 1.00 0.00 H new ATOM 0 HA2 GLY A 50 0.757 0.546 -11.606 1.00 0.00 H new ATOM 0 HA3 GLY A 50 1.681 1.661 -10.618 1.00 0.00 H new ATOM 724 N SER A 51 -0.262 2.924 -12.157 1.00 0.00 N ATOM 725 CA SER A 51 -0.967 4.011 -12.816 1.00 0.00 C ATOM 726 C SER A 51 -1.543 4.911 -11.720 1.00 0.00 C ATOM 727 O SER A 51 -2.011 4.398 -10.701 1.00 0.00 O ATOM 728 CB SER A 51 -2.012 3.347 -13.724 1.00 0.00 C ATOM 729 OG SER A 51 -2.772 4.234 -14.521 1.00 0.00 O ATOM 0 H SER A 51 -0.811 2.491 -11.415 1.00 0.00 H new ATOM 0 HA SER A 51 -0.347 4.653 -13.442 1.00 0.00 H new ATOM 0 HB2 SER A 51 -1.503 2.641 -14.380 1.00 0.00 H new ATOM 0 HB3 SER A 51 -2.695 2.768 -13.102 1.00 0.00 H new ATOM 0 HG SER A 51 -3.407 3.723 -15.065 1.00 0.00 H new ATOM 735 N GLY A 52 -1.501 6.234 -11.900 1.00 0.00 N ATOM 736 CA GLY A 52 -2.018 7.202 -10.934 1.00 0.00 C ATOM 737 C GLY A 52 -0.918 7.834 -10.083 1.00 0.00 C ATOM 738 O GLY A 52 0.267 7.791 -10.444 1.00 0.00 O ATOM 0 H GLY A 52 -1.101 6.667 -12.733 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -2.556 7.987 -11.465 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -2.738 6.708 -10.281 1.00 0.00 H new ATOM 742 N SER A 53 -1.330 8.535 -9.027 1.00 0.00 N ATOM 743 CA SER A 53 -0.522 9.225 -8.032 1.00 0.00 C ATOM 744 C SER A 53 -1.506 9.748 -6.987 1.00 0.00 C ATOM 745 O SER A 53 -2.319 10.626 -7.299 1.00 0.00 O ATOM 746 CB SER A 53 0.267 10.388 -8.650 1.00 0.00 C ATOM 747 OG SER A 53 1.466 10.643 -7.945 1.00 0.00 O ATOM 0 H SER A 53 -2.326 8.641 -8.833 1.00 0.00 H new ATOM 0 HA SER A 53 0.217 8.550 -7.599 1.00 0.00 H new ATOM 0 HB2 SER A 53 0.499 10.158 -9.690 1.00 0.00 H new ATOM 0 HB3 SER A 53 -0.351 11.286 -8.652 1.00 0.00 H new ATOM 0 HG SER A 53 1.942 11.388 -8.368 1.00 0.00 H new ATOM 753 N GLY A 54 -1.399 9.288 -5.745 1.00 0.00 N ATOM 754 CA GLY A 54 -2.279 9.688 -4.657 1.00 0.00 C ATOM 755 C GLY A 54 -1.659 9.508 -3.277 1.00 0.00 C ATOM 756 O GLY A 54 -2.356 9.077 -2.351 1.00 0.00 O ATOM 0 H GLY A 54 -0.686 8.615 -5.463 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -2.555 10.734 -4.789 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -3.199 9.106 -4.712 1.00 0.00 H new ATOM 760 N SER A 55 -0.352 9.745 -3.138 1.00 0.00 N ATOM 761 CA SER A 55 0.328 9.632 -1.853 1.00 0.00 C ATOM 762 C SER A 55 -0.244 10.690 -0.888 1.00 0.00 C ATOM 763 O SER A 55 -1.047 11.550 -1.271 1.00 0.00 O ATOM 764 CB SER A 55 1.843 9.809 -2.039 1.00 0.00 C ATOM 765 OG SER A 55 2.433 8.635 -2.564 1.00 0.00 O ATOM 0 H SER A 55 0.257 10.018 -3.909 1.00 0.00 H new ATOM 0 HA SER A 55 0.161 8.642 -1.429 1.00 0.00 H new ATOM 0 HB2 SER A 55 2.035 10.647 -2.709 1.00 0.00 H new ATOM 0 HB3 SER A 55 2.304 10.054 -1.082 1.00 0.00 H new ATOM 0 HG SER A 55 3.397 8.774 -2.674 1.00 0.00 H new ATOM 771 N GLY A 56 0.164 10.638 0.379 1.00 0.00 N ATOM 772 CA GLY A 56 -0.293 11.589 1.375 1.00 0.00 C ATOM 773 C GLY A 56 -1.483 11.101 2.190 1.00 0.00 C ATOM 774 O GLY A 56 -1.822 9.909 2.194 1.00 0.00 O ATOM 0 H GLY A 56 0.816 9.939 0.736 1.00 0.00 H new ATOM 0 HA2 GLY A 56 0.531 11.816 2.052 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -0.563 12.521 0.878 1.00 0.00 H new ATOM 778 N SER A 57 -2.103 12.061 2.882 1.00 0.00 N ATOM 779 CA SER A 57 -3.263 11.920 3.758 1.00 0.00 C ATOM 780 C SER A 57 -3.061 10.869 4.857 1.00 0.00 C ATOM 781 O SER A 57 -3.987 10.138 5.224 1.00 0.00 O ATOM 782 CB SER A 57 -4.567 11.824 2.944 1.00 0.00 C ATOM 783 OG SER A 57 -4.586 10.810 1.950 1.00 0.00 O ATOM 0 H SER A 57 -1.781 13.028 2.839 1.00 0.00 H new ATOM 0 HA SER A 57 -3.375 12.836 4.338 1.00 0.00 H new ATOM 0 HB2 SER A 57 -5.394 11.651 3.632 1.00 0.00 H new ATOM 0 HB3 SER A 57 -4.748 12.785 2.463 1.00 0.00 H new ATOM 0 HG SER A 57 -5.450 10.822 1.487 1.00 0.00 H new ATOM 789 N GLY A 58 -1.836 10.754 5.365 1.00 0.00 N ATOM 790 CA GLY A 58 -1.468 9.823 6.410 1.00 0.00 C ATOM 791 C GLY A 58 -0.422 10.437 7.322 1.00 0.00 C ATOM 792 O GLY A 58 -0.034 11.594 7.172 1.00 0.00 O ATOM 0 H GLY A 58 -1.054 11.327 5.046 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -2.350 9.550 6.990 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -1.080 8.905 5.968 1.00 0.00 H new ATOM 796 N TYR A 59 0.021 9.649 8.295 1.00 0.00 N ATOM 797 CA TYR A 59 1.036 10.023 9.276 1.00 0.00 C ATOM 798 C TYR A 59 2.299 9.181 9.026 1.00 0.00 C ATOM 799 O TYR A 59 3.173 9.064 9.888 1.00 0.00 O ATOM 800 CB TYR A 59 0.464 9.849 10.688 1.00 0.00 C ATOM 801 CG TYR A 59 -0.690 10.778 11.032 1.00 0.00 C ATOM 802 CD1 TYR A 59 -0.457 11.923 11.818 1.00 0.00 C ATOM 803 CD2 TYR A 59 -1.996 10.503 10.578 1.00 0.00 C ATOM 804 CE1 TYR A 59 -1.517 12.785 12.150 1.00 0.00 C ATOM 805 CE2 TYR A 59 -3.058 11.367 10.896 1.00 0.00 C ATOM 806 CZ TYR A 59 -2.822 12.510 11.692 1.00 0.00 C ATOM 807 OH TYR A 59 -3.832 13.373 11.984 1.00 0.00 O ATOM 0 H TYR A 59 -0.328 8.700 8.428 1.00 0.00 H new ATOM 0 HA TYR A 59 1.318 11.071 9.177 1.00 0.00 H new ATOM 0 HB2 TYR A 59 0.128 8.818 10.803 1.00 0.00 H new ATOM 0 HB3 TYR A 59 1.265 10.006 11.410 1.00 0.00 H new ATOM 0 HD1 TYR A 59 0.541 12.140 12.168 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -2.182 9.622 9.982 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -1.331 13.659 12.757 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -4.053 11.157 10.532 1.00 0.00 H new ATOM 0 HH TYR A 59 -4.668 13.041 11.596 1.00 0.00 H new ATOM 817 N GLN A3288 2.356 8.537 7.861 1.00 0.00 N ATOM 818 CA GLN A3288 3.422 7.690 7.367 1.00 0.00 C ATOM 819 C GLN A3288 4.676 8.526 7.128 1.00 0.00 C ATOM 820 O GLN A3288 4.588 9.732 6.884 1.00 0.00 O ATOM 821 CB GLN A3288 2.923 7.000 6.084 1.00 0.00 C ATOM 822 CG GLN A3288 2.498 7.995 4.991 1.00 0.00 C ATOM 823 CD GLN A3288 1.908 7.280 3.785 1.00 0.00 C ATOM 824 OE1 GLN A3288 2.731 6.966 2.808 1.00 0.00 O flip ATOM 825 NE2 GLN A3288 0.715 6.984 3.717 1.00 0.00 N flip ATOM 0 H GLN A3288 1.591 8.605 7.189 1.00 0.00 H new ATOM 0 HA GLN A3288 3.689 6.923 8.094 1.00 0.00 H new ATOM 0 HB2 GLN A3288 3.712 6.356 5.694 1.00 0.00 H new ATOM 0 HB3 GLN A3288 2.078 6.356 6.330 1.00 0.00 H new ATOM 0 HG2 GLN A3288 1.765 8.692 5.397 1.00 0.00 H new ATOM 0 HG3 GLN A3288 3.360 8.585 4.680 1.00 0.00 H new ATOM 0 HE21 GLN A3288 0.084 7.231 4.479 1.00 0.00 H new ATOM 0 HE22 GLN A3288 0.358 6.491 2.898 1.00 0.00 H new ATOM 834 N ILE A3289 5.841 7.881 7.161 1.00 0.00 N ATOM 835 CA ILE A3289 7.116 8.549 6.966 1.00 0.00 C ATOM 836 C ILE A3289 7.272 8.924 5.492 1.00 0.00 C ATOM 837 O ILE A3289 7.645 8.111 4.641 1.00 0.00 O ATOM 838 CB ILE A3289 8.281 7.736 7.555 1.00 0.00 C ATOM 839 CG1 ILE A3289 7.976 7.340 9.023 1.00 0.00 C ATOM 840 CG2 ILE A3289 9.551 8.591 7.463 1.00 0.00 C ATOM 841 CD1 ILE A3289 9.152 6.718 9.781 1.00 0.00 C ATOM 0 H ILE A3289 5.922 6.877 7.325 1.00 0.00 H new ATOM 0 HA ILE A3289 7.139 9.483 7.527 1.00 0.00 H new ATOM 0 HB ILE A3289 8.421 6.812 6.995 1.00 0.00 H new ATOM 0 HG12 ILE A3289 7.644 8.227 9.562 1.00 0.00 H new ATOM 0 HG13 ILE A3289 7.145 6.634 9.028 1.00 0.00 H new ATOM 0 HG21 ILE A3289 10.394 8.036 7.875 1.00 0.00 H new ATOM 0 HG22 ILE A3289 9.752 8.833 6.419 1.00 0.00 H new ATOM 0 HG23 ILE A3289 9.411 9.512 8.029 1.00 0.00 H new ATOM 0 HD11 ILE A3289 8.842 6.475 10.797 1.00 0.00 H new ATOM 0 HD12 ILE A3289 9.473 5.809 9.272 1.00 0.00 H new ATOM 0 HD13 ILE A3289 9.979 7.427 9.814 1.00 0.00 H new ATOM 853 N GLU A3290 6.979 10.184 5.194 1.00 0.00 N ATOM 854 CA GLU A3290 7.049 10.795 3.875 1.00 0.00 C ATOM 855 C GLU A3290 8.496 10.919 3.371 1.00 0.00 C ATOM 856 O GLU A3290 8.713 11.226 2.206 1.00 0.00 O ATOM 857 CB GLU A3290 6.344 12.155 3.965 1.00 0.00 C ATOM 858 CG GLU A3290 6.140 12.832 2.604 1.00 0.00 C ATOM 859 CD GLU A3290 5.049 13.899 2.678 1.00 0.00 C ATOM 860 OE1 GLU A3290 4.039 13.762 1.946 1.00 0.00 O ATOM 861 OE2 GLU A3290 5.169 14.859 3.475 1.00 0.00 O ATOM 0 H GLU A3290 6.669 10.843 5.908 1.00 0.00 H new ATOM 0 HA GLU A3290 6.549 10.164 3.140 1.00 0.00 H new ATOM 0 HB2 GLU A3290 5.374 12.021 4.444 1.00 0.00 H new ATOM 0 HB3 GLU A3290 6.928 12.816 4.606 1.00 0.00 H new ATOM 0 HG2 GLU A3290 7.075 13.286 2.276 1.00 0.00 H new ATOM 0 HG3 GLU A3290 5.871 12.083 1.859 1.00 0.00 H new ATOM 868 N THR A3291 9.495 10.618 4.204 1.00 0.00 N ATOM 869 CA THR A3291 10.906 10.728 3.860 1.00 0.00 C ATOM 870 C THR A3291 11.682 9.439 4.190 1.00 0.00 C ATOM 871 O THR A3291 12.753 9.486 4.793 1.00 0.00 O ATOM 872 CB THR A3291 11.390 12.056 4.494 1.00 0.00 C ATOM 873 OG1 THR A3291 12.650 12.486 4.015 1.00 0.00 O ATOM 874 CG2 THR A3291 11.400 12.082 6.028 1.00 0.00 C ATOM 0 H THR A3291 9.337 10.285 5.155 1.00 0.00 H new ATOM 0 HA THR A3291 11.096 10.797 2.789 1.00 0.00 H new ATOM 0 HB THR A3291 10.625 12.758 4.164 1.00 0.00 H new ATOM 0 HG1 THR A3291 12.896 13.328 4.452 1.00 0.00 H new ATOM 0 HG21 THR A3291 11.754 13.053 6.373 1.00 0.00 H new ATOM 0 HG22 THR A3291 10.390 11.910 6.401 1.00 0.00 H new ATOM 0 HG23 THR A3291 12.063 11.301 6.401 1.00 0.00 H new ATOM 882 N PHE A3292 11.137 8.263 3.849 1.00 0.00 N ATOM 883 CA PHE A3292 11.820 6.996 4.122 1.00 0.00 C ATOM 884 C PHE A3292 11.451 5.914 3.112 1.00 0.00 C ATOM 885 O PHE A3292 12.334 5.303 2.506 1.00 0.00 O ATOM 886 CB PHE A3292 11.535 6.540 5.561 1.00 0.00 C ATOM 887 CG PHE A3292 12.240 5.249 5.952 1.00 0.00 C ATOM 888 CD1 PHE A3292 13.614 5.061 5.695 1.00 0.00 C ATOM 889 CD2 PHE A3292 11.514 4.217 6.568 1.00 0.00 C ATOM 890 CE1 PHE A3292 14.229 3.833 5.998 1.00 0.00 C ATOM 891 CE2 PHE A3292 12.117 2.980 6.850 1.00 0.00 C ATOM 892 CZ PHE A3292 13.476 2.783 6.552 1.00 0.00 C ATOM 0 H PHE A3292 10.233 8.165 3.388 1.00 0.00 H new ATOM 0 HA PHE A3292 12.892 7.165 4.016 1.00 0.00 H new ATOM 0 HB2 PHE A3292 11.838 7.330 6.248 1.00 0.00 H new ATOM 0 HB3 PHE A3292 10.460 6.406 5.683 1.00 0.00 H new ATOM 0 HD1 PHE A3292 14.196 5.863 5.264 1.00 0.00 H new ATOM 0 HD2 PHE A3292 10.478 4.376 6.828 1.00 0.00 H new ATOM 0 HE1 PHE A3292 15.283 3.696 5.805 1.00 0.00 H new ATOM 0 HE2 PHE A3292 11.538 2.184 7.294 1.00 0.00 H new ATOM 0 HZ PHE A3292 13.941 1.828 6.748 1.00 0.00 H new ATOM 902 N PHE A3293 10.155 5.674 2.920 1.00 0.00 N ATOM 903 CA PHE A3293 9.621 4.678 1.989 1.00 0.00 C ATOM 904 C PHE A3293 8.659 5.325 0.993 1.00 0.00 C ATOM 905 O PHE A3293 7.990 4.606 0.265 1.00 0.00 O ATOM 906 CB PHE A3293 8.967 3.504 2.758 1.00 0.00 C ATOM 907 CG PHE A3293 8.271 3.852 4.054 1.00 0.00 C ATOM 908 CD1 PHE A3293 8.663 3.222 5.247 1.00 0.00 C ATOM 909 CD2 PHE A3293 7.246 4.813 4.074 1.00 0.00 C ATOM 910 CE1 PHE A3293 8.062 3.583 6.462 1.00 0.00 C ATOM 911 CE2 PHE A3293 6.643 5.169 5.287 1.00 0.00 C ATOM 912 CZ PHE A3293 7.051 4.557 6.483 1.00 0.00 C ATOM 0 H PHE A3293 9.426 6.181 3.422 1.00 0.00 H new ATOM 0 HA PHE A3293 10.447 4.263 1.411 1.00 0.00 H new ATOM 0 HB2 PHE A3293 8.242 3.026 2.099 1.00 0.00 H new ATOM 0 HB3 PHE A3293 9.739 2.765 2.973 1.00 0.00 H new ATOM 0 HD1 PHE A3293 9.427 2.459 5.229 1.00 0.00 H new ATOM 0 HD2 PHE A3293 6.923 5.277 3.154 1.00 0.00 H new ATOM 0 HE1 PHE A3293 8.377 3.112 7.381 1.00 0.00 H new ATOM 0 HE2 PHE A3293 5.863 5.916 5.302 1.00 0.00 H new ATOM 0 HZ PHE A3293 6.588 4.835 7.418 1.00 0.00 H new ATOM 922 N ALA A3294 8.563 6.660 0.944 1.00 0.00 N ATOM 923 CA ALA A3294 7.657 7.387 0.058 1.00 0.00 C ATOM 924 C ALA A3294 7.747 6.992 -1.419 1.00 0.00 C ATOM 925 O ALA A3294 6.759 7.143 -2.142 1.00 0.00 O ATOM 926 CB ALA A3294 7.887 8.886 0.222 1.00 0.00 C ATOM 0 H ALA A3294 9.126 7.273 1.533 1.00 0.00 H new ATOM 0 HA ALA A3294 6.648 7.111 0.363 1.00 0.00 H new ATOM 0 HB1 ALA A3294 7.213 9.432 -0.438 1.00 0.00 H new ATOM 0 HB2 ALA A3294 7.694 9.173 1.256 1.00 0.00 H new ATOM 0 HB3 ALA A3294 8.919 9.126 -0.035 1.00 0.00 H new ATOM 932 N GLN A3295 8.908 6.516 -1.870 1.00 0.00 N ATOM 933 CA GLN A3295 9.088 6.103 -3.262 1.00 0.00 C ATOM 934 C GLN A3295 8.438 4.736 -3.512 1.00 0.00 C ATOM 935 O GLN A3295 7.999 4.432 -4.614 1.00 0.00 O ATOM 936 CB GLN A3295 10.571 6.113 -3.628 1.00 0.00 C ATOM 937 CG GLN A3295 11.283 7.429 -3.260 1.00 0.00 C ATOM 938 CD GLN A3295 10.582 8.688 -3.776 1.00 0.00 C ATOM 939 OE1 GLN A3295 10.094 8.747 -4.901 1.00 0.00 O ATOM 940 NE2 GLN A3295 10.534 9.757 -2.999 1.00 0.00 N ATOM 0 H GLN A3295 9.740 6.407 -1.290 1.00 0.00 H new ATOM 0 HA GLN A3295 8.585 6.818 -3.913 1.00 0.00 H new ATOM 0 HB2 GLN A3295 11.068 5.286 -3.122 1.00 0.00 H new ATOM 0 HB3 GLN A3295 10.675 5.940 -4.699 1.00 0.00 H new ATOM 0 HG2 GLN A3295 11.367 7.492 -2.175 1.00 0.00 H new ATOM 0 HG3 GLN A3295 12.298 7.403 -3.657 1.00 0.00 H new ATOM 0 HE21 GLN A3295 10.935 9.725 -2.062 1.00 0.00 H new ATOM 0 HE22 GLN A3295 10.096 10.614 -3.337 1.00 0.00 H new ATOM 949 N ASP A3296 8.440 3.859 -2.516 1.00 0.00 N ATOM 950 CA ASP A3296 7.804 2.541 -2.597 1.00 0.00 C ATOM 951 C ASP A3296 6.305 2.696 -2.346 1.00 0.00 C ATOM 952 O ASP A3296 5.475 2.029 -2.955 1.00 0.00 O ATOM 953 CB ASP A3296 8.380 1.590 -1.548 1.00 0.00 C ATOM 954 CG ASP A3296 9.769 1.043 -1.857 1.00 0.00 C ATOM 955 OD1 ASP A3296 10.662 1.835 -2.214 1.00 0.00 O ATOM 956 OD2 ASP A3296 9.944 -0.187 -1.690 1.00 0.00 O ATOM 0 H ASP A3296 8.887 4.041 -1.617 1.00 0.00 H new ATOM 0 HA ASP A3296 7.990 2.127 -3.588 1.00 0.00 H new ATOM 0 HB2 ASP A3296 8.417 2.111 -0.591 1.00 0.00 H new ATOM 0 HB3 ASP A3296 7.695 0.750 -1.428 1.00 0.00 H new ATOM 961 N ILE A3297 5.956 3.589 -1.421 1.00 0.00 N ATOM 962 CA ILE A3297 4.605 3.911 -0.991 1.00 0.00 C ATOM 963 C ILE A3297 3.735 4.311 -2.168 1.00 0.00 C ATOM 964 O ILE A3297 2.573 3.906 -2.200 1.00 0.00 O ATOM 965 CB ILE A3297 4.679 5.005 0.105 1.00 0.00 C ATOM 966 CG1 ILE A3297 4.324 4.464 1.502 1.00 0.00 C ATOM 967 CG2 ILE A3297 3.909 6.299 -0.213 1.00 0.00 C ATOM 968 CD1 ILE A3297 5.106 3.207 1.893 1.00 0.00 C ATOM 0 H ILE A3297 6.656 4.139 -0.924 1.00 0.00 H new ATOM 0 HA ILE A3297 4.129 3.029 -0.561 1.00 0.00 H new ATOM 0 HB ILE A3297 5.729 5.297 0.113 1.00 0.00 H new ATOM 0 HG12 ILE A3297 4.512 5.242 2.242 1.00 0.00 H new ATOM 0 HG13 ILE A3297 3.257 4.243 1.536 1.00 0.00 H new ATOM 0 HG21 ILE A3297 4.021 7.002 0.613 1.00 0.00 H new ATOM 0 HG22 ILE A3297 4.307 6.744 -1.125 1.00 0.00 H new ATOM 0 HG23 ILE A3297 2.853 6.069 -0.352 1.00 0.00 H new ATOM 0 HD11 ILE A3297 4.802 2.885 2.889 1.00 0.00 H new ATOM 0 HD12 ILE A3297 4.900 2.412 1.176 1.00 0.00 H new ATOM 0 HD13 ILE A3297 6.173 3.428 1.893 1.00 0.00 H new ATOM 980 N GLU A3298 4.271 5.121 -3.084 1.00 0.00 N ATOM 981 CA GLU A3298 3.539 5.581 -4.249 1.00 0.00 C ATOM 982 C GLU A3298 3.187 4.383 -5.128 1.00 0.00 C ATOM 983 O GLU A3298 2.079 4.291 -5.638 1.00 0.00 O ATOM 984 CB GLU A3298 4.303 6.681 -4.994 1.00 0.00 C ATOM 985 CG GLU A3298 5.729 6.286 -5.394 1.00 0.00 C ATOM 986 CD GLU A3298 6.048 6.525 -6.862 1.00 0.00 C ATOM 987 OE1 GLU A3298 7.059 7.205 -7.157 1.00 0.00 O ATOM 988 OE2 GLU A3298 5.328 5.992 -7.735 1.00 0.00 O ATOM 0 H GLU A3298 5.227 5.473 -3.032 1.00 0.00 H new ATOM 0 HA GLU A3298 2.604 6.046 -3.936 1.00 0.00 H new ATOM 0 HB2 GLU A3298 3.747 6.952 -5.891 1.00 0.00 H new ATOM 0 HB3 GLU A3298 4.346 7.570 -4.365 1.00 0.00 H new ATOM 0 HG2 GLU A3298 6.436 6.848 -4.783 1.00 0.00 H new ATOM 0 HG3 GLU A3298 5.880 5.231 -5.167 1.00 0.00 H new ATOM 995 N SER A3299 4.099 3.424 -5.245 1.00 0.00 N ATOM 996 CA SER A3299 3.903 2.238 -6.059 1.00 0.00 C ATOM 997 C SER A3299 2.726 1.416 -5.525 1.00 0.00 C ATOM 998 O SER A3299 1.858 0.996 -6.295 1.00 0.00 O ATOM 999 CB SER A3299 5.215 1.441 -6.153 1.00 0.00 C ATOM 1000 OG SER A3299 5.060 0.262 -6.914 1.00 0.00 O ATOM 0 H SER A3299 5.002 3.452 -4.772 1.00 0.00 H new ATOM 0 HA SER A3299 3.639 2.524 -7.077 1.00 0.00 H new ATOM 0 HB2 SER A3299 5.988 2.065 -6.603 1.00 0.00 H new ATOM 0 HB3 SER A3299 5.557 1.184 -5.150 1.00 0.00 H new ATOM 0 HG SER A3299 5.914 -0.217 -6.953 1.00 0.00 H new ATOM 1006 N VAL A3300 2.670 1.192 -4.213 1.00 0.00 N ATOM 1007 CA VAL A3300 1.606 0.405 -3.614 1.00 0.00 C ATOM 1008 C VAL A3300 0.291 1.198 -3.505 1.00 0.00 C ATOM 1009 O VAL A3300 -0.792 0.619 -3.594 1.00 0.00 O ATOM 1010 CB VAL A3300 2.149 -0.289 -2.352 1.00 0.00 C ATOM 1011 CG1 VAL A3300 2.605 0.687 -1.267 1.00 0.00 C ATOM 1012 CG2 VAL A3300 1.151 -1.312 -1.808 1.00 0.00 C ATOM 0 H VAL A3300 3.355 1.548 -3.546 1.00 0.00 H new ATOM 0 HA VAL A3300 1.294 -0.415 -4.261 1.00 0.00 H new ATOM 0 HB VAL A3300 3.047 -0.823 -2.664 1.00 0.00 H new ATOM 0 HG11 VAL A3300 2.975 0.128 -0.407 1.00 0.00 H new ATOM 0 HG12 VAL A3300 3.401 1.320 -1.659 1.00 0.00 H new ATOM 0 HG13 VAL A3300 1.764 1.309 -0.960 1.00 0.00 H new ATOM 0 HG21 VAL A3300 1.564 -1.785 -0.917 1.00 0.00 H new ATOM 0 HG22 VAL A3300 0.218 -0.810 -1.553 1.00 0.00 H new ATOM 0 HG23 VAL A3300 0.959 -2.072 -2.566 1.00 0.00 H new ATOM 1022 N GLN A3301 0.312 2.519 -3.273 1.00 0.00 N ATOM 1023 CA GLN A3301 -0.934 3.302 -3.201 1.00 0.00 C ATOM 1024 C GLN A3301 -1.548 3.392 -4.592 1.00 0.00 C ATOM 1025 O GLN A3301 -2.777 3.413 -4.667 1.00 0.00 O ATOM 1026 CB GLN A3301 -0.774 4.691 -2.554 1.00 0.00 C ATOM 1027 CG GLN A3301 0.205 5.622 -3.269 1.00 0.00 C ATOM 1028 CD GLN A3301 -0.282 6.489 -4.425 1.00 0.00 C ATOM 1029 OE1 GLN A3301 0.500 7.246 -4.999 1.00 0.00 O ATOM 1030 NE2 GLN A3301 -1.542 6.397 -4.804 1.00 0.00 N ATOM 0 H GLN A3301 1.164 3.063 -3.134 1.00 0.00 H new ATOM 0 HA GLN A3301 -1.610 2.771 -2.530 1.00 0.00 H new ATOM 0 HB2 GLN A3301 -1.751 5.173 -2.516 1.00 0.00 H new ATOM 0 HB3 GLN A3301 -0.443 4.560 -1.524 1.00 0.00 H new ATOM 0 HG2 GLN A3301 0.627 6.289 -2.518 1.00 0.00 H new ATOM 0 HG3 GLN A3301 1.023 5.007 -3.645 1.00 0.00 H new ATOM 0 HE21 GLN A3301 -2.176 5.764 -4.317 1.00 0.00 H new ATOM 0 HE22 GLN A3301 -1.882 6.959 -5.585 1.00 0.00 H new ATOM 1039 N LYS A3302 -0.722 3.412 -5.653 1.00 0.00 N ATOM 1040 CA LYS A3302 -1.148 3.469 -7.051 1.00 0.00 C ATOM 1041 C LYS A3302 -2.047 2.276 -7.361 1.00 0.00 C ATOM 1042 O LYS A3302 -2.868 2.352 -8.276 1.00 0.00 O ATOM 1043 CB LYS A3302 0.076 3.546 -7.984 1.00 0.00 C ATOM 1044 CG LYS A3302 0.565 4.995 -8.184 1.00 0.00 C ATOM 1045 CD LYS A3302 2.020 5.087 -8.684 1.00 0.00 C ATOM 1046 CE LYS A3302 2.200 4.589 -10.120 1.00 0.00 C ATOM 1047 NZ LYS A3302 2.032 5.665 -11.114 1.00 0.00 N ATOM 0 H LYS A3302 0.293 3.388 -5.551 1.00 0.00 H new ATOM 0 HA LYS A3302 -1.731 4.374 -7.224 1.00 0.00 H new ATOM 0 HB2 LYS A3302 0.885 2.945 -7.569 1.00 0.00 H new ATOM 0 HB3 LYS A3302 -0.179 3.113 -8.951 1.00 0.00 H new ATOM 0 HG2 LYS A3302 -0.089 5.496 -8.898 1.00 0.00 H new ATOM 0 HG3 LYS A3302 0.478 5.533 -7.240 1.00 0.00 H new ATOM 0 HD2 LYS A3302 2.353 6.123 -8.622 1.00 0.00 H new ATOM 0 HD3 LYS A3302 2.662 4.505 -8.022 1.00 0.00 H new ATOM 0 HE2 LYS A3302 3.192 4.150 -10.228 1.00 0.00 H new ATOM 0 HE3 LYS A3302 1.478 3.797 -10.320 1.00 0.00 H new ATOM 0 HZ1 LYS A3302 1.645 5.268 -11.994 1.00 0.00 H new ATOM 0 HZ2 LYS A3302 1.378 6.383 -10.741 1.00 0.00 H new ATOM 0 HZ3 LYS A3302 2.954 6.105 -11.309 1.00 0.00 H new ATOM 1061 N GLU A3303 -1.867 1.162 -6.646 1.00 0.00 N ATOM 1062 CA GLU A3303 -2.686 -0.031 -6.843 1.00 0.00 C ATOM 1063 C GLU A3303 -4.056 0.206 -6.193 1.00 0.00 C ATOM 1064 O GLU A3303 -5.100 0.066 -6.821 1.00 0.00 O ATOM 1065 CB GLU A3303 -1.941 -1.302 -6.356 1.00 0.00 C ATOM 1066 CG GLU A3303 -2.447 -1.976 -5.065 1.00 0.00 C ATOM 1067 CD GLU A3303 -1.623 -3.186 -4.591 1.00 0.00 C ATOM 1068 OE1 GLU A3303 -0.384 -3.227 -4.783 1.00 0.00 O ATOM 1069 OE2 GLU A3303 -2.196 -4.059 -3.900 1.00 0.00 O ATOM 0 H GLU A3303 -1.156 1.064 -5.922 1.00 0.00 H new ATOM 0 HA GLU A3303 -2.866 -0.216 -7.902 1.00 0.00 H new ATOM 0 HB2 GLU A3303 -1.978 -2.040 -7.157 1.00 0.00 H new ATOM 0 HB3 GLU A3303 -0.893 -1.042 -6.210 1.00 0.00 H new ATOM 0 HG2 GLU A3303 -2.462 -1.233 -4.268 1.00 0.00 H new ATOM 0 HG3 GLU A3303 -3.477 -2.297 -5.221 1.00 0.00 H new ATOM 1076 N LEU A3304 -4.063 0.666 -4.943 1.00 0.00 N ATOM 1077 CA LEU A3304 -5.271 0.900 -4.175 1.00 0.00 C ATOM 1078 C LEU A3304 -6.178 1.996 -4.703 1.00 0.00 C ATOM 1079 O LEU A3304 -7.392 1.885 -4.571 1.00 0.00 O ATOM 1080 CB LEU A3304 -4.870 1.259 -2.748 1.00 0.00 C ATOM 1081 CG LEU A3304 -4.152 0.133 -1.983 1.00 0.00 C ATOM 1082 CD1 LEU A3304 -3.977 0.559 -0.540 1.00 0.00 C ATOM 1083 CD2 LEU A3304 -4.788 -1.250 -2.060 1.00 0.00 C ATOM 0 H LEU A3304 -3.209 0.889 -4.431 1.00 0.00 H new ATOM 0 HA LEU A3304 -5.848 -0.022 -4.242 1.00 0.00 H new ATOM 0 HB2 LEU A3304 -4.220 2.133 -2.776 1.00 0.00 H new ATOM 0 HB3 LEU A3304 -5.764 1.544 -2.194 1.00 0.00 H new ATOM 0 HG LEU A3304 -3.195 0.002 -2.488 1.00 0.00 H new ATOM 0 HD11 LEU A3304 -3.469 -0.231 0.013 1.00 0.00 H new ATOM 0 HD12 LEU A3304 -3.382 1.471 -0.500 1.00 0.00 H new ATOM 0 HD13 LEU A3304 -4.954 0.744 -0.094 1.00 0.00 H new ATOM 0 HD21 LEU A3304 -4.192 -1.957 -1.483 1.00 0.00 H new ATOM 0 HD22 LEU A3304 -5.798 -1.209 -1.653 1.00 0.00 H new ATOM 0 HD23 LEU A3304 -4.829 -1.574 -3.100 1.00 0.00 H new ATOM 1095 N GLU A3305 -5.635 3.060 -5.278 1.00 0.00 N ATOM 1096 CA GLU A3305 -6.452 4.167 -5.780 1.00 0.00 C ATOM 1097 C GLU A3305 -7.332 3.858 -6.984 1.00 0.00 C ATOM 1098 O GLU A3305 -8.141 4.714 -7.362 1.00 0.00 O ATOM 1099 CB GLU A3305 -5.623 5.421 -5.986 1.00 0.00 C ATOM 1100 CG GLU A3305 -4.539 5.209 -7.028 1.00 0.00 C ATOM 1101 CD GLU A3305 -3.810 6.533 -7.336 1.00 0.00 C ATOM 1102 OE1 GLU A3305 -4.471 7.588 -7.491 1.00 0.00 O ATOM 1103 OE2 GLU A3305 -2.562 6.563 -7.335 1.00 0.00 O ATOM 0 H GLU A3305 -4.631 3.184 -5.411 1.00 0.00 H new ATOM 0 HA GLU A3305 -7.172 4.348 -4.982 1.00 0.00 H new ATOM 0 HB2 GLU A3305 -6.272 6.240 -6.296 1.00 0.00 H new ATOM 0 HB3 GLU A3305 -5.167 5.716 -5.041 1.00 0.00 H new ATOM 0 HG2 GLU A3305 -3.823 4.469 -6.670 1.00 0.00 H new ATOM 0 HG3 GLU A3305 -4.979 4.810 -7.942 1.00 0.00 H new ATOM 1110 N ASN A3306 -7.138 2.691 -7.598 1.00 0.00 N ATOM 1111 CA ASN A3306 -7.929 2.223 -8.728 1.00 0.00 C ATOM 1112 C ASN A3306 -8.731 0.986 -8.321 1.00 0.00 C ATOM 1113 O ASN A3306 -9.452 0.442 -9.160 1.00 0.00 O ATOM 1114 CB ASN A3306 -7.086 1.969 -9.976 1.00 0.00 C ATOM 1115 CG ASN A3306 -6.214 0.740 -9.857 1.00 0.00 C ATOM 1116 OD1 ASN A3306 -6.647 -0.395 -10.029 1.00 0.00 O ATOM 1117 ND2 ASN A3306 -4.944 0.931 -9.575 1.00 0.00 N ATOM 0 H ASN A3306 -6.411 2.034 -7.315 1.00 0.00 H new ATOM 0 HA ASN A3306 -8.623 3.018 -9.001 1.00 0.00 H new ATOM 0 HB2 ASN A3306 -7.745 1.859 -10.837 1.00 0.00 H new ATOM 0 HB3 ASN A3306 -6.456 2.838 -10.166 1.00 0.00 H new ATOM 0 HD21 ASN A3306 -4.313 0.133 -9.498 1.00 0.00 H new ATOM 0 HD22 ASN A3306 -4.590 1.877 -9.433 1.00 0.00 H new ATOM 1124 N LEU A3307 -8.576 0.505 -7.078 1.00 0.00 N ATOM 1125 CA LEU A3307 -9.326 -0.668 -6.622 1.00 0.00 C ATOM 1126 C LEU A3307 -10.734 -0.221 -6.204 1.00 0.00 C ATOM 1127 O LEU A3307 -10.938 0.954 -5.883 1.00 0.00 O ATOM 1128 CB LEU A3307 -8.593 -1.365 -5.457 1.00 0.00 C ATOM 1129 CG LEU A3307 -7.928 -2.742 -5.687 1.00 0.00 C ATOM 1130 CD1 LEU A3307 -8.232 -3.449 -7.002 1.00 0.00 C ATOM 1131 CD2 LEU A3307 -6.415 -2.729 -5.527 1.00 0.00 C ATOM 0 H LEU A3307 -7.947 0.905 -6.382 1.00 0.00 H new ATOM 0 HA LEU A3307 -9.405 -1.392 -7.433 1.00 0.00 H new ATOM 0 HB2 LEU A3307 -7.818 -0.684 -5.105 1.00 0.00 H new ATOM 0 HB3 LEU A3307 -9.309 -1.481 -4.644 1.00 0.00 H new ATOM 0 HG LEU A3307 -8.406 -3.311 -4.890 1.00 0.00 H new ATOM 0 HD11 LEU A3307 -7.703 -4.402 -7.034 1.00 0.00 H new ATOM 0 HD12 LEU A3307 -9.305 -3.627 -7.080 1.00 0.00 H new ATOM 0 HD13 LEU A3307 -7.906 -2.825 -7.834 1.00 0.00 H new ATOM 0 HD21 LEU A3307 -6.022 -3.730 -5.704 1.00 0.00 H new ATOM 0 HD22 LEU A3307 -5.979 -2.036 -6.246 1.00 0.00 H new ATOM 0 HD23 LEU A3307 -6.159 -2.412 -4.516 1.00 0.00 H new ATOM 1143 N SER A3308 -11.686 -1.155 -6.220 1.00 0.00 N ATOM 1144 CA SER A3308 -13.099 -1.005 -5.862 1.00 0.00 C ATOM 1145 C SER A3308 -13.325 -1.201 -4.360 1.00 0.00 C ATOM 1146 O SER A3308 -12.409 -1.630 -3.662 1.00 0.00 O ATOM 1147 CB SER A3308 -13.897 -2.048 -6.650 1.00 0.00 C ATOM 1148 OG SER A3308 -13.500 -2.060 -8.013 1.00 0.00 O ATOM 0 H SER A3308 -11.473 -2.111 -6.506 1.00 0.00 H new ATOM 0 HA SER A3308 -13.427 0.005 -6.108 1.00 0.00 H new ATOM 0 HB2 SER A3308 -13.745 -3.035 -6.213 1.00 0.00 H new ATOM 0 HB3 SER A3308 -14.962 -1.828 -6.578 1.00 0.00 H new ATOM 0 HG SER A3308 -14.020 -2.734 -8.499 1.00 0.00 H new ATOM 1154 N GLU A3309 -14.521 -0.905 -3.829 1.00 0.00 N ATOM 1155 CA GLU A3309 -14.775 -1.094 -2.401 1.00 0.00 C ATOM 1156 C GLU A3309 -14.628 -2.568 -2.092 1.00 0.00 C ATOM 1157 O GLU A3309 -13.857 -2.889 -1.215 1.00 0.00 O ATOM 1158 CB GLU A3309 -16.204 -0.687 -1.975 1.00 0.00 C ATOM 1159 CG GLU A3309 -16.370 0.804 -1.697 1.00 0.00 C ATOM 1160 CD GLU A3309 -17.762 1.196 -1.194 1.00 0.00 C ATOM 1161 OE1 GLU A3309 -17.924 1.542 0.004 1.00 0.00 O ATOM 1162 OE2 GLU A3309 -18.689 1.211 -2.038 1.00 0.00 O ATOM 0 H GLU A3309 -15.312 -0.540 -4.360 1.00 0.00 H new ATOM 0 HA GLU A3309 -14.067 -0.464 -1.863 1.00 0.00 H new ATOM 0 HB2 GLU A3309 -16.903 -0.979 -2.759 1.00 0.00 H new ATOM 0 HB3 GLU A3309 -16.478 -1.245 -1.080 1.00 0.00 H new ATOM 0 HG2 GLU A3309 -15.629 1.109 -0.958 1.00 0.00 H new ATOM 0 HG3 GLU A3309 -16.156 1.359 -2.611 1.00 0.00 H new ATOM 1169 N GLU A3310 -15.205 -3.464 -2.880 1.00 0.00 N ATOM 1170 CA GLU A3310 -15.143 -4.902 -2.622 1.00 0.00 C ATOM 1171 C GLU A3310 -13.709 -5.395 -2.417 1.00 0.00 C ATOM 1172 O GLU A3310 -13.486 -6.498 -1.911 1.00 0.00 O ATOM 1173 CB GLU A3310 -15.790 -5.668 -3.784 1.00 0.00 C ATOM 1174 CG GLU A3310 -17.239 -5.256 -4.065 1.00 0.00 C ATOM 1175 CD GLU A3310 -17.830 -6.141 -5.157 1.00 0.00 C ATOM 1176 OE1 GLU A3310 -18.338 -7.245 -4.847 1.00 0.00 O ATOM 1177 OE2 GLU A3310 -17.741 -5.774 -6.352 1.00 0.00 O ATOM 0 H GLU A3310 -15.731 -3.218 -3.718 1.00 0.00 H new ATOM 0 HA GLU A3310 -15.690 -5.089 -1.698 1.00 0.00 H new ATOM 0 HB2 GLU A3310 -15.196 -5.512 -4.685 1.00 0.00 H new ATOM 0 HB3 GLU A3310 -15.762 -6.735 -3.564 1.00 0.00 H new ATOM 0 HG2 GLU A3310 -17.833 -5.341 -3.155 1.00 0.00 H new ATOM 0 HG3 GLU A3310 -17.276 -4.211 -4.373 1.00 0.00 H new ATOM 1184 N GLU A3311 -12.750 -4.722 -3.048 1.00 0.00 N ATOM 1185 CA GLU A3311 -11.360 -5.054 -2.907 1.00 0.00 C ATOM 1186 C GLU A3311 -10.781 -4.453 -1.624 1.00 0.00 C ATOM 1187 O GLU A3311 -10.181 -5.152 -0.828 1.00 0.00 O ATOM 1188 CB GLU A3311 -10.645 -4.510 -4.139 1.00 0.00 C ATOM 1189 CG GLU A3311 -11.177 -5.071 -5.473 1.00 0.00 C ATOM 1190 CD GLU A3311 -10.440 -6.325 -5.953 1.00 0.00 C ATOM 1191 OE1 GLU A3311 -9.981 -7.134 -5.116 1.00 0.00 O ATOM 1192 OE2 GLU A3311 -10.340 -6.526 -7.188 1.00 0.00 O ATOM 0 H GLU A3311 -12.929 -3.933 -3.669 1.00 0.00 H new ATOM 0 HA GLU A3311 -11.227 -6.133 -2.832 1.00 0.00 H new ATOM 0 HB2 GLU A3311 -10.739 -3.424 -4.151 1.00 0.00 H new ATOM 0 HB3 GLU A3311 -9.582 -4.738 -4.059 1.00 0.00 H new ATOM 0 HG2 GLU A3311 -12.236 -5.303 -5.362 1.00 0.00 H new ATOM 0 HG3 GLU A3311 -11.098 -4.299 -6.238 1.00 0.00 H new ATOM 1199 N LEU A3312 -10.950 -3.137 -1.422 1.00 0.00 N ATOM 1200 CA LEU A3312 -10.427 -2.381 -0.276 1.00 0.00 C ATOM 1201 C LEU A3312 -11.199 -2.560 1.028 1.00 0.00 C ATOM 1202 O LEU A3312 -10.623 -2.837 2.077 1.00 0.00 O ATOM 1203 CB LEU A3312 -10.382 -0.873 -0.581 1.00 0.00 C ATOM 1204 CG LEU A3312 -9.938 -0.477 -1.998 1.00 0.00 C ATOM 1205 CD1 LEU A3312 -10.695 0.772 -2.429 1.00 0.00 C ATOM 1206 CD2 LEU A3312 -8.421 -0.347 -2.096 1.00 0.00 C ATOM 0 H LEU A3312 -11.472 -2.552 -2.074 1.00 0.00 H new ATOM 0 HA LEU A3312 -9.431 -2.797 -0.128 1.00 0.00 H new ATOM 0 HB2 LEU A3312 -11.375 -0.459 -0.406 1.00 0.00 H new ATOM 0 HB3 LEU A3312 -9.708 -0.400 0.133 1.00 0.00 H new ATOM 0 HG LEU A3312 -10.193 -1.270 -2.701 1.00 0.00 H new ATOM 0 HD11 LEU A3312 -10.384 1.057 -3.434 1.00 0.00 H new ATOM 0 HD12 LEU A3312 -11.766 0.568 -2.425 1.00 0.00 H new ATOM 0 HD13 LEU A3312 -10.478 1.586 -1.737 1.00 0.00 H new ATOM 0 HD21 LEU A3312 -8.145 -0.066 -3.112 1.00 0.00 H new ATOM 0 HD22 LEU A3312 -8.076 0.419 -1.401 1.00 0.00 H new ATOM 0 HD23 LEU A3312 -7.957 -1.301 -1.845 1.00 0.00 H new ATOM 1218 N LEU A3313 -12.508 -2.324 0.966 1.00 0.00 N ATOM 1219 CA LEU A3313 -13.489 -2.426 2.029 1.00 0.00 C ATOM 1220 C LEU A3313 -13.372 -3.826 2.596 1.00 0.00 C ATOM 1221 O LEU A3313 -13.362 -3.978 3.815 1.00 0.00 O ATOM 1222 CB LEU A3313 -14.905 -2.068 1.488 1.00 0.00 C ATOM 1223 CG LEU A3313 -16.114 -2.298 2.423 1.00 0.00 C ATOM 1224 CD1 LEU A3313 -16.521 -3.775 2.530 1.00 0.00 C ATOM 1225 CD2 LEU A3313 -15.977 -1.717 3.830 1.00 0.00 C ATOM 0 H LEU A3313 -12.941 -2.031 0.090 1.00 0.00 H new ATOM 0 HA LEU A3313 -13.312 -1.714 2.835 1.00 0.00 H new ATOM 0 HB2 LEU A3313 -14.898 -1.016 1.202 1.00 0.00 H new ATOM 0 HB3 LEU A3313 -15.071 -2.644 0.578 1.00 0.00 H new ATOM 0 HG LEU A3313 -16.902 -1.736 1.922 1.00 0.00 H new ATOM 0 HD11 LEU A3313 -17.375 -3.869 3.201 1.00 0.00 H new ATOM 0 HD12 LEU A3313 -16.791 -4.150 1.543 1.00 0.00 H new ATOM 0 HD13 LEU A3313 -15.686 -4.355 2.922 1.00 0.00 H new ATOM 0 HD21 LEU A3313 -16.879 -1.934 4.403 1.00 0.00 H new ATOM 0 HD22 LEU A3313 -15.116 -2.164 4.326 1.00 0.00 H new ATOM 0 HD23 LEU A3313 -15.839 -0.638 3.766 1.00 0.00 H new ATOM 1237 N ALA A3314 -13.207 -4.840 1.745 1.00 0.00 N ATOM 1238 CA ALA A3314 -13.102 -6.189 2.258 1.00 0.00 C ATOM 1239 C ALA A3314 -11.824 -6.397 3.078 1.00 0.00 C ATOM 1240 O ALA A3314 -11.834 -7.207 3.999 1.00 0.00 O ATOM 1241 CB ALA A3314 -13.199 -7.164 1.097 1.00 0.00 C ATOM 0 H ALA A3314 -13.146 -4.750 0.731 1.00 0.00 H new ATOM 0 HA ALA A3314 -13.926 -6.372 2.948 1.00 0.00 H new ATOM 0 HB1 ALA A3314 -13.121 -8.185 1.472 1.00 0.00 H new ATOM 0 HB2 ALA A3314 -14.156 -7.035 0.592 1.00 0.00 H new ATOM 0 HB3 ALA A3314 -12.389 -6.973 0.393 1.00 0.00 H new ATOM 1247 N MET A3315 -10.749 -5.641 2.825 1.00 0.00 N ATOM 1248 CA MET A3315 -9.484 -5.789 3.546 1.00 0.00 C ATOM 1249 C MET A3315 -9.573 -5.183 4.942 1.00 0.00 C ATOM 1250 O MET A3315 -9.435 -5.873 5.948 1.00 0.00 O ATOM 1251 CB MET A3315 -8.362 -5.093 2.753 1.00 0.00 C ATOM 1252 CG MET A3315 -8.273 -5.469 1.285 1.00 0.00 C ATOM 1253 SD MET A3315 -6.775 -6.351 0.785 1.00 0.00 S ATOM 1254 CE MET A3315 -7.052 -6.395 -1.005 1.00 0.00 C ATOM 0 H MET A3315 -10.734 -4.910 2.114 1.00 0.00 H new ATOM 0 HA MET A3315 -9.267 -6.852 3.649 1.00 0.00 H new ATOM 0 HB2 MET A3315 -8.503 -4.015 2.827 1.00 0.00 H new ATOM 0 HB3 MET A3315 -7.408 -5.323 3.228 1.00 0.00 H new ATOM 0 HG2 MET A3315 -9.136 -6.087 1.035 1.00 0.00 H new ATOM 0 HG3 MET A3315 -8.350 -4.558 0.691 1.00 0.00 H new ATOM 0 HE1 MET A3315 -6.221 -6.907 -1.489 1.00 0.00 H new ATOM 0 HE2 MET A3315 -7.979 -6.927 -1.217 1.00 0.00 H new ATOM 0 HE3 MET A3315 -7.123 -5.377 -1.387 1.00 0.00 H new ATOM 1264 N LEU A3316 -9.908 -3.893 5.035 1.00 0.00 N ATOM 1265 CA LEU A3316 -10.055 -3.133 6.278 1.00 0.00 C ATOM 1266 C LEU A3316 -11.174 -3.680 7.151 1.00 0.00 C ATOM 1267 O LEU A3316 -11.142 -3.483 8.370 1.00 0.00 O ATOM 1268 CB LEU A3316 -10.316 -1.652 5.973 1.00 0.00 C ATOM 1269 CG LEU A3316 -11.488 -1.399 4.995 1.00 0.00 C ATOM 1270 CD1 LEU A3316 -12.831 -1.140 5.687 1.00 0.00 C ATOM 1271 CD2 LEU A3316 -11.208 -0.164 4.149 1.00 0.00 C ATOM 0 H LEU A3316 -10.092 -3.325 4.208 1.00 0.00 H new ATOM 0 HA LEU A3316 -9.119 -3.234 6.828 1.00 0.00 H new ATOM 0 HB2 LEU A3316 -10.520 -1.131 6.909 1.00 0.00 H new ATOM 0 HB3 LEU A3316 -9.409 -1.214 5.556 1.00 0.00 H new ATOM 0 HG LEU A3316 -11.561 -2.312 4.404 1.00 0.00 H new ATOM 0 HD11 LEU A3316 -13.602 -0.972 4.935 1.00 0.00 H new ATOM 0 HD12 LEU A3316 -13.100 -2.004 6.295 1.00 0.00 H new ATOM 0 HD13 LEU A3316 -12.748 -0.260 6.324 1.00 0.00 H new ATOM 0 HD21 LEU A3316 -12.039 0.004 3.465 1.00 0.00 H new ATOM 0 HD22 LEU A3316 -11.092 0.703 4.799 1.00 0.00 H new ATOM 0 HD23 LEU A3316 -10.292 -0.315 3.577 1.00 0.00 H new ATOM 1283 N ASN A3317 -12.157 -4.332 6.532 1.00 0.00 N ATOM 1284 CA ASN A3317 -13.281 -4.923 7.255 1.00 0.00 C ATOM 1285 C ASN A3317 -13.034 -6.399 7.556 1.00 0.00 C ATOM 1286 O ASN A3317 -13.623 -6.955 8.483 1.00 0.00 O ATOM 1287 CB ASN A3317 -14.590 -4.761 6.475 1.00 0.00 C ATOM 1288 CG ASN A3317 -15.758 -4.645 7.431 1.00 0.00 C ATOM 1289 OD1 ASN A3317 -16.617 -5.514 7.507 1.00 0.00 O ATOM 1290 ND2 ASN A3317 -15.831 -3.537 8.153 1.00 0.00 N ATOM 0 H ASN A3317 -12.197 -4.465 5.521 1.00 0.00 H new ATOM 0 HA ASN A3317 -13.371 -4.388 8.200 1.00 0.00 H new ATOM 0 HB2 ASN A3317 -14.538 -3.874 5.844 1.00 0.00 H new ATOM 0 HB3 ASN A3317 -14.736 -5.615 5.814 1.00 0.00 H new ATOM 0 HD21 ASN A3317 -16.615 -3.394 8.789 1.00 0.00 H new ATOM 0 HD22 ASN A3317 -15.103 -2.827 8.073 1.00 0.00 H new ATOM 1297 N GLY A3318 -12.097 -7.000 6.825 1.00 0.00 N ATOM 1298 CA GLY A3318 -11.700 -8.395 6.925 1.00 0.00 C ATOM 1299 C GLY A3318 -12.913 -9.253 6.615 1.00 0.00 C ATOM 1300 O GLY A3318 -13.352 -10.027 7.470 1.00 0.00 O ATOM 0 H GLY A3318 -11.570 -6.497 6.111 1.00 0.00 H new ATOM 0 HA2 GLY A3318 -10.892 -8.612 6.227 1.00 0.00 H new ATOM 0 HA3 GLY A3318 -11.325 -8.613 7.925 1.00 0.00 H new ATOM 1304 N ASP A3319 -13.494 -9.074 5.431 1.00 0.00 N ATOM 1305 CA ASP A3319 -14.680 -9.797 4.983 1.00 0.00 C ATOM 1306 C ASP A3319 -14.628 -10.058 3.482 1.00 0.00 C ATOM 1307 O ASP A3319 -13.529 -10.143 2.928 1.00 0.00 O ATOM 1308 CB ASP A3319 -15.947 -9.049 5.431 1.00 0.00 C ATOM 1309 CG ASP A3319 -16.842 -10.032 6.186 1.00 0.00 C ATOM 1310 OD1 ASP A3319 -16.761 -10.072 7.435 1.00 0.00 O ATOM 1311 OD2 ASP A3319 -17.486 -10.903 5.555 1.00 0.00 O ATOM 0 H ASP A3319 -13.145 -8.408 4.742 1.00 0.00 H new ATOM 0 HA ASP A3319 -14.708 -10.781 5.452 1.00 0.00 H new ATOM 0 HB2 ASP A3319 -15.684 -8.206 6.070 1.00 0.00 H new ATOM 0 HB3 ASP A3319 -16.473 -8.642 4.568 1.00 0.00 H new ATOM 1316 N GLN A3320 -15.785 -10.238 2.840 1.00 0.00 N ATOM 1317 CA GLN A3320 -15.942 -10.502 1.416 1.00 0.00 C ATOM 1318 C GLN A3320 -17.071 -9.646 0.820 1.00 0.00 C ATOM 1319 O GLN A3320 -17.820 -10.112 -0.043 1.00 0.00 O ATOM 1320 CB GLN A3320 -16.161 -12.020 1.241 1.00 0.00 C ATOM 1321 CG GLN A3320 -15.798 -12.549 -0.151 1.00 0.00 C ATOM 1322 CD GLN A3320 -14.293 -12.482 -0.400 1.00 0.00 C ATOM 1323 OE1 GLN A3320 -13.560 -13.408 -0.056 1.00 0.00 O ATOM 1324 NE2 GLN A3320 -13.773 -11.389 -0.931 1.00 0.00 N ATOM 0 H GLN A3320 -16.680 -10.201 3.328 1.00 0.00 H new ATOM 0 HA GLN A3320 -15.048 -10.217 0.862 1.00 0.00 H new ATOM 0 HB2 GLN A3320 -15.567 -12.550 1.985 1.00 0.00 H new ATOM 0 HB3 GLN A3320 -17.207 -12.251 1.444 1.00 0.00 H new ATOM 0 HG2 GLN A3320 -16.139 -13.580 -0.250 1.00 0.00 H new ATOM 0 HG3 GLN A3320 -16.320 -11.966 -0.910 1.00 0.00 H new ATOM 0 HE21 GLN A3320 -14.381 -10.621 -1.216 1.00 0.00 H new ATOM 0 HE22 GLN A3320 -12.763 -11.313 -1.056 1.00 0.00 H new ATOM 1333 N GLN A3321 -17.280 -8.440 1.354 1.00 0.00 N ATOM 1334 CA GLN A3321 -18.310 -7.510 0.897 1.00 0.00 C ATOM 1335 C GLN A3321 -17.721 -6.573 -0.154 1.00 0.00 C ATOM 1336 O GLN A3321 -18.319 -5.498 -0.407 1.00 0.00 O ATOM 1337 CB GLN A3321 -18.900 -6.758 2.106 1.00 0.00 C ATOM 1338 CG GLN A3321 -19.906 -7.571 2.931 1.00 0.00 C ATOM 1339 CD GLN A3321 -19.295 -8.591 3.891 1.00 0.00 C ATOM 1340 OE1 GLN A3321 -19.145 -8.332 5.080 1.00 0.00 O ATOM 1341 NE2 GLN A3321 -18.948 -9.782 3.425 1.00 0.00 N ATOM 0 H GLN A3321 -16.727 -8.078 2.131 1.00 0.00 H new ATOM 0 HA GLN A3321 -19.130 -8.049 0.423 1.00 0.00 H new ATOM 0 HB2 GLN A3321 -18.084 -6.445 2.757 1.00 0.00 H new ATOM 0 HB3 GLN A3321 -19.389 -5.851 1.750 1.00 0.00 H new ATOM 0 HG2 GLN A3321 -20.521 -6.879 3.506 1.00 0.00 H new ATOM 0 HG3 GLN A3321 -20.572 -8.096 2.246 1.00 0.00 H new ATOM 0 HE21 GLN A3321 -19.072 -9.999 2.436 1.00 0.00 H new ATOM 0 HE22 GLN A3321 -18.557 -10.482 4.055 1.00 0.00 H new TER 1350 GLN A3321