USER MOD reduce.3.24.130724 H: found=0, std=0, add=1016, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1014 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 56 CYS SG : rot 180:sc= 0 USER MOD Set 1.2: A 90 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 45 ASN : amide:sc= 1.33 K(o=1.5,f=-4.5) USER MOD Set 2.2: A 63 GLN : amide:sc= 0.741 K(o=1.5,f=-2!) USER MOD Set 2.3: A 65 HIS : no HD1:sc= -0.544 X(o=1.5,f=1.9) USER MOD Set 3.1: A 29 GLN : amide:sc= 1.04 K(o=3.4,f=-11!) USER MOD Set 3.2: A 48 LYS NZ :NH3+ 150:sc= 2.32 (180deg=-0.245) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 167:sc= 0.982 (180deg=0.849) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 HIS : no HD1:sc= -0.128 X(o=-0.13,f=-0.015) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 THR OG1 : rot -57:sc= 0.916 USER MOD Single : A 15 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.12) USER MOD Single : A 31 SER OG : rot -150:sc= 0 USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=-0.043) USER MOD Single : A 34 SER OG : rot 73:sc= 0.281 USER MOD Single : A 37 LYS NZ :NH3+ 156:sc= 1.13 (180deg=0.808) USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=-0.036) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= -0.164 K(o=-0.16,f=-1.7!) USER MOD Single : A 58 HIS : no HD1:sc= 0.293 K(o=0.29,f=-4.2!) USER MOD Single : A 61 SER OG : rot 180:sc= 1.09 USER MOD Single : A 62 SER OG : rot 180:sc= 0.0537 USER MOD Single : A 67 ASN : amide:sc= -1.58! X(o=-1.6!,f=-1.8) USER MOD Single : A 68 ASN : amide:sc= -1.03 X(o=-1,f=-1) USER MOD Single : A 72 GLN : amide:sc= 0.748 K(o=0.75,f=-0.63) USER MOD Single : A 73 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 74 LYS NZ :NH3+ 153:sc= 1.27 (180deg=0.29) USER MOD Single : A 80 SER OG : rot 87:sc= 1.27 USER MOD Single : A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ -168:sc= 1.29 (180deg=1.18) USER MOD Single : A 85 SER OG : rot 180:sc= -0.0365 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0.007 USER MOD Single : A 96 ASN : amide:sc= -0.13 X(o=-0.13,f=-0.081) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0.46 USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=-0.062) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN :FLIP amide:sc= 0 F(o=-1.4!,f=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0.0054 USER MOD Single : A 125 ASN : amide:sc= 0.205 X(o=0.2,f=-0.022) USER MOD Single : A 126 ASN : amide:sc= -0.0841 K(o=-0.084,f=-0.94) USER MOD Single : A 128 GLN : amide:sc= -0.318 X(o=-0.32,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -29.638 13.774 -2.072 1.00 0.00 N ATOM 2 CA MET A 1 -28.399 14.303 -1.471 1.00 0.00 C ATOM 3 C MET A 1 -27.605 15.031 -2.553 1.00 0.00 C ATOM 4 O MET A 1 -27.892 14.869 -3.739 1.00 0.00 O ATOM 5 CB MET A 1 -27.575 13.162 -0.845 1.00 0.00 C ATOM 6 CG MET A 1 -28.061 12.828 0.571 1.00 0.00 C ATOM 7 SD MET A 1 -29.788 12.302 0.708 1.00 0.00 S ATOM 8 CE MET A 1 -29.875 12.036 2.499 1.00 0.00 C ATOM 0 H1 MET A 1 -30.079 13.096 -1.418 1.00 0.00 H new ATOM 0 H2 MET A 1 -30.297 14.557 -2.255 1.00 0.00 H new ATOM 0 H3 MET A 1 -29.413 13.295 -2.967 1.00 0.00 H new ATOM 0 HA MET A 1 -28.641 15.004 -0.672 1.00 0.00 H new ATOM 0 HB2 MET A 1 -27.645 12.274 -1.474 1.00 0.00 H new ATOM 0 HB3 MET A 1 -26.523 13.447 -0.812 1.00 0.00 H new ATOM 0 HG2 MET A 1 -27.427 12.039 0.975 1.00 0.00 H new ATOM 0 HG3 MET A 1 -27.917 13.706 1.201 1.00 0.00 H new ATOM 0 HE1 MET A 1 -30.878 11.705 2.769 1.00 0.00 H new ATOM 0 HE2 MET A 1 -29.151 11.275 2.789 1.00 0.00 H new ATOM 0 HE3 MET A 1 -29.649 12.968 3.017 1.00 0.00 H new ATOM 18 N LYS A 2 -26.590 15.808 -2.178 1.00 0.00 N ATOM 19 CA LYS A 2 -25.397 15.975 -3.002 1.00 0.00 C ATOM 20 C LYS A 2 -24.191 15.867 -2.082 1.00 0.00 C ATOM 21 O LYS A 2 -24.237 16.372 -0.957 1.00 0.00 O ATOM 22 CB LYS A 2 -25.381 17.284 -3.818 1.00 0.00 C ATOM 23 CG LYS A 2 -25.422 18.604 -3.015 1.00 0.00 C ATOM 24 CD LYS A 2 -24.697 19.753 -3.738 1.00 0.00 C ATOM 25 CE LYS A 2 -23.168 19.609 -3.615 1.00 0.00 C ATOM 26 NZ LYS A 2 -22.437 20.538 -4.504 1.00 0.00 N ATOM 0 H LYS A 2 -26.572 16.334 -1.304 1.00 0.00 H new ATOM 0 HA LYS A 2 -25.380 15.191 -3.759 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -24.483 17.289 -4.435 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -26.234 17.272 -4.497 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -26.460 18.887 -2.839 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -24.964 18.446 -2.038 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -24.981 19.761 -4.790 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -25.011 20.708 -3.316 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -22.871 19.791 -2.582 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -22.883 18.584 -3.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -21.413 20.401 -4.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -22.697 20.349 -5.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -22.686 21.518 -4.262 1.00 0.00 H new ATOM 40 N ALA A 3 -23.151 15.182 -2.531 1.00 0.00 N ATOM 41 CA ALA A 3 -21.900 15.127 -1.801 1.00 0.00 C ATOM 42 C ALA A 3 -21.206 16.476 -2.032 1.00 0.00 C ATOM 43 O ALA A 3 -21.344 17.068 -3.110 1.00 0.00 O ATOM 44 CB ALA A 3 -21.106 13.932 -2.305 1.00 0.00 C ATOM 0 H ALA A 3 -23.152 14.654 -3.404 1.00 0.00 H new ATOM 0 HA ALA A 3 -22.021 14.984 -0.727 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -20.159 13.872 -1.768 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -21.677 13.019 -2.137 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -20.912 14.048 -3.371 1.00 0.00 H new ATOM 50 N LEU A 4 -20.509 16.990 -1.021 1.00 0.00 N ATOM 51 CA LEU A 4 -19.914 18.325 -1.049 1.00 0.00 C ATOM 52 C LEU A 4 -18.706 18.424 -1.983 1.00 0.00 C ATOM 53 O LEU A 4 -18.634 19.378 -2.756 1.00 0.00 O ATOM 54 CB LEU A 4 -19.600 18.747 0.398 1.00 0.00 C ATOM 55 CG LEU A 4 -19.234 20.223 0.657 1.00 0.00 C ATOM 56 CD1 LEU A 4 -17.779 20.549 0.323 1.00 0.00 C ATOM 57 CD2 LEU A 4 -20.174 21.212 -0.047 1.00 0.00 C ATOM 0 H LEU A 4 -20.339 16.487 -0.150 1.00 0.00 H new ATOM 0 HA LEU A 4 -20.631 19.027 -1.475 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -20.467 18.505 1.012 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -18.775 18.131 0.754 1.00 0.00 H new ATOM 0 HG LEU A 4 -19.365 20.349 1.732 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -17.586 21.602 0.527 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -17.119 19.934 0.934 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -17.593 20.344 -0.731 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -19.862 22.232 0.176 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -20.135 21.048 -1.124 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -21.194 21.059 0.306 1.00 0.00 H new ATOM 69 N GLU A 5 -17.793 17.453 -1.929 1.00 0.00 N ATOM 70 CA GLU A 5 -16.547 17.340 -2.691 1.00 0.00 C ATOM 71 C GLU A 5 -15.846 18.679 -2.940 1.00 0.00 C ATOM 72 O GLU A 5 -15.862 19.259 -4.034 1.00 0.00 O ATOM 73 CB GLU A 5 -16.779 16.558 -3.984 1.00 0.00 C ATOM 74 CG GLU A 5 -16.636 15.037 -3.829 1.00 0.00 C ATOM 75 CD GLU A 5 -17.744 14.346 -3.043 1.00 0.00 C ATOM 76 OE1 GLU A 5 -17.931 14.671 -1.852 1.00 0.00 O ATOM 77 OE2 GLU A 5 -18.366 13.420 -3.627 1.00 0.00 O ATOM 0 H GLU A 5 -17.916 16.660 -1.300 1.00 0.00 H new ATOM 0 HA GLU A 5 -15.851 16.778 -2.068 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -17.778 16.782 -4.358 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -16.072 16.904 -4.738 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -16.589 14.592 -4.823 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -15.684 14.828 -3.340 1.00 0.00 H new ATOM 84 N HIS A 6 -15.188 19.155 -1.890 1.00 0.00 N ATOM 85 CA HIS A 6 -14.338 20.338 -1.930 1.00 0.00 C ATOM 86 C HIS A 6 -12.928 19.974 -1.503 1.00 0.00 C ATOM 87 O HIS A 6 -12.043 20.011 -2.352 1.00 0.00 O ATOM 88 CB HIS A 6 -14.926 21.539 -1.178 1.00 0.00 C ATOM 89 CG HIS A 6 -14.153 22.819 -1.402 1.00 0.00 C ATOM 90 ND1 HIS A 6 -14.040 23.869 -0.508 1.00 0.00 N ATOM 91 CD2 HIS A 6 -13.497 23.176 -2.551 1.00 0.00 C ATOM 92 CE1 HIS A 6 -13.324 24.837 -1.105 1.00 0.00 C ATOM 93 NE2 HIS A 6 -12.981 24.438 -2.342 1.00 0.00 N ATOM 0 H HIS A 6 -15.231 18.720 -0.968 1.00 0.00 H new ATOM 0 HA HIS A 6 -14.290 20.685 -2.962 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -15.959 21.686 -1.493 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -14.947 21.317 -0.111 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -13.402 22.583 -3.448 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -13.065 25.787 -0.661 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -12.432 24.977 -3.012 1.00 0.00 H new ATOM 102 N GLU A 7 -12.685 19.623 -0.241 1.00 0.00 N ATOM 103 CA GLU A 7 -11.327 19.304 0.188 1.00 0.00 C ATOM 104 C GLU A 7 -10.914 17.884 -0.226 1.00 0.00 C ATOM 105 O GLU A 7 -9.725 17.644 -0.432 1.00 0.00 O ATOM 106 CB GLU A 7 -11.136 19.582 1.692 1.00 0.00 C ATOM 107 CG GLU A 7 -11.620 18.511 2.684 1.00 0.00 C ATOM 108 CD GLU A 7 -13.106 18.579 3.028 1.00 0.00 C ATOM 109 OE1 GLU A 7 -13.933 19.026 2.200 1.00 0.00 O ATOM 110 OE2 GLU A 7 -13.468 18.153 4.149 1.00 0.00 O ATOM 0 H GLU A 7 -13.395 19.553 0.488 1.00 0.00 H new ATOM 0 HA GLU A 7 -10.644 19.972 -0.336 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -10.074 19.748 1.870 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -11.649 20.514 1.928 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -11.403 17.527 2.269 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -11.044 18.603 3.605 1.00 0.00 H new ATOM 117 N LYS A 8 -11.875 16.961 -0.402 1.00 0.00 N ATOM 118 CA LYS A 8 -11.633 15.537 -0.676 1.00 0.00 C ATOM 119 C LYS A 8 -10.568 15.313 -1.746 1.00 0.00 C ATOM 120 O LYS A 8 -9.630 14.563 -1.492 1.00 0.00 O ATOM 121 CB LYS A 8 -12.954 14.839 -1.057 1.00 0.00 C ATOM 122 CG LYS A 8 -13.716 14.280 0.156 1.00 0.00 C ATOM 123 CD LYS A 8 -13.462 12.782 0.398 1.00 0.00 C ATOM 124 CE LYS A 8 -11.985 12.428 0.628 1.00 0.00 C ATOM 125 NZ LYS A 8 -11.837 11.052 1.143 1.00 0.00 N ATOM 0 H LYS A 8 -12.867 17.193 -0.356 1.00 0.00 H new ATOM 0 HA LYS A 8 -11.244 15.093 0.240 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -13.593 15.548 -1.584 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -12.741 14.025 -1.750 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -13.427 14.839 1.046 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -14.784 14.441 0.011 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -14.041 12.461 1.264 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -13.831 12.218 -0.459 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -11.435 12.530 -0.307 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -11.546 13.132 1.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -10.829 10.842 1.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -12.343 10.964 2.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -12.235 10.380 0.457 1.00 0.00 H new ATOM 139 N THR A 9 -10.720 15.971 -2.894 1.00 0.00 N ATOM 140 CA THR A 9 -9.848 15.964 -4.060 1.00 0.00 C ATOM 141 C THR A 9 -9.048 14.663 -4.258 1.00 0.00 C ATOM 142 O THR A 9 -7.845 14.618 -3.968 1.00 0.00 O ATOM 143 CB THR A 9 -8.985 17.231 -4.093 1.00 0.00 C ATOM 144 OG1 THR A 9 -8.344 17.543 -2.862 1.00 0.00 O ATOM 145 CG2 THR A 9 -9.835 18.440 -4.483 1.00 0.00 C ATOM 0 H THR A 9 -11.529 16.575 -3.041 1.00 0.00 H new ATOM 0 HA THR A 9 -10.498 15.982 -4.935 1.00 0.00 H new ATOM 0 HB THR A 9 -8.208 17.017 -4.827 1.00 0.00 H new ATOM 0 HG1 THR A 9 -9.018 17.637 -2.157 1.00 0.00 H new ATOM 0 HG21 THR A 9 -9.210 19.333 -4.503 1.00 0.00 H new ATOM 0 HG22 THR A 9 -10.267 18.278 -5.470 1.00 0.00 H new ATOM 0 HG23 THR A 9 -10.635 18.573 -3.754 1.00 0.00 H new ATOM 153 N PRO A 10 -9.674 13.606 -4.811 1.00 0.00 N ATOM 154 CA PRO A 10 -8.980 12.376 -5.149 1.00 0.00 C ATOM 155 C PRO A 10 -7.857 12.598 -6.170 1.00 0.00 C ATOM 156 O PRO A 10 -7.039 11.705 -6.359 1.00 0.00 O ATOM 157 CB PRO A 10 -10.053 11.394 -5.631 1.00 0.00 C ATOM 158 CG PRO A 10 -11.170 12.300 -6.124 1.00 0.00 C ATOM 159 CD PRO A 10 -11.076 13.497 -5.179 1.00 0.00 C ATOM 0 HA PRO A 10 -8.462 11.968 -4.281 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -9.679 10.750 -6.426 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -10.391 10.742 -4.825 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -11.024 12.593 -7.164 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -12.143 11.812 -6.064 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -11.424 14.408 -5.667 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -11.701 13.349 -4.298 1.00 0.00 H new ATOM 167 N GLU A 11 -7.769 13.759 -6.828 1.00 0.00 N ATOM 168 CA GLU A 11 -6.653 14.091 -7.707 1.00 0.00 C ATOM 169 C GLU A 11 -5.357 14.081 -6.903 1.00 0.00 C ATOM 170 O GLU A 11 -4.378 13.473 -7.331 1.00 0.00 O ATOM 171 CB GLU A 11 -6.826 15.462 -8.386 1.00 0.00 C ATOM 172 CG GLU A 11 -8.186 15.678 -9.058 1.00 0.00 C ATOM 173 CD GLU A 11 -9.171 16.398 -8.142 1.00 0.00 C ATOM 174 OE1 GLU A 11 -9.754 15.738 -7.253 1.00 0.00 O ATOM 175 OE2 GLU A 11 -9.365 17.626 -8.317 1.00 0.00 O ATOM 0 H GLU A 11 -8.474 14.494 -6.763 1.00 0.00 H new ATOM 0 HA GLU A 11 -6.621 13.339 -8.496 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -6.677 16.243 -7.640 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -6.043 15.583 -9.135 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -8.051 16.258 -9.971 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -8.602 14.714 -9.351 1.00 0.00 H new ATOM 182 N LEU A 12 -5.350 14.707 -5.718 1.00 0.00 N ATOM 183 CA LEU A 12 -4.173 14.674 -4.864 1.00 0.00 C ATOM 184 C LEU A 12 -4.013 13.269 -4.310 1.00 0.00 C ATOM 185 O LEU A 12 -2.914 12.732 -4.331 1.00 0.00 O ATOM 186 CB LEU A 12 -4.250 15.659 -3.690 1.00 0.00 C ATOM 187 CG LEU A 12 -2.884 15.702 -2.956 1.00 0.00 C ATOM 188 CD1 LEU A 12 -1.957 16.722 -3.617 1.00 0.00 C ATOM 189 CD2 LEU A 12 -3.046 16.004 -1.470 1.00 0.00 C ATOM 0 H LEU A 12 -6.138 15.233 -5.340 1.00 0.00 H new ATOM 0 HA LEU A 12 -3.321 14.968 -5.477 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -4.511 16.653 -4.053 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -5.036 15.356 -2.999 1.00 0.00 H new ATOM 0 HG LEU A 12 -2.435 14.712 -3.037 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -1.003 16.741 -3.091 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -1.792 16.443 -4.658 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -2.414 17.711 -3.574 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -2.066 16.025 -0.994 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -3.530 16.973 -1.346 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -3.658 15.231 -1.006 1.00 0.00 H new ATOM 201 N ALA A 13 -5.086 12.652 -3.816 1.00 0.00 N ATOM 202 CA ALA A 13 -4.960 11.363 -3.156 1.00 0.00 C ATOM 203 C ALA A 13 -4.420 10.291 -4.100 1.00 0.00 C ATOM 204 O ALA A 13 -3.689 9.403 -3.645 1.00 0.00 O ATOM 205 CB ALA A 13 -6.317 10.959 -2.573 1.00 0.00 C ATOM 0 H ALA A 13 -6.036 13.021 -3.861 1.00 0.00 H new ATOM 0 HA ALA A 13 -4.235 11.456 -2.347 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -6.227 9.993 -2.077 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -6.640 11.709 -1.851 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -7.051 10.888 -3.376 1.00 0.00 H new ATOM 211 N ALA A 14 -4.730 10.394 -5.393 1.00 0.00 N ATOM 212 CA ALA A 14 -4.189 9.516 -6.413 1.00 0.00 C ATOM 213 C ALA A 14 -2.828 9.999 -6.927 1.00 0.00 C ATOM 214 O ALA A 14 -2.102 9.196 -7.511 1.00 0.00 O ATOM 215 CB ALA A 14 -5.199 9.357 -7.539 1.00 0.00 C ATOM 0 H ALA A 14 -5.371 11.099 -5.758 1.00 0.00 H new ATOM 0 HA ALA A 14 -4.010 8.538 -5.966 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -4.790 8.697 -8.304 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -6.120 8.928 -7.144 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -5.412 10.332 -7.977 1.00 0.00 H new ATOM 221 N LYS A 15 -2.445 11.271 -6.759 1.00 0.00 N ATOM 222 CA LYS A 15 -1.090 11.713 -7.113 1.00 0.00 C ATOM 223 C LYS A 15 -0.156 11.231 -6.012 1.00 0.00 C ATOM 224 O LYS A 15 0.923 10.727 -6.305 1.00 0.00 O ATOM 225 CB LYS A 15 -1.018 13.233 -7.295 1.00 0.00 C ATOM 226 CG LYS A 15 -1.394 13.578 -8.740 1.00 0.00 C ATOM 227 CD LYS A 15 -1.659 15.077 -8.922 1.00 0.00 C ATOM 228 CE LYS A 15 -1.717 15.485 -10.400 1.00 0.00 C ATOM 229 NZ LYS A 15 -2.541 14.573 -11.226 1.00 0.00 N ATOM 0 H LYS A 15 -3.046 12.005 -6.385 1.00 0.00 H new ATOM 0 HA LYS A 15 -0.793 11.289 -8.072 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -1.696 13.728 -6.600 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -0.014 13.592 -7.071 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -0.590 13.268 -9.408 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -2.282 13.015 -9.028 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -2.600 15.338 -8.438 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -0.875 15.645 -8.421 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -2.119 16.495 -10.476 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -0.704 15.514 -10.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -2.666 14.981 -12.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -2.065 13.652 -11.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -3.471 14.444 -10.779 1.00 0.00 H new ATOM 243 N LEU A 16 -0.614 11.261 -4.762 1.00 0.00 N ATOM 244 CA LEU A 16 0.105 10.712 -3.632 1.00 0.00 C ATOM 245 C LEU A 16 0.294 9.210 -3.863 1.00 0.00 C ATOM 246 O LEU A 16 1.350 8.655 -3.563 1.00 0.00 O ATOM 247 CB LEU A 16 -0.699 11.058 -2.371 1.00 0.00 C ATOM 248 CG LEU A 16 -0.093 10.531 -1.069 1.00 0.00 C ATOM 249 CD1 LEU A 16 1.348 10.991 -0.866 1.00 0.00 C ATOM 250 CD2 LEU A 16 -0.967 11.014 0.094 1.00 0.00 C ATOM 0 H LEU A 16 -1.511 11.676 -4.510 1.00 0.00 H new ATOM 0 HA LEU A 16 1.104 11.131 -3.510 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.793 12.142 -2.301 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.707 10.657 -2.476 1.00 0.00 H new ATOM 0 HG LEU A 16 -0.068 9.442 -1.115 1.00 0.00 H new ATOM 0 HD11 LEU A 16 1.730 10.589 0.073 1.00 0.00 H new ATOM 0 HD12 LEU A 16 1.964 10.633 -1.691 1.00 0.00 H new ATOM 0 HD13 LEU A 16 1.381 12.080 -0.834 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -0.554 10.650 1.035 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -0.989 12.104 0.105 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -1.980 10.632 -0.029 1.00 0.00 H new ATOM 262 N ALA A 17 -0.719 8.543 -4.436 1.00 0.00 N ATOM 263 CA ALA A 17 -0.618 7.156 -4.834 1.00 0.00 C ATOM 264 C ALA A 17 0.419 6.998 -5.943 1.00 0.00 C ATOM 265 O ALA A 17 1.239 6.096 -5.851 1.00 0.00 O ATOM 266 CB ALA A 17 -1.970 6.598 -5.280 1.00 0.00 C ATOM 0 H ALA A 17 -1.628 8.963 -4.631 1.00 0.00 H new ATOM 0 HA ALA A 17 -0.297 6.582 -3.965 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -1.854 5.554 -5.571 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -2.682 6.669 -4.458 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -2.339 7.173 -6.129 1.00 0.00 H new ATOM 272 N ALA A 18 0.411 7.858 -6.966 1.00 0.00 N ATOM 273 CA ALA A 18 1.368 7.823 -8.066 1.00 0.00 C ATOM 274 C ALA A 18 2.811 7.975 -7.572 1.00 0.00 C ATOM 275 O ALA A 18 3.723 7.383 -8.154 1.00 0.00 O ATOM 276 CB ALA A 18 1.031 8.918 -9.084 1.00 0.00 C ATOM 0 H ALA A 18 -0.274 8.609 -7.050 1.00 0.00 H new ATOM 0 HA ALA A 18 1.292 6.847 -8.546 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.749 8.887 -9.903 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.027 8.754 -9.475 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.077 9.893 -8.598 1.00 0.00 H new ATOM 282 N GLU A 19 3.041 8.773 -6.530 1.00 0.00 N ATOM 283 CA GLU A 19 4.353 8.950 -5.916 1.00 0.00 C ATOM 284 C GLU A 19 4.739 7.709 -5.101 1.00 0.00 C ATOM 285 O GLU A 19 5.906 7.319 -5.105 1.00 0.00 O ATOM 286 CB GLU A 19 4.373 10.243 -5.082 1.00 0.00 C ATOM 287 CG GLU A 19 4.324 11.466 -6.005 1.00 0.00 C ATOM 288 CD GLU A 19 4.447 12.815 -5.294 1.00 0.00 C ATOM 289 OE1 GLU A 19 3.749 13.070 -4.286 1.00 0.00 O ATOM 290 OE2 GLU A 19 5.199 13.679 -5.809 1.00 0.00 O ATOM 0 H GLU A 19 2.308 9.323 -6.083 1.00 0.00 H new ATOM 0 HA GLU A 19 5.109 9.057 -6.694 1.00 0.00 H new ATOM 0 HB2 GLU A 19 3.523 10.258 -4.400 1.00 0.00 H new ATOM 0 HB3 GLU A 19 5.274 10.276 -4.469 1.00 0.00 H new ATOM 0 HG2 GLU A 19 5.127 11.383 -6.737 1.00 0.00 H new ATOM 0 HG3 GLU A 19 3.385 11.448 -6.559 1.00 0.00 H new ATOM 297 N ALA A 20 3.782 7.052 -4.440 1.00 0.00 N ATOM 298 CA ALA A 20 4.016 5.789 -3.747 1.00 0.00 C ATOM 299 C ALA A 20 4.332 4.673 -4.734 1.00 0.00 C ATOM 300 O ALA A 20 5.290 3.943 -4.532 1.00 0.00 O ATOM 301 CB ALA A 20 2.798 5.429 -2.892 1.00 0.00 C ATOM 0 H ALA A 20 2.820 7.385 -4.372 1.00 0.00 H new ATOM 0 HA ALA A 20 4.881 5.908 -3.095 1.00 0.00 H new ATOM 0 HB1 ALA A 20 2.980 4.485 -2.378 1.00 0.00 H new ATOM 0 HB2 ALA A 20 2.624 6.215 -2.157 1.00 0.00 H new ATOM 0 HB3 ALA A 20 1.921 5.330 -3.532 1.00 0.00 H new ATOM 307 N ILE A 21 3.563 4.573 -5.816 1.00 0.00 N ATOM 308 CA ILE A 21 3.751 3.658 -6.937 1.00 0.00 C ATOM 309 C ILE A 21 5.166 3.815 -7.500 1.00 0.00 C ATOM 310 O ILE A 21 5.808 2.828 -7.858 1.00 0.00 O ATOM 311 CB ILE A 21 2.622 3.952 -7.962 1.00 0.00 C ATOM 312 CG1 ILE A 21 1.300 3.320 -7.474 1.00 0.00 C ATOM 313 CG2 ILE A 21 2.943 3.512 -9.397 1.00 0.00 C ATOM 314 CD1 ILE A 21 0.048 3.851 -8.183 1.00 0.00 C ATOM 0 H ILE A 21 2.742 5.165 -5.940 1.00 0.00 H new ATOM 0 HA ILE A 21 3.673 2.612 -6.642 1.00 0.00 H new ATOM 0 HB ILE A 21 2.524 5.036 -8.012 1.00 0.00 H new ATOM 0 HG12 ILE A 21 1.353 2.240 -7.615 1.00 0.00 H new ATOM 0 HG13 ILE A 21 1.200 3.497 -6.403 1.00 0.00 H new ATOM 0 HG21 ILE A 21 2.103 3.754 -10.048 1.00 0.00 H new ATOM 0 HG22 ILE A 21 3.835 4.033 -9.746 1.00 0.00 H new ATOM 0 HG23 ILE A 21 3.120 2.437 -9.417 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -0.836 3.355 -7.781 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -0.034 4.926 -8.021 1.00 0.00 H new ATOM 0 HD13 ILE A 21 0.122 3.650 -9.252 1.00 0.00 H new ATOM 326 N GLU A 22 5.688 5.041 -7.545 1.00 0.00 N ATOM 327 CA GLU A 22 7.013 5.299 -8.085 1.00 0.00 C ATOM 328 C GLU A 22 8.099 4.743 -7.127 1.00 0.00 C ATOM 329 O GLU A 22 9.260 4.612 -7.524 1.00 0.00 O ATOM 330 CB GLU A 22 7.126 6.815 -8.337 1.00 0.00 C ATOM 331 CG GLU A 22 8.443 7.296 -8.954 1.00 0.00 C ATOM 332 CD GLU A 22 8.484 6.971 -10.446 1.00 0.00 C ATOM 333 OE1 GLU A 22 8.522 5.779 -10.820 1.00 0.00 O ATOM 334 OE2 GLU A 22 8.358 7.930 -11.249 1.00 0.00 O ATOM 0 H GLU A 22 5.204 5.874 -7.210 1.00 0.00 H new ATOM 0 HA GLU A 22 7.171 4.785 -9.033 1.00 0.00 H new ATOM 0 HB2 GLU A 22 6.309 7.116 -8.993 1.00 0.00 H new ATOM 0 HB3 GLU A 22 6.981 7.333 -7.389 1.00 0.00 H new ATOM 0 HG2 GLU A 22 8.549 8.371 -8.807 1.00 0.00 H new ATOM 0 HG3 GLU A 22 9.283 6.820 -8.449 1.00 0.00 H new ATOM 341 N ARG A 23 7.751 4.358 -5.890 1.00 0.00 N ATOM 342 CA ARG A 23 8.665 3.826 -4.879 1.00 0.00 C ATOM 343 C ARG A 23 8.235 2.431 -4.405 1.00 0.00 C ATOM 344 O ARG A 23 8.816 1.915 -3.448 1.00 0.00 O ATOM 345 CB ARG A 23 8.691 4.802 -3.686 1.00 0.00 C ATOM 346 CG ARG A 23 10.064 4.792 -3.009 1.00 0.00 C ATOM 347 CD ARG A 23 10.133 5.869 -1.927 1.00 0.00 C ATOM 348 NE ARG A 23 11.496 6.396 -1.745 1.00 0.00 N ATOM 349 CZ ARG A 23 11.885 7.240 -0.785 1.00 0.00 C ATOM 350 NH1 ARG A 23 11.091 7.470 0.253 1.00 0.00 N ATOM 351 NH2 ARG A 23 13.038 7.885 -0.885 1.00 0.00 N ATOM 0 H ARG A 23 6.788 4.412 -5.558 1.00 0.00 H new ATOM 0 HA ARG A 23 9.658 3.728 -5.317 1.00 0.00 H new ATOM 0 HB2 ARG A 23 8.456 5.810 -4.029 1.00 0.00 H new ATOM 0 HB3 ARG A 23 7.922 4.524 -2.965 1.00 0.00 H new ATOM 0 HG2 ARG A 23 10.252 3.813 -2.569 1.00 0.00 H new ATOM 0 HG3 ARG A 23 10.844 4.963 -3.751 1.00 0.00 H new ATOM 0 HD2 ARG A 23 9.462 6.687 -2.189 1.00 0.00 H new ATOM 0 HD3 ARG A 23 9.777 5.455 -0.983 1.00 0.00 H new ATOM 0 HE ARG A 23 12.206 6.090 -2.411 1.00 0.00 H new ATOM 0 HH11 ARG A 23 10.186 7.003 0.316 1.00 0.00 H new ATOM 0 HH12 ARG A 23 11.385 8.114 0.987 1.00 0.00 H new ATOM 0 HH21 ARG A 23 13.635 7.739 -1.699 1.00 0.00 H new ATOM 0 HH22 ARG A 23 13.328 8.528 -0.148 1.00 0.00 H new ATOM 365 N ASP A 24 7.217 1.822 -5.014 1.00 0.00 N ATOM 366 CA ASP A 24 6.648 0.559 -4.553 1.00 0.00 C ATOM 367 C ASP A 24 6.204 -0.304 -5.742 1.00 0.00 C ATOM 368 O ASP A 24 5.182 0.003 -6.368 1.00 0.00 O ATOM 369 CB ASP A 24 5.471 0.828 -3.608 1.00 0.00 C ATOM 370 CG ASP A 24 4.901 -0.441 -2.986 1.00 0.00 C ATOM 371 OD1 ASP A 24 5.193 -1.555 -3.473 1.00 0.00 O ATOM 372 OD2 ASP A 24 4.118 -0.317 -2.030 1.00 0.00 O ATOM 0 H ASP A 24 6.762 2.196 -5.847 1.00 0.00 H new ATOM 0 HA ASP A 24 7.415 0.009 -4.008 1.00 0.00 H new ATOM 0 HB2 ASP A 24 5.797 1.500 -2.814 1.00 0.00 H new ATOM 0 HB3 ASP A 24 4.682 1.342 -4.157 1.00 0.00 H new ATOM 377 N PRO A 25 6.922 -1.400 -6.058 1.00 0.00 N ATOM 378 CA PRO A 25 6.551 -2.288 -7.150 1.00 0.00 C ATOM 379 C PRO A 25 5.205 -2.981 -6.917 1.00 0.00 C ATOM 380 O PRO A 25 4.520 -3.299 -7.891 1.00 0.00 O ATOM 381 CB PRO A 25 7.682 -3.318 -7.250 1.00 0.00 C ATOM 382 CG PRO A 25 8.291 -3.336 -5.852 1.00 0.00 C ATOM 383 CD PRO A 25 8.111 -1.899 -5.376 1.00 0.00 C ATOM 0 HA PRO A 25 6.425 -1.721 -8.073 1.00 0.00 H new ATOM 0 HB2 PRO A 25 7.303 -4.300 -7.533 1.00 0.00 H new ATOM 0 HB3 PRO A 25 8.417 -3.031 -8.002 1.00 0.00 H new ATOM 0 HG2 PRO A 25 7.780 -4.044 -5.199 1.00 0.00 H new ATOM 0 HG3 PRO A 25 9.342 -3.624 -5.874 1.00 0.00 H new ATOM 0 HD2 PRO A 25 7.987 -1.858 -4.294 1.00 0.00 H new ATOM 0 HD3 PRO A 25 8.984 -1.294 -5.620 1.00 0.00 H new ATOM 391 N TRP A 26 4.808 -3.229 -5.667 1.00 0.00 N ATOM 392 CA TRP A 26 3.525 -3.830 -5.345 1.00 0.00 C ATOM 393 C TRP A 26 2.420 -2.787 -5.442 1.00 0.00 C ATOM 394 O TRP A 26 1.375 -3.114 -6.000 1.00 0.00 O ATOM 395 CB TRP A 26 3.560 -4.458 -3.952 1.00 0.00 C ATOM 396 CG TRP A 26 2.263 -5.037 -3.473 1.00 0.00 C ATOM 397 CD1 TRP A 26 1.677 -4.714 -2.302 1.00 0.00 C ATOM 398 CD2 TRP A 26 1.386 -6.030 -4.089 1.00 0.00 C ATOM 399 NE1 TRP A 26 0.486 -5.395 -2.167 1.00 0.00 N ATOM 400 CE2 TRP A 26 0.265 -6.239 -3.234 1.00 0.00 C ATOM 401 CE3 TRP A 26 1.440 -6.809 -5.262 1.00 0.00 C ATOM 402 CZ2 TRP A 26 -0.743 -7.170 -3.531 1.00 0.00 C ATOM 403 CZ3 TRP A 26 0.459 -7.775 -5.554 1.00 0.00 C ATOM 404 CH2 TRP A 26 -0.634 -7.955 -4.690 1.00 0.00 C ATOM 0 H TRP A 26 5.377 -3.014 -4.848 1.00 0.00 H new ATOM 0 HA TRP A 26 3.318 -4.621 -6.065 1.00 0.00 H new ATOM 0 HB2 TRP A 26 4.314 -5.245 -3.946 1.00 0.00 H new ATOM 0 HB3 TRP A 26 3.885 -3.700 -3.239 1.00 0.00 H new ATOM 0 HD1 TRP A 26 2.081 -4.023 -1.577 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -0.151 -5.288 -1.378 1.00 0.00 H new ATOM 0 HE3 TRP A 26 2.255 -6.661 -5.955 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -1.593 -7.281 -2.875 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 0.547 -8.380 -6.445 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -1.388 -8.695 -4.916 1.00 0.00 H new ATOM 415 N ALA A 27 2.613 -1.539 -4.984 1.00 0.00 N ATOM 416 CA ALA A 27 1.579 -0.527 -5.208 1.00 0.00 C ATOM 417 C ALA A 27 1.329 -0.381 -6.716 1.00 0.00 C ATOM 418 O ALA A 27 0.178 -0.283 -7.147 1.00 0.00 O ATOM 419 CB ALA A 27 1.963 0.831 -4.617 1.00 0.00 C ATOM 0 H ALA A 27 3.439 -1.220 -4.478 1.00 0.00 H new ATOM 0 HA ALA A 27 0.672 -0.860 -4.703 1.00 0.00 H new ATOM 0 HB1 ALA A 27 1.166 1.549 -4.808 1.00 0.00 H new ATOM 0 HB2 ALA A 27 2.112 0.731 -3.542 1.00 0.00 H new ATOM 0 HB3 ALA A 27 2.886 1.181 -5.080 1.00 0.00 H new ATOM 425 N ALA A 28 2.403 -0.406 -7.517 1.00 0.00 N ATOM 426 CA ALA A 28 2.347 -0.318 -8.968 1.00 0.00 C ATOM 427 C ALA A 28 1.548 -1.488 -9.541 1.00 0.00 C ATOM 428 O ALA A 28 0.726 -1.296 -10.440 1.00 0.00 O ATOM 429 CB ALA A 28 3.768 -0.292 -9.548 1.00 0.00 C ATOM 0 H ALA A 28 3.354 -0.490 -7.157 1.00 0.00 H new ATOM 0 HA ALA A 28 1.842 0.607 -9.248 1.00 0.00 H new ATOM 0 HB1 ALA A 28 3.716 -0.226 -10.635 1.00 0.00 H new ATOM 0 HB2 ALA A 28 4.305 0.572 -9.157 1.00 0.00 H new ATOM 0 HB3 ALA A 28 4.293 -1.204 -9.264 1.00 0.00 H new ATOM 435 N GLN A 29 1.771 -2.695 -9.025 1.00 0.00 N ATOM 436 CA GLN A 29 1.016 -3.876 -9.417 1.00 0.00 C ATOM 437 C GLN A 29 -0.456 -3.708 -9.050 1.00 0.00 C ATOM 438 O GLN A 29 -1.307 -3.851 -9.923 1.00 0.00 O ATOM 439 CB GLN A 29 1.630 -5.134 -8.789 1.00 0.00 C ATOM 440 CG GLN A 29 2.867 -5.555 -9.590 1.00 0.00 C ATOM 441 CD GLN A 29 3.551 -6.791 -9.011 1.00 0.00 C ATOM 442 OE1 GLN A 29 3.721 -6.926 -7.804 1.00 0.00 O ATOM 443 NE2 GLN A 29 3.944 -7.740 -9.840 1.00 0.00 N ATOM 0 H GLN A 29 2.485 -2.879 -8.320 1.00 0.00 H new ATOM 0 HA GLN A 29 1.070 -3.996 -10.499 1.00 0.00 H new ATOM 0 HB2 GLN A 29 1.904 -4.939 -7.752 1.00 0.00 H new ATOM 0 HB3 GLN A 29 0.898 -5.942 -8.778 1.00 0.00 H new ATOM 0 HG2 GLN A 29 2.576 -5.755 -10.621 1.00 0.00 H new ATOM 0 HG3 GLN A 29 3.578 -4.729 -9.614 1.00 0.00 H new ATOM 0 HE21 GLN A 29 3.804 -7.630 -10.844 1.00 0.00 H new ATOM 0 HE22 GLN A 29 4.388 -8.583 -9.476 1.00 0.00 H new ATOM 452 N VAL A 30 -0.788 -3.374 -7.802 1.00 0.00 N ATOM 453 CA VAL A 30 -2.181 -3.312 -7.358 1.00 0.00 C ATOM 454 C VAL A 30 -2.946 -2.266 -8.169 1.00 0.00 C ATOM 455 O VAL A 30 -4.084 -2.522 -8.569 1.00 0.00 O ATOM 456 CB VAL A 30 -2.255 -3.053 -5.836 1.00 0.00 C ATOM 457 CG1 VAL A 30 -3.691 -2.848 -5.320 1.00 0.00 C ATOM 458 CG2 VAL A 30 -1.670 -4.242 -5.066 1.00 0.00 C ATOM 0 H VAL A 30 -0.108 -3.141 -7.078 1.00 0.00 H new ATOM 0 HA VAL A 30 -2.661 -4.274 -7.537 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.687 -2.138 -5.670 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -3.669 -2.671 -4.245 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.138 -1.989 -5.820 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -4.283 -3.739 -5.529 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.728 -4.046 -3.995 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -2.237 -5.143 -5.302 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -0.628 -4.384 -5.353 1.00 0.00 H new ATOM 468 N SER A 31 -2.329 -1.122 -8.472 1.00 0.00 N ATOM 469 CA SER A 31 -2.991 -0.107 -9.270 1.00 0.00 C ATOM 470 C SER A 31 -3.138 -0.523 -10.727 1.00 0.00 C ATOM 471 O SER A 31 -4.046 -0.024 -11.397 1.00 0.00 O ATOM 472 CB SER A 31 -2.301 1.248 -9.108 1.00 0.00 C ATOM 473 OG SER A 31 -3.093 2.074 -8.274 1.00 0.00 O ATOM 0 H SER A 31 -1.382 -0.883 -8.177 1.00 0.00 H new ATOM 0 HA SER A 31 -4.008 0.002 -8.892 1.00 0.00 H new ATOM 0 HB2 SER A 31 -1.310 1.116 -8.674 1.00 0.00 H new ATOM 0 HB3 SER A 31 -2.163 1.719 -10.081 1.00 0.00 H new ATOM 0 HG SER A 31 -2.963 3.012 -8.524 1.00 0.00 H new ATOM 479 N GLN A 32 -2.304 -1.435 -11.227 1.00 0.00 N ATOM 480 CA GLN A 32 -2.490 -1.969 -12.561 1.00 0.00 C ATOM 481 C GLN A 32 -3.722 -2.878 -12.492 1.00 0.00 C ATOM 482 O GLN A 32 -4.677 -2.664 -13.241 1.00 0.00 O ATOM 483 CB GLN A 32 -1.217 -2.685 -13.033 1.00 0.00 C ATOM 484 CG GLN A 32 -1.395 -3.233 -14.452 1.00 0.00 C ATOM 485 CD GLN A 32 -0.056 -3.592 -15.089 1.00 0.00 C ATOM 486 OE1 GLN A 32 0.829 -2.746 -15.206 1.00 0.00 O ATOM 487 NE2 GLN A 32 0.120 -4.824 -15.532 1.00 0.00 N ATOM 0 H GLN A 32 -1.500 -1.813 -10.726 1.00 0.00 H new ATOM 0 HA GLN A 32 -2.664 -1.190 -13.303 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -0.375 -1.993 -13.009 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -0.979 -3.501 -12.351 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -2.033 -4.116 -14.424 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -1.904 -2.491 -15.068 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -0.623 -5.515 -15.428 1.00 0.00 H new ATOM 0 HE22 GLN A 32 0.999 -5.085 -15.978 1.00 0.00 H new ATOM 496 N LEU A 33 -3.736 -3.805 -11.522 1.00 0.00 N ATOM 497 CA LEU A 33 -4.776 -4.818 -11.332 1.00 0.00 C ATOM 498 C LEU A 33 -6.149 -4.169 -11.246 1.00 0.00 C ATOM 499 O LEU A 33 -7.092 -4.612 -11.898 1.00 0.00 O ATOM 500 CB LEU A 33 -4.547 -5.628 -10.040 1.00 0.00 C ATOM 501 CG LEU A 33 -3.321 -6.546 -10.007 1.00 0.00 C ATOM 502 CD1 LEU A 33 -3.204 -7.282 -8.666 1.00 0.00 C ATOM 503 CD2 LEU A 33 -3.409 -7.548 -11.150 1.00 0.00 C ATOM 0 H LEU A 33 -2.994 -3.869 -10.825 1.00 0.00 H new ATOM 0 HA LEU A 33 -4.727 -5.485 -12.192 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -4.469 -4.927 -9.209 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -5.432 -6.238 -9.860 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.429 -5.931 -10.123 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -2.323 -7.924 -8.679 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -3.112 -6.555 -7.859 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -4.094 -7.891 -8.506 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -2.537 -8.202 -11.128 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.314 -8.146 -11.041 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -3.439 -7.015 -12.100 1.00 0.00 H new ATOM 515 N SER A 34 -6.237 -3.111 -10.442 1.00 0.00 N ATOM 516 CA SER A 34 -7.456 -2.374 -10.137 1.00 0.00 C ATOM 517 C SER A 34 -8.484 -3.320 -9.502 1.00 0.00 C ATOM 518 O SER A 34 -9.415 -3.807 -10.152 1.00 0.00 O ATOM 519 CB SER A 34 -7.954 -1.643 -11.391 1.00 0.00 C ATOM 520 OG SER A 34 -6.890 -0.926 -11.992 1.00 0.00 O ATOM 0 H SER A 34 -5.421 -2.729 -9.965 1.00 0.00 H new ATOM 0 HA SER A 34 -7.266 -1.595 -9.398 1.00 0.00 H new ATOM 0 HB2 SER A 34 -8.365 -2.361 -12.101 1.00 0.00 H new ATOM 0 HB3 SER A 34 -8.760 -0.959 -11.126 1.00 0.00 H new ATOM 0 HG SER A 34 -6.277 -1.554 -12.428 1.00 0.00 H new ATOM 526 N LEU A 35 -8.266 -3.625 -8.221 1.00 0.00 N ATOM 527 CA LEU A 35 -9.090 -4.517 -7.396 1.00 0.00 C ATOM 528 C LEU A 35 -10.475 -3.904 -7.135 1.00 0.00 C ATOM 529 O LEU A 35 -10.697 -2.760 -7.532 1.00 0.00 O ATOM 530 CB LEU A 35 -8.327 -4.806 -6.082 1.00 0.00 C ATOM 531 CG LEU A 35 -7.445 -6.065 -6.164 1.00 0.00 C ATOM 532 CD1 LEU A 35 -6.418 -6.008 -7.287 1.00 0.00 C ATOM 533 CD2 LEU A 35 -6.687 -6.269 -4.857 1.00 0.00 C ATOM 0 H LEU A 35 -7.475 -3.240 -7.705 1.00 0.00 H new ATOM 0 HA LEU A 35 -9.266 -5.456 -7.920 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -7.703 -3.947 -5.834 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -9.044 -4.924 -5.270 1.00 0.00 H new ATOM 0 HG LEU A 35 -8.129 -6.890 -6.362 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -5.830 -6.926 -7.289 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -6.930 -5.903 -8.243 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.758 -5.154 -7.133 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -6.068 -7.163 -4.931 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -6.053 -5.403 -4.665 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -7.398 -6.386 -4.039 1.00 0.00 H new ATOM 545 N PRO A 36 -11.421 -4.643 -6.512 1.00 0.00 N ATOM 546 CA PRO A 36 -12.716 -4.097 -6.102 1.00 0.00 C ATOM 547 C PRO A 36 -12.450 -3.133 -4.932 1.00 0.00 C ATOM 548 O PRO A 36 -11.856 -2.083 -5.156 1.00 0.00 O ATOM 549 CB PRO A 36 -13.589 -5.321 -5.796 1.00 0.00 C ATOM 550 CG PRO A 36 -12.587 -6.392 -5.380 1.00 0.00 C ATOM 551 CD PRO A 36 -11.385 -6.084 -6.271 1.00 0.00 C ATOM 0 HA PRO A 36 -13.249 -3.503 -6.844 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -14.304 -5.113 -5.000 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -14.164 -5.630 -6.669 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -12.336 -6.323 -4.322 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -12.972 -7.397 -5.552 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -10.454 -6.375 -5.785 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -11.442 -6.638 -7.208 1.00 0.00 H new ATOM 559 N LYS A 37 -12.818 -3.433 -3.678 1.00 0.00 N ATOM 560 CA LYS A 37 -12.420 -2.554 -2.569 1.00 0.00 C ATOM 561 C LYS A 37 -12.158 -3.284 -1.274 1.00 0.00 C ATOM 562 O LYS A 37 -11.175 -2.994 -0.603 1.00 0.00 O ATOM 563 CB LYS A 37 -13.401 -1.396 -2.379 1.00 0.00 C ATOM 564 CG LYS A 37 -12.638 -0.171 -1.839 1.00 0.00 C ATOM 565 CD LYS A 37 -13.284 1.153 -2.256 1.00 0.00 C ATOM 566 CE LYS A 37 -12.311 2.328 -2.106 1.00 0.00 C ATOM 567 NZ LYS A 37 -11.159 2.240 -3.028 1.00 0.00 N ATOM 0 H LYS A 37 -13.371 -4.248 -3.411 1.00 0.00 H new ATOM 0 HA LYS A 37 -11.460 -2.132 -2.865 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -13.882 -1.152 -3.326 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -14.191 -1.683 -1.685 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -12.596 -0.224 -0.751 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -11.610 -0.199 -2.200 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -13.617 1.086 -3.292 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -14.170 1.334 -1.647 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -12.845 3.261 -2.287 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -11.947 2.363 -1.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -10.770 3.191 -3.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -10.426 1.632 -2.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -11.470 1.835 -3.934 1.00 0.00 H new ATOM 581 N LEU A 38 -12.978 -4.279 -0.956 1.00 0.00 N ATOM 582 CA LEU A 38 -12.749 -5.140 0.199 1.00 0.00 C ATOM 583 C LEU A 38 -11.388 -5.815 0.018 1.00 0.00 C ATOM 584 O LEU A 38 -10.499 -5.718 0.861 1.00 0.00 O ATOM 585 CB LEU A 38 -13.914 -6.146 0.314 1.00 0.00 C ATOM 586 CG LEU A 38 -13.962 -6.997 1.598 1.00 0.00 C ATOM 587 CD1 LEU A 38 -12.810 -7.998 1.732 1.00 0.00 C ATOM 588 CD2 LEU A 38 -14.047 -6.120 2.850 1.00 0.00 C ATOM 0 H LEU A 38 -13.816 -4.511 -1.488 1.00 0.00 H new ATOM 0 HA LEU A 38 -12.724 -4.578 1.133 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -14.851 -5.594 0.235 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -13.868 -6.820 -0.541 1.00 0.00 H new ATOM 0 HG LEU A 38 -14.873 -7.588 1.508 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -12.919 -8.556 2.662 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -12.829 -8.690 0.890 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -11.861 -7.462 1.740 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -14.079 -6.753 3.736 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -13.173 -5.471 2.899 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -14.950 -5.511 2.807 1.00 0.00 H new ATOM 600 N VAL A 39 -11.206 -6.459 -1.134 1.00 0.00 N ATOM 601 CA VAL A 39 -9.977 -7.167 -1.468 1.00 0.00 C ATOM 602 C VAL A 39 -8.845 -6.166 -1.734 1.00 0.00 C ATOM 603 O VAL A 39 -7.686 -6.479 -1.468 1.00 0.00 O ATOM 604 CB VAL A 39 -10.246 -8.134 -2.640 1.00 0.00 C ATOM 605 CG1 VAL A 39 -9.050 -9.048 -2.921 1.00 0.00 C ATOM 606 CG2 VAL A 39 -11.472 -9.008 -2.326 1.00 0.00 C ATOM 0 H VAL A 39 -11.915 -6.503 -1.866 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.643 -7.777 -0.629 1.00 0.00 H new ATOM 0 HB VAL A 39 -10.425 -7.523 -3.525 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -9.286 -9.711 -3.754 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -8.181 -8.442 -3.175 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -8.831 -9.643 -2.035 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -11.656 -9.688 -3.157 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -11.285 -9.584 -1.420 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -12.344 -8.371 -2.178 1.00 0.00 H new ATOM 616 N GLU A 40 -9.154 -4.955 -2.217 1.00 0.00 N ATOM 617 CA GLU A 40 -8.152 -3.902 -2.370 1.00 0.00 C ATOM 618 C GLU A 40 -7.585 -3.597 -0.979 1.00 0.00 C ATOM 619 O GLU A 40 -6.370 -3.516 -0.843 1.00 0.00 O ATOM 620 CB GLU A 40 -8.766 -2.651 -3.017 1.00 0.00 C ATOM 621 CG GLU A 40 -7.770 -1.509 -3.247 1.00 0.00 C ATOM 622 CD GLU A 40 -8.486 -0.219 -3.660 1.00 0.00 C ATOM 623 OE1 GLU A 40 -9.081 0.451 -2.785 1.00 0.00 O ATOM 624 OE2 GLU A 40 -8.490 0.144 -4.858 1.00 0.00 O ATOM 0 H GLU A 40 -10.093 -4.684 -2.508 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.351 -4.230 -3.032 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -9.208 -2.930 -3.973 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -9.577 -2.289 -2.384 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.198 -1.334 -2.336 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -7.058 -1.795 -4.021 1.00 0.00 H new ATOM 631 N GLN A 41 -8.425 -3.512 0.066 1.00 0.00 N ATOM 632 CA GLN A 41 -7.960 -3.271 1.426 1.00 0.00 C ATOM 633 C GLN A 41 -6.966 -4.351 1.840 1.00 0.00 C ATOM 634 O GLN A 41 -5.952 -4.002 2.430 1.00 0.00 O ATOM 635 CB GLN A 41 -9.119 -3.176 2.440 1.00 0.00 C ATOM 636 CG GLN A 41 -8.656 -2.463 3.725 1.00 0.00 C ATOM 637 CD GLN A 41 -9.786 -2.135 4.699 1.00 0.00 C ATOM 638 OE1 GLN A 41 -9.769 -2.553 5.851 1.00 0.00 O ATOM 639 NE2 GLN A 41 -10.760 -1.347 4.284 1.00 0.00 N ATOM 0 H GLN A 41 -9.437 -3.609 -0.016 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.461 -2.302 1.431 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -9.954 -2.633 1.997 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.481 -4.175 2.682 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -7.924 -3.092 4.233 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.147 -1.539 3.451 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -10.765 -1.005 3.323 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -11.508 -1.080 4.924 1.00 0.00 H new ATOM 648 N VAL A 42 -7.215 -5.626 1.526 1.00 0.00 N ATOM 649 CA VAL A 42 -6.294 -6.728 1.816 1.00 0.00 C ATOM 650 C VAL A 42 -4.962 -6.497 1.116 1.00 0.00 C ATOM 651 O VAL A 42 -3.929 -6.456 1.781 1.00 0.00 O ATOM 652 CB VAL A 42 -6.929 -8.078 1.425 1.00 0.00 C ATOM 653 CG1 VAL A 42 -5.953 -9.265 1.409 1.00 0.00 C ATOM 654 CG2 VAL A 42 -8.031 -8.378 2.434 1.00 0.00 C ATOM 0 H VAL A 42 -8.071 -5.925 1.058 1.00 0.00 H new ATOM 0 HA VAL A 42 -6.099 -6.762 2.888 1.00 0.00 H new ATOM 0 HB VAL A 42 -7.294 -7.972 0.404 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -6.487 -10.171 1.124 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -5.157 -9.072 0.690 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -5.522 -9.395 2.402 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -8.502 -9.329 2.186 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -7.602 -8.435 3.435 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -8.778 -7.584 2.404 1.00 0.00 H new ATOM 664 N ALA A 43 -4.988 -6.336 -0.209 1.00 0.00 N ATOM 665 CA ALA A 43 -3.788 -6.133 -1.005 1.00 0.00 C ATOM 666 C ALA A 43 -2.993 -4.930 -0.500 1.00 0.00 C ATOM 667 O ALA A 43 -1.765 -4.942 -0.526 1.00 0.00 O ATOM 668 CB ALA A 43 -4.191 -5.933 -2.466 1.00 0.00 C ATOM 0 H ALA A 43 -5.848 -6.344 -0.757 1.00 0.00 H new ATOM 0 HA ALA A 43 -3.147 -7.010 -0.917 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -3.298 -5.780 -3.072 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -4.723 -6.816 -2.821 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.839 -5.061 -2.548 1.00 0.00 H new ATOM 674 N LEU A 44 -3.696 -3.897 -0.043 1.00 0.00 N ATOM 675 CA LEU A 44 -3.113 -2.655 0.408 1.00 0.00 C ATOM 676 C LEU A 44 -2.602 -2.760 1.838 1.00 0.00 C ATOM 677 O LEU A 44 -1.690 -2.019 2.196 1.00 0.00 O ATOM 678 CB LEU A 44 -4.115 -1.494 0.281 1.00 0.00 C ATOM 679 CG LEU A 44 -4.356 -0.970 -1.150 1.00 0.00 C ATOM 680 CD1 LEU A 44 -5.329 0.213 -1.065 1.00 0.00 C ATOM 681 CD2 LEU A 44 -3.078 -0.497 -1.859 1.00 0.00 C ATOM 0 H LEU A 44 -4.714 -3.910 0.022 1.00 0.00 H new ATOM 0 HA LEU A 44 -2.260 -2.448 -0.238 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -5.070 -1.816 0.696 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -3.763 -0.666 0.897 1.00 0.00 H new ATOM 0 HG LEU A 44 -4.753 -1.800 -1.735 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -5.516 0.603 -2.066 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -6.268 -0.120 -0.623 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -4.895 0.998 -0.446 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -3.327 -0.143 -2.859 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -2.625 0.314 -1.289 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -2.374 -1.326 -1.932 1.00 0.00 H new ATOM 693 N ASN A 45 -3.164 -3.655 2.661 1.00 0.00 N ATOM 694 CA ASN A 45 -2.806 -3.769 4.073 1.00 0.00 C ATOM 695 C ASN A 45 -1.769 -4.853 4.318 1.00 0.00 C ATOM 696 O ASN A 45 -1.534 -5.224 5.475 1.00 0.00 O ATOM 697 CB ASN A 45 -4.058 -3.950 4.942 1.00 0.00 C ATOM 698 CG ASN A 45 -4.596 -2.572 5.266 1.00 0.00 C ATOM 699 OD1 ASN A 45 -4.153 -1.961 6.229 1.00 0.00 O ATOM 700 ND2 ASN A 45 -5.479 -2.033 4.452 1.00 0.00 N ATOM 0 H ASN A 45 -3.879 -4.318 2.363 1.00 0.00 H new ATOM 0 HA ASN A 45 -2.335 -2.832 4.370 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -4.808 -4.539 4.414 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -3.814 -4.490 5.857 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -5.811 -1.083 4.617 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -5.831 -2.566 3.657 1.00 0.00 H new ATOM 707 N ALA A 46 -1.143 -5.346 3.254 1.00 0.00 N ATOM 708 CA ALA A 46 -0.057 -6.287 3.327 1.00 0.00 C ATOM 709 C ALA A 46 1.115 -5.795 2.495 1.00 0.00 C ATOM 710 O ALA A 46 0.942 -4.989 1.581 1.00 0.00 O ATOM 711 CB ALA A 46 -0.559 -7.635 2.811 1.00 0.00 C ATOM 0 H ALA A 46 -1.391 -5.089 2.299 1.00 0.00 H new ATOM 0 HA ALA A 46 0.286 -6.392 4.356 1.00 0.00 H new ATOM 0 HB1 ALA A 46 0.248 -8.366 2.857 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.391 -7.974 3.428 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -0.893 -7.528 1.779 1.00 0.00 H new ATOM 717 N TRP A 47 2.298 -6.318 2.793 1.00 0.00 N ATOM 718 CA TRP A 47 3.511 -6.083 2.031 1.00 0.00 C ATOM 719 C TRP A 47 3.760 -7.383 1.282 1.00 0.00 C ATOM 720 O TRP A 47 3.656 -8.484 1.833 1.00 0.00 O ATOM 721 CB TRP A 47 4.689 -5.616 2.894 1.00 0.00 C ATOM 722 CG TRP A 47 5.205 -6.511 3.974 1.00 0.00 C ATOM 723 CD1 TRP A 47 4.774 -6.515 5.254 1.00 0.00 C ATOM 724 CD2 TRP A 47 6.286 -7.494 3.909 1.00 0.00 C ATOM 725 NE1 TRP A 47 5.557 -7.374 5.996 1.00 0.00 N ATOM 726 CE2 TRP A 47 6.502 -8.003 5.222 1.00 0.00 C ATOM 727 CE3 TRP A 47 7.111 -8.009 2.886 1.00 0.00 C ATOM 728 CZ2 TRP A 47 7.459 -8.986 5.507 1.00 0.00 C ATOM 729 CZ3 TRP A 47 8.082 -8.992 3.164 1.00 0.00 C ATOM 730 CH2 TRP A 47 8.248 -9.491 4.463 1.00 0.00 C ATOM 0 H TRP A 47 2.440 -6.934 3.594 1.00 0.00 H new ATOM 0 HA TRP A 47 3.398 -5.251 1.336 1.00 0.00 H new ATOM 0 HB2 TRP A 47 5.520 -5.399 2.223 1.00 0.00 H new ATOM 0 HB3 TRP A 47 4.401 -4.674 3.360 1.00 0.00 H new ATOM 0 HD1 TRP A 47 3.946 -5.936 5.636 1.00 0.00 H new ATOM 0 HE1 TRP A 47 5.448 -7.524 6.999 1.00 0.00 H new ATOM 0 HE3 TRP A 47 6.997 -7.645 1.876 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 7.587 -9.350 6.516 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 8.706 -9.366 2.366 1.00 0.00 H new ATOM 0 HH2 TRP A 47 8.980 -10.261 4.659 1.00 0.00 H new ATOM 741 N LYS A 48 3.972 -7.261 -0.021 1.00 0.00 N ATOM 742 CA LYS A 48 4.088 -8.390 -0.923 1.00 0.00 C ATOM 743 C LYS A 48 5.500 -8.936 -0.965 1.00 0.00 C ATOM 744 O LYS A 48 6.417 -8.256 -1.422 1.00 0.00 O ATOM 745 CB LYS A 48 3.601 -7.921 -2.300 1.00 0.00 C ATOM 746 CG LYS A 48 3.670 -8.955 -3.430 1.00 0.00 C ATOM 747 CD LYS A 48 4.567 -8.457 -4.577 1.00 0.00 C ATOM 748 CE LYS A 48 4.521 -9.406 -5.778 1.00 0.00 C ATOM 749 NZ LYS A 48 5.364 -8.923 -6.887 1.00 0.00 N ATOM 0 H LYS A 48 4.069 -6.358 -0.485 1.00 0.00 H new ATOM 0 HA LYS A 48 3.474 -9.221 -0.575 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.568 -7.588 -2.203 1.00 0.00 H new ATOM 0 HB3 LYS A 48 4.190 -7.052 -2.594 1.00 0.00 H new ATOM 0 HG2 LYS A 48 4.058 -9.897 -3.043 1.00 0.00 H new ATOM 0 HG3 LYS A 48 2.667 -9.154 -3.808 1.00 0.00 H new ATOM 0 HD2 LYS A 48 4.246 -7.462 -4.886 1.00 0.00 H new ATOM 0 HD3 LYS A 48 5.594 -8.365 -4.224 1.00 0.00 H new ATOM 0 HE2 LYS A 48 4.855 -10.397 -5.472 1.00 0.00 H new ATOM 0 HE3 LYS A 48 3.492 -9.509 -6.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 5.723 -9.735 -7.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 4.800 -8.312 -7.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 6.165 -8.381 -6.504 1.00 0.00 H new ATOM 763 N GLU A 49 5.655 -10.169 -0.509 1.00 0.00 N ATOM 764 CA GLU A 49 6.887 -10.914 -0.587 1.00 0.00 C ATOM 765 C GLU A 49 6.710 -11.900 -1.732 1.00 0.00 C ATOM 766 O GLU A 49 5.962 -12.870 -1.609 1.00 0.00 O ATOM 767 CB GLU A 49 7.152 -11.630 0.733 1.00 0.00 C ATOM 768 CG GLU A 49 8.408 -12.493 0.630 1.00 0.00 C ATOM 769 CD GLU A 49 9.054 -12.639 1.994 1.00 0.00 C ATOM 770 OE1 GLU A 49 8.596 -13.505 2.775 1.00 0.00 O ATOM 771 OE2 GLU A 49 9.984 -11.868 2.310 1.00 0.00 O ATOM 0 H GLU A 49 4.900 -10.689 -0.062 1.00 0.00 H new ATOM 0 HA GLU A 49 7.745 -10.267 -0.767 1.00 0.00 H new ATOM 0 HB2 GLU A 49 7.270 -10.899 1.533 1.00 0.00 H new ATOM 0 HB3 GLU A 49 6.296 -12.252 0.994 1.00 0.00 H new ATOM 0 HG2 GLU A 49 8.152 -13.475 0.233 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.113 -12.041 -0.068 1.00 0.00 H new ATOM 778 N GLU A 50 7.308 -11.622 -2.882 1.00 0.00 N ATOM 779 CA GLU A 50 7.312 -12.569 -3.982 1.00 0.00 C ATOM 780 C GLU A 50 8.413 -13.562 -3.634 1.00 0.00 C ATOM 781 O GLU A 50 9.599 -13.223 -3.616 1.00 0.00 O ATOM 782 CB GLU A 50 7.481 -11.829 -5.299 1.00 0.00 C ATOM 783 CG GLU A 50 7.461 -12.737 -6.538 1.00 0.00 C ATOM 784 CD GLU A 50 6.917 -12.002 -7.770 1.00 0.00 C ATOM 785 OE1 GLU A 50 7.137 -10.774 -7.881 1.00 0.00 O ATOM 786 OE2 GLU A 50 6.182 -12.617 -8.577 1.00 0.00 O ATOM 0 H GLU A 50 7.796 -10.747 -3.075 1.00 0.00 H new ATOM 0 HA GLU A 50 6.379 -13.116 -4.117 1.00 0.00 H new ATOM 0 HB2 GLU A 50 6.686 -11.089 -5.392 1.00 0.00 H new ATOM 0 HB3 GLU A 50 8.424 -11.283 -5.278 1.00 0.00 H new ATOM 0 HG2 GLU A 50 8.470 -13.095 -6.744 1.00 0.00 H new ATOM 0 HG3 GLU A 50 6.846 -13.614 -6.337 1.00 0.00 H new ATOM 793 N SER A 51 7.974 -14.742 -3.220 1.00 0.00 N ATOM 794 CA SER A 51 8.766 -15.841 -2.715 1.00 0.00 C ATOM 795 C SER A 51 9.207 -16.651 -3.940 1.00 0.00 C ATOM 796 O SER A 51 8.802 -16.325 -5.063 1.00 0.00 O ATOM 797 CB SER A 51 7.854 -16.592 -1.730 1.00 0.00 C ATOM 798 OG SER A 51 8.480 -17.614 -0.978 1.00 0.00 O ATOM 0 H SER A 51 6.979 -14.967 -3.232 1.00 0.00 H new ATOM 0 HA SER A 51 9.673 -15.569 -2.175 1.00 0.00 H new ATOM 0 HB2 SER A 51 7.422 -15.869 -1.038 1.00 0.00 H new ATOM 0 HB3 SER A 51 7.028 -17.031 -2.289 1.00 0.00 H new ATOM 0 HG SER A 51 7.823 -18.030 -0.382 1.00 0.00 H new ATOM 804 N ASP A 52 9.997 -17.708 -3.729 1.00 0.00 N ATOM 805 CA ASP A 52 10.631 -18.538 -4.760 1.00 0.00 C ATOM 806 C ASP A 52 9.698 -18.719 -5.959 1.00 0.00 C ATOM 807 O ASP A 52 10.018 -18.245 -7.050 1.00 0.00 O ATOM 808 CB ASP A 52 11.031 -19.875 -4.127 1.00 0.00 C ATOM 809 CG ASP A 52 11.783 -20.806 -5.075 1.00 0.00 C ATOM 810 OD1 ASP A 52 12.245 -20.363 -6.150 1.00 0.00 O ATOM 811 OD2 ASP A 52 11.967 -21.985 -4.694 1.00 0.00 O ATOM 0 H ASP A 52 10.224 -18.025 -2.786 1.00 0.00 H new ATOM 0 HA ASP A 52 11.528 -18.050 -5.141 1.00 0.00 H new ATOM 0 HB2 ASP A 52 11.654 -19.681 -3.254 1.00 0.00 H new ATOM 0 HB3 ASP A 52 10.133 -20.381 -3.772 1.00 0.00 H new ATOM 816 N ASN A 53 8.481 -19.219 -5.717 1.00 0.00 N ATOM 817 CA ASN A 53 7.414 -19.324 -6.703 1.00 0.00 C ATOM 818 C ASN A 53 6.071 -19.238 -5.976 1.00 0.00 C ATOM 819 O ASN A 53 5.195 -20.095 -6.120 1.00 0.00 O ATOM 820 CB ASN A 53 7.491 -20.525 -7.656 1.00 0.00 C ATOM 821 CG ASN A 53 6.431 -20.367 -8.756 1.00 0.00 C ATOM 822 OD1 ASN A 53 5.936 -19.269 -9.023 1.00 0.00 O ATOM 823 ND2 ASN A 53 6.069 -21.437 -9.433 1.00 0.00 N ATOM 0 H ASN A 53 8.209 -19.571 -4.799 1.00 0.00 H new ATOM 0 HA ASN A 53 7.537 -18.483 -7.386 1.00 0.00 H new ATOM 0 HB2 ASN A 53 8.485 -20.590 -8.099 1.00 0.00 H new ATOM 0 HB3 ASN A 53 7.326 -21.452 -7.106 1.00 0.00 H new ATOM 0 HD21 ASN A 53 5.378 -21.359 -10.179 1.00 0.00 H new ATOM 0 HD22 ASN A 53 6.479 -22.344 -9.211 1.00 0.00 H new ATOM 830 N ALA A 54 5.938 -18.236 -5.106 1.00 0.00 N ATOM 831 CA ALA A 54 4.696 -17.913 -4.426 1.00 0.00 C ATOM 832 C ALA A 54 4.688 -16.399 -4.235 1.00 0.00 C ATOM 833 O ALA A 54 5.700 -15.738 -4.489 1.00 0.00 O ATOM 834 CB ALA A 54 4.626 -18.675 -3.092 1.00 0.00 C ATOM 0 H ALA A 54 6.709 -17.618 -4.854 1.00 0.00 H new ATOM 0 HA ALA A 54 3.818 -18.212 -4.998 1.00 0.00 H new ATOM 0 HB1 ALA A 54 3.694 -18.432 -2.583 1.00 0.00 H new ATOM 0 HB2 ALA A 54 4.666 -19.747 -3.283 1.00 0.00 H new ATOM 0 HB3 ALA A 54 5.469 -18.387 -2.464 1.00 0.00 H new ATOM 840 N VAL A 55 3.571 -15.827 -3.806 1.00 0.00 N ATOM 841 CA VAL A 55 3.499 -14.410 -3.466 1.00 0.00 C ATOM 842 C VAL A 55 2.808 -14.340 -2.110 1.00 0.00 C ATOM 843 O VAL A 55 1.600 -14.512 -1.995 1.00 0.00 O ATOM 844 CB VAL A 55 2.857 -13.578 -4.597 1.00 0.00 C ATOM 845 CG1 VAL A 55 2.845 -12.091 -4.237 1.00 0.00 C ATOM 846 CG2 VAL A 55 3.672 -13.666 -5.900 1.00 0.00 C ATOM 0 H VAL A 55 2.692 -16.329 -3.684 1.00 0.00 H new ATOM 0 HA VAL A 55 4.482 -13.947 -3.375 1.00 0.00 H new ATOM 0 HB VAL A 55 1.853 -13.981 -4.727 1.00 0.00 H new ATOM 0 HG11 VAL A 55 2.388 -11.524 -5.048 1.00 0.00 H new ATOM 0 HG12 VAL A 55 2.271 -11.943 -3.322 1.00 0.00 H new ATOM 0 HG13 VAL A 55 3.867 -11.746 -4.084 1.00 0.00 H new ATOM 0 HG21 VAL A 55 3.189 -13.068 -6.672 1.00 0.00 H new ATOM 0 HG22 VAL A 55 4.679 -13.288 -5.725 1.00 0.00 H new ATOM 0 HG23 VAL A 55 3.726 -14.705 -6.226 1.00 0.00 H new ATOM 856 N CYS A 56 3.597 -14.182 -1.057 1.00 0.00 N ATOM 857 CA CYS A 56 3.145 -14.170 0.315 1.00 0.00 C ATOM 858 C CYS A 56 2.861 -12.720 0.691 1.00 0.00 C ATOM 859 O CYS A 56 3.786 -11.925 0.837 1.00 0.00 O ATOM 860 CB CYS A 56 4.233 -14.791 1.204 1.00 0.00 C ATOM 861 SG CYS A 56 4.665 -16.442 0.578 1.00 0.00 S ATOM 0 H CYS A 56 4.605 -14.054 -1.145 1.00 0.00 H new ATOM 0 HA CYS A 56 2.236 -14.756 0.450 1.00 0.00 H new ATOM 0 HB2 CYS A 56 5.116 -14.153 1.214 1.00 0.00 H new ATOM 0 HB3 CYS A 56 3.879 -14.862 2.233 1.00 0.00 H new ATOM 0 HG CYS A 56 5.587 -16.964 1.331 1.00 0.00 H new ATOM 867 N LEU A 57 1.596 -12.336 0.790 1.00 0.00 N ATOM 868 CA LEU A 57 1.207 -11.021 1.271 1.00 0.00 C ATOM 869 C LEU A 57 1.286 -11.067 2.787 1.00 0.00 C ATOM 870 O LEU A 57 0.446 -11.682 3.441 1.00 0.00 O ATOM 871 CB LEU A 57 -0.190 -10.640 0.759 1.00 0.00 C ATOM 872 CG LEU A 57 -0.072 -9.986 -0.625 1.00 0.00 C ATOM 873 CD1 LEU A 57 -1.427 -9.883 -1.301 1.00 0.00 C ATOM 874 CD2 LEU A 57 0.477 -8.561 -0.586 1.00 0.00 C ATOM 0 H LEU A 57 0.808 -12.932 0.537 1.00 0.00 H new ATOM 0 HA LEU A 57 1.873 -10.245 0.894 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.821 -11.527 0.700 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.669 -9.953 1.457 1.00 0.00 H new ATOM 0 HG LEU A 57 0.616 -10.634 -1.168 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -1.311 -9.416 -2.279 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -1.849 -10.880 -1.423 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -2.095 -9.279 -0.687 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.532 -8.164 -1.600 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.182 -7.933 0.014 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.473 -8.567 -0.144 1.00 0.00 H new ATOM 886 N HIS A 58 2.337 -10.473 3.339 1.00 0.00 N ATOM 887 CA HIS A 58 2.506 -10.326 4.780 1.00 0.00 C ATOM 888 C HIS A 58 1.562 -9.215 5.236 1.00 0.00 C ATOM 889 O HIS A 58 1.857 -8.039 5.041 1.00 0.00 O ATOM 890 CB HIS A 58 3.969 -10.015 5.103 1.00 0.00 C ATOM 891 CG HIS A 58 4.950 -11.159 4.945 1.00 0.00 C ATOM 892 ND1 HIS A 58 5.821 -11.636 5.913 1.00 0.00 N ATOM 893 CD2 HIS A 58 5.300 -11.743 3.758 1.00 0.00 C ATOM 894 CE1 HIS A 58 6.674 -12.483 5.311 1.00 0.00 C ATOM 895 NE2 HIS A 58 6.367 -12.585 4.012 1.00 0.00 N ATOM 0 H HIS A 58 3.103 -10.076 2.795 1.00 0.00 H new ATOM 0 HA HIS A 58 2.260 -11.246 5.310 1.00 0.00 H new ATOM 0 HB2 HIS A 58 4.294 -9.195 4.462 1.00 0.00 H new ATOM 0 HB3 HIS A 58 4.024 -9.657 6.131 1.00 0.00 H new ATOM 0 HD2 HIS A 58 4.830 -11.577 2.800 1.00 0.00 H new ATOM 0 HE1 HIS A 58 7.484 -13.002 5.801 1.00 0.00 H new ATOM 0 HE2 HIS A 58 6.837 -13.179 3.330 1.00 0.00 H new ATOM 904 N LEU A 59 0.385 -9.594 5.725 1.00 0.00 N ATOM 905 CA LEU A 59 -0.711 -8.735 6.150 1.00 0.00 C ATOM 906 C LEU A 59 -0.510 -8.383 7.618 1.00 0.00 C ATOM 907 O LEU A 59 -0.216 -9.265 8.426 1.00 0.00 O ATOM 908 CB LEU A 59 -2.010 -9.534 5.948 1.00 0.00 C ATOM 909 CG LEU A 59 -3.334 -8.782 6.203 1.00 0.00 C ATOM 910 CD1 LEU A 59 -4.065 -8.393 4.908 1.00 0.00 C ATOM 911 CD2 LEU A 59 -4.272 -9.730 6.943 1.00 0.00 C ATOM 0 H LEU A 59 0.158 -10.581 5.842 1.00 0.00 H new ATOM 0 HA LEU A 59 -0.754 -7.808 5.579 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -2.023 -9.909 4.924 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -1.980 -10.403 6.605 1.00 0.00 H new ATOM 0 HG LEU A 59 -3.087 -7.876 6.756 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -4.988 -7.868 5.155 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -3.426 -7.743 4.311 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.301 -9.292 4.339 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -5.219 -9.226 7.138 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -4.451 -10.615 6.332 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -3.818 -10.027 7.888 1.00 0.00 H new ATOM 923 N ARG A 60 -0.708 -7.113 7.986 1.00 0.00 N ATOM 924 CA ARG A 60 -0.630 -6.718 9.391 1.00 0.00 C ATOM 925 C ARG A 60 -1.650 -7.506 10.190 1.00 0.00 C ATOM 926 O ARG A 60 -2.815 -7.579 9.797 1.00 0.00 O ATOM 927 CB ARG A 60 -0.889 -5.217 9.573 1.00 0.00 C ATOM 928 CG ARG A 60 0.240 -4.331 9.043 1.00 0.00 C ATOM 929 CD ARG A 60 1.500 -4.365 9.914 1.00 0.00 C ATOM 930 NE ARG A 60 2.568 -3.581 9.283 1.00 0.00 N ATOM 931 CZ ARG A 60 2.608 -2.260 9.087 1.00 0.00 C ATOM 932 NH1 ARG A 60 1.761 -1.434 9.694 1.00 0.00 N ATOM 933 NH2 ARG A 60 3.514 -1.775 8.256 1.00 0.00 N ATOM 0 H ARG A 60 -0.920 -6.353 7.340 1.00 0.00 H new ATOM 0 HA ARG A 60 0.378 -6.930 9.747 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -1.816 -4.953 9.064 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -1.036 -5.008 10.633 1.00 0.00 H new ATOM 0 HG2 ARG A 60 0.497 -4.649 8.032 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -0.117 -3.303 8.973 1.00 0.00 H new ATOM 0 HD2 ARG A 60 1.279 -3.964 10.903 1.00 0.00 H new ATOM 0 HD3 ARG A 60 1.828 -5.395 10.054 1.00 0.00 H new ATOM 0 HE ARG A 60 3.377 -4.108 8.955 1.00 0.00 H new ATOM 0 HH11 ARG A 60 1.055 -1.804 10.330 1.00 0.00 H new ATOM 0 HH12 ARG A 60 1.817 -0.430 9.523 1.00 0.00 H new ATOM 0 HH21 ARG A 60 4.161 -2.405 7.782 1.00 0.00 H new ATOM 0 HH22 ARG A 60 3.566 -0.770 8.088 1.00 0.00 H new ATOM 947 N SER A 61 -1.251 -8.016 11.351 1.00 0.00 N ATOM 948 CA SER A 61 -2.161 -8.677 12.273 1.00 0.00 C ATOM 949 C SER A 61 -3.275 -7.706 12.711 1.00 0.00 C ATOM 950 O SER A 61 -4.422 -8.116 12.911 1.00 0.00 O ATOM 951 CB SER A 61 -1.322 -9.223 13.425 1.00 0.00 C ATOM 952 OG SER A 61 -0.664 -8.165 14.092 1.00 0.00 O ATOM 0 H SER A 61 -0.285 -7.981 11.677 1.00 0.00 H new ATOM 0 HA SER A 61 -2.682 -9.513 11.807 1.00 0.00 H new ATOM 0 HB2 SER A 61 -1.959 -9.764 14.125 1.00 0.00 H new ATOM 0 HB3 SER A 61 -0.589 -9.935 13.046 1.00 0.00 H new ATOM 0 HG SER A 61 -0.133 -8.525 14.833 1.00 0.00 H new ATOM 958 N SER A 62 -2.988 -6.396 12.725 1.00 0.00 N ATOM 959 CA SER A 62 -3.926 -5.305 12.979 1.00 0.00 C ATOM 960 C SER A 62 -5.114 -5.372 12.019 1.00 0.00 C ATOM 961 O SER A 62 -6.211 -4.915 12.328 1.00 0.00 O ATOM 962 CB SER A 62 -3.198 -3.969 12.755 1.00 0.00 C ATOM 963 OG SER A 62 -1.902 -3.977 13.320 1.00 0.00 O ATOM 0 H SER A 62 -2.042 -6.056 12.549 1.00 0.00 H new ATOM 0 HA SER A 62 -4.291 -5.389 14.002 1.00 0.00 H new ATOM 0 HB2 SER A 62 -3.127 -3.768 11.686 1.00 0.00 H new ATOM 0 HB3 SER A 62 -3.781 -3.159 13.194 1.00 0.00 H new ATOM 0 HG SER A 62 -1.469 -3.113 13.157 1.00 0.00 H new ATOM 969 N GLN A 63 -4.891 -5.987 10.859 1.00 0.00 N ATOM 970 CA GLN A 63 -5.794 -6.087 9.732 1.00 0.00 C ATOM 971 C GLN A 63 -6.142 -7.542 9.414 1.00 0.00 C ATOM 972 O GLN A 63 -6.841 -7.779 8.430 1.00 0.00 O ATOM 973 CB GLN A 63 -5.178 -5.364 8.525 1.00 0.00 C ATOM 974 CG GLN A 63 -4.632 -3.962 8.848 1.00 0.00 C ATOM 975 CD GLN A 63 -5.691 -2.925 9.216 1.00 0.00 C ATOM 976 OE1 GLN A 63 -6.556 -3.139 10.060 1.00 0.00 O ATOM 977 NE2 GLN A 63 -5.620 -1.757 8.622 1.00 0.00 N ATOM 0 H GLN A 63 -4.006 -6.461 10.677 1.00 0.00 H new ATOM 0 HA GLN A 63 -6.736 -5.601 9.986 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -4.369 -5.974 8.123 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -5.932 -5.278 7.742 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -3.925 -4.045 9.673 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -4.074 -3.598 7.985 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -4.899 -1.584 7.921 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -6.286 -1.022 8.861 1.00 0.00 H new ATOM 986 N ARG A 64 -5.781 -8.524 10.258 1.00 0.00 N ATOM 987 CA ARG A 64 -6.182 -9.925 10.044 1.00 0.00 C ATOM 988 C ARG A 64 -7.705 -10.063 10.003 1.00 0.00 C ATOM 989 O ARG A 64 -8.221 -11.038 9.460 1.00 0.00 O ATOM 990 CB ARG A 64 -5.532 -10.873 11.073 1.00 0.00 C ATOM 991 CG ARG A 64 -6.062 -10.738 12.509 1.00 0.00 C ATOM 992 CD ARG A 64 -7.224 -11.681 12.843 1.00 0.00 C ATOM 993 NE ARG A 64 -8.198 -11.029 13.729 1.00 0.00 N ATOM 994 CZ ARG A 64 -9.440 -11.451 13.981 1.00 0.00 C ATOM 995 NH1 ARG A 64 -9.820 -12.682 13.664 1.00 0.00 N ATOM 996 NH2 ARG A 64 -10.314 -10.628 14.532 1.00 0.00 N ATOM 0 H ARG A 64 -5.214 -8.374 11.092 1.00 0.00 H new ATOM 0 HA ARG A 64 -5.807 -10.231 9.068 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -5.681 -11.901 10.742 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -4.457 -10.694 11.081 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -5.245 -10.927 13.205 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -6.386 -9.710 12.669 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -7.718 -11.994 11.923 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -6.839 -12.582 13.321 1.00 0.00 H new ATOM 0 HE ARG A 64 -7.897 -10.173 14.196 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -9.160 -13.321 13.221 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -10.772 -12.989 13.863 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -10.040 -9.673 14.764 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -11.263 -10.947 14.726 1.00 0.00 H new ATOM 1010 N HIS A 65 -8.456 -9.089 10.529 1.00 0.00 N ATOM 1011 CA HIS A 65 -9.907 -9.073 10.410 1.00 0.00 C ATOM 1012 C HIS A 65 -10.373 -8.990 8.941 1.00 0.00 C ATOM 1013 O HIS A 65 -11.496 -9.400 8.663 1.00 0.00 O ATOM 1014 CB HIS A 65 -10.521 -7.992 11.314 1.00 0.00 C ATOM 1015 CG HIS A 65 -10.095 -6.561 11.066 1.00 0.00 C ATOM 1016 ND1 HIS A 65 -8.999 -5.917 11.623 1.00 0.00 N ATOM 1017 CD2 HIS A 65 -10.793 -5.639 10.332 1.00 0.00 C ATOM 1018 CE1 HIS A 65 -9.027 -4.636 11.207 1.00 0.00 C ATOM 1019 NE2 HIS A 65 -10.090 -4.451 10.404 1.00 0.00 N ATOM 0 H HIS A 65 -8.072 -8.297 11.045 1.00 0.00 H new ATOM 0 HA HIS A 65 -10.285 -10.029 10.771 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -11.605 -8.044 11.215 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -10.283 -8.241 12.348 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -11.717 -5.808 9.799 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -8.308 -3.876 11.476 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -10.336 -3.582 9.929 1.00 0.00 H new ATOM 1028 N LEU A 66 -9.543 -8.530 7.993 1.00 0.00 N ATOM 1029 CA LEU A 66 -9.842 -8.530 6.553 1.00 0.00 C ATOM 1030 C LEU A 66 -9.358 -9.823 5.868 1.00 0.00 C ATOM 1031 O LEU A 66 -9.696 -10.061 4.712 1.00 0.00 O ATOM 1032 CB LEU A 66 -9.176 -7.313 5.858 1.00 0.00 C ATOM 1033 CG LEU A 66 -9.992 -6.012 5.754 1.00 0.00 C ATOM 1034 CD1 LEU A 66 -11.208 -6.164 4.842 1.00 0.00 C ATOM 1035 CD2 LEU A 66 -10.439 -5.523 7.126 1.00 0.00 C ATOM 0 H LEU A 66 -8.626 -8.139 8.210 1.00 0.00 H new ATOM 0 HA LEU A 66 -10.926 -8.467 6.454 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -8.252 -7.087 6.390 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -8.897 -7.615 4.849 1.00 0.00 H new ATOM 0 HG LEU A 66 -9.327 -5.270 5.313 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -11.752 -5.220 4.800 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -10.879 -6.438 3.840 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -11.862 -6.943 5.234 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -11.012 -4.603 7.015 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -11.061 -6.283 7.598 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -9.564 -5.333 7.747 1.00 0.00 H new ATOM 1047 N ASN A 67 -8.545 -10.648 6.534 1.00 0.00 N ATOM 1048 CA ASN A 67 -7.927 -11.838 5.950 1.00 0.00 C ATOM 1049 C ASN A 67 -8.977 -12.930 5.769 1.00 0.00 C ATOM 1050 O ASN A 67 -9.208 -13.689 6.714 1.00 0.00 O ATOM 1051 CB ASN A 67 -6.791 -12.338 6.870 1.00 0.00 C ATOM 1052 CG ASN A 67 -5.880 -13.382 6.228 1.00 0.00 C ATOM 1053 OD1 ASN A 67 -4.669 -13.216 6.208 1.00 0.00 O ATOM 1054 ND2 ASN A 67 -6.420 -14.480 5.739 1.00 0.00 N ATOM 0 H ASN A 67 -8.294 -10.503 7.512 1.00 0.00 H new ATOM 0 HA ASN A 67 -7.509 -11.587 4.975 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -6.187 -11.485 7.179 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -7.230 -12.761 7.773 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -5.826 -15.205 5.337 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -7.432 -14.605 5.763 1.00 0.00 H new ATOM 1061 N ASN A 68 -9.580 -13.076 4.586 1.00 0.00 N ATOM 1062 CA ASN A 68 -10.512 -14.181 4.328 1.00 0.00 C ATOM 1063 C ASN A 68 -10.138 -14.933 3.052 1.00 0.00 C ATOM 1064 O ASN A 68 -9.558 -14.353 2.135 1.00 0.00 O ATOM 1065 CB ASN A 68 -11.979 -13.715 4.392 1.00 0.00 C ATOM 1066 CG ASN A 68 -12.526 -13.104 3.113 1.00 0.00 C ATOM 1067 OD1 ASN A 68 -12.397 -11.911 2.861 1.00 0.00 O ATOM 1068 ND2 ASN A 68 -13.184 -13.902 2.292 1.00 0.00 N ATOM 0 H ASN A 68 -9.442 -12.448 3.795 1.00 0.00 H new ATOM 0 HA ASN A 68 -10.418 -14.912 5.131 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -12.602 -14.568 4.662 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -12.075 -12.983 5.194 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -13.593 -13.528 1.436 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -13.284 -14.893 2.514 1.00 0.00 H new ATOM 1075 N ARG A 69 -10.439 -16.237 2.990 1.00 0.00 N ATOM 1076 CA ARG A 69 -10.011 -17.090 1.870 1.00 0.00 C ATOM 1077 C ARG A 69 -10.667 -16.655 0.561 1.00 0.00 C ATOM 1078 O ARG A 69 -10.030 -16.690 -0.488 1.00 0.00 O ATOM 1079 CB ARG A 69 -10.263 -18.588 2.145 1.00 0.00 C ATOM 1080 CG ARG A 69 -9.212 -19.229 3.072 1.00 0.00 C ATOM 1081 CD ARG A 69 -9.499 -19.056 4.572 1.00 0.00 C ATOM 1082 NE ARG A 69 -8.269 -18.891 5.369 1.00 0.00 N ATOM 1083 CZ ARG A 69 -7.345 -19.812 5.663 1.00 0.00 C ATOM 1084 NH1 ARG A 69 -7.502 -21.080 5.310 1.00 0.00 N ATOM 1085 NH2 ARG A 69 -6.254 -19.455 6.328 1.00 0.00 N ATOM 0 H ARG A 69 -10.979 -16.727 3.704 1.00 0.00 H new ATOM 0 HA ARG A 69 -8.933 -16.961 1.770 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -11.250 -18.706 2.592 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -10.276 -19.126 1.197 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -9.148 -20.294 2.847 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -8.237 -18.797 2.849 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -10.141 -18.187 4.718 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -10.049 -19.924 4.935 1.00 0.00 H new ATOM 0 HE ARG A 69 -8.102 -17.957 5.743 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -8.340 -21.369 4.804 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -6.785 -21.767 5.544 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -6.124 -18.484 6.611 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -5.545 -20.152 6.556 1.00 0.00 H new ATOM 1099 N GLY A 70 -11.903 -16.168 0.607 1.00 0.00 N ATOM 1100 CA GLY A 70 -12.536 -15.617 -0.579 1.00 0.00 C ATOM 1101 C GLY A 70 -11.799 -14.366 -1.069 1.00 0.00 C ATOM 1102 O GLY A 70 -11.660 -14.190 -2.284 1.00 0.00 O ATOM 0 H GLY A 70 -12.480 -16.145 1.448 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -12.549 -16.367 -1.369 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -13.574 -15.368 -0.358 1.00 0.00 H new ATOM 1106 N ALA A 71 -11.294 -13.506 -0.165 1.00 0.00 N ATOM 1107 CA ALA A 71 -10.482 -12.361 -0.566 1.00 0.00 C ATOM 1108 C ALA A 71 -9.209 -12.851 -1.238 1.00 0.00 C ATOM 1109 O ALA A 71 -8.862 -12.318 -2.285 1.00 0.00 O ATOM 1110 CB ALA A 71 -10.131 -11.432 0.606 1.00 0.00 C ATOM 0 H ALA A 71 -11.438 -13.589 0.841 1.00 0.00 H new ATOM 0 HA ALA A 71 -11.079 -11.773 -1.264 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -9.527 -10.601 0.243 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -11.048 -11.047 1.052 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -9.569 -11.989 1.356 1.00 0.00 H new ATOM 1116 N GLN A 72 -8.538 -13.863 -0.673 1.00 0.00 N ATOM 1117 CA GLN A 72 -7.343 -14.453 -1.255 1.00 0.00 C ATOM 1118 C GLN A 72 -7.624 -14.872 -2.686 1.00 0.00 C ATOM 1119 O GLN A 72 -6.878 -14.467 -3.567 1.00 0.00 O ATOM 1120 CB GLN A 72 -6.868 -15.664 -0.427 1.00 0.00 C ATOM 1121 CG GLN A 72 -5.643 -16.382 -1.024 1.00 0.00 C ATOM 1122 CD GLN A 72 -5.473 -17.795 -0.462 1.00 0.00 C ATOM 1123 OE1 GLN A 72 -6.437 -18.543 -0.304 1.00 0.00 O ATOM 1124 NE2 GLN A 72 -4.249 -18.201 -0.192 1.00 0.00 N ATOM 0 H GLN A 72 -8.818 -14.293 0.208 1.00 0.00 H new ATOM 0 HA GLN A 72 -6.548 -13.707 -1.248 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -6.626 -15.330 0.582 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -7.688 -16.377 -0.339 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -5.746 -16.434 -2.108 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -4.745 -15.800 -0.817 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -3.460 -17.569 -0.328 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -4.090 -19.148 0.153 1.00 0.00 H new ATOM 1133 N GLN A 73 -8.667 -15.668 -2.930 1.00 0.00 N ATOM 1134 CA GLN A 73 -8.900 -16.203 -4.264 1.00 0.00 C ATOM 1135 C GLN A 73 -9.213 -15.093 -5.269 1.00 0.00 C ATOM 1136 O GLN A 73 -8.740 -15.134 -6.402 1.00 0.00 O ATOM 1137 CB GLN A 73 -10.000 -17.266 -4.225 1.00 0.00 C ATOM 1138 CG GLN A 73 -9.904 -18.167 -5.469 1.00 0.00 C ATOM 1139 CD GLN A 73 -10.749 -19.432 -5.356 1.00 0.00 C ATOM 1140 OE1 GLN A 73 -11.607 -19.557 -4.484 1.00 0.00 O ATOM 1141 NE2 GLN A 73 -10.510 -20.422 -6.195 1.00 0.00 N ATOM 0 H GLN A 73 -9.352 -15.951 -2.229 1.00 0.00 H new ATOM 0 HA GLN A 73 -7.982 -16.682 -4.606 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -9.904 -17.868 -3.321 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -10.979 -16.788 -4.187 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -10.221 -17.602 -6.345 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -8.862 -18.446 -5.629 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -9.798 -20.317 -6.918 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -11.037 -21.292 -6.121 1.00 0.00 H new ATOM 1150 N LYS A 74 -9.961 -14.069 -4.854 1.00 0.00 N ATOM 1151 CA LYS A 74 -10.216 -12.902 -5.699 1.00 0.00 C ATOM 1152 C LYS A 74 -8.905 -12.174 -6.001 1.00 0.00 C ATOM 1153 O LYS A 74 -8.670 -11.777 -7.139 1.00 0.00 O ATOM 1154 CB LYS A 74 -11.234 -11.986 -5.008 1.00 0.00 C ATOM 1155 CG LYS A 74 -11.631 -10.729 -5.803 1.00 0.00 C ATOM 1156 CD LYS A 74 -12.356 -11.006 -7.129 1.00 0.00 C ATOM 1157 CE LYS A 74 -11.420 -11.058 -8.339 1.00 0.00 C ATOM 1158 NZ LYS A 74 -12.126 -11.346 -9.605 1.00 0.00 N ATOM 0 H LYS A 74 -10.402 -14.025 -3.935 1.00 0.00 H new ATOM 0 HA LYS A 74 -10.638 -13.218 -6.653 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -12.135 -12.563 -4.799 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -10.825 -11.674 -4.047 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -12.273 -10.108 -5.177 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -10.732 -10.149 -6.011 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -12.889 -11.954 -7.051 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -13.105 -10.232 -7.293 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -10.899 -10.105 -8.429 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -10.661 -11.822 -8.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -11.594 -10.937 -10.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -12.203 -12.375 -9.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -13.078 -10.928 -9.574 1.00 0.00 H new ATOM 1172 N LEU A 75 -8.047 -11.989 -4.996 1.00 0.00 N ATOM 1173 CA LEU A 75 -6.730 -11.386 -5.177 1.00 0.00 C ATOM 1174 C LEU A 75 -5.898 -12.254 -6.128 1.00 0.00 C ATOM 1175 O LEU A 75 -5.142 -11.735 -6.946 1.00 0.00 O ATOM 1176 CB LEU A 75 -6.021 -11.257 -3.812 1.00 0.00 C ATOM 1177 CG LEU A 75 -5.318 -9.921 -3.531 1.00 0.00 C ATOM 1178 CD1 LEU A 75 -4.735 -10.027 -2.117 1.00 0.00 C ATOM 1179 CD2 LEU A 75 -4.254 -9.484 -4.547 1.00 0.00 C ATOM 0 H LEU A 75 -8.249 -12.255 -4.032 1.00 0.00 H new ATOM 0 HA LEU A 75 -6.841 -10.391 -5.608 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -6.758 -11.427 -3.027 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -5.282 -12.055 -3.734 1.00 0.00 H new ATOM 0 HG LEU A 75 -6.062 -9.130 -3.624 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -4.221 -9.099 -1.865 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -5.540 -10.202 -1.404 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -4.028 -10.856 -2.076 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -3.830 -8.528 -4.241 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.464 -10.234 -4.592 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -4.711 -9.380 -5.531 1.00 0.00 H new ATOM 1191 N ALA A 76 -6.032 -13.577 -6.012 1.00 0.00 N ATOM 1192 CA ALA A 76 -5.252 -14.554 -6.745 1.00 0.00 C ATOM 1193 C ALA A 76 -5.641 -14.497 -8.200 1.00 0.00 C ATOM 1194 O ALA A 76 -4.755 -14.462 -9.038 1.00 0.00 O ATOM 1195 CB ALA A 76 -5.428 -15.964 -6.174 1.00 0.00 C ATOM 0 H ALA A 76 -6.712 -14.003 -5.382 1.00 0.00 H new ATOM 0 HA ALA A 76 -4.194 -14.312 -6.644 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -4.827 -16.668 -6.751 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -5.104 -15.978 -5.133 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -6.478 -16.251 -6.231 1.00 0.00 H new ATOM 1201 N GLU A 77 -6.928 -14.430 -8.516 1.00 0.00 N ATOM 1202 CA GLU A 77 -7.428 -14.312 -9.875 1.00 0.00 C ATOM 1203 C GLU A 77 -6.856 -13.068 -10.567 1.00 0.00 C ATOM 1204 O GLU A 77 -6.602 -13.091 -11.774 1.00 0.00 O ATOM 1205 CB GLU A 77 -8.958 -14.263 -9.776 1.00 0.00 C ATOM 1206 CG GLU A 77 -9.662 -14.284 -11.135 1.00 0.00 C ATOM 1207 CD GLU A 77 -11.186 -14.340 -11.017 1.00 0.00 C ATOM 1208 OE1 GLU A 77 -11.766 -14.002 -9.961 1.00 0.00 O ATOM 1209 OE2 GLU A 77 -11.837 -14.654 -12.039 1.00 0.00 O ATOM 0 H GLU A 77 -7.669 -14.457 -7.816 1.00 0.00 H new ATOM 0 HA GLU A 77 -7.116 -15.159 -10.486 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -9.303 -15.111 -9.185 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -9.250 -13.361 -9.239 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -9.379 -13.395 -11.699 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -9.315 -15.146 -11.705 1.00 0.00 H new ATOM 1216 N ALA A 78 -6.629 -11.991 -9.812 1.00 0.00 N ATOM 1217 CA ALA A 78 -5.978 -10.779 -10.294 1.00 0.00 C ATOM 1218 C ALA A 78 -4.486 -11.044 -10.532 1.00 0.00 C ATOM 1219 O ALA A 78 -3.992 -10.862 -11.644 1.00 0.00 O ATOM 1220 CB ALA A 78 -6.229 -9.628 -9.309 1.00 0.00 C ATOM 0 H ALA A 78 -6.899 -11.940 -8.830 1.00 0.00 H new ATOM 0 HA ALA A 78 -6.403 -10.480 -11.252 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -5.741 -8.724 -9.673 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -7.301 -9.451 -9.222 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -5.824 -9.891 -8.332 1.00 0.00 H new ATOM 1226 N LEU A 79 -3.748 -11.500 -9.516 1.00 0.00 N ATOM 1227 CA LEU A 79 -2.309 -11.735 -9.626 1.00 0.00 C ATOM 1228 C LEU A 79 -1.968 -12.799 -10.675 1.00 0.00 C ATOM 1229 O LEU A 79 -0.950 -12.686 -11.347 1.00 0.00 O ATOM 1230 CB LEU A 79 -1.734 -12.116 -8.250 1.00 0.00 C ATOM 1231 CG LEU A 79 -0.664 -11.118 -7.777 1.00 0.00 C ATOM 1232 CD1 LEU A 79 -0.377 -11.376 -6.298 1.00 0.00 C ATOM 1233 CD2 LEU A 79 0.637 -11.221 -8.585 1.00 0.00 C ATOM 0 H LEU A 79 -4.132 -11.716 -8.596 1.00 0.00 H new ATOM 0 HA LEU A 79 -1.848 -10.807 -9.964 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -2.541 -12.156 -7.518 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -1.301 -13.115 -8.302 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.051 -10.110 -7.929 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.381 -10.676 -5.947 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.292 -11.241 -5.721 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -0.015 -12.396 -6.170 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.357 -10.494 -8.209 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.049 -12.225 -8.485 1.00 0.00 H new ATOM 0 HD23 LEU A 79 0.430 -11.017 -9.635 1.00 0.00 H new ATOM 1245 N SER A 80 -2.824 -13.803 -10.847 1.00 0.00 N ATOM 1246 CA SER A 80 -2.732 -14.858 -11.852 1.00 0.00 C ATOM 1247 C SER A 80 -2.851 -14.263 -13.260 1.00 0.00 C ATOM 1248 O SER A 80 -2.194 -14.735 -14.189 1.00 0.00 O ATOM 1249 CB SER A 80 -3.870 -15.855 -11.609 1.00 0.00 C ATOM 1250 OG SER A 80 -3.703 -16.444 -10.335 1.00 0.00 O ATOM 0 H SER A 80 -3.648 -13.908 -10.255 1.00 0.00 H new ATOM 0 HA SER A 80 -1.768 -15.360 -11.774 1.00 0.00 H new ATOM 0 HB2 SER A 80 -4.833 -15.348 -11.666 1.00 0.00 H new ATOM 0 HB3 SER A 80 -3.868 -16.624 -12.382 1.00 0.00 H new ATOM 0 HG SER A 80 -4.133 -15.883 -9.656 1.00 0.00 H new ATOM 1256 N MET A 81 -3.675 -13.222 -13.432 1.00 0.00 N ATOM 1257 CA MET A 81 -3.836 -12.518 -14.699 1.00 0.00 C ATOM 1258 C MET A 81 -2.572 -11.714 -15.021 1.00 0.00 C ATOM 1259 O MET A 81 -2.084 -11.721 -16.152 1.00 0.00 O ATOM 1260 CB MET A 81 -5.061 -11.592 -14.609 1.00 0.00 C ATOM 1261 CG MET A 81 -5.470 -11.106 -15.993 1.00 0.00 C ATOM 1262 SD MET A 81 -6.236 -12.399 -16.998 1.00 0.00 S ATOM 1263 CE MET A 81 -5.951 -11.654 -18.608 1.00 0.00 C ATOM 0 H MET A 81 -4.254 -12.844 -12.682 1.00 0.00 H new ATOM 0 HA MET A 81 -3.992 -13.239 -15.502 1.00 0.00 H new ATOM 0 HB2 MET A 81 -5.892 -12.123 -14.144 1.00 0.00 H new ATOM 0 HB3 MET A 81 -4.832 -10.738 -13.971 1.00 0.00 H new ATOM 0 HG2 MET A 81 -6.167 -10.274 -15.889 1.00 0.00 H new ATOM 0 HG3 MET A 81 -4.591 -10.723 -16.512 1.00 0.00 H new ATOM 0 HE1 MET A 81 -6.355 -12.302 -19.386 1.00 0.00 H new ATOM 0 HE2 MET A 81 -6.445 -10.683 -18.652 1.00 0.00 H new ATOM 0 HE3 MET A 81 -4.880 -11.524 -18.764 1.00 0.00 H new ATOM 1273 N LEU A 82 -2.040 -11.022 -14.015 1.00 0.00 N ATOM 1274 CA LEU A 82 -0.856 -10.181 -14.109 1.00 0.00 C ATOM 1275 C LEU A 82 0.398 -11.017 -14.361 1.00 0.00 C ATOM 1276 O LEU A 82 1.169 -10.719 -15.269 1.00 0.00 O ATOM 1277 CB LEU A 82 -0.779 -9.380 -12.805 1.00 0.00 C ATOM 1278 CG LEU A 82 0.520 -8.607 -12.539 1.00 0.00 C ATOM 1279 CD1 LEU A 82 0.749 -7.496 -13.566 1.00 0.00 C ATOM 1280 CD2 LEU A 82 0.427 -8.002 -11.135 1.00 0.00 C ATOM 0 H LEU A 82 -2.440 -11.035 -13.077 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.921 -9.500 -14.958 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.605 -8.669 -12.795 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -0.940 -10.068 -11.975 1.00 0.00 H new ATOM 0 HG LEU A 82 1.363 -9.294 -12.619 1.00 0.00 H new ATOM 0 HD11 LEU A 82 1.680 -6.976 -13.338 1.00 0.00 H new ATOM 0 HD12 LEU A 82 0.811 -7.930 -14.564 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -0.080 -6.789 -13.528 1.00 0.00 H new ATOM 0 HD21 LEU A 82 1.339 -7.445 -10.918 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -0.430 -7.330 -11.085 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.306 -8.800 -10.402 1.00 0.00 H new ATOM 1292 N LYS A 83 0.630 -12.056 -13.559 1.00 0.00 N ATOM 1293 CA LYS A 83 1.770 -12.953 -13.724 1.00 0.00 C ATOM 1294 C LYS A 83 1.614 -13.792 -14.994 1.00 0.00 C ATOM 1295 O LYS A 83 2.621 -14.106 -15.622 1.00 0.00 O ATOM 1296 CB LYS A 83 1.915 -13.819 -12.458 1.00 0.00 C ATOM 1297 CG LYS A 83 3.252 -14.582 -12.364 1.00 0.00 C ATOM 1298 CD LYS A 83 4.047 -14.287 -11.081 1.00 0.00 C ATOM 1299 CE LYS A 83 5.324 -15.131 -11.065 1.00 0.00 C ATOM 1300 NZ LYS A 83 6.008 -15.093 -9.758 1.00 0.00 N ATOM 0 H LYS A 83 0.028 -12.299 -12.772 1.00 0.00 H new ATOM 0 HA LYS A 83 2.687 -12.376 -13.846 1.00 0.00 H new ATOM 0 HB2 LYS A 83 1.811 -13.180 -11.581 1.00 0.00 H new ATOM 0 HB3 LYS A 83 1.096 -14.538 -12.427 1.00 0.00 H new ATOM 0 HG2 LYS A 83 3.053 -15.652 -12.419 1.00 0.00 H new ATOM 0 HG3 LYS A 83 3.866 -14.327 -13.228 1.00 0.00 H new ATOM 0 HD2 LYS A 83 4.298 -13.227 -11.032 1.00 0.00 H new ATOM 0 HD3 LYS A 83 3.439 -14.511 -10.204 1.00 0.00 H new ATOM 0 HE2 LYS A 83 5.077 -16.163 -11.313 1.00 0.00 H new ATOM 0 HE3 LYS A 83 6.003 -14.772 -11.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 6.959 -15.504 -9.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 6.087 -14.107 -9.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 5.461 -15.641 -9.064 1.00 0.00 H new ATOM 1314 N GLY A 84 0.389 -14.142 -15.398 1.00 0.00 N ATOM 1315 CA GLY A 84 0.144 -15.004 -16.551 1.00 0.00 C ATOM 1316 C GLY A 84 0.538 -16.462 -16.290 1.00 0.00 C ATOM 1317 O GLY A 84 0.527 -17.278 -17.215 1.00 0.00 O ATOM 0 H GLY A 84 -0.463 -13.832 -14.930 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -0.912 -14.959 -16.816 1.00 0.00 H new ATOM 0 HA3 GLY A 84 0.704 -14.628 -17.407 1.00 0.00 H new ATOM 1321 N SER A 85 0.901 -16.802 -15.055 1.00 0.00 N ATOM 1322 CA SER A 85 1.275 -18.127 -14.593 1.00 0.00 C ATOM 1323 C SER A 85 0.697 -18.335 -13.190 1.00 0.00 C ATOM 1324 O SER A 85 -0.019 -17.465 -12.678 1.00 0.00 O ATOM 1325 CB SER A 85 2.796 -18.310 -14.710 1.00 0.00 C ATOM 1326 OG SER A 85 3.527 -17.149 -14.369 1.00 0.00 O ATOM 0 H SER A 85 0.943 -16.111 -14.306 1.00 0.00 H new ATOM 0 HA SER A 85 0.850 -18.913 -15.217 1.00 0.00 H new ATOM 0 HB2 SER A 85 3.107 -19.130 -14.063 1.00 0.00 H new ATOM 0 HB3 SER A 85 3.043 -18.599 -15.732 1.00 0.00 H new ATOM 0 HG SER A 85 4.486 -17.328 -14.461 1.00 0.00 H new ATOM 1332 N THR A 86 0.907 -19.511 -12.603 1.00 0.00 N ATOM 1333 CA THR A 86 0.346 -19.865 -11.310 1.00 0.00 C ATOM 1334 C THR A 86 1.061 -19.066 -10.213 1.00 0.00 C ATOM 1335 O THR A 86 2.293 -19.094 -10.132 1.00 0.00 O ATOM 1336 CB THR A 86 0.481 -21.383 -11.095 1.00 0.00 C ATOM 1337 OG1 THR A 86 0.351 -22.100 -12.316 1.00 0.00 O ATOM 1338 CG2 THR A 86 -0.564 -21.913 -10.112 1.00 0.00 C ATOM 0 H THR A 86 1.477 -20.248 -13.018 1.00 0.00 H new ATOM 0 HA THR A 86 -0.714 -19.615 -11.271 1.00 0.00 H new ATOM 0 HB THR A 86 1.478 -21.540 -10.684 1.00 0.00 H new ATOM 0 HG1 THR A 86 0.444 -23.060 -12.143 1.00 0.00 H new ATOM 0 HG21 THR A 86 -0.435 -22.988 -9.988 1.00 0.00 H new ATOM 0 HG22 THR A 86 -0.440 -21.419 -9.148 1.00 0.00 H new ATOM 0 HG23 THR A 86 -1.563 -21.710 -10.498 1.00 0.00 H new ATOM 1346 N VAL A 87 0.306 -18.359 -9.374 1.00 0.00 N ATOM 1347 CA VAL A 87 0.823 -17.610 -8.232 1.00 0.00 C ATOM 1348 C VAL A 87 0.263 -18.231 -6.956 1.00 0.00 C ATOM 1349 O VAL A 87 -0.954 -18.234 -6.766 1.00 0.00 O ATOM 1350 CB VAL A 87 0.407 -16.131 -8.359 1.00 0.00 C ATOM 1351 CG1 VAL A 87 1.205 -15.284 -7.369 1.00 0.00 C ATOM 1352 CG2 VAL A 87 0.627 -15.566 -9.768 1.00 0.00 C ATOM 0 H VAL A 87 -0.707 -18.290 -9.473 1.00 0.00 H new ATOM 0 HA VAL A 87 1.912 -17.653 -8.201 1.00 0.00 H new ATOM 0 HB VAL A 87 -0.661 -16.089 -8.144 1.00 0.00 H new ATOM 0 HG11 VAL A 87 0.908 -14.239 -7.462 1.00 0.00 H new ATOM 0 HG12 VAL A 87 1.008 -15.628 -6.354 1.00 0.00 H new ATOM 0 HG13 VAL A 87 2.269 -15.379 -7.584 1.00 0.00 H new ATOM 0 HG21 VAL A 87 0.316 -14.522 -9.794 1.00 0.00 H new ATOM 0 HG22 VAL A 87 1.683 -15.636 -10.027 1.00 0.00 H new ATOM 0 HG23 VAL A 87 0.039 -16.138 -10.485 1.00 0.00 H new ATOM 1362 N GLU A 88 1.109 -18.764 -6.069 1.00 0.00 N ATOM 1363 CA GLU A 88 0.625 -19.245 -4.777 1.00 0.00 C ATOM 1364 C GLU A 88 0.499 -18.003 -3.908 1.00 0.00 C ATOM 1365 O GLU A 88 1.421 -17.610 -3.192 1.00 0.00 O ATOM 1366 CB GLU A 88 1.560 -20.307 -4.173 1.00 0.00 C ATOM 1367 CG GLU A 88 1.209 -21.723 -4.643 1.00 0.00 C ATOM 1368 CD GLU A 88 -0.080 -22.255 -4.009 1.00 0.00 C ATOM 1369 OE1 GLU A 88 -1.190 -21.827 -4.392 1.00 0.00 O ATOM 1370 OE2 GLU A 88 -0.024 -23.163 -3.148 1.00 0.00 O ATOM 0 H GLU A 88 2.112 -18.871 -6.219 1.00 0.00 H new ATOM 0 HA GLU A 88 -0.334 -19.755 -4.866 1.00 0.00 H new ATOM 0 HB2 GLU A 88 2.590 -20.080 -4.448 1.00 0.00 H new ATOM 0 HB3 GLU A 88 1.503 -20.263 -3.085 1.00 0.00 H new ATOM 0 HG2 GLU A 88 1.103 -21.725 -5.728 1.00 0.00 H new ATOM 0 HG3 GLU A 88 2.032 -22.396 -4.402 1.00 0.00 H new ATOM 1377 N LEU A 89 -0.646 -17.341 -4.024 1.00 0.00 N ATOM 1378 CA LEU A 89 -0.892 -16.079 -3.369 1.00 0.00 C ATOM 1379 C LEU A 89 -1.331 -16.374 -1.950 1.00 0.00 C ATOM 1380 O LEU A 89 -2.489 -16.703 -1.708 1.00 0.00 O ATOM 1381 CB LEU A 89 -1.922 -15.283 -4.155 1.00 0.00 C ATOM 1382 CG LEU A 89 -2.282 -13.957 -3.466 1.00 0.00 C ATOM 1383 CD1 LEU A 89 -1.117 -13.042 -3.101 1.00 0.00 C ATOM 1384 CD2 LEU A 89 -3.143 -13.209 -4.451 1.00 0.00 C ATOM 0 H LEU A 89 -1.432 -17.675 -4.582 1.00 0.00 H new ATOM 0 HA LEU A 89 0.007 -15.463 -3.331 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -1.535 -15.078 -5.153 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -2.824 -15.882 -4.279 1.00 0.00 H new ATOM 0 HG LEU A 89 -2.751 -14.214 -2.516 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.499 -12.140 -2.622 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.447 -13.561 -2.416 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -0.571 -12.770 -4.004 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -3.437 -12.251 -4.023 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -2.581 -13.039 -5.370 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -4.034 -13.795 -4.674 1.00 0.00 H new ATOM 1396 N THR A 90 -0.401 -16.314 -1.012 1.00 0.00 N ATOM 1397 CA THR A 90 -0.680 -16.584 0.387 1.00 0.00 C ATOM 1398 C THR A 90 -0.922 -15.244 1.076 1.00 0.00 C ATOM 1399 O THR A 90 -0.455 -14.211 0.600 1.00 0.00 O ATOM 1400 CB THR A 90 0.534 -17.303 0.992 1.00 0.00 C ATOM 1401 OG1 THR A 90 1.061 -18.249 0.075 1.00 0.00 O ATOM 1402 CG2 THR A 90 0.212 -18.034 2.294 1.00 0.00 C ATOM 0 H THR A 90 0.573 -16.076 -1.201 1.00 0.00 H new ATOM 0 HA THR A 90 -1.558 -17.218 0.513 1.00 0.00 H new ATOM 0 HB THR A 90 1.262 -16.521 1.209 1.00 0.00 H new ATOM 0 HG1 THR A 90 1.835 -18.697 0.476 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.112 -18.521 2.670 1.00 0.00 H new ATOM 0 HG22 THR A 90 -0.149 -17.319 3.033 1.00 0.00 H new ATOM 0 HG23 THR A 90 -0.557 -18.784 2.109 1.00 0.00 H new ATOM 1410 N ILE A 91 -1.623 -15.248 2.202 1.00 0.00 N ATOM 1411 CA ILE A 91 -1.819 -14.083 3.045 1.00 0.00 C ATOM 1412 C ILE A 91 -1.385 -14.586 4.414 1.00 0.00 C ATOM 1413 O ILE A 91 -2.051 -15.454 4.988 1.00 0.00 O ATOM 1414 CB ILE A 91 -3.261 -13.533 3.022 1.00 0.00 C ATOM 1415 CG1 ILE A 91 -3.851 -13.435 1.601 1.00 0.00 C ATOM 1416 CG2 ILE A 91 -3.244 -12.140 3.678 1.00 0.00 C ATOM 1417 CD1 ILE A 91 -5.342 -13.115 1.644 1.00 0.00 C ATOM 0 H ILE A 91 -2.082 -16.085 2.561 1.00 0.00 H new ATOM 0 HA ILE A 91 -1.247 -13.219 2.707 1.00 0.00 H new ATOM 0 HB ILE A 91 -3.900 -14.228 3.568 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -3.327 -12.662 1.039 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -3.693 -14.376 1.073 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -4.252 -11.725 3.676 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -2.889 -12.226 4.705 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -2.580 -11.482 3.118 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -5.730 -13.052 0.627 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -5.868 -13.902 2.185 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -5.495 -12.162 2.150 1.00 0.00 H new ATOM 1429 N VAL A 92 -0.218 -14.145 4.872 1.00 0.00 N ATOM 1430 CA VAL A 92 0.364 -14.543 6.146 1.00 0.00 C ATOM 1431 C VAL A 92 0.164 -13.377 7.110 1.00 0.00 C ATOM 1432 O VAL A 92 0.199 -12.226 6.676 1.00 0.00 O ATOM 1433 CB VAL A 92 1.849 -14.945 5.973 1.00 0.00 C ATOM 1434 CG1 VAL A 92 2.017 -16.079 4.951 1.00 0.00 C ATOM 1435 CG2 VAL A 92 2.793 -13.812 5.546 1.00 0.00 C ATOM 0 H VAL A 92 0.362 -13.485 4.354 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.124 -15.429 6.551 1.00 0.00 H new ATOM 0 HB VAL A 92 2.133 -15.258 6.978 1.00 0.00 H new ATOM 0 HG11 VAL A 92 3.073 -16.332 4.858 1.00 0.00 H new ATOM 0 HG12 VAL A 92 1.462 -16.955 5.286 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.635 -15.756 3.983 1.00 0.00 H new ATOM 0 HG21 VAL A 92 3.808 -14.199 5.454 1.00 0.00 H new ATOM 0 HG22 VAL A 92 2.469 -13.411 4.586 1.00 0.00 H new ATOM 0 HG23 VAL A 92 2.774 -13.020 6.295 1.00 0.00 H new ATOM 1445 N GLU A 93 -0.068 -13.650 8.391 1.00 0.00 N ATOM 1446 CA GLU A 93 -0.134 -12.578 9.382 1.00 0.00 C ATOM 1447 C GLU A 93 1.304 -12.249 9.775 1.00 0.00 C ATOM 1448 O GLU A 93 2.130 -13.150 9.982 1.00 0.00 O ATOM 1449 CB GLU A 93 -1.026 -12.879 10.601 1.00 0.00 C ATOM 1450 CG GLU A 93 -0.922 -14.277 11.231 1.00 0.00 C ATOM 1451 CD GLU A 93 -1.700 -15.380 10.498 1.00 0.00 C ATOM 1452 OE1 GLU A 93 -2.551 -15.095 9.620 1.00 0.00 O ATOM 1453 OE2 GLU A 93 -1.485 -16.570 10.829 1.00 0.00 O ATOM 0 H GLU A 93 -0.212 -14.588 8.764 1.00 0.00 H new ATOM 0 HA GLU A 93 -0.627 -11.715 8.934 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -0.798 -12.145 11.374 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -2.063 -12.720 10.306 1.00 0.00 H new ATOM 0 HG2 GLU A 93 0.129 -14.562 11.274 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -1.280 -14.223 12.259 1.00 0.00 H new ATOM 1460 N ASP A 94 1.630 -10.959 9.794 1.00 0.00 N ATOM 1461 CA ASP A 94 2.953 -10.466 10.117 1.00 0.00 C ATOM 1462 C ASP A 94 2.874 -9.193 10.950 1.00 0.00 C ATOM 1463 O ASP A 94 2.189 -8.246 10.558 1.00 0.00 O ATOM 1464 CB ASP A 94 3.740 -10.277 8.827 1.00 0.00 C ATOM 1465 CG ASP A 94 5.198 -9.993 9.136 1.00 0.00 C ATOM 1466 OD1 ASP A 94 5.805 -10.767 9.910 1.00 0.00 O ATOM 1467 OD2 ASP A 94 5.757 -9.048 8.540 1.00 0.00 O ATOM 0 H ASP A 94 0.963 -10.217 9.580 1.00 0.00 H new ATOM 0 HA ASP A 94 3.481 -11.195 10.733 1.00 0.00 H new ATOM 0 HB2 ASP A 94 3.660 -11.172 8.210 1.00 0.00 H new ATOM 0 HB3 ASP A 94 3.316 -9.454 8.252 1.00 0.00 H new ATOM 1472 N ASP A 95 3.555 -9.171 12.096 1.00 0.00 N ATOM 1473 CA ASP A 95 3.478 -8.081 13.067 1.00 0.00 C ATOM 1474 C ASP A 95 4.573 -7.031 12.882 1.00 0.00 C ATOM 1475 O ASP A 95 4.264 -5.840 12.797 1.00 0.00 O ATOM 1476 CB ASP A 95 3.537 -8.649 14.502 1.00 0.00 C ATOM 1477 CG ASP A 95 2.237 -8.389 15.252 1.00 0.00 C ATOM 1478 OD1 ASP A 95 2.051 -7.286 15.805 1.00 0.00 O ATOM 1479 OD2 ASP A 95 1.352 -9.279 15.261 1.00 0.00 O ATOM 0 H ASP A 95 4.185 -9.922 12.379 1.00 0.00 H new ATOM 0 HA ASP A 95 2.526 -7.578 12.897 1.00 0.00 H new ATOM 0 HB2 ASP A 95 3.729 -9.721 14.464 1.00 0.00 H new ATOM 0 HB3 ASP A 95 4.368 -8.195 15.042 1.00 0.00 H new ATOM 1484 N ASN A 96 5.847 -7.443 12.831 1.00 0.00 N ATOM 1485 CA ASN A 96 6.981 -6.515 12.796 1.00 0.00 C ATOM 1486 C ASN A 96 7.059 -5.739 11.475 1.00 0.00 C ATOM 1487 O ASN A 96 7.240 -6.381 10.435 1.00 0.00 O ATOM 1488 CB ASN A 96 8.306 -7.250 13.032 1.00 0.00 C ATOM 1489 CG ASN A 96 9.469 -6.275 12.870 1.00 0.00 C ATOM 1490 OD1 ASN A 96 9.552 -5.270 13.571 1.00 0.00 O ATOM 1491 ND2 ASN A 96 10.356 -6.505 11.921 1.00 0.00 N ATOM 0 H ASN A 96 6.118 -8.426 12.813 1.00 0.00 H new ATOM 0 HA ASN A 96 6.815 -5.800 13.602 1.00 0.00 H new ATOM 0 HB2 ASN A 96 8.319 -7.685 14.032 1.00 0.00 H new ATOM 0 HB3 ASN A 96 8.408 -8.073 12.325 1.00 0.00 H new ATOM 0 HD21 ASN A 96 11.118 -5.846 11.765 1.00 0.00 H new ATOM 0 HD22 ASN A 96 10.279 -7.342 11.343 1.00 0.00 H new ATOM 1498 N PRO A 97 6.955 -4.397 11.452 1.00 0.00 N ATOM 1499 CA PRO A 97 6.970 -3.603 10.225 1.00 0.00 C ATOM 1500 C PRO A 97 8.390 -3.422 9.659 1.00 0.00 C ATOM 1501 O PRO A 97 8.942 -2.319 9.629 1.00 0.00 O ATOM 1502 CB PRO A 97 6.295 -2.286 10.610 1.00 0.00 C ATOM 1503 CG PRO A 97 6.730 -2.101 12.060 1.00 0.00 C ATOM 1504 CD PRO A 97 6.714 -3.528 12.600 1.00 0.00 C ATOM 0 HA PRO A 97 6.439 -4.094 9.409 1.00 0.00 H new ATOM 0 HB2 PRO A 97 6.626 -1.461 9.979 1.00 0.00 H new ATOM 0 HB3 PRO A 97 5.211 -2.344 10.516 1.00 0.00 H new ATOM 0 HG2 PRO A 97 7.721 -1.652 12.131 1.00 0.00 H new ATOM 0 HG3 PRO A 97 6.046 -1.453 12.608 1.00 0.00 H new ATOM 0 HD2 PRO A 97 7.482 -3.665 13.361 1.00 0.00 H new ATOM 0 HD3 PRO A 97 5.757 -3.757 13.068 1.00 0.00 H new ATOM 1512 N ALA A 98 8.991 -4.518 9.195 1.00 0.00 N ATOM 1513 CA ALA A 98 10.288 -4.517 8.514 1.00 0.00 C ATOM 1514 C ALA A 98 10.210 -3.898 7.123 1.00 0.00 C ATOM 1515 O ALA A 98 11.155 -3.284 6.632 1.00 0.00 O ATOM 1516 CB ALA A 98 10.799 -5.951 8.384 1.00 0.00 C ATOM 0 H ALA A 98 8.583 -5.449 9.283 1.00 0.00 H new ATOM 0 HA ALA A 98 10.968 -3.914 9.116 1.00 0.00 H new ATOM 0 HB1 ALA A 98 11.764 -5.949 7.877 1.00 0.00 H new ATOM 0 HB2 ALA A 98 10.911 -6.389 9.376 1.00 0.00 H new ATOM 0 HB3 ALA A 98 10.087 -6.540 7.806 1.00 0.00 H new ATOM 1522 N VAL A 99 9.053 -4.064 6.506 1.00 0.00 N ATOM 1523 CA VAL A 99 8.726 -3.654 5.152 1.00 0.00 C ATOM 1524 C VAL A 99 7.445 -2.827 5.243 1.00 0.00 C ATOM 1525 O VAL A 99 6.584 -3.107 6.083 1.00 0.00 O ATOM 1526 CB VAL A 99 8.587 -4.892 4.246 1.00 0.00 C ATOM 1527 CG1 VAL A 99 8.282 -4.519 2.790 1.00 0.00 C ATOM 1528 CG2 VAL A 99 9.846 -5.779 4.269 1.00 0.00 C ATOM 0 H VAL A 99 8.266 -4.519 6.968 1.00 0.00 H new ATOM 0 HA VAL A 99 9.511 -3.046 4.701 1.00 0.00 H new ATOM 0 HB VAL A 99 7.746 -5.451 4.657 1.00 0.00 H new ATOM 0 HG11 VAL A 99 8.194 -5.427 2.193 1.00 0.00 H new ATOM 0 HG12 VAL A 99 7.346 -3.963 2.745 1.00 0.00 H new ATOM 0 HG13 VAL A 99 9.090 -3.902 2.396 1.00 0.00 H new ATOM 0 HG21 VAL A 99 9.698 -6.638 3.615 1.00 0.00 H new ATOM 0 HG22 VAL A 99 10.704 -5.202 3.922 1.00 0.00 H new ATOM 0 HG23 VAL A 99 10.029 -6.125 5.286 1.00 0.00 H new ATOM 1538 N ARG A 100 7.320 -1.788 4.421 1.00 0.00 N ATOM 1539 CA ARG A 100 6.142 -0.929 4.378 1.00 0.00 C ATOM 1540 C ARG A 100 5.065 -1.575 3.503 1.00 0.00 C ATOM 1541 O ARG A 100 5.382 -2.255 2.524 1.00 0.00 O ATOM 1542 CB ARG A 100 6.515 0.426 3.754 1.00 0.00 C ATOM 1543 CG ARG A 100 7.706 1.204 4.350 1.00 0.00 C ATOM 1544 CD ARG A 100 7.659 1.380 5.875 1.00 0.00 C ATOM 1545 NE ARG A 100 8.271 2.650 6.306 1.00 0.00 N ATOM 1546 CZ ARG A 100 9.561 2.955 6.487 1.00 0.00 C ATOM 1547 NH1 ARG A 100 10.522 2.078 6.213 1.00 0.00 N ATOM 1548 NH2 ARG A 100 9.874 4.162 6.949 1.00 0.00 N ATOM 0 H ARG A 100 8.045 -1.516 3.757 1.00 0.00 H new ATOM 0 HA ARG A 100 5.771 -0.790 5.393 1.00 0.00 H new ATOM 0 HB2 ARG A 100 6.723 0.259 2.697 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.637 1.070 3.808 1.00 0.00 H new ATOM 0 HG2 ARG A 100 8.629 0.687 4.086 1.00 0.00 H new ATOM 0 HG3 ARG A 100 7.748 2.189 3.885 1.00 0.00 H new ATOM 0 HD2 ARG A 100 6.623 1.345 6.212 1.00 0.00 H new ATOM 0 HD3 ARG A 100 8.178 0.548 6.352 1.00 0.00 H new ATOM 0 HE ARG A 100 7.614 3.408 6.494 1.00 0.00 H new ATOM 0 HH11 ARG A 100 10.282 1.153 5.858 1.00 0.00 H new ATOM 0 HH12 ARG A 100 11.500 2.331 6.358 1.00 0.00 H new ATOM 0 HH21 ARG A 100 9.137 4.835 7.158 1.00 0.00 H new ATOM 0 HH22 ARG A 100 10.851 4.415 7.094 1.00 0.00 H new ATOM 1562 N THR A 101 3.796 -1.378 3.852 1.00 0.00 N ATOM 1563 CA THR A 101 2.678 -1.815 3.024 1.00 0.00 C ATOM 1564 C THR A 101 2.517 -0.731 1.935 1.00 0.00 C ATOM 1565 O THR A 101 2.998 0.390 2.134 1.00 0.00 O ATOM 1566 CB THR A 101 1.423 -1.951 3.913 1.00 0.00 C ATOM 1567 OG1 THR A 101 1.165 -0.720 4.558 1.00 0.00 O ATOM 1568 CG2 THR A 101 1.596 -3.033 4.987 1.00 0.00 C ATOM 0 H THR A 101 3.516 -0.912 4.715 1.00 0.00 H new ATOM 0 HA THR A 101 2.838 -2.787 2.557 1.00 0.00 H new ATOM 0 HB THR A 101 0.594 -2.234 3.265 1.00 0.00 H new ATOM 0 HG1 THR A 101 0.367 -0.806 5.121 1.00 0.00 H new ATOM 0 HG21 THR A 101 0.690 -3.095 5.590 1.00 0.00 H new ATOM 0 HG22 THR A 101 1.780 -3.995 4.508 1.00 0.00 H new ATOM 0 HG23 THR A 101 2.441 -2.779 5.627 1.00 0.00 H new ATOM 1576 N PRO A 102 1.801 -0.959 0.823 1.00 0.00 N ATOM 1577 CA PRO A 102 1.577 0.086 -0.172 1.00 0.00 C ATOM 1578 C PRO A 102 0.654 1.182 0.385 1.00 0.00 C ATOM 1579 O PRO A 102 0.694 2.323 -0.085 1.00 0.00 O ATOM 1580 CB PRO A 102 0.998 -0.626 -1.398 1.00 0.00 C ATOM 1581 CG PRO A 102 0.257 -1.780 -0.759 1.00 0.00 C ATOM 1582 CD PRO A 102 1.145 -2.183 0.419 1.00 0.00 C ATOM 0 HA PRO A 102 2.496 0.607 -0.443 1.00 0.00 H new ATOM 0 HB2 PRO A 102 0.333 0.020 -1.971 1.00 0.00 H new ATOM 0 HB3 PRO A 102 1.777 -0.967 -2.080 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -0.737 -1.481 -0.426 1.00 0.00 H new ATOM 0 HG3 PRO A 102 0.123 -2.605 -1.459 1.00 0.00 H new ATOM 0 HD2 PRO A 102 0.555 -2.603 1.234 1.00 0.00 H new ATOM 0 HD3 PRO A 102 1.870 -2.942 0.126 1.00 0.00 H new ATOM 1590 N LEU A 103 -0.184 0.861 1.382 1.00 0.00 N ATOM 1591 CA LEU A 103 -1.019 1.824 2.091 1.00 0.00 C ATOM 1592 C LEU A 103 -0.122 2.730 2.922 1.00 0.00 C ATOM 1593 O LEU A 103 -0.175 3.952 2.764 1.00 0.00 O ATOM 1594 CB LEU A 103 -2.041 1.074 2.957 1.00 0.00 C ATOM 1595 CG LEU A 103 -3.101 1.960 3.642 1.00 0.00 C ATOM 1596 CD1 LEU A 103 -4.309 1.088 4.001 1.00 0.00 C ATOM 1597 CD2 LEU A 103 -2.598 2.631 4.926 1.00 0.00 C ATOM 0 H LEU A 103 -0.298 -0.095 1.719 1.00 0.00 H new ATOM 0 HA LEU A 103 -1.576 2.446 1.390 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -2.552 0.341 2.333 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -1.503 0.519 3.726 1.00 0.00 H new ATOM 0 HG LEU A 103 -3.356 2.752 2.938 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -5.068 1.701 4.487 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -4.723 0.649 3.093 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -3.996 0.294 4.678 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -3.395 3.239 5.355 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -2.299 1.866 5.643 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -1.743 3.265 4.694 1.00 0.00 H new ATOM 1609 N GLU A 104 0.726 2.151 3.780 1.00 0.00 N ATOM 1610 CA GLU A 104 1.644 2.950 4.575 1.00 0.00 C ATOM 1611 C GLU A 104 2.644 3.654 3.673 1.00 0.00 C ATOM 1612 O GLU A 104 3.134 4.701 4.071 1.00 0.00 O ATOM 1613 CB GLU A 104 2.328 2.152 5.695 1.00 0.00 C ATOM 1614 CG GLU A 104 1.348 1.997 6.870 1.00 0.00 C ATOM 1615 CD GLU A 104 1.970 1.412 8.136 1.00 0.00 C ATOM 1616 OE1 GLU A 104 3.107 0.899 8.128 1.00 0.00 O ATOM 1617 OE2 GLU A 104 1.324 1.474 9.210 1.00 0.00 O ATOM 0 H GLU A 104 0.790 1.145 3.935 1.00 0.00 H new ATOM 0 HA GLU A 104 1.054 3.708 5.090 1.00 0.00 H new ATOM 0 HB2 GLU A 104 2.633 1.172 5.327 1.00 0.00 H new ATOM 0 HB3 GLU A 104 3.232 2.664 6.024 1.00 0.00 H new ATOM 0 HG2 GLU A 104 0.924 2.973 7.105 1.00 0.00 H new ATOM 0 HG3 GLU A 104 0.522 1.358 6.557 1.00 0.00 H new ATOM 1624 N TRP A 105 2.969 3.153 2.477 1.00 0.00 N ATOM 1625 CA TRP A 105 3.815 3.894 1.549 1.00 0.00 C ATOM 1626 C TRP A 105 3.067 5.152 1.128 1.00 0.00 C ATOM 1627 O TRP A 105 3.612 6.243 1.239 1.00 0.00 O ATOM 1628 CB TRP A 105 4.232 3.069 0.324 1.00 0.00 C ATOM 1629 CG TRP A 105 5.599 2.469 0.397 1.00 0.00 C ATOM 1630 CD1 TRP A 105 5.911 1.168 0.210 1.00 0.00 C ATOM 1631 CD2 TRP A 105 6.864 3.152 0.631 1.00 0.00 C ATOM 1632 NE1 TRP A 105 7.279 1.004 0.305 1.00 0.00 N ATOM 1633 CE2 TRP A 105 7.916 2.193 0.584 1.00 0.00 C ATOM 1634 CE3 TRP A 105 7.225 4.490 0.892 1.00 0.00 C ATOM 1635 CZ2 TRP A 105 9.255 2.542 0.819 1.00 0.00 C ATOM 1636 CZ3 TRP A 105 8.562 4.851 1.132 1.00 0.00 C ATOM 1637 CH2 TRP A 105 9.576 3.876 1.121 1.00 0.00 C ATOM 0 H TRP A 105 2.659 2.243 2.135 1.00 0.00 H new ATOM 0 HA TRP A 105 4.744 4.149 2.058 1.00 0.00 H new ATOM 0 HB2 TRP A 105 3.508 2.267 0.182 1.00 0.00 H new ATOM 0 HB3 TRP A 105 4.179 3.706 -0.559 1.00 0.00 H new ATOM 0 HD1 TRP A 105 5.200 0.378 0.016 1.00 0.00 H new ATOM 0 HE1 TRP A 105 7.759 0.112 0.183 1.00 0.00 H new ATOM 0 HE3 TRP A 105 6.460 5.252 0.908 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 10.031 1.792 0.768 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 8.812 5.883 1.326 1.00 0.00 H new ATOM 0 HH2 TRP A 105 10.596 4.152 1.344 1.00 0.00 H new ATOM 1648 N ARG A 106 1.806 5.042 0.711 1.00 0.00 N ATOM 1649 CA ARG A 106 1.004 6.198 0.312 1.00 0.00 C ATOM 1650 C ARG A 106 0.895 7.237 1.423 1.00 0.00 C ATOM 1651 O ARG A 106 0.828 8.428 1.146 1.00 0.00 O ATOM 1652 CB ARG A 106 -0.366 5.696 -0.158 1.00 0.00 C ATOM 1653 CG ARG A 106 -1.090 6.727 -1.026 1.00 0.00 C ATOM 1654 CD ARG A 106 -2.353 6.136 -1.673 1.00 0.00 C ATOM 1655 NE ARG A 106 -3.390 7.177 -1.826 1.00 0.00 N ATOM 1656 CZ ARG A 106 -4.088 7.609 -0.765 1.00 0.00 C ATOM 1657 NH1 ARG A 106 -4.445 6.764 0.194 1.00 0.00 N ATOM 1658 NH2 ARG A 106 -4.387 8.893 -0.660 1.00 0.00 N ATOM 0 H ARG A 106 1.313 4.152 0.640 1.00 0.00 H new ATOM 0 HA ARG A 106 1.498 6.715 -0.511 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -0.239 4.772 -0.723 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -0.981 5.457 0.709 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -1.362 7.589 -0.417 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -0.416 7.086 -1.804 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -2.106 5.714 -2.647 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -2.736 5.320 -1.060 1.00 0.00 H new ATOM 0 HE ARG A 106 -3.577 7.571 -2.748 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -4.189 5.779 0.127 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -4.976 7.100 0.998 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -4.087 9.547 -1.383 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -4.917 9.229 0.144 1.00 0.00 H new ATOM 1672 N GLN A 107 0.847 6.821 2.681 1.00 0.00 N ATOM 1673 CA GLN A 107 0.830 7.741 3.820 1.00 0.00 C ATOM 1674 C GLN A 107 2.234 8.251 4.166 1.00 0.00 C ATOM 1675 O GLN A 107 2.382 9.411 4.555 1.00 0.00 O ATOM 1676 CB GLN A 107 0.145 6.988 4.970 1.00 0.00 C ATOM 1677 CG GLN A 107 -0.164 7.823 6.219 1.00 0.00 C ATOM 1678 CD GLN A 107 -1.237 7.129 7.059 1.00 0.00 C ATOM 1679 OE1 GLN A 107 -1.223 5.911 7.231 1.00 0.00 O ATOM 1680 NE2 GLN A 107 -2.212 7.858 7.573 1.00 0.00 N ATOM 0 H GLN A 107 0.819 5.836 2.945 1.00 0.00 H new ATOM 0 HA GLN A 107 0.273 8.650 3.593 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -0.788 6.565 4.598 1.00 0.00 H new ATOM 0 HB3 GLN A 107 0.780 6.152 5.262 1.00 0.00 H new ATOM 0 HG2 GLN A 107 0.742 7.957 6.810 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -0.505 8.816 5.927 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -2.223 8.868 7.430 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -2.953 7.411 8.113 1.00 0.00 H new ATOM 1689 N ALA A 108 3.272 7.434 4.000 1.00 0.00 N ATOM 1690 CA ALA A 108 4.647 7.798 4.295 1.00 0.00 C ATOM 1691 C ALA A 108 5.208 8.753 3.259 1.00 0.00 C ATOM 1692 O ALA A 108 5.983 9.608 3.642 1.00 0.00 O ATOM 1693 CB ALA A 108 5.524 6.554 4.354 1.00 0.00 C ATOM 0 H ALA A 108 3.173 6.481 3.649 1.00 0.00 H new ATOM 0 HA ALA A 108 4.648 8.298 5.264 1.00 0.00 H new ATOM 0 HB1 ALA A 108 6.551 6.843 4.576 1.00 0.00 H new ATOM 0 HB2 ALA A 108 5.158 5.887 5.135 1.00 0.00 H new ATOM 0 HB3 ALA A 108 5.491 6.040 3.393 1.00 0.00 H new ATOM 1699 N ILE A 109 4.833 8.641 1.985 1.00 0.00 N ATOM 1700 CA ILE A 109 5.273 9.522 0.903 1.00 0.00 C ATOM 1701 C ILE A 109 4.829 10.953 1.201 1.00 0.00 C ATOM 1702 O ILE A 109 5.584 11.891 0.979 1.00 0.00 O ATOM 1703 CB ILE A 109 4.715 8.986 -0.432 1.00 0.00 C ATOM 1704 CG1 ILE A 109 5.402 7.660 -0.826 1.00 0.00 C ATOM 1705 CG2 ILE A 109 4.783 9.988 -1.592 1.00 0.00 C ATOM 1706 CD1 ILE A 109 6.716 7.753 -1.610 1.00 0.00 C ATOM 0 H ILE A 109 4.195 7.912 1.667 1.00 0.00 H new ATOM 0 HA ILE A 109 6.360 9.537 0.824 1.00 0.00 H new ATOM 0 HB ILE A 109 3.655 8.809 -0.250 1.00 0.00 H new ATOM 0 HG12 ILE A 109 5.593 7.095 0.087 1.00 0.00 H new ATOM 0 HG13 ILE A 109 4.696 7.078 -1.419 1.00 0.00 H new ATOM 0 HG21 ILE A 109 4.371 9.531 -2.492 1.00 0.00 H new ATOM 0 HG22 ILE A 109 4.205 10.877 -1.339 1.00 0.00 H new ATOM 0 HG23 ILE A 109 5.821 10.268 -1.770 1.00 0.00 H new ATOM 0 HD11 ILE A 109 7.087 6.750 -1.819 1.00 0.00 H new ATOM 0 HD12 ILE A 109 6.543 8.279 -2.549 1.00 0.00 H new ATOM 0 HD13 ILE A 109 7.454 8.297 -1.020 1.00 0.00 H new ATOM 1718 N TYR A 110 3.634 11.135 1.762 1.00 0.00 N ATOM 1719 CA TYR A 110 3.204 12.458 2.187 1.00 0.00 C ATOM 1720 C TYR A 110 4.135 12.969 3.272 1.00 0.00 C ATOM 1721 O TYR A 110 4.588 14.114 3.258 1.00 0.00 O ATOM 1722 CB TYR A 110 1.764 12.378 2.715 1.00 0.00 C ATOM 1723 CG TYR A 110 1.168 13.755 2.896 1.00 0.00 C ATOM 1724 CD1 TYR A 110 0.658 14.413 1.765 1.00 0.00 C ATOM 1725 CD2 TYR A 110 1.198 14.410 4.143 1.00 0.00 C ATOM 1726 CE1 TYR A 110 0.163 15.721 1.868 1.00 0.00 C ATOM 1727 CE2 TYR A 110 0.719 15.731 4.249 1.00 0.00 C ATOM 1728 CZ TYR A 110 0.211 16.396 3.107 1.00 0.00 C ATOM 1729 OH TYR A 110 -0.201 17.691 3.187 1.00 0.00 O ATOM 0 H TYR A 110 2.957 10.391 1.929 1.00 0.00 H new ATOM 0 HA TYR A 110 3.236 13.147 1.343 1.00 0.00 H new ATOM 0 HB2 TYR A 110 1.151 11.803 2.021 1.00 0.00 H new ATOM 0 HB3 TYR A 110 1.752 11.846 3.667 1.00 0.00 H new ATOM 0 HD1 TYR A 110 0.647 13.909 0.810 1.00 0.00 H new ATOM 0 HD2 TYR A 110 1.586 13.902 5.013 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -0.254 16.211 1.001 1.00 0.00 H new ATOM 0 HE2 TYR A 110 0.739 16.237 5.203 1.00 0.00 H new ATOM 0 HH TYR A 110 -0.105 18.008 4.109 1.00 0.00 H new ATOM 1739 N GLU A 111 4.431 12.069 4.197 1.00 0.00 N ATOM 1740 CA GLU A 111 5.271 12.305 5.332 1.00 0.00 C ATOM 1741 C GLU A 111 6.722 12.471 4.896 1.00 0.00 C ATOM 1742 O GLU A 111 7.442 13.088 5.650 1.00 0.00 O ATOM 1743 CB GLU A 111 5.080 11.131 6.299 1.00 0.00 C ATOM 1744 CG GLU A 111 5.255 11.559 7.749 1.00 0.00 C ATOM 1745 CD GLU A 111 4.853 10.421 8.691 1.00 0.00 C ATOM 1746 OE1 GLU A 111 3.628 10.230 8.891 1.00 0.00 O ATOM 1747 OE2 GLU A 111 5.734 9.741 9.270 1.00 0.00 O ATOM 0 H GLU A 111 4.070 11.116 4.164 1.00 0.00 H new ATOM 0 HA GLU A 111 5.000 13.232 5.837 1.00 0.00 H new ATOM 0 HB2 GLU A 111 4.085 10.706 6.163 1.00 0.00 H new ATOM 0 HB3 GLU A 111 5.797 10.345 6.063 1.00 0.00 H new ATOM 0 HG2 GLU A 111 6.292 11.840 7.930 1.00 0.00 H new ATOM 0 HG3 GLU A 111 4.646 12.440 7.951 1.00 0.00 H new ATOM 1754 N GLU A 112 7.183 12.045 3.712 1.00 0.00 N ATOM 1755 CA GLU A 112 8.535 12.265 3.247 1.00 0.00 C ATOM 1756 C GLU A 112 8.774 13.764 3.099 1.00 0.00 C ATOM 1757 O GLU A 112 9.847 14.247 3.452 1.00 0.00 O ATOM 1758 CB GLU A 112 8.748 11.568 1.900 1.00 0.00 C ATOM 1759 CG GLU A 112 8.888 10.042 1.912 1.00 0.00 C ATOM 1760 CD GLU A 112 10.086 9.538 2.713 1.00 0.00 C ATOM 1761 OE1 GLU A 112 11.192 9.457 2.133 1.00 0.00 O ATOM 1762 OE2 GLU A 112 9.892 9.081 3.860 1.00 0.00 O ATOM 0 H GLU A 112 6.606 11.529 3.048 1.00 0.00 H new ATOM 0 HA GLU A 112 9.239 11.851 3.969 1.00 0.00 H new ATOM 0 HB2 GLU A 112 7.910 11.825 1.251 1.00 0.00 H new ATOM 0 HB3 GLU A 112 9.645 11.985 1.443 1.00 0.00 H new ATOM 0 HG2 GLU A 112 7.978 9.607 2.325 1.00 0.00 H new ATOM 0 HG3 GLU A 112 8.974 9.687 0.885 1.00 0.00 H new ATOM 1769 N LYS A 113 7.765 14.532 2.667 1.00 0.00 N ATOM 1770 CA LYS A 113 7.909 15.985 2.512 1.00 0.00 C ATOM 1771 C LYS A 113 8.182 16.636 3.879 1.00 0.00 C ATOM 1772 O LYS A 113 8.842 17.672 3.986 1.00 0.00 O ATOM 1773 CB LYS A 113 6.633 16.510 1.818 1.00 0.00 C ATOM 1774 CG LYS A 113 6.807 17.761 0.940 1.00 0.00 C ATOM 1775 CD LYS A 113 6.810 19.082 1.717 1.00 0.00 C ATOM 1776 CE LYS A 113 6.764 20.296 0.778 1.00 0.00 C ATOM 1777 NZ LYS A 113 8.011 20.486 0.009 1.00 0.00 N ATOM 0 H LYS A 113 6.843 14.173 2.419 1.00 0.00 H new ATOM 0 HA LYS A 113 8.764 16.244 1.888 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.225 15.711 1.199 1.00 0.00 H new ATOM 0 HB3 LYS A 113 5.891 16.730 2.585 1.00 0.00 H new ATOM 0 HG2 LYS A 113 7.743 17.676 0.388 1.00 0.00 H new ATOM 0 HG3 LYS A 113 6.004 17.788 0.204 1.00 0.00 H new ATOM 0 HD2 LYS A 113 5.953 19.110 2.390 1.00 0.00 H new ATOM 0 HD3 LYS A 113 7.704 19.136 2.338 1.00 0.00 H new ATOM 0 HE2 LYS A 113 5.931 20.179 0.084 1.00 0.00 H new ATOM 0 HE3 LYS A 113 6.566 21.193 1.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 7.917 21.320 -0.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 8.805 20.627 0.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 8.190 19.645 -0.575 1.00 0.00 H new ATOM 1791 N LEU A 114 7.661 16.023 4.939 1.00 0.00 N ATOM 1792 CA LEU A 114 7.782 16.432 6.330 1.00 0.00 C ATOM 1793 C LEU A 114 9.045 15.852 6.963 1.00 0.00 C ATOM 1794 O LEU A 114 9.736 16.538 7.711 1.00 0.00 O ATOM 1795 CB LEU A 114 6.513 15.952 7.074 1.00 0.00 C ATOM 1796 CG LEU A 114 5.175 16.409 6.461 1.00 0.00 C ATOM 1797 CD1 LEU A 114 4.022 15.934 7.348 1.00 0.00 C ATOM 1798 CD2 LEU A 114 5.087 17.931 6.306 1.00 0.00 C ATOM 0 H LEU A 114 7.107 15.172 4.839 1.00 0.00 H new ATOM 0 HA LEU A 114 7.867 17.517 6.398 1.00 0.00 H new ATOM 0 HB2 LEU A 114 6.524 14.863 7.110 1.00 0.00 H new ATOM 0 HB3 LEU A 114 6.561 16.305 8.104 1.00 0.00 H new ATOM 0 HG LEU A 114 5.110 15.970 5.465 1.00 0.00 H new ATOM 0 HD11 LEU A 114 3.074 16.256 6.916 1.00 0.00 H new ATOM 0 HD12 LEU A 114 4.039 14.846 7.415 1.00 0.00 H new ATOM 0 HD13 LEU A 114 4.130 16.361 8.345 1.00 0.00 H new ATOM 0 HD21 LEU A 114 4.124 18.197 5.870 1.00 0.00 H new ATOM 0 HD22 LEU A 114 5.185 18.403 7.284 1.00 0.00 H new ATOM 0 HD23 LEU A 114 5.889 18.277 5.654 1.00 0.00 H new ATOM 1810 N ALA A 115 9.353 14.593 6.675 1.00 0.00 N ATOM 1811 CA ALA A 115 10.423 13.805 7.255 1.00 0.00 C ATOM 1812 C ALA A 115 11.765 14.240 6.699 1.00 0.00 C ATOM 1813 O ALA A 115 12.746 14.270 7.447 1.00 0.00 O ATOM 1814 CB ALA A 115 10.182 12.319 6.960 1.00 0.00 C ATOM 0 H ALA A 115 8.823 14.064 5.982 1.00 0.00 H new ATOM 0 HA ALA A 115 10.434 13.961 8.334 1.00 0.00 H new ATOM 0 HB1 ALA A 115 10.986 11.726 7.396 1.00 0.00 H new ATOM 0 HB2 ALA A 115 9.230 12.012 7.392 1.00 0.00 H new ATOM 0 HB3 ALA A 115 10.159 12.161 5.882 1.00 0.00 H new ATOM 1820 N GLN A 116 11.815 14.638 5.424 1.00 0.00 N ATOM 1821 CA GLN A 116 13.034 15.136 4.806 1.00 0.00 C ATOM 1822 C GLN A 116 13.541 16.380 5.547 1.00 0.00 C ATOM 1823 O GLN A 116 14.715 16.725 5.429 1.00 0.00 O ATOM 1824 CB GLN A 116 12.847 15.381 3.299 1.00 0.00 C ATOM 1825 CG GLN A 116 12.000 16.614 2.932 1.00 0.00 C ATOM 1826 CD GLN A 116 12.834 17.768 2.372 1.00 0.00 C ATOM 1827 OE1 GLN A 116 13.831 18.271 3.087 1.00 0.00 O flip ATOM 1828 NE2 GLN A 116 12.591 18.223 1.258 1.00 0.00 N flip ATOM 0 H GLN A 116 11.010 14.622 4.798 1.00 0.00 H new ATOM 0 HA GLN A 116 13.803 14.369 4.894 1.00 0.00 H new ATOM 0 HB2 GLN A 116 13.830 15.487 2.840 1.00 0.00 H new ATOM 0 HB3 GLN A 116 12.383 14.498 2.859 1.00 0.00 H new ATOM 0 HG2 GLN A 116 11.249 16.326 2.197 1.00 0.00 H new ATOM 0 HG3 GLN A 116 11.464 16.956 3.817 1.00 0.00 H new ATOM 0 HE21 GLN A 116 11.825 17.838 0.706 1.00 0.00 H new ATOM 0 HE22 GLN A 116 13.155 18.986 0.885 1.00 0.00 H new ATOM 1837 N ALA A 117 12.662 17.076 6.279 1.00 0.00 N ATOM 1838 CA ALA A 117 12.963 18.289 7.023 1.00 0.00 C ATOM 1839 C ALA A 117 13.688 18.017 8.346 1.00 0.00 C ATOM 1840 O ALA A 117 14.257 18.942 8.927 1.00 0.00 O ATOM 1841 CB ALA A 117 11.651 19.034 7.283 1.00 0.00 C ATOM 0 H ALA A 117 11.686 16.792 6.368 1.00 0.00 H new ATOM 0 HA ALA A 117 13.643 18.893 6.423 1.00 0.00 H new ATOM 0 HB1 ALA A 117 11.856 19.948 7.841 1.00 0.00 H new ATOM 0 HB2 ALA A 117 11.181 19.287 6.332 1.00 0.00 H new ATOM 0 HB3 ALA A 117 10.980 18.399 7.861 1.00 0.00 H new ATOM 1847 N ARG A 118 13.676 16.775 8.842 1.00 0.00 N ATOM 1848 CA ARG A 118 14.430 16.353 10.016 1.00 0.00 C ATOM 1849 C ARG A 118 15.604 15.506 9.548 1.00 0.00 C ATOM 1850 O ARG A 118 16.719 15.702 10.028 1.00 0.00 O ATOM 1851 CB ARG A 118 13.514 15.666 11.049 1.00 0.00 C ATOM 1852 CG ARG A 118 14.047 15.792 12.487 1.00 0.00 C ATOM 1853 CD ARG A 118 15.124 14.762 12.852 1.00 0.00 C ATOM 1854 NE ARG A 118 15.888 15.176 14.038 1.00 0.00 N ATOM 1855 CZ ARG A 118 16.802 14.451 14.691 1.00 0.00 C ATOM 1856 NH1 ARG A 118 17.109 13.221 14.304 1.00 0.00 N ATOM 1857 NH2 ARG A 118 17.411 14.978 15.741 1.00 0.00 N ATOM 0 H ARG A 118 13.128 16.022 8.425 1.00 0.00 H new ATOM 0 HA ARG A 118 14.839 17.211 10.550 1.00 0.00 H new ATOM 0 HB2 ARG A 118 12.518 16.105 10.995 1.00 0.00 H new ATOM 0 HB3 ARG A 118 13.412 14.611 10.794 1.00 0.00 H new ATOM 0 HG2 ARG A 118 14.456 16.793 12.624 1.00 0.00 H new ATOM 0 HG3 ARG A 118 13.213 15.691 13.182 1.00 0.00 H new ATOM 0 HD2 ARG A 118 14.656 13.796 13.039 1.00 0.00 H new ATOM 0 HD3 ARG A 118 15.802 14.630 12.009 1.00 0.00 H new ATOM 0 HE ARG A 118 15.702 16.111 14.399 1.00 0.00 H new ATOM 0 HH11 ARG A 118 16.645 12.810 13.494 1.00 0.00 H new ATOM 0 HH12 ARG A 118 17.809 12.685 14.816 1.00 0.00 H new ATOM 0 HH21 ARG A 118 17.181 15.925 16.042 1.00 0.00 H new ATOM 0 HH22 ARG A 118 18.111 14.437 16.249 1.00 0.00 H new ATOM 1871 N GLU A 119 15.372 14.649 8.550 1.00 0.00 N ATOM 1872 CA GLU A 119 16.375 13.842 7.868 1.00 0.00 C ATOM 1873 C GLU A 119 17.528 14.744 7.454 1.00 0.00 C ATOM 1874 O GLU A 119 18.672 14.339 7.607 1.00 0.00 O ATOM 1875 CB GLU A 119 15.739 13.229 6.614 1.00 0.00 C ATOM 1876 CG GLU A 119 16.681 12.417 5.706 1.00 0.00 C ATOM 1877 CD GLU A 119 16.206 12.405 4.248 1.00 0.00 C ATOM 1878 OE1 GLU A 119 15.947 13.488 3.671 1.00 0.00 O ATOM 1879 OE2 GLU A 119 16.139 11.315 3.639 1.00 0.00 O ATOM 0 H GLU A 119 14.433 14.495 8.182 1.00 0.00 H new ATOM 0 HA GLU A 119 16.740 13.052 8.525 1.00 0.00 H new ATOM 0 HB2 GLU A 119 14.920 12.581 6.926 1.00 0.00 H new ATOM 0 HB3 GLU A 119 15.301 14.033 6.023 1.00 0.00 H new ATOM 0 HG2 GLU A 119 17.685 12.838 5.757 1.00 0.00 H new ATOM 0 HG3 GLU A 119 16.746 11.393 6.074 1.00 0.00 H new ATOM 1886 N SER A 120 17.246 15.970 6.994 1.00 0.00 N ATOM 1887 CA SER A 120 18.250 16.903 6.503 1.00 0.00 C ATOM 1888 C SER A 120 19.414 17.109 7.478 1.00 0.00 C ATOM 1889 O SER A 120 20.527 17.389 7.041 1.00 0.00 O ATOM 1890 CB SER A 120 17.585 18.237 6.137 1.00 0.00 C ATOM 1891 OG SER A 120 16.622 18.646 7.097 1.00 0.00 O ATOM 0 H SER A 120 16.296 16.341 6.955 1.00 0.00 H new ATOM 0 HA SER A 120 18.692 16.462 5.609 1.00 0.00 H new ATOM 0 HB2 SER A 120 18.350 19.007 6.044 1.00 0.00 H new ATOM 0 HB3 SER A 120 17.105 18.145 5.163 1.00 0.00 H new ATOM 0 HG SER A 120 16.228 19.500 6.821 1.00 0.00 H new ATOM 1897 N ILE A 121 19.181 16.988 8.788 1.00 0.00 N ATOM 1898 CA ILE A 121 20.228 17.096 9.798 1.00 0.00 C ATOM 1899 C ILE A 121 21.201 15.929 9.595 1.00 0.00 C ATOM 1900 O ILE A 121 22.401 16.136 9.426 1.00 0.00 O ATOM 1901 CB ILE A 121 19.593 17.123 11.213 1.00 0.00 C ATOM 1902 CG1 ILE A 121 18.593 18.300 11.355 1.00 0.00 C ATOM 1903 CG2 ILE A 121 20.680 17.222 12.299 1.00 0.00 C ATOM 1904 CD1 ILE A 121 17.704 18.207 12.599 1.00 0.00 C ATOM 0 H ILE A 121 18.254 16.811 9.176 1.00 0.00 H new ATOM 0 HA ILE A 121 20.788 18.026 9.699 1.00 0.00 H new ATOM 0 HB ILE A 121 19.047 16.189 11.347 1.00 0.00 H new ATOM 0 HG12 ILE A 121 19.150 19.236 11.387 1.00 0.00 H new ATOM 0 HG13 ILE A 121 17.960 18.336 10.469 1.00 0.00 H new ATOM 0 HG21 ILE A 121 20.211 17.239 13.283 1.00 0.00 H new ATOM 0 HG22 ILE A 121 21.344 16.360 12.229 1.00 0.00 H new ATOM 0 HG23 ILE A 121 21.256 18.136 12.155 1.00 0.00 H new ATOM 0 HD11 ILE A 121 17.031 19.064 12.630 1.00 0.00 H new ATOM 0 HD12 ILE A 121 17.119 17.288 12.560 1.00 0.00 H new ATOM 0 HD13 ILE A 121 18.328 18.203 13.493 1.00 0.00 H new ATOM 1916 N ILE A 122 20.681 14.700 9.578 1.00 0.00 N ATOM 1917 CA ILE A 122 21.474 13.497 9.371 1.00 0.00 C ATOM 1918 C ILE A 122 22.072 13.519 7.961 1.00 0.00 C ATOM 1919 O ILE A 122 23.221 13.136 7.802 1.00 0.00 O ATOM 1920 CB ILE A 122 20.624 12.230 9.637 1.00 0.00 C ATOM 1921 CG1 ILE A 122 19.815 12.295 10.957 1.00 0.00 C ATOM 1922 CG2 ILE A 122 21.508 10.969 9.619 1.00 0.00 C ATOM 1923 CD1 ILE A 122 20.634 12.575 12.226 1.00 0.00 C ATOM 0 H ILE A 122 19.687 14.515 9.709 1.00 0.00 H new ATOM 0 HA ILE A 122 22.299 13.470 10.083 1.00 0.00 H new ATOM 0 HB ILE A 122 19.896 12.180 8.827 1.00 0.00 H new ATOM 0 HG12 ILE A 122 19.055 13.070 10.858 1.00 0.00 H new ATOM 0 HG13 ILE A 122 19.290 11.349 11.087 1.00 0.00 H new ATOM 0 HG21 ILE A 122 20.892 10.090 9.808 1.00 0.00 H new ATOM 0 HG22 ILE A 122 21.987 10.874 8.644 1.00 0.00 H new ATOM 0 HG23 ILE A 122 22.272 11.049 10.392 1.00 0.00 H new ATOM 0 HD11 ILE A 122 19.970 12.599 13.090 1.00 0.00 H new ATOM 0 HD12 ILE A 122 21.376 11.788 12.361 1.00 0.00 H new ATOM 0 HD13 ILE A 122 21.138 13.537 12.129 1.00 0.00 H new ATOM 1935 N ALA A 123 21.354 14.025 6.955 1.00 0.00 N ATOM 1936 CA ALA A 123 21.815 14.096 5.573 1.00 0.00 C ATOM 1937 C ALA A 123 23.057 14.977 5.397 1.00 0.00 C ATOM 1938 O ALA A 123 23.680 14.931 4.335 1.00 0.00 O ATOM 1939 CB ALA A 123 20.690 14.611 4.671 1.00 0.00 C ATOM 0 H ALA A 123 20.416 14.404 7.085 1.00 0.00 H new ATOM 0 HA ALA A 123 22.098 13.083 5.287 1.00 0.00 H new ATOM 0 HB1 ALA A 123 21.043 14.661 3.641 1.00 0.00 H new ATOM 0 HB2 ALA A 123 19.838 13.934 4.730 1.00 0.00 H new ATOM 0 HB3 ALA A 123 20.387 15.605 4.999 1.00 0.00 H new ATOM 1945 N ASP A 124 23.421 15.787 6.396 1.00 0.00 N ATOM 1946 CA ASP A 124 24.614 16.636 6.368 1.00 0.00 C ATOM 1947 C ASP A 124 25.732 16.111 7.271 1.00 0.00 C ATOM 1948 O ASP A 124 26.866 16.587 7.185 1.00 0.00 O ATOM 1949 CB ASP A 124 24.239 18.072 6.753 1.00 0.00 C ATOM 1950 CG ASP A 124 24.071 18.943 5.508 1.00 0.00 C ATOM 1951 OD1 ASP A 124 25.034 19.038 4.714 1.00 0.00 O ATOM 1952 OD2 ASP A 124 22.965 19.492 5.287 1.00 0.00 O ATOM 0 H ASP A 124 22.886 15.872 7.260 1.00 0.00 H new ATOM 0 HA ASP A 124 25.003 16.620 5.350 1.00 0.00 H new ATOM 0 HB2 ASP A 124 23.313 18.069 7.328 1.00 0.00 H new ATOM 0 HB3 ASP A 124 25.011 18.494 7.396 1.00 0.00 H new ATOM 1957 N ASN A 125 25.437 15.116 8.106 1.00 0.00 N ATOM 1958 CA ASN A 125 26.378 14.419 8.986 1.00 0.00 C ATOM 1959 C ASN A 125 26.073 12.915 8.925 1.00 0.00 C ATOM 1960 O ASN A 125 25.936 12.247 9.953 1.00 0.00 O ATOM 1961 CB ASN A 125 26.291 15.010 10.408 1.00 0.00 C ATOM 1962 CG ASN A 125 27.601 14.825 11.163 1.00 0.00 C ATOM 1963 OD1 ASN A 125 28.186 15.798 11.617 1.00 0.00 O ATOM 1964 ND2 ASN A 125 28.085 13.602 11.285 1.00 0.00 N ATOM 0 H ASN A 125 24.487 14.755 8.193 1.00 0.00 H new ATOM 0 HA ASN A 125 27.410 14.557 8.662 1.00 0.00 H new ATOM 0 HB2 ASN A 125 26.049 16.071 10.349 1.00 0.00 H new ATOM 0 HB3 ASN A 125 25.481 14.528 10.956 1.00 0.00 H new ATOM 0 HD21 ASN A 125 28.970 13.450 11.769 1.00 0.00 H new ATOM 0 HD22 ASN A 125 27.574 12.810 10.896 1.00 0.00 H new ATOM 1971 N ASN A 126 25.961 12.395 7.700 1.00 0.00 N ATOM 1972 CA ASN A 126 25.543 11.039 7.331 1.00 0.00 C ATOM 1973 C ASN A 126 26.150 9.937 8.181 1.00 0.00 C ATOM 1974 O ASN A 126 25.424 9.249 8.906 1.00 0.00 O ATOM 1975 CB ASN A 126 25.772 10.760 5.834 1.00 0.00 C ATOM 1976 CG ASN A 126 25.029 11.755 4.968 1.00 0.00 C ATOM 1977 OD1 ASN A 126 23.870 11.541 4.637 1.00 0.00 O ATOM 1978 ND2 ASN A 126 25.643 12.870 4.608 1.00 0.00 N ATOM 0 H ASN A 126 26.177 12.955 6.875 1.00 0.00 H new ATOM 0 HA ASN A 126 24.473 11.016 7.537 1.00 0.00 H new ATOM 0 HB2 ASN A 126 26.838 10.807 5.612 1.00 0.00 H new ATOM 0 HB3 ASN A 126 25.441 9.749 5.596 1.00 0.00 H new ATOM 0 HD21 ASN A 126 25.150 13.565 4.047 1.00 0.00 H new ATOM 0 HD22 ASN A 126 26.609 13.035 4.891 1.00 0.00 H new ATOM 1985 N ILE A 127 27.459 9.739 8.054 1.00 0.00 N ATOM 1986 CA ILE A 127 28.232 8.659 8.673 1.00 0.00 C ATOM 1987 C ILE A 127 29.554 9.207 9.241 1.00 0.00 C ATOM 1988 O ILE A 127 30.205 8.540 10.047 1.00 0.00 O ATOM 1989 CB ILE A 127 28.423 7.537 7.610 1.00 0.00 C ATOM 1990 CG1 ILE A 127 27.087 6.880 7.182 1.00 0.00 C ATOM 1991 CG2 ILE A 127 29.410 6.428 8.016 1.00 0.00 C ATOM 1992 CD1 ILE A 127 26.342 6.115 8.287 1.00 0.00 C ATOM 0 H ILE A 127 28.041 10.357 7.489 1.00 0.00 H new ATOM 0 HA ILE A 127 27.707 8.228 9.525 1.00 0.00 H new ATOM 0 HB ILE A 127 28.857 8.072 6.765 1.00 0.00 H new ATOM 0 HG12 ILE A 127 26.428 7.657 6.795 1.00 0.00 H new ATOM 0 HG13 ILE A 127 27.287 6.193 6.360 1.00 0.00 H new ATOM 0 HG21 ILE A 127 29.479 5.691 7.215 1.00 0.00 H new ATOM 0 HG22 ILE A 127 30.393 6.863 8.194 1.00 0.00 H new ATOM 0 HG23 ILE A 127 29.058 5.943 8.926 1.00 0.00 H new ATOM 0 HD11 ILE A 127 25.421 5.695 7.882 1.00 0.00 H new ATOM 0 HD12 ILE A 127 26.974 5.310 8.662 1.00 0.00 H new ATOM 0 HD13 ILE A 127 26.101 6.797 9.103 1.00 0.00 H new ATOM 2004 N GLN A 128 29.946 10.421 8.852 1.00 0.00 N ATOM 2005 CA GLN A 128 31.132 11.142 9.281 1.00 0.00 C ATOM 2006 C GLN A 128 30.684 12.587 9.402 1.00 0.00 C ATOM 2007 O GLN A 128 30.680 13.100 10.531 1.00 0.00 O ATOM 2008 CB GLN A 128 32.257 11.004 8.241 1.00 0.00 C ATOM 2009 CG GLN A 128 32.705 9.561 7.956 1.00 0.00 C ATOM 2010 CD GLN A 128 33.696 9.479 6.791 1.00 0.00 C ATOM 2011 OE1 GLN A 128 34.720 8.800 6.868 1.00 0.00 O ATOM 2012 NE2 GLN A 128 33.385 10.113 5.672 1.00 0.00 N ATOM 2013 OXT GLN A 128 30.245 13.132 8.356 1.00 0.00 O ATOM 0 H GLN A 128 29.399 10.960 8.180 1.00 0.00 H new ATOM 0 HA GLN A 128 31.532 10.757 10.219 1.00 0.00 H new ATOM 0 HB2 GLN A 128 31.925 11.457 7.307 1.00 0.00 H new ATOM 0 HB3 GLN A 128 33.120 11.575 8.583 1.00 0.00 H new ATOM 0 HG2 GLN A 128 33.165 9.142 8.851 1.00 0.00 H new ATOM 0 HG3 GLN A 128 31.831 8.950 7.731 1.00 0.00 H new ATOM 0 HE21 GLN A 128 32.533 10.672 5.622 1.00 0.00 H new ATOM 0 HE22 GLN A 128 33.997 10.043 4.859 1.00 0.00 H new TER 2022 GLN A 128