USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 985 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 96 THR OG1 : rot 88:sc= 1.18 USER MOD Set 1.2: A 97 ASN :FLIP amide:sc= 1.01 F(o=1.2,f=2.2) USER MOD Set 2.1: A 65 LYS NZ :NH3+ -125:sc= -0.0359 (180deg=-1.64!) USER MOD Set 2.2: A 68 SER OG : rot -44:sc= -0.227 USER MOD Set 3.1: A 23 TYR OH : rot 155:sc= -0.909! USER MOD Set 3.2: A 27 SER OG : rot -80:sc= -1.58 USER MOD Set 3.3: A 112 HIS : no HD1:sc= -6.71! C(o=-9.2!,f=-12!) USER MOD Set 4.1: A 20 THR OG1 : rot -68:sc= -1.59! USER MOD Set 4.2: A 108 MET CE :methyl 157:sc= -5.94! (180deg=-8.3!) USER MOD Set 5.1: A 18 TYR OH : rot 165:sc= 0 USER MOD Set 5.2: A 92 ASN : amide:sc= -2.73 K(o=-2.7,f=-13!) USER MOD Single : A 1 PHE N :NH3+ -144:sc= 0.0602 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 TYR OH : rot 94:sc= -3.38 USER MOD Single : A 24 SER OG : rot 160:sc= -1.14 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 ASN : amide:sc= -2.03! C(o=-2!,f=-4.7!) USER MOD Single : A 31 LYS NZ :NH3+ -150:sc= -1.58 (180deg=-4.44!) USER MOD Single : A 34 GLN : amide:sc= -2.57 K(o=-2.6,f=-4.4!) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 MET CE :methyl -146:sc= -3.24! (180deg=-4.45!) USER MOD Single : A 54 SER OG : rot 90:sc=8.04e-05 USER MOD Single : A 57 ASN : amide:sc= -0.0752 K(o=-0.075,f=-3.7!) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl -129:sc= -1.91 (180deg=-5.81!) USER MOD Single : A 73 THR OG1 : rot 59:sc= -5.71! USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot -90:sc= -1.34 USER MOD Single : A 83 SER OG : rot -58:sc= 1.13 USER MOD Single : A 84 ASN : amide:sc=-0.00644 X(o=-0.0064,f=0) USER MOD Single : A 87 ASN : amide:sc= -1.13 K(o=-1.1,f=-3.8!) USER MOD Single : A 98 THR OG1 : rot 35:sc= -1.74 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl 159:sc= -0.0802 (180deg=-0.447) USER MOD Single : A 110 SER OG : rot -57:sc= 0.123 USER MOD Single : A 118 CYS SG : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 48:sc= 0.0448 USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 1 9.835 15.277 28.783 1.00 0.00 N ATOM 2 CA PHE A 1 9.511 13.906 29.256 1.00 0.00 C ATOM 3 C PHE A 1 10.631 13.343 30.125 1.00 0.00 C ATOM 4 O PHE A 1 11.550 14.065 30.514 1.00 0.00 O ATOM 5 CB PHE A 1 9.287 13.010 28.037 1.00 0.00 C ATOM 6 CG PHE A 1 8.189 12.001 28.226 1.00 0.00 C ATOM 7 CD1 PHE A 1 6.888 12.411 28.468 1.00 0.00 C ATOM 8 CD2 PHE A 1 8.460 10.644 28.163 1.00 0.00 C ATOM 9 CE1 PHE A 1 5.877 11.486 28.642 1.00 0.00 C ATOM 10 CE2 PHE A 1 7.452 9.714 28.336 1.00 0.00 C ATOM 11 CZ PHE A 1 6.159 10.136 28.577 1.00 0.00 C ATOM 0 H1 PHE A 1 8.967 15.849 28.754 1.00 0.00 H new ATOM 0 H2 PHE A 1 10.517 15.716 29.433 1.00 0.00 H new ATOM 0 H3 PHE A 1 10.248 15.227 27.830 1.00 0.00 H new ATOM 0 HA PHE A 1 8.609 13.942 29.867 1.00 0.00 H new ATOM 0 HB2 PHE A 1 9.051 13.635 27.176 1.00 0.00 H new ATOM 0 HB3 PHE A 1 10.215 12.486 27.806 1.00 0.00 H new ATOM 0 HD1 PHE A 1 6.662 13.466 28.521 1.00 0.00 H new ATOM 0 HD2 PHE A 1 9.470 10.309 27.977 1.00 0.00 H new ATOM 0 HE1 PHE A 1 4.867 11.819 28.829 1.00 0.00 H new ATOM 0 HE2 PHE A 1 7.675 8.659 28.283 1.00 0.00 H new ATOM 0 HZ PHE A 1 5.370 9.411 28.714 1.00 0.00 H new ATOM 22 N ALA A 2 10.549 12.051 30.424 1.00 0.00 N ATOM 23 CA ALA A 2 11.557 11.392 31.246 1.00 0.00 C ATOM 24 C ALA A 2 11.609 9.896 30.955 1.00 0.00 C ATOM 25 O ALA A 2 10.633 9.310 30.485 1.00 0.00 O ATOM 26 CB ALA A 2 11.276 11.636 32.721 1.00 0.00 C ATOM 0 H ALA A 2 9.795 11.440 30.110 1.00 0.00 H new ATOM 0 HA ALA A 2 12.529 11.818 30.998 1.00 0.00 H new ATOM 0 HB1 ALA A 2 12.036 11.138 33.323 1.00 0.00 H new ATOM 0 HB2 ALA A 2 11.297 12.707 32.923 1.00 0.00 H new ATOM 0 HB3 ALA A 2 10.294 11.238 32.975 1.00 0.00 H new ATOM 32 N LYS A 3 12.753 9.283 31.239 1.00 0.00 N ATOM 33 CA LYS A 3 12.933 7.853 31.008 1.00 0.00 C ATOM 34 C LYS A 3 12.766 7.516 29.530 1.00 0.00 C ATOM 35 O LYS A 3 11.670 7.618 28.979 1.00 0.00 O ATOM 36 CB LYS A 3 11.932 7.052 31.842 1.00 0.00 C ATOM 37 CG LYS A 3 12.408 6.771 33.259 1.00 0.00 C ATOM 38 CD LYS A 3 11.243 6.692 34.232 1.00 0.00 C ATOM 39 CE LYS A 3 11.030 8.011 34.956 1.00 0.00 C ATOM 40 NZ LYS A 3 11.951 8.162 36.116 1.00 0.00 N ATOM 0 H LYS A 3 13.570 9.753 31.629 1.00 0.00 H new ATOM 0 HA LYS A 3 13.945 7.585 31.311 1.00 0.00 H new ATOM 0 HB2 LYS A 3 10.989 7.597 31.886 1.00 0.00 H new ATOM 0 HB3 LYS A 3 11.730 6.105 31.341 1.00 0.00 H new ATOM 0 HG2 LYS A 3 12.964 5.834 33.278 1.00 0.00 H new ATOM 0 HG3 LYS A 3 13.095 7.556 33.575 1.00 0.00 H new ATOM 0 HD2 LYS A 3 10.335 6.421 33.693 1.00 0.00 H new ATOM 0 HD3 LYS A 3 11.429 5.902 34.960 1.00 0.00 H new ATOM 0 HE2 LYS A 3 11.184 8.836 34.260 1.00 0.00 H new ATOM 0 HE3 LYS A 3 9.998 8.073 35.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 11.774 9.074 36.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 11.787 7.389 36.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 12.936 8.128 35.784 1.00 0.00 H new ATOM 54 N LEU A 4 13.861 7.113 28.894 1.00 0.00 N ATOM 55 CA LEU A 4 13.837 6.760 27.479 1.00 0.00 C ATOM 56 C LEU A 4 13.393 7.947 26.629 1.00 0.00 C ATOM 57 O LEU A 4 12.787 8.892 27.133 1.00 0.00 O ATOM 58 CB LEU A 4 12.901 5.572 27.244 1.00 0.00 C ATOM 59 CG LEU A 4 13.511 4.200 27.533 1.00 0.00 C ATOM 60 CD1 LEU A 4 13.643 3.979 29.031 1.00 0.00 C ATOM 61 CD2 LEU A 4 12.671 3.101 26.901 1.00 0.00 C ATOM 0 H LEU A 4 14.776 7.023 29.336 1.00 0.00 H new ATOM 0 HA LEU A 4 14.848 6.482 27.183 1.00 0.00 H new ATOM 0 HB2 LEU A 4 12.016 5.698 27.867 1.00 0.00 H new ATOM 0 HB3 LEU A 4 12.566 5.593 26.207 1.00 0.00 H new ATOM 0 HG LEU A 4 14.508 4.166 27.094 1.00 0.00 H new ATOM 0 HD11 LEU A 4 14.079 2.997 29.217 1.00 0.00 H new ATOM 0 HD12 LEU A 4 14.287 4.749 29.457 1.00 0.00 H new ATOM 0 HD13 LEU A 4 12.658 4.032 29.495 1.00 0.00 H new ATOM 0 HD21 LEU A 4 13.119 2.131 27.116 1.00 0.00 H new ATOM 0 HD22 LEU A 4 11.662 3.133 27.311 1.00 0.00 H new ATOM 0 HD23 LEU A 4 12.629 3.250 25.822 1.00 0.00 H new ATOM 73 N VAL A 5 13.701 7.891 25.338 1.00 0.00 N ATOM 74 CA VAL A 5 13.336 8.961 24.418 1.00 0.00 C ATOM 75 C VAL A 5 13.295 8.460 22.978 1.00 0.00 C ATOM 76 O VAL A 5 13.569 9.210 22.042 1.00 0.00 O ATOM 77 CB VAL A 5 14.320 10.143 24.509 1.00 0.00 C ATOM 78 CG1 VAL A 5 14.087 10.935 25.787 1.00 0.00 C ATOM 79 CG2 VAL A 5 15.756 9.648 24.434 1.00 0.00 C ATOM 0 H VAL A 5 14.203 7.116 24.905 1.00 0.00 H new ATOM 0 HA VAL A 5 12.343 9.301 24.710 1.00 0.00 H new ATOM 0 HB VAL A 5 14.143 10.806 23.662 1.00 0.00 H new ATOM 0 HG11 VAL A 5 14.791 11.766 25.834 1.00 0.00 H new ATOM 0 HG12 VAL A 5 13.068 11.322 25.794 1.00 0.00 H new ATOM 0 HG13 VAL A 5 14.235 10.285 26.650 1.00 0.00 H new ATOM 0 HG21 VAL A 5 16.437 10.496 24.500 1.00 0.00 H new ATOM 0 HG22 VAL A 5 15.948 8.963 25.260 1.00 0.00 H new ATOM 0 HG23 VAL A 5 15.913 9.129 23.488 1.00 0.00 H new ATOM 89 N ARG A 6 12.951 7.186 22.810 1.00 0.00 N ATOM 90 CA ARG A 6 12.874 6.584 21.484 1.00 0.00 C ATOM 91 C ARG A 6 11.469 6.054 21.209 1.00 0.00 C ATOM 92 O ARG A 6 11.243 4.843 21.207 1.00 0.00 O ATOM 93 CB ARG A 6 13.896 5.453 21.356 1.00 0.00 C ATOM 94 CG ARG A 6 13.927 4.521 22.557 1.00 0.00 C ATOM 95 CD ARG A 6 15.027 3.481 22.427 1.00 0.00 C ATOM 96 NE ARG A 6 14.645 2.202 23.021 1.00 0.00 N ATOM 97 CZ ARG A 6 15.319 1.068 22.839 1.00 0.00 C ATOM 98 NH1 ARG A 6 16.409 1.051 22.081 1.00 0.00 N ATOM 99 NH2 ARG A 6 14.902 -0.050 23.416 1.00 0.00 N ATOM 0 H ARG A 6 12.722 6.552 23.575 1.00 0.00 H new ATOM 0 HA ARG A 6 13.102 7.354 20.747 1.00 0.00 H new ATOM 0 HB2 ARG A 6 13.672 4.872 20.461 1.00 0.00 H new ATOM 0 HB3 ARG A 6 14.887 5.884 21.216 1.00 0.00 H new ATOM 0 HG2 ARG A 6 14.080 5.102 23.466 1.00 0.00 H new ATOM 0 HG3 ARG A 6 12.963 4.022 22.657 1.00 0.00 H new ATOM 0 HD2 ARG A 6 15.265 3.335 21.373 1.00 0.00 H new ATOM 0 HD3 ARG A 6 15.932 3.849 22.910 1.00 0.00 H new ATOM 0 HE ARG A 6 13.813 2.176 23.610 1.00 0.00 H new ATOM 0 HH11 ARG A 6 16.734 1.909 21.635 1.00 0.00 H new ATOM 0 HH12 ARG A 6 16.922 0.180 21.945 1.00 0.00 H new ATOM 0 HH21 ARG A 6 14.065 -0.042 23.999 1.00 0.00 H new ATOM 0 HH22 ARG A 6 15.418 -0.919 23.277 1.00 0.00 H new ATOM 113 N PRO A 7 10.504 6.957 20.970 1.00 0.00 N ATOM 114 CA PRO A 7 9.115 6.575 20.692 1.00 0.00 C ATOM 115 C PRO A 7 8.953 5.940 19.311 1.00 0.00 C ATOM 116 O PRO A 7 9.073 6.620 18.292 1.00 0.00 O ATOM 117 CB PRO A 7 8.362 7.905 20.758 1.00 0.00 C ATOM 118 CG PRO A 7 9.383 8.933 20.412 1.00 0.00 C ATOM 119 CD PRO A 7 10.689 8.420 20.952 1.00 0.00 C ATOM 0 HA PRO A 7 8.750 5.826 21.395 1.00 0.00 H new ATOM 0 HB2 PRO A 7 7.528 7.923 20.057 1.00 0.00 H new ATOM 0 HB3 PRO A 7 7.947 8.077 21.751 1.00 0.00 H new ATOM 0 HG2 PRO A 7 9.438 9.080 19.333 1.00 0.00 H new ATOM 0 HG3 PRO A 7 9.131 9.897 20.853 1.00 0.00 H new ATOM 0 HD2 PRO A 7 11.527 8.711 20.319 1.00 0.00 H new ATOM 0 HD3 PRO A 7 10.892 8.811 21.949 1.00 0.00 H new ATOM 127 N PRO A 8 8.674 4.625 19.256 1.00 0.00 N ATOM 128 CA PRO A 8 8.496 3.911 17.988 1.00 0.00 C ATOM 129 C PRO A 8 7.215 4.320 17.270 1.00 0.00 C ATOM 130 O PRO A 8 6.317 4.910 17.870 1.00 0.00 O ATOM 131 CB PRO A 8 8.426 2.442 18.411 1.00 0.00 C ATOM 132 CG PRO A 8 7.942 2.477 19.819 1.00 0.00 C ATOM 133 CD PRO A 8 8.510 3.732 20.420 1.00 0.00 C ATOM 0 HA PRO A 8 9.300 4.126 17.284 1.00 0.00 H new ATOM 0 HB2 PRO A 8 7.746 1.878 17.772 1.00 0.00 H new ATOM 0 HB3 PRO A 8 9.402 1.962 18.340 1.00 0.00 H new ATOM 0 HG2 PRO A 8 6.853 2.484 19.857 1.00 0.00 H new ATOM 0 HG3 PRO A 8 8.274 1.596 20.368 1.00 0.00 H new ATOM 0 HD2 PRO A 8 7.839 4.161 21.164 1.00 0.00 H new ATOM 0 HD3 PRO A 8 9.461 3.544 20.919 1.00 0.00 H new ATOM 141 N VAL A 9 7.135 4.002 15.982 1.00 0.00 N ATOM 142 CA VAL A 9 5.963 4.337 15.183 1.00 0.00 C ATOM 143 C VAL A 9 5.239 3.080 14.713 1.00 0.00 C ATOM 144 O VAL A 9 5.812 2.245 14.012 1.00 0.00 O ATOM 145 CB VAL A 9 6.340 5.190 13.956 1.00 0.00 C ATOM 146 CG1 VAL A 9 6.920 6.526 14.393 1.00 0.00 C ATOM 147 CG2 VAL A 9 7.317 4.443 13.062 1.00 0.00 C ATOM 0 H VAL A 9 7.869 3.512 15.470 1.00 0.00 H new ATOM 0 HA VAL A 9 5.300 4.916 15.826 1.00 0.00 H new ATOM 0 HB VAL A 9 5.435 5.383 13.380 1.00 0.00 H new ATOM 0 HG11 VAL A 9 7.180 7.115 13.513 1.00 0.00 H new ATOM 0 HG12 VAL A 9 6.182 7.066 14.986 1.00 0.00 H new ATOM 0 HG13 VAL A 9 7.814 6.356 14.993 1.00 0.00 H new ATOM 0 HG21 VAL A 9 7.570 5.063 12.202 1.00 0.00 H new ATOM 0 HG22 VAL A 9 8.223 4.215 13.624 1.00 0.00 H new ATOM 0 HG23 VAL A 9 6.860 3.515 12.719 1.00 0.00 H new ATOM 157 N GLN A 10 3.975 2.955 15.103 1.00 0.00 N ATOM 158 CA GLN A 10 3.161 1.806 14.724 1.00 0.00 C ATOM 159 C GLN A 10 1.765 1.921 15.324 1.00 0.00 C ATOM 160 O GLN A 10 1.615 2.215 16.510 1.00 0.00 O ATOM 161 CB GLN A 10 3.823 0.505 15.187 1.00 0.00 C ATOM 162 CG GLN A 10 3.652 -0.645 14.209 1.00 0.00 C ATOM 163 CD GLN A 10 4.579 -1.808 14.509 1.00 0.00 C ATOM 164 OE1 GLN A 10 5.429 -2.166 13.694 1.00 0.00 O ATOM 165 NE2 GLN A 10 4.419 -2.403 15.686 1.00 0.00 N ATOM 0 H GLN A 10 3.490 3.639 15.684 1.00 0.00 H new ATOM 0 HA GLN A 10 3.076 1.790 13.637 1.00 0.00 H new ATOM 0 HB2 GLN A 10 4.887 0.684 15.343 1.00 0.00 H new ATOM 0 HB3 GLN A 10 3.404 0.217 16.151 1.00 0.00 H new ATOM 0 HG2 GLN A 10 2.619 -0.992 14.238 1.00 0.00 H new ATOM 0 HG3 GLN A 10 3.840 -0.287 13.197 1.00 0.00 H new ATOM 0 HE21 GLN A 10 3.701 -2.073 16.331 1.00 0.00 H new ATOM 0 HE22 GLN A 10 5.014 -3.190 15.945 1.00 0.00 H new ATOM 174 N ILE A 11 0.744 1.693 14.502 1.00 0.00 N ATOM 175 CA ILE A 11 -0.636 1.779 14.965 1.00 0.00 C ATOM 176 C ILE A 11 -0.970 3.204 15.399 1.00 0.00 C ATOM 177 O ILE A 11 -0.281 3.784 16.238 1.00 0.00 O ATOM 178 CB ILE A 11 -0.885 0.824 16.139 1.00 0.00 C ATOM 179 CG1 ILE A 11 -0.561 -0.616 15.734 1.00 0.00 C ATOM 180 CG2 ILE A 11 -2.324 0.937 16.619 1.00 0.00 C ATOM 181 CD1 ILE A 11 -1.469 -1.159 14.653 1.00 0.00 C ATOM 0 H ILE A 11 0.846 1.449 13.517 1.00 0.00 H new ATOM 0 HA ILE A 11 -1.279 1.493 14.132 1.00 0.00 H new ATOM 0 HB ILE A 11 -0.227 1.105 16.961 1.00 0.00 H new ATOM 0 HG12 ILE A 11 0.471 -0.664 15.388 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -0.632 -1.257 16.613 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -2.484 0.253 17.452 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -2.520 1.958 16.945 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -3.001 0.681 15.804 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -1.181 -2.183 14.417 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -2.501 -1.144 15.003 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -1.380 -0.542 13.759 1.00 0.00 H new ATOM 193 N TYR A 12 -2.009 3.775 14.798 1.00 0.00 N ATOM 194 CA TYR A 12 -2.405 5.147 15.101 1.00 0.00 C ATOM 195 C TYR A 12 -3.904 5.342 14.895 1.00 0.00 C ATOM 196 O TYR A 12 -4.647 5.556 15.852 1.00 0.00 O ATOM 197 CB TYR A 12 -1.615 6.127 14.217 1.00 0.00 C ATOM 198 CG TYR A 12 -0.229 5.630 13.856 1.00 0.00 C ATOM 199 CD1 TYR A 12 -0.062 4.459 13.125 1.00 0.00 C ATOM 200 CD2 TYR A 12 0.911 6.314 14.260 1.00 0.00 C ATOM 201 CE1 TYR A 12 1.190 3.983 12.811 1.00 0.00 C ATOM 202 CE2 TYR A 12 2.172 5.844 13.945 1.00 0.00 C ATOM 203 CZ TYR A 12 2.306 4.676 13.223 1.00 0.00 C ATOM 204 OH TYR A 12 3.560 4.207 12.904 1.00 0.00 O ATOM 0 H TYR A 12 -2.591 3.311 14.100 1.00 0.00 H new ATOM 0 HA TYR A 12 -2.179 5.347 16.148 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -2.176 6.312 13.301 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -1.527 7.082 14.735 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -0.933 3.912 12.797 1.00 0.00 H new ATOM 0 HD2 TYR A 12 0.810 7.227 14.829 1.00 0.00 H new ATOM 0 HE1 TYR A 12 1.297 3.070 12.244 1.00 0.00 H new ATOM 0 HE2 TYR A 12 3.049 6.389 14.263 1.00 0.00 H new ATOM 0 HH TYR A 12 3.869 4.634 12.078 1.00 0.00 H new ATOM 214 N GLY A 13 -4.342 5.263 13.643 1.00 0.00 N ATOM 215 CA GLY A 13 -5.751 5.432 13.342 1.00 0.00 C ATOM 216 C GLY A 13 -5.993 5.967 11.944 1.00 0.00 C ATOM 217 O GLY A 13 -6.508 5.256 11.081 1.00 0.00 O ATOM 0 H GLY A 13 -3.748 5.085 12.833 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -6.259 4.474 13.452 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -6.194 6.113 14.069 1.00 0.00 H new ATOM 221 N ILE A 14 -5.625 7.225 11.720 1.00 0.00 N ATOM 222 CA ILE A 14 -5.810 7.853 10.417 1.00 0.00 C ATOM 223 C ILE A 14 -5.105 7.063 9.320 1.00 0.00 C ATOM 224 O ILE A 14 -5.682 6.800 8.265 1.00 0.00 O ATOM 225 CB ILE A 14 -5.303 9.313 10.418 1.00 0.00 C ATOM 226 CG1 ILE A 14 -5.751 10.041 9.143 1.00 0.00 C ATOM 227 CG2 ILE A 14 -3.788 9.360 10.571 1.00 0.00 C ATOM 228 CD1 ILE A 14 -4.987 9.639 7.897 1.00 0.00 C ATOM 0 H ILE A 14 -5.198 7.828 12.423 1.00 0.00 H new ATOM 0 HA ILE A 14 -6.881 7.858 10.213 1.00 0.00 H new ATOM 0 HB ILE A 14 -5.741 9.827 11.273 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -6.812 9.850 8.983 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -5.640 11.115 9.293 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -3.454 10.398 10.569 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -3.502 8.889 11.511 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -3.322 8.827 9.742 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -5.365 10.199 7.042 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -3.928 9.857 8.034 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -5.118 8.572 7.718 1.00 0.00 H new ATOM 240 N GLU A 15 -3.859 6.681 9.575 1.00 0.00 N ATOM 241 CA GLU A 15 -3.088 5.915 8.604 1.00 0.00 C ATOM 242 C GLU A 15 -3.608 4.486 8.524 1.00 0.00 C ATOM 243 O GLU A 15 -3.590 3.865 7.461 1.00 0.00 O ATOM 244 CB GLU A 15 -1.603 5.920 8.974 1.00 0.00 C ATOM 245 CG GLU A 15 -0.766 6.842 8.102 1.00 0.00 C ATOM 246 CD GLU A 15 0.218 7.671 8.906 1.00 0.00 C ATOM 247 OE1 GLU A 15 -0.229 8.422 9.798 1.00 0.00 O ATOM 248 OE2 GLU A 15 1.434 7.568 8.642 1.00 0.00 O ATOM 0 H GLU A 15 -3.363 6.888 10.442 1.00 0.00 H new ATOM 0 HA GLU A 15 -3.202 6.383 7.626 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -1.497 6.222 10.016 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -1.213 4.905 8.895 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -0.221 6.247 7.369 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -1.426 7.507 7.545 1.00 0.00 H new ATOM 255 N GLY A 16 -4.086 3.974 9.654 1.00 0.00 N ATOM 256 CA GLY A 16 -4.621 2.628 9.686 1.00 0.00 C ATOM 257 C GLY A 16 -5.978 2.545 9.020 1.00 0.00 C ATOM 258 O GLY A 16 -6.349 1.506 8.476 1.00 0.00 O ATOM 0 H GLY A 16 -4.112 4.468 10.546 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -3.929 1.950 9.186 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -4.703 2.294 10.720 1.00 0.00 H new ATOM 262 N ARG A 17 -6.718 3.651 9.057 1.00 0.00 N ATOM 263 CA ARG A 17 -8.039 3.706 8.446 1.00 0.00 C ATOM 264 C ARG A 17 -7.929 3.697 6.926 1.00 0.00 C ATOM 265 O ARG A 17 -8.867 3.305 6.232 1.00 0.00 O ATOM 266 CB ARG A 17 -8.790 4.955 8.911 1.00 0.00 C ATOM 267 CG ARG A 17 -9.396 4.819 10.298 1.00 0.00 C ATOM 268 CD ARG A 17 -9.963 6.141 10.790 1.00 0.00 C ATOM 269 NE ARG A 17 -10.808 6.782 9.786 1.00 0.00 N ATOM 270 CZ ARG A 17 -11.183 8.059 9.837 1.00 0.00 C ATOM 271 NH1 ARG A 17 -10.791 8.832 10.841 1.00 0.00 N ATOM 272 NH2 ARG A 17 -11.952 8.562 8.881 1.00 0.00 N ATOM 0 H ARG A 17 -6.423 4.519 9.504 1.00 0.00 H new ATOM 0 HA ARG A 17 -8.597 2.823 8.759 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -8.106 5.804 8.904 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -9.583 5.179 8.197 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -10.185 4.068 10.279 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -8.636 4.466 10.995 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -10.543 5.971 11.697 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -9.144 6.810 11.055 1.00 0.00 H new ATOM 0 HE ARG A 17 -11.130 6.218 8.999 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -10.200 8.449 11.579 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -11.081 9.809 10.875 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -12.256 7.971 8.107 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -12.240 9.540 8.919 1.00 0.00 H new ATOM 286 N TYR A 18 -6.779 4.124 6.411 1.00 0.00 N ATOM 287 CA TYR A 18 -6.556 4.150 4.970 1.00 0.00 C ATOM 288 C TYR A 18 -6.756 2.763 4.379 1.00 0.00 C ATOM 289 O TYR A 18 -7.491 2.587 3.408 1.00 0.00 O ATOM 290 CB TYR A 18 -5.142 4.650 4.660 1.00 0.00 C ATOM 291 CG TYR A 18 -5.085 6.089 4.198 1.00 0.00 C ATOM 292 CD1 TYR A 18 -5.773 7.085 4.878 1.00 0.00 C ATOM 293 CD2 TYR A 18 -4.340 6.449 3.083 1.00 0.00 C ATOM 294 CE1 TYR A 18 -5.720 8.401 4.459 1.00 0.00 C ATOM 295 CE2 TYR A 18 -4.281 7.762 2.658 1.00 0.00 C ATOM 296 CZ TYR A 18 -4.973 8.734 3.349 1.00 0.00 C ATOM 297 OH TYR A 18 -4.917 10.043 2.928 1.00 0.00 O ATOM 0 H TYR A 18 -5.991 4.455 6.968 1.00 0.00 H new ATOM 0 HA TYR A 18 -7.278 4.832 4.521 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -4.526 4.541 5.552 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -4.704 4.015 3.890 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -6.359 6.827 5.748 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -3.798 5.690 2.539 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -6.261 9.165 4.998 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -3.696 8.026 1.789 1.00 0.00 H new ATOM 0 HH TYR A 18 -4.176 10.152 2.297 1.00 0.00 H new ATOM 307 N ALA A 19 -6.100 1.778 4.982 1.00 0.00 N ATOM 308 CA ALA A 19 -6.209 0.402 4.526 1.00 0.00 C ATOM 309 C ALA A 19 -7.605 -0.141 4.798 1.00 0.00 C ATOM 310 O ALA A 19 -8.181 -0.843 3.968 1.00 0.00 O ATOM 311 CB ALA A 19 -5.159 -0.463 5.207 1.00 0.00 C ATOM 0 H ALA A 19 -5.488 1.909 5.787 1.00 0.00 H new ATOM 0 HA ALA A 19 -6.035 0.378 3.450 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -5.252 -1.491 4.857 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -4.165 -0.086 4.966 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -5.307 -0.433 6.286 1.00 0.00 H new ATOM 317 N THR A 20 -8.145 0.191 5.965 1.00 0.00 N ATOM 318 CA THR A 20 -9.477 -0.264 6.337 1.00 0.00 C ATOM 319 C THR A 20 -10.546 0.448 5.520 1.00 0.00 C ATOM 320 O THR A 20 -11.671 -0.036 5.409 1.00 0.00 O ATOM 321 CB THR A 20 -9.723 -0.065 7.833 1.00 0.00 C ATOM 322 OG1 THR A 20 -8.699 0.721 8.413 1.00 0.00 O ATOM 323 CG2 THR A 20 -9.786 -1.371 8.593 1.00 0.00 C ATOM 0 H THR A 20 -7.683 0.771 6.666 1.00 0.00 H new ATOM 0 HA THR A 20 -9.538 -1.330 6.119 1.00 0.00 H new ATOM 0 HB THR A 20 -10.688 0.437 7.909 1.00 0.00 H new ATOM 0 HG1 THR A 20 -7.859 0.216 8.414 1.00 0.00 H new ATOM 0 HG21 THR A 20 -9.962 -1.169 9.649 1.00 0.00 H new ATOM 0 HG22 THR A 20 -10.599 -1.982 8.200 1.00 0.00 H new ATOM 0 HG23 THR A 20 -8.843 -1.905 8.478 1.00 0.00 H new ATOM 331 N ALA A 21 -10.194 1.589 4.934 1.00 0.00 N ATOM 332 CA ALA A 21 -11.141 2.331 4.118 1.00 0.00 C ATOM 333 C ALA A 21 -11.021 1.937 2.651 1.00 0.00 C ATOM 334 O ALA A 21 -11.783 2.408 1.806 1.00 0.00 O ATOM 335 CB ALA A 21 -10.946 3.829 4.294 1.00 0.00 C ATOM 0 H ALA A 21 -9.270 2.014 5.009 1.00 0.00 H new ATOM 0 HA ALA A 21 -12.147 2.078 4.453 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -11.665 4.365 3.674 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -11.099 4.095 5.340 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -9.934 4.102 3.994 1.00 0.00 H new ATOM 341 N LEU A 22 -10.081 1.045 2.360 1.00 0.00 N ATOM 342 CA LEU A 22 -9.887 0.557 1.003 1.00 0.00 C ATOM 343 C LEU A 22 -10.197 -0.918 0.977 1.00 0.00 C ATOM 344 O LEU A 22 -10.866 -1.415 0.071 1.00 0.00 O ATOM 345 CB LEU A 22 -8.458 0.811 0.519 1.00 0.00 C ATOM 346 CG LEU A 22 -8.124 0.193 -0.842 1.00 0.00 C ATOM 347 CD1 LEU A 22 -8.033 1.269 -1.912 1.00 0.00 C ATOM 348 CD2 LEU A 22 -6.828 -0.601 -0.764 1.00 0.00 C ATOM 0 H LEU A 22 -9.442 0.646 3.047 1.00 0.00 H new ATOM 0 HA LEU A 22 -10.556 1.093 0.330 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -8.293 1.887 0.464 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -7.762 0.419 1.261 1.00 0.00 H new ATOM 0 HG LEU A 22 -8.928 -0.490 -1.116 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.795 0.809 -2.871 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -8.988 1.790 -1.986 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -7.251 1.981 -1.647 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.607 -1.033 -1.740 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -6.014 0.060 -0.466 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -6.934 -1.399 -0.030 1.00 0.00 H new ATOM 360 N TYR A 23 -9.741 -1.609 2.007 1.00 0.00 N ATOM 361 CA TYR A 23 -10.005 -3.013 2.133 1.00 0.00 C ATOM 362 C TYR A 23 -11.438 -3.206 2.632 1.00 0.00 C ATOM 363 O TYR A 23 -12.014 -4.277 2.470 1.00 0.00 O ATOM 364 CB TYR A 23 -8.980 -3.668 3.069 1.00 0.00 C ATOM 365 CG TYR A 23 -9.570 -4.236 4.336 1.00 0.00 C ATOM 366 CD1 TYR A 23 -10.385 -5.354 4.288 1.00 0.00 C ATOM 367 CD2 TYR A 23 -9.321 -3.654 5.569 1.00 0.00 C ATOM 368 CE1 TYR A 23 -10.946 -5.878 5.430 1.00 0.00 C ATOM 369 CE2 TYR A 23 -9.874 -4.169 6.718 1.00 0.00 C ATOM 370 CZ TYR A 23 -10.689 -5.280 6.648 1.00 0.00 C ATOM 371 OH TYR A 23 -11.247 -5.793 7.794 1.00 0.00 O ATOM 0 H TYR A 23 -9.186 -1.211 2.764 1.00 0.00 H new ATOM 0 HA TYR A 23 -9.908 -3.500 1.163 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -8.471 -4.467 2.529 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -8.223 -2.930 3.334 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -10.584 -5.824 3.336 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -8.684 -2.784 5.628 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -11.582 -6.749 5.374 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -9.671 -3.705 7.672 1.00 0.00 H new ATOM 0 HH TYR A 23 -10.691 -5.553 8.564 1.00 0.00 H new ATOM 381 N SER A 24 -12.027 -2.152 3.223 1.00 0.00 N ATOM 382 CA SER A 24 -13.401 -2.238 3.707 1.00 0.00 C ATOM 383 C SER A 24 -14.282 -2.814 2.610 1.00 0.00 C ATOM 384 O SER A 24 -15.137 -3.664 2.859 1.00 0.00 O ATOM 385 CB SER A 24 -13.916 -0.862 4.134 1.00 0.00 C ATOM 386 OG SER A 24 -13.225 0.174 3.459 1.00 0.00 O ATOM 0 H SER A 24 -11.577 -1.249 3.372 1.00 0.00 H new ATOM 0 HA SER A 24 -13.430 -2.891 4.579 1.00 0.00 H new ATOM 0 HB2 SER A 24 -14.983 -0.789 3.924 1.00 0.00 H new ATOM 0 HB3 SER A 24 -13.794 -0.743 5.211 1.00 0.00 H new ATOM 0 HG SER A 24 -13.757 0.996 3.490 1.00 0.00 H new ATOM 392 N ALA A 25 -14.023 -2.375 1.383 1.00 0.00 N ATOM 393 CA ALA A 25 -14.747 -2.877 0.231 1.00 0.00 C ATOM 394 C ALA A 25 -14.249 -4.278 -0.077 1.00 0.00 C ATOM 395 O ALA A 25 -15.020 -5.167 -0.438 1.00 0.00 O ATOM 396 CB ALA A 25 -14.559 -1.958 -0.967 1.00 0.00 C ATOM 0 H ALA A 25 -13.316 -1.673 1.165 1.00 0.00 H new ATOM 0 HA ALA A 25 -15.814 -2.908 0.451 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -15.111 -2.354 -1.820 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -14.932 -0.963 -0.724 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -13.500 -1.898 -1.217 1.00 0.00 H new ATOM 402 N ALA A 26 -12.941 -4.468 0.096 1.00 0.00 N ATOM 403 CA ALA A 26 -12.318 -5.766 -0.133 1.00 0.00 C ATOM 404 C ALA A 26 -12.938 -6.830 0.768 1.00 0.00 C ATOM 405 O ALA A 26 -13.242 -7.934 0.321 1.00 0.00 O ATOM 406 CB ALA A 26 -10.818 -5.686 0.114 1.00 0.00 C ATOM 0 H ALA A 26 -12.294 -3.738 0.394 1.00 0.00 H new ATOM 0 HA ALA A 26 -12.491 -6.046 -1.172 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -10.368 -6.663 -0.061 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -10.376 -4.956 -0.564 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -10.635 -5.382 1.144 1.00 0.00 H new ATOM 412 N SER A 27 -13.128 -6.487 2.042 1.00 0.00 N ATOM 413 CA SER A 27 -13.716 -7.410 3.007 1.00 0.00 C ATOM 414 C SER A 27 -15.057 -7.922 2.504 1.00 0.00 C ATOM 415 O SER A 27 -15.328 -9.122 2.538 1.00 0.00 O ATOM 416 CB SER A 27 -13.896 -6.720 4.360 1.00 0.00 C ATOM 417 OG SER A 27 -13.633 -7.614 5.427 1.00 0.00 O ATOM 0 H SER A 27 -12.882 -5.575 2.428 1.00 0.00 H new ATOM 0 HA SER A 27 -13.040 -8.257 3.129 1.00 0.00 H new ATOM 0 HB2 SER A 27 -13.226 -5.863 4.426 1.00 0.00 H new ATOM 0 HB3 SER A 27 -14.913 -6.337 4.444 1.00 0.00 H new ATOM 0 HG SER A 27 -14.417 -8.182 5.578 1.00 0.00 H new ATOM 423 N LYS A 28 -15.893 -7.003 2.020 1.00 0.00 N ATOM 424 CA LYS A 28 -17.202 -7.368 1.492 1.00 0.00 C ATOM 425 C LYS A 28 -17.062 -8.517 0.500 1.00 0.00 C ATOM 426 O LYS A 28 -17.957 -9.351 0.363 1.00 0.00 O ATOM 427 CB LYS A 28 -17.858 -6.164 0.812 1.00 0.00 C ATOM 428 CG LYS A 28 -19.365 -6.109 0.996 1.00 0.00 C ATOM 429 CD LYS A 28 -19.752 -5.202 2.154 1.00 0.00 C ATOM 430 CE LYS A 28 -19.566 -3.736 1.799 1.00 0.00 C ATOM 431 NZ LYS A 28 -19.149 -2.927 2.978 1.00 0.00 N ATOM 0 H LYS A 28 -15.686 -6.005 1.984 1.00 0.00 H new ATOM 0 HA LYS A 28 -17.835 -7.688 2.319 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -17.418 -5.249 1.209 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -17.631 -6.191 -0.254 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -19.832 -5.749 0.079 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -19.748 -7.114 1.176 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -20.792 -5.382 2.427 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -19.146 -5.446 3.027 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -18.816 -3.645 1.013 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -20.498 -3.339 1.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -19.033 -1.933 2.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -19.876 -2.993 3.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -18.246 -3.289 3.346 1.00 0.00 H new ATOM 445 N GLN A 29 -15.918 -8.557 -0.175 1.00 0.00 N ATOM 446 CA GLN A 29 -15.632 -9.606 -1.140 1.00 0.00 C ATOM 447 C GLN A 29 -14.783 -10.693 -0.497 1.00 0.00 C ATOM 448 O GLN A 29 -15.282 -11.770 -0.172 1.00 0.00 O ATOM 449 CB GLN A 29 -14.911 -9.026 -2.359 1.00 0.00 C ATOM 450 CG GLN A 29 -15.845 -8.373 -3.365 1.00 0.00 C ATOM 451 CD GLN A 29 -15.219 -8.238 -4.739 1.00 0.00 C ATOM 452 OE1 GLN A 29 -15.123 -9.209 -5.489 1.00 0.00 O ATOM 453 NE2 GLN A 29 -14.788 -7.028 -5.077 1.00 0.00 N ATOM 0 H GLN A 29 -15.172 -7.870 -0.069 1.00 0.00 H new ATOM 0 HA GLN A 29 -16.575 -10.044 -1.468 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -14.181 -8.290 -2.023 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -14.356 -9.822 -2.855 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -16.759 -8.962 -3.442 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -16.132 -7.386 -3.002 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -14.887 -6.250 -4.424 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -14.358 -6.876 -5.989 1.00 0.00 H new ATOM 462 N ASN A 30 -13.498 -10.385 -0.311 1.00 0.00 N ATOM 463 CA ASN A 30 -12.532 -11.303 0.301 1.00 0.00 C ATOM 464 C ASN A 30 -11.140 -11.037 -0.253 1.00 0.00 C ATOM 465 O ASN A 30 -10.287 -11.925 -0.273 1.00 0.00 O ATOM 466 CB ASN A 30 -12.900 -12.771 0.058 1.00 0.00 C ATOM 467 CG ASN A 30 -13.219 -13.058 -1.397 1.00 0.00 C ATOM 468 OD1 ASN A 30 -12.607 -12.490 -2.303 1.00 0.00 O ATOM 469 ND2 ASN A 30 -14.181 -13.943 -1.629 1.00 0.00 N ATOM 0 H ASN A 30 -13.095 -9.488 -0.582 1.00 0.00 H new ATOM 0 HA ASN A 30 -12.550 -11.124 1.376 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -12.074 -13.407 0.378 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -13.761 -13.033 0.674 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -14.439 -14.176 -2.588 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -14.662 -14.390 -0.848 1.00 0.00 H new ATOM 476 N LYS A 31 -10.919 -9.811 -0.715 1.00 0.00 N ATOM 477 CA LYS A 31 -9.637 -9.433 -1.283 1.00 0.00 C ATOM 478 C LYS A 31 -8.586 -9.191 -0.203 1.00 0.00 C ATOM 479 O LYS A 31 -7.437 -8.891 -0.518 1.00 0.00 O ATOM 480 CB LYS A 31 -9.795 -8.193 -2.163 1.00 0.00 C ATOM 481 CG LYS A 31 -10.537 -8.468 -3.462 1.00 0.00 C ATOM 482 CD LYS A 31 -9.584 -8.872 -4.577 1.00 0.00 C ATOM 483 CE LYS A 31 -9.816 -10.309 -5.018 1.00 0.00 C ATOM 484 NZ LYS A 31 -9.268 -11.287 -4.037 1.00 0.00 N ATOM 0 H LYS A 31 -11.614 -9.064 -0.706 1.00 0.00 H new ATOM 0 HA LYS A 31 -9.288 -10.264 -1.896 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -10.328 -7.425 -1.604 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -8.808 -7.792 -2.394 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -11.269 -9.260 -3.303 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -11.091 -7.578 -3.761 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -9.715 -8.204 -5.428 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -8.555 -8.757 -4.237 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -10.885 -10.482 -5.144 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -9.350 -10.470 -5.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -8.976 -12.152 -4.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -8.446 -10.871 -3.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -9.999 -11.522 -3.335 1.00 0.00 H new ATOM 498 N LEU A 32 -8.968 -9.334 1.073 1.00 0.00 N ATOM 499 CA LEU A 32 -8.034 -9.147 2.180 1.00 0.00 C ATOM 500 C LEU A 32 -6.681 -9.770 1.858 1.00 0.00 C ATOM 501 O LEU A 32 -5.639 -9.272 2.276 1.00 0.00 O ATOM 502 CB LEU A 32 -8.612 -9.778 3.446 1.00 0.00 C ATOM 503 CG LEU A 32 -9.614 -8.906 4.199 1.00 0.00 C ATOM 504 CD1 LEU A 32 -8.875 -7.907 5.072 1.00 0.00 C ATOM 505 CD2 LEU A 32 -10.544 -8.195 3.225 1.00 0.00 C ATOM 0 H LEU A 32 -9.916 -9.578 1.359 1.00 0.00 H new ATOM 0 HA LEU A 32 -7.888 -8.079 2.338 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -9.098 -10.716 3.178 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -7.791 -10.026 4.118 1.00 0.00 H new ATOM 0 HG LEU A 32 -10.225 -9.542 4.840 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.596 -7.288 5.606 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -8.253 -8.441 5.790 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -8.245 -7.274 4.447 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -11.251 -7.579 3.781 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -9.958 -7.563 2.558 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -11.090 -8.934 2.638 1.00 0.00 H new ATOM 517 N GLU A 33 -6.710 -10.856 1.095 1.00 0.00 N ATOM 518 CA GLU A 33 -5.487 -11.544 0.699 1.00 0.00 C ATOM 519 C GLU A 33 -4.780 -10.782 -0.418 1.00 0.00 C ATOM 520 O GLU A 33 -3.551 -10.727 -0.470 1.00 0.00 O ATOM 521 CB GLU A 33 -5.802 -12.970 0.243 1.00 0.00 C ATOM 522 CG GLU A 33 -4.637 -13.934 0.410 1.00 0.00 C ATOM 523 CD GLU A 33 -4.557 -14.951 -0.710 1.00 0.00 C ATOM 524 OE1 GLU A 33 -4.162 -14.569 -1.832 1.00 0.00 O ATOM 525 OE2 GLU A 33 -4.890 -16.130 -0.467 1.00 0.00 O ATOM 0 H GLU A 33 -7.567 -11.279 0.738 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.825 -11.589 1.563 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -6.656 -13.343 0.809 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -6.099 -12.950 -0.806 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -3.706 -13.369 0.450 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -4.735 -14.455 1.362 1.00 0.00 H new ATOM 532 N GLN A 34 -5.571 -10.190 -1.307 1.00 0.00 N ATOM 533 CA GLN A 34 -5.039 -9.421 -2.427 1.00 0.00 C ATOM 534 C GLN A 34 -4.734 -7.980 -2.020 1.00 0.00 C ATOM 535 O GLN A 34 -4.099 -7.240 -2.771 1.00 0.00 O ATOM 536 CB GLN A 34 -6.030 -9.432 -3.592 1.00 0.00 C ATOM 537 CG GLN A 34 -5.808 -10.575 -4.569 1.00 0.00 C ATOM 538 CD GLN A 34 -5.525 -10.093 -5.980 1.00 0.00 C ATOM 539 OE1 GLN A 34 -6.408 -10.097 -6.838 1.00 0.00 O ATOM 540 NE2 GLN A 34 -4.289 -9.674 -6.225 1.00 0.00 N ATOM 0 H GLN A 34 -6.590 -10.229 -1.273 1.00 0.00 H new ATOM 0 HA GLN A 34 -4.106 -9.890 -2.739 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -7.043 -9.496 -3.195 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -5.957 -8.486 -4.129 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -4.974 -11.186 -4.224 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -6.690 -11.216 -4.578 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -3.589 -9.688 -5.483 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -4.039 -9.338 -7.155 1.00 0.00 H new ATOM 549 N VAL A 35 -5.189 -7.581 -0.834 1.00 0.00 N ATOM 550 CA VAL A 35 -4.956 -6.222 -0.352 1.00 0.00 C ATOM 551 C VAL A 35 -4.003 -6.210 0.841 1.00 0.00 C ATOM 552 O VAL A 35 -3.368 -5.196 1.128 1.00 0.00 O ATOM 553 CB VAL A 35 -6.271 -5.509 0.052 1.00 0.00 C ATOM 554 CG1 VAL A 35 -6.204 -4.035 -0.309 1.00 0.00 C ATOM 555 CG2 VAL A 35 -7.494 -6.166 -0.589 1.00 0.00 C ATOM 0 H VAL A 35 -5.717 -8.174 -0.194 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.507 -5.681 -1.185 1.00 0.00 H new ATOM 0 HB VAL A 35 -6.380 -5.604 1.132 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -7.135 -3.547 -0.019 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -5.371 -3.569 0.217 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -6.058 -3.930 -1.384 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -8.395 -5.636 -0.280 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -7.402 -6.125 -1.674 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -7.557 -7.206 -0.270 1.00 0.00 H new ATOM 565 N GLU A 36 -3.896 -7.343 1.525 1.00 0.00 N ATOM 566 CA GLU A 36 -3.006 -7.459 2.676 1.00 0.00 C ATOM 567 C GLU A 36 -1.640 -7.943 2.225 1.00 0.00 C ATOM 568 O GLU A 36 -0.610 -7.499 2.731 1.00 0.00 O ATOM 569 CB GLU A 36 -3.580 -8.423 3.718 1.00 0.00 C ATOM 570 CG GLU A 36 -2.854 -8.380 5.052 1.00 0.00 C ATOM 571 CD GLU A 36 -1.877 -9.526 5.221 1.00 0.00 C ATOM 572 OE1 GLU A 36 -2.285 -10.689 5.022 1.00 0.00 O ATOM 573 OE2 GLU A 36 -0.702 -9.261 5.552 1.00 0.00 O ATOM 0 H GLU A 36 -4.413 -8.194 1.304 1.00 0.00 H new ATOM 0 HA GLU A 36 -2.910 -6.475 3.135 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -4.632 -8.187 3.879 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.538 -9.438 3.324 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.318 -7.435 5.140 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -3.585 -8.408 5.860 1.00 0.00 H new ATOM 580 N LYS A 37 -1.643 -8.845 1.253 1.00 0.00 N ATOM 581 CA LYS A 37 -0.406 -9.378 0.711 1.00 0.00 C ATOM 582 C LYS A 37 0.228 -8.350 -0.206 1.00 0.00 C ATOM 583 O LYS A 37 1.451 -8.230 -0.275 1.00 0.00 O ATOM 584 CB LYS A 37 -0.661 -10.682 -0.045 1.00 0.00 C ATOM 585 CG LYS A 37 0.610 -11.424 -0.425 1.00 0.00 C ATOM 586 CD LYS A 37 0.320 -12.867 -0.804 1.00 0.00 C ATOM 587 CE LYS A 37 1.533 -13.757 -0.580 1.00 0.00 C ATOM 588 NZ LYS A 37 1.591 -14.876 -1.559 1.00 0.00 N ATOM 0 H LYS A 37 -2.489 -9.221 0.825 1.00 0.00 H new ATOM 0 HA LYS A 37 0.275 -9.596 1.534 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -1.282 -11.333 0.570 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -1.228 -10.463 -0.950 1.00 0.00 H new ATOM 0 HG2 LYS A 37 1.093 -10.917 -1.261 1.00 0.00 H new ATOM 0 HG3 LYS A 37 1.310 -11.400 0.410 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -0.518 -13.238 -0.214 1.00 0.00 H new ATOM 0 HD3 LYS A 37 0.020 -12.916 -1.851 1.00 0.00 H new ATOM 0 HE2 LYS A 37 2.441 -13.159 -0.659 1.00 0.00 H new ATOM 0 HE3 LYS A 37 1.504 -14.161 0.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 2.432 -15.458 -1.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 0.737 -15.462 -1.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 1.645 -14.491 -2.524 1.00 0.00 H new ATOM 602 N GLU A 38 -0.615 -7.585 -0.893 1.00 0.00 N ATOM 603 CA GLU A 38 -0.130 -6.549 -1.777 1.00 0.00 C ATOM 604 C GLU A 38 0.496 -5.434 -0.954 1.00 0.00 C ATOM 605 O GLU A 38 1.652 -5.074 -1.159 1.00 0.00 O ATOM 606 CB GLU A 38 -1.279 -6.008 -2.625 1.00 0.00 C ATOM 607 CG GLU A 38 -1.415 -6.692 -3.975 1.00 0.00 C ATOM 608 CD GLU A 38 -1.755 -8.164 -3.850 1.00 0.00 C ATOM 609 OE1 GLU A 38 -0.987 -8.897 -3.192 1.00 0.00 O ATOM 610 OE2 GLU A 38 -2.789 -8.584 -4.410 1.00 0.00 O ATOM 0 H GLU A 38 -1.631 -7.668 -0.850 1.00 0.00 H new ATOM 0 HA GLU A 38 0.626 -6.963 -2.444 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -2.212 -6.123 -2.073 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.132 -4.939 -2.782 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.190 -6.192 -4.555 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -0.482 -6.584 -4.529 1.00 0.00 H new ATOM 617 N LEU A 39 -0.274 -4.902 -0.009 1.00 0.00 N ATOM 618 CA LEU A 39 0.205 -3.831 0.858 1.00 0.00 C ATOM 619 C LEU A 39 1.580 -4.163 1.427 1.00 0.00 C ATOM 620 O LEU A 39 2.390 -3.271 1.676 1.00 0.00 O ATOM 621 CB LEU A 39 -0.789 -3.586 1.996 1.00 0.00 C ATOM 622 CG LEU A 39 -1.843 -2.515 1.715 1.00 0.00 C ATOM 623 CD1 LEU A 39 -2.916 -2.526 2.793 1.00 0.00 C ATOM 624 CD2 LEU A 39 -1.192 -1.142 1.621 1.00 0.00 C ATOM 0 H LEU A 39 -1.233 -5.196 0.176 1.00 0.00 H new ATOM 0 HA LEU A 39 0.292 -2.924 0.260 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -1.297 -4.523 2.222 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -0.233 -3.301 2.889 1.00 0.00 H new ATOM 0 HG LEU A 39 -2.317 -2.738 0.759 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -3.657 -1.757 2.576 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -3.401 -3.502 2.814 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -2.460 -2.327 3.763 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -1.955 -0.390 1.421 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -0.693 -0.911 2.562 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -0.461 -1.141 0.813 1.00 0.00 H new ATOM 636 N LEU A 40 1.840 -5.452 1.628 1.00 0.00 N ATOM 637 CA LEU A 40 3.125 -5.890 2.161 1.00 0.00 C ATOM 638 C LEU A 40 4.262 -5.511 1.215 1.00 0.00 C ATOM 639 O LEU A 40 5.413 -5.383 1.634 1.00 0.00 O ATOM 640 CB LEU A 40 3.119 -7.402 2.392 1.00 0.00 C ATOM 641 CG LEU A 40 4.119 -7.901 3.436 1.00 0.00 C ATOM 642 CD1 LEU A 40 3.550 -7.749 4.838 1.00 0.00 C ATOM 643 CD2 LEU A 40 4.492 -9.351 3.164 1.00 0.00 C ATOM 0 H LEU A 40 1.182 -6.206 1.431 1.00 0.00 H new ATOM 0 HA LEU A 40 3.285 -5.387 3.115 1.00 0.00 H new ATOM 0 HB2 LEU A 40 2.117 -7.704 2.697 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.327 -7.900 1.445 1.00 0.00 H new ATOM 0 HG LEU A 40 5.022 -7.294 3.366 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.276 -8.109 5.566 1.00 0.00 H new ATOM 0 HD12 LEU A 40 3.333 -6.698 5.031 1.00 0.00 H new ATOM 0 HD13 LEU A 40 2.632 -8.330 4.923 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.204 -9.691 3.916 1.00 0.00 H new ATOM 0 HD22 LEU A 40 3.597 -9.971 3.206 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.943 -9.431 2.175 1.00 0.00 H new ATOM 655 N ARG A 41 3.932 -5.331 -0.060 1.00 0.00 N ATOM 656 CA ARG A 41 4.925 -4.967 -1.062 1.00 0.00 C ATOM 657 C ARG A 41 5.410 -3.536 -0.858 1.00 0.00 C ATOM 658 O ARG A 41 6.614 -3.277 -0.858 1.00 0.00 O ATOM 659 CB ARG A 41 4.348 -5.133 -2.469 1.00 0.00 C ATOM 660 CG ARG A 41 4.214 -6.585 -2.900 1.00 0.00 C ATOM 661 CD ARG A 41 5.573 -7.237 -3.098 1.00 0.00 C ATOM 662 NE ARG A 41 5.466 -8.683 -3.274 1.00 0.00 N ATOM 663 CZ ARG A 41 6.504 -9.478 -3.527 1.00 0.00 C ATOM 664 NH1 ARG A 41 7.726 -8.972 -3.634 1.00 0.00 N ATOM 665 NH2 ARG A 41 6.319 -10.782 -3.673 1.00 0.00 N ATOM 0 H ARG A 41 2.984 -5.432 -0.423 1.00 0.00 H new ATOM 0 HA ARG A 41 5.778 -5.636 -0.949 1.00 0.00 H new ATOM 0 HB2 ARG A 41 3.368 -4.658 -2.510 1.00 0.00 H new ATOM 0 HB3 ARG A 41 4.987 -4.608 -3.180 1.00 0.00 H new ATOM 0 HG2 ARG A 41 3.650 -7.138 -2.148 1.00 0.00 H new ATOM 0 HG3 ARG A 41 3.645 -6.639 -3.828 1.00 0.00 H new ATOM 0 HD2 ARG A 41 6.061 -6.801 -3.970 1.00 0.00 H new ATOM 0 HD3 ARG A 41 6.207 -7.022 -2.238 1.00 0.00 H new ATOM 0 HE ARG A 41 4.542 -9.109 -3.199 1.00 0.00 H new ATOM 0 HH11 ARG A 41 7.874 -7.969 -3.522 1.00 0.00 H new ATOM 0 HH12 ARG A 41 8.517 -9.586 -3.828 1.00 0.00 H new ATOM 0 HH21 ARG A 41 5.382 -11.176 -3.592 1.00 0.00 H new ATOM 0 HH22 ARG A 41 7.114 -11.391 -3.867 1.00 0.00 H new ATOM 679 N VAL A 42 4.474 -2.607 -0.677 1.00 0.00 N ATOM 680 CA VAL A 42 4.827 -1.208 -0.466 1.00 0.00 C ATOM 681 C VAL A 42 5.745 -1.059 0.746 1.00 0.00 C ATOM 682 O VAL A 42 6.538 -0.120 0.822 1.00 0.00 O ATOM 683 CB VAL A 42 3.573 -0.326 -0.272 1.00 0.00 C ATOM 684 CG1 VAL A 42 3.962 1.101 0.088 1.00 0.00 C ATOM 685 CG2 VAL A 42 2.709 -0.341 -1.526 1.00 0.00 C ATOM 0 H VAL A 42 3.472 -2.797 -0.672 1.00 0.00 H new ATOM 0 HA VAL A 42 5.350 -0.871 -1.361 1.00 0.00 H new ATOM 0 HB VAL A 42 2.994 -0.740 0.554 1.00 0.00 H new ATOM 0 HG11 VAL A 42 3.062 1.701 0.219 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.535 1.099 1.015 1.00 0.00 H new ATOM 0 HG13 VAL A 42 4.568 1.526 -0.712 1.00 0.00 H new ATOM 0 HG21 VAL A 42 1.831 0.286 -1.370 1.00 0.00 H new ATOM 0 HG22 VAL A 42 3.284 0.043 -2.369 1.00 0.00 H new ATOM 0 HG23 VAL A 42 2.393 -1.362 -1.738 1.00 0.00 H new ATOM 695 N GLY A 43 5.638 -1.994 1.685 1.00 0.00 N ATOM 696 CA GLY A 43 6.472 -1.947 2.871 1.00 0.00 C ATOM 697 C GLY A 43 7.896 -2.381 2.585 1.00 0.00 C ATOM 698 O GLY A 43 8.847 -1.777 3.080 1.00 0.00 O ATOM 0 H GLY A 43 4.990 -2.781 1.646 1.00 0.00 H new ATOM 0 HA2 GLY A 43 6.476 -0.933 3.271 1.00 0.00 H new ATOM 0 HA3 GLY A 43 6.045 -2.591 3.640 1.00 0.00 H new ATOM 702 N GLN A 44 8.040 -3.427 1.778 1.00 0.00 N ATOM 703 CA GLN A 44 9.357 -3.937 1.418 1.00 0.00 C ATOM 704 C GLN A 44 10.080 -2.954 0.503 1.00 0.00 C ATOM 705 O GLN A 44 11.305 -2.839 0.540 1.00 0.00 O ATOM 706 CB GLN A 44 9.233 -5.298 0.731 1.00 0.00 C ATOM 707 CG GLN A 44 9.122 -6.462 1.702 1.00 0.00 C ATOM 708 CD GLN A 44 9.829 -7.706 1.202 1.00 0.00 C ATOM 709 OE1 GLN A 44 10.797 -8.168 1.805 1.00 0.00 O ATOM 710 NE2 GLN A 44 9.347 -8.257 0.094 1.00 0.00 N ATOM 0 H GLN A 44 7.261 -3.937 1.361 1.00 0.00 H new ATOM 0 HA GLN A 44 9.939 -4.056 2.332 1.00 0.00 H new ATOM 0 HB2 GLN A 44 8.356 -5.290 0.084 1.00 0.00 H new ATOM 0 HB3 GLN A 44 10.101 -5.452 0.090 1.00 0.00 H new ATOM 0 HG2 GLN A 44 9.544 -6.170 2.664 1.00 0.00 H new ATOM 0 HG3 GLN A 44 8.070 -6.690 1.872 1.00 0.00 H new ATOM 0 HE21 GLN A 44 8.542 -7.841 -0.374 1.00 0.00 H new ATOM 0 HE22 GLN A 44 9.782 -9.097 -0.289 1.00 0.00 H new ATOM 719 N ILE A 45 9.309 -2.244 -0.315 1.00 0.00 N ATOM 720 CA ILE A 45 9.869 -1.266 -1.236 1.00 0.00 C ATOM 721 C ILE A 45 10.574 -0.147 -0.477 1.00 0.00 C ATOM 722 O ILE A 45 11.608 0.354 -0.913 1.00 0.00 O ATOM 723 CB ILE A 45 8.773 -0.664 -2.145 1.00 0.00 C ATOM 724 CG1 ILE A 45 8.108 -1.768 -2.970 1.00 0.00 C ATOM 725 CG2 ILE A 45 9.352 0.410 -3.059 1.00 0.00 C ATOM 726 CD1 ILE A 45 6.680 -1.453 -3.361 1.00 0.00 C ATOM 0 H ILE A 45 8.293 -2.329 -0.357 1.00 0.00 H new ATOM 0 HA ILE A 45 10.596 -1.785 -1.861 1.00 0.00 H new ATOM 0 HB ILE A 45 8.020 -0.196 -1.511 1.00 0.00 H new ATOM 0 HG12 ILE A 45 8.694 -1.939 -3.873 1.00 0.00 H new ATOM 0 HG13 ILE A 45 8.124 -2.697 -2.399 1.00 0.00 H new ATOM 0 HG21 ILE A 45 8.561 0.818 -3.688 1.00 0.00 H new ATOM 0 HG22 ILE A 45 9.783 1.208 -2.455 1.00 0.00 H new ATOM 0 HG23 ILE A 45 10.127 -0.027 -3.688 1.00 0.00 H new ATOM 0 HD11 ILE A 45 6.272 -2.279 -3.944 1.00 0.00 H new ATOM 0 HD12 ILE A 45 6.080 -1.311 -2.462 1.00 0.00 H new ATOM 0 HD13 ILE A 45 6.659 -0.542 -3.959 1.00 0.00 H new ATOM 738 N LEU A 46 10.012 0.241 0.663 1.00 0.00 N ATOM 739 CA LEU A 46 10.600 1.301 1.471 1.00 0.00 C ATOM 740 C LEU A 46 11.824 0.791 2.224 1.00 0.00 C ATOM 741 O LEU A 46 12.789 1.527 2.430 1.00 0.00 O ATOM 742 CB LEU A 46 9.568 1.861 2.449 1.00 0.00 C ATOM 743 CG LEU A 46 9.257 3.347 2.273 1.00 0.00 C ATOM 744 CD1 LEU A 46 8.865 3.647 0.831 1.00 0.00 C ATOM 745 CD2 LEU A 46 8.157 3.779 3.230 1.00 0.00 C ATOM 0 H LEU A 46 9.156 -0.160 1.046 1.00 0.00 H new ATOM 0 HA LEU A 46 10.918 2.102 0.804 1.00 0.00 H new ATOM 0 HB2 LEU A 46 8.642 1.295 2.342 1.00 0.00 H new ATOM 0 HB3 LEU A 46 9.925 1.697 3.466 1.00 0.00 H new ATOM 0 HG LEU A 46 10.157 3.916 2.506 1.00 0.00 H new ATOM 0 HD11 LEU A 46 8.648 4.710 0.727 1.00 0.00 H new ATOM 0 HD12 LEU A 46 9.687 3.378 0.167 1.00 0.00 H new ATOM 0 HD13 LEU A 46 7.980 3.068 0.567 1.00 0.00 H new ATOM 0 HD21 LEU A 46 7.949 4.840 3.090 1.00 0.00 H new ATOM 0 HD22 LEU A 46 7.254 3.203 3.030 1.00 0.00 H new ATOM 0 HD23 LEU A 46 8.479 3.604 4.257 1.00 0.00 H new ATOM 757 N LYS A 47 11.783 -0.475 2.620 1.00 0.00 N ATOM 758 CA LYS A 47 12.895 -1.086 3.336 1.00 0.00 C ATOM 759 C LYS A 47 14.055 -1.358 2.384 1.00 0.00 C ATOM 760 O LYS A 47 15.207 -1.460 2.805 1.00 0.00 O ATOM 761 CB LYS A 47 12.448 -2.389 4.002 1.00 0.00 C ATOM 762 CG LYS A 47 13.538 -3.055 4.826 1.00 0.00 C ATOM 763 CD LYS A 47 13.204 -4.510 5.117 1.00 0.00 C ATOM 764 CE LYS A 47 14.452 -5.311 5.451 1.00 0.00 C ATOM 765 NZ LYS A 47 14.942 -5.028 6.829 1.00 0.00 N ATOM 0 H LYS A 47 10.992 -1.098 2.457 1.00 0.00 H new ATOM 0 HA LYS A 47 13.230 -0.393 4.108 1.00 0.00 H new ATOM 0 HB2 LYS A 47 11.592 -2.184 4.645 1.00 0.00 H new ATOM 0 HB3 LYS A 47 12.110 -3.083 3.233 1.00 0.00 H new ATOM 0 HG2 LYS A 47 14.486 -2.998 4.292 1.00 0.00 H new ATOM 0 HG3 LYS A 47 13.668 -2.515 5.764 1.00 0.00 H new ATOM 0 HD2 LYS A 47 12.502 -4.564 5.949 1.00 0.00 H new ATOM 0 HD3 LYS A 47 12.708 -4.951 4.252 1.00 0.00 H new ATOM 0 HE2 LYS A 47 14.237 -6.375 5.354 1.00 0.00 H new ATOM 0 HE3 LYS A 47 15.237 -5.077 4.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 15.794 -5.594 7.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 15.171 -4.017 6.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 14.203 -5.275 7.518 1.00 0.00 H new ATOM 779 N GLU A 48 13.740 -1.470 1.096 1.00 0.00 N ATOM 780 CA GLU A 48 14.749 -1.727 0.078 1.00 0.00 C ATOM 781 C GLU A 48 15.763 -0.584 0.019 1.00 0.00 C ATOM 782 O GLU A 48 15.425 0.532 -0.376 1.00 0.00 O ATOM 783 CB GLU A 48 14.081 -1.902 -1.288 1.00 0.00 C ATOM 784 CG GLU A 48 13.824 -3.354 -1.656 1.00 0.00 C ATOM 785 CD GLU A 48 13.381 -3.520 -3.096 1.00 0.00 C ATOM 786 OE1 GLU A 48 14.215 -3.310 -4.003 1.00 0.00 O ATOM 787 OE2 GLU A 48 12.199 -3.859 -3.318 1.00 0.00 O ATOM 0 H GLU A 48 12.790 -1.386 0.734 1.00 0.00 H new ATOM 0 HA GLU A 48 15.277 -2.644 0.341 1.00 0.00 H new ATOM 0 HB2 GLU A 48 13.135 -1.361 -1.293 1.00 0.00 H new ATOM 0 HB3 GLU A 48 14.711 -1.448 -2.053 1.00 0.00 H new ATOM 0 HG2 GLU A 48 14.732 -3.933 -1.490 1.00 0.00 H new ATOM 0 HG3 GLU A 48 13.060 -3.763 -0.995 1.00 0.00 H new ATOM 794 N PRO A 49 17.025 -0.844 0.407 1.00 0.00 N ATOM 795 CA PRO A 49 18.079 0.176 0.390 1.00 0.00 C ATOM 796 C PRO A 49 18.178 0.883 -0.959 1.00 0.00 C ATOM 797 O PRO A 49 18.442 2.083 -1.024 1.00 0.00 O ATOM 798 CB PRO A 49 19.353 -0.622 0.671 1.00 0.00 C ATOM 799 CG PRO A 49 18.891 -1.818 1.429 1.00 0.00 C ATOM 800 CD PRO A 49 17.525 -2.145 0.891 1.00 0.00 C ATOM 0 HA PRO A 49 17.890 0.969 1.114 1.00 0.00 H new ATOM 0 HB2 PRO A 49 19.853 -0.908 -0.254 1.00 0.00 H new ATOM 0 HB3 PRO A 49 20.067 -0.037 1.251 1.00 0.00 H new ATOM 0 HG2 PRO A 49 19.575 -2.655 1.292 1.00 0.00 H new ATOM 0 HG3 PRO A 49 18.850 -1.611 2.498 1.00 0.00 H new ATOM 0 HD2 PRO A 49 17.575 -2.880 0.087 1.00 0.00 H new ATOM 0 HD3 PRO A 49 16.878 -2.561 1.663 1.00 0.00 H new ATOM 808 N LYS A 50 17.963 0.130 -2.032 1.00 0.00 N ATOM 809 CA LYS A 50 18.027 0.685 -3.379 1.00 0.00 C ATOM 810 C LYS A 50 16.806 1.553 -3.666 1.00 0.00 C ATOM 811 O LYS A 50 16.885 2.522 -4.420 1.00 0.00 O ATOM 812 CB LYS A 50 18.121 -0.440 -4.413 1.00 0.00 C ATOM 813 CG LYS A 50 18.831 -0.031 -5.693 1.00 0.00 C ATOM 814 CD LYS A 50 17.857 0.537 -6.712 1.00 0.00 C ATOM 815 CE LYS A 50 18.508 0.693 -8.077 1.00 0.00 C ATOM 816 NZ LYS A 50 17.497 0.783 -9.167 1.00 0.00 N ATOM 0 H LYS A 50 17.743 -0.865 -1.995 1.00 0.00 H new ATOM 0 HA LYS A 50 18.919 1.308 -3.448 1.00 0.00 H new ATOM 0 HB2 LYS A 50 18.646 -1.286 -3.970 1.00 0.00 H new ATOM 0 HB3 LYS A 50 17.115 -0.782 -4.658 1.00 0.00 H new ATOM 0 HG2 LYS A 50 19.595 0.712 -5.465 1.00 0.00 H new ATOM 0 HG3 LYS A 50 19.342 -0.894 -6.119 1.00 0.00 H new ATOM 0 HD2 LYS A 50 16.990 -0.119 -6.794 1.00 0.00 H new ATOM 0 HD3 LYS A 50 17.493 1.505 -6.369 1.00 0.00 H new ATOM 0 HE2 LYS A 50 19.129 1.589 -8.083 1.00 0.00 H new ATOM 0 HE3 LYS A 50 19.168 -0.154 -8.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 17.981 0.889 -10.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 16.921 -0.083 -9.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 16.883 1.606 -9.003 1.00 0.00 H new ATOM 830 N MET A 51 15.679 1.199 -3.057 1.00 0.00 N ATOM 831 CA MET A 51 14.441 1.945 -3.245 1.00 0.00 C ATOM 832 C MET A 51 14.427 3.204 -2.383 1.00 0.00 C ATOM 833 O MET A 51 13.830 4.215 -2.752 1.00 0.00 O ATOM 834 CB MET A 51 13.236 1.070 -2.905 1.00 0.00 C ATOM 835 CG MET A 51 12.738 0.231 -4.072 1.00 0.00 C ATOM 836 SD MET A 51 12.248 1.229 -5.493 1.00 0.00 S ATOM 837 CE MET A 51 11.383 2.574 -4.689 1.00 0.00 C ATOM 0 H MET A 51 15.598 0.400 -2.429 1.00 0.00 H new ATOM 0 HA MET A 51 14.382 2.242 -4.292 1.00 0.00 H new ATOM 0 HB2 MET A 51 13.501 0.408 -2.080 1.00 0.00 H new ATOM 0 HB3 MET A 51 12.424 1.707 -2.555 1.00 0.00 H new ATOM 0 HG2 MET A 51 13.522 -0.463 -4.375 1.00 0.00 H new ATOM 0 HG3 MET A 51 11.889 -0.369 -3.745 1.00 0.00 H new ATOM 0 HE1 MET A 51 10.560 2.907 -5.322 1.00 0.00 H new ATOM 0 HE2 MET A 51 10.989 2.233 -3.732 1.00 0.00 H new ATOM 0 HE3 MET A 51 12.072 3.402 -4.523 1.00 0.00 H new ATOM 847 N ALA A 52 15.086 3.134 -1.230 1.00 0.00 N ATOM 848 CA ALA A 52 15.147 4.268 -0.315 1.00 0.00 C ATOM 849 C ALA A 52 15.732 5.497 -1.001 1.00 0.00 C ATOM 850 O ALA A 52 15.370 6.630 -0.681 1.00 0.00 O ATOM 851 CB ALA A 52 15.966 3.908 0.915 1.00 0.00 C ATOM 0 H ALA A 52 15.585 2.305 -0.908 1.00 0.00 H new ATOM 0 HA ALA A 52 14.130 4.508 -0.005 1.00 0.00 H new ATOM 0 HB1 ALA A 52 16.004 4.763 1.590 1.00 0.00 H new ATOM 0 HB2 ALA A 52 15.504 3.063 1.425 1.00 0.00 H new ATOM 0 HB3 ALA A 52 16.978 3.640 0.612 1.00 0.00 H new ATOM 857 N ALA A 53 16.636 5.268 -1.947 1.00 0.00 N ATOM 858 CA ALA A 53 17.269 6.358 -2.679 1.00 0.00 C ATOM 859 C ALA A 53 16.437 6.775 -3.891 1.00 0.00 C ATOM 860 O ALA A 53 16.859 7.621 -4.679 1.00 0.00 O ATOM 861 CB ALA A 53 18.670 5.956 -3.114 1.00 0.00 C ATOM 0 H ALA A 53 16.947 4.337 -2.225 1.00 0.00 H new ATOM 0 HA ALA A 53 17.336 7.216 -2.010 1.00 0.00 H new ATOM 0 HB1 ALA A 53 19.132 6.779 -3.660 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.271 5.721 -2.235 1.00 0.00 H new ATOM 0 HB3 ALA A 53 18.613 5.079 -3.759 1.00 0.00 H new ATOM 867 N SER A 54 15.255 6.179 -4.038 1.00 0.00 N ATOM 868 CA SER A 54 14.375 6.496 -5.158 1.00 0.00 C ATOM 869 C SER A 54 12.958 6.822 -4.686 1.00 0.00 C ATOM 870 O SER A 54 12.082 7.122 -5.497 1.00 0.00 O ATOM 871 CB SER A 54 14.333 5.329 -6.144 1.00 0.00 C ATOM 872 OG SER A 54 15.640 4.879 -6.459 1.00 0.00 O ATOM 0 H SER A 54 14.887 5.476 -3.397 1.00 0.00 H new ATOM 0 HA SER A 54 14.779 7.379 -5.654 1.00 0.00 H new ATOM 0 HB2 SER A 54 13.756 4.509 -5.717 1.00 0.00 H new ATOM 0 HB3 SER A 54 13.822 5.638 -7.056 1.00 0.00 H new ATOM 0 HG SER A 54 15.910 4.186 -5.821 1.00 0.00 H new ATOM 878 N LEU A 55 12.733 6.763 -3.376 1.00 0.00 N ATOM 879 CA LEU A 55 11.418 7.054 -2.815 1.00 0.00 C ATOM 880 C LEU A 55 11.341 8.498 -2.331 1.00 0.00 C ATOM 881 O LEU A 55 10.262 9.088 -2.278 1.00 0.00 O ATOM 882 CB LEU A 55 11.112 6.099 -1.659 1.00 0.00 C ATOM 883 CG LEU A 55 10.506 4.756 -2.074 1.00 0.00 C ATOM 884 CD1 LEU A 55 11.081 3.627 -1.231 1.00 0.00 C ATOM 885 CD2 LEU A 55 8.990 4.796 -1.954 1.00 0.00 C ATOM 0 H LEU A 55 13.442 6.517 -2.685 1.00 0.00 H new ATOM 0 HA LEU A 55 10.675 6.913 -3.600 1.00 0.00 H new ATOM 0 HB2 LEU A 55 12.034 5.910 -1.109 1.00 0.00 H new ATOM 0 HB3 LEU A 55 10.426 6.593 -0.971 1.00 0.00 H new ATOM 0 HG LEU A 55 10.763 4.569 -3.117 1.00 0.00 H new ATOM 0 HD11 LEU A 55 10.638 2.680 -1.540 1.00 0.00 H new ATOM 0 HD12 LEU A 55 12.162 3.585 -1.368 1.00 0.00 H new ATOM 0 HD13 LEU A 55 10.855 3.807 -0.180 1.00 0.00 H new ATOM 0 HD21 LEU A 55 8.576 3.833 -2.253 1.00 0.00 H new ATOM 0 HD22 LEU A 55 8.712 5.006 -0.921 1.00 0.00 H new ATOM 0 HD23 LEU A 55 8.594 5.578 -2.602 1.00 0.00 H new ATOM 897 N LEU A 56 12.492 9.064 -1.982 1.00 0.00 N ATOM 898 CA LEU A 56 12.554 10.441 -1.503 1.00 0.00 C ATOM 899 C LEU A 56 13.615 11.232 -2.261 1.00 0.00 C ATOM 900 O LEU A 56 14.174 12.197 -1.738 1.00 0.00 O ATOM 901 CB LEU A 56 12.859 10.471 -0.002 1.00 0.00 C ATOM 902 CG LEU A 56 12.189 9.372 0.828 1.00 0.00 C ATOM 903 CD1 LEU A 56 10.709 9.264 0.488 1.00 0.00 C ATOM 904 CD2 LEU A 56 12.893 8.037 0.615 1.00 0.00 C ATOM 0 H LEU A 56 13.395 8.591 -2.022 1.00 0.00 H new ATOM 0 HA LEU A 56 11.583 10.903 -1.679 1.00 0.00 H new ATOM 0 HB2 LEU A 56 13.938 10.398 0.133 1.00 0.00 H new ATOM 0 HB3 LEU A 56 12.553 11.439 0.394 1.00 0.00 H new ATOM 0 HG LEU A 56 12.274 9.639 1.881 1.00 0.00 H new ATOM 0 HD11 LEU A 56 10.254 8.477 1.090 1.00 0.00 H new ATOM 0 HD12 LEU A 56 10.217 10.213 0.700 1.00 0.00 H new ATOM 0 HD13 LEU A 56 10.595 9.024 -0.569 1.00 0.00 H new ATOM 0 HD21 LEU A 56 12.403 7.268 1.213 1.00 0.00 H new ATOM 0 HD22 LEU A 56 12.844 7.764 -0.439 1.00 0.00 H new ATOM 0 HD23 LEU A 56 13.936 8.123 0.919 1.00 0.00 H new ATOM 916 N ASN A 57 13.892 10.818 -3.494 1.00 0.00 N ATOM 917 CA ASN A 57 14.890 11.490 -4.318 1.00 0.00 C ATOM 918 C ASN A 57 14.276 11.986 -5.628 1.00 0.00 C ATOM 919 O ASN A 57 13.098 11.751 -5.896 1.00 0.00 O ATOM 920 CB ASN A 57 16.057 10.543 -4.601 1.00 0.00 C ATOM 921 CG ASN A 57 17.257 10.824 -3.718 1.00 0.00 C ATOM 922 OD1 ASN A 57 18.091 11.673 -4.035 1.00 0.00 O ATOM 923 ND2 ASN A 57 17.351 10.110 -2.602 1.00 0.00 N ATOM 0 H ASN A 57 13.440 10.022 -3.943 1.00 0.00 H new ATOM 0 HA ASN A 57 15.260 12.357 -3.771 1.00 0.00 H new ATOM 0 HB2 ASN A 57 15.731 9.514 -4.450 1.00 0.00 H new ATOM 0 HB3 ASN A 57 16.350 10.634 -5.647 1.00 0.00 H new ATOM 0 HD21 ASN A 57 18.137 10.255 -1.969 1.00 0.00 H new ATOM 0 HD22 ASN A 57 16.637 9.417 -2.378 1.00 0.00 H new ATOM 930 N PRO A 58 15.066 12.691 -6.459 1.00 0.00 N ATOM 931 CA PRO A 58 14.592 13.232 -7.740 1.00 0.00 C ATOM 932 C PRO A 58 13.975 12.178 -8.662 1.00 0.00 C ATOM 933 O PRO A 58 13.334 12.518 -9.657 1.00 0.00 O ATOM 934 CB PRO A 58 15.858 13.815 -8.373 1.00 0.00 C ATOM 935 CG PRO A 58 16.755 14.108 -7.223 1.00 0.00 C ATOM 936 CD PRO A 58 16.480 13.033 -6.210 1.00 0.00 C ATOM 0 HA PRO A 58 13.792 13.956 -7.586 1.00 0.00 H new ATOM 0 HB2 PRO A 58 16.317 13.107 -9.063 1.00 0.00 H new ATOM 0 HB3 PRO A 58 15.636 14.718 -8.942 1.00 0.00 H new ATOM 0 HG2 PRO A 58 17.801 14.099 -7.530 1.00 0.00 H new ATOM 0 HG3 PRO A 58 16.553 15.096 -6.810 1.00 0.00 H new ATOM 0 HD2 PRO A 58 17.133 12.172 -6.349 1.00 0.00 H new ATOM 0 HD3 PRO A 58 16.635 13.390 -5.192 1.00 0.00 H new ATOM 944 N TYR A 59 14.171 10.904 -8.337 1.00 0.00 N ATOM 945 CA TYR A 59 13.630 9.820 -9.152 1.00 0.00 C ATOM 946 C TYR A 59 12.163 9.547 -8.821 1.00 0.00 C ATOM 947 O TYR A 59 11.544 8.659 -9.407 1.00 0.00 O ATOM 948 CB TYR A 59 14.453 8.546 -8.958 1.00 0.00 C ATOM 949 CG TYR A 59 15.944 8.789 -8.919 1.00 0.00 C ATOM 950 CD1 TYR A 59 16.564 9.215 -7.753 1.00 0.00 C ATOM 951 CD2 TYR A 59 16.731 8.601 -10.048 1.00 0.00 C ATOM 952 CE1 TYR A 59 17.925 9.446 -7.709 1.00 0.00 C ATOM 953 CE2 TYR A 59 18.094 8.827 -10.014 1.00 0.00 C ATOM 954 CZ TYR A 59 18.686 9.250 -8.843 1.00 0.00 C ATOM 955 OH TYR A 59 20.042 9.478 -8.805 1.00 0.00 O ATOM 0 H TYR A 59 14.698 10.597 -7.519 1.00 0.00 H new ATOM 0 HA TYR A 59 13.689 10.132 -10.195 1.00 0.00 H new ATOM 0 HB2 TYR A 59 14.147 8.064 -8.029 1.00 0.00 H new ATOM 0 HB3 TYR A 59 14.228 7.851 -9.767 1.00 0.00 H new ATOM 0 HD1 TYR A 59 15.971 9.369 -6.863 1.00 0.00 H new ATOM 0 HD2 TYR A 59 16.270 8.273 -10.968 1.00 0.00 H new ATOM 0 HE1 TYR A 59 18.391 9.778 -6.793 1.00 0.00 H new ATOM 0 HE2 TYR A 59 18.692 8.673 -10.900 1.00 0.00 H new ATOM 0 HH TYR A 59 20.430 9.292 -9.686 1.00 0.00 H new ATOM 965 N VAL A 60 11.606 10.312 -7.883 1.00 0.00 N ATOM 966 CA VAL A 60 10.211 10.139 -7.491 1.00 0.00 C ATOM 967 C VAL A 60 9.413 11.423 -7.712 1.00 0.00 C ATOM 968 O VAL A 60 8.971 12.065 -6.760 1.00 0.00 O ATOM 969 CB VAL A 60 10.089 9.709 -6.015 1.00 0.00 C ATOM 970 CG1 VAL A 60 10.688 10.763 -5.094 1.00 0.00 C ATOM 971 CG2 VAL A 60 8.635 9.433 -5.656 1.00 0.00 C ATOM 0 H VAL A 60 12.098 11.053 -7.384 1.00 0.00 H new ATOM 0 HA VAL A 60 9.800 9.351 -8.121 1.00 0.00 H new ATOM 0 HB VAL A 60 10.653 8.786 -5.879 1.00 0.00 H new ATOM 0 HG11 VAL A 60 10.591 10.439 -4.058 1.00 0.00 H new ATOM 0 HG12 VAL A 60 11.742 10.899 -5.334 1.00 0.00 H new ATOM 0 HG13 VAL A 60 10.160 11.707 -5.230 1.00 0.00 H new ATOM 0 HG21 VAL A 60 8.569 9.131 -4.611 1.00 0.00 H new ATOM 0 HG22 VAL A 60 8.044 10.336 -5.811 1.00 0.00 H new ATOM 0 HG23 VAL A 60 8.249 8.634 -6.289 1.00 0.00 H new ATOM 981 N LYS A 61 9.232 11.790 -8.977 1.00 0.00 N ATOM 982 CA LYS A 61 8.488 12.994 -9.324 1.00 0.00 C ATOM 983 C LYS A 61 6.996 12.804 -9.062 1.00 0.00 C ATOM 984 O LYS A 61 6.583 11.813 -8.461 1.00 0.00 O ATOM 985 CB LYS A 61 8.718 13.357 -10.792 1.00 0.00 C ATOM 986 CG LYS A 61 8.860 14.851 -11.034 1.00 0.00 C ATOM 987 CD LYS A 61 10.320 15.271 -11.088 1.00 0.00 C ATOM 988 CE LYS A 61 10.977 14.834 -12.388 1.00 0.00 C ATOM 989 NZ LYS A 61 12.430 15.156 -12.412 1.00 0.00 N ATOM 0 H LYS A 61 9.591 11.270 -9.778 1.00 0.00 H new ATOM 0 HA LYS A 61 8.849 13.808 -8.696 1.00 0.00 H new ATOM 0 HB2 LYS A 61 9.617 12.853 -11.146 1.00 0.00 H new ATOM 0 HB3 LYS A 61 7.886 12.979 -11.386 1.00 0.00 H new ATOM 0 HG2 LYS A 61 8.369 15.117 -11.970 1.00 0.00 H new ATOM 0 HG3 LYS A 61 8.352 15.399 -10.240 1.00 0.00 H new ATOM 0 HD2 LYS A 61 10.392 16.354 -10.989 1.00 0.00 H new ATOM 0 HD3 LYS A 61 10.856 14.837 -10.244 1.00 0.00 H new ATOM 0 HE2 LYS A 61 10.841 13.761 -12.520 1.00 0.00 H new ATOM 0 HE3 LYS A 61 10.483 15.324 -13.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 12.840 14.842 -13.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 12.560 16.183 -12.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 12.907 14.668 -11.627 1.00 0.00 H new ATOM 1003 N ARG A 62 6.194 13.761 -9.517 1.00 0.00 N ATOM 1004 CA ARG A 62 4.748 13.698 -9.333 1.00 0.00 C ATOM 1005 C ARG A 62 4.065 13.146 -10.580 1.00 0.00 C ATOM 1006 O ARG A 62 2.994 13.611 -10.973 1.00 0.00 O ATOM 1007 CB ARG A 62 4.195 15.087 -9.002 1.00 0.00 C ATOM 1008 CG ARG A 62 4.146 15.382 -7.513 1.00 0.00 C ATOM 1009 CD ARG A 62 2.780 15.064 -6.926 1.00 0.00 C ATOM 1010 NE ARG A 62 2.677 15.471 -5.527 1.00 0.00 N ATOM 1011 CZ ARG A 62 2.540 16.734 -5.130 1.00 0.00 C ATOM 1012 NH1 ARG A 62 2.490 17.715 -6.022 1.00 0.00 N ATOM 1013 NH2 ARG A 62 2.453 17.017 -3.838 1.00 0.00 N ATOM 0 H ARG A 62 6.520 14.589 -10.015 1.00 0.00 H new ATOM 0 HA ARG A 62 4.540 13.025 -8.501 1.00 0.00 H new ATOM 0 HB2 ARG A 62 4.810 15.841 -9.493 1.00 0.00 H new ATOM 0 HB3 ARG A 62 3.190 15.177 -9.415 1.00 0.00 H new ATOM 0 HG2 ARG A 62 4.909 14.796 -7.000 1.00 0.00 H new ATOM 0 HG3 ARG A 62 4.381 16.432 -7.341 1.00 0.00 H new ATOM 0 HD2 ARG A 62 2.009 15.569 -7.508 1.00 0.00 H new ATOM 0 HD3 ARG A 62 2.591 13.994 -7.007 1.00 0.00 H new ATOM 0 HE ARG A 62 2.712 14.744 -4.812 1.00 0.00 H new ATOM 0 HH11 ARG A 62 2.557 17.503 -7.017 1.00 0.00 H new ATOM 0 HH12 ARG A 62 2.385 18.681 -5.712 1.00 0.00 H new ATOM 0 HH21 ARG A 62 2.491 16.267 -3.148 1.00 0.00 H new ATOM 0 HH22 ARG A 62 2.348 17.985 -3.534 1.00 0.00 H new ATOM 1027 N SER A 63 4.691 12.150 -11.198 1.00 0.00 N ATOM 1028 CA SER A 63 4.146 11.531 -12.401 1.00 0.00 C ATOM 1029 C SER A 63 4.996 10.340 -12.829 1.00 0.00 C ATOM 1030 O SER A 63 4.469 9.301 -13.228 1.00 0.00 O ATOM 1031 CB SER A 63 4.070 12.553 -13.536 1.00 0.00 C ATOM 1032 OG SER A 63 2.929 12.332 -14.347 1.00 0.00 O ATOM 0 H SER A 63 5.577 11.754 -10.885 1.00 0.00 H new ATOM 0 HA SER A 63 3.141 11.176 -12.175 1.00 0.00 H new ATOM 0 HB2 SER A 63 4.035 13.560 -13.121 1.00 0.00 H new ATOM 0 HB3 SER A 63 4.971 12.491 -14.146 1.00 0.00 H new ATOM 0 HG SER A 63 2.903 13.000 -15.064 1.00 0.00 H new ATOM 1038 N VAL A 64 6.312 10.497 -12.740 1.00 0.00 N ATOM 1039 CA VAL A 64 7.235 9.434 -13.116 1.00 0.00 C ATOM 1040 C VAL A 64 7.101 8.236 -12.183 1.00 0.00 C ATOM 1041 O VAL A 64 7.029 7.091 -12.631 1.00 0.00 O ATOM 1042 CB VAL A 64 8.695 9.925 -13.091 1.00 0.00 C ATOM 1043 CG1 VAL A 64 9.624 8.869 -13.671 1.00 0.00 C ATOM 1044 CG2 VAL A 64 8.830 11.237 -13.850 1.00 0.00 C ATOM 0 H VAL A 64 6.763 11.350 -12.411 1.00 0.00 H new ATOM 0 HA VAL A 64 6.976 9.134 -14.131 1.00 0.00 H new ATOM 0 HB VAL A 64 8.982 10.099 -12.054 1.00 0.00 H new ATOM 0 HG11 VAL A 64 10.651 9.234 -13.645 1.00 0.00 H new ATOM 0 HG12 VAL A 64 9.549 7.955 -13.082 1.00 0.00 H new ATOM 0 HG13 VAL A 64 9.339 8.661 -14.702 1.00 0.00 H new ATOM 0 HG21 VAL A 64 9.868 11.569 -13.822 1.00 0.00 H new ATOM 0 HG22 VAL A 64 8.524 11.091 -14.886 1.00 0.00 H new ATOM 0 HG23 VAL A 64 8.195 11.992 -13.387 1.00 0.00 H new ATOM 1054 N LYS A 65 7.066 8.508 -10.884 1.00 0.00 N ATOM 1055 CA LYS A 65 6.938 7.453 -9.885 1.00 0.00 C ATOM 1056 C LYS A 65 5.583 6.761 -9.991 1.00 0.00 C ATOM 1057 O LYS A 65 5.446 5.590 -9.636 1.00 0.00 O ATOM 1058 CB LYS A 65 7.120 8.029 -8.479 1.00 0.00 C ATOM 1059 CG LYS A 65 7.360 6.969 -7.416 1.00 0.00 C ATOM 1060 CD LYS A 65 8.835 6.620 -7.300 1.00 0.00 C ATOM 1061 CE LYS A 65 9.178 5.377 -8.104 1.00 0.00 C ATOM 1062 NZ LYS A 65 8.265 4.243 -7.789 1.00 0.00 N ATOM 0 H LYS A 65 7.124 9.450 -10.497 1.00 0.00 H new ATOM 0 HA LYS A 65 7.717 6.714 -10.073 1.00 0.00 H new ATOM 0 HB2 LYS A 65 7.961 8.723 -8.485 1.00 0.00 H new ATOM 0 HB3 LYS A 65 6.233 8.605 -8.213 1.00 0.00 H new ATOM 0 HG2 LYS A 65 6.993 7.327 -6.454 1.00 0.00 H new ATOM 0 HG3 LYS A 65 6.791 6.072 -7.660 1.00 0.00 H new ATOM 0 HD2 LYS A 65 9.437 7.459 -7.650 1.00 0.00 H new ATOM 0 HD3 LYS A 65 9.091 6.459 -6.253 1.00 0.00 H new ATOM 0 HE2 LYS A 65 9.120 5.605 -9.168 1.00 0.00 H new ATOM 0 HE3 LYS A 65 10.207 5.083 -7.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 8.826 3.416 -7.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 7.627 4.516 -7.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 7.704 4.005 -8.632 1.00 0.00 H new ATOM 1076 N VAL A 66 4.583 7.490 -10.478 1.00 0.00 N ATOM 1077 CA VAL A 66 3.242 6.941 -10.622 1.00 0.00 C ATOM 1078 C VAL A 66 3.161 5.982 -11.805 1.00 0.00 C ATOM 1079 O VAL A 66 2.318 5.086 -11.832 1.00 0.00 O ATOM 1080 CB VAL A 66 2.190 8.051 -10.798 1.00 0.00 C ATOM 1081 CG1 VAL A 66 0.785 7.472 -10.732 1.00 0.00 C ATOM 1082 CG2 VAL A 66 2.377 9.136 -9.748 1.00 0.00 C ATOM 0 H VAL A 66 4.677 8.460 -10.779 1.00 0.00 H new ATOM 0 HA VAL A 66 3.028 6.396 -9.703 1.00 0.00 H new ATOM 0 HB VAL A 66 2.326 8.502 -11.781 1.00 0.00 H new ATOM 0 HG11 VAL A 66 0.055 8.272 -10.858 1.00 0.00 H new ATOM 0 HG12 VAL A 66 0.657 6.736 -11.525 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.634 6.993 -9.765 1.00 0.00 H new ATOM 0 HG21 VAL A 66 1.624 9.912 -9.888 1.00 0.00 H new ATOM 0 HG22 VAL A 66 2.270 8.702 -8.754 1.00 0.00 H new ATOM 0 HG23 VAL A 66 3.371 9.572 -9.849 1.00 0.00 H new ATOM 1092 N LYS A 67 4.048 6.165 -12.775 1.00 0.00 N ATOM 1093 CA LYS A 67 4.077 5.298 -13.944 1.00 0.00 C ATOM 1094 C LYS A 67 4.999 4.112 -13.696 1.00 0.00 C ATOM 1095 O LYS A 67 4.839 3.049 -14.295 1.00 0.00 O ATOM 1096 CB LYS A 67 4.536 6.076 -15.180 1.00 0.00 C ATOM 1097 CG LYS A 67 3.907 5.587 -16.475 1.00 0.00 C ATOM 1098 CD LYS A 67 4.806 5.864 -17.669 1.00 0.00 C ATOM 1099 CE LYS A 67 3.999 6.285 -18.887 1.00 0.00 C ATOM 1100 NZ LYS A 67 3.382 5.118 -19.576 1.00 0.00 N ATOM 0 H LYS A 67 4.753 6.902 -12.775 1.00 0.00 H new ATOM 0 HA LYS A 67 3.068 4.928 -14.125 1.00 0.00 H new ATOM 0 HB2 LYS A 67 4.296 7.131 -15.045 1.00 0.00 H new ATOM 0 HB3 LYS A 67 5.620 6.004 -15.263 1.00 0.00 H new ATOM 0 HG2 LYS A 67 3.712 4.517 -16.405 1.00 0.00 H new ATOM 0 HG3 LYS A 67 2.944 6.077 -16.621 1.00 0.00 H new ATOM 0 HD2 LYS A 67 5.519 6.648 -17.415 1.00 0.00 H new ATOM 0 HD3 LYS A 67 5.385 4.971 -17.905 1.00 0.00 H new ATOM 0 HE2 LYS A 67 3.218 6.981 -18.582 1.00 0.00 H new ATOM 0 HE3 LYS A 67 4.646 6.818 -19.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 2.841 5.448 -20.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 4.129 4.466 -19.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 2.745 4.624 -18.919 1.00 0.00 H new ATOM 1114 N SER A 68 5.958 4.300 -12.795 1.00 0.00 N ATOM 1115 CA SER A 68 6.899 3.246 -12.451 1.00 0.00 C ATOM 1116 C SER A 68 6.277 2.289 -11.441 1.00 0.00 C ATOM 1117 O SER A 68 6.639 1.114 -11.383 1.00 0.00 O ATOM 1118 CB SER A 68 8.187 3.845 -11.883 1.00 0.00 C ATOM 1119 OG SER A 68 8.034 4.179 -10.514 1.00 0.00 O ATOM 0 H SER A 68 6.102 5.175 -12.291 1.00 0.00 H new ATOM 0 HA SER A 68 7.141 2.691 -13.357 1.00 0.00 H new ATOM 0 HB2 SER A 68 9.004 3.133 -11.998 1.00 0.00 H new ATOM 0 HB3 SER A 68 8.458 4.736 -12.450 1.00 0.00 H new ATOM 0 HG SER A 68 7.170 4.622 -10.380 1.00 0.00 H new ATOM 1125 N LEU A 69 5.336 2.794 -10.643 1.00 0.00 N ATOM 1126 CA LEU A 69 4.672 1.971 -9.642 1.00 0.00 C ATOM 1127 C LEU A 69 3.721 0.978 -10.302 1.00 0.00 C ATOM 1128 O LEU A 69 3.506 -0.118 -9.793 1.00 0.00 O ATOM 1129 CB LEU A 69 3.921 2.843 -8.623 1.00 0.00 C ATOM 1130 CG LEU A 69 2.833 3.761 -9.188 1.00 0.00 C ATOM 1131 CD1 LEU A 69 1.639 2.959 -9.688 1.00 0.00 C ATOM 1132 CD2 LEU A 69 2.393 4.758 -8.128 1.00 0.00 C ATOM 0 H LEU A 69 5.020 3.764 -10.672 1.00 0.00 H new ATOM 0 HA LEU A 69 5.438 1.409 -9.108 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.464 2.187 -7.882 1.00 0.00 H new ATOM 0 HB3 LEU A 69 4.650 3.460 -8.097 1.00 0.00 H new ATOM 0 HG LEU A 69 3.251 4.302 -10.037 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.884 3.639 -10.083 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.962 2.278 -10.476 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.215 2.385 -8.864 1.00 0.00 H new ATOM 0 HD21 LEU A 69 1.619 5.407 -8.538 1.00 0.00 H new ATOM 0 HD22 LEU A 69 1.997 4.221 -7.266 1.00 0.00 H new ATOM 0 HD23 LEU A 69 3.247 5.361 -7.819 1.00 0.00 H new ATOM 1144 N SER A 70 3.155 1.368 -11.439 1.00 0.00 N ATOM 1145 CA SER A 70 2.227 0.510 -12.165 1.00 0.00 C ATOM 1146 C SER A 70 2.972 -0.557 -12.955 1.00 0.00 C ATOM 1147 O SER A 70 2.444 -1.640 -13.204 1.00 0.00 O ATOM 1148 CB SER A 70 1.351 1.344 -13.103 1.00 0.00 C ATOM 1149 OG SER A 70 0.065 0.767 -13.247 1.00 0.00 O ATOM 0 H SER A 70 3.323 2.273 -11.878 1.00 0.00 H new ATOM 0 HA SER A 70 1.589 0.012 -11.435 1.00 0.00 H new ATOM 0 HB2 SER A 70 1.257 2.357 -12.713 1.00 0.00 H new ATOM 0 HB3 SER A 70 1.830 1.422 -14.079 1.00 0.00 H new ATOM 0 HG SER A 70 -0.476 1.319 -13.850 1.00 0.00 H new ATOM 1155 N ASP A 71 4.205 -0.252 -13.339 1.00 0.00 N ATOM 1156 CA ASP A 71 5.019 -1.200 -14.084 1.00 0.00 C ATOM 1157 C ASP A 71 5.845 -2.037 -13.123 1.00 0.00 C ATOM 1158 O ASP A 71 6.104 -3.215 -13.369 1.00 0.00 O ATOM 1159 CB ASP A 71 5.930 -0.472 -15.074 1.00 0.00 C ATOM 1160 CG ASP A 71 6.155 -1.266 -16.346 1.00 0.00 C ATOM 1161 OD1 ASP A 71 6.513 -2.457 -16.246 1.00 0.00 O ATOM 1162 OD2 ASP A 71 5.972 -0.696 -17.442 1.00 0.00 O ATOM 0 H ASP A 71 4.660 0.640 -13.147 1.00 0.00 H new ATOM 0 HA ASP A 71 4.359 -1.856 -14.651 1.00 0.00 H new ATOM 0 HB2 ASP A 71 5.491 0.494 -15.325 1.00 0.00 H new ATOM 0 HB3 ASP A 71 6.891 -0.272 -14.600 1.00 0.00 H new ATOM 1167 N MET A 72 6.235 -1.425 -12.011 1.00 0.00 N ATOM 1168 CA MET A 72 7.007 -2.124 -10.999 1.00 0.00 C ATOM 1169 C MET A 72 6.083 -2.965 -10.137 1.00 0.00 C ATOM 1170 O MET A 72 6.489 -4.003 -9.614 1.00 0.00 O ATOM 1171 CB MET A 72 7.805 -1.136 -10.139 1.00 0.00 C ATOM 1172 CG MET A 72 6.996 -0.487 -9.024 1.00 0.00 C ATOM 1173 SD MET A 72 7.348 -1.199 -7.404 1.00 0.00 S ATOM 1174 CE MET A 72 6.845 0.142 -6.329 1.00 0.00 C ATOM 0 H MET A 72 6.029 -0.451 -11.791 1.00 0.00 H new ATOM 0 HA MET A 72 7.720 -2.782 -11.496 1.00 0.00 H new ATOM 0 HB2 MET A 72 8.655 -1.658 -9.700 1.00 0.00 H new ATOM 0 HB3 MET A 72 8.209 -0.354 -10.783 1.00 0.00 H new ATOM 0 HG2 MET A 72 7.209 0.582 -9.001 1.00 0.00 H new ATOM 0 HG3 MET A 72 5.933 -0.596 -9.241 1.00 0.00 H new ATOM 0 HE1 MET A 72 7.646 0.362 -5.623 1.00 0.00 H new ATOM 0 HE2 MET A 72 6.635 1.029 -6.927 1.00 0.00 H new ATOM 0 HE3 MET A 72 5.948 -0.147 -5.782 1.00 0.00 H new ATOM 1184 N THR A 73 4.828 -2.533 -10.005 1.00 0.00 N ATOM 1185 CA THR A 73 3.878 -3.296 -9.218 1.00 0.00 C ATOM 1186 C THR A 73 3.635 -4.640 -9.875 1.00 0.00 C ATOM 1187 O THR A 73 3.356 -5.628 -9.197 1.00 0.00 O ATOM 1188 CB THR A 73 2.552 -2.567 -9.037 1.00 0.00 C ATOM 1189 OG1 THR A 73 1.695 -3.341 -8.225 1.00 0.00 O ATOM 1190 CG2 THR A 73 1.810 -2.308 -10.320 1.00 0.00 C ATOM 0 H THR A 73 4.459 -1.679 -10.424 1.00 0.00 H new ATOM 0 HA THR A 73 4.312 -3.432 -8.227 1.00 0.00 H new ATOM 0 HB THR A 73 2.811 -1.606 -8.591 1.00 0.00 H new ATOM 0 HG1 THR A 73 2.122 -3.500 -7.357 1.00 0.00 H new ATOM 0 HG21 THR A 73 0.878 -1.786 -10.102 1.00 0.00 H new ATOM 0 HG22 THR A 73 2.425 -1.694 -10.978 1.00 0.00 H new ATOM 0 HG23 THR A 73 1.589 -3.256 -10.810 1.00 0.00 H new ATOM 1198 N ALA A 74 3.769 -4.683 -11.202 1.00 0.00 N ATOM 1199 CA ALA A 74 3.591 -5.931 -11.927 1.00 0.00 C ATOM 1200 C ALA A 74 4.410 -7.028 -11.260 1.00 0.00 C ATOM 1201 O ALA A 74 4.047 -8.204 -11.299 1.00 0.00 O ATOM 1202 CB ALA A 74 3.993 -5.766 -13.385 1.00 0.00 C ATOM 0 H ALA A 74 3.997 -3.878 -11.785 1.00 0.00 H new ATOM 0 HA ALA A 74 2.538 -6.212 -11.902 1.00 0.00 H new ATOM 0 HB1 ALA A 74 3.853 -6.711 -13.910 1.00 0.00 H new ATOM 0 HB2 ALA A 74 3.374 -4.998 -13.848 1.00 0.00 H new ATOM 0 HB3 ALA A 74 5.041 -5.471 -13.442 1.00 0.00 H new ATOM 1208 N LYS A 75 5.513 -6.621 -10.630 1.00 0.00 N ATOM 1209 CA LYS A 75 6.378 -7.558 -9.932 1.00 0.00 C ATOM 1210 C LYS A 75 6.069 -7.572 -8.435 1.00 0.00 C ATOM 1211 O LYS A 75 6.338 -8.559 -7.751 1.00 0.00 O ATOM 1212 CB LYS A 75 7.848 -7.201 -10.162 1.00 0.00 C ATOM 1213 CG LYS A 75 8.467 -7.913 -11.353 1.00 0.00 C ATOM 1214 CD LYS A 75 8.350 -7.082 -12.621 1.00 0.00 C ATOM 1215 CE LYS A 75 8.125 -7.959 -13.842 1.00 0.00 C ATOM 1216 NZ LYS A 75 8.344 -7.211 -15.112 1.00 0.00 N ATOM 0 H LYS A 75 5.823 -5.650 -10.592 1.00 0.00 H new ATOM 0 HA LYS A 75 6.190 -8.554 -10.332 1.00 0.00 H new ATOM 0 HB2 LYS A 75 7.933 -6.124 -10.308 1.00 0.00 H new ATOM 0 HB3 LYS A 75 8.418 -7.447 -9.266 1.00 0.00 H new ATOM 0 HG2 LYS A 75 9.517 -8.121 -11.148 1.00 0.00 H new ATOM 0 HG3 LYS A 75 7.975 -8.874 -11.500 1.00 0.00 H new ATOM 0 HD2 LYS A 75 7.525 -6.377 -12.521 1.00 0.00 H new ATOM 0 HD3 LYS A 75 9.257 -6.493 -12.757 1.00 0.00 H new ATOM 0 HE2 LYS A 75 8.799 -8.814 -13.804 1.00 0.00 H new ATOM 0 HE3 LYS A 75 7.109 -8.353 -13.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 8.181 -7.844 -15.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 7.683 -6.409 -15.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 9.321 -6.856 -15.142 1.00 0.00 H new ATOM 1230 N GLU A 76 5.497 -6.479 -7.930 1.00 0.00 N ATOM 1231 CA GLU A 76 5.152 -6.391 -6.519 1.00 0.00 C ATOM 1232 C GLU A 76 3.981 -7.309 -6.197 1.00 0.00 C ATOM 1233 O GLU A 76 4.129 -8.272 -5.445 1.00 0.00 O ATOM 1234 CB GLU A 76 4.803 -4.951 -6.140 1.00 0.00 C ATOM 1235 CG GLU A 76 5.941 -3.969 -6.367 1.00 0.00 C ATOM 1236 CD GLU A 76 7.225 -4.394 -5.683 1.00 0.00 C ATOM 1237 OE1 GLU A 76 7.416 -4.038 -4.502 1.00 0.00 O ATOM 1238 OE2 GLU A 76 8.041 -5.084 -6.330 1.00 0.00 O ATOM 0 H GLU A 76 5.266 -5.649 -8.476 1.00 0.00 H new ATOM 0 HA GLU A 76 6.018 -6.708 -5.938 1.00 0.00 H new ATOM 0 HB2 GLU A 76 3.937 -4.631 -6.720 1.00 0.00 H new ATOM 0 HB3 GLU A 76 4.512 -4.921 -5.090 1.00 0.00 H new ATOM 0 HG2 GLU A 76 6.120 -3.868 -7.437 1.00 0.00 H new ATOM 0 HG3 GLU A 76 5.646 -2.986 -5.999 1.00 0.00 H new ATOM 1245 N LYS A 77 2.821 -7.006 -6.785 1.00 0.00 N ATOM 1246 CA LYS A 77 1.604 -7.798 -6.580 1.00 0.00 C ATOM 1247 C LYS A 77 0.350 -6.971 -6.865 1.00 0.00 C ATOM 1248 O LYS A 77 -0.638 -7.493 -7.385 1.00 0.00 O ATOM 1249 CB LYS A 77 1.534 -8.349 -5.149 1.00 0.00 C ATOM 1250 CG LYS A 77 1.937 -9.812 -5.040 1.00 0.00 C ATOM 1251 CD LYS A 77 0.763 -10.736 -5.320 1.00 0.00 C ATOM 1252 CE LYS A 77 0.935 -12.078 -4.629 1.00 0.00 C ATOM 1253 NZ LYS A 77 0.023 -13.113 -5.190 1.00 0.00 N ATOM 0 H LYS A 77 2.698 -6.211 -7.412 1.00 0.00 H new ATOM 0 HA LYS A 77 1.645 -8.632 -7.280 1.00 0.00 H new ATOM 0 HB2 LYS A 77 2.183 -7.753 -4.507 1.00 0.00 H new ATOM 0 HB3 LYS A 77 0.518 -8.232 -4.773 1.00 0.00 H new ATOM 0 HG2 LYS A 77 2.742 -10.022 -5.744 1.00 0.00 H new ATOM 0 HG3 LYS A 77 2.327 -10.010 -4.041 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -0.160 -10.266 -4.981 1.00 0.00 H new ATOM 0 HD3 LYS A 77 0.667 -10.889 -6.395 1.00 0.00 H new ATOM 0 HE2 LYS A 77 1.968 -12.410 -4.733 1.00 0.00 H new ATOM 0 HE3 LYS A 77 0.742 -11.964 -3.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 0.172 -14.014 -4.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -0.964 -12.809 -5.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 0.224 -13.241 -6.202 1.00 0.00 H new ATOM 1267 N PHE A 78 0.385 -5.685 -6.507 1.00 0.00 N ATOM 1268 CA PHE A 78 -0.759 -4.794 -6.710 1.00 0.00 C ATOM 1269 C PHE A 78 -1.407 -4.997 -8.053 1.00 0.00 C ATOM 1270 O PHE A 78 -0.800 -5.527 -8.983 1.00 0.00 O ATOM 1271 CB PHE A 78 -0.353 -3.331 -6.594 1.00 0.00 C ATOM 1272 CG PHE A 78 0.586 -3.082 -5.472 1.00 0.00 C ATOM 1273 CD1 PHE A 78 0.244 -3.477 -4.203 1.00 0.00 C ATOM 1274 CD2 PHE A 78 1.804 -2.467 -5.684 1.00 0.00 C ATOM 1275 CE1 PHE A 78 1.100 -3.268 -3.152 1.00 0.00 C ATOM 1276 CE2 PHE A 78 2.669 -2.251 -4.637 1.00 0.00 C ATOM 1277 CZ PHE A 78 2.318 -2.655 -3.365 1.00 0.00 C ATOM 0 H PHE A 78 1.194 -5.238 -6.075 1.00 0.00 H new ATOM 0 HA PHE A 78 -1.473 -5.045 -5.926 1.00 0.00 H new ATOM 0 HB2 PHE A 78 0.111 -3.012 -7.527 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -1.246 -2.721 -6.457 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -0.708 -3.957 -4.030 1.00 0.00 H new ATOM 0 HD2 PHE A 78 2.079 -2.153 -6.680 1.00 0.00 H new ATOM 0 HE1 PHE A 78 0.821 -3.583 -2.157 1.00 0.00 H new ATOM 0 HE2 PHE A 78 3.619 -1.767 -4.809 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.994 -2.492 -2.539 1.00 0.00 H new ATOM 1287 N SER A 79 -2.642 -4.535 -8.143 1.00 0.00 N ATOM 1288 CA SER A 79 -3.400 -4.621 -9.378 1.00 0.00 C ATOM 1289 C SER A 79 -4.900 -4.490 -9.139 1.00 0.00 C ATOM 1290 O SER A 79 -5.587 -3.785 -9.877 1.00 0.00 O ATOM 1291 CB SER A 79 -3.109 -5.929 -10.127 1.00 0.00 C ATOM 1292 OG SER A 79 -4.165 -6.262 -11.012 1.00 0.00 O ATOM 0 H SER A 79 -3.143 -4.094 -7.371 1.00 0.00 H new ATOM 0 HA SER A 79 -3.077 -3.782 -9.995 1.00 0.00 H new ATOM 0 HB2 SER A 79 -2.179 -5.830 -10.688 1.00 0.00 H new ATOM 0 HB3 SER A 79 -2.965 -6.737 -9.410 1.00 0.00 H new ATOM 0 HG SER A 79 -3.951 -7.098 -11.476 1.00 0.00 H new ATOM 1298 N PRO A 80 -5.453 -5.207 -8.150 1.00 0.00 N ATOM 1299 CA PRO A 80 -6.874 -5.189 -7.886 1.00 0.00 C ATOM 1300 C PRO A 80 -7.307 -4.294 -6.734 1.00 0.00 C ATOM 1301 O PRO A 80 -7.913 -3.245 -6.957 1.00 0.00 O ATOM 1302 CB PRO A 80 -7.146 -6.658 -7.565 1.00 0.00 C ATOM 1303 CG PRO A 80 -5.849 -7.193 -7.009 1.00 0.00 C ATOM 1304 CD PRO A 80 -4.779 -6.148 -7.258 1.00 0.00 C ATOM 0 HA PRO A 80 -7.432 -4.776 -8.726 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -7.955 -6.759 -6.841 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -7.447 -7.206 -8.458 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -5.945 -7.397 -5.943 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -5.585 -8.134 -7.491 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -4.457 -5.670 -6.333 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -3.891 -6.579 -7.720 1.00 0.00 H new ATOM 1312 N LEU A 81 -7.010 -4.696 -5.502 1.00 0.00 N ATOM 1313 CA LEU A 81 -7.400 -3.896 -4.354 1.00 0.00 C ATOM 1314 C LEU A 81 -6.255 -3.003 -3.937 1.00 0.00 C ATOM 1315 O LEU A 81 -6.279 -2.382 -2.876 1.00 0.00 O ATOM 1316 CB LEU A 81 -7.829 -4.788 -3.195 1.00 0.00 C ATOM 1317 CG LEU A 81 -9.339 -4.994 -3.073 1.00 0.00 C ATOM 1318 CD1 LEU A 81 -10.020 -3.704 -2.638 1.00 0.00 C ATOM 1319 CD2 LEU A 81 -9.918 -5.481 -4.392 1.00 0.00 C ATOM 0 H LEU A 81 -6.509 -5.556 -5.278 1.00 0.00 H new ATOM 0 HA LEU A 81 -8.250 -3.274 -4.635 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -7.351 -5.761 -3.307 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.459 -4.356 -2.265 1.00 0.00 H new ATOM 0 HG LEU A 81 -9.522 -5.754 -2.313 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -11.094 -3.869 -2.556 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -9.626 -3.393 -1.670 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -9.828 -2.925 -3.375 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -10.994 -5.622 -4.287 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -9.723 -4.742 -5.170 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.453 -6.428 -4.666 1.00 0.00 H new ATOM 1331 N THR A 82 -5.248 -2.952 -4.790 1.00 0.00 N ATOM 1332 CA THR A 82 -4.082 -2.152 -4.538 1.00 0.00 C ATOM 1333 C THR A 82 -3.736 -1.293 -5.745 1.00 0.00 C ATOM 1334 O THR A 82 -2.820 -0.478 -5.684 1.00 0.00 O ATOM 1335 CB THR A 82 -2.915 -3.050 -4.167 1.00 0.00 C ATOM 1336 OG1 THR A 82 -3.345 -4.391 -4.001 1.00 0.00 O ATOM 1337 CG2 THR A 82 -2.247 -2.621 -2.877 1.00 0.00 C ATOM 0 H THR A 82 -5.223 -3.465 -5.671 1.00 0.00 H new ATOM 0 HA THR A 82 -4.294 -1.481 -3.705 1.00 0.00 H new ATOM 0 HB THR A 82 -2.201 -2.970 -4.987 1.00 0.00 H new ATOM 0 HG1 THR A 82 -3.603 -4.539 -3.067 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.419 -3.294 -2.655 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.869 -1.604 -2.983 1.00 0.00 H new ATOM 0 HG23 THR A 82 -2.971 -2.656 -2.063 1.00 0.00 H new ATOM 1345 N SER A 83 -4.476 -1.453 -6.842 1.00 0.00 N ATOM 1346 CA SER A 83 -4.211 -0.654 -8.025 1.00 0.00 C ATOM 1347 C SER A 83 -4.971 0.667 -7.967 1.00 0.00 C ATOM 1348 O SER A 83 -5.275 1.277 -8.992 1.00 0.00 O ATOM 1349 CB SER A 83 -4.582 -1.406 -9.298 1.00 0.00 C ATOM 1350 OG SER A 83 -4.463 -0.571 -10.437 1.00 0.00 O ATOM 0 H SER A 83 -5.247 -2.115 -6.931 1.00 0.00 H new ATOM 0 HA SER A 83 -3.141 -0.448 -8.045 1.00 0.00 H new ATOM 0 HB2 SER A 83 -3.935 -2.276 -9.412 1.00 0.00 H new ATOM 0 HB3 SER A 83 -5.604 -1.777 -9.220 1.00 0.00 H new ATOM 0 HG SER A 83 -5.039 0.214 -10.328 1.00 0.00 H new ATOM 1356 N ASN A 84 -5.251 1.100 -6.752 1.00 0.00 N ATOM 1357 CA ASN A 84 -5.949 2.346 -6.496 1.00 0.00 C ATOM 1358 C ASN A 84 -5.313 2.965 -5.275 1.00 0.00 C ATOM 1359 O ASN A 84 -4.957 4.144 -5.260 1.00 0.00 O ATOM 1360 CB ASN A 84 -7.442 2.102 -6.264 1.00 0.00 C ATOM 1361 CG ASN A 84 -8.263 2.302 -7.524 1.00 0.00 C ATOM 1362 OD1 ASN A 84 -8.767 1.343 -8.108 1.00 0.00 O ATOM 1363 ND2 ASN A 84 -8.401 3.552 -7.948 1.00 0.00 N ATOM 0 H ASN A 84 -4.997 0.591 -5.905 1.00 0.00 H new ATOM 0 HA ASN A 84 -5.869 3.012 -7.355 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -7.589 1.087 -5.895 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -7.802 2.778 -5.488 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -8.943 3.748 -8.790 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -7.965 4.317 -7.432 1.00 0.00 H new ATOM 1370 N LEU A 85 -5.114 2.123 -4.269 1.00 0.00 N ATOM 1371 CA LEU A 85 -4.450 2.537 -3.058 1.00 0.00 C ATOM 1372 C LEU A 85 -2.992 2.830 -3.390 1.00 0.00 C ATOM 1373 O LEU A 85 -2.317 3.564 -2.671 1.00 0.00 O ATOM 1374 CB LEU A 85 -4.547 1.441 -1.990 1.00 0.00 C ATOM 1375 CG LEU A 85 -3.691 1.669 -0.740 1.00 0.00 C ATOM 1376 CD1 LEU A 85 -4.374 2.649 0.202 1.00 0.00 C ATOM 1377 CD2 LEU A 85 -3.419 0.349 -0.032 1.00 0.00 C ATOM 0 H LEU A 85 -5.408 1.146 -4.276 1.00 0.00 H new ATOM 0 HA LEU A 85 -4.928 3.431 -2.659 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -5.589 1.345 -1.685 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -4.258 0.491 -2.440 1.00 0.00 H new ATOM 0 HG LEU A 85 -2.737 2.097 -1.049 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -3.752 2.799 1.084 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -4.518 3.602 -0.307 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -5.342 2.249 0.504 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.810 0.530 0.854 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -4.364 -0.106 0.264 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -2.888 -0.323 -0.706 1.00 0.00 H new ATOM 1389 N ILE A 86 -2.510 2.258 -4.506 1.00 0.00 N ATOM 1390 CA ILE A 86 -1.138 2.478 -4.928 1.00 0.00 C ATOM 1391 C ILE A 86 -0.912 3.951 -5.251 1.00 0.00 C ATOM 1392 O ILE A 86 0.057 4.558 -4.795 1.00 0.00 O ATOM 1393 CB ILE A 86 -0.770 1.596 -6.150 1.00 0.00 C ATOM 1394 CG1 ILE A 86 0.188 0.482 -5.728 1.00 0.00 C ATOM 1395 CG2 ILE A 86 -0.151 2.419 -7.274 1.00 0.00 C ATOM 1396 CD1 ILE A 86 -0.363 -0.403 -4.635 1.00 0.00 C ATOM 0 H ILE A 86 -3.052 1.648 -5.119 1.00 0.00 H new ATOM 0 HA ILE A 86 -0.487 2.192 -4.102 1.00 0.00 H new ATOM 0 HB ILE A 86 -1.692 1.156 -6.529 1.00 0.00 H new ATOM 0 HG12 ILE A 86 0.425 -0.132 -6.597 1.00 0.00 H new ATOM 0 HG13 ILE A 86 1.123 0.927 -5.388 1.00 0.00 H new ATOM 0 HG21 ILE A 86 0.093 1.766 -8.112 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -0.860 3.179 -7.601 1.00 0.00 H new ATOM 0 HG23 ILE A 86 0.758 2.902 -6.914 1.00 0.00 H new ATOM 0 HD11 ILE A 86 0.369 -1.171 -4.385 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -0.573 0.199 -3.751 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -1.283 -0.876 -4.979 1.00 0.00 H new ATOM 1408 N ASN A 87 -1.820 4.521 -6.038 1.00 0.00 N ATOM 1409 CA ASN A 87 -1.726 5.922 -6.417 1.00 0.00 C ATOM 1410 C ASN A 87 -1.859 6.822 -5.194 1.00 0.00 C ATOM 1411 O ASN A 87 -1.349 7.940 -5.176 1.00 0.00 O ATOM 1412 CB ASN A 87 -2.809 6.270 -7.442 1.00 0.00 C ATOM 1413 CG ASN A 87 -2.647 7.669 -8.003 1.00 0.00 C ATOM 1414 OD1 ASN A 87 -1.601 8.297 -7.844 1.00 0.00 O ATOM 1415 ND2 ASN A 87 -3.686 8.164 -8.665 1.00 0.00 N ATOM 0 H ASN A 87 -2.628 4.032 -6.424 1.00 0.00 H new ATOM 0 HA ASN A 87 -0.747 6.088 -6.866 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -2.778 5.548 -8.258 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -3.790 6.180 -6.975 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -3.636 9.101 -9.066 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -4.534 7.608 -8.773 1.00 0.00 H new ATOM 1422 N LEU A 88 -2.549 6.325 -4.172 1.00 0.00 N ATOM 1423 CA LEU A 88 -2.749 7.085 -2.944 1.00 0.00 C ATOM 1424 C LEU A 88 -1.432 7.279 -2.199 1.00 0.00 C ATOM 1425 O LEU A 88 -1.165 8.356 -1.667 1.00 0.00 O ATOM 1426 CB LEU A 88 -3.759 6.376 -2.038 1.00 0.00 C ATOM 1427 CG LEU A 88 -5.222 6.745 -2.289 1.00 0.00 C ATOM 1428 CD1 LEU A 88 -6.147 5.784 -1.559 1.00 0.00 C ATOM 1429 CD2 LEU A 88 -5.490 8.179 -1.854 1.00 0.00 C ATOM 0 H LEU A 88 -2.979 5.400 -4.170 1.00 0.00 H new ATOM 0 HA LEU A 88 -3.139 8.066 -3.216 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -3.645 5.299 -2.164 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -3.515 6.603 -1.000 1.00 0.00 H new ATOM 0 HG LEU A 88 -5.420 6.666 -3.358 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -7.184 6.062 -1.749 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -5.972 4.769 -1.916 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -5.949 5.831 -0.488 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -6.535 8.426 -2.039 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -5.276 8.283 -0.790 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -4.851 8.857 -2.421 1.00 0.00 H new ATOM 1441 N LEU A 89 -0.611 6.234 -2.166 1.00 0.00 N ATOM 1442 CA LEU A 89 0.676 6.304 -1.483 1.00 0.00 C ATOM 1443 C LEU A 89 1.716 7.000 -2.351 1.00 0.00 C ATOM 1444 O LEU A 89 2.676 7.583 -1.845 1.00 0.00 O ATOM 1445 CB LEU A 89 1.154 4.901 -1.112 1.00 0.00 C ATOM 1446 CG LEU A 89 0.428 4.277 0.076 1.00 0.00 C ATOM 1447 CD1 LEU A 89 -0.916 3.716 -0.357 1.00 0.00 C ATOM 1448 CD2 LEU A 89 1.281 3.194 0.718 1.00 0.00 C ATOM 0 H LEU A 89 -0.812 5.334 -2.601 1.00 0.00 H new ATOM 0 HA LEU A 89 0.546 6.888 -0.572 1.00 0.00 H new ATOM 0 HB2 LEU A 89 1.034 4.250 -1.978 1.00 0.00 H new ATOM 0 HB3 LEU A 89 2.220 4.942 -0.889 1.00 0.00 H new ATOM 0 HG LEU A 89 0.252 5.055 0.819 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.420 3.275 0.503 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -1.530 4.518 -0.766 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -0.763 2.952 -1.119 1.00 0.00 H new ATOM 0 HD21 LEU A 89 0.745 2.762 1.563 1.00 0.00 H new ATOM 0 HD22 LEU A 89 1.492 2.415 -0.015 1.00 0.00 H new ATOM 0 HD23 LEU A 89 2.218 3.628 1.066 1.00 0.00 H new ATOM 1460 N ALA A 90 1.520 6.933 -3.661 1.00 0.00 N ATOM 1461 CA ALA A 90 2.439 7.555 -4.606 1.00 0.00 C ATOM 1462 C ALA A 90 2.024 8.988 -4.934 1.00 0.00 C ATOM 1463 O ALA A 90 2.829 9.773 -5.431 1.00 0.00 O ATOM 1464 CB ALA A 90 2.525 6.726 -5.878 1.00 0.00 C ATOM 0 H ALA A 90 0.731 6.453 -4.095 1.00 0.00 H new ATOM 0 HA ALA A 90 3.422 7.594 -4.138 1.00 0.00 H new ATOM 0 HB1 ALA A 90 3.214 7.201 -6.576 1.00 0.00 H new ATOM 0 HB2 ALA A 90 2.885 5.726 -5.637 1.00 0.00 H new ATOM 0 HB3 ALA A 90 1.538 6.656 -6.334 1.00 0.00 H new ATOM 1470 N GLU A 91 0.766 9.324 -4.657 1.00 0.00 N ATOM 1471 CA GLU A 91 0.264 10.668 -4.933 1.00 0.00 C ATOM 1472 C GLU A 91 0.187 11.495 -3.655 1.00 0.00 C ATOM 1473 O GLU A 91 0.837 12.533 -3.536 1.00 0.00 O ATOM 1474 CB GLU A 91 -1.116 10.598 -5.590 1.00 0.00 C ATOM 1475 CG GLU A 91 -1.677 11.958 -5.973 1.00 0.00 C ATOM 1476 CD GLU A 91 -2.359 12.654 -4.810 1.00 0.00 C ATOM 1477 OE1 GLU A 91 -3.448 12.200 -4.403 1.00 0.00 O ATOM 1478 OE2 GLU A 91 -1.803 13.653 -4.308 1.00 0.00 O ATOM 0 H GLU A 91 0.081 8.690 -4.245 1.00 0.00 H new ATOM 0 HA GLU A 91 0.961 11.152 -5.617 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -1.053 9.976 -6.483 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -1.810 10.107 -4.907 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -0.870 12.588 -6.347 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -2.390 11.837 -6.788 1.00 0.00 H new ATOM 1485 N ASN A 92 -0.612 11.029 -2.700 1.00 0.00 N ATOM 1486 CA ASN A 92 -0.773 11.727 -1.429 1.00 0.00 C ATOM 1487 C ASN A 92 0.575 11.944 -0.746 1.00 0.00 C ATOM 1488 O ASN A 92 0.724 12.846 0.080 1.00 0.00 O ATOM 1489 CB ASN A 92 -1.705 10.941 -0.505 1.00 0.00 C ATOM 1490 CG ASN A 92 -3.004 10.557 -1.185 1.00 0.00 C ATOM 1491 OD1 ASN A 92 -3.011 10.114 -2.334 1.00 0.00 O ATOM 1492 ND2 ASN A 92 -4.115 10.725 -0.476 1.00 0.00 N ATOM 0 H ASN A 92 -1.158 10.171 -2.782 1.00 0.00 H new ATOM 0 HA ASN A 92 -1.214 12.702 -1.636 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -1.197 10.039 -0.163 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -1.924 11.539 0.380 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -5.020 10.484 -0.881 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -4.063 11.095 0.473 1.00 0.00 H new ATOM 1499 N GLY A 93 1.552 11.112 -1.092 1.00 0.00 N ATOM 1500 CA GLY A 93 2.871 11.233 -0.500 1.00 0.00 C ATOM 1501 C GLY A 93 2.993 10.452 0.794 1.00 0.00 C ATOM 1502 O GLY A 93 3.708 10.861 1.709 1.00 0.00 O ATOM 0 H GLY A 93 1.454 10.357 -1.771 1.00 0.00 H new ATOM 0 HA2 GLY A 93 3.619 10.878 -1.209 1.00 0.00 H new ATOM 0 HA3 GLY A 93 3.087 12.284 -0.309 1.00 0.00 H new ATOM 1506 N ARG A 94 2.292 9.327 0.869 1.00 0.00 N ATOM 1507 CA ARG A 94 2.321 8.487 2.061 1.00 0.00 C ATOM 1508 C ARG A 94 3.299 7.329 1.890 1.00 0.00 C ATOM 1509 O ARG A 94 3.111 6.257 2.463 1.00 0.00 O ATOM 1510 CB ARG A 94 0.922 7.946 2.362 1.00 0.00 C ATOM 1511 CG ARG A 94 0.731 7.528 3.811 1.00 0.00 C ATOM 1512 CD ARG A 94 0.478 8.728 4.708 1.00 0.00 C ATOM 1513 NE ARG A 94 1.721 9.299 5.223 1.00 0.00 N ATOM 1514 CZ ARG A 94 1.818 10.523 5.738 1.00 0.00 C ATOM 1515 NH1 ARG A 94 0.749 11.307 5.807 1.00 0.00 N ATOM 1516 NH2 ARG A 94 2.985 10.963 6.183 1.00 0.00 N ATOM 0 H ARG A 94 1.697 8.975 0.119 1.00 0.00 H new ATOM 0 HA ARG A 94 2.656 9.100 2.898 1.00 0.00 H new ATOM 0 HB2 ARG A 94 0.185 8.709 2.112 1.00 0.00 H new ATOM 0 HB3 ARG A 94 0.726 7.090 1.717 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -0.107 6.835 3.883 1.00 0.00 H new ATOM 0 HG3 ARG A 94 1.616 6.994 4.157 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -0.067 9.489 4.150 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -0.157 8.429 5.542 1.00 0.00 H new ATOM 0 HE ARG A 94 2.564 8.726 5.186 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -0.152 10.972 5.465 1.00 0.00 H new ATOM 0 HH12 ARG A 94 0.828 12.244 6.202 1.00 0.00 H new ATOM 0 HH21 ARG A 94 3.809 10.364 6.131 1.00 0.00 H new ATOM 0 HH22 ARG A 94 3.060 11.901 6.578 1.00 0.00 H new ATOM 1530 N LEU A 95 4.347 7.552 1.101 1.00 0.00 N ATOM 1531 CA LEU A 95 5.354 6.524 0.863 1.00 0.00 C ATOM 1532 C LEU A 95 6.550 6.705 1.793 1.00 0.00 C ATOM 1533 O LEU A 95 7.668 6.310 1.468 1.00 0.00 O ATOM 1534 CB LEU A 95 5.815 6.557 -0.596 1.00 0.00 C ATOM 1535 CG LEU A 95 4.998 5.686 -1.552 1.00 0.00 C ATOM 1536 CD1 LEU A 95 5.231 6.113 -2.993 1.00 0.00 C ATOM 1537 CD2 LEU A 95 5.349 4.218 -1.366 1.00 0.00 C ATOM 0 H LEU A 95 4.520 8.433 0.617 1.00 0.00 H new ATOM 0 HA LEU A 95 4.901 5.554 1.070 1.00 0.00 H new ATOM 0 HB2 LEU A 95 5.781 7.588 -0.949 1.00 0.00 H new ATOM 0 HB3 LEU A 95 6.857 6.239 -0.639 1.00 0.00 H new ATOM 0 HG LEU A 95 3.941 5.819 -1.321 1.00 0.00 H new ATOM 0 HD11 LEU A 95 4.642 5.483 -3.659 1.00 0.00 H new ATOM 0 HD12 LEU A 95 4.930 7.153 -3.117 1.00 0.00 H new ATOM 0 HD13 LEU A 95 6.288 6.010 -3.237 1.00 0.00 H new ATOM 0 HD21 LEU A 95 4.759 3.613 -2.054 1.00 0.00 H new ATOM 0 HD22 LEU A 95 6.409 4.069 -1.570 1.00 0.00 H new ATOM 0 HD23 LEU A 95 5.131 3.919 -0.341 1.00 0.00 H new ATOM 1549 N THR A 96 6.301 7.298 2.955 1.00 0.00 N ATOM 1550 CA THR A 96 7.348 7.523 3.943 1.00 0.00 C ATOM 1551 C THR A 96 7.053 6.725 5.206 1.00 0.00 C ATOM 1552 O THR A 96 7.956 6.176 5.837 1.00 0.00 O ATOM 1553 CB THR A 96 7.459 9.012 4.276 1.00 0.00 C ATOM 1554 OG1 THR A 96 6.413 9.411 5.144 1.00 0.00 O ATOM 1555 CG2 THR A 96 7.406 9.903 3.054 1.00 0.00 C ATOM 0 H THR A 96 5.379 7.633 3.236 1.00 0.00 H new ATOM 0 HA THR A 96 8.298 7.189 3.526 1.00 0.00 H new ATOM 0 HB THR A 96 8.433 9.130 4.751 1.00 0.00 H new ATOM 0 HG1 THR A 96 6.688 9.271 6.074 1.00 0.00 H new ATOM 0 HG21 THR A 96 7.490 10.946 3.360 1.00 0.00 H new ATOM 0 HG22 THR A 96 8.230 9.654 2.386 1.00 0.00 H new ATOM 0 HG23 THR A 96 6.460 9.752 2.535 1.00 0.00 H new ATOM 1563 N ASN A 97 5.773 6.657 5.555 1.00 0.00 N ATOM 1564 CA ASN A 97 5.333 5.917 6.729 1.00 0.00 C ATOM 1565 C ASN A 97 4.276 4.889 6.340 1.00 0.00 C ATOM 1566 O ASN A 97 3.415 4.533 7.144 1.00 0.00 O ATOM 1567 CB ASN A 97 4.771 6.873 7.782 1.00 0.00 C ATOM 1568 CG ASN A 97 5.846 7.733 8.417 1.00 0.00 C ATOM 1569 OD1 ASN A 97 6.218 8.812 7.739 1.00 0.00 O flip ATOM 1570 ND2 ASN A 97 6.338 7.430 9.504 1.00 0.00 N flip ATOM 0 H ASN A 97 5.019 7.109 5.037 1.00 0.00 H new ATOM 0 HA ASN A 97 6.192 5.397 7.152 1.00 0.00 H new ATOM 0 HB2 ASN A 97 4.021 7.516 7.321 1.00 0.00 H new ATOM 0 HB3 ASN A 97 4.265 6.298 8.557 1.00 0.00 H new ATOM 0 HD21 ASN A 97 6.022 6.591 9.991 1.00 0.00 H new ATOM 0 HD22 ASN A 97 7.062 8.018 9.918 1.00 0.00 H new ATOM 1577 N THR A 98 4.345 4.420 5.095 1.00 0.00 N ATOM 1578 CA THR A 98 3.390 3.439 4.594 1.00 0.00 C ATOM 1579 C THR A 98 3.444 2.120 5.375 1.00 0.00 C ATOM 1580 O THR A 98 2.423 1.445 5.509 1.00 0.00 O ATOM 1581 CB THR A 98 3.609 3.172 3.100 1.00 0.00 C ATOM 1582 OG1 THR A 98 2.833 2.067 2.672 1.00 0.00 O ATOM 1583 CG2 THR A 98 5.049 2.883 2.730 1.00 0.00 C ATOM 0 H THR A 98 5.052 4.705 4.417 1.00 0.00 H new ATOM 0 HA THR A 98 2.399 3.869 4.739 1.00 0.00 H new ATOM 0 HB THR A 98 3.308 4.095 2.604 1.00 0.00 H new ATOM 0 HG1 THR A 98 1.983 2.056 3.159 1.00 0.00 H new ATOM 0 HG21 THR A 98 5.120 2.705 1.657 1.00 0.00 H new ATOM 0 HG22 THR A 98 5.672 3.736 2.999 1.00 0.00 H new ATOM 0 HG23 THR A 98 5.393 1.999 3.268 1.00 0.00 H new ATOM 1591 N PRO A 99 4.619 1.719 5.909 1.00 0.00 N ATOM 1592 CA PRO A 99 4.738 0.467 6.666 1.00 0.00 C ATOM 1593 C PRO A 99 3.781 0.420 7.853 1.00 0.00 C ATOM 1594 O PRO A 99 3.418 -0.656 8.327 1.00 0.00 O ATOM 1595 CB PRO A 99 6.193 0.467 7.146 1.00 0.00 C ATOM 1596 CG PRO A 99 6.903 1.362 6.193 1.00 0.00 C ATOM 1597 CD PRO A 99 5.911 2.428 5.826 1.00 0.00 C ATOM 0 HA PRO A 99 4.483 -0.401 6.058 1.00 0.00 H new ATOM 0 HB2 PRO A 99 6.273 0.834 8.169 1.00 0.00 H new ATOM 0 HB3 PRO A 99 6.614 -0.538 7.134 1.00 0.00 H new ATOM 0 HG2 PRO A 99 7.793 1.795 6.650 1.00 0.00 H new ATOM 0 HG3 PRO A 99 7.233 0.813 5.311 1.00 0.00 H new ATOM 0 HD2 PRO A 99 5.953 3.273 6.513 1.00 0.00 H new ATOM 0 HD3 PRO A 99 6.092 2.822 4.826 1.00 0.00 H new ATOM 1605 N ALA A 100 3.372 1.594 8.324 1.00 0.00 N ATOM 1606 CA ALA A 100 2.453 1.685 9.451 1.00 0.00 C ATOM 1607 C ALA A 100 1.020 1.420 9.002 1.00 0.00 C ATOM 1608 O ALA A 100 0.210 0.883 9.758 1.00 0.00 O ATOM 1609 CB ALA A 100 2.561 3.052 10.112 1.00 0.00 C ATOM 0 H ALA A 100 3.663 2.494 7.942 1.00 0.00 H new ATOM 0 HA ALA A 100 2.727 0.923 10.181 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.869 3.106 10.952 1.00 0.00 H new ATOM 0 HB2 ALA A 100 3.579 3.203 10.470 1.00 0.00 H new ATOM 0 HB3 ALA A 100 2.312 3.827 9.387 1.00 0.00 H new ATOM 1615 N VAL A 101 0.714 1.797 7.764 1.00 0.00 N ATOM 1616 CA VAL A 101 -0.619 1.597 7.212 1.00 0.00 C ATOM 1617 C VAL A 101 -0.848 0.133 6.858 1.00 0.00 C ATOM 1618 O VAL A 101 -1.969 -0.369 6.939 1.00 0.00 O ATOM 1619 CB VAL A 101 -0.842 2.459 5.954 1.00 0.00 C ATOM 1620 CG1 VAL A 101 -2.289 2.371 5.493 1.00 0.00 C ATOM 1621 CG2 VAL A 101 -0.444 3.903 6.219 1.00 0.00 C ATOM 0 H VAL A 101 1.372 2.243 7.125 1.00 0.00 H new ATOM 0 HA VAL A 101 -1.330 1.900 7.980 1.00 0.00 H new ATOM 0 HB VAL A 101 -0.209 2.073 5.155 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -2.426 2.986 4.604 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -2.534 1.335 5.258 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -2.946 2.728 6.286 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -0.608 4.497 5.320 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -1.048 4.303 7.033 1.00 0.00 H new ATOM 0 HG23 VAL A 101 0.610 3.945 6.494 1.00 0.00 H new ATOM 1631 N ILE A 102 0.225 -0.550 6.470 1.00 0.00 N ATOM 1632 CA ILE A 102 0.143 -1.960 6.106 1.00 0.00 C ATOM 1633 C ILE A 102 0.010 -2.836 7.348 1.00 0.00 C ATOM 1634 O ILE A 102 -0.738 -3.812 7.354 1.00 0.00 O ATOM 1635 CB ILE A 102 1.381 -2.406 5.306 1.00 0.00 C ATOM 1636 CG1 ILE A 102 1.614 -1.470 4.118 1.00 0.00 C ATOM 1637 CG2 ILE A 102 1.218 -3.842 4.830 1.00 0.00 C ATOM 1638 CD1 ILE A 102 3.072 -1.134 3.891 1.00 0.00 C ATOM 0 H ILE A 102 1.161 -0.150 6.400 1.00 0.00 H new ATOM 0 HA ILE A 102 -0.743 -2.078 5.482 1.00 0.00 H new ATOM 0 HB ILE A 102 2.252 -2.357 5.960 1.00 0.00 H new ATOM 0 HG12 ILE A 102 1.211 -1.933 3.217 1.00 0.00 H new ATOM 0 HG13 ILE A 102 1.057 -0.547 4.278 1.00 0.00 H new ATOM 0 HG21 ILE A 102 2.102 -4.141 4.266 1.00 0.00 H new ATOM 0 HG22 ILE A 102 1.097 -4.499 5.691 1.00 0.00 H new ATOM 0 HG23 ILE A 102 0.338 -3.916 4.191 1.00 0.00 H new ATOM 0 HD11 ILE A 102 3.162 -0.467 3.034 1.00 0.00 H new ATOM 0 HD12 ILE A 102 3.474 -0.643 4.777 1.00 0.00 H new ATOM 0 HD13 ILE A 102 3.631 -2.050 3.699 1.00 0.00 H new ATOM 1650 N SER A 103 0.744 -2.478 8.399 1.00 0.00 N ATOM 1651 CA SER A 103 0.707 -3.233 9.647 1.00 0.00 C ATOM 1652 C SER A 103 -0.704 -3.263 10.221 1.00 0.00 C ATOM 1653 O SER A 103 -1.184 -4.309 10.660 1.00 0.00 O ATOM 1654 CB SER A 103 1.673 -2.623 10.665 1.00 0.00 C ATOM 1655 OG SER A 103 1.779 -3.438 11.820 1.00 0.00 O ATOM 0 H SER A 103 1.369 -1.672 8.411 1.00 0.00 H new ATOM 0 HA SER A 103 1.015 -4.257 9.434 1.00 0.00 H new ATOM 0 HB2 SER A 103 2.656 -2.501 10.210 1.00 0.00 H new ATOM 0 HB3 SER A 103 1.328 -1.629 10.948 1.00 0.00 H new ATOM 0 HG SER A 103 2.403 -3.027 12.454 1.00 0.00 H new ATOM 1661 N ALA A 104 -1.368 -2.111 10.210 1.00 0.00 N ATOM 1662 CA ALA A 104 -2.727 -2.009 10.726 1.00 0.00 C ATOM 1663 C ALA A 104 -3.658 -2.966 9.991 1.00 0.00 C ATOM 1664 O ALA A 104 -4.577 -3.534 10.583 1.00 0.00 O ATOM 1665 CB ALA A 104 -3.231 -0.579 10.605 1.00 0.00 C ATOM 0 H ALA A 104 -0.987 -1.236 9.850 1.00 0.00 H new ATOM 0 HA ALA A 104 -2.716 -2.288 11.780 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -4.247 -0.517 10.994 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -2.583 0.085 11.177 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -3.225 -0.278 9.557 1.00 0.00 H new ATOM 1671 N PHE A 105 -3.410 -3.145 8.697 1.00 0.00 N ATOM 1672 CA PHE A 105 -4.222 -4.036 7.876 1.00 0.00 C ATOM 1673 C PHE A 105 -4.227 -5.448 8.451 1.00 0.00 C ATOM 1674 O PHE A 105 -5.233 -6.150 8.386 1.00 0.00 O ATOM 1675 CB PHE A 105 -3.692 -4.064 6.441 1.00 0.00 C ATOM 1676 CG PHE A 105 -4.690 -4.574 5.438 1.00 0.00 C ATOM 1677 CD1 PHE A 105 -5.149 -5.882 5.495 1.00 0.00 C ATOM 1678 CD2 PHE A 105 -5.169 -3.746 4.437 1.00 0.00 C ATOM 1679 CE1 PHE A 105 -6.064 -6.349 4.574 1.00 0.00 C ATOM 1680 CE2 PHE A 105 -6.083 -4.210 3.514 1.00 0.00 C ATOM 1681 CZ PHE A 105 -6.532 -5.513 3.583 1.00 0.00 C ATOM 0 H PHE A 105 -2.652 -2.684 8.194 1.00 0.00 H new ATOM 0 HA PHE A 105 -5.244 -3.657 7.874 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -3.386 -3.057 6.156 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -2.801 -4.690 6.404 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -4.786 -6.542 6.269 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -4.823 -2.725 4.378 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -6.413 -7.369 4.630 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -6.447 -3.554 2.737 1.00 0.00 H new ATOM 0 HZ PHE A 105 -7.249 -5.877 2.862 1.00 0.00 H new ATOM 1691 N SER A 106 -3.093 -5.858 9.011 1.00 0.00 N ATOM 1692 CA SER A 106 -2.971 -7.190 9.590 1.00 0.00 C ATOM 1693 C SER A 106 -3.874 -7.346 10.808 1.00 0.00 C ATOM 1694 O SER A 106 -4.322 -8.448 11.121 1.00 0.00 O ATOM 1695 CB SER A 106 -1.519 -7.477 9.971 1.00 0.00 C ATOM 1696 OG SER A 106 -0.826 -8.104 8.906 1.00 0.00 O ATOM 0 H SER A 106 -2.249 -5.289 9.076 1.00 0.00 H new ATOM 0 HA SER A 106 -3.288 -7.911 8.837 1.00 0.00 H new ATOM 0 HB2 SER A 106 -1.019 -6.546 10.236 1.00 0.00 H new ATOM 0 HB3 SER A 106 -1.491 -8.116 10.853 1.00 0.00 H new ATOM 0 HG SER A 106 0.101 -8.275 9.175 1.00 0.00 H new ATOM 1702 N THR A 107 -4.148 -6.239 11.487 1.00 0.00 N ATOM 1703 CA THR A 107 -5.010 -6.270 12.659 1.00 0.00 C ATOM 1704 C THR A 107 -6.449 -5.990 12.262 1.00 0.00 C ATOM 1705 O THR A 107 -7.385 -6.467 12.906 1.00 0.00 O ATOM 1706 CB THR A 107 -4.539 -5.256 13.704 1.00 0.00 C ATOM 1707 OG1 THR A 107 -3.197 -5.511 14.079 1.00 0.00 O ATOM 1708 CG2 THR A 107 -5.377 -5.262 14.964 1.00 0.00 C ATOM 0 H THR A 107 -3.788 -5.315 11.248 1.00 0.00 H new ATOM 0 HA THR A 107 -4.956 -7.266 13.099 1.00 0.00 H new ATOM 0 HB THR A 107 -4.638 -4.281 13.227 1.00 0.00 H new ATOM 0 HG1 THR A 107 -2.913 -4.852 14.746 1.00 0.00 H new ATOM 0 HG21 THR A 107 -4.989 -4.520 15.662 1.00 0.00 H new ATOM 0 HG22 THR A 107 -6.410 -5.020 14.715 1.00 0.00 H new ATOM 0 HG23 THR A 107 -5.336 -6.250 15.424 1.00 0.00 H new ATOM 1716 N MET A 108 -6.625 -5.235 11.185 1.00 0.00 N ATOM 1717 CA MET A 108 -7.954 -4.924 10.698 1.00 0.00 C ATOM 1718 C MET A 108 -8.453 -6.048 9.801 1.00 0.00 C ATOM 1719 O MET A 108 -9.656 -6.206 9.599 1.00 0.00 O ATOM 1720 CB MET A 108 -7.949 -3.603 9.935 1.00 0.00 C ATOM 1721 CG MET A 108 -7.580 -2.406 10.798 1.00 0.00 C ATOM 1722 SD MET A 108 -6.379 -1.317 10.007 1.00 0.00 S ATOM 1723 CE MET A 108 -6.552 0.160 11.006 1.00 0.00 C ATOM 0 H MET A 108 -5.865 -4.830 10.637 1.00 0.00 H new ATOM 0 HA MET A 108 -8.625 -4.825 11.551 1.00 0.00 H new ATOM 0 HB2 MET A 108 -7.245 -3.674 9.106 1.00 0.00 H new ATOM 0 HB3 MET A 108 -8.936 -3.439 9.502 1.00 0.00 H new ATOM 0 HG2 MET A 108 -8.482 -1.838 11.028 1.00 0.00 H new ATOM 0 HG3 MET A 108 -7.174 -2.759 11.746 1.00 0.00 H new ATOM 0 HE1 MET A 108 -5.643 0.757 10.933 1.00 0.00 H new ATOM 0 HE2 MET A 108 -7.399 0.744 10.648 1.00 0.00 H new ATOM 0 HE3 MET A 108 -6.719 -0.121 12.046 1.00 0.00 H new ATOM 1733 N MET A 109 -7.522 -6.842 9.272 1.00 0.00 N ATOM 1734 CA MET A 109 -7.882 -7.956 8.411 1.00 0.00 C ATOM 1735 C MET A 109 -8.324 -9.159 9.239 1.00 0.00 C ATOM 1736 O MET A 109 -8.872 -10.117 8.701 1.00 0.00 O ATOM 1737 CB MET A 109 -6.707 -8.347 7.510 1.00 0.00 C ATOM 1738 CG MET A 109 -5.505 -8.877 8.269 1.00 0.00 C ATOM 1739 SD MET A 109 -5.604 -10.650 8.581 1.00 0.00 S ATOM 1740 CE MET A 109 -5.345 -11.299 6.931 1.00 0.00 C ATOM 0 H MET A 109 -6.520 -6.731 9.426 1.00 0.00 H new ATOM 0 HA MET A 109 -8.714 -7.638 7.783 1.00 0.00 H new ATOM 0 HB2 MET A 109 -7.041 -9.105 6.801 1.00 0.00 H new ATOM 0 HB3 MET A 109 -6.403 -7.478 6.927 1.00 0.00 H new ATOM 0 HG2 MET A 109 -4.599 -8.662 7.702 1.00 0.00 H new ATOM 0 HG3 MET A 109 -5.419 -8.350 9.219 1.00 0.00 H new ATOM 0 HE1 MET A 109 -5.010 -12.334 6.996 1.00 0.00 H new ATOM 0 HE2 MET A 109 -6.280 -11.255 6.372 1.00 0.00 H new ATOM 0 HE3 MET A 109 -4.588 -10.704 6.421 1.00 0.00 H new ATOM 1750 N SER A 110 -8.087 -9.111 10.550 1.00 0.00 N ATOM 1751 CA SER A 110 -8.479 -10.209 11.427 1.00 0.00 C ATOM 1752 C SER A 110 -9.807 -9.905 12.112 1.00 0.00 C ATOM 1753 O SER A 110 -10.529 -10.816 12.515 1.00 0.00 O ATOM 1754 CB SER A 110 -7.395 -10.475 12.472 1.00 0.00 C ATOM 1755 OG SER A 110 -7.502 -9.572 13.559 1.00 0.00 O ATOM 0 H SER A 110 -7.630 -8.331 11.022 1.00 0.00 H new ATOM 0 HA SER A 110 -8.602 -11.103 10.816 1.00 0.00 H new ATOM 0 HB2 SER A 110 -7.480 -11.499 12.836 1.00 0.00 H new ATOM 0 HB3 SER A 110 -6.411 -10.381 12.012 1.00 0.00 H new ATOM 0 HG SER A 110 -7.450 -8.652 13.226 1.00 0.00 H new ATOM 1761 N VAL A 111 -10.129 -8.622 12.230 1.00 0.00 N ATOM 1762 CA VAL A 111 -11.376 -8.208 12.856 1.00 0.00 C ATOM 1763 C VAL A 111 -12.553 -8.376 11.896 1.00 0.00 C ATOM 1764 O VAL A 111 -13.712 -8.317 12.309 1.00 0.00 O ATOM 1765 CB VAL A 111 -11.313 -6.742 13.331 1.00 0.00 C ATOM 1766 CG1 VAL A 111 -11.173 -5.795 12.150 1.00 0.00 C ATOM 1767 CG2 VAL A 111 -12.541 -6.396 14.158 1.00 0.00 C ATOM 0 H VAL A 111 -9.545 -7.853 11.901 1.00 0.00 H new ATOM 0 HA VAL A 111 -11.523 -8.851 13.724 1.00 0.00 H new ATOM 0 HB VAL A 111 -10.431 -6.625 13.961 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -11.131 -4.767 12.511 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -10.258 -6.026 11.605 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -12.030 -5.912 11.487 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -12.479 -5.358 14.484 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -13.437 -6.533 13.553 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -12.588 -7.048 15.030 1.00 0.00 H new ATOM 1777 N HIS A 112 -12.254 -8.586 10.614 1.00 0.00 N ATOM 1778 CA HIS A 112 -13.285 -8.761 9.611 1.00 0.00 C ATOM 1779 C HIS A 112 -13.864 -10.173 9.667 1.00 0.00 C ATOM 1780 O HIS A 112 -15.012 -10.399 9.286 1.00 0.00 O ATOM 1781 CB HIS A 112 -12.708 -8.476 8.225 1.00 0.00 C ATOM 1782 CG HIS A 112 -12.061 -9.658 7.578 1.00 0.00 C ATOM 1783 ND1 HIS A 112 -11.225 -10.528 8.242 1.00 0.00 N ATOM 1784 CD2 HIS A 112 -12.143 -10.112 6.314 1.00 0.00 C ATOM 1785 CE1 HIS A 112 -10.822 -11.470 7.407 1.00 0.00 C ATOM 1786 NE2 HIS A 112 -11.366 -11.239 6.229 1.00 0.00 N ATOM 0 H HIS A 112 -11.302 -8.638 10.253 1.00 0.00 H new ATOM 0 HA HIS A 112 -14.093 -8.058 9.814 1.00 0.00 H new ATOM 0 HB2 HIS A 112 -13.507 -8.113 7.578 1.00 0.00 H new ATOM 0 HB3 HIS A 112 -11.975 -7.673 8.306 1.00 0.00 H new ATOM 0 HD2 HIS A 112 -12.716 -9.670 5.513 1.00 0.00 H new ATOM 0 HE1 HIS A 112 -10.160 -12.289 7.649 1.00 0.00 H new ATOM 0 HE2 HIS A 112 -11.231 -11.805 5.392 1.00 0.00 H new ATOM 1795 N ARG A 113 -13.057 -11.122 10.140 1.00 0.00 N ATOM 1796 CA ARG A 113 -13.493 -12.508 10.237 1.00 0.00 C ATOM 1797 C ARG A 113 -14.577 -12.666 11.297 1.00 0.00 C ATOM 1798 O ARG A 113 -15.480 -13.492 11.160 1.00 0.00 O ATOM 1799 CB ARG A 113 -12.307 -13.418 10.562 1.00 0.00 C ATOM 1800 CG ARG A 113 -12.362 -14.765 9.861 1.00 0.00 C ATOM 1801 CD ARG A 113 -10.982 -15.221 9.419 1.00 0.00 C ATOM 1802 NE ARG A 113 -11.044 -16.388 8.542 1.00 0.00 N ATOM 1803 CZ ARG A 113 -11.492 -16.351 7.289 1.00 0.00 C ATOM 1804 NH1 ARG A 113 -11.916 -15.208 6.761 1.00 0.00 N ATOM 1805 NH2 ARG A 113 -11.516 -17.458 6.560 1.00 0.00 N ATOM 0 H ARG A 113 -12.103 -10.954 10.460 1.00 0.00 H new ATOM 0 HA ARG A 113 -13.910 -12.798 9.273 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -11.384 -12.910 10.283 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -12.269 -13.580 11.639 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -12.794 -15.508 10.532 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -13.019 -14.698 8.994 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -10.480 -14.404 8.900 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -10.381 -15.459 10.297 1.00 0.00 H new ATOM 0 HE ARG A 113 -10.725 -17.284 8.912 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -11.899 -14.353 7.316 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -12.258 -15.186 5.800 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -11.191 -18.339 6.959 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -11.859 -17.429 5.600 1.00 0.00 H new ATOM 1819 N GLY A 114 -14.482 -11.867 12.356 1.00 0.00 N ATOM 1820 CA GLY A 114 -15.460 -11.934 13.425 1.00 0.00 C ATOM 1821 C GLY A 114 -16.551 -10.892 13.279 1.00 0.00 C ATOM 1822 O GLY A 114 -17.137 -10.453 14.269 1.00 0.00 O ATOM 0 H GLY A 114 -13.745 -11.175 12.492 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -15.910 -12.927 13.440 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -14.957 -11.797 14.382 1.00 0.00 H new ATOM 1826 N GLU A 115 -16.825 -10.493 12.041 1.00 0.00 N ATOM 1827 CA GLU A 115 -17.855 -9.496 11.769 1.00 0.00 C ATOM 1828 C GLU A 115 -19.062 -10.132 11.089 1.00 0.00 C ATOM 1829 O GLU A 115 -20.203 -9.742 11.336 1.00 0.00 O ATOM 1830 CB GLU A 115 -17.290 -8.378 10.890 1.00 0.00 C ATOM 1831 CG GLU A 115 -16.702 -7.221 11.682 1.00 0.00 C ATOM 1832 CD GLU A 115 -17.060 -5.870 11.094 1.00 0.00 C ATOM 1833 OE1 GLU A 115 -18.266 -5.606 10.905 1.00 0.00 O ATOM 1834 OE2 GLU A 115 -16.134 -5.076 10.822 1.00 0.00 O ATOM 0 H GLU A 115 -16.348 -10.844 11.210 1.00 0.00 H new ATOM 0 HA GLU A 115 -18.178 -9.074 12.721 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -16.519 -8.792 10.241 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -18.082 -8.000 10.243 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -17.059 -7.271 12.711 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -15.617 -7.323 11.715 1.00 0.00 H new ATOM 1841 N VAL A 116 -18.802 -11.114 10.231 1.00 0.00 N ATOM 1842 CA VAL A 116 -19.868 -11.805 9.515 1.00 0.00 C ATOM 1843 C VAL A 116 -20.671 -12.715 10.445 1.00 0.00 C ATOM 1844 O VAL A 116 -21.901 -12.680 10.442 1.00 0.00 O ATOM 1845 CB VAL A 116 -19.316 -12.641 8.342 1.00 0.00 C ATOM 1846 CG1 VAL A 116 -20.450 -13.116 7.447 1.00 0.00 C ATOM 1847 CG2 VAL A 116 -18.299 -11.838 7.545 1.00 0.00 C ATOM 0 H VAL A 116 -17.863 -11.449 10.015 1.00 0.00 H new ATOM 0 HA VAL A 116 -20.526 -11.031 9.120 1.00 0.00 H new ATOM 0 HB VAL A 116 -18.812 -13.518 8.749 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -20.043 -13.704 6.625 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -21.138 -13.731 8.027 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -20.983 -12.254 7.047 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -17.921 -12.444 6.722 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -18.775 -10.942 7.147 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -17.472 -11.552 8.195 1.00 0.00 H new ATOM 1857 N PRO A 117 -19.990 -13.545 11.258 1.00 0.00 N ATOM 1858 CA PRO A 117 -20.662 -14.458 12.186 1.00 0.00 C ATOM 1859 C PRO A 117 -21.166 -13.746 13.437 1.00 0.00 C ATOM 1860 O PRO A 117 -20.382 -13.181 14.200 1.00 0.00 O ATOM 1861 CB PRO A 117 -19.563 -15.456 12.543 1.00 0.00 C ATOM 1862 CG PRO A 117 -18.299 -14.676 12.434 1.00 0.00 C ATOM 1863 CD PRO A 117 -18.519 -13.664 11.339 1.00 0.00 C ATOM 0 HA PRO A 117 -21.549 -14.914 11.746 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -19.699 -15.852 13.549 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -19.564 -16.307 11.862 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -18.064 -14.183 13.377 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -17.459 -15.329 12.197 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -18.053 -12.708 11.578 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -18.092 -13.999 10.394 1.00 0.00 H new ATOM 1871 N CYS A 118 -22.478 -13.777 13.641 1.00 0.00 N ATOM 1872 CA CYS A 118 -23.087 -13.135 14.800 1.00 0.00 C ATOM 1873 C CYS A 118 -24.194 -14.005 15.385 1.00 0.00 C ATOM 1874 O CYS A 118 -24.215 -14.276 16.587 1.00 0.00 O ATOM 1875 CB CYS A 118 -23.650 -11.766 14.414 1.00 0.00 C ATOM 1876 SG CYS A 118 -23.677 -10.570 15.770 1.00 0.00 S ATOM 0 H CYS A 118 -23.141 -14.240 13.019 1.00 0.00 H new ATOM 0 HA CYS A 118 -22.315 -13.003 15.558 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -23.056 -11.358 13.596 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -24.665 -11.895 14.038 1.00 0.00 H new ATOM 0 HG CYS A 118 -24.167 -9.443 15.345 1.00 0.00 H new ATOM 1882 N THR A 119 -25.113 -14.442 14.530 1.00 0.00 N ATOM 1883 CA THR A 119 -26.223 -15.281 14.962 1.00 0.00 C ATOM 1884 C THR A 119 -25.976 -16.741 14.596 1.00 0.00 C ATOM 1885 O THR A 119 -26.051 -17.119 13.427 1.00 0.00 O ATOM 1886 CB THR A 119 -27.530 -14.800 14.332 1.00 0.00 C ATOM 1887 OG1 THR A 119 -27.330 -14.441 12.975 1.00 0.00 O ATOM 1888 CG2 THR A 119 -28.131 -13.605 15.039 1.00 0.00 C ATOM 0 H THR A 119 -25.110 -14.228 13.533 1.00 0.00 H new ATOM 0 HA THR A 119 -26.302 -15.205 16.046 1.00 0.00 H new ATOM 0 HB THR A 119 -28.220 -15.639 14.421 1.00 0.00 H new ATOM 0 HG1 THR A 119 -26.826 -15.148 12.520 1.00 0.00 H new ATOM 0 HG21 THR A 119 -29.056 -13.315 14.541 1.00 0.00 H new ATOM 0 HG22 THR A 119 -28.343 -13.865 16.076 1.00 0.00 H new ATOM 0 HG23 THR A 119 -27.427 -12.773 15.010 1.00 0.00 H new ATOM 1896 N VAL A 120 -25.680 -17.557 15.602 1.00 0.00 N ATOM 1897 CA VAL A 120 -25.422 -18.975 15.386 1.00 0.00 C ATOM 1898 C VAL A 120 -26.706 -19.720 15.037 1.00 0.00 C ATOM 1899 O VAL A 120 -26.653 -20.611 14.162 1.00 0.00 O ATOM 1900 CB VAL A 120 -24.787 -19.627 16.629 1.00 0.00 C ATOM 1901 CG1 VAL A 120 -24.342 -21.048 16.319 1.00 0.00 C ATOM 1902 CG2 VAL A 120 -23.618 -18.792 17.131 1.00 0.00 C ATOM 1903 OXT VAL A 120 -27.753 -19.408 15.640 1.00 0.00 O ATOM 0 H VAL A 120 -25.613 -17.260 16.575 1.00 0.00 H new ATOM 0 HA VAL A 120 -24.725 -19.045 14.551 1.00 0.00 H new ATOM 0 HB VAL A 120 -25.538 -19.671 17.418 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -23.896 -21.492 17.209 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -25.204 -21.640 16.011 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -23.607 -21.032 15.514 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -23.182 -19.268 18.009 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -22.864 -18.714 16.348 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -23.970 -17.795 17.396 1.00 0.00 H new TER 1913 VAL A 120