USER MOD reduce.3.24.130724 H: found=0, std=0, add=1137, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1140 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 NoAdj-H: A 18 HIS HE2 : A 18 HIS NE2 : A 96 ZNZN :(H bumps) USER MOD NoAdj-H: A 49 HIS HE2 : A 49 HIS NE2 : A 97 ZNZN :(H bumps) USER MOD NoAdj-H: A 73 HIS HE2 : A 73 HIS NE2 : A 98 ZNZN :(H bumps) USER MOD Set 1.1: A 90 ASN : amide:sc= 0.748 K(o=1.6,f=-3.9) USER MOD Set 1.2: A 94 LYS NZ :NH3+ -173:sc= 0.85 (180deg=0) USER MOD Set 2.1: A 75 LYS NZ :NH3+ 145:sc= 1.19 (180deg=0) USER MOD Set 2.2: B 147 GLN : amide:sc= 2.12 K(o=3.3,f=-7.7!) USER MOD Set 3.1: A 11 GLN : amide:sc= 0.613 K(o=0.69,f=-1.8) USER MOD Set 3.2: A 12 GLN : amide:sc= 0.298 K(o=0.69,f=-1.8) USER MOD Set 3.3: A 39 HIS : no HD1:sc= -0.0243 K(o=0.69,f=-0.065) USER MOD Set 3.4: A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.5: B 110 MET CE :methyl 167:sc= -0.202 (180deg=-0.284) USER MOD Single : A 1 ALA N :NH3+ -112:sc= 0.0797 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 177:sc= 1.28 (180deg=1.28) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=-0.03) USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 21 LYS NZ :NH3+ 168:sc= 1.1 (180deg=0.954) USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 29 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 149:sc= 3.22 (180deg=0.686) USER MOD Single : A 45 ASN : amide:sc= 0.994 K(o=0.99,f=0) USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 MET CE :methyl -173:sc= -0.753 (180deg=-0.812) USER MOD Single : A 51 THR OG1 : rot 36:sc= 0.352 USER MOD Single : A 52 HIS : no HE2:sc= 1.04 K(o=1,f=-3.1!) USER MOD Single : A 54 GLN : amide:sc= 0.907 K(o=0.91,f=0) USER MOD Single : A 57 LYS NZ :NH3+ -162:sc= 1.19 (180deg=1.1) USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 HIS : no HD1:sc= -0.0924 X(o=-0.092,f=-0.092) USER MOD Single : A 66 SER OG : rot 79:sc= 0.968 USER MOD Single : A 67 SER OG : rot -79:sc= 1.23 USER MOD Single : A 69 GLN : amide:sc= -0.491 K(o=-0.49,f=-1.3) USER MOD Single : A 72 SER OG : rot 68:sc= 2.1 USER MOD Single : A 76 ASN : amide:sc= 1.05 K(o=1.1,f=0) USER MOD Single : A 78 THR OG1 : rot -44:sc= 0.0766 USER MOD Single : A 80 HIS : no HE2:sc= 1.22 K(o=1.2,f=-3.8!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : B 99 SER OG : rot -31:sc= 0.29 USER MOD Single : B 103 CYS SG : rot 81:sc= 0.535 USER MOD Single : B 108 GLN : amide:sc= 0.542 K(o=0.54,f=0) USER MOD Single : B 109 SER OG : rot -154:sc= 0.394 USER MOD Single : B 113 SER OG : rot 180:sc= 0 USER MOD Single : B 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 119 THR OG1 : rot 180:sc= 0.0864 USER MOD Single : B 120 SER OG : rot 180:sc= 0 USER MOD Single : B 121 TYR OH : rot 180:sc= 0 USER MOD Single : B 123 CYS SG : rot 180:sc= 0 USER MOD Single : B 126 ASN : amide:sc= 1.88 K(o=1.9,f=-4.1!) USER MOD Single : B 130 GLN : amide:sc= 0.0243 K(o=0.024,f=-2.8!) USER MOD Single : B 132 SER OG : rot 180:sc= 0 USER MOD Single : B 134 ASN : amide:sc= 0.232 K(o=0.23,f=-2.3!) USER MOD Single : B 137 GLN : amide:sc= 0.952 K(o=0.95,f=0) USER MOD Single : B 149 ASN : amide:sc= 1.15 K(o=1.2,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 6.300 -12.158 15.905 1.00 0.00 N ATOM 2 CA ALA A 1 5.537 -10.922 15.603 1.00 0.00 C ATOM 3 C ALA A 1 5.554 -9.965 16.803 1.00 0.00 C ATOM 4 O ALA A 1 5.774 -10.389 17.940 1.00 0.00 O ATOM 5 CB ALA A 1 4.102 -11.248 15.154 1.00 0.00 C ATOM 0 H1 ALA A 1 7.159 -12.187 15.320 1.00 0.00 H new ATOM 0 H2 ALA A 1 6.566 -12.165 16.910 1.00 0.00 H new ATOM 0 H3 ALA A 1 5.711 -12.989 15.697 1.00 0.00 H new ATOM 0 HA ALA A 1 6.026 -10.416 14.771 1.00 0.00 H new ATOM 0 HB1 ALA A 1 3.568 -10.322 14.940 1.00 0.00 H new ATOM 0 HB2 ALA A 1 4.133 -11.865 14.256 1.00 0.00 H new ATOM 0 HB3 ALA A 1 3.586 -11.789 15.948 1.00 0.00 H new ATOM 13 N ASP A 2 5.333 -8.669 16.564 1.00 0.00 N ATOM 14 CA ASP A 2 5.336 -7.598 17.569 1.00 0.00 C ATOM 15 C ASP A 2 4.245 -6.543 17.260 1.00 0.00 C ATOM 16 O ASP A 2 4.076 -6.165 16.095 1.00 0.00 O ATOM 17 CB ASP A 2 6.738 -6.966 17.586 1.00 0.00 C ATOM 18 CG ASP A 2 6.895 -5.934 18.709 1.00 0.00 C ATOM 19 OD1 ASP A 2 6.451 -4.780 18.519 1.00 0.00 O ATOM 20 OD2 ASP A 2 7.447 -6.282 19.780 1.00 0.00 O ATOM 0 H ASP A 2 5.139 -8.321 15.625 1.00 0.00 H new ATOM 0 HA ASP A 2 5.105 -8.007 18.553 1.00 0.00 H new ATOM 0 HB2 ASP A 2 7.486 -7.749 17.708 1.00 0.00 H new ATOM 0 HB3 ASP A 2 6.931 -6.488 16.626 1.00 0.00 H new ATOM 25 N PRO A 3 3.490 -6.047 18.262 1.00 0.00 N ATOM 26 CA PRO A 3 2.428 -5.063 18.045 1.00 0.00 C ATOM 27 C PRO A 3 2.929 -3.745 17.439 1.00 0.00 C ATOM 28 O PRO A 3 2.259 -3.179 16.577 1.00 0.00 O ATOM 29 CB PRO A 3 1.748 -4.865 19.404 1.00 0.00 C ATOM 30 CG PRO A 3 2.820 -5.278 20.411 1.00 0.00 C ATOM 31 CD PRO A 3 3.569 -6.388 19.676 1.00 0.00 C ATOM 0 HA PRO A 3 1.721 -5.430 17.301 1.00 0.00 H new ATOM 0 HB2 PRO A 3 1.440 -3.830 19.550 1.00 0.00 H new ATOM 0 HB3 PRO A 3 0.853 -5.480 19.497 1.00 0.00 H new ATOM 0 HG2 PRO A 3 3.477 -4.447 20.665 1.00 0.00 H new ATOM 0 HG3 PRO A 3 2.382 -5.635 21.343 1.00 0.00 H new ATOM 0 HD2 PRO A 3 4.606 -6.447 20.007 1.00 0.00 H new ATOM 0 HD3 PRO A 3 3.117 -7.361 19.870 1.00 0.00 H new ATOM 39 N GLU A 4 4.101 -3.241 17.832 1.00 0.00 N ATOM 40 CA GLU A 4 4.657 -2.004 17.270 1.00 0.00 C ATOM 41 C GLU A 4 5.094 -2.198 15.805 1.00 0.00 C ATOM 42 O GLU A 4 4.905 -1.302 14.982 1.00 0.00 O ATOM 43 CB GLU A 4 5.767 -1.405 18.142 1.00 0.00 C ATOM 44 CG GLU A 4 5.379 -1.309 19.627 1.00 0.00 C ATOM 45 CD GLU A 4 6.422 -0.523 20.448 1.00 0.00 C ATOM 46 OE1 GLU A 4 7.580 -0.990 20.592 1.00 0.00 O ATOM 47 OE2 GLU A 4 6.081 0.553 20.999 1.00 0.00 O ATOM 0 H GLU A 4 4.689 -3.674 18.544 1.00 0.00 H new ATOM 0 HA GLU A 4 3.854 -1.266 17.269 1.00 0.00 H new ATOM 0 HB2 GLU A 4 6.666 -2.014 18.046 1.00 0.00 H new ATOM 0 HB3 GLU A 4 6.015 -0.410 17.772 1.00 0.00 H new ATOM 0 HG2 GLU A 4 4.407 -0.824 19.717 1.00 0.00 H new ATOM 0 HG3 GLU A 4 5.274 -2.312 20.040 1.00 0.00 H new ATOM 54 N LYS A 5 5.593 -3.389 15.427 1.00 0.00 N ATOM 55 CA LYS A 5 5.853 -3.713 14.009 1.00 0.00 C ATOM 56 C LYS A 5 4.537 -3.674 13.226 1.00 0.00 C ATOM 57 O LYS A 5 4.501 -3.109 12.135 1.00 0.00 O ATOM 58 CB LYS A 5 6.581 -5.051 13.823 1.00 0.00 C ATOM 59 CG LYS A 5 8.053 -4.965 14.248 1.00 0.00 C ATOM 60 CD LYS A 5 8.765 -6.303 14.001 1.00 0.00 C ATOM 61 CE LYS A 5 10.238 -6.268 14.434 1.00 0.00 C ATOM 62 NZ LYS A 5 11.079 -5.460 13.513 1.00 0.00 N ATOM 0 H LYS A 5 5.824 -4.140 16.078 1.00 0.00 H new ATOM 0 HA LYS A 5 6.530 -2.956 13.614 1.00 0.00 H new ATOM 0 HB2 LYS A 5 6.079 -5.822 14.407 1.00 0.00 H new ATOM 0 HB3 LYS A 5 6.522 -5.354 12.778 1.00 0.00 H new ATOM 0 HG2 LYS A 5 8.553 -4.173 13.691 1.00 0.00 H new ATOM 0 HG3 LYS A 5 8.118 -4.702 15.304 1.00 0.00 H new ATOM 0 HD2 LYS A 5 8.247 -7.093 14.545 1.00 0.00 H new ATOM 0 HD3 LYS A 5 8.706 -6.553 12.942 1.00 0.00 H new ATOM 0 HE2 LYS A 5 10.308 -5.857 15.441 1.00 0.00 H new ATOM 0 HE3 LYS A 5 10.626 -7.286 14.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 12.054 -5.424 13.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 11.076 -5.895 12.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 10.697 -4.495 13.451 1.00 0.00 H new ATOM 76 N ARG A 6 3.436 -4.200 13.782 1.00 0.00 N ATOM 77 CA ARG A 6 2.090 -4.091 13.183 1.00 0.00 C ATOM 78 C ARG A 6 1.690 -2.617 13.001 1.00 0.00 C ATOM 79 O ARG A 6 1.274 -2.263 11.902 1.00 0.00 O ATOM 80 CB ARG A 6 1.052 -4.929 13.948 1.00 0.00 C ATOM 81 CG ARG A 6 1.284 -6.428 13.697 1.00 0.00 C ATOM 82 CD ARG A 6 0.304 -7.293 14.495 1.00 0.00 C ATOM 83 NE ARG A 6 0.415 -8.707 14.096 1.00 0.00 N ATOM 84 CZ ARG A 6 0.093 -9.784 14.786 1.00 0.00 C ATOM 85 NH1 ARG A 6 -0.384 -9.732 15.997 1.00 0.00 N ATOM 86 NH2 ARG A 6 0.253 -10.956 14.245 1.00 0.00 N ATOM 0 H ARG A 6 3.450 -4.715 14.662 1.00 0.00 H new ATOM 0 HA ARG A 6 2.120 -4.524 12.183 1.00 0.00 H new ATOM 0 HB2 ARG A 6 1.120 -4.718 15.015 1.00 0.00 H new ATOM 0 HB3 ARG A 6 0.047 -4.652 13.631 1.00 0.00 H new ATOM 0 HG2 ARG A 6 1.174 -6.640 12.634 1.00 0.00 H new ATOM 0 HG3 ARG A 6 2.306 -6.689 13.971 1.00 0.00 H new ATOM 0 HD2 ARG A 6 0.508 -7.194 15.561 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -0.715 -6.942 14.331 1.00 0.00 H new ATOM 0 HE ARG A 6 0.791 -8.875 13.163 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -0.523 -8.830 16.452 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -0.618 -10.594 16.490 1.00 0.00 H new ATOM 0 HH21 ARG A 6 0.624 -11.034 13.298 1.00 0.00 H new ATOM 0 HH22 ARG A 6 0.008 -11.797 14.768 1.00 0.00 H new ATOM 100 N LYS A 7 1.885 -1.743 14.003 1.00 0.00 N ATOM 101 CA LYS A 7 1.679 -0.272 13.892 1.00 0.00 C ATOM 102 C LYS A 7 2.434 0.303 12.683 1.00 0.00 C ATOM 103 O LYS A 7 1.855 1.020 11.866 1.00 0.00 O ATOM 104 CB LYS A 7 2.114 0.464 15.178 1.00 0.00 C ATOM 105 CG LYS A 7 1.009 0.744 16.202 1.00 0.00 C ATOM 106 CD LYS A 7 0.423 -0.518 16.844 1.00 0.00 C ATOM 107 CE LYS A 7 -0.605 -0.121 17.905 1.00 0.00 C ATOM 108 NZ LYS A 7 -1.260 -1.313 18.505 1.00 0.00 N ATOM 0 H LYS A 7 2.195 -2.034 14.930 1.00 0.00 H new ATOM 0 HA LYS A 7 0.610 -0.111 13.750 1.00 0.00 H new ATOM 0 HB2 LYS A 7 2.891 -0.126 15.665 1.00 0.00 H new ATOM 0 HB3 LYS A 7 2.566 1.414 14.893 1.00 0.00 H new ATOM 0 HG2 LYS A 7 1.409 1.387 16.986 1.00 0.00 H new ATOM 0 HG3 LYS A 7 0.207 1.298 15.714 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -0.046 -1.141 16.083 1.00 0.00 H new ATOM 0 HD3 LYS A 7 1.218 -1.111 17.296 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -0.116 0.459 18.688 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -1.361 0.523 17.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -1.951 -1.007 19.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -1.748 -1.852 17.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -0.541 -1.915 18.954 1.00 0.00 H new ATOM 122 N LEU A 8 3.725 -0.018 12.559 1.00 0.00 N ATOM 123 CA LEU A 8 4.582 0.392 11.441 1.00 0.00 C ATOM 124 C LEU A 8 4.030 -0.102 10.089 1.00 0.00 C ATOM 125 O LEU A 8 3.938 0.683 9.145 1.00 0.00 O ATOM 126 CB LEU A 8 6.024 -0.087 11.686 1.00 0.00 C ATOM 127 CG LEU A 8 6.763 0.635 12.830 1.00 0.00 C ATOM 128 CD1 LEU A 8 8.099 -0.064 13.085 1.00 0.00 C ATOM 129 CD2 LEU A 8 7.034 2.106 12.500 1.00 0.00 C ATOM 0 H LEU A 8 4.216 -0.585 13.250 1.00 0.00 H new ATOM 0 HA LEU A 8 4.588 1.481 11.388 1.00 0.00 H new ATOM 0 HB2 LEU A 8 6.005 -1.155 11.903 1.00 0.00 H new ATOM 0 HB3 LEU A 8 6.595 0.041 10.766 1.00 0.00 H new ATOM 0 HG LEU A 8 6.125 0.596 13.713 1.00 0.00 H new ATOM 0 HD11 LEU A 8 8.626 0.443 13.893 1.00 0.00 H new ATOM 0 HD12 LEU A 8 7.919 -1.102 13.364 1.00 0.00 H new ATOM 0 HD13 LEU A 8 8.705 -0.031 12.180 1.00 0.00 H new ATOM 0 HD21 LEU A 8 7.556 2.576 13.334 1.00 0.00 H new ATOM 0 HD22 LEU A 8 7.650 2.170 11.603 1.00 0.00 H new ATOM 0 HD23 LEU A 8 6.089 2.620 12.328 1.00 0.00 H new ATOM 141 N ILE A 9 3.643 -1.376 9.990 1.00 0.00 N ATOM 142 CA ILE A 9 3.035 -1.993 8.798 1.00 0.00 C ATOM 143 C ILE A 9 1.729 -1.272 8.417 1.00 0.00 C ATOM 144 O ILE A 9 1.548 -0.931 7.248 1.00 0.00 O ATOM 145 CB ILE A 9 2.855 -3.517 9.007 1.00 0.00 C ATOM 146 CG1 ILE A 9 4.243 -4.197 9.042 1.00 0.00 C ATOM 147 CG2 ILE A 9 2.003 -4.156 7.894 1.00 0.00 C ATOM 148 CD1 ILE A 9 4.233 -5.604 9.649 1.00 0.00 C ATOM 0 H ILE A 9 3.746 -2.034 10.763 1.00 0.00 H new ATOM 0 HA ILE A 9 3.708 -1.875 7.949 1.00 0.00 H new ATOM 0 HB ILE A 9 2.333 -3.664 9.953 1.00 0.00 H new ATOM 0 HG12 ILE A 9 4.634 -4.254 8.026 1.00 0.00 H new ATOM 0 HG13 ILE A 9 4.929 -3.571 9.613 1.00 0.00 H new ATOM 0 HG21 ILE A 9 1.903 -5.225 8.081 1.00 0.00 H new ATOM 0 HG22 ILE A 9 1.015 -3.696 7.882 1.00 0.00 H new ATOM 0 HG23 ILE A 9 2.487 -4.000 6.930 1.00 0.00 H new ATOM 0 HD11 ILE A 9 5.243 -6.013 9.637 1.00 0.00 H new ATOM 0 HD12 ILE A 9 3.874 -5.554 10.677 1.00 0.00 H new ATOM 0 HD13 ILE A 9 3.575 -6.247 9.065 1.00 0.00 H new ATOM 160 N GLN A 10 0.837 -1.002 9.381 1.00 0.00 N ATOM 161 CA GLN A 10 -0.416 -0.258 9.184 1.00 0.00 C ATOM 162 C GLN A 10 -0.156 1.074 8.464 1.00 0.00 C ATOM 163 O GLN A 10 -0.758 1.327 7.417 1.00 0.00 O ATOM 164 CB GLN A 10 -1.144 -0.016 10.522 1.00 0.00 C ATOM 165 CG GLN A 10 -1.810 -1.270 11.099 1.00 0.00 C ATOM 166 CD GLN A 10 -2.372 -1.027 12.498 1.00 0.00 C ATOM 167 OE1 GLN A 10 -1.750 -1.317 13.512 1.00 0.00 O ATOM 168 NE2 GLN A 10 -3.571 -0.495 12.612 1.00 0.00 N ATOM 0 H GLN A 10 0.971 -1.303 10.346 1.00 0.00 H new ATOM 0 HA GLN A 10 -1.064 -0.869 8.556 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -0.430 0.372 11.249 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -1.902 0.754 10.378 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -2.614 -1.591 10.436 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -1.084 -2.082 11.136 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -4.101 -0.248 11.776 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -3.970 -0.330 13.536 1.00 0.00 H new ATOM 177 N GLN A 11 0.742 1.921 8.992 1.00 0.00 N ATOM 178 CA GLN A 11 1.063 3.191 8.329 1.00 0.00 C ATOM 179 C GLN A 11 1.697 2.981 6.943 1.00 0.00 C ATOM 180 O GLN A 11 1.269 3.653 6.011 1.00 0.00 O ATOM 181 CB GLN A 11 1.767 4.207 9.245 1.00 0.00 C ATOM 182 CG GLN A 11 3.209 3.932 9.692 1.00 0.00 C ATOM 183 CD GLN A 11 4.244 4.142 8.589 1.00 0.00 C ATOM 184 OE1 GLN A 11 4.260 5.143 7.891 1.00 0.00 O ATOM 185 NE2 GLN A 11 5.135 3.206 8.377 1.00 0.00 N ATOM 0 H GLN A 11 1.250 1.753 9.860 1.00 0.00 H new ATOM 0 HA GLN A 11 0.116 3.687 8.116 1.00 0.00 H new ATOM 0 HB2 GLN A 11 1.759 5.170 8.735 1.00 0.00 H new ATOM 0 HB3 GLN A 11 1.159 4.316 10.143 1.00 0.00 H new ATOM 0 HG2 GLN A 11 3.450 4.583 10.533 1.00 0.00 H new ATOM 0 HG3 GLN A 11 3.279 2.906 10.053 1.00 0.00 H new ATOM 0 HE21 GLN A 11 5.136 2.363 8.951 1.00 0.00 H new ATOM 0 HE22 GLN A 11 5.828 3.320 7.638 1.00 0.00 H new ATOM 194 N GLN A 12 2.635 2.036 6.750 1.00 0.00 N ATOM 195 CA GLN A 12 3.203 1.731 5.419 1.00 0.00 C ATOM 196 C GLN A 12 2.098 1.440 4.391 1.00 0.00 C ATOM 197 O GLN A 12 2.131 1.983 3.287 1.00 0.00 O ATOM 198 CB GLN A 12 4.176 0.535 5.450 1.00 0.00 C ATOM 199 CG GLN A 12 5.581 0.834 5.986 1.00 0.00 C ATOM 200 CD GLN A 12 6.255 2.011 5.288 1.00 0.00 C ATOM 201 OE1 GLN A 12 6.582 3.020 5.894 1.00 0.00 O ATOM 202 NE2 GLN A 12 6.487 1.936 3.994 1.00 0.00 N ATOM 0 H GLN A 12 3.019 1.466 7.503 1.00 0.00 H new ATOM 0 HA GLN A 12 3.757 2.622 5.124 1.00 0.00 H new ATOM 0 HB2 GLN A 12 3.735 -0.253 6.060 1.00 0.00 H new ATOM 0 HB3 GLN A 12 4.270 0.140 4.438 1.00 0.00 H new ATOM 0 HG2 GLN A 12 5.518 1.041 7.054 1.00 0.00 H new ATOM 0 HG3 GLN A 12 6.203 -0.053 5.870 1.00 0.00 H new ATOM 0 HE21 GLN A 12 6.219 1.099 3.476 1.00 0.00 H new ATOM 0 HE22 GLN A 12 6.935 2.714 3.510 1.00 0.00 H new ATOM 211 N LEU A 13 1.123 0.597 4.750 1.00 0.00 N ATOM 212 CA LEU A 13 -0.029 0.217 3.937 1.00 0.00 C ATOM 213 C LEU A 13 -0.793 1.483 3.505 1.00 0.00 C ATOM 214 O LEU A 13 -0.920 1.759 2.313 1.00 0.00 O ATOM 215 CB LEU A 13 -0.861 -0.818 4.732 1.00 0.00 C ATOM 216 CG LEU A 13 -1.605 -1.828 3.841 1.00 0.00 C ATOM 217 CD1 LEU A 13 -1.952 -3.099 4.615 1.00 0.00 C ATOM 218 CD2 LEU A 13 -2.897 -1.284 3.246 1.00 0.00 C ATOM 0 H LEU A 13 1.120 0.141 5.662 1.00 0.00 H new ATOM 0 HA LEU A 13 0.259 -0.270 3.006 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.200 -1.361 5.408 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.586 -0.290 5.351 1.00 0.00 H new ATOM 0 HG LEU A 13 -0.912 -2.041 3.027 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -2.477 -3.793 3.958 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.036 -3.565 4.978 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -2.591 -2.847 5.461 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -3.366 -2.052 2.630 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -3.576 -0.999 4.050 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -2.675 -0.411 2.632 1.00 0.00 H new ATOM 230 N VAL A 14 -1.245 2.286 4.471 1.00 0.00 N ATOM 231 CA VAL A 14 -1.940 3.567 4.247 1.00 0.00 C ATOM 232 C VAL A 14 -1.116 4.535 3.376 1.00 0.00 C ATOM 233 O VAL A 14 -1.654 5.074 2.407 1.00 0.00 O ATOM 234 CB VAL A 14 -2.350 4.190 5.594 1.00 0.00 C ATOM 235 CG1 VAL A 14 -2.975 5.580 5.440 1.00 0.00 C ATOM 236 CG2 VAL A 14 -3.386 3.312 6.314 1.00 0.00 C ATOM 0 H VAL A 14 -1.137 2.062 5.460 1.00 0.00 H new ATOM 0 HA VAL A 14 -2.849 3.365 3.680 1.00 0.00 H new ATOM 0 HB VAL A 14 -1.427 4.267 6.168 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -3.244 5.969 6.422 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -2.258 6.251 4.968 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -3.869 5.510 4.820 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -3.659 3.775 7.263 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -4.274 3.212 5.690 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -2.961 2.326 6.500 1.00 0.00 H new ATOM 246 N LEU A 15 0.173 4.760 3.673 1.00 0.00 N ATOM 247 CA LEU A 15 1.063 5.632 2.889 1.00 0.00 C ATOM 248 C LEU A 15 1.187 5.166 1.426 1.00 0.00 C ATOM 249 O LEU A 15 1.098 5.983 0.509 1.00 0.00 O ATOM 250 CB LEU A 15 2.480 5.733 3.484 1.00 0.00 C ATOM 251 CG LEU A 15 2.703 6.410 4.847 1.00 0.00 C ATOM 252 CD1 LEU A 15 4.190 6.748 4.958 1.00 0.00 C ATOM 253 CD2 LEU A 15 1.913 7.704 5.011 1.00 0.00 C ATOM 0 H LEU A 15 0.634 4.335 4.477 1.00 0.00 H new ATOM 0 HA LEU A 15 0.594 6.615 2.926 1.00 0.00 H new ATOM 0 HB2 LEU A 15 2.871 4.718 3.560 1.00 0.00 H new ATOM 0 HB3 LEU A 15 3.098 6.260 2.757 1.00 0.00 H new ATOM 0 HG LEU A 15 2.364 5.721 5.620 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.383 7.231 5.916 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.777 5.832 4.888 1.00 0.00 H new ATOM 0 HD13 LEU A 15 4.471 7.422 4.149 1.00 0.00 H new ATOM 0 HD21 LEU A 15 2.115 8.131 5.993 1.00 0.00 H new ATOM 0 HD22 LEU A 15 2.212 8.413 4.239 1.00 0.00 H new ATOM 0 HD23 LEU A 15 0.847 7.494 4.918 1.00 0.00 H new ATOM 265 N LEU A 16 1.412 3.868 1.196 1.00 0.00 N ATOM 266 CA LEU A 16 1.530 3.290 -0.145 1.00 0.00 C ATOM 267 C LEU A 16 0.251 3.529 -0.960 1.00 0.00 C ATOM 268 O LEU A 16 0.316 3.949 -2.116 1.00 0.00 O ATOM 269 CB LEU A 16 1.893 1.801 -0.045 1.00 0.00 C ATOM 270 CG LEU A 16 2.156 1.159 -1.419 1.00 0.00 C ATOM 271 CD1 LEU A 16 3.331 1.819 -2.137 1.00 0.00 C ATOM 272 CD2 LEU A 16 2.509 -0.311 -1.233 1.00 0.00 C ATOM 0 H LEU A 16 1.518 3.183 1.944 1.00 0.00 H new ATOM 0 HA LEU A 16 2.337 3.790 -0.681 1.00 0.00 H new ATOM 0 HB2 LEU A 16 2.779 1.689 0.579 1.00 0.00 H new ATOM 0 HB3 LEU A 16 1.083 1.267 0.452 1.00 0.00 H new ATOM 0 HG LEU A 16 1.251 1.285 -2.013 1.00 0.00 H new ATOM 0 HD11 LEU A 16 3.484 1.337 -3.103 1.00 0.00 H new ATOM 0 HD12 LEU A 16 3.117 2.877 -2.289 1.00 0.00 H new ATOM 0 HD13 LEU A 16 4.232 1.715 -1.532 1.00 0.00 H new ATOM 0 HD21 LEU A 16 2.695 -0.766 -2.206 1.00 0.00 H new ATOM 0 HD22 LEU A 16 3.403 -0.395 -0.616 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.681 -0.825 -0.744 1.00 0.00 H new ATOM 284 N LEU A 17 -0.914 3.302 -0.346 1.00 0.00 N ATOM 285 CA LEU A 17 -2.208 3.611 -0.950 1.00 0.00 C ATOM 286 C LEU A 17 -2.319 5.114 -1.268 1.00 0.00 C ATOM 287 O LEU A 17 -2.702 5.453 -2.389 1.00 0.00 O ATOM 288 CB LEU A 17 -3.361 3.106 -0.070 1.00 0.00 C ATOM 289 CG LEU A 17 -3.810 1.672 -0.409 1.00 0.00 C ATOM 290 CD1 LEU A 17 -2.772 0.572 -0.205 1.00 0.00 C ATOM 291 CD2 LEU A 17 -5.009 1.344 0.468 1.00 0.00 C ATOM 0 H LEU A 17 -0.983 2.897 0.588 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.285 3.081 -1.899 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -3.054 3.145 0.975 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -4.211 3.779 -0.177 1.00 0.00 H new ATOM 0 HG LEU A 17 -4.021 1.678 -1.478 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -3.204 -0.391 -0.477 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -1.904 0.770 -0.833 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -2.466 0.550 0.841 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -5.352 0.332 0.252 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -4.722 1.413 1.517 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -5.813 2.051 0.264 1.00 0.00 H new ATOM 303 N HIS A 18 -1.961 6.009 -0.331 1.00 0.00 N ATOM 304 CA HIS A 18 -1.947 7.462 -0.563 1.00 0.00 C ATOM 305 C HIS A 18 -1.145 7.804 -1.825 1.00 0.00 C ATOM 306 O HIS A 18 -1.673 8.499 -2.684 1.00 0.00 O ATOM 307 CB HIS A 18 -1.439 8.280 0.643 1.00 0.00 C ATOM 308 CG HIS A 18 -1.414 9.778 0.367 1.00 0.00 C ATOM 309 ND1 HIS A 18 -2.325 10.713 0.811 1.00 0.00 N ATOM 310 CD2 HIS A 18 -0.536 10.438 -0.459 1.00 0.00 C ATOM 311 CE1 HIS A 18 -2.013 11.895 0.239 1.00 0.00 C ATOM 312 NE2 HIS A 18 -0.934 11.778 -0.557 1.00 0.00 N ATOM 0 H HIS A 18 -1.673 5.743 0.611 1.00 0.00 H new ATOM 0 HA HIS A 18 -2.988 7.752 -0.707 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -2.077 8.084 1.505 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -0.435 7.946 0.907 1.00 0.00 H new ATOM 0 HD1 HIS A 18 -3.096 10.542 1.456 1.00 0.00 H new ATOM 0 HD2 HIS A 18 0.319 9.997 -0.951 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -2.558 12.814 0.399 1.00 0.00 H new ATOM 320 N ALA A 19 0.099 7.324 -1.960 1.00 0.00 N ATOM 321 CA ALA A 19 0.968 7.590 -3.113 1.00 0.00 C ATOM 322 C ALA A 19 0.233 7.483 -4.462 1.00 0.00 C ATOM 323 O ALA A 19 0.257 8.426 -5.260 1.00 0.00 O ATOM 324 CB ALA A 19 2.191 6.672 -3.054 1.00 0.00 C ATOM 0 H ALA A 19 0.537 6.729 -1.257 1.00 0.00 H new ATOM 0 HA ALA A 19 1.297 8.627 -3.049 1.00 0.00 H new ATOM 0 HB1 ALA A 19 2.836 6.870 -3.910 1.00 0.00 H new ATOM 0 HB2 ALA A 19 2.743 6.860 -2.133 1.00 0.00 H new ATOM 0 HB3 ALA A 19 1.866 5.632 -3.077 1.00 0.00 H new ATOM 330 N HIS A 20 -0.447 6.356 -4.705 1.00 0.00 N ATOM 331 CA HIS A 20 -1.247 6.138 -5.917 1.00 0.00 C ATOM 332 C HIS A 20 -2.557 6.946 -5.916 1.00 0.00 C ATOM 333 O HIS A 20 -2.895 7.520 -6.947 1.00 0.00 O ATOM 334 CB HIS A 20 -1.465 4.639 -6.135 1.00 0.00 C ATOM 335 CG HIS A 20 -2.187 4.340 -7.427 1.00 0.00 C ATOM 336 ND1 HIS A 20 -3.525 4.003 -7.568 1.00 0.00 N ATOM 337 CD2 HIS A 20 -1.631 4.410 -8.674 1.00 0.00 C ATOM 338 CE1 HIS A 20 -3.768 3.864 -8.888 1.00 0.00 C ATOM 339 NE2 HIS A 20 -2.633 4.105 -9.578 1.00 0.00 N ATOM 0 H HIS A 20 -0.458 5.564 -4.062 1.00 0.00 H new ATOM 0 HA HIS A 20 -0.687 6.520 -6.770 1.00 0.00 H new ATOM 0 HB2 HIS A 20 -0.500 4.132 -6.136 1.00 0.00 H new ATOM 0 HB3 HIS A 20 -2.037 4.234 -5.301 1.00 0.00 H new ATOM 0 HD2 HIS A 20 -0.606 4.656 -8.909 1.00 0.00 H new ATOM 0 HE1 HIS A 20 -4.721 3.601 -9.324 1.00 0.00 H new ATOM 0 HE2 HIS A 20 -2.531 4.068 -10.592 1.00 0.00 H new ATOM 348 N LYS A 21 -3.287 7.034 -4.794 1.00 0.00 N ATOM 349 CA LYS A 21 -4.524 7.838 -4.633 1.00 0.00 C ATOM 350 C LYS A 21 -4.293 9.298 -5.060 1.00 0.00 C ATOM 351 O LYS A 21 -5.021 9.815 -5.906 1.00 0.00 O ATOM 352 CB LYS A 21 -5.018 7.722 -3.179 1.00 0.00 C ATOM 353 CG LYS A 21 -6.361 8.428 -2.914 1.00 0.00 C ATOM 354 CD LYS A 21 -6.692 8.494 -1.412 1.00 0.00 C ATOM 355 CE LYS A 21 -7.010 7.115 -0.823 1.00 0.00 C ATOM 356 NZ LYS A 21 -7.229 7.179 0.646 1.00 0.00 N ATOM 0 H LYS A 21 -3.031 6.534 -3.942 1.00 0.00 H new ATOM 0 HA LYS A 21 -5.303 7.448 -5.289 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -5.117 6.667 -2.923 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -4.262 8.141 -2.515 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -6.326 9.438 -3.322 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -7.158 7.900 -3.438 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -5.849 8.930 -0.876 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -7.544 9.157 -1.259 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -7.899 6.710 -1.306 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -6.190 6.430 -1.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -7.637 6.281 0.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -6.321 7.344 1.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -7.883 7.957 0.866 1.00 0.00 H new ATOM 370 N CYS A 22 -3.256 9.927 -4.505 1.00 0.00 N ATOM 371 CA CYS A 22 -2.738 11.268 -4.773 1.00 0.00 C ATOM 372 C CYS A 22 -2.472 11.439 -6.281 1.00 0.00 C ATOM 373 O CYS A 22 -3.089 12.288 -6.928 1.00 0.00 O ATOM 374 CB CYS A 22 -1.504 11.414 -3.861 1.00 0.00 C ATOM 375 SG CYS A 22 -0.521 12.939 -4.042 1.00 0.00 S ATOM 0 H CYS A 22 -2.703 9.463 -3.784 1.00 0.00 H new ATOM 0 HA CYS A 22 -3.437 12.072 -4.543 1.00 0.00 H new ATOM 0 HB2 CYS A 22 -1.837 11.346 -2.825 1.00 0.00 H new ATOM 0 HB3 CYS A 22 -0.847 10.563 -4.041 1.00 0.00 H new ATOM 380 N GLN A 23 -1.620 10.579 -6.857 1.00 0.00 N ATOM 381 CA GLN A 23 -1.304 10.523 -8.290 1.00 0.00 C ATOM 382 C GLN A 23 -2.580 10.467 -9.160 1.00 0.00 C ATOM 383 O GLN A 23 -2.784 11.325 -10.021 1.00 0.00 O ATOM 384 CB GLN A 23 -0.366 9.326 -8.536 1.00 0.00 C ATOM 385 CG GLN A 23 0.049 9.157 -10.002 1.00 0.00 C ATOM 386 CD GLN A 23 1.004 7.976 -10.175 1.00 0.00 C ATOM 387 OE1 GLN A 23 0.642 6.817 -10.006 1.00 0.00 O ATOM 388 NE2 GLN A 23 2.256 8.211 -10.512 1.00 0.00 N ATOM 0 H GLN A 23 -1.114 9.877 -6.317 1.00 0.00 H new ATOM 0 HA GLN A 23 -0.794 11.439 -8.589 1.00 0.00 H new ATOM 0 HB2 GLN A 23 0.529 9.447 -7.926 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -0.860 8.414 -8.200 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -0.837 9.004 -10.618 1.00 0.00 H new ATOM 0 HG3 GLN A 23 0.529 10.070 -10.354 1.00 0.00 H new ATOM 0 HE21 GLN A 23 2.574 9.169 -10.657 1.00 0.00 H new ATOM 0 HE22 GLN A 23 2.907 7.435 -10.628 1.00 0.00 H new ATOM 397 N ARG A 24 -3.445 9.470 -8.923 1.00 0.00 N ATOM 398 CA ARG A 24 -4.728 9.234 -9.608 1.00 0.00 C ATOM 399 C ARG A 24 -5.617 10.480 -9.584 1.00 0.00 C ATOM 400 O ARG A 24 -6.008 10.972 -10.643 1.00 0.00 O ATOM 401 CB ARG A 24 -5.422 8.018 -8.967 1.00 0.00 C ATOM 402 CG ARG A 24 -6.640 7.523 -9.762 1.00 0.00 C ATOM 403 CD ARG A 24 -7.424 6.499 -8.929 1.00 0.00 C ATOM 404 NE ARG A 24 -8.232 5.605 -9.774 1.00 0.00 N ATOM 405 CZ ARG A 24 -9.460 5.742 -10.226 1.00 0.00 C ATOM 406 NH1 ARG A 24 -10.165 6.822 -10.034 1.00 0.00 N ATOM 407 NH2 ARG A 24 -10.005 4.765 -10.889 1.00 0.00 N ATOM 0 H ARG A 24 -3.259 8.766 -8.208 1.00 0.00 H new ATOM 0 HA ARG A 24 -4.540 9.018 -10.660 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -4.702 7.205 -8.875 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -5.738 8.280 -7.957 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -7.283 8.364 -10.020 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -6.315 7.071 -10.699 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -6.729 5.906 -8.335 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -8.075 7.023 -8.229 1.00 0.00 H new ATOM 0 HE ARG A 24 -7.766 4.742 -10.054 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -9.768 7.605 -9.515 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -11.114 6.884 -10.403 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -9.481 3.905 -11.053 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -10.956 4.858 -11.245 1.00 0.00 H new ATOM 421 N ARG A 25 -5.925 10.993 -8.385 1.00 0.00 N ATOM 422 CA ARG A 25 -6.742 12.194 -8.139 1.00 0.00 C ATOM 423 C ARG A 25 -6.202 13.401 -8.903 1.00 0.00 C ATOM 424 O ARG A 25 -6.941 14.018 -9.663 1.00 0.00 O ATOM 425 CB ARG A 25 -6.853 12.446 -6.625 1.00 0.00 C ATOM 426 CG ARG A 25 -7.716 13.676 -6.299 1.00 0.00 C ATOM 427 CD ARG A 25 -7.926 13.820 -4.788 1.00 0.00 C ATOM 428 NE ARG A 25 -8.598 15.095 -4.465 1.00 0.00 N ATOM 429 CZ ARG A 25 -8.638 15.709 -3.296 1.00 0.00 C ATOM 430 NH1 ARG A 25 -8.065 15.223 -2.231 1.00 0.00 N ATOM 431 NH2 ARG A 25 -9.265 16.843 -3.172 1.00 0.00 N ATOM 0 H ARG A 25 -5.598 10.564 -7.519 1.00 0.00 H new ATOM 0 HA ARG A 25 -7.749 12.027 -8.520 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -7.281 11.567 -6.143 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -5.855 12.584 -6.208 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -7.237 14.574 -6.690 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -8.682 13.588 -6.796 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -8.524 12.986 -4.419 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -6.964 13.773 -4.278 1.00 0.00 H new ATOM 0 HE ARG A 25 -9.088 15.554 -5.233 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -7.562 14.337 -2.282 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -8.119 15.729 -1.347 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -9.728 17.261 -3.979 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -9.293 17.314 -2.268 1.00 0.00 H new ATOM 445 N GLU A 26 -4.923 13.719 -8.715 1.00 0.00 N ATOM 446 CA GLU A 26 -4.223 14.830 -9.370 1.00 0.00 C ATOM 447 C GLU A 26 -4.370 14.786 -10.903 1.00 0.00 C ATOM 448 O GLU A 26 -4.769 15.779 -11.517 1.00 0.00 O ATOM 449 CB GLU A 26 -2.745 14.835 -8.942 1.00 0.00 C ATOM 450 CG GLU A 26 -2.041 16.161 -9.244 1.00 0.00 C ATOM 451 CD GLU A 26 -2.593 17.294 -8.362 1.00 0.00 C ATOM 452 OE1 GLU A 26 -2.427 17.206 -7.121 1.00 0.00 O ATOM 453 OE2 GLU A 26 -3.168 18.269 -8.897 1.00 0.00 O ATOM 0 H GLU A 26 -4.321 13.194 -8.081 1.00 0.00 H new ATOM 0 HA GLU A 26 -4.686 15.763 -9.048 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -2.681 14.631 -7.873 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -2.221 14.027 -9.453 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -0.969 16.054 -9.076 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -2.175 16.416 -10.295 1.00 0.00 H new ATOM 460 N GLN A 27 -4.072 13.637 -11.523 1.00 0.00 N ATOM 461 CA GLN A 27 -4.214 13.423 -12.969 1.00 0.00 C ATOM 462 C GLN A 27 -5.678 13.558 -13.438 1.00 0.00 C ATOM 463 O GLN A 27 -5.937 14.208 -14.453 1.00 0.00 O ATOM 464 CB GLN A 27 -3.638 12.057 -13.377 1.00 0.00 C ATOM 465 CG GLN A 27 -2.103 12.034 -13.314 1.00 0.00 C ATOM 466 CD GLN A 27 -1.538 10.725 -13.862 1.00 0.00 C ATOM 467 OE1 GLN A 27 -1.298 9.763 -13.145 1.00 0.00 O ATOM 468 NE2 GLN A 27 -1.302 10.632 -15.155 1.00 0.00 N ATOM 0 H GLN A 27 -3.720 12.818 -11.027 1.00 0.00 H new ATOM 0 HA GLN A 27 -3.643 14.207 -13.466 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -4.039 11.285 -12.721 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -3.962 11.815 -14.389 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -1.702 12.871 -13.885 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -1.778 12.167 -12.282 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -1.496 11.424 -15.767 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -0.925 9.768 -15.544 1.00 0.00 H new ATOM 477 N ALA A 28 -6.629 12.949 -12.719 1.00 0.00 N ATOM 478 CA ALA A 28 -8.063 12.988 -13.017 1.00 0.00 C ATOM 479 C ALA A 28 -8.633 14.424 -12.989 1.00 0.00 C ATOM 480 O ALA A 28 -9.104 14.925 -14.015 1.00 0.00 O ATOM 481 CB ALA A 28 -8.799 12.047 -12.052 1.00 0.00 C ATOM 0 H ALA A 28 -6.413 12.399 -11.888 1.00 0.00 H new ATOM 0 HA ALA A 28 -8.220 12.640 -14.038 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -9.868 12.069 -12.266 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -8.425 11.031 -12.178 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -8.628 12.372 -11.026 1.00 0.00 H new ATOM 487 N ASN A 29 -8.597 15.091 -11.829 1.00 0.00 N ATOM 488 CA ASN A 29 -9.061 16.467 -11.625 1.00 0.00 C ATOM 489 C ASN A 29 -8.406 17.106 -10.383 1.00 0.00 C ATOM 490 O ASN A 29 -8.518 16.585 -9.269 1.00 0.00 O ATOM 491 CB ASN A 29 -10.596 16.481 -11.496 1.00 0.00 C ATOM 492 CG ASN A 29 -11.130 17.884 -11.251 1.00 0.00 C ATOM 493 OD1 ASN A 29 -11.567 18.233 -10.162 1.00 0.00 O ATOM 494 ND2 ASN A 29 -11.098 18.743 -12.246 1.00 0.00 N ATOM 0 H ASN A 29 -8.230 14.671 -10.975 1.00 0.00 H new ATOM 0 HA ASN A 29 -8.766 17.061 -12.490 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -11.041 16.077 -12.405 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -10.898 15.829 -10.676 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -11.436 19.695 -12.109 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -10.735 18.457 -13.155 1.00 0.00 H new ATOM 501 N GLY A 30 -7.753 18.256 -10.567 1.00 0.00 N ATOM 502 CA GLY A 30 -7.098 19.009 -9.495 1.00 0.00 C ATOM 503 C GLY A 30 -6.764 20.457 -9.871 1.00 0.00 C ATOM 504 O GLY A 30 -6.705 20.829 -11.046 1.00 0.00 O ATOM 0 H GLY A 30 -7.663 18.698 -11.482 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -7.745 19.011 -8.618 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.179 18.496 -9.212 1.00 0.00 H new ATOM 508 N GLU A 31 -6.523 21.269 -8.845 1.00 0.00 N ATOM 509 CA GLU A 31 -6.132 22.687 -8.896 1.00 0.00 C ATOM 510 C GLU A 31 -5.156 22.911 -7.731 1.00 0.00 C ATOM 511 O GLU A 31 -3.949 23.071 -7.936 1.00 0.00 O ATOM 512 CB GLU A 31 -7.384 23.581 -8.843 1.00 0.00 C ATOM 513 CG GLU A 31 -7.040 25.073 -8.926 1.00 0.00 C ATOM 514 CD GLU A 31 -8.318 25.931 -8.979 1.00 0.00 C ATOM 515 OE1 GLU A 31 -8.867 26.282 -7.905 1.00 0.00 O ATOM 516 OE2 GLU A 31 -8.786 26.268 -10.096 1.00 0.00 O ATOM 0 H GLU A 31 -6.600 20.935 -7.884 1.00 0.00 H new ATOM 0 HA GLU A 31 -5.633 22.954 -9.827 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -8.050 23.318 -9.665 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -7.927 23.387 -7.918 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -6.440 25.360 -8.062 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -6.434 25.262 -9.812 1.00 0.00 H new ATOM 523 N VAL A 32 -5.670 22.818 -6.501 1.00 0.00 N ATOM 524 CA VAL A 32 -4.881 22.778 -5.259 1.00 0.00 C ATOM 525 C VAL A 32 -4.353 21.338 -5.147 1.00 0.00 C ATOM 526 O VAL A 32 -5.092 20.397 -5.464 1.00 0.00 O ATOM 527 CB VAL A 32 -5.754 23.127 -4.034 1.00 0.00 C ATOM 528 CG1 VAL A 32 -4.940 23.123 -2.734 1.00 0.00 C ATOM 529 CG2 VAL A 32 -6.391 24.517 -4.178 1.00 0.00 C ATOM 0 H VAL A 32 -6.675 22.767 -6.334 1.00 0.00 H new ATOM 0 HA VAL A 32 -4.072 23.508 -5.283 1.00 0.00 H new ATOM 0 HB VAL A 32 -6.527 22.360 -3.989 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -5.591 23.373 -1.896 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -4.510 22.134 -2.577 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -4.139 23.859 -2.804 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -6.999 24.731 -3.299 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -5.607 25.269 -4.269 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -7.020 24.539 -5.068 1.00 0.00 H new ATOM 539 N ARG A 33 -3.093 21.140 -4.729 1.00 0.00 N ATOM 540 CA ARG A 33 -2.472 19.802 -4.623 1.00 0.00 C ATOM 541 C ARG A 33 -3.359 18.783 -3.893 1.00 0.00 C ATOM 542 O ARG A 33 -3.816 19.036 -2.775 1.00 0.00 O ATOM 543 CB ARG A 33 -1.107 19.864 -3.907 1.00 0.00 C ATOM 544 CG ARG A 33 0.103 20.324 -4.743 1.00 0.00 C ATOM 545 CD ARG A 33 0.418 19.535 -6.033 1.00 0.00 C ATOM 546 NE ARG A 33 -0.084 18.146 -6.045 1.00 0.00 N ATOM 547 CZ ARG A 33 0.336 17.056 -5.434 1.00 0.00 C ATOM 548 NH1 ARG A 33 1.423 17.021 -4.720 1.00 0.00 N ATOM 549 NH2 ARG A 33 -0.392 15.981 -5.534 1.00 0.00 N ATOM 0 H ARG A 33 -2.472 21.901 -4.454 1.00 0.00 H new ATOM 0 HA ARG A 33 -2.338 19.468 -5.652 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -1.203 20.535 -3.053 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -0.887 18.873 -3.511 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -0.054 21.367 -5.016 1.00 0.00 H new ATOM 0 HG3 ARG A 33 0.986 20.291 -4.104 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -0.009 20.068 -6.882 1.00 0.00 H new ATOM 0 HD3 ARG A 33 1.498 19.518 -6.178 1.00 0.00 H new ATOM 0 HE ARG A 33 -0.905 18.004 -6.633 1.00 0.00 H new ATOM 0 HH11 ARG A 33 1.991 17.862 -4.614 1.00 0.00 H new ATOM 0 HH12 ARG A 33 1.707 16.153 -4.266 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -1.258 16.000 -6.073 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -0.096 15.120 -5.074 1.00 0.00 H new ATOM 563 N ALA A 34 -3.561 17.620 -4.514 1.00 0.00 N ATOM 564 CA ALA A 34 -4.292 16.486 -3.945 1.00 0.00 C ATOM 565 C ALA A 34 -3.615 15.956 -2.659 1.00 0.00 C ATOM 566 O ALA A 34 -4.294 15.491 -1.737 1.00 0.00 O ATOM 567 CB ALA A 34 -4.380 15.387 -5.012 1.00 0.00 C ATOM 0 H ALA A 34 -3.211 17.435 -5.454 1.00 0.00 H new ATOM 0 HA ALA A 34 -5.292 16.810 -3.658 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -4.922 14.531 -4.609 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -4.906 15.770 -5.886 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -3.375 15.078 -5.300 1.00 0.00 H new ATOM 573 N CYS A 35 -2.280 16.020 -2.624 1.00 0.00 N ATOM 574 CA CYS A 35 -1.403 15.569 -1.551 1.00 0.00 C ATOM 575 C CYS A 35 -1.615 16.294 -0.208 1.00 0.00 C ATOM 576 O CYS A 35 -1.966 17.480 -0.153 1.00 0.00 O ATOM 577 CB CYS A 35 0.037 15.737 -2.044 1.00 0.00 C ATOM 578 SG CYS A 35 1.151 14.630 -1.152 1.00 0.00 S ATOM 0 H CYS A 35 -1.752 16.417 -3.401 1.00 0.00 H new ATOM 0 HA CYS A 35 -1.638 14.527 -1.333 1.00 0.00 H new ATOM 0 HB2 CYS A 35 0.087 15.528 -3.113 1.00 0.00 H new ATOM 0 HB3 CYS A 35 0.356 16.770 -1.906 1.00 0.00 H new ATOM 583 N SER A 36 -1.351 15.561 0.873 1.00 0.00 N ATOM 584 CA SER A 36 -1.425 16.003 2.274 1.00 0.00 C ATOM 585 C SER A 36 -0.218 15.533 3.094 1.00 0.00 C ATOM 586 O SER A 36 0.423 16.328 3.788 1.00 0.00 O ATOM 587 CB SER A 36 -2.721 15.513 2.939 1.00 0.00 C ATOM 588 OG SER A 36 -3.870 16.050 2.300 1.00 0.00 O ATOM 0 H SER A 36 -1.063 14.586 0.795 1.00 0.00 H new ATOM 0 HA SER A 36 -1.418 17.093 2.256 1.00 0.00 H new ATOM 0 HB2 SER A 36 -2.760 14.424 2.904 1.00 0.00 H new ATOM 0 HB3 SER A 36 -2.722 15.799 3.991 1.00 0.00 H new ATOM 0 HG SER A 36 -4.677 15.718 2.745 1.00 0.00 H new ATOM 594 N LEU A 37 0.068 14.229 3.046 1.00 0.00 N ATOM 595 CA LEU A 37 1.135 13.552 3.792 1.00 0.00 C ATOM 596 C LEU A 37 2.534 13.901 3.236 1.00 0.00 C ATOM 597 O LEU A 37 2.723 13.866 2.021 1.00 0.00 O ATOM 598 CB LEU A 37 0.900 12.029 3.721 1.00 0.00 C ATOM 599 CG LEU A 37 -0.525 11.563 4.081 1.00 0.00 C ATOM 600 CD1 LEU A 37 -0.591 10.044 3.996 1.00 0.00 C ATOM 601 CD2 LEU A 37 -0.948 11.987 5.490 1.00 0.00 C ATOM 0 H LEU A 37 -0.462 13.585 2.459 1.00 0.00 H new ATOM 0 HA LEU A 37 1.106 13.892 4.827 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.131 11.689 2.711 1.00 0.00 H new ATOM 0 HB3 LEU A 37 1.605 11.538 4.392 1.00 0.00 H new ATOM 0 HG LEU A 37 -1.205 12.034 3.371 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -1.597 9.709 4.250 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.347 9.725 2.983 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.123 9.609 4.695 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.959 11.632 5.689 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.262 11.557 6.220 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.924 13.074 5.565 1.00 0.00 H new ATOM 613 N PRO A 38 3.544 14.216 4.073 1.00 0.00 N ATOM 614 CA PRO A 38 4.886 14.572 3.596 1.00 0.00 C ATOM 615 C PRO A 38 5.583 13.419 2.850 1.00 0.00 C ATOM 616 O PRO A 38 6.095 13.614 1.745 1.00 0.00 O ATOM 617 CB PRO A 38 5.654 15.042 4.838 1.00 0.00 C ATOM 618 CG PRO A 38 4.929 14.377 6.007 1.00 0.00 C ATOM 619 CD PRO A 38 3.480 14.280 5.526 1.00 0.00 C ATOM 0 HA PRO A 38 4.841 15.362 2.846 1.00 0.00 H new ATOM 0 HB2 PRO A 38 6.701 14.740 4.796 1.00 0.00 H new ATOM 0 HB3 PRO A 38 5.639 16.128 4.927 1.00 0.00 H new ATOM 0 HG2 PRO A 38 5.344 13.394 6.229 1.00 0.00 H new ATOM 0 HG3 PRO A 38 5.010 14.970 6.918 1.00 0.00 H new ATOM 0 HD2 PRO A 38 2.991 13.395 5.935 1.00 0.00 H new ATOM 0 HD3 PRO A 38 2.901 15.144 5.854 1.00 0.00 H new ATOM 627 N HIS A 39 5.587 12.221 3.449 1.00 0.00 N ATOM 628 CA HIS A 39 6.201 10.965 2.970 1.00 0.00 C ATOM 629 C HIS A 39 5.661 10.400 1.642 1.00 0.00 C ATOM 630 O HIS A 39 6.248 9.452 1.115 1.00 0.00 O ATOM 631 CB HIS A 39 6.104 9.913 4.086 1.00 0.00 C ATOM 632 CG HIS A 39 6.762 10.345 5.373 1.00 0.00 C ATOM 633 ND1 HIS A 39 8.110 10.605 5.549 1.00 0.00 N ATOM 634 CD2 HIS A 39 6.119 10.594 6.552 1.00 0.00 C ATOM 635 CE1 HIS A 39 8.281 11.007 6.827 1.00 0.00 C ATOM 636 NE2 HIS A 39 7.085 11.007 7.455 1.00 0.00 N ATOM 0 H HIS A 39 5.127 12.089 4.350 1.00 0.00 H new ATOM 0 HA HIS A 39 7.235 11.216 2.735 1.00 0.00 H new ATOM 0 HB2 HIS A 39 5.054 9.694 4.279 1.00 0.00 H new ATOM 0 HB3 HIS A 39 6.565 8.987 3.743 1.00 0.00 H new ATOM 0 HD2 HIS A 39 5.061 10.489 6.743 1.00 0.00 H new ATOM 0 HE1 HIS A 39 9.224 11.284 7.275 1.00 0.00 H new ATOM 0 HE2 HIS A 39 6.921 11.267 8.428 1.00 0.00 H new ATOM 645 N CYS A 40 4.568 10.944 1.102 1.00 0.00 N ATOM 646 CA CYS A 40 3.945 10.537 -0.159 1.00 0.00 C ATOM 647 C CYS A 40 4.975 10.375 -1.303 1.00 0.00 C ATOM 648 O CYS A 40 5.059 9.301 -1.905 1.00 0.00 O ATOM 649 CB CYS A 40 2.831 11.546 -0.460 1.00 0.00 C ATOM 650 SG CYS A 40 2.234 11.413 -2.164 1.00 0.00 S ATOM 0 H CYS A 40 4.072 11.714 1.551 1.00 0.00 H new ATOM 0 HA CYS A 40 3.509 9.542 -0.070 1.00 0.00 H new ATOM 0 HB2 CYS A 40 2.001 11.385 0.228 1.00 0.00 H new ATOM 0 HB3 CYS A 40 3.200 12.556 -0.283 1.00 0.00 H new ATOM 655 N ARG A 41 5.813 11.393 -1.569 1.00 0.00 N ATOM 656 CA ARG A 41 6.896 11.351 -2.578 1.00 0.00 C ATOM 657 C ARG A 41 7.834 10.155 -2.403 1.00 0.00 C ATOM 658 O ARG A 41 8.192 9.515 -3.393 1.00 0.00 O ATOM 659 CB ARG A 41 7.667 12.682 -2.613 1.00 0.00 C ATOM 660 CG ARG A 41 6.925 13.730 -3.465 1.00 0.00 C ATOM 661 CD ARG A 41 6.810 15.101 -2.787 1.00 0.00 C ATOM 662 NE ARG A 41 6.001 15.047 -1.555 1.00 0.00 N ATOM 663 CZ ARG A 41 4.691 14.898 -1.452 1.00 0.00 C ATOM 664 NH1 ARG A 41 3.887 14.769 -2.460 1.00 0.00 N ATOM 665 NH2 ARG A 41 4.128 14.853 -0.293 1.00 0.00 N ATOM 0 H ARG A 41 5.758 12.287 -1.081 1.00 0.00 H new ATOM 0 HA ARG A 41 6.416 11.211 -3.547 1.00 0.00 H new ATOM 0 HB2 ARG A 41 7.795 13.058 -1.598 1.00 0.00 H new ATOM 0 HB3 ARG A 41 8.665 12.518 -3.020 1.00 0.00 H new ATOM 0 HG2 ARG A 41 7.444 13.847 -4.416 1.00 0.00 H new ATOM 0 HG3 ARG A 41 5.925 13.360 -3.691 1.00 0.00 H new ATOM 0 HD2 ARG A 41 7.807 15.472 -2.549 1.00 0.00 H new ATOM 0 HD3 ARG A 41 6.363 15.812 -3.482 1.00 0.00 H new ATOM 0 HE ARG A 41 6.513 15.135 -0.677 1.00 0.00 H new ATOM 0 HH11 ARG A 41 4.256 14.779 -3.411 1.00 0.00 H new ATOM 0 HH12 ARG A 41 2.885 14.658 -2.302 1.00 0.00 H new ATOM 0 HH21 ARG A 41 4.694 14.933 0.552 1.00 0.00 H new ATOM 0 HH22 ARG A 41 3.117 14.738 -0.221 1.00 0.00 H new ATOM 679 N THR A 42 8.206 9.816 -1.167 1.00 0.00 N ATOM 680 CA THR A 42 9.021 8.628 -0.859 1.00 0.00 C ATOM 681 C THR A 42 8.290 7.371 -1.340 1.00 0.00 C ATOM 682 O THR A 42 8.845 6.588 -2.109 1.00 0.00 O ATOM 683 CB THR A 42 9.354 8.516 0.641 1.00 0.00 C ATOM 684 OG1 THR A 42 9.767 9.765 1.162 1.00 0.00 O ATOM 685 CG2 THR A 42 10.486 7.515 0.883 1.00 0.00 C ATOM 0 H THR A 42 7.951 10.359 -0.342 1.00 0.00 H new ATOM 0 HA THR A 42 9.971 8.729 -1.384 1.00 0.00 H new ATOM 0 HB THR A 42 8.445 8.180 1.140 1.00 0.00 H new ATOM 0 HG1 THR A 42 9.971 9.670 2.116 1.00 0.00 H new ATOM 0 HG21 THR A 42 10.699 7.457 1.950 1.00 0.00 H new ATOM 0 HG22 THR A 42 10.187 6.532 0.519 1.00 0.00 H new ATOM 0 HG23 THR A 42 11.380 7.842 0.352 1.00 0.00 H new ATOM 693 N MET A 43 7.022 7.196 -0.951 1.00 0.00 N ATOM 694 CA MET A 43 6.192 6.076 -1.413 1.00 0.00 C ATOM 695 C MET A 43 5.974 6.079 -2.939 1.00 0.00 C ATOM 696 O MET A 43 5.970 5.005 -3.527 1.00 0.00 O ATOM 697 CB MET A 43 4.869 5.987 -0.649 1.00 0.00 C ATOM 698 CG MET A 43 5.017 5.544 0.809 1.00 0.00 C ATOM 699 SD MET A 43 5.946 4.014 1.122 1.00 0.00 S ATOM 700 CE MET A 43 7.477 4.718 1.794 1.00 0.00 C ATOM 0 H MET A 43 6.542 7.826 -0.308 1.00 0.00 H new ATOM 0 HA MET A 43 6.756 5.171 -1.187 1.00 0.00 H new ATOM 0 HB2 MET A 43 4.382 6.962 -0.674 1.00 0.00 H new ATOM 0 HB3 MET A 43 4.210 5.288 -1.165 1.00 0.00 H new ATOM 0 HG2 MET A 43 5.500 6.351 1.360 1.00 0.00 H new ATOM 0 HG3 MET A 43 4.018 5.425 1.229 1.00 0.00 H new ATOM 0 HE1 MET A 43 8.169 3.913 2.043 1.00 0.00 H new ATOM 0 HE2 MET A 43 7.934 5.372 1.051 1.00 0.00 H new ATOM 0 HE3 MET A 43 7.250 5.292 2.692 1.00 0.00 H new ATOM 710 N LYS A 44 5.835 7.231 -3.613 1.00 0.00 N ATOM 711 CA LYS A 44 5.739 7.332 -5.089 1.00 0.00 C ATOM 712 C LYS A 44 7.003 6.778 -5.765 1.00 0.00 C ATOM 713 O LYS A 44 6.903 6.033 -6.741 1.00 0.00 O ATOM 714 CB LYS A 44 5.470 8.779 -5.542 1.00 0.00 C ATOM 715 CG LYS A 44 3.985 9.181 -5.483 1.00 0.00 C ATOM 716 CD LYS A 44 3.847 10.671 -5.853 1.00 0.00 C ATOM 717 CE LYS A 44 2.418 11.170 -6.117 1.00 0.00 C ATOM 718 NZ LYS A 44 1.517 10.948 -4.971 1.00 0.00 N ATOM 0 H LYS A 44 5.785 8.137 -3.146 1.00 0.00 H new ATOM 0 HA LYS A 44 4.890 6.723 -5.401 1.00 0.00 H new ATOM 0 HB2 LYS A 44 6.046 9.459 -4.915 1.00 0.00 H new ATOM 0 HB3 LYS A 44 5.831 8.903 -6.563 1.00 0.00 H new ATOM 0 HG2 LYS A 44 3.403 8.568 -6.171 1.00 0.00 H new ATOM 0 HG3 LYS A 44 3.588 9.004 -4.484 1.00 0.00 H new ATOM 0 HD2 LYS A 44 4.275 11.266 -5.047 1.00 0.00 H new ATOM 0 HD3 LYS A 44 4.447 10.861 -6.743 1.00 0.00 H new ATOM 0 HE2 LYS A 44 2.447 12.234 -6.351 1.00 0.00 H new ATOM 0 HE3 LYS A 44 2.016 10.662 -6.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 0.796 11.698 -4.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 1.051 10.023 -5.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 2.067 10.966 -4.088 1.00 0.00 H new ATOM 732 N ASN A 45 8.191 7.099 -5.242 1.00 0.00 N ATOM 733 CA ASN A 45 9.468 6.551 -5.727 1.00 0.00 C ATOM 734 C ASN A 45 9.481 5.017 -5.567 1.00 0.00 C ATOM 735 O ASN A 45 9.810 4.292 -6.507 1.00 0.00 O ATOM 736 CB ASN A 45 10.653 7.222 -5.008 1.00 0.00 C ATOM 737 CG ASN A 45 11.026 8.559 -5.627 1.00 0.00 C ATOM 738 OD1 ASN A 45 11.925 8.656 -6.451 1.00 0.00 O ATOM 739 ND2 ASN A 45 10.356 9.629 -5.268 1.00 0.00 N ATOM 0 H ASN A 45 8.297 7.751 -4.465 1.00 0.00 H new ATOM 0 HA ASN A 45 9.574 6.771 -6.789 1.00 0.00 H new ATOM 0 HB2 ASN A 45 10.401 7.369 -3.958 1.00 0.00 H new ATOM 0 HB3 ASN A 45 11.516 6.557 -5.039 1.00 0.00 H new ATOM 0 HD21 ASN A 45 10.586 10.535 -5.676 1.00 0.00 H new ATOM 0 HD22 ASN A 45 9.605 9.554 -4.581 1.00 0.00 H new ATOM 746 N VAL A 46 9.082 4.520 -4.390 1.00 0.00 N ATOM 747 CA VAL A 46 8.940 3.084 -4.083 1.00 0.00 C ATOM 748 C VAL A 46 7.954 2.417 -5.065 1.00 0.00 C ATOM 749 O VAL A 46 8.285 1.393 -5.657 1.00 0.00 O ATOM 750 CB VAL A 46 8.554 2.899 -2.601 1.00 0.00 C ATOM 751 CG1 VAL A 46 8.200 1.457 -2.235 1.00 0.00 C ATOM 752 CG2 VAL A 46 9.713 3.344 -1.696 1.00 0.00 C ATOM 0 H VAL A 46 8.841 5.119 -3.600 1.00 0.00 H new ATOM 0 HA VAL A 46 9.895 2.577 -4.223 1.00 0.00 H new ATOM 0 HB VAL A 46 7.666 3.512 -2.449 1.00 0.00 H new ATOM 0 HG11 VAL A 46 7.939 1.403 -1.178 1.00 0.00 H new ATOM 0 HG12 VAL A 46 7.352 1.127 -2.835 1.00 0.00 H new ATOM 0 HG13 VAL A 46 9.056 0.811 -2.431 1.00 0.00 H new ATOM 0 HG21 VAL A 46 9.431 3.210 -0.652 1.00 0.00 H new ATOM 0 HG22 VAL A 46 10.596 2.743 -1.914 1.00 0.00 H new ATOM 0 HG23 VAL A 46 9.935 4.395 -1.880 1.00 0.00 H new ATOM 762 N LEU A 47 6.777 3.015 -5.284 1.00 0.00 N ATOM 763 CA LEU A 47 5.722 2.597 -6.220 1.00 0.00 C ATOM 764 C LEU A 47 6.275 2.381 -7.636 1.00 0.00 C ATOM 765 O LEU A 47 6.101 1.313 -8.224 1.00 0.00 O ATOM 766 CB LEU A 47 4.558 3.610 -6.140 1.00 0.00 C ATOM 767 CG LEU A 47 3.262 3.284 -6.900 1.00 0.00 C ATOM 768 CD1 LEU A 47 3.270 3.653 -8.380 1.00 0.00 C ATOM 769 CD2 LEU A 47 2.887 1.816 -6.778 1.00 0.00 C ATOM 0 H LEU A 47 6.517 3.862 -4.778 1.00 0.00 H new ATOM 0 HA LEU A 47 5.327 1.622 -5.934 1.00 0.00 H new ATOM 0 HB2 LEU A 47 4.304 3.743 -5.089 1.00 0.00 H new ATOM 0 HB3 LEU A 47 4.925 4.570 -6.503 1.00 0.00 H new ATOM 0 HG LEU A 47 2.520 3.916 -6.412 1.00 0.00 H new ATOM 0 HD11 LEU A 47 2.313 3.384 -8.827 1.00 0.00 H new ATOM 0 HD12 LEU A 47 3.432 4.726 -8.487 1.00 0.00 H new ATOM 0 HD13 LEU A 47 4.071 3.113 -8.885 1.00 0.00 H new ATOM 0 HD21 LEU A 47 1.966 1.629 -7.329 1.00 0.00 H new ATOM 0 HD22 LEU A 47 3.687 1.201 -7.189 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.739 1.564 -5.728 1.00 0.00 H new ATOM 781 N ASN A 48 6.979 3.383 -8.163 1.00 0.00 N ATOM 782 CA ASN A 48 7.658 3.330 -9.460 1.00 0.00 C ATOM 783 C ASN A 48 8.640 2.145 -9.534 1.00 0.00 C ATOM 784 O ASN A 48 8.646 1.394 -10.512 1.00 0.00 O ATOM 785 CB ASN A 48 8.390 4.659 -9.699 1.00 0.00 C ATOM 786 CG ASN A 48 9.124 4.652 -11.031 1.00 0.00 C ATOM 787 OD1 ASN A 48 8.531 4.601 -12.098 1.00 0.00 O ATOM 788 ND2 ASN A 48 10.439 4.673 -11.017 1.00 0.00 N ATOM 0 H ASN A 48 7.096 4.278 -7.688 1.00 0.00 H new ATOM 0 HA ASN A 48 6.913 3.178 -10.241 1.00 0.00 H new ATOM 0 HB2 ASN A 48 7.673 5.480 -9.680 1.00 0.00 H new ATOM 0 HB3 ASN A 48 9.100 4.837 -8.891 1.00 0.00 H new ATOM 0 HD21 ASN A 48 10.959 4.647 -11.894 1.00 0.00 H new ATOM 0 HD22 ASN A 48 10.939 4.716 -10.129 1.00 0.00 H new ATOM 795 N HIS A 49 9.481 1.983 -8.510 1.00 0.00 N ATOM 796 CA HIS A 49 10.444 0.888 -8.414 1.00 0.00 C ATOM 797 C HIS A 49 9.740 -0.486 -8.439 1.00 0.00 C ATOM 798 O HIS A 49 10.099 -1.323 -9.266 1.00 0.00 O ATOM 799 CB HIS A 49 11.343 1.091 -7.185 1.00 0.00 C ATOM 800 CG HIS A 49 12.295 -0.063 -6.968 1.00 0.00 C ATOM 801 ND1 HIS A 49 13.499 -0.250 -7.614 1.00 0.00 N ATOM 802 CD2 HIS A 49 12.025 -1.204 -6.258 1.00 0.00 C ATOM 803 CE1 HIS A 49 13.926 -1.496 -7.330 1.00 0.00 C ATOM 804 NE2 HIS A 49 13.070 -2.107 -6.494 1.00 0.00 N ATOM 0 H HIS A 49 9.511 2.619 -7.713 1.00 0.00 H new ATOM 0 HA HIS A 49 11.091 0.898 -9.291 1.00 0.00 H new ATOM 0 HB2 HIS A 49 11.914 2.012 -7.305 1.00 0.00 H new ATOM 0 HB3 HIS A 49 10.720 1.215 -6.299 1.00 0.00 H new ATOM 0 HD1 HIS A 49 13.980 0.432 -8.201 1.00 0.00 H new ATOM 0 HD2 HIS A 49 11.163 -1.376 -5.630 1.00 0.00 H new ATOM 0 HE1 HIS A 49 14.830 -1.941 -7.720 1.00 0.00 H new ATOM 812 N MET A 50 8.730 -0.716 -7.586 1.00 0.00 N ATOM 813 CA MET A 50 7.951 -1.966 -7.486 1.00 0.00 C ATOM 814 C MET A 50 7.493 -2.536 -8.841 1.00 0.00 C ATOM 815 O MET A 50 7.644 -3.732 -9.090 1.00 0.00 O ATOM 816 CB MET A 50 6.699 -1.769 -6.622 1.00 0.00 C ATOM 817 CG MET A 50 6.906 -1.581 -5.121 1.00 0.00 C ATOM 818 SD MET A 50 5.759 -0.397 -4.355 1.00 0.00 S ATOM 819 CE MET A 50 4.153 -1.057 -4.842 1.00 0.00 C ATOM 0 H MET A 50 8.419 -0.010 -6.919 1.00 0.00 H new ATOM 0 HA MET A 50 8.641 -2.678 -7.033 1.00 0.00 H new ATOM 0 HB2 MET A 50 6.162 -0.899 -7.000 1.00 0.00 H new ATOM 0 HB3 MET A 50 6.050 -2.632 -6.767 1.00 0.00 H new ATOM 0 HG2 MET A 50 6.798 -2.546 -4.627 1.00 0.00 H new ATOM 0 HG3 MET A 50 7.928 -1.246 -4.945 1.00 0.00 H new ATOM 0 HE1 MET A 50 3.368 -0.361 -4.546 1.00 0.00 H new ATOM 0 HE2 MET A 50 4.128 -1.193 -5.923 1.00 0.00 H new ATOM 0 HE3 MET A 50 3.990 -2.017 -4.352 1.00 0.00 H new ATOM 829 N THR A 51 6.905 -1.705 -9.711 1.00 0.00 N ATOM 830 CA THR A 51 6.429 -2.112 -11.049 1.00 0.00 C ATOM 831 C THR A 51 7.557 -2.595 -11.968 1.00 0.00 C ATOM 832 O THR A 51 7.376 -3.570 -12.700 1.00 0.00 O ATOM 833 CB THR A 51 5.640 -0.998 -11.764 1.00 0.00 C ATOM 834 OG1 THR A 51 6.024 0.306 -11.375 1.00 0.00 O ATOM 835 CG2 THR A 51 4.152 -1.124 -11.451 1.00 0.00 C ATOM 0 H THR A 51 6.742 -0.719 -9.508 1.00 0.00 H new ATOM 0 HA THR A 51 5.759 -2.950 -10.856 1.00 0.00 H new ATOM 0 HB THR A 51 5.855 -1.129 -12.824 1.00 0.00 H new ATOM 0 HG1 THR A 51 6.990 0.327 -11.210 1.00 0.00 H new ATOM 0 HG21 THR A 51 3.604 -0.332 -11.961 1.00 0.00 H new ATOM 0 HG22 THR A 51 3.789 -2.094 -11.792 1.00 0.00 H new ATOM 0 HG23 THR A 51 3.998 -1.037 -10.376 1.00 0.00 H new ATOM 843 N HIS A 52 8.713 -1.921 -11.946 1.00 0.00 N ATOM 844 CA HIS A 52 9.897 -2.252 -12.758 1.00 0.00 C ATOM 845 C HIS A 52 10.653 -3.478 -12.221 1.00 0.00 C ATOM 846 O HIS A 52 10.942 -4.404 -12.984 1.00 0.00 O ATOM 847 CB HIS A 52 10.809 -1.021 -12.869 1.00 0.00 C ATOM 848 CG HIS A 52 10.178 0.095 -13.666 1.00 0.00 C ATOM 849 ND1 HIS A 52 9.547 1.212 -13.149 1.00 0.00 N ATOM 850 CD2 HIS A 52 10.088 0.150 -15.029 1.00 0.00 C ATOM 851 CE1 HIS A 52 9.088 1.942 -14.185 1.00 0.00 C ATOM 852 NE2 HIS A 52 9.409 1.318 -15.339 1.00 0.00 N ATOM 0 H HIS A 52 8.858 -1.108 -11.348 1.00 0.00 H new ATOM 0 HA HIS A 52 9.557 -2.527 -13.756 1.00 0.00 H new ATOM 0 HB2 HIS A 52 11.049 -0.659 -11.869 1.00 0.00 H new ATOM 0 HB3 HIS A 52 11.750 -1.311 -13.337 1.00 0.00 H new ATOM 0 HD1 HIS A 52 9.447 1.442 -12.160 1.00 0.00 H new ATOM 0 HD2 HIS A 52 10.472 -0.577 -15.729 1.00 0.00 H new ATOM 0 HE1 HIS A 52 8.550 2.875 -14.105 1.00 0.00 H new ATOM 861 N CYS A 53 10.975 -3.487 -10.927 1.00 0.00 N ATOM 862 CA CYS A 53 11.661 -4.565 -10.219 1.00 0.00 C ATOM 863 C CYS A 53 10.813 -5.858 -10.210 1.00 0.00 C ATOM 864 O CYS A 53 9.583 -5.819 -10.094 1.00 0.00 O ATOM 865 CB CYS A 53 11.984 -4.049 -8.812 1.00 0.00 C ATOM 866 SG CYS A 53 12.701 -5.339 -7.739 1.00 0.00 S ATOM 0 H CYS A 53 10.752 -2.702 -10.315 1.00 0.00 H new ATOM 0 HA CYS A 53 12.588 -4.839 -10.723 1.00 0.00 H new ATOM 0 HB2 CYS A 53 12.681 -3.215 -8.886 1.00 0.00 H new ATOM 0 HB3 CYS A 53 11.074 -3.664 -8.352 1.00 0.00 H new ATOM 871 N GLN A 54 11.475 -7.009 -10.343 1.00 0.00 N ATOM 872 CA GLN A 54 10.889 -8.359 -10.367 1.00 0.00 C ATOM 873 C GLN A 54 11.595 -9.332 -9.398 1.00 0.00 C ATOM 874 O GLN A 54 11.231 -10.508 -9.314 1.00 0.00 O ATOM 875 CB GLN A 54 10.972 -8.909 -11.803 1.00 0.00 C ATOM 876 CG GLN A 54 10.205 -8.098 -12.864 1.00 0.00 C ATOM 877 CD GLN A 54 8.686 -8.217 -12.737 1.00 0.00 C ATOM 878 OE1 GLN A 54 8.045 -9.030 -13.392 1.00 0.00 O ATOM 879 NE2 GLN A 54 8.041 -7.418 -11.913 1.00 0.00 N ATOM 0 H GLN A 54 12.490 -7.030 -10.443 1.00 0.00 H new ATOM 0 HA GLN A 54 9.853 -8.279 -10.038 1.00 0.00 H new ATOM 0 HB2 GLN A 54 12.021 -8.958 -12.095 1.00 0.00 H new ATOM 0 HB3 GLN A 54 10.592 -9.931 -11.806 1.00 0.00 H new ATOM 0 HG2 GLN A 54 10.488 -7.048 -12.783 1.00 0.00 H new ATOM 0 HG3 GLN A 54 10.507 -8.434 -13.856 1.00 0.00 H new ATOM 0 HE21 GLN A 54 8.556 -6.734 -11.358 1.00 0.00 H new ATOM 0 HE22 GLN A 54 7.027 -7.483 -11.829 1.00 0.00 H new ATOM 888 N ALA A 55 12.606 -8.861 -8.662 1.00 0.00 N ATOM 889 CA ALA A 55 13.399 -9.644 -7.719 1.00 0.00 C ATOM 890 C ALA A 55 12.602 -10.071 -6.467 1.00 0.00 C ATOM 891 O ALA A 55 12.774 -11.192 -5.982 1.00 0.00 O ATOM 892 CB ALA A 55 14.654 -8.832 -7.389 1.00 0.00 C ATOM 0 H ALA A 55 12.903 -7.886 -8.711 1.00 0.00 H new ATOM 0 HA ALA A 55 13.686 -10.592 -8.175 1.00 0.00 H new ATOM 0 HB1 ALA A 55 15.272 -9.388 -6.684 1.00 0.00 H new ATOM 0 HB2 ALA A 55 15.220 -8.649 -8.303 1.00 0.00 H new ATOM 0 HB3 ALA A 55 14.365 -7.880 -6.945 1.00 0.00 H new ATOM 898 N GLY A 56 11.728 -9.198 -5.948 1.00 0.00 N ATOM 899 CA GLY A 56 10.847 -9.439 -4.796 1.00 0.00 C ATOM 900 C GLY A 56 11.588 -9.878 -3.530 1.00 0.00 C ATOM 901 O GLY A 56 12.161 -9.049 -2.822 1.00 0.00 O ATOM 0 H GLY A 56 11.610 -8.262 -6.337 1.00 0.00 H new ATOM 0 HA2 GLY A 56 10.289 -8.528 -4.581 1.00 0.00 H new ATOM 0 HA3 GLY A 56 10.118 -10.204 -5.062 1.00 0.00 H new ATOM 905 N LYS A 57 11.605 -11.192 -3.262 1.00 0.00 N ATOM 906 CA LYS A 57 12.314 -11.827 -2.133 1.00 0.00 C ATOM 907 C LYS A 57 13.804 -11.448 -2.121 1.00 0.00 C ATOM 908 O LYS A 57 14.374 -11.179 -1.063 1.00 0.00 O ATOM 909 CB LYS A 57 12.184 -13.362 -2.210 1.00 0.00 C ATOM 910 CG LYS A 57 10.753 -13.922 -2.143 1.00 0.00 C ATOM 911 CD LYS A 57 10.033 -13.741 -0.797 1.00 0.00 C ATOM 912 CE LYS A 57 10.720 -14.539 0.320 1.00 0.00 C ATOM 913 NZ LYS A 57 9.820 -14.764 1.480 1.00 0.00 N ATOM 0 H LYS A 57 11.110 -11.868 -3.843 1.00 0.00 H new ATOM 0 HA LYS A 57 11.853 -11.464 -1.214 1.00 0.00 H new ATOM 0 HB2 LYS A 57 12.642 -13.699 -3.140 1.00 0.00 H new ATOM 0 HB3 LYS A 57 12.762 -13.797 -1.394 1.00 0.00 H new ATOM 0 HG2 LYS A 57 10.158 -13.444 -2.921 1.00 0.00 H new ATOM 0 HG3 LYS A 57 10.787 -14.986 -2.377 1.00 0.00 H new ATOM 0 HD2 LYS A 57 10.015 -12.684 -0.532 1.00 0.00 H new ATOM 0 HD3 LYS A 57 8.996 -14.064 -0.891 1.00 0.00 H new ATOM 0 HE2 LYS A 57 11.052 -15.500 -0.073 1.00 0.00 H new ATOM 0 HE3 LYS A 57 11.611 -14.005 0.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 10.386 -15.024 2.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 9.288 -13.893 1.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 9.155 -15.533 1.260 1.00 0.00 H new ATOM 927 N ALA A 58 14.425 -11.456 -3.302 1.00 0.00 N ATOM 928 CA ALA A 58 15.839 -11.166 -3.530 1.00 0.00 C ATOM 929 C ALA A 58 16.214 -9.666 -3.506 1.00 0.00 C ATOM 930 O ALA A 58 17.397 -9.352 -3.341 1.00 0.00 O ATOM 931 CB ALA A 58 16.246 -11.822 -4.856 1.00 0.00 C ATOM 0 H ALA A 58 13.930 -11.676 -4.166 1.00 0.00 H new ATOM 0 HA ALA A 58 16.396 -11.583 -2.691 1.00 0.00 H new ATOM 0 HB1 ALA A 58 17.299 -11.622 -5.053 1.00 0.00 H new ATOM 0 HB2 ALA A 58 16.087 -12.898 -4.793 1.00 0.00 H new ATOM 0 HB3 ALA A 58 15.641 -11.412 -5.665 1.00 0.00 H new ATOM 937 N CYS A 59 15.256 -8.738 -3.663 1.00 0.00 N ATOM 938 CA CYS A 59 15.530 -7.298 -3.645 1.00 0.00 C ATOM 939 C CYS A 59 15.971 -6.855 -2.233 1.00 0.00 C ATOM 940 O CYS A 59 15.256 -7.039 -1.241 1.00 0.00 O ATOM 941 CB CYS A 59 14.305 -6.520 -4.160 1.00 0.00 C ATOM 942 SG CYS A 59 14.784 -4.856 -4.752 1.00 0.00 S ATOM 0 H CYS A 59 14.272 -8.968 -3.806 1.00 0.00 H new ATOM 0 HA CYS A 59 16.357 -7.072 -4.319 1.00 0.00 H new ATOM 0 HB2 CYS A 59 13.832 -7.075 -4.970 1.00 0.00 H new ATOM 0 HB3 CYS A 59 13.567 -6.428 -3.363 1.00 0.00 H new ATOM 947 N GLN A 60 17.184 -6.303 -2.136 1.00 0.00 N ATOM 948 CA GLN A 60 17.801 -5.852 -0.882 1.00 0.00 C ATOM 949 C GLN A 60 17.110 -4.619 -0.271 1.00 0.00 C ATOM 950 O GLN A 60 17.200 -4.396 0.940 1.00 0.00 O ATOM 951 CB GLN A 60 19.295 -5.566 -1.108 1.00 0.00 C ATOM 952 CG GLN A 60 20.080 -6.821 -1.521 1.00 0.00 C ATOM 953 CD GLN A 60 21.576 -6.536 -1.640 1.00 0.00 C ATOM 954 OE1 GLN A 60 22.099 -6.227 -2.705 1.00 0.00 O ATOM 955 NE2 GLN A 60 22.327 -6.624 -0.560 1.00 0.00 N ATOM 0 H GLN A 60 17.781 -6.153 -2.949 1.00 0.00 H new ATOM 0 HA GLN A 60 17.679 -6.662 -0.162 1.00 0.00 H new ATOM 0 HB2 GLN A 60 19.403 -4.804 -1.880 1.00 0.00 H new ATOM 0 HB3 GLN A 60 19.725 -5.157 -0.194 1.00 0.00 H new ATOM 0 HG2 GLN A 60 19.917 -7.610 -0.787 1.00 0.00 H new ATOM 0 HG3 GLN A 60 19.702 -7.189 -2.475 1.00 0.00 H new ATOM 0 HE21 GLN A 60 21.907 -6.880 0.334 1.00 0.00 H new ATOM 0 HE22 GLN A 60 23.328 -6.436 -0.618 1.00 0.00 H new ATOM 964 N VAL A 61 16.435 -3.807 -1.092 1.00 0.00 N ATOM 965 CA VAL A 61 15.729 -2.582 -0.684 1.00 0.00 C ATOM 966 C VAL A 61 14.564 -2.908 0.261 1.00 0.00 C ATOM 967 O VAL A 61 13.621 -3.613 -0.107 1.00 0.00 O ATOM 968 CB VAL A 61 15.234 -1.791 -1.915 1.00 0.00 C ATOM 969 CG1 VAL A 61 14.578 -0.464 -1.503 1.00 0.00 C ATOM 970 CG2 VAL A 61 16.394 -1.441 -2.860 1.00 0.00 C ATOM 0 H VAL A 61 16.361 -3.988 -2.093 1.00 0.00 H new ATOM 0 HA VAL A 61 16.436 -1.954 -0.143 1.00 0.00 H new ATOM 0 HB VAL A 61 14.512 -2.436 -2.416 1.00 0.00 H new ATOM 0 HG11 VAL A 61 14.241 0.067 -2.393 1.00 0.00 H new ATOM 0 HG12 VAL A 61 13.724 -0.666 -0.856 1.00 0.00 H new ATOM 0 HG13 VAL A 61 15.303 0.149 -0.967 1.00 0.00 H new ATOM 0 HG21 VAL A 61 16.011 -0.885 -3.716 1.00 0.00 H new ATOM 0 HG22 VAL A 61 17.125 -0.832 -2.329 1.00 0.00 H new ATOM 0 HG23 VAL A 61 16.870 -2.358 -3.207 1.00 0.00 H new ATOM 980 N ALA A 62 14.620 -2.360 1.481 1.00 0.00 N ATOM 981 CA ALA A 62 13.614 -2.498 2.541 1.00 0.00 C ATOM 982 C ALA A 62 12.187 -2.253 2.020 1.00 0.00 C ATOM 983 O ALA A 62 11.281 -3.075 2.186 1.00 0.00 O ATOM 984 CB ALA A 62 13.976 -1.505 3.658 1.00 0.00 C ATOM 0 H ALA A 62 15.407 -1.779 1.770 1.00 0.00 H new ATOM 0 HA ALA A 62 13.622 -3.520 2.921 1.00 0.00 H new ATOM 0 HB1 ALA A 62 13.246 -1.582 4.464 1.00 0.00 H new ATOM 0 HB2 ALA A 62 14.969 -1.738 4.044 1.00 0.00 H new ATOM 0 HB3 ALA A 62 13.970 -0.491 3.259 1.00 0.00 H new ATOM 990 N HIS A 63 12.008 -1.098 1.373 1.00 0.00 N ATOM 991 CA HIS A 63 10.754 -0.627 0.785 1.00 0.00 C ATOM 992 C HIS A 63 10.139 -1.623 -0.210 1.00 0.00 C ATOM 993 O HIS A 63 8.979 -1.985 -0.035 1.00 0.00 O ATOM 994 CB HIS A 63 10.964 0.754 0.152 1.00 0.00 C ATOM 995 CG HIS A 63 11.620 1.774 1.053 1.00 0.00 C ATOM 996 ND1 HIS A 63 12.848 2.377 0.838 1.00 0.00 N ATOM 997 CD2 HIS A 63 11.096 2.274 2.213 1.00 0.00 C ATOM 998 CE1 HIS A 63 13.072 3.222 1.866 1.00 0.00 C ATOM 999 NE2 HIS A 63 12.023 3.172 2.716 1.00 0.00 N ATOM 0 H HIS A 63 12.772 -0.435 1.239 1.00 0.00 H new ATOM 0 HA HIS A 63 10.026 -0.541 1.592 1.00 0.00 H new ATOM 0 HB2 HIS A 63 11.573 0.638 -0.745 1.00 0.00 H new ATOM 0 HB3 HIS A 63 9.997 1.142 -0.168 1.00 0.00 H new ATOM 0 HD2 HIS A 63 10.143 2.018 2.652 1.00 0.00 H new ATOM 0 HE1 HIS A 63 13.949 3.839 1.990 1.00 0.00 H new ATOM 0 HE2 HIS A 63 11.930 3.705 3.581 1.00 0.00 H new ATOM 1008 N CYS A 64 10.886 -2.069 -1.227 1.00 0.00 N ATOM 1009 CA CYS A 64 10.444 -3.038 -2.241 1.00 0.00 C ATOM 1010 C CYS A 64 9.935 -4.340 -1.580 1.00 0.00 C ATOM 1011 O CYS A 64 8.784 -4.751 -1.765 1.00 0.00 O ATOM 1012 CB CYS A 64 11.609 -3.282 -3.218 1.00 0.00 C ATOM 1013 SG CYS A 64 11.118 -4.352 -4.612 1.00 0.00 S ATOM 0 H CYS A 64 11.846 -1.756 -1.373 1.00 0.00 H new ATOM 0 HA CYS A 64 9.598 -2.641 -2.802 1.00 0.00 H new ATOM 0 HB2 CYS A 64 11.966 -2.327 -3.602 1.00 0.00 H new ATOM 0 HB3 CYS A 64 12.440 -3.741 -2.683 1.00 0.00 H new ATOM 1018 N ALA A 65 10.781 -4.958 -0.750 1.00 0.00 N ATOM 1019 CA ALA A 65 10.468 -6.168 0.004 1.00 0.00 C ATOM 1020 C ALA A 65 9.162 -6.039 0.824 1.00 0.00 C ATOM 1021 O ALA A 65 8.323 -6.943 0.811 1.00 0.00 O ATOM 1022 CB ALA A 65 11.685 -6.507 0.873 1.00 0.00 C ATOM 0 H ALA A 65 11.728 -4.618 -0.582 1.00 0.00 H new ATOM 0 HA ALA A 65 10.273 -6.989 -0.685 1.00 0.00 H new ATOM 0 HB1 ALA A 65 11.480 -7.409 1.450 1.00 0.00 H new ATOM 0 HB2 ALA A 65 12.553 -6.673 0.235 1.00 0.00 H new ATOM 0 HB3 ALA A 65 11.888 -5.680 1.553 1.00 0.00 H new ATOM 1028 N SER A 66 8.986 -4.917 1.533 1.00 0.00 N ATOM 1029 CA SER A 66 7.810 -4.603 2.362 1.00 0.00 C ATOM 1030 C SER A 66 6.541 -4.318 1.542 1.00 0.00 C ATOM 1031 O SER A 66 5.510 -4.953 1.756 1.00 0.00 O ATOM 1032 CB SER A 66 8.092 -3.396 3.266 1.00 0.00 C ATOM 1033 OG SER A 66 9.244 -3.614 4.053 1.00 0.00 O ATOM 0 H SER A 66 9.684 -4.173 1.547 1.00 0.00 H new ATOM 0 HA SER A 66 7.625 -5.496 2.959 1.00 0.00 H new ATOM 0 HB2 SER A 66 8.227 -2.503 2.656 1.00 0.00 H new ATOM 0 HB3 SER A 66 7.234 -3.213 3.913 1.00 0.00 H new ATOM 0 HG SER A 66 10.045 -3.458 3.510 1.00 0.00 H new ATOM 1039 N SER A 67 6.592 -3.353 0.617 1.00 0.00 N ATOM 1040 CA SER A 67 5.489 -2.892 -0.249 1.00 0.00 C ATOM 1041 C SER A 67 4.787 -4.012 -1.020 1.00 0.00 C ATOM 1042 O SER A 67 3.556 -4.058 -1.062 1.00 0.00 O ATOM 1043 CB SER A 67 5.953 -1.790 -1.199 1.00 0.00 C ATOM 1044 OG SER A 67 7.058 -2.219 -1.960 1.00 0.00 O ATOM 0 H SER A 67 7.455 -2.839 0.438 1.00 0.00 H new ATOM 0 HA SER A 67 4.741 -2.485 0.432 1.00 0.00 H new ATOM 0 HB2 SER A 67 5.136 -1.508 -1.863 1.00 0.00 H new ATOM 0 HB3 SER A 67 6.222 -0.901 -0.629 1.00 0.00 H new ATOM 0 HG SER A 67 7.871 -2.166 -1.415 1.00 0.00 H new ATOM 1050 N ARG A 68 5.532 -4.951 -1.608 1.00 0.00 N ATOM 1051 CA ARG A 68 4.943 -6.121 -2.282 1.00 0.00 C ATOM 1052 C ARG A 68 4.082 -6.919 -1.299 1.00 0.00 C ATOM 1053 O ARG A 68 2.943 -7.260 -1.610 1.00 0.00 O ATOM 1054 CB ARG A 68 6.046 -6.980 -2.908 1.00 0.00 C ATOM 1055 CG ARG A 68 6.770 -6.233 -4.035 1.00 0.00 C ATOM 1056 CD ARG A 68 7.969 -7.055 -4.514 1.00 0.00 C ATOM 1057 NE ARG A 68 8.844 -6.268 -5.390 1.00 0.00 N ATOM 1058 CZ ARG A 68 8.668 -5.923 -6.643 1.00 0.00 C ATOM 1059 NH1 ARG A 68 7.623 -6.248 -7.347 1.00 0.00 N ATOM 1060 NH2 ARG A 68 9.565 -5.219 -7.231 1.00 0.00 N ATOM 0 H ARG A 68 6.551 -4.927 -1.633 1.00 0.00 H new ATOM 0 HA ARG A 68 4.292 -5.785 -3.089 1.00 0.00 H new ATOM 0 HB2 ARG A 68 6.765 -7.267 -2.140 1.00 0.00 H new ATOM 0 HB3 ARG A 68 5.613 -7.901 -3.300 1.00 0.00 H new ATOM 0 HG2 ARG A 68 6.085 -6.054 -4.864 1.00 0.00 H new ATOM 0 HG3 ARG A 68 7.104 -5.257 -3.681 1.00 0.00 H new ATOM 0 HD2 ARG A 68 8.537 -7.408 -3.653 1.00 0.00 H new ATOM 0 HD3 ARG A 68 7.617 -7.938 -5.048 1.00 0.00 H new ATOM 0 HE ARG A 68 9.712 -5.943 -4.964 1.00 0.00 H new ATOM 0 HH11 ARG A 68 6.878 -6.804 -6.927 1.00 0.00 H new ATOM 0 HH12 ARG A 68 7.549 -5.946 -8.319 1.00 0.00 H new ATOM 0 HH21 ARG A 68 10.403 -4.934 -6.724 1.00 0.00 H new ATOM 0 HH22 ARG A 68 9.440 -4.944 -8.205 1.00 0.00 H new ATOM 1074 N GLN A 69 4.606 -7.176 -0.099 1.00 0.00 N ATOM 1075 CA GLN A 69 3.941 -7.881 1.003 1.00 0.00 C ATOM 1076 C GLN A 69 2.617 -7.212 1.416 1.00 0.00 C ATOM 1077 O GLN A 69 1.584 -7.881 1.415 1.00 0.00 O ATOM 1078 CB GLN A 69 4.918 -8.015 2.189 1.00 0.00 C ATOM 1079 CG GLN A 69 4.812 -9.352 2.935 1.00 0.00 C ATOM 1080 CD GLN A 69 3.525 -9.612 3.721 1.00 0.00 C ATOM 1081 OE1 GLN A 69 3.103 -10.748 3.863 1.00 0.00 O ATOM 1082 NE2 GLN A 69 2.864 -8.626 4.291 1.00 0.00 N ATOM 0 H GLN A 69 5.553 -6.884 0.145 1.00 0.00 H new ATOM 0 HA GLN A 69 3.668 -8.878 0.658 1.00 0.00 H new ATOM 0 HB2 GLN A 69 5.937 -7.895 1.822 1.00 0.00 H new ATOM 0 HB3 GLN A 69 4.734 -7.203 2.892 1.00 0.00 H new ATOM 0 HG2 GLN A 69 4.932 -10.155 2.208 1.00 0.00 H new ATOM 0 HG3 GLN A 69 5.651 -9.420 3.628 1.00 0.00 H new ATOM 0 HE21 GLN A 69 3.193 -7.666 4.190 1.00 0.00 H new ATOM 0 HE22 GLN A 69 2.023 -8.822 4.834 1.00 0.00 H new ATOM 1091 N ILE A 70 2.616 -5.915 1.767 1.00 0.00 N ATOM 1092 CA ILE A 70 1.384 -5.195 2.164 1.00 0.00 C ATOM 1093 C ILE A 70 0.272 -5.286 1.108 1.00 0.00 C ATOM 1094 O ILE A 70 -0.873 -5.587 1.454 1.00 0.00 O ATOM 1095 CB ILE A 70 1.601 -3.721 2.600 1.00 0.00 C ATOM 1096 CG1 ILE A 70 2.666 -2.939 1.823 1.00 0.00 C ATOM 1097 CG2 ILE A 70 1.840 -3.643 4.112 1.00 0.00 C ATOM 1098 CD1 ILE A 70 2.712 -1.427 2.080 1.00 0.00 C ATOM 0 H ILE A 70 3.457 -5.337 1.785 1.00 0.00 H new ATOM 0 HA ILE A 70 1.057 -5.729 3.056 1.00 0.00 H new ATOM 0 HB ILE A 70 0.672 -3.213 2.340 1.00 0.00 H new ATOM 0 HG12 ILE A 70 3.643 -3.358 2.063 1.00 0.00 H new ATOM 0 HG13 ILE A 70 2.502 -3.102 0.758 1.00 0.00 H new ATOM 0 HG21 ILE A 70 1.991 -2.604 4.403 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.975 -4.046 4.638 1.00 0.00 H new ATOM 0 HG23 ILE A 70 2.725 -4.224 4.371 1.00 0.00 H new ATOM 0 HD11 ILE A 70 3.502 -0.979 1.477 1.00 0.00 H new ATOM 0 HD12 ILE A 70 1.754 -0.983 1.810 1.00 0.00 H new ATOM 0 HD13 ILE A 70 2.912 -1.243 3.136 1.00 0.00 H new ATOM 1110 N ILE A 71 0.586 -5.053 -0.172 1.00 0.00 N ATOM 1111 CA ILE A 71 -0.403 -5.163 -1.259 1.00 0.00 C ATOM 1112 C ILE A 71 -0.865 -6.614 -1.438 1.00 0.00 C ATOM 1113 O ILE A 71 -2.064 -6.849 -1.594 1.00 0.00 O ATOM 1114 CB ILE A 71 0.104 -4.489 -2.552 1.00 0.00 C ATOM 1115 CG1 ILE A 71 0.429 -2.995 -2.310 1.00 0.00 C ATOM 1116 CG2 ILE A 71 -0.920 -4.607 -3.694 1.00 0.00 C ATOM 1117 CD1 ILE A 71 -0.650 -2.194 -1.556 1.00 0.00 C ATOM 0 H ILE A 71 1.520 -4.786 -0.484 1.00 0.00 H new ATOM 0 HA ILE A 71 -1.298 -4.606 -0.981 1.00 0.00 H new ATOM 0 HB ILE A 71 1.014 -5.013 -2.844 1.00 0.00 H new ATOM 0 HG12 ILE A 71 1.362 -2.930 -1.750 1.00 0.00 H new ATOM 0 HG13 ILE A 71 0.603 -2.518 -3.275 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -0.527 -4.121 -4.587 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -1.108 -5.659 -3.907 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -1.852 -4.125 -3.399 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -0.322 -1.161 -1.440 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -1.582 -2.218 -2.121 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -0.811 -2.636 -0.573 1.00 0.00 H new ATOM 1129 N SER A 72 0.046 -7.591 -1.345 1.00 0.00 N ATOM 1130 CA SER A 72 -0.290 -9.026 -1.369 1.00 0.00 C ATOM 1131 C SER A 72 -1.319 -9.358 -0.289 1.00 0.00 C ATOM 1132 O SER A 72 -2.320 -10.017 -0.583 1.00 0.00 O ATOM 1133 CB SER A 72 0.933 -9.924 -1.162 1.00 0.00 C ATOM 1134 OG SER A 72 1.930 -9.664 -2.120 1.00 0.00 O ATOM 0 H SER A 72 1.045 -7.410 -1.250 1.00 0.00 H new ATOM 0 HA SER A 72 -0.698 -9.222 -2.360 1.00 0.00 H new ATOM 0 HB2 SER A 72 1.337 -9.766 -0.162 1.00 0.00 H new ATOM 0 HB3 SER A 72 0.632 -10.970 -1.222 1.00 0.00 H new ATOM 0 HG SER A 72 2.309 -8.774 -1.965 1.00 0.00 H new ATOM 1140 N HIS A 73 -1.091 -8.895 0.947 1.00 0.00 N ATOM 1141 CA HIS A 73 -2.011 -9.080 2.066 1.00 0.00 C ATOM 1142 C HIS A 73 -3.375 -8.478 1.716 1.00 0.00 C ATOM 1143 O HIS A 73 -4.344 -9.226 1.635 1.00 0.00 O ATOM 1144 CB HIS A 73 -1.445 -8.503 3.374 1.00 0.00 C ATOM 1145 CG HIS A 73 -2.297 -8.812 4.592 1.00 0.00 C ATOM 1146 ND1 HIS A 73 -1.896 -9.552 5.680 1.00 0.00 N ATOM 1147 CD2 HIS A 73 -3.593 -8.420 4.827 1.00 0.00 C ATOM 1148 CE1 HIS A 73 -2.930 -9.616 6.541 1.00 0.00 C ATOM 1149 NE2 HIS A 73 -3.996 -8.946 6.063 1.00 0.00 N ATOM 0 H HIS A 73 -0.250 -8.375 1.196 1.00 0.00 H new ATOM 0 HA HIS A 73 -2.139 -10.149 2.238 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -0.442 -8.899 3.532 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -1.348 -7.422 3.273 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -0.978 -9.977 5.812 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -4.198 -7.811 4.172 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -2.907 -10.135 7.488 1.00 0.00 H new ATOM 1157 N TRP A 74 -3.460 -7.160 1.493 1.00 0.00 N ATOM 1158 CA TRP A 74 -4.723 -6.471 1.194 1.00 0.00 C ATOM 1159 C TRP A 74 -5.537 -7.120 0.058 1.00 0.00 C ATOM 1160 O TRP A 74 -6.752 -7.295 0.181 1.00 0.00 O ATOM 1161 CB TRP A 74 -4.487 -4.974 0.942 1.00 0.00 C ATOM 1162 CG TRP A 74 -5.750 -4.163 0.907 1.00 0.00 C ATOM 1163 CD1 TRP A 74 -6.771 -4.302 1.783 1.00 0.00 C ATOM 1164 CD2 TRP A 74 -6.167 -3.109 -0.019 1.00 0.00 C ATOM 1165 NE1 TRP A 74 -7.806 -3.457 1.444 1.00 0.00 N ATOM 1166 CE2 TRP A 74 -7.486 -2.699 0.343 1.00 0.00 C ATOM 1167 CE3 TRP A 74 -5.579 -2.454 -1.126 1.00 0.00 C ATOM 1168 CZ2 TRP A 74 -8.186 -1.708 -0.356 1.00 0.00 C ATOM 1169 CZ3 TRP A 74 -6.269 -1.436 -1.819 1.00 0.00 C ATOM 1170 CH2 TRP A 74 -7.570 -1.065 -1.433 1.00 0.00 C ATOM 0 H TRP A 74 -2.651 -6.539 1.515 1.00 0.00 H new ATOM 0 HA TRP A 74 -5.342 -6.579 2.085 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -3.835 -4.581 1.722 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -3.961 -4.852 -0.005 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -6.775 -4.977 2.626 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -8.693 -3.402 1.945 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -4.587 -2.737 -1.446 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -9.192 -1.443 -0.066 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -5.795 -0.938 -2.652 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -8.091 -0.285 -1.968 1.00 0.00 H new ATOM 1181 N LYS A 75 -4.876 -7.501 -1.045 1.00 0.00 N ATOM 1182 CA LYS A 75 -5.477 -8.185 -2.203 1.00 0.00 C ATOM 1183 C LYS A 75 -6.120 -9.527 -1.814 1.00 0.00 C ATOM 1184 O LYS A 75 -7.278 -9.773 -2.154 1.00 0.00 O ATOM 1185 CB LYS A 75 -4.401 -8.324 -3.298 1.00 0.00 C ATOM 1186 CG LYS A 75 -4.805 -9.103 -4.563 1.00 0.00 C ATOM 1187 CD LYS A 75 -6.112 -8.684 -5.253 1.00 0.00 C ATOM 1188 CE LYS A 75 -6.223 -7.178 -5.526 1.00 0.00 C ATOM 1189 NZ LYS A 75 -7.544 -6.844 -6.121 1.00 0.00 N ATOM 0 H LYS A 75 -3.876 -7.337 -1.161 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.300 -7.589 -2.596 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -4.089 -7.324 -3.598 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -3.530 -8.812 -2.860 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -3.996 -9.015 -5.288 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -4.884 -10.158 -4.300 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -6.200 -9.221 -6.198 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -6.953 -8.992 -4.632 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -6.088 -6.625 -4.597 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -5.426 -6.867 -6.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -7.855 -5.914 -5.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -7.461 -6.819 -7.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -8.241 -7.566 -5.847 1.00 0.00 H new ATOM 1203 N ASN A 76 -5.382 -10.398 -1.123 1.00 0.00 N ATOM 1204 CA ASN A 76 -5.854 -11.721 -0.696 1.00 0.00 C ATOM 1205 C ASN A 76 -6.871 -11.686 0.466 1.00 0.00 C ATOM 1206 O ASN A 76 -7.827 -12.466 0.462 1.00 0.00 O ATOM 1207 CB ASN A 76 -4.651 -12.600 -0.330 1.00 0.00 C ATOM 1208 CG ASN A 76 -3.919 -13.103 -1.563 1.00 0.00 C ATOM 1209 OD1 ASN A 76 -4.268 -14.118 -2.151 1.00 0.00 O ATOM 1210 ND2 ASN A 76 -2.902 -12.406 -2.014 1.00 0.00 N ATOM 0 H ASN A 76 -4.422 -10.202 -0.838 1.00 0.00 H new ATOM 0 HA ASN A 76 -6.395 -12.145 -1.542 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -3.962 -12.031 0.294 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -4.990 -13.450 0.263 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -2.406 -12.711 -2.851 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -2.608 -11.559 -1.527 1.00 0.00 H new ATOM 1217 N CYS A 77 -6.648 -10.836 1.473 1.00 0.00 N ATOM 1218 CA CYS A 77 -7.452 -10.715 2.686 1.00 0.00 C ATOM 1219 C CYS A 77 -8.945 -10.454 2.391 1.00 0.00 C ATOM 1220 O CYS A 77 -9.336 -9.488 1.726 1.00 0.00 O ATOM 1221 CB CYS A 77 -6.814 -9.656 3.601 1.00 0.00 C ATOM 1222 SG CYS A 77 -7.417 -9.771 5.317 1.00 0.00 S ATOM 0 H CYS A 77 -5.864 -10.184 1.461 1.00 0.00 H new ATOM 0 HA CYS A 77 -7.450 -11.670 3.212 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -5.731 -9.775 3.590 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -7.030 -8.662 3.208 1.00 0.00 H new ATOM 1227 N THR A 78 -9.777 -11.366 2.895 1.00 0.00 N ATOM 1228 CA THR A 78 -11.247 -11.391 2.792 1.00 0.00 C ATOM 1229 C THR A 78 -11.877 -11.715 4.166 1.00 0.00 C ATOM 1230 O THR A 78 -13.016 -12.177 4.290 1.00 0.00 O ATOM 1231 CB THR A 78 -11.650 -12.344 1.646 1.00 0.00 C ATOM 1232 OG1 THR A 78 -13.013 -12.212 1.292 1.00 0.00 O ATOM 1233 CG2 THR A 78 -11.364 -13.823 1.929 1.00 0.00 C ATOM 0 H THR A 78 -9.423 -12.164 3.423 1.00 0.00 H new ATOM 0 HA THR A 78 -11.645 -10.411 2.530 1.00 0.00 H new ATOM 0 HB THR A 78 -11.017 -12.032 0.816 1.00 0.00 H new ATOM 0 HG1 THR A 78 -13.559 -12.166 2.104 1.00 0.00 H new ATOM 0 HG21 THR A 78 -11.676 -14.424 1.075 1.00 0.00 H new ATOM 0 HG22 THR A 78 -10.296 -13.961 2.099 1.00 0.00 H new ATOM 0 HG23 THR A 78 -11.916 -14.137 2.815 1.00 0.00 H new ATOM 1241 N ARG A 79 -11.114 -11.438 5.233 1.00 0.00 N ATOM 1242 CA ARG A 79 -11.431 -11.609 6.658 1.00 0.00 C ATOM 1243 C ARG A 79 -12.603 -10.720 7.097 1.00 0.00 C ATOM 1244 O ARG A 79 -12.784 -9.619 6.571 1.00 0.00 O ATOM 1245 CB ARG A 79 -10.131 -11.286 7.426 1.00 0.00 C ATOM 1246 CG ARG A 79 -10.235 -11.293 8.960 1.00 0.00 C ATOM 1247 CD ARG A 79 -8.892 -11.429 9.707 1.00 0.00 C ATOM 1248 NE ARG A 79 -7.723 -10.920 8.959 1.00 0.00 N ATOM 1249 CZ ARG A 79 -6.699 -11.601 8.486 1.00 0.00 C ATOM 1250 NH1 ARG A 79 -6.529 -12.880 8.695 1.00 0.00 N ATOM 1251 NH2 ARG A 79 -5.808 -10.989 7.781 1.00 0.00 N ATOM 0 H ARG A 79 -10.177 -11.055 5.110 1.00 0.00 H new ATOM 0 HA ARG A 79 -11.762 -12.626 6.867 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -9.369 -12.007 7.130 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -9.780 -10.304 7.110 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -10.719 -10.370 9.280 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -10.885 -12.115 9.261 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -8.962 -10.896 10.655 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -8.727 -12.480 9.944 1.00 0.00 H new ATOM 0 HE ARG A 79 -7.707 -9.915 8.787 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -7.209 -13.401 9.249 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -5.717 -13.357 8.304 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -5.902 -9.990 7.596 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -5.010 -11.504 7.409 1.00 0.00 H new ATOM 1265 N HIS A 80 -13.376 -11.189 8.088 1.00 0.00 N ATOM 1266 CA HIS A 80 -14.516 -10.477 8.700 1.00 0.00 C ATOM 1267 C HIS A 80 -14.131 -9.041 9.082 1.00 0.00 C ATOM 1268 O HIS A 80 -14.756 -8.080 8.632 1.00 0.00 O ATOM 1269 CB HIS A 80 -15.036 -11.281 9.905 1.00 0.00 C ATOM 1270 CG HIS A 80 -16.138 -10.574 10.655 1.00 0.00 C ATOM 1271 ND1 HIS A 80 -15.977 -9.802 11.791 1.00 0.00 N ATOM 1272 CD2 HIS A 80 -17.459 -10.551 10.307 1.00 0.00 C ATOM 1273 CE1 HIS A 80 -17.187 -9.315 12.130 1.00 0.00 C ATOM 1274 NE2 HIS A 80 -18.105 -9.760 11.243 1.00 0.00 N ATOM 0 H HIS A 80 -13.222 -12.108 8.503 1.00 0.00 H new ATOM 0 HA HIS A 80 -15.323 -10.396 7.972 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -15.402 -12.248 9.559 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -14.209 -11.479 10.587 1.00 0.00 H new ATOM 0 HD1 HIS A 80 -15.100 -9.632 12.284 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -17.912 -11.053 9.465 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -17.390 -8.673 12.974 1.00 0.00 H new ATOM 1283 N ASP A 81 -13.079 -8.907 9.891 1.00 0.00 N ATOM 1284 CA ASP A 81 -12.479 -7.640 10.305 1.00 0.00 C ATOM 1285 C ASP A 81 -10.958 -7.790 10.515 1.00 0.00 C ATOM 1286 O ASP A 81 -10.500 -8.626 11.298 1.00 0.00 O ATOM 1287 CB ASP A 81 -13.186 -7.050 11.537 1.00 0.00 C ATOM 1288 CG ASP A 81 -13.001 -7.857 12.834 1.00 0.00 C ATOM 1289 OD1 ASP A 81 -13.627 -8.938 12.965 1.00 0.00 O ATOM 1290 OD2 ASP A 81 -12.290 -7.379 13.751 1.00 0.00 O ATOM 0 H ASP A 81 -12.602 -9.714 10.292 1.00 0.00 H new ATOM 0 HA ASP A 81 -12.622 -6.923 9.497 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -12.817 -6.037 11.700 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -14.252 -6.971 11.324 1.00 0.00 H new ATOM 1295 N CYS A 82 -10.190 -6.965 9.801 1.00 0.00 N ATOM 1296 CA CYS A 82 -8.731 -6.850 9.819 1.00 0.00 C ATOM 1297 C CYS A 82 -8.429 -5.353 10.099 1.00 0.00 C ATOM 1298 O CYS A 82 -9.177 -4.494 9.611 1.00 0.00 O ATOM 1299 CB CYS A 82 -8.204 -7.322 8.448 1.00 0.00 C ATOM 1300 SG CYS A 82 -6.549 -8.080 8.458 1.00 0.00 S ATOM 0 H CYS A 82 -10.606 -6.307 9.142 1.00 0.00 H new ATOM 0 HA CYS A 82 -8.245 -7.462 10.579 1.00 0.00 H new ATOM 0 HB2 CYS A 82 -8.911 -8.042 8.036 1.00 0.00 H new ATOM 0 HB3 CYS A 82 -8.188 -6.468 7.771 1.00 0.00 H new ATOM 1305 N PRO A 83 -7.393 -4.991 10.878 1.00 0.00 N ATOM 1306 CA PRO A 83 -7.103 -3.602 11.268 1.00 0.00 C ATOM 1307 C PRO A 83 -6.791 -2.610 10.131 1.00 0.00 C ATOM 1308 O PRO A 83 -6.640 -1.415 10.404 1.00 0.00 O ATOM 1309 CB PRO A 83 -5.943 -3.700 12.270 1.00 0.00 C ATOM 1310 CG PRO A 83 -5.261 -5.011 11.887 1.00 0.00 C ATOM 1311 CD PRO A 83 -6.444 -5.892 11.511 1.00 0.00 C ATOM 0 HA PRO A 83 -8.011 -3.168 11.686 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -5.263 -2.852 12.183 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -6.301 -3.718 13.300 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -4.569 -4.882 11.055 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -4.689 -5.429 12.715 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -6.143 -6.690 10.832 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -6.877 -6.369 12.390 1.00 0.00 H new ATOM 1319 N VAL A 84 -6.702 -3.054 8.872 1.00 0.00 N ATOM 1320 CA VAL A 84 -6.433 -2.176 7.717 1.00 0.00 C ATOM 1321 C VAL A 84 -7.378 -2.507 6.561 1.00 0.00 C ATOM 1322 O VAL A 84 -8.050 -1.624 6.031 1.00 0.00 O ATOM 1323 CB VAL A 84 -4.970 -2.226 7.234 1.00 0.00 C ATOM 1324 CG1 VAL A 84 -4.620 -0.853 6.651 1.00 0.00 C ATOM 1325 CG2 VAL A 84 -3.971 -2.525 8.347 1.00 0.00 C ATOM 0 H VAL A 84 -6.814 -4.036 8.620 1.00 0.00 H new ATOM 0 HA VAL A 84 -6.613 -1.158 8.063 1.00 0.00 H new ATOM 0 HB VAL A 84 -4.898 -3.033 6.504 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -3.588 -0.859 6.300 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -5.285 -0.632 5.817 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -4.737 -0.090 7.421 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -2.962 -2.545 7.935 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -4.035 -1.751 9.111 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -4.201 -3.493 8.791 1.00 0.00 H new ATOM 1335 N CYS A 85 -7.441 -3.778 6.169 1.00 0.00 N ATOM 1336 CA CYS A 85 -8.252 -4.319 5.091 1.00 0.00 C ATOM 1337 C CYS A 85 -9.734 -3.919 5.202 1.00 0.00 C ATOM 1338 O CYS A 85 -10.295 -3.390 4.240 1.00 0.00 O ATOM 1339 CB CYS A 85 -8.036 -5.843 5.061 1.00 0.00 C ATOM 1340 SG CYS A 85 -6.278 -6.288 5.316 1.00 0.00 S ATOM 0 H CYS A 85 -6.889 -4.501 6.629 1.00 0.00 H new ATOM 0 HA CYS A 85 -7.935 -3.891 4.140 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -8.645 -6.311 5.834 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -8.376 -6.239 4.104 1.00 0.00 H new ATOM 1345 N LEU A 86 -10.363 -4.147 6.364 1.00 0.00 N ATOM 1346 CA LEU A 86 -11.760 -3.784 6.641 1.00 0.00 C ATOM 1347 C LEU A 86 -12.055 -2.286 6.384 1.00 0.00 C ATOM 1348 O LEU A 86 -12.882 -2.020 5.507 1.00 0.00 O ATOM 1349 CB LEU A 86 -12.172 -4.307 8.033 1.00 0.00 C ATOM 1350 CG LEU A 86 -13.656 -4.191 8.440 1.00 0.00 C ATOM 1351 CD1 LEU A 86 -14.086 -2.772 8.819 1.00 0.00 C ATOM 1352 CD2 LEU A 86 -14.603 -4.741 7.374 1.00 0.00 C ATOM 0 H LEU A 86 -9.904 -4.599 7.155 1.00 0.00 H new ATOM 0 HA LEU A 86 -12.408 -4.285 5.922 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -11.891 -5.359 8.091 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -11.579 -3.777 8.778 1.00 0.00 H new ATOM 0 HG LEU A 86 -13.733 -4.808 9.335 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -15.141 -2.772 9.093 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -13.492 -2.425 9.665 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -13.932 -2.106 7.970 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -15.634 -4.634 7.713 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -14.467 -4.187 6.445 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -14.385 -5.795 7.203 1.00 0.00 H new ATOM 1364 N PRO A 87 -11.432 -1.299 7.075 1.00 0.00 N ATOM 1365 CA PRO A 87 -11.697 0.122 6.822 1.00 0.00 C ATOM 1366 C PRO A 87 -11.418 0.542 5.367 1.00 0.00 C ATOM 1367 O PRO A 87 -12.152 1.360 4.817 1.00 0.00 O ATOM 1368 CB PRO A 87 -10.880 0.914 7.851 1.00 0.00 C ATOM 1369 CG PRO A 87 -9.800 -0.060 8.314 1.00 0.00 C ATOM 1370 CD PRO A 87 -10.460 -1.432 8.153 1.00 0.00 C ATOM 0 HA PRO A 87 -12.759 0.335 6.943 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -10.444 1.809 7.407 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -11.502 1.242 8.684 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -8.898 0.024 7.708 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -9.509 0.126 9.348 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -9.718 -2.194 7.915 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -10.947 -1.740 9.079 1.00 0.00 H new ATOM 1378 N LEU A 88 -10.393 -0.018 4.713 1.00 0.00 N ATOM 1379 CA LEU A 88 -10.098 0.236 3.295 1.00 0.00 C ATOM 1380 C LEU A 88 -11.220 -0.277 2.371 1.00 0.00 C ATOM 1381 O LEU A 88 -11.684 0.463 1.500 1.00 0.00 O ATOM 1382 CB LEU A 88 -8.745 -0.382 2.935 1.00 0.00 C ATOM 1383 CG LEU A 88 -7.533 0.346 3.534 1.00 0.00 C ATOM 1384 CD1 LEU A 88 -6.282 -0.447 3.175 1.00 0.00 C ATOM 1385 CD2 LEU A 88 -7.395 1.768 2.991 1.00 0.00 C ATOM 0 H LEU A 88 -9.740 -0.665 5.155 1.00 0.00 H new ATOM 0 HA LEU A 88 -10.045 1.314 3.141 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -8.733 -1.419 3.271 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -8.644 -0.397 1.850 1.00 0.00 H new ATOM 0 HG LEU A 88 -7.667 0.416 4.613 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -5.405 0.050 3.589 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -6.358 -1.453 3.588 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -6.187 -0.506 2.091 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -6.525 2.246 3.441 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -7.271 1.734 1.909 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -8.290 2.339 3.236 1.00 0.00 H new ATOM 1397 N LYS A 89 -11.663 -1.528 2.556 1.00 0.00 N ATOM 1398 CA LYS A 89 -12.754 -2.173 1.801 1.00 0.00 C ATOM 1399 C LYS A 89 -14.078 -1.422 1.979 1.00 0.00 C ATOM 1400 O LYS A 89 -14.716 -1.044 0.995 1.00 0.00 O ATOM 1401 CB LYS A 89 -12.876 -3.646 2.232 1.00 0.00 C ATOM 1402 CG LYS A 89 -13.911 -4.412 1.392 1.00 0.00 C ATOM 1403 CD LYS A 89 -14.115 -5.828 1.943 1.00 0.00 C ATOM 1404 CE LYS A 89 -15.005 -6.691 1.037 1.00 0.00 C ATOM 1405 NZ LYS A 89 -16.417 -6.219 1.000 1.00 0.00 N ATOM 0 H LYS A 89 -11.258 -2.144 3.261 1.00 0.00 H new ATOM 0 HA LYS A 89 -12.516 -2.138 0.738 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -11.904 -4.132 2.140 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -13.157 -3.693 3.284 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -14.859 -3.875 1.396 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -13.579 -4.464 0.355 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -13.145 -6.311 2.061 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -14.563 -5.767 2.935 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -14.599 -6.688 0.026 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -14.980 -7.723 1.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -16.973 -6.836 0.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -16.818 -6.247 1.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -16.448 -5.244 0.640 1.00 0.00 H new ATOM 1419 N ASN A 90 -14.481 -1.212 3.231 1.00 0.00 N ATOM 1420 CA ASN A 90 -15.697 -0.510 3.635 1.00 0.00 C ATOM 1421 C ASN A 90 -15.335 0.741 4.453 1.00 0.00 C ATOM 1422 O ASN A 90 -15.203 0.685 5.679 1.00 0.00 O ATOM 1423 CB ASN A 90 -16.624 -1.470 4.402 1.00 0.00 C ATOM 1424 CG ASN A 90 -17.912 -0.777 4.823 1.00 0.00 C ATOM 1425 OD1 ASN A 90 -18.675 -0.280 4.003 1.00 0.00 O ATOM 1426 ND2 ASN A 90 -18.195 -0.699 6.103 1.00 0.00 N ATOM 0 H ASN A 90 -13.941 -1.543 4.030 1.00 0.00 H new ATOM 0 HA ASN A 90 -16.241 -0.170 2.754 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -16.859 -2.330 3.775 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -16.108 -1.850 5.284 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -19.046 -0.227 6.409 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -17.564 -1.111 6.791 1.00 0.00 H new ATOM 1433 N ALA A 91 -15.187 1.876 3.766 1.00 0.00 N ATOM 1434 CA ALA A 91 -14.869 3.161 4.383 1.00 0.00 C ATOM 1435 C ALA A 91 -15.997 3.601 5.335 1.00 0.00 C ATOM 1436 O ALA A 91 -17.139 3.772 4.907 1.00 0.00 O ATOM 1437 CB ALA A 91 -14.619 4.186 3.269 1.00 0.00 C ATOM 0 H ALA A 91 -15.286 1.927 2.752 1.00 0.00 H new ATOM 0 HA ALA A 91 -13.968 3.076 4.990 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -14.380 5.153 3.711 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -13.786 3.854 2.650 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -15.514 4.280 2.654 1.00 0.00 H new ATOM 1443 N SER A 92 -15.690 3.762 6.628 1.00 0.00 N ATOM 1444 CA SER A 92 -16.651 4.173 7.667 1.00 0.00 C ATOM 1445 C SER A 92 -17.330 5.506 7.317 1.00 0.00 C ATOM 1446 O SER A 92 -18.554 5.629 7.387 1.00 0.00 O ATOM 1447 CB SER A 92 -15.977 4.270 9.043 1.00 0.00 C ATOM 1448 OG SER A 92 -15.212 3.105 9.317 1.00 0.00 O ATOM 0 H SER A 92 -14.749 3.608 6.991 1.00 0.00 H new ATOM 0 HA SER A 92 -17.419 3.401 7.710 1.00 0.00 H new ATOM 0 HB2 SER A 92 -15.333 5.149 9.075 1.00 0.00 H new ATOM 0 HB3 SER A 92 -16.735 4.402 9.815 1.00 0.00 H new ATOM 0 HG SER A 92 -14.791 3.190 10.198 1.00 0.00 H new ATOM 1454 N ASP A 93 -16.535 6.498 6.904 1.00 0.00 N ATOM 1455 CA ASP A 93 -16.999 7.807 6.433 1.00 0.00 C ATOM 1456 C ASP A 93 -17.511 7.701 4.980 1.00 0.00 C ATOM 1457 O ASP A 93 -16.771 7.284 4.083 1.00 0.00 O ATOM 1458 CB ASP A 93 -15.845 8.815 6.529 1.00 0.00 C ATOM 1459 CG ASP A 93 -16.260 10.201 6.006 1.00 0.00 C ATOM 1460 OD1 ASP A 93 -17.205 10.800 6.574 1.00 0.00 O ATOM 1461 OD2 ASP A 93 -15.645 10.697 5.032 1.00 0.00 O ATOM 0 H ASP A 93 -15.519 6.409 6.888 1.00 0.00 H new ATOM 0 HA ASP A 93 -17.824 8.148 7.058 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -15.520 8.899 7.566 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -14.993 8.449 5.956 1.00 0.00 H new ATOM 1466 N LYS A 94 -18.774 8.085 4.747 1.00 0.00 N ATOM 1467 CA LYS A 94 -19.459 8.066 3.439 1.00 0.00 C ATOM 1468 C LYS A 94 -20.270 9.351 3.213 1.00 0.00 C ATOM 1469 O LYS A 94 -20.751 9.964 4.173 1.00 0.00 O ATOM 1470 CB LYS A 94 -20.373 6.828 3.320 1.00 0.00 C ATOM 1471 CG LYS A 94 -19.612 5.497 3.438 1.00 0.00 C ATOM 1472 CD LYS A 94 -20.518 4.287 3.162 1.00 0.00 C ATOM 1473 CE LYS A 94 -19.721 2.997 3.381 1.00 0.00 C ATOM 1474 NZ LYS A 94 -20.530 1.780 3.112 1.00 0.00 N ATOM 0 H LYS A 94 -19.375 8.433 5.494 1.00 0.00 H new ATOM 0 HA LYS A 94 -18.692 8.011 2.666 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -21.136 6.872 4.097 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -20.892 6.858 2.362 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -18.778 5.493 2.736 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -19.187 5.410 4.438 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -21.385 4.309 3.823 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -20.895 4.326 2.140 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -18.846 2.999 2.732 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -19.356 2.968 4.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -19.989 0.936 3.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -21.411 1.820 3.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -20.757 1.731 2.098 1.00 0.00 H new ATOM 1488 N ARG A 95 -20.431 9.744 1.944 1.00 0.00 N ATOM 1489 CA ARG A 95 -21.171 10.932 1.467 1.00 0.00 C ATOM 1490 C ARG A 95 -22.050 10.598 0.255 1.00 0.00 C ATOM 1491 O ARG A 95 -21.558 9.924 -0.680 1.00 0.00 O ATOM 1492 CB ARG A 95 -20.198 12.081 1.134 1.00 0.00 C ATOM 1493 CG ARG A 95 -19.458 12.640 2.363 1.00 0.00 C ATOM 1494 CD ARG A 95 -18.525 13.809 2.012 1.00 0.00 C ATOM 1495 NE ARG A 95 -19.263 15.003 1.551 1.00 0.00 N ATOM 1496 CZ ARG A 95 -19.381 15.468 0.321 1.00 0.00 C ATOM 1497 NH1 ARG A 95 -18.823 14.891 -0.706 1.00 0.00 N ATOM 1498 NH2 ARG A 95 -20.080 16.540 0.092 1.00 0.00 N ATOM 1499 OXT ARG A 95 -23.235 11.001 0.255 1.00 0.00 O ATOM 0 H ARG A 95 -20.027 9.214 1.172 1.00 0.00 H new ATOM 0 HA ARG A 95 -21.829 11.257 2.273 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -19.465 11.726 0.410 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -20.753 12.889 0.656 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -20.188 12.972 3.101 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -18.876 11.843 2.826 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -17.929 14.069 2.887 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -17.829 13.493 1.235 1.00 0.00 H new ATOM 0 HE ARG A 95 -19.743 15.536 2.276 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -18.268 14.045 -0.577 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -18.941 15.286 -1.639 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -20.539 17.024 0.864 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -20.169 16.897 -0.859 1.00 0.00 H new TER 1513 ARG A 95 ATOM 1514 N SER B 99 -10.424 14.715 6.692 1.00 0.00 N ATOM 1515 CA SER B 99 -9.341 14.635 5.685 1.00 0.00 C ATOM 1516 C SER B 99 -9.538 13.418 4.777 1.00 0.00 C ATOM 1517 O SER B 99 -10.088 13.555 3.684 1.00 0.00 O ATOM 1518 CB SER B 99 -7.957 14.664 6.350 1.00 0.00 C ATOM 1519 OG SER B 99 -7.879 13.705 7.397 1.00 0.00 O ATOM 0 HA SER B 99 -9.391 15.519 5.049 1.00 0.00 H new ATOM 0 HB2 SER B 99 -7.187 14.460 5.606 1.00 0.00 H new ATOM 0 HB3 SER B 99 -7.760 15.660 6.748 1.00 0.00 H new ATOM 0 HG SER B 99 -8.762 13.596 7.807 1.00 0.00 H new ATOM 1527 N ASP B 100 -9.123 12.222 5.207 1.00 0.00 N ATOM 1528 CA ASP B 100 -9.245 10.942 4.494 1.00 0.00 C ATOM 1529 C ASP B 100 -9.447 9.785 5.495 1.00 0.00 C ATOM 1530 O ASP B 100 -8.847 9.779 6.575 1.00 0.00 O ATOM 1531 CB ASP B 100 -7.997 10.729 3.627 1.00 0.00 C ATOM 1532 CG ASP B 100 -8.010 9.357 2.948 1.00 0.00 C ATOM 1533 OD1 ASP B 100 -8.683 9.197 1.903 1.00 0.00 O ATOM 1534 OD2 ASP B 100 -7.354 8.426 3.464 1.00 0.00 O ATOM 0 H ASP B 100 -8.667 12.113 6.113 1.00 0.00 H new ATOM 0 HA ASP B 100 -10.120 10.963 3.844 1.00 0.00 H new ATOM 0 HB2 ASP B 100 -7.942 11.510 2.869 1.00 0.00 H new ATOM 0 HB3 ASP B 100 -7.104 10.821 4.245 1.00 0.00 H new ATOM 1539 N LEU B 101 -10.304 8.816 5.148 1.00 0.00 N ATOM 1540 CA LEU B 101 -10.657 7.673 5.997 1.00 0.00 C ATOM 1541 C LEU B 101 -9.447 6.785 6.321 1.00 0.00 C ATOM 1542 O LEU B 101 -9.161 6.561 7.494 1.00 0.00 O ATOM 1543 CB LEU B 101 -11.835 6.903 5.361 1.00 0.00 C ATOM 1544 CG LEU B 101 -12.480 5.775 6.198 1.00 0.00 C ATOM 1545 CD1 LEU B 101 -11.705 4.458 6.162 1.00 0.00 C ATOM 1546 CD2 LEU B 101 -12.732 6.160 7.657 1.00 0.00 C ATOM 0 H LEU B 101 -10.782 8.806 4.247 1.00 0.00 H new ATOM 0 HA LEU B 101 -10.988 8.044 6.967 1.00 0.00 H new ATOM 0 HB2 LEU B 101 -12.613 7.624 5.111 1.00 0.00 H new ATOM 0 HB3 LEU B 101 -11.488 6.470 4.423 1.00 0.00 H new ATOM 0 HG LEU B 101 -13.441 5.623 5.706 1.00 0.00 H new ATOM 0 HD11 LEU B 101 -12.220 3.716 6.773 1.00 0.00 H new ATOM 0 HD12 LEU B 101 -11.642 4.101 5.134 1.00 0.00 H new ATOM 0 HD13 LEU B 101 -10.700 4.616 6.554 1.00 0.00 H new ATOM 0 HD21 LEU B 101 -13.186 5.319 8.182 1.00 0.00 H new ATOM 0 HD22 LEU B 101 -11.786 6.418 8.134 1.00 0.00 H new ATOM 0 HD23 LEU B 101 -13.404 7.018 7.696 1.00 0.00 H new ATOM 1558 N ALA B 102 -8.725 6.290 5.311 1.00 0.00 N ATOM 1559 CA ALA B 102 -7.539 5.447 5.499 1.00 0.00 C ATOM 1560 C ALA B 102 -6.505 6.110 6.427 1.00 0.00 C ATOM 1561 O ALA B 102 -5.976 5.467 7.337 1.00 0.00 O ATOM 1562 CB ALA B 102 -6.919 5.127 4.136 1.00 0.00 C ATOM 0 H ALA B 102 -8.949 6.464 4.331 1.00 0.00 H new ATOM 0 HA ALA B 102 -7.851 4.521 5.982 1.00 0.00 H new ATOM 0 HB1 ALA B 102 -6.038 4.501 4.275 1.00 0.00 H new ATOM 0 HB2 ALA B 102 -7.647 4.598 3.520 1.00 0.00 H new ATOM 0 HB3 ALA B 102 -6.631 6.054 3.641 1.00 0.00 H new ATOM 1568 N CYS B 103 -6.242 7.398 6.191 1.00 0.00 N ATOM 1569 CA CYS B 103 -5.302 8.249 6.924 1.00 0.00 C ATOM 1570 C CYS B 103 -5.677 8.564 8.391 1.00 0.00 C ATOM 1571 O CYS B 103 -4.941 9.321 9.033 1.00 0.00 O ATOM 1572 CB CYS B 103 -5.101 9.550 6.129 1.00 0.00 C ATOM 1573 SG CYS B 103 -4.451 9.200 4.466 1.00 0.00 S ATOM 0 H CYS B 103 -6.708 7.904 5.438 1.00 0.00 H new ATOM 0 HA CYS B 103 -4.379 7.675 7.008 1.00 0.00 H new ATOM 0 HB2 CYS B 103 -6.049 10.082 6.049 1.00 0.00 H new ATOM 0 HB3 CYS B 103 -4.412 10.205 6.663 1.00 0.00 H new ATOM 0 HG CYS B 103 -5.426 8.837 3.686 1.00 0.00 H new ATOM 1579 N ARG B 104 -6.780 8.024 8.945 1.00 0.00 N ATOM 1580 CA ARG B 104 -7.217 8.266 10.340 1.00 0.00 C ATOM 1581 C ARG B 104 -6.075 8.075 11.353 1.00 0.00 C ATOM 1582 O ARG B 104 -5.484 6.999 11.449 1.00 0.00 O ATOM 1583 CB ARG B 104 -8.498 7.475 10.695 1.00 0.00 C ATOM 1584 CG ARG B 104 -8.361 5.995 11.106 1.00 0.00 C ATOM 1585 CD ARG B 104 -7.694 5.090 10.064 1.00 0.00 C ATOM 1586 NE ARG B 104 -7.618 3.696 10.530 1.00 0.00 N ATOM 1587 CZ ARG B 104 -7.028 2.691 9.912 1.00 0.00 C ATOM 1588 NH1 ARG B 104 -6.382 2.850 8.790 1.00 0.00 N ATOM 1589 NH2 ARG B 104 -7.088 1.499 10.430 1.00 0.00 N ATOM 0 H ARG B 104 -7.402 7.399 8.433 1.00 0.00 H new ATOM 0 HA ARG B 104 -7.492 9.318 10.410 1.00 0.00 H new ATOM 0 HB2 ARG B 104 -8.996 8.000 11.510 1.00 0.00 H new ATOM 0 HB3 ARG B 104 -9.164 7.519 9.833 1.00 0.00 H new ATOM 0 HG2 ARG B 104 -7.787 5.943 12.031 1.00 0.00 H new ATOM 0 HG3 ARG B 104 -9.354 5.601 11.324 1.00 0.00 H new ATOM 0 HD2 ARG B 104 -8.256 5.133 9.131 1.00 0.00 H new ATOM 0 HD3 ARG B 104 -6.691 5.458 9.850 1.00 0.00 H new ATOM 0 HE ARG B 104 -8.067 3.486 11.421 1.00 0.00 H new ATOM 0 HH11 ARG B 104 -6.321 3.774 8.363 1.00 0.00 H new ATOM 0 HH12 ARG B 104 -5.938 2.050 8.340 1.00 0.00 H new ATOM 0 HH21 ARG B 104 -7.588 1.348 11.306 1.00 0.00 H new ATOM 0 HH22 ARG B 104 -6.635 0.715 9.960 1.00 0.00 H new ATOM 1603 N LEU B 105 -5.745 9.152 12.070 1.00 0.00 N ATOM 1604 CA LEU B 105 -4.643 9.279 13.033 1.00 0.00 C ATOM 1605 C LEU B 105 -3.357 8.530 12.620 1.00 0.00 C ATOM 1606 O LEU B 105 -2.844 7.697 13.371 1.00 0.00 O ATOM 1607 CB LEU B 105 -5.092 8.909 14.464 1.00 0.00 C ATOM 1608 CG LEU B 105 -6.332 9.615 15.022 1.00 0.00 C ATOM 1609 CD1 LEU B 105 -6.558 9.182 16.471 1.00 0.00 C ATOM 1610 CD2 LEU B 105 -6.216 11.141 14.990 1.00 0.00 C ATOM 0 H LEU B 105 -6.276 10.019 11.989 1.00 0.00 H new ATOM 0 HA LEU B 105 -4.372 10.335 13.029 1.00 0.00 H new ATOM 0 HB2 LEU B 105 -5.276 7.835 14.492 1.00 0.00 H new ATOM 0 HB3 LEU B 105 -4.260 9.107 15.139 1.00 0.00 H new ATOM 0 HG LEU B 105 -7.168 9.328 14.384 1.00 0.00 H new ATOM 0 HD11 LEU B 105 -7.440 9.685 16.868 1.00 0.00 H new ATOM 0 HD12 LEU B 105 -6.707 8.103 16.509 1.00 0.00 H new ATOM 0 HD13 LEU B 105 -5.688 9.449 17.071 1.00 0.00 H new ATOM 0 HD21 LEU B 105 -7.125 11.584 15.398 1.00 0.00 H new ATOM 0 HD22 LEU B 105 -5.360 11.453 15.588 1.00 0.00 H new ATOM 0 HD23 LEU B 105 -6.081 11.474 13.961 1.00 0.00 H new ATOM 1622 N LEU B 106 -2.790 8.863 11.455 1.00 0.00 N ATOM 1623 CA LEU B 106 -1.490 8.325 11.013 1.00 0.00 C ATOM 1624 C LEU B 106 -0.385 8.628 12.046 1.00 0.00 C ATOM 1625 O LEU B 106 0.505 7.803 12.264 1.00 0.00 O ATOM 1626 CB LEU B 106 -1.135 8.862 9.614 1.00 0.00 C ATOM 1627 CG LEU B 106 -1.626 7.980 8.449 1.00 0.00 C ATOM 1628 CD1 LEU B 106 -1.490 8.769 7.151 1.00 0.00 C ATOM 1629 CD2 LEU B 106 -0.755 6.727 8.325 1.00 0.00 C ATOM 0 H LEU B 106 -3.214 9.511 10.791 1.00 0.00 H new ATOM 0 HA LEU B 106 -1.568 7.240 10.940 1.00 0.00 H new ATOM 0 HB2 LEU B 106 -1.560 9.859 9.503 1.00 0.00 H new ATOM 0 HB3 LEU B 106 -0.052 8.967 9.543 1.00 0.00 H new ATOM 0 HG LEU B 106 -2.661 7.693 8.636 1.00 0.00 H new ATOM 0 HD11 LEU B 106 -1.834 8.158 6.316 1.00 0.00 H new ATOM 0 HD12 LEU B 106 -2.094 9.675 7.211 1.00 0.00 H new ATOM 0 HD13 LEU B 106 -0.445 9.039 6.997 1.00 0.00 H new ATOM 0 HD21 LEU B 106 -1.114 6.114 7.498 1.00 0.00 H new ATOM 0 HD22 LEU B 106 0.278 7.019 8.138 1.00 0.00 H new ATOM 0 HD23 LEU B 106 -0.808 6.154 9.251 1.00 0.00 H new ATOM 1641 N GLY B 107 -0.481 9.790 12.711 1.00 0.00 N ATOM 1642 CA GLY B 107 0.375 10.276 13.803 1.00 0.00 C ATOM 1643 C GLY B 107 0.749 9.198 14.831 1.00 0.00 C ATOM 1644 O GLY B 107 1.900 9.146 15.266 1.00 0.00 O ATOM 0 H GLY B 107 -1.213 10.463 12.482 1.00 0.00 H new ATOM 0 HA2 GLY B 107 1.289 10.690 13.377 1.00 0.00 H new ATOM 0 HA3 GLY B 107 -0.136 11.091 14.316 1.00 0.00 H new ATOM 1648 N GLN B 108 -0.207 8.323 15.177 1.00 0.00 N ATOM 1649 CA GLN B 108 -0.062 7.168 16.078 1.00 0.00 C ATOM 1650 C GLN B 108 1.248 6.398 15.832 1.00 0.00 C ATOM 1651 O GLN B 108 2.058 6.204 16.741 1.00 0.00 O ATOM 1652 CB GLN B 108 -1.236 6.198 15.850 1.00 0.00 C ATOM 1653 CG GLN B 108 -2.595 6.656 16.407 1.00 0.00 C ATOM 1654 CD GLN B 108 -3.672 5.616 16.106 1.00 0.00 C ATOM 1655 OE1 GLN B 108 -4.159 4.905 16.978 1.00 0.00 O ATOM 1656 NE2 GLN B 108 -4.080 5.483 14.861 1.00 0.00 N ATOM 0 H GLN B 108 -1.157 8.407 14.815 1.00 0.00 H new ATOM 0 HA GLN B 108 -0.051 7.551 17.098 1.00 0.00 H new ATOM 0 HB2 GLN B 108 -1.341 6.029 14.778 1.00 0.00 H new ATOM 0 HB3 GLN B 108 -0.984 5.238 16.301 1.00 0.00 H new ATOM 0 HG2 GLN B 108 -2.521 6.810 17.483 1.00 0.00 H new ATOM 0 HG3 GLN B 108 -2.872 7.614 15.966 1.00 0.00 H new ATOM 0 HE21 GLN B 108 -3.681 6.070 14.128 1.00 0.00 H new ATOM 0 HE22 GLN B 108 -4.795 4.793 14.630 1.00 0.00 H new ATOM 1665 N SER B 109 1.423 5.946 14.590 1.00 0.00 N ATOM 1666 CA SER B 109 2.553 5.152 14.103 1.00 0.00 C ATOM 1667 C SER B 109 3.685 6.018 13.534 1.00 0.00 C ATOM 1668 O SER B 109 4.854 5.678 13.707 1.00 0.00 O ATOM 1669 CB SER B 109 2.050 4.185 13.033 1.00 0.00 C ATOM 1670 OG SER B 109 1.048 3.326 13.551 1.00 0.00 O ATOM 0 H SER B 109 0.742 6.134 13.855 1.00 0.00 H new ATOM 0 HA SER B 109 2.970 4.609 14.951 1.00 0.00 H new ATOM 0 HB2 SER B 109 1.650 4.747 12.189 1.00 0.00 H new ATOM 0 HB3 SER B 109 2.882 3.591 12.655 1.00 0.00 H new ATOM 0 HG SER B 109 1.030 2.494 13.033 1.00 0.00 H new ATOM 1676 N MET B 110 3.361 7.138 12.869 1.00 0.00 N ATOM 1677 CA MET B 110 4.331 8.088 12.286 1.00 0.00 C ATOM 1678 C MET B 110 5.351 8.613 13.312 1.00 0.00 C ATOM 1679 O MET B 110 6.498 8.888 12.958 1.00 0.00 O ATOM 1680 CB MET B 110 3.604 9.280 11.642 1.00 0.00 C ATOM 1681 CG MET B 110 2.748 8.922 10.419 1.00 0.00 C ATOM 1682 SD MET B 110 3.476 9.228 8.783 1.00 0.00 S ATOM 1683 CE MET B 110 4.975 8.218 8.879 1.00 0.00 C ATOM 0 H MET B 110 2.392 7.418 12.716 1.00 0.00 H new ATOM 0 HA MET B 110 4.881 7.530 11.529 1.00 0.00 H new ATOM 0 HB2 MET B 110 2.965 9.747 12.392 1.00 0.00 H new ATOM 0 HB3 MET B 110 4.344 10.023 11.346 1.00 0.00 H new ATOM 0 HG2 MET B 110 2.492 7.864 10.483 1.00 0.00 H new ATOM 0 HG3 MET B 110 1.814 9.481 10.484 1.00 0.00 H new ATOM 0 HE1 MET B 110 5.408 8.114 7.884 1.00 0.00 H new ATOM 0 HE2 MET B 110 5.696 8.699 9.540 1.00 0.00 H new ATOM 0 HE3 MET B 110 4.725 7.232 9.270 1.00 0.00 H new ATOM 1693 N ASP B 111 4.942 8.747 14.579 1.00 0.00 N ATOM 1694 CA ASP B 111 5.774 9.180 15.710 1.00 0.00 C ATOM 1695 C ASP B 111 7.054 8.334 15.881 1.00 0.00 C ATOM 1696 O ASP B 111 8.100 8.859 16.271 1.00 0.00 O ATOM 1697 CB ASP B 111 4.922 9.141 16.987 1.00 0.00 C ATOM 1698 CG ASP B 111 5.705 9.620 18.223 1.00 0.00 C ATOM 1699 OD1 ASP B 111 5.954 10.843 18.345 1.00 0.00 O ATOM 1700 OD2 ASP B 111 6.050 8.780 19.089 1.00 0.00 O ATOM 0 H ASP B 111 3.981 8.548 14.857 1.00 0.00 H new ATOM 0 HA ASP B 111 6.115 10.195 15.508 1.00 0.00 H new ATOM 0 HB2 ASP B 111 4.040 9.767 16.853 1.00 0.00 H new ATOM 0 HB3 ASP B 111 4.568 8.124 17.155 1.00 0.00 H new ATOM 1705 N GLU B 112 6.993 7.031 15.579 1.00 0.00 N ATOM 1706 CA GLU B 112 8.125 6.101 15.654 1.00 0.00 C ATOM 1707 C GLU B 112 9.101 6.318 14.478 1.00 0.00 C ATOM 1708 O GLU B 112 8.974 5.705 13.414 1.00 0.00 O ATOM 1709 CB GLU B 112 7.626 4.646 15.709 1.00 0.00 C ATOM 1710 CG GLU B 112 6.833 4.352 16.990 1.00 0.00 C ATOM 1711 CD GLU B 112 6.467 2.860 17.078 1.00 0.00 C ATOM 1712 OE1 GLU B 112 7.375 2.031 17.337 1.00 0.00 O ATOM 1713 OE2 GLU B 112 5.274 2.512 16.910 1.00 0.00 O ATOM 0 H GLU B 112 6.131 6.583 15.267 1.00 0.00 H new ATOM 0 HA GLU B 112 8.674 6.303 16.574 1.00 0.00 H new ATOM 0 HB2 GLU B 112 6.998 4.446 14.841 1.00 0.00 H new ATOM 0 HB3 GLU B 112 8.478 3.969 15.648 1.00 0.00 H new ATOM 0 HG2 GLU B 112 7.422 4.638 17.861 1.00 0.00 H new ATOM 0 HG3 GLU B 112 5.925 4.955 17.007 1.00 0.00 H new ATOM 1720 N SER B 113 10.082 7.208 14.682 1.00 0.00 N ATOM 1721 CA SER B 113 11.149 7.626 13.751 1.00 0.00 C ATOM 1722 C SER B 113 10.658 8.421 12.526 1.00 0.00 C ATOM 1723 O SER B 113 11.096 9.553 12.305 1.00 0.00 O ATOM 1724 CB SER B 113 12.033 6.442 13.318 1.00 0.00 C ATOM 1725 OG SER B 113 12.558 5.739 14.439 1.00 0.00 O ATOM 0 H SER B 113 10.159 7.696 15.574 1.00 0.00 H new ATOM 0 HA SER B 113 11.756 8.322 14.330 1.00 0.00 H new ATOM 0 HB2 SER B 113 11.449 5.759 12.701 1.00 0.00 H new ATOM 0 HB3 SER B 113 12.854 6.807 12.701 1.00 0.00 H new ATOM 0 HG SER B 113 13.112 4.993 14.127 1.00 0.00 H new ATOM 1731 N GLY B 114 9.771 7.835 11.723 1.00 0.00 N ATOM 1732 CA GLY B 114 9.190 8.388 10.496 1.00 0.00 C ATOM 1733 C GLY B 114 8.823 7.251 9.544 1.00 0.00 C ATOM 1734 O GLY B 114 7.666 6.842 9.469 1.00 0.00 O ATOM 0 H GLY B 114 9.415 6.901 11.923 1.00 0.00 H new ATOM 0 HA2 GLY B 114 8.304 8.976 10.734 1.00 0.00 H new ATOM 0 HA3 GLY B 114 9.900 9.062 10.017 1.00 0.00 H new ATOM 1738 N LEU B 115 9.833 6.703 8.862 1.00 0.00 N ATOM 1739 CA LEU B 115 9.735 5.545 7.965 1.00 0.00 C ATOM 1740 C LEU B 115 10.702 4.449 8.464 1.00 0.00 C ATOM 1741 O LEU B 115 11.895 4.732 8.632 1.00 0.00 O ATOM 1742 CB LEU B 115 10.046 5.945 6.511 1.00 0.00 C ATOM 1743 CG LEU B 115 9.056 6.933 5.869 1.00 0.00 C ATOM 1744 CD1 LEU B 115 9.528 7.261 4.453 1.00 0.00 C ATOM 1745 CD2 LEU B 115 7.637 6.378 5.761 1.00 0.00 C ATOM 0 H LEU B 115 10.783 7.069 8.922 1.00 0.00 H new ATOM 0 HA LEU B 115 8.716 5.159 7.977 1.00 0.00 H new ATOM 0 HB2 LEU B 115 11.043 6.384 6.479 1.00 0.00 H new ATOM 0 HB3 LEU B 115 10.076 5.041 5.903 1.00 0.00 H new ATOM 0 HG LEU B 115 9.030 7.812 6.514 1.00 0.00 H new ATOM 0 HD11 LEU B 115 8.832 7.961 3.990 1.00 0.00 H new ATOM 0 HD12 LEU B 115 10.520 7.710 4.495 1.00 0.00 H new ATOM 0 HD13 LEU B 115 9.569 6.346 3.862 1.00 0.00 H new ATOM 0 HD21 LEU B 115 6.989 7.123 5.300 1.00 0.00 H new ATOM 0 HD22 LEU B 115 7.645 5.476 5.149 1.00 0.00 H new ATOM 0 HD23 LEU B 115 7.263 6.138 6.756 1.00 0.00 H new ATOM 1757 N PRO B 116 10.226 3.217 8.729 1.00 0.00 N ATOM 1758 CA PRO B 116 11.048 2.124 9.245 1.00 0.00 C ATOM 1759 C PRO B 116 11.845 1.405 8.143 1.00 0.00 C ATOM 1760 O PRO B 116 11.709 1.689 6.950 1.00 0.00 O ATOM 1761 CB PRO B 116 10.023 1.174 9.878 1.00 0.00 C ATOM 1762 CG PRO B 116 8.853 1.276 8.901 1.00 0.00 C ATOM 1763 CD PRO B 116 8.846 2.769 8.576 1.00 0.00 C ATOM 0 HA PRO B 116 11.804 2.484 9.942 1.00 0.00 H new ATOM 0 HB2 PRO B 116 10.403 0.155 9.955 1.00 0.00 H new ATOM 0 HB3 PRO B 116 9.743 1.487 10.884 1.00 0.00 H new ATOM 0 HG2 PRO B 116 9.008 0.665 8.012 1.00 0.00 H new ATOM 0 HG3 PRO B 116 7.915 0.951 9.351 1.00 0.00 H new ATOM 0 HD2 PRO B 116 8.488 2.947 7.562 1.00 0.00 H new ATOM 0 HD3 PRO B 116 8.182 3.312 9.248 1.00 0.00 H new ATOM 1771 N GLN B 117 12.630 0.405 8.553 1.00 0.00 N ATOM 1772 CA GLN B 117 13.374 -0.502 7.675 1.00 0.00 C ATOM 1773 C GLN B 117 12.839 -1.929 7.854 1.00 0.00 C ATOM 1774 O GLN B 117 13.545 -2.856 8.260 1.00 0.00 O ATOM 1775 CB GLN B 117 14.892 -0.365 7.889 1.00 0.00 C ATOM 1776 CG GLN B 117 15.421 0.921 7.241 1.00 0.00 C ATOM 1777 CD GLN B 117 16.923 1.093 7.457 1.00 0.00 C ATOM 1778 OE1 GLN B 117 17.744 0.803 6.593 1.00 0.00 O ATOM 1779 NE2 GLN B 117 17.347 1.571 8.608 1.00 0.00 N ATOM 0 H GLN B 117 12.770 0.197 9.542 1.00 0.00 H new ATOM 0 HA GLN B 117 13.215 -0.231 6.631 1.00 0.00 H new ATOM 0 HB2 GLN B 117 15.114 -0.357 8.956 1.00 0.00 H new ATOM 0 HB3 GLN B 117 15.403 -1.229 7.463 1.00 0.00 H new ATOM 0 HG2 GLN B 117 15.208 0.903 6.172 1.00 0.00 H new ATOM 0 HG3 GLN B 117 14.894 1.780 7.657 1.00 0.00 H new ATOM 0 HE21 GLN B 117 16.676 1.817 9.336 1.00 0.00 H new ATOM 0 HE22 GLN B 117 18.346 1.696 8.772 1.00 0.00 H new ATOM 1788 N LEU B 118 11.556 -2.089 7.510 1.00 0.00 N ATOM 1789 CA LEU B 118 10.860 -3.374 7.473 1.00 0.00 C ATOM 1790 C LEU B 118 11.402 -4.204 6.292 1.00 0.00 C ATOM 1791 O LEU B 118 12.107 -3.697 5.412 1.00 0.00 O ATOM 1792 CB LEU B 118 9.340 -3.141 7.339 1.00 0.00 C ATOM 1793 CG LEU B 118 8.655 -2.525 8.572 1.00 0.00 C ATOM 1794 CD1 LEU B 118 7.236 -2.093 8.202 1.00 0.00 C ATOM 1795 CD2 LEU B 118 8.557 -3.499 9.746 1.00 0.00 C ATOM 0 H LEU B 118 10.960 -1.305 7.243 1.00 0.00 H new ATOM 0 HA LEU B 118 11.036 -3.924 8.398 1.00 0.00 H new ATOM 0 HB2 LEU B 118 9.164 -2.489 6.483 1.00 0.00 H new ATOM 0 HB3 LEU B 118 8.862 -4.095 7.117 1.00 0.00 H new ATOM 0 HG LEU B 118 9.269 -1.679 8.880 1.00 0.00 H new ATOM 0 HD11 LEU B 118 6.749 -1.657 9.074 1.00 0.00 H new ATOM 0 HD12 LEU B 118 7.278 -1.354 7.402 1.00 0.00 H new ATOM 0 HD13 LEU B 118 6.668 -2.960 7.866 1.00 0.00 H new ATOM 0 HD21 LEU B 118 8.065 -3.008 10.586 1.00 0.00 H new ATOM 0 HD22 LEU B 118 7.978 -4.373 9.447 1.00 0.00 H new ATOM 0 HD23 LEU B 118 9.558 -3.812 10.044 1.00 0.00 H new ATOM 1807 N THR B 119 11.079 -5.492 6.270 1.00 0.00 N ATOM 1808 CA THR B 119 11.507 -6.442 5.234 1.00 0.00 C ATOM 1809 C THR B 119 10.370 -7.390 4.869 1.00 0.00 C ATOM 1810 O THR B 119 9.366 -7.481 5.580 1.00 0.00 O ATOM 1811 CB THR B 119 12.731 -7.259 5.696 1.00 0.00 C ATOM 1812 OG1 THR B 119 12.426 -8.005 6.859 1.00 0.00 O ATOM 1813 CG2 THR B 119 13.953 -6.381 5.987 1.00 0.00 C ATOM 0 H THR B 119 10.497 -5.922 6.989 1.00 0.00 H new ATOM 0 HA THR B 119 11.787 -5.862 4.355 1.00 0.00 H new ATOM 0 HB THR B 119 12.977 -7.926 4.870 1.00 0.00 H new ATOM 0 HG1 THR B 119 13.214 -8.518 7.135 1.00 0.00 H new ATOM 0 HG21 THR B 119 14.784 -7.009 6.308 1.00 0.00 H new ATOM 0 HG22 THR B 119 14.235 -5.839 5.084 1.00 0.00 H new ATOM 0 HG23 THR B 119 13.710 -5.669 6.776 1.00 0.00 H new ATOM 1821 N SER B 120 10.545 -8.142 3.779 1.00 0.00 N ATOM 1822 CA SER B 120 9.612 -9.186 3.335 1.00 0.00 C ATOM 1823 C SER B 120 9.338 -10.149 4.495 1.00 0.00 C ATOM 1824 O SER B 120 8.184 -10.337 4.873 1.00 0.00 O ATOM 1825 CB SER B 120 10.166 -9.918 2.106 1.00 0.00 C ATOM 1826 OG SER B 120 11.534 -10.255 2.298 1.00 0.00 O ATOM 0 H SER B 120 11.355 -8.042 3.167 1.00 0.00 H new ATOM 0 HA SER B 120 8.668 -8.730 3.037 1.00 0.00 H new ATOM 0 HB2 SER B 120 9.586 -10.822 1.922 1.00 0.00 H new ATOM 0 HB3 SER B 120 10.062 -9.288 1.223 1.00 0.00 H new ATOM 0 HG SER B 120 11.870 -10.723 1.505 1.00 0.00 H new ATOM 1832 N TYR B 121 10.399 -10.689 5.109 1.00 0.00 N ATOM 1833 CA TYR B 121 10.348 -11.555 6.288 1.00 0.00 C ATOM 1834 C TYR B 121 9.521 -10.937 7.429 1.00 0.00 C ATOM 1835 O TYR B 121 8.548 -11.549 7.869 1.00 0.00 O ATOM 1836 CB TYR B 121 11.771 -11.899 6.755 1.00 0.00 C ATOM 1837 CG TYR B 121 11.799 -12.860 7.930 1.00 0.00 C ATOM 1838 CD1 TYR B 121 11.825 -14.251 7.702 1.00 0.00 C ATOM 1839 CD2 TYR B 121 11.752 -12.368 9.250 1.00 0.00 C ATOM 1840 CE1 TYR B 121 11.803 -15.146 8.789 1.00 0.00 C ATOM 1841 CE2 TYR B 121 11.710 -13.260 10.339 1.00 0.00 C ATOM 1842 CZ TYR B 121 11.741 -14.653 10.111 1.00 0.00 C ATOM 1843 OH TYR B 121 11.700 -15.511 11.168 1.00 0.00 O ATOM 0 H TYR B 121 11.352 -10.527 4.783 1.00 0.00 H new ATOM 0 HA TYR B 121 9.841 -12.476 6.001 1.00 0.00 H new ATOM 0 HB2 TYR B 121 12.324 -12.336 5.923 1.00 0.00 H new ATOM 0 HB3 TYR B 121 12.287 -10.980 7.033 1.00 0.00 H new ATOM 0 HD1 TYR B 121 11.862 -14.631 6.692 1.00 0.00 H new ATOM 0 HD2 TYR B 121 11.748 -11.303 9.427 1.00 0.00 H new ATOM 0 HE1 TYR B 121 11.834 -16.211 8.611 1.00 0.00 H new ATOM 0 HE2 TYR B 121 11.654 -12.879 11.348 1.00 0.00 H new ATOM 0 HH TYR B 121 11.661 -15.000 12.003 1.00 0.00 H new ATOM 1853 N ASP B 122 9.880 -9.738 7.910 1.00 0.00 N ATOM 1854 CA ASP B 122 9.168 -9.040 8.993 1.00 0.00 C ATOM 1855 C ASP B 122 7.665 -8.908 8.699 1.00 0.00 C ATOM 1856 O ASP B 122 6.836 -9.290 9.527 1.00 0.00 O ATOM 1857 CB ASP B 122 9.784 -7.654 9.260 1.00 0.00 C ATOM 1858 CG ASP B 122 10.923 -7.658 10.297 1.00 0.00 C ATOM 1859 OD1 ASP B 122 11.634 -8.677 10.460 1.00 0.00 O ATOM 1860 OD2 ASP B 122 11.090 -6.620 10.983 1.00 0.00 O ATOM 0 H ASP B 122 10.683 -9.219 7.554 1.00 0.00 H new ATOM 0 HA ASP B 122 9.280 -9.649 9.890 1.00 0.00 H new ATOM 0 HB2 ASP B 122 10.164 -7.251 8.321 1.00 0.00 H new ATOM 0 HB3 ASP B 122 8.999 -6.980 9.602 1.00 0.00 H new ATOM 1865 N CYS B 123 7.309 -8.382 7.527 1.00 0.00 N ATOM 1866 CA CYS B 123 5.927 -8.204 7.086 1.00 0.00 C ATOM 1867 C CYS B 123 5.171 -9.546 6.988 1.00 0.00 C ATOM 1868 O CYS B 123 4.072 -9.660 7.530 1.00 0.00 O ATOM 1869 CB CYS B 123 5.921 -7.411 5.775 1.00 0.00 C ATOM 1870 SG CYS B 123 6.492 -5.709 6.051 1.00 0.00 S ATOM 0 H CYS B 123 7.992 -8.060 6.841 1.00 0.00 H new ATOM 0 HA CYS B 123 5.380 -7.630 7.834 1.00 0.00 H new ATOM 0 HB2 CYS B 123 6.564 -7.902 5.045 1.00 0.00 H new ATOM 0 HB3 CYS B 123 4.915 -7.399 5.356 1.00 0.00 H new ATOM 0 HG CYS B 123 6.480 -5.059 4.925 1.00 0.00 H new ATOM 1876 N GLU B 124 5.754 -10.567 6.348 1.00 0.00 N ATOM 1877 CA GLU B 124 5.205 -11.932 6.233 1.00 0.00 C ATOM 1878 C GLU B 124 4.890 -12.533 7.613 1.00 0.00 C ATOM 1879 O GLU B 124 3.815 -13.095 7.820 1.00 0.00 O ATOM 1880 CB GLU B 124 6.184 -12.856 5.484 1.00 0.00 C ATOM 1881 CG GLU B 124 6.162 -12.671 3.960 1.00 0.00 C ATOM 1882 CD GLU B 124 7.277 -13.486 3.285 1.00 0.00 C ATOM 1883 OE1 GLU B 124 7.189 -14.739 3.273 1.00 0.00 O ATOM 1884 OE2 GLU B 124 8.239 -12.898 2.740 1.00 0.00 O ATOM 0 H GLU B 124 6.653 -10.466 5.878 1.00 0.00 H new ATOM 0 HA GLU B 124 4.276 -11.856 5.667 1.00 0.00 H new ATOM 0 HB2 GLU B 124 7.195 -12.673 5.849 1.00 0.00 H new ATOM 0 HB3 GLU B 124 5.943 -13.893 5.719 1.00 0.00 H new ATOM 0 HG2 GLU B 124 5.193 -12.980 3.567 1.00 0.00 H new ATOM 0 HG3 GLU B 124 6.282 -11.615 3.717 1.00 0.00 H new ATOM 1891 N VAL B 125 5.828 -12.413 8.555 1.00 0.00 N ATOM 1892 CA VAL B 125 5.734 -12.881 9.945 1.00 0.00 C ATOM 1893 C VAL B 125 4.627 -12.160 10.723 1.00 0.00 C ATOM 1894 O VAL B 125 3.812 -12.804 11.387 1.00 0.00 O ATOM 1895 CB VAL B 125 7.114 -12.712 10.624 1.00 0.00 C ATOM 1896 CG1 VAL B 125 7.095 -12.699 12.156 1.00 0.00 C ATOM 1897 CG2 VAL B 125 8.040 -13.843 10.165 1.00 0.00 C ATOM 0 H VAL B 125 6.723 -11.963 8.361 1.00 0.00 H new ATOM 0 HA VAL B 125 5.459 -13.936 9.944 1.00 0.00 H new ATOM 0 HB VAL B 125 7.466 -11.727 10.317 1.00 0.00 H new ATOM 0 HG11 VAL B 125 8.111 -12.576 12.531 1.00 0.00 H new ATOM 0 HG12 VAL B 125 6.476 -11.872 12.505 1.00 0.00 H new ATOM 0 HG13 VAL B 125 6.684 -13.640 12.523 1.00 0.00 H new ATOM 0 HG21 VAL B 125 9.015 -13.730 10.640 1.00 0.00 H new ATOM 0 HG22 VAL B 125 7.608 -14.804 10.446 1.00 0.00 H new ATOM 0 HG23 VAL B 125 8.157 -13.801 9.082 1.00 0.00 H new ATOM 1907 N ASN B 126 4.611 -10.826 10.685 1.00 0.00 N ATOM 1908 CA ASN B 126 3.675 -9.985 11.436 1.00 0.00 C ATOM 1909 C ASN B 126 2.239 -9.988 10.889 1.00 0.00 C ATOM 1910 O ASN B 126 1.299 -10.059 11.685 1.00 0.00 O ATOM 1911 CB ASN B 126 4.257 -8.568 11.555 1.00 0.00 C ATOM 1912 CG ASN B 126 5.339 -8.517 12.616 1.00 0.00 C ATOM 1913 OD1 ASN B 126 5.087 -8.205 13.765 1.00 0.00 O ATOM 1914 ND2 ASN B 126 6.559 -8.882 12.303 1.00 0.00 N ATOM 0 H ASN B 126 5.265 -10.287 10.117 1.00 0.00 H new ATOM 0 HA ASN B 126 3.571 -10.420 12.430 1.00 0.00 H new ATOM 0 HB2 ASN B 126 4.668 -8.257 10.595 1.00 0.00 H new ATOM 0 HB3 ASN B 126 3.463 -7.864 11.805 1.00 0.00 H new ATOM 0 HD21 ASN B 126 7.285 -8.902 13.019 1.00 0.00 H new ATOM 0 HD22 ASN B 126 6.782 -9.146 11.343 1.00 0.00 H new ATOM 1921 N ALA B 127 2.051 -9.909 9.571 1.00 0.00 N ATOM 1922 CA ALA B 127 0.740 -9.899 8.915 1.00 0.00 C ATOM 1923 C ALA B 127 0.700 -10.870 7.707 1.00 0.00 C ATOM 1924 O ALA B 127 0.735 -10.422 6.553 1.00 0.00 O ATOM 1925 CB ALA B 127 0.402 -8.444 8.553 1.00 0.00 C ATOM 0 H ALA B 127 2.827 -9.849 8.911 1.00 0.00 H new ATOM 0 HA ALA B 127 -0.031 -10.272 9.589 1.00 0.00 H new ATOM 0 HB1 ALA B 127 -0.571 -8.408 8.062 1.00 0.00 H new ATOM 0 HB2 ALA B 127 0.374 -7.841 9.460 1.00 0.00 H new ATOM 0 HB3 ALA B 127 1.163 -8.050 7.879 1.00 0.00 H new ATOM 1931 N PRO B 128 0.609 -12.196 7.948 1.00 0.00 N ATOM 1932 CA PRO B 128 0.561 -13.217 6.898 1.00 0.00 C ATOM 1933 C PRO B 128 -0.563 -13.005 5.874 1.00 0.00 C ATOM 1934 O PRO B 128 -1.712 -12.731 6.233 1.00 0.00 O ATOM 1935 CB PRO B 128 0.379 -14.562 7.616 1.00 0.00 C ATOM 1936 CG PRO B 128 0.877 -14.307 9.034 1.00 0.00 C ATOM 1937 CD PRO B 128 0.557 -12.832 9.261 1.00 0.00 C ATOM 0 HA PRO B 128 1.481 -13.171 6.316 1.00 0.00 H new ATOM 0 HB2 PRO B 128 -0.665 -14.876 7.612 1.00 0.00 H new ATOM 0 HB3 PRO B 128 0.951 -15.352 7.130 1.00 0.00 H new ATOM 0 HG2 PRO B 128 0.370 -14.944 9.759 1.00 0.00 H new ATOM 0 HG3 PRO B 128 1.945 -14.505 9.127 1.00 0.00 H new ATOM 0 HD2 PRO B 128 -0.428 -12.713 9.712 1.00 0.00 H new ATOM 0 HD3 PRO B 128 1.277 -12.378 9.942 1.00 0.00 H new ATOM 1945 N ILE B 129 -0.229 -13.170 4.593 1.00 0.00 N ATOM 1946 CA ILE B 129 -1.153 -13.087 3.449 1.00 0.00 C ATOM 1947 C ILE B 129 -2.196 -14.212 3.568 1.00 0.00 C ATOM 1948 O ILE B 129 -1.835 -15.379 3.755 1.00 0.00 O ATOM 1949 CB ILE B 129 -0.346 -13.209 2.136 1.00 0.00 C ATOM 1950 CG1 ILE B 129 0.641 -12.033 1.962 1.00 0.00 C ATOM 1951 CG2 ILE B 129 -1.239 -13.288 0.884 1.00 0.00 C ATOM 1952 CD1 ILE B 129 1.860 -12.389 1.103 1.00 0.00 C ATOM 0 H ILE B 129 0.729 -13.373 4.308 1.00 0.00 H new ATOM 0 HA ILE B 129 -1.674 -12.130 3.444 1.00 0.00 H new ATOM 0 HB ILE B 129 0.204 -14.146 2.227 1.00 0.00 H new ATOM 0 HG12 ILE B 129 0.117 -11.192 1.507 1.00 0.00 H new ATOM 0 HG13 ILE B 129 0.980 -11.704 2.944 1.00 0.00 H new ATOM 0 HG21 ILE B 129 -0.613 -13.372 -0.004 1.00 0.00 H new ATOM 0 HG22 ILE B 129 -1.888 -14.161 0.955 1.00 0.00 H new ATOM 0 HG23 ILE B 129 -1.848 -12.387 0.814 1.00 0.00 H new ATOM 0 HD11 ILE B 129 2.513 -11.520 1.020 1.00 0.00 H new ATOM 0 HD12 ILE B 129 2.406 -13.210 1.568 1.00 0.00 H new ATOM 0 HD13 ILE B 129 1.529 -12.690 0.109 1.00 0.00 H new ATOM 1964 N GLN B 130 -3.485 -13.872 3.470 1.00 0.00 N ATOM 1965 CA GLN B 130 -4.595 -14.827 3.574 1.00 0.00 C ATOM 1966 C GLN B 130 -4.496 -15.947 2.514 1.00 0.00 C ATOM 1967 O GLN B 130 -4.150 -15.700 1.356 1.00 0.00 O ATOM 1968 CB GLN B 130 -5.922 -14.053 3.487 1.00 0.00 C ATOM 1969 CG GLN B 130 -7.184 -14.903 3.704 1.00 0.00 C ATOM 1970 CD GLN B 130 -7.196 -15.616 5.055 1.00 0.00 C ATOM 1971 OE1 GLN B 130 -6.743 -16.745 5.193 1.00 0.00 O ATOM 1972 NE2 GLN B 130 -7.689 -14.991 6.104 1.00 0.00 N ATOM 0 H GLN B 130 -3.792 -12.912 3.314 1.00 0.00 H new ATOM 0 HA GLN B 130 -4.545 -15.335 4.537 1.00 0.00 H new ATOM 0 HB2 GLN B 130 -5.908 -13.254 4.228 1.00 0.00 H new ATOM 0 HB3 GLN B 130 -5.985 -13.579 2.508 1.00 0.00 H new ATOM 0 HG2 GLN B 130 -8.064 -14.264 3.628 1.00 0.00 H new ATOM 0 HG3 GLN B 130 -7.259 -15.643 2.908 1.00 0.00 H new ATOM 0 HE21 GLN B 130 -8.070 -14.050 6.005 1.00 0.00 H new ATOM 0 HE22 GLN B 130 -7.690 -15.448 7.016 1.00 0.00 H new ATOM 1981 N GLY B 131 -4.789 -17.188 2.912 1.00 0.00 N ATOM 1982 CA GLY B 131 -4.714 -18.378 2.058 1.00 0.00 C ATOM 1983 C GLY B 131 -3.296 -18.960 2.042 1.00 0.00 C ATOM 1984 O GLY B 131 -2.962 -19.812 2.869 1.00 0.00 O ATOM 0 H GLY B 131 -5.093 -17.399 3.862 1.00 0.00 H new ATOM 0 HA2 GLY B 131 -5.415 -19.131 2.417 1.00 0.00 H new ATOM 0 HA3 GLY B 131 -5.016 -18.120 1.043 1.00 0.00 H new ATOM 1988 N SER B 132 -2.461 -18.477 1.118 1.00 0.00 N ATOM 1989 CA SER B 132 -1.048 -18.856 0.933 1.00 0.00 C ATOM 1990 C SER B 132 -0.204 -17.620 0.600 1.00 0.00 C ATOM 1991 O SER B 132 -0.634 -16.764 -0.179 1.00 0.00 O ATOM 1992 CB SER B 132 -0.889 -19.879 -0.203 1.00 0.00 C ATOM 1993 OG SER B 132 -1.592 -21.084 0.066 1.00 0.00 O ATOM 0 H SER B 132 -2.763 -17.775 0.442 1.00 0.00 H new ATOM 0 HA SER B 132 -0.706 -19.303 1.867 1.00 0.00 H new ATOM 0 HB2 SER B 132 -1.254 -19.446 -1.135 1.00 0.00 H new ATOM 0 HB3 SER B 132 0.169 -20.100 -0.347 1.00 0.00 H new ATOM 0 HG SER B 132 -1.468 -21.708 -0.679 1.00 0.00 H new ATOM 1999 N ARG B 133 1.004 -17.511 1.176 1.00 0.00 N ATOM 2000 CA ARG B 133 1.908 -16.373 0.940 1.00 0.00 C ATOM 2001 C ARG B 133 2.443 -16.350 -0.494 1.00 0.00 C ATOM 2002 O ARG B 133 2.783 -17.383 -1.076 1.00 0.00 O ATOM 2003 CB ARG B 133 3.043 -16.311 1.977 1.00 0.00 C ATOM 2004 CG ARG B 133 2.521 -16.285 3.429 1.00 0.00 C ATOM 2005 CD ARG B 133 3.456 -15.544 4.395 1.00 0.00 C ATOM 2006 NE ARG B 133 4.859 -15.982 4.291 1.00 0.00 N ATOM 2007 CZ ARG B 133 5.470 -16.994 4.872 1.00 0.00 C ATOM 2008 NH1 ARG B 133 4.851 -17.868 5.614 1.00 0.00 N ATOM 2009 NH2 ARG B 133 6.749 -17.122 4.697 1.00 0.00 N ATOM 0 H ARG B 133 1.381 -18.208 1.818 1.00 0.00 H new ATOM 0 HA ARG B 133 1.312 -15.469 1.069 1.00 0.00 H new ATOM 0 HB2 ARG B 133 3.697 -17.173 1.846 1.00 0.00 H new ATOM 0 HB3 ARG B 133 3.647 -15.422 1.796 1.00 0.00 H new ATOM 0 HG2 ARG B 133 1.540 -15.810 3.447 1.00 0.00 H new ATOM 0 HG3 ARG B 133 2.386 -17.309 3.778 1.00 0.00 H new ATOM 0 HD2 ARG B 133 3.400 -14.474 4.196 1.00 0.00 H new ATOM 0 HD3 ARG B 133 3.109 -15.697 5.417 1.00 0.00 H new ATOM 0 HE ARG B 133 5.445 -15.417 3.677 1.00 0.00 H new ATOM 0 HH11 ARG B 133 3.846 -17.786 5.767 1.00 0.00 H new ATOM 0 HH12 ARG B 133 5.372 -18.634 6.042 1.00 0.00 H new ATOM 0 HH21 ARG B 133 7.255 -16.449 4.122 1.00 0.00 H new ATOM 0 HH22 ARG B 133 7.249 -17.896 5.135 1.00 0.00 H new ATOM 2023 N ASN B 134 2.494 -15.145 -1.051 1.00 0.00 N ATOM 2024 CA ASN B 134 2.927 -14.811 -2.408 1.00 0.00 C ATOM 2025 C ASN B 134 3.591 -13.411 -2.420 1.00 0.00 C ATOM 2026 O ASN B 134 3.862 -12.844 -1.360 1.00 0.00 O ATOM 2027 CB ASN B 134 1.672 -14.895 -3.309 1.00 0.00 C ATOM 2028 CG ASN B 134 2.008 -15.191 -4.760 1.00 0.00 C ATOM 2029 OD1 ASN B 134 2.256 -14.301 -5.561 1.00 0.00 O ATOM 2030 ND2 ASN B 134 2.051 -16.448 -5.136 1.00 0.00 N ATOM 0 H ASN B 134 2.214 -14.314 -0.530 1.00 0.00 H new ATOM 0 HA ASN B 134 3.682 -15.502 -2.783 1.00 0.00 H new ATOM 0 HB2 ASN B 134 1.009 -15.672 -2.929 1.00 0.00 H new ATOM 0 HB3 ASN B 134 1.126 -13.953 -3.252 1.00 0.00 H new ATOM 0 HD21 ASN B 134 2.292 -16.684 -6.099 1.00 0.00 H new ATOM 0 HD22 ASN B 134 1.844 -17.188 -4.466 1.00 0.00 H new ATOM 2037 N LEU B 135 3.816 -12.834 -3.602 1.00 0.00 N ATOM 2038 CA LEU B 135 4.320 -11.476 -3.827 1.00 0.00 C ATOM 2039 C LEU B 135 3.649 -10.882 -5.077 1.00 0.00 C ATOM 2040 O LEU B 135 4.107 -11.067 -6.208 1.00 0.00 O ATOM 2041 CB LEU B 135 5.857 -11.420 -3.956 1.00 0.00 C ATOM 2042 CG LEU B 135 6.684 -11.589 -2.667 1.00 0.00 C ATOM 2043 CD1 LEU B 135 8.152 -11.346 -3.025 1.00 0.00 C ATOM 2044 CD2 LEU B 135 6.342 -10.593 -1.554 1.00 0.00 C ATOM 0 H LEU B 135 3.642 -13.328 -4.477 1.00 0.00 H new ATOM 0 HA LEU B 135 4.065 -10.881 -2.950 1.00 0.00 H new ATOM 0 HB2 LEU B 135 6.164 -12.196 -4.657 1.00 0.00 H new ATOM 0 HB3 LEU B 135 6.123 -10.462 -4.403 1.00 0.00 H new ATOM 0 HG LEU B 135 6.467 -12.589 -2.292 1.00 0.00 H new ATOM 0 HD11 LEU B 135 8.768 -11.458 -2.132 1.00 0.00 H new ATOM 0 HD12 LEU B 135 8.468 -12.069 -3.777 1.00 0.00 H new ATOM 0 HD13 LEU B 135 8.268 -10.337 -3.421 1.00 0.00 H new ATOM 0 HD21 LEU B 135 6.972 -10.787 -0.686 1.00 0.00 H new ATOM 0 HD22 LEU B 135 6.515 -9.577 -1.909 1.00 0.00 H new ATOM 0 HD23 LEU B 135 5.295 -10.706 -1.274 1.00 0.00 H new ATOM 2056 N LEU B 136 2.569 -10.137 -4.850 1.00 0.00 N ATOM 2057 CA LEU B 136 1.804 -9.372 -5.835 1.00 0.00 C ATOM 2058 C LEU B 136 2.778 -8.359 -6.477 1.00 0.00 C ATOM 2059 O LEU B 136 3.454 -7.610 -5.766 1.00 0.00 O ATOM 2060 CB LEU B 136 0.630 -8.728 -5.062 1.00 0.00 C ATOM 2061 CG LEU B 136 -0.571 -8.185 -5.852 1.00 0.00 C ATOM 2062 CD1 LEU B 136 -0.171 -7.188 -6.927 1.00 0.00 C ATOM 2063 CD2 LEU B 136 -1.417 -9.277 -6.503 1.00 0.00 C ATOM 0 H LEU B 136 2.179 -10.045 -3.912 1.00 0.00 H new ATOM 0 HA LEU B 136 1.381 -9.962 -6.648 1.00 0.00 H new ATOM 0 HB2 LEU B 136 0.253 -9.470 -4.358 1.00 0.00 H new ATOM 0 HB3 LEU B 136 1.035 -7.906 -4.472 1.00 0.00 H new ATOM 0 HG LEU B 136 -1.171 -7.681 -5.095 1.00 0.00 H new ATOM 0 HD11 LEU B 136 -1.062 -6.840 -7.450 1.00 0.00 H new ATOM 0 HD12 LEU B 136 0.334 -6.339 -6.466 1.00 0.00 H new ATOM 0 HD13 LEU B 136 0.502 -7.669 -7.637 1.00 0.00 H new ATOM 0 HD21 LEU B 136 -2.247 -8.821 -7.043 1.00 0.00 H new ATOM 0 HD22 LEU B 136 -0.802 -9.848 -7.198 1.00 0.00 H new ATOM 0 HD23 LEU B 136 -1.808 -9.942 -5.733 1.00 0.00 H new ATOM 2075 N GLN B 137 2.921 -8.384 -7.807 1.00 0.00 N ATOM 2076 CA GLN B 137 3.918 -7.589 -8.542 1.00 0.00 C ATOM 2077 C GLN B 137 3.456 -7.103 -9.929 1.00 0.00 C ATOM 2078 O GLN B 137 2.478 -7.601 -10.488 1.00 0.00 O ATOM 2079 CB GLN B 137 5.215 -8.418 -8.635 1.00 0.00 C ATOM 2080 CG GLN B 137 5.073 -9.730 -9.429 1.00 0.00 C ATOM 2081 CD GLN B 137 6.261 -10.657 -9.183 1.00 0.00 C ATOM 2082 OE1 GLN B 137 7.201 -10.740 -9.962 1.00 0.00 O ATOM 2083 NE2 GLN B 137 6.259 -11.385 -8.087 1.00 0.00 N ATOM 0 H GLN B 137 2.341 -8.964 -8.413 1.00 0.00 H new ATOM 0 HA GLN B 137 4.083 -6.667 -7.984 1.00 0.00 H new ATOM 0 HB2 GLN B 137 5.990 -7.808 -9.099 1.00 0.00 H new ATOM 0 HB3 GLN B 137 5.556 -8.652 -7.626 1.00 0.00 H new ATOM 0 HG2 GLN B 137 4.150 -10.234 -9.142 1.00 0.00 H new ATOM 0 HG3 GLN B 137 4.997 -9.507 -10.493 1.00 0.00 H new ATOM 0 HE21 GLN B 137 5.479 -11.321 -7.433 1.00 0.00 H new ATOM 0 HE22 GLN B 137 7.038 -12.014 -7.891 1.00 0.00 H new ATOM 2092 N GLY B 138 4.182 -6.126 -10.485 1.00 0.00 N ATOM 2093 CA GLY B 138 3.941 -5.515 -11.798 1.00 0.00 C ATOM 2094 C GLY B 138 2.589 -4.810 -11.933 1.00 0.00 C ATOM 2095 O GLY B 138 2.158 -4.118 -11.014 1.00 0.00 O ATOM 0 H GLY B 138 4.990 -5.722 -10.011 1.00 0.00 H new ATOM 0 HA2 GLY B 138 4.734 -4.795 -12.000 1.00 0.00 H new ATOM 0 HA3 GLY B 138 4.011 -6.289 -12.563 1.00 0.00 H new ATOM 2099 N GLU B 139 1.928 -4.948 -13.086 1.00 0.00 N ATOM 2100 CA GLU B 139 0.642 -4.298 -13.402 1.00 0.00 C ATOM 2101 C GLU B 139 -0.419 -4.488 -12.303 1.00 0.00 C ATOM 2102 O GLU B 139 -1.133 -3.550 -11.941 1.00 0.00 O ATOM 2103 CB GLU B 139 0.118 -4.824 -14.750 1.00 0.00 C ATOM 2104 CG GLU B 139 -1.044 -3.984 -15.298 1.00 0.00 C ATOM 2105 CD GLU B 139 -1.674 -4.646 -16.538 1.00 0.00 C ATOM 2106 OE1 GLU B 139 -1.139 -4.480 -17.661 1.00 0.00 O ATOM 2107 OE2 GLU B 139 -2.721 -5.325 -16.395 1.00 0.00 O ATOM 0 H GLU B 139 2.277 -5.529 -13.848 1.00 0.00 H new ATOM 0 HA GLU B 139 0.829 -3.226 -13.464 1.00 0.00 H new ATOM 0 HB2 GLU B 139 0.932 -4.829 -15.475 1.00 0.00 H new ATOM 0 HB3 GLU B 139 -0.209 -5.857 -14.631 1.00 0.00 H new ATOM 0 HG2 GLU B 139 -1.802 -3.859 -14.525 1.00 0.00 H new ATOM 0 HG3 GLU B 139 -0.685 -2.988 -15.557 1.00 0.00 H new ATOM 2114 N GLU B 140 -0.512 -5.705 -11.758 1.00 0.00 N ATOM 2115 CA GLU B 140 -1.434 -6.077 -10.683 1.00 0.00 C ATOM 2116 C GLU B 140 -1.313 -5.168 -9.449 1.00 0.00 C ATOM 2117 O GLU B 140 -2.328 -4.917 -8.800 1.00 0.00 O ATOM 2118 CB GLU B 140 -1.243 -7.550 -10.289 1.00 0.00 C ATOM 2119 CG GLU B 140 -1.893 -8.552 -11.249 1.00 0.00 C ATOM 2120 CD GLU B 140 -1.333 -8.519 -12.686 1.00 0.00 C ATOM 2121 OE1 GLU B 140 -0.103 -8.682 -12.876 1.00 0.00 O ATOM 2122 OE2 GLU B 140 -2.132 -8.358 -13.640 1.00 0.00 O ATOM 0 H GLU B 140 0.072 -6.483 -12.064 1.00 0.00 H new ATOM 0 HA GLU B 140 -2.441 -5.940 -11.076 1.00 0.00 H new ATOM 0 HB2 GLU B 140 -0.175 -7.762 -10.230 1.00 0.00 H new ATOM 0 HB3 GLU B 140 -1.654 -7.703 -9.291 1.00 0.00 H new ATOM 0 HG2 GLU B 140 -1.765 -9.557 -10.846 1.00 0.00 H new ATOM 0 HG3 GLU B 140 -2.965 -8.357 -11.286 1.00 0.00 H new ATOM 2129 N LEU B 141 -0.116 -4.641 -9.134 1.00 0.00 N ATOM 2130 CA LEU B 141 0.089 -3.692 -8.031 1.00 0.00 C ATOM 2131 C LEU B 141 -0.815 -2.478 -8.237 1.00 0.00 C ATOM 2132 O LEU B 141 -1.664 -2.184 -7.403 1.00 0.00 O ATOM 2133 CB LEU B 141 1.542 -3.189 -7.965 1.00 0.00 C ATOM 2134 CG LEU B 141 2.604 -4.215 -7.554 1.00 0.00 C ATOM 2135 CD1 LEU B 141 3.957 -3.697 -8.030 1.00 0.00 C ATOM 2136 CD2 LEU B 141 2.684 -4.367 -6.034 1.00 0.00 C ATOM 0 H LEU B 141 0.740 -4.865 -9.642 1.00 0.00 H new ATOM 0 HA LEU B 141 -0.145 -4.215 -7.104 1.00 0.00 H new ATOM 0 HB2 LEU B 141 1.811 -2.794 -8.945 1.00 0.00 H new ATOM 0 HB3 LEU B 141 1.583 -2.356 -7.263 1.00 0.00 H new ATOM 0 HG LEU B 141 2.343 -5.178 -7.992 1.00 0.00 H new ATOM 0 HD11 LEU B 141 4.736 -4.406 -7.752 1.00 0.00 H new ATOM 0 HD12 LEU B 141 3.941 -3.581 -9.114 1.00 0.00 H new ATOM 0 HD13 LEU B 141 4.162 -2.733 -7.565 1.00 0.00 H new ATOM 0 HD21 LEU B 141 3.448 -5.103 -5.782 1.00 0.00 H new ATOM 0 HD22 LEU B 141 2.942 -3.408 -5.585 1.00 0.00 H new ATOM 0 HD23 LEU B 141 1.719 -4.699 -5.650 1.00 0.00 H new ATOM 2148 N LEU B 142 -0.632 -1.777 -9.359 1.00 0.00 N ATOM 2149 CA LEU B 142 -1.380 -0.571 -9.704 1.00 0.00 C ATOM 2150 C LEU B 142 -2.889 -0.842 -9.729 1.00 0.00 C ATOM 2151 O LEU B 142 -3.656 -0.046 -9.195 1.00 0.00 O ATOM 2152 CB LEU B 142 -0.875 0.043 -11.019 1.00 0.00 C ATOM 2153 CG LEU B 142 0.653 0.214 -11.161 1.00 0.00 C ATOM 2154 CD1 LEU B 142 0.927 1.229 -12.271 1.00 0.00 C ATOM 2155 CD2 LEU B 142 1.367 0.718 -9.902 1.00 0.00 C ATOM 0 H LEU B 142 0.055 -2.040 -10.066 1.00 0.00 H new ATOM 0 HA LEU B 142 -1.204 0.169 -8.923 1.00 0.00 H new ATOM 0 HB2 LEU B 142 -1.226 -0.579 -11.842 1.00 0.00 H new ATOM 0 HB3 LEU B 142 -1.340 1.022 -11.138 1.00 0.00 H new ATOM 0 HG LEU B 142 1.042 -0.782 -11.373 1.00 0.00 H new ATOM 0 HD11 LEU B 142 2.003 1.362 -12.385 1.00 0.00 H new ATOM 0 HD12 LEU B 142 0.505 0.866 -13.208 1.00 0.00 H new ATOM 0 HD13 LEU B 142 0.469 2.184 -12.012 1.00 0.00 H new ATOM 0 HD21 LEU B 142 2.435 0.806 -10.100 1.00 0.00 H new ATOM 0 HD22 LEU B 142 0.968 1.693 -9.623 1.00 0.00 H new ATOM 0 HD23 LEU B 142 1.206 0.014 -9.086 1.00 0.00 H new ATOM 2167 N ARG B 143 -3.312 -1.980 -10.297 1.00 0.00 N ATOM 2168 CA ARG B 143 -4.715 -2.443 -10.322 1.00 0.00 C ATOM 2169 C ARG B 143 -5.272 -2.582 -8.899 1.00 0.00 C ATOM 2170 O ARG B 143 -6.356 -2.071 -8.615 1.00 0.00 O ATOM 2171 CB ARG B 143 -4.831 -3.744 -11.138 1.00 0.00 C ATOM 2172 CG ARG B 143 -4.542 -3.482 -12.627 1.00 0.00 C ATOM 2173 CD ARG B 143 -4.352 -4.744 -13.475 1.00 0.00 C ATOM 2174 NE ARG B 143 -5.559 -5.586 -13.551 1.00 0.00 N ATOM 2175 CZ ARG B 143 -5.844 -6.459 -14.503 1.00 0.00 C ATOM 2176 NH1 ARG B 143 -5.079 -6.652 -15.543 1.00 0.00 N ATOM 2177 NH2 ARG B 143 -6.934 -7.168 -14.431 1.00 0.00 N ATOM 0 H ARG B 143 -2.674 -2.624 -10.765 1.00 0.00 H new ATOM 0 HA ARG B 143 -5.330 -1.694 -10.821 1.00 0.00 H new ATOM 0 HB2 ARG B 143 -4.131 -4.485 -10.752 1.00 0.00 H new ATOM 0 HB3 ARG B 143 -5.831 -4.162 -11.025 1.00 0.00 H new ATOM 0 HG2 ARG B 143 -5.363 -2.900 -13.045 1.00 0.00 H new ATOM 0 HG3 ARG B 143 -3.644 -2.869 -12.706 1.00 0.00 H new ATOM 0 HD2 ARG B 143 -4.056 -4.454 -14.483 1.00 0.00 H new ATOM 0 HD3 ARG B 143 -3.534 -5.332 -13.060 1.00 0.00 H new ATOM 0 HE ARG B 143 -6.239 -5.486 -12.798 1.00 0.00 H new ATOM 0 HH11 ARG B 143 -4.217 -6.117 -15.648 1.00 0.00 H new ATOM 0 HH12 ARG B 143 -5.343 -7.338 -16.250 1.00 0.00 H new ATOM 0 HH21 ARG B 143 -7.568 -7.050 -13.641 1.00 0.00 H new ATOM 0 HH22 ARG B 143 -7.154 -7.841 -15.165 1.00 0.00 H new ATOM 2191 N ALA B 144 -4.522 -3.216 -7.993 1.00 0.00 N ATOM 2192 CA ALA B 144 -4.864 -3.333 -6.575 1.00 0.00 C ATOM 2193 C ALA B 144 -4.956 -1.938 -5.915 1.00 0.00 C ATOM 2194 O ALA B 144 -5.940 -1.652 -5.239 1.00 0.00 O ATOM 2195 CB ALA B 144 -3.866 -4.266 -5.871 1.00 0.00 C ATOM 0 H ALA B 144 -3.641 -3.672 -8.232 1.00 0.00 H new ATOM 0 HA ALA B 144 -5.852 -3.783 -6.474 1.00 0.00 H new ATOM 0 HB1 ALA B 144 -4.127 -4.348 -4.816 1.00 0.00 H new ATOM 0 HB2 ALA B 144 -3.903 -5.253 -6.332 1.00 0.00 H new ATOM 0 HB3 ALA B 144 -2.859 -3.859 -5.965 1.00 0.00 H new ATOM 2201 N LEU B 145 -3.978 -1.046 -6.121 1.00 0.00 N ATOM 2202 CA LEU B 145 -3.997 0.332 -5.595 1.00 0.00 C ATOM 2203 C LEU B 145 -5.165 1.175 -6.148 1.00 0.00 C ATOM 2204 O LEU B 145 -5.633 2.097 -5.483 1.00 0.00 O ATOM 2205 CB LEU B 145 -2.679 1.067 -5.892 1.00 0.00 C ATOM 2206 CG LEU B 145 -1.391 0.446 -5.337 1.00 0.00 C ATOM 2207 CD1 LEU B 145 -0.209 1.339 -5.667 1.00 0.00 C ATOM 2208 CD2 LEU B 145 -1.394 0.254 -3.826 1.00 0.00 C ATOM 0 H LEU B 145 -3.141 -1.260 -6.663 1.00 0.00 H new ATOM 0 HA LEU B 145 -4.131 0.225 -4.519 1.00 0.00 H new ATOM 0 HB2 LEU B 145 -2.575 1.151 -6.974 1.00 0.00 H new ATOM 0 HB3 LEU B 145 -2.762 2.081 -5.500 1.00 0.00 H new ATOM 0 HG LEU B 145 -1.320 -0.536 -5.804 1.00 0.00 H new ATOM 0 HD11 LEU B 145 0.704 0.895 -5.271 1.00 0.00 H new ATOM 0 HD12 LEU B 145 -0.123 1.443 -6.749 1.00 0.00 H new ATOM 0 HD13 LEU B 145 -0.359 2.321 -5.219 1.00 0.00 H new ATOM 0 HD21 LEU B 145 -0.449 -0.190 -3.514 1.00 0.00 H new ATOM 0 HD22 LEU B 145 -1.521 1.220 -3.337 1.00 0.00 H new ATOM 0 HD23 LEU B 145 -2.215 -0.406 -3.545 1.00 0.00 H new ATOM 2220 N ASP B 146 -5.617 0.918 -7.376 1.00 0.00 N ATOM 2221 CA ASP B 146 -6.715 1.642 -8.028 1.00 0.00 C ATOM 2222 C ASP B 146 -8.065 1.427 -7.325 1.00 0.00 C ATOM 2223 O ASP B 146 -8.854 2.366 -7.207 1.00 0.00 O ATOM 2224 CB ASP B 146 -6.808 1.246 -9.511 1.00 0.00 C ATOM 2225 CG ASP B 146 -7.507 2.342 -10.321 1.00 0.00 C ATOM 2226 OD1 ASP B 146 -6.839 3.355 -10.626 1.00 0.00 O ATOM 2227 OD2 ASP B 146 -8.716 2.238 -10.628 1.00 0.00 O ATOM 0 H ASP B 146 -5.221 0.183 -7.962 1.00 0.00 H new ATOM 0 HA ASP B 146 -6.487 2.705 -7.953 1.00 0.00 H new ATOM 0 HB2 ASP B 146 -5.808 1.074 -9.910 1.00 0.00 H new ATOM 0 HB3 ASP B 146 -7.356 0.309 -9.609 1.00 0.00 H new ATOM 2232 N GLN B 147 -8.333 0.203 -6.848 1.00 0.00 N ATOM 2233 CA GLN B 147 -9.583 -0.218 -6.188 1.00 0.00 C ATOM 2234 C GLN B 147 -10.004 0.628 -4.963 1.00 0.00 C ATOM 2235 O GLN B 147 -11.156 0.551 -4.532 1.00 0.00 O ATOM 2236 CB GLN B 147 -9.515 -1.726 -5.866 1.00 0.00 C ATOM 2237 CG GLN B 147 -8.932 -2.057 -4.478 1.00 0.00 C ATOM 2238 CD GLN B 147 -8.406 -3.488 -4.338 1.00 0.00 C ATOM 2239 OE1 GLN B 147 -8.507 -4.336 -5.220 1.00 0.00 O ATOM 2240 NE2 GLN B 147 -7.809 -3.824 -3.216 1.00 0.00 N ATOM 0 H GLN B 147 -7.656 -0.557 -6.913 1.00 0.00 H new ATOM 0 HA GLN B 147 -10.384 -0.031 -6.903 1.00 0.00 H new ATOM 0 HB2 GLN B 147 -10.519 -2.145 -5.934 1.00 0.00 H new ATOM 0 HB3 GLN B 147 -8.911 -2.220 -6.627 1.00 0.00 H new ATOM 0 HG2 GLN B 147 -8.120 -1.362 -4.263 1.00 0.00 H new ATOM 0 HG3 GLN B 147 -9.702 -1.891 -3.725 1.00 0.00 H new ATOM 0 HE21 GLN B 147 -7.711 -3.140 -2.466 1.00 0.00 H new ATOM 0 HE22 GLN B 147 -7.444 -4.769 -3.096 1.00 0.00 H new ATOM 2249 N VAL B 148 -9.092 1.437 -4.408 1.00 0.00 N ATOM 2250 CA VAL B 148 -9.327 2.356 -3.279 1.00 0.00 C ATOM 2251 C VAL B 148 -10.398 3.412 -3.615 1.00 0.00 C ATOM 2252 O VAL B 148 -11.174 3.799 -2.737 1.00 0.00 O ATOM 2253 CB VAL B 148 -8.021 3.074 -2.862 1.00 0.00 C ATOM 2254 CG1 VAL B 148 -8.210 3.914 -1.593 1.00 0.00 C ATOM 2255 CG2 VAL B 148 -6.863 2.125 -2.538 1.00 0.00 C ATOM 0 H VAL B 148 -8.130 1.473 -4.745 1.00 0.00 H new ATOM 0 HA VAL B 148 -9.685 1.746 -2.450 1.00 0.00 H new ATOM 0 HB VAL B 148 -7.782 3.682 -3.735 1.00 0.00 H new ATOM 0 HG11 VAL B 148 -7.269 4.401 -1.335 1.00 0.00 H new ATOM 0 HG12 VAL B 148 -8.974 4.671 -1.768 1.00 0.00 H new ATOM 0 HG13 VAL B 148 -8.521 3.268 -0.772 1.00 0.00 H new ATOM 0 HG21 VAL B 148 -5.985 2.706 -2.255 1.00 0.00 H new ATOM 0 HG22 VAL B 148 -7.148 1.472 -1.713 1.00 0.00 H new ATOM 0 HG23 VAL B 148 -6.631 1.521 -3.415 1.00 0.00 H new ATOM 2265 N ASN B 149 -10.418 3.899 -4.866 1.00 0.00 N ATOM 2266 CA ASN B 149 -11.324 4.957 -5.355 1.00 0.00 C ATOM 2267 C ASN B 149 -12.832 4.678 -5.123 1.00 0.00 C ATOM 2268 O ASN B 149 -13.553 5.641 -4.767 1.00 0.00 O ATOM 2269 CB ASN B 149 -11.007 5.299 -6.831 1.00 0.00 C ATOM 2270 CG ASN B 149 -11.775 4.476 -7.863 1.00 0.00 C ATOM 2271 OD1 ASN B 149 -12.778 4.915 -8.419 1.00 0.00 O ATOM 2272 ND2 ASN B 149 -11.318 3.295 -8.199 1.00 0.00 N ATOM 2273 OXT ASN B 149 -13.292 3.530 -5.321 1.00 0.00 O ATOM 0 H ASN B 149 -9.785 3.558 -5.590 1.00 0.00 H new ATOM 0 HA ASN B 149 -11.124 5.835 -4.741 1.00 0.00 H new ATOM 0 HB2 ASN B 149 -11.221 6.355 -6.998 1.00 0.00 H new ATOM 0 HB3 ASN B 149 -9.939 5.160 -6.999 1.00 0.00 H new ATOM 0 HD21 ASN B 149 -11.795 2.749 -8.917 1.00 0.00 H new ATOM 0 HD22 ASN B 149 -10.486 2.922 -7.743 1.00 0.00 H new TER 2280 ASN B 149 HETATM 2281 ZN ZN A 96 0.362 12.659 -1.945 1.00 0.00 ZN HETATM 2282 ZN ZN A 97 12.969 -4.083 -5.878 1.00 0.00 ZN HETATM 2283 ZN ZN A 98 -5.968 -8.313 6.278 1.00 0.00 ZN