USER MOD reduce.3.24.130724 H: found=0, std=0, add=943, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 946 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 121 GLN : amide:sc= 0 X(o=-0.72,f=-1.2) USER MOD Set 1.2: A 122 SER OG : rot 180:sc= -0.72 USER MOD Set 2.1: A 64 SER OG : rot 180:sc= -0.197 USER MOD Set 2.2: A 65 ASN : amide:sc= 0 X(o=-0.2,f=0.12) USER MOD Set 3.1: A 54 HIS : no HD1:sc=-0.00819 X(o=0.78,f=0.78) USER MOD Set 3.2: A 59 THR OG1 : rot 62:sc= 0.792 USER MOD Set 4.1: A 43 TYR OH : rot -33:sc= 0.221 USER MOD Set 4.2: A 71 THR OG1 : rot 180:sc= 0.221 USER MOD Single : A 24 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc= -1.6! C(o=-1.6!,f=-8.7!) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -170:sc= -0.122 (180deg=-0.21) USER MOD Single : A 34 THR OG1 : rot 82:sc= 1.24 USER MOD Single : A 36 MET CE :methyl 162:sc= -1.01 (180deg=-1.29) USER MOD Single : A 38 GLN :FLIP amide:sc= -0.0772 F(o=-0.97,f=-0.077) USER MOD Single : A 39 THR OG1 : rot 75:sc= 1.2 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0.0111 USER MOD Single : A 72 THR OG1 : rot 38:sc= 0.00372 USER MOD Single : A 73 THR OG1 : rot 180:sc= -0.703 USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0.00211 USER MOD Single : A 79 MET CE :methyl -138:sc= -0.187 (180deg=-0.826) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 166:sc=-0.00704 (180deg=-0.175) USER MOD Single : A 87 SER OG : rot 180:sc= -0.0303 USER MOD Single : A 89 THR OG1 : rot 180:sc= -0.0121 USER MOD Single : A 91 GLN : amide:sc= -2.96! C(o=-3!,f=-11!) USER MOD Single : A 93 SER OG : rot 130:sc= 0.684 USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=-0.0094) USER MOD Single : A 98 SER OG : rot 180:sc= -0.0529 USER MOD Single : A 101 MET CE :methyl 164:sc= -0.552 (180deg=-0.755) USER MOD Single : A 102 THR OG1 : rot 180:sc= -0.0168 USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=-0.032) USER MOD Single : A 109 ASN :FLIP amide:sc= -0.532 F(o=-1.4,f=-0.53) USER MOD Single : A 112 THR OG1 : rot 31:sc= 0.034 USER MOD Single : A 117 ASN :FLIP amide:sc=-6.56e-05 F(o=-1.3!,f=-6.6e-05) USER MOD Single : A 119 ASN : amide:sc= -0.0331 X(o=-0.033,f=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 127 GLN :FLIP amide:sc= 0 F(o=-0.59,f=0) USER MOD Single : A 128 GLN : amide:sc= -0.0996 K(o=-0.1,f=-0.87) USER MOD Single : A 140 ASN : amide:sc= -0.301 X(o=-0.3,f=-0.79) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 150 HIS : no HD1:sc= -0.0316 X(o=-0.032,f=0) USER MOD Single : A 151 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 152 HIS : no HD1:sc= -0.104 K(o=-0.1,f=-0.62) USER MOD Single : A 153 HIS : no HD1:sc= 0.286 K(o=0.29,f=-2) USER MOD Single : A 154 HIS : no HD1:sc=-0.00579 X(o=-0.0058,f=-0.03) USER MOD Single : A 155 HIS : no HD1:sc= 0 X(o=0,f=-0.017) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 24 -14.047 -13.904 -9.453 1.00 0.00 N ATOM 2 CA MET A 24 -15.513 -14.079 -9.562 1.00 0.00 C ATOM 3 C MET A 24 -16.233 -13.082 -8.668 1.00 0.00 C ATOM 4 O MET A 24 -16.854 -12.136 -9.151 1.00 0.00 O ATOM 5 CB MET A 24 -15.926 -15.503 -9.176 1.00 0.00 C ATOM 6 CG MET A 24 -15.419 -16.575 -10.125 1.00 0.00 C ATOM 7 SD MET A 24 -15.920 -18.232 -9.622 1.00 0.00 S ATOM 8 CE MET A 24 -15.222 -19.210 -10.949 1.00 0.00 C ATOM 0 HA MET A 24 -15.794 -13.902 -10.600 1.00 0.00 H new ATOM 0 HB2 MET A 24 -15.557 -15.717 -8.173 1.00 0.00 H new ATOM 0 HB3 MET A 24 -17.014 -15.555 -9.134 1.00 0.00 H new ATOM 0 HG2 MET A 24 -15.794 -16.374 -11.129 1.00 0.00 H new ATOM 0 HG3 MET A 24 -14.331 -16.527 -10.175 1.00 0.00 H new ATOM 0 HE1 MET A 24 -15.447 -20.263 -10.782 1.00 0.00 H new ATOM 0 HE2 MET A 24 -15.652 -18.893 -11.899 1.00 0.00 H new ATOM 0 HE3 MET A 24 -14.141 -19.070 -10.975 1.00 0.00 H new ATOM 20 N GLU A 25 -16.139 -13.288 -7.364 1.00 0.00 N ATOM 21 CA GLU A 25 -16.797 -12.411 -6.411 1.00 0.00 C ATOM 22 C GLU A 25 -15.884 -11.244 -6.054 1.00 0.00 C ATOM 23 O GLU A 25 -14.787 -11.120 -6.602 1.00 0.00 O ATOM 24 CB GLU A 25 -17.206 -13.194 -5.157 1.00 0.00 C ATOM 25 CG GLU A 25 -16.045 -13.864 -4.441 1.00 0.00 C ATOM 26 CD GLU A 25 -16.501 -14.753 -3.303 1.00 0.00 C ATOM 27 OE1 GLU A 25 -16.468 -15.988 -3.462 1.00 0.00 O ATOM 28 OE2 GLU A 25 -16.909 -14.223 -2.250 1.00 0.00 O ATOM 0 H GLU A 25 -15.614 -14.054 -6.942 1.00 0.00 H new ATOM 0 HA GLU A 25 -17.702 -12.009 -6.867 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -17.704 -12.516 -4.464 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -17.934 -13.955 -5.438 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -15.475 -14.458 -5.156 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -15.372 -13.100 -4.053 1.00 0.00 H new ATOM 35 N ASN A 26 -16.356 -10.388 -5.151 1.00 0.00 N ATOM 36 CA ASN A 26 -15.617 -9.199 -4.716 1.00 0.00 C ATOM 37 C ASN A 26 -15.491 -8.180 -5.836 1.00 0.00 C ATOM 38 O ASN A 26 -14.698 -7.254 -5.732 1.00 0.00 O ATOM 39 CB ASN A 26 -14.207 -9.541 -4.206 1.00 0.00 C ATOM 40 CG ASN A 26 -14.202 -10.268 -2.879 1.00 0.00 C ATOM 41 OD1 ASN A 26 -14.238 -9.643 -1.820 1.00 0.00 O ATOM 42 ND2 ASN A 26 -14.118 -11.585 -2.923 1.00 0.00 N ATOM 0 H ASN A 26 -17.263 -10.497 -4.698 1.00 0.00 H new ATOM 0 HA ASN A 26 -16.196 -8.775 -3.896 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -13.700 -10.156 -4.950 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -13.632 -8.620 -4.108 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -14.080 -12.123 -2.057 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -14.091 -12.065 -3.823 1.00 0.00 H new ATOM 49 N TYR A 27 -16.282 -8.326 -6.892 1.00 0.00 N ATOM 50 CA TYR A 27 -16.107 -7.487 -8.069 1.00 0.00 C ATOM 51 C TYR A 27 -16.529 -6.049 -7.783 1.00 0.00 C ATOM 52 O TYR A 27 -15.854 -5.102 -8.193 1.00 0.00 O ATOM 53 CB TYR A 27 -16.880 -8.044 -9.269 1.00 0.00 C ATOM 54 CG TYR A 27 -16.444 -7.433 -10.583 1.00 0.00 C ATOM 55 CD1 TYR A 27 -15.279 -7.860 -11.210 1.00 0.00 C ATOM 56 CD2 TYR A 27 -17.185 -6.426 -11.192 1.00 0.00 C ATOM 57 CE1 TYR A 27 -14.868 -7.302 -12.405 1.00 0.00 C ATOM 58 CE2 TYR A 27 -16.778 -5.865 -12.387 1.00 0.00 C ATOM 59 CZ TYR A 27 -15.618 -6.307 -12.989 1.00 0.00 C ATOM 60 OH TYR A 27 -15.209 -5.748 -14.180 1.00 0.00 O ATOM 0 H TYR A 27 -17.039 -9.006 -6.957 1.00 0.00 H new ATOM 0 HA TYR A 27 -15.046 -7.490 -8.319 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -16.744 -9.125 -9.313 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -17.945 -7.863 -9.125 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -14.686 -8.640 -10.756 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -18.093 -6.077 -10.723 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -13.961 -7.646 -12.880 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -17.365 -5.084 -12.848 1.00 0.00 H new ATOM 0 HH TYR A 27 -15.851 -5.061 -14.456 1.00 0.00 H new ATOM 70 N LEU A 28 -17.641 -5.893 -7.073 1.00 0.00 N ATOM 71 CA LEU A 28 -18.113 -4.571 -6.677 1.00 0.00 C ATOM 72 C LEU A 28 -17.103 -3.909 -5.747 1.00 0.00 C ATOM 73 O LEU A 28 -16.806 -2.718 -5.868 1.00 0.00 O ATOM 74 CB LEU A 28 -19.477 -4.672 -5.983 1.00 0.00 C ATOM 75 CG LEU A 28 -20.631 -5.153 -6.868 1.00 0.00 C ATOM 76 CD1 LEU A 28 -21.885 -5.375 -6.035 1.00 0.00 C ATOM 77 CD2 LEU A 28 -20.908 -4.150 -7.976 1.00 0.00 C ATOM 0 H LEU A 28 -18.231 -6.664 -6.760 1.00 0.00 H new ATOM 0 HA LEU A 28 -18.223 -3.961 -7.574 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -19.385 -5.351 -5.135 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -19.734 -3.692 -5.581 1.00 0.00 H new ATOM 0 HG LEU A 28 -20.341 -6.101 -7.322 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -22.695 -5.716 -6.680 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -21.687 -6.128 -5.272 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -22.173 -4.440 -5.555 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -21.731 -4.509 -8.594 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -21.176 -3.189 -7.538 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -20.016 -4.032 -8.592 1.00 0.00 H new ATOM 89 N ARG A 29 -16.581 -4.697 -4.820 1.00 0.00 N ATOM 90 CA ARG A 29 -15.574 -4.224 -3.888 1.00 0.00 C ATOM 91 C ARG A 29 -14.263 -3.925 -4.611 1.00 0.00 C ATOM 92 O ARG A 29 -13.552 -2.988 -4.255 1.00 0.00 O ATOM 93 CB ARG A 29 -15.375 -5.253 -2.768 1.00 0.00 C ATOM 94 CG ARG A 29 -14.275 -4.899 -1.779 1.00 0.00 C ATOM 95 CD ARG A 29 -14.544 -5.494 -0.402 1.00 0.00 C ATOM 96 NE ARG A 29 -14.780 -6.939 -0.453 1.00 0.00 N ATOM 97 CZ ARG A 29 -15.687 -7.578 0.291 1.00 0.00 C ATOM 98 NH1 ARG A 29 -16.442 -6.914 1.159 1.00 0.00 N ATOM 99 NH2 ARG A 29 -15.835 -8.890 0.168 1.00 0.00 N ATOM 0 H ARG A 29 -16.842 -5.675 -4.694 1.00 0.00 H new ATOM 0 HA ARG A 29 -15.917 -3.292 -3.439 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -16.313 -5.367 -2.224 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -15.147 -6.220 -3.216 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -13.318 -5.264 -2.153 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -14.193 -3.815 -1.698 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -13.695 -5.290 0.251 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -15.411 -5.003 0.040 1.00 0.00 H new ATOM 0 HE ARG A 29 -14.216 -7.492 -1.098 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -16.333 -5.905 1.263 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -17.131 -7.413 1.722 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -15.257 -9.409 -0.493 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -16.527 -9.381 0.735 1.00 0.00 H new ATOM 113 N LYS A 30 -13.959 -4.713 -5.642 1.00 0.00 N ATOM 114 CA LYS A 30 -12.742 -4.520 -6.424 1.00 0.00 C ATOM 115 C LYS A 30 -12.673 -3.114 -6.994 1.00 0.00 C ATOM 116 O LYS A 30 -11.670 -2.427 -6.818 1.00 0.00 O ATOM 117 CB LYS A 30 -12.652 -5.534 -7.569 1.00 0.00 C ATOM 118 CG LYS A 30 -12.071 -6.880 -7.169 1.00 0.00 C ATOM 119 CD LYS A 30 -12.155 -7.883 -8.312 1.00 0.00 C ATOM 120 CE LYS A 30 -11.501 -9.208 -7.952 1.00 0.00 C ATOM 121 NZ LYS A 30 -10.024 -9.085 -7.821 1.00 0.00 N ATOM 0 H LYS A 30 -14.540 -5.491 -5.954 1.00 0.00 H new ATOM 0 HA LYS A 30 -11.901 -4.672 -5.748 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -13.650 -5.690 -7.980 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -12.041 -5.111 -8.366 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -11.031 -6.754 -6.869 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -12.608 -7.267 -6.303 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -13.200 -8.052 -8.570 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -11.671 -7.468 -9.196 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -11.918 -9.575 -7.014 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -11.736 -9.948 -8.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -9.602 -10.032 -7.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -9.640 -8.602 -8.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -9.796 -8.534 -6.969 1.00 0.00 H new ATOM 135 N ALA A 31 -13.736 -2.677 -7.667 1.00 0.00 N ATOM 136 CA ALA A 31 -13.785 -1.331 -8.225 1.00 0.00 C ATOM 137 C ALA A 31 -13.608 -0.266 -7.155 1.00 0.00 C ATOM 138 O ALA A 31 -12.945 0.743 -7.383 1.00 0.00 O ATOM 139 CB ALA A 31 -15.094 -1.119 -8.966 1.00 0.00 C ATOM 0 H ALA A 31 -14.572 -3.236 -7.838 1.00 0.00 H new ATOM 0 HA ALA A 31 -12.954 -1.234 -8.924 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -15.119 -0.110 -9.378 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -15.175 -1.844 -9.776 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -15.928 -1.250 -8.276 1.00 0.00 H new ATOM 145 N ALA A 32 -14.182 -0.499 -5.984 1.00 0.00 N ATOM 146 CA ALA A 32 -14.073 0.454 -4.890 1.00 0.00 C ATOM 147 C ALA A 32 -12.628 0.548 -4.425 1.00 0.00 C ATOM 148 O ALA A 32 -12.100 1.637 -4.195 1.00 0.00 O ATOM 149 CB ALA A 32 -14.983 0.054 -3.737 1.00 0.00 C ATOM 0 H ALA A 32 -14.725 -1.335 -5.768 1.00 0.00 H new ATOM 0 HA ALA A 32 -14.391 1.434 -5.246 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -14.887 0.779 -2.929 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -16.017 0.029 -4.081 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -14.698 -0.933 -3.374 1.00 0.00 H new ATOM 155 N LEU A 33 -11.989 -0.608 -4.312 1.00 0.00 N ATOM 156 CA LEU A 33 -10.594 -0.684 -3.909 1.00 0.00 C ATOM 157 C LEU A 33 -9.691 -0.118 -4.997 1.00 0.00 C ATOM 158 O LEU A 33 -8.685 0.530 -4.711 1.00 0.00 O ATOM 159 CB LEU A 33 -10.209 -2.134 -3.613 1.00 0.00 C ATOM 160 CG LEU A 33 -11.083 -2.836 -2.571 1.00 0.00 C ATOM 161 CD1 LEU A 33 -10.612 -4.262 -2.343 1.00 0.00 C ATOM 162 CD2 LEU A 33 -11.099 -2.056 -1.267 1.00 0.00 C ATOM 0 H LEU A 33 -12.421 -1.514 -4.496 1.00 0.00 H new ATOM 0 HA LEU A 33 -10.464 -0.090 -3.005 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -10.251 -2.702 -4.542 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -9.174 -2.157 -3.272 1.00 0.00 H new ATOM 0 HG LEU A 33 -12.103 -2.875 -2.954 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -11.248 -4.741 -1.599 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -10.668 -4.818 -3.279 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -9.582 -4.252 -1.987 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -11.726 -2.573 -0.541 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -10.084 -1.977 -0.878 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -11.498 -1.058 -1.445 1.00 0.00 H new ATOM 174 N THR A 34 -10.067 -0.359 -6.246 1.00 0.00 N ATOM 175 CA THR A 34 -9.307 0.139 -7.377 1.00 0.00 C ATOM 176 C THR A 34 -9.391 1.658 -7.438 1.00 0.00 C ATOM 177 O THR A 34 -8.411 2.332 -7.744 1.00 0.00 O ATOM 178 CB THR A 34 -9.812 -0.460 -8.705 1.00 0.00 C ATOM 179 OG1 THR A 34 -9.808 -1.893 -8.632 1.00 0.00 O ATOM 180 CG2 THR A 34 -8.938 -0.016 -9.868 1.00 0.00 C ATOM 0 H THR A 34 -10.896 -0.898 -6.498 1.00 0.00 H new ATOM 0 HA THR A 34 -8.270 -0.165 -7.238 1.00 0.00 H new ATOM 0 HB THR A 34 -10.828 -0.103 -8.871 1.00 0.00 H new ATOM 0 HG1 THR A 34 -10.616 -2.199 -8.170 1.00 0.00 H new ATOM 0 HG21 THR A 34 -9.315 -0.452 -10.793 1.00 0.00 H new ATOM 0 HG22 THR A 34 -8.958 1.071 -9.944 1.00 0.00 H new ATOM 0 HG23 THR A 34 -7.914 -0.349 -9.701 1.00 0.00 H new ATOM 188 N ASP A 35 -10.565 2.191 -7.124 1.00 0.00 N ATOM 189 CA ASP A 35 -10.770 3.633 -7.104 1.00 0.00 C ATOM 190 C ASP A 35 -9.977 4.253 -5.963 1.00 0.00 C ATOM 191 O ASP A 35 -9.381 5.322 -6.106 1.00 0.00 O ATOM 192 CB ASP A 35 -12.254 3.965 -6.956 1.00 0.00 C ATOM 193 CG ASP A 35 -12.538 5.438 -7.168 1.00 0.00 C ATOM 194 OD1 ASP A 35 -12.491 6.210 -6.188 1.00 0.00 O ATOM 195 OD2 ASP A 35 -12.814 5.826 -8.323 1.00 0.00 O ATOM 0 H ASP A 35 -11.391 1.645 -6.879 1.00 0.00 H new ATOM 0 HA ASP A 35 -10.419 4.047 -8.049 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -12.828 3.380 -7.674 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -12.592 3.671 -5.962 1.00 0.00 H new ATOM 200 N MET A 36 -9.968 3.558 -4.830 1.00 0.00 N ATOM 201 CA MET A 36 -9.171 3.963 -3.675 1.00 0.00 C ATOM 202 C MET A 36 -7.696 4.012 -4.057 1.00 0.00 C ATOM 203 O MET A 36 -6.998 4.989 -3.783 1.00 0.00 O ATOM 204 CB MET A 36 -9.380 2.978 -2.519 1.00 0.00 C ATOM 205 CG MET A 36 -8.440 3.192 -1.344 1.00 0.00 C ATOM 206 SD MET A 36 -8.501 1.829 -0.168 1.00 0.00 S ATOM 207 CE MET A 36 -7.268 2.350 1.019 1.00 0.00 C ATOM 0 H MET A 36 -10.508 2.705 -4.686 1.00 0.00 H new ATOM 0 HA MET A 36 -9.490 4.955 -3.354 1.00 0.00 H new ATOM 0 HB2 MET A 36 -10.408 3.060 -2.167 1.00 0.00 H new ATOM 0 HB3 MET A 36 -9.251 1.962 -2.893 1.00 0.00 H new ATOM 0 HG2 MET A 36 -7.421 3.307 -1.712 1.00 0.00 H new ATOM 0 HG3 MET A 36 -8.701 4.120 -0.836 1.00 0.00 H new ATOM 0 HE1 MET A 36 -7.405 1.801 1.951 1.00 0.00 H new ATOM 0 HE2 MET A 36 -6.273 2.149 0.622 1.00 0.00 H new ATOM 0 HE3 MET A 36 -7.374 3.418 1.209 1.00 0.00 H new ATOM 217 N LEU A 37 -7.243 2.955 -4.717 1.00 0.00 N ATOM 218 CA LEU A 37 -5.872 2.869 -5.194 1.00 0.00 C ATOM 219 C LEU A 37 -5.595 3.966 -6.217 1.00 0.00 C ATOM 220 O LEU A 37 -4.543 4.602 -6.196 1.00 0.00 O ATOM 221 CB LEU A 37 -5.632 1.494 -5.819 1.00 0.00 C ATOM 222 CG LEU A 37 -4.226 1.253 -6.376 1.00 0.00 C ATOM 223 CD1 LEU A 37 -3.214 1.122 -5.249 1.00 0.00 C ATOM 224 CD2 LEU A 37 -4.214 0.016 -7.256 1.00 0.00 C ATOM 0 H LEU A 37 -7.813 2.138 -4.935 1.00 0.00 H new ATOM 0 HA LEU A 37 -5.194 3.004 -4.351 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -5.840 0.733 -5.067 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -6.351 1.351 -6.625 1.00 0.00 H new ATOM 0 HG LEU A 37 -3.943 2.113 -6.983 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -2.222 0.951 -5.668 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.206 2.039 -4.659 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -3.487 0.282 -4.610 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -3.209 -0.144 -7.645 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -4.518 -0.851 -6.669 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -4.907 0.153 -8.086 1.00 0.00 H new ATOM 236 N GLN A 38 -6.564 4.193 -7.092 1.00 0.00 N ATOM 237 CA GLN A 38 -6.446 5.192 -8.144 1.00 0.00 C ATOM 238 C GLN A 38 -6.335 6.594 -7.552 1.00 0.00 C ATOM 239 O GLN A 38 -5.696 7.469 -8.129 1.00 0.00 O ATOM 240 CB GLN A 38 -7.653 5.106 -9.086 1.00 0.00 C ATOM 241 CG GLN A 38 -7.559 6.015 -10.301 1.00 0.00 C ATOM 242 CD GLN A 38 -6.378 5.684 -11.198 1.00 0.00 C ATOM 243 OE1 GLN A 38 -6.009 4.409 -11.265 1.00 0.00 O flip ATOM 244 NE2 GLN A 38 -5.810 6.568 -11.838 1.00 0.00 N flip ATOM 0 H GLN A 38 -7.452 3.691 -7.093 1.00 0.00 H new ATOM 0 HA GLN A 38 -5.537 4.990 -8.711 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -7.763 4.076 -9.424 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -8.555 5.356 -8.527 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -8.480 5.937 -10.878 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -7.477 7.050 -9.969 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -6.123 7.536 -11.760 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -5.026 6.333 -12.447 1.00 0.00 H new ATOM 253 N THR A 39 -6.953 6.800 -6.397 1.00 0.00 N ATOM 254 CA THR A 39 -6.874 8.078 -5.700 1.00 0.00 C ATOM 255 C THR A 39 -5.509 8.238 -5.034 1.00 0.00 C ATOM 256 O THR A 39 -4.980 9.347 -4.910 1.00 0.00 O ATOM 257 CB THR A 39 -7.984 8.192 -4.637 1.00 0.00 C ATOM 258 OG1 THR A 39 -9.257 7.931 -5.238 1.00 0.00 O ATOM 259 CG2 THR A 39 -7.999 9.575 -3.999 1.00 0.00 C ATOM 0 H THR A 39 -7.517 6.096 -5.921 1.00 0.00 H new ATOM 0 HA THR A 39 -7.010 8.871 -6.436 1.00 0.00 H new ATOM 0 HB THR A 39 -7.782 7.457 -3.858 1.00 0.00 H new ATOM 0 HG1 THR A 39 -9.351 6.969 -5.399 1.00 0.00 H new ATOM 0 HG21 THR A 39 -8.793 9.623 -3.254 1.00 0.00 H new ATOM 0 HG22 THR A 39 -7.039 9.765 -3.519 1.00 0.00 H new ATOM 0 HG23 THR A 39 -8.176 10.328 -4.767 1.00 0.00 H new ATOM 267 N PHE A 40 -4.942 7.116 -4.616 1.00 0.00 N ATOM 268 CA PHE A 40 -3.637 7.106 -3.976 1.00 0.00 C ATOM 269 C PHE A 40 -2.525 7.404 -4.982 1.00 0.00 C ATOM 270 O PHE A 40 -1.524 8.037 -4.639 1.00 0.00 O ATOM 271 CB PHE A 40 -3.386 5.762 -3.292 1.00 0.00 C ATOM 272 CG PHE A 40 -2.097 5.723 -2.527 1.00 0.00 C ATOM 273 CD1 PHE A 40 -1.146 4.757 -2.801 1.00 0.00 C ATOM 274 CD2 PHE A 40 -1.829 6.667 -1.545 1.00 0.00 C ATOM 275 CE1 PHE A 40 0.048 4.731 -2.114 1.00 0.00 C ATOM 276 CE2 PHE A 40 -0.638 6.644 -0.853 1.00 0.00 C ATOM 277 CZ PHE A 40 0.304 5.676 -1.137 1.00 0.00 C ATOM 0 H PHE A 40 -5.370 6.195 -4.710 1.00 0.00 H new ATOM 0 HA PHE A 40 -3.630 7.892 -3.221 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -4.211 5.547 -2.613 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -3.379 4.974 -4.045 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -1.341 4.015 -3.561 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -2.562 7.428 -1.321 1.00 0.00 H new ATOM 0 HE1 PHE A 40 0.784 3.973 -2.338 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -0.442 7.382 -0.090 1.00 0.00 H new ATOM 0 HZ PHE A 40 1.239 5.656 -0.597 1.00 0.00 H new ATOM 287 N VAL A 41 -2.701 6.929 -6.216 1.00 0.00 N ATOM 288 CA VAL A 41 -1.697 7.090 -7.270 1.00 0.00 C ATOM 289 C VAL A 41 -1.161 8.532 -7.370 1.00 0.00 C ATOM 290 O VAL A 41 0.055 8.724 -7.353 1.00 0.00 O ATOM 291 CB VAL A 41 -2.227 6.620 -8.646 1.00 0.00 C ATOM 292 CG1 VAL A 41 -1.230 6.938 -9.747 1.00 0.00 C ATOM 293 CG2 VAL A 41 -2.524 5.131 -8.619 1.00 0.00 C ATOM 0 H VAL A 41 -3.537 6.425 -6.512 1.00 0.00 H new ATOM 0 HA VAL A 41 -0.863 6.450 -6.983 1.00 0.00 H new ATOM 0 HB VAL A 41 -3.151 7.158 -8.856 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -1.625 6.598 -10.705 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -1.061 8.014 -9.785 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -0.288 6.430 -9.542 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -2.896 4.816 -9.594 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -1.612 4.582 -8.384 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -3.278 4.924 -7.859 1.00 0.00 H new ATOM 303 N PRO A 42 -2.033 9.565 -7.472 1.00 0.00 N ATOM 304 CA PRO A 42 -1.583 10.962 -7.512 1.00 0.00 C ATOM 305 C PRO A 42 -0.708 11.339 -6.320 1.00 0.00 C ATOM 306 O PRO A 42 0.257 12.088 -6.474 1.00 0.00 O ATOM 307 CB PRO A 42 -2.877 11.773 -7.490 1.00 0.00 C ATOM 308 CG PRO A 42 -3.915 10.849 -8.017 1.00 0.00 C ATOM 309 CD PRO A 42 -3.500 9.471 -7.588 1.00 0.00 C ATOM 0 HA PRO A 42 -0.964 11.147 -8.390 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -3.119 12.104 -6.480 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -2.794 12.667 -8.108 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -4.899 11.101 -7.621 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -3.982 10.916 -9.103 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -3.959 9.192 -6.640 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -3.796 8.718 -8.319 1.00 0.00 H new ATOM 317 N TYR A 43 -1.027 10.818 -5.133 1.00 0.00 N ATOM 318 CA TYR A 43 -0.259 11.145 -3.933 1.00 0.00 C ATOM 319 C TYR A 43 1.149 10.565 -3.998 1.00 0.00 C ATOM 320 O TYR A 43 2.068 11.084 -3.363 1.00 0.00 O ATOM 321 CB TYR A 43 -0.955 10.617 -2.671 1.00 0.00 C ATOM 322 CG TYR A 43 -2.140 11.443 -2.213 1.00 0.00 C ATOM 323 CD1 TYR A 43 -1.951 12.655 -1.558 1.00 0.00 C ATOM 324 CD2 TYR A 43 -3.446 11.003 -2.410 1.00 0.00 C ATOM 325 CE1 TYR A 43 -3.024 13.403 -1.115 1.00 0.00 C ATOM 326 CE2 TYR A 43 -4.524 11.750 -1.972 1.00 0.00 C ATOM 327 CZ TYR A 43 -4.306 12.949 -1.324 1.00 0.00 C ATOM 328 OH TYR A 43 -5.376 13.692 -0.878 1.00 0.00 O ATOM 0 H TYR A 43 -1.804 10.175 -4.979 1.00 0.00 H new ATOM 0 HA TYR A 43 -0.196 12.232 -3.886 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -1.290 9.596 -2.856 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -0.226 10.571 -1.862 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -0.947 13.018 -1.393 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -3.620 10.063 -2.913 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -2.857 14.341 -0.606 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -5.531 11.397 -2.136 1.00 0.00 H new ATOM 0 HH TYR A 43 -5.129 14.158 -0.052 1.00 0.00 H new ATOM 338 N ARG A 44 1.312 9.484 -4.754 1.00 0.00 N ATOM 339 CA ARG A 44 2.613 8.837 -4.873 1.00 0.00 C ATOM 340 C ARG A 44 3.643 9.813 -5.404 1.00 0.00 C ATOM 341 O ARG A 44 4.754 9.860 -4.908 1.00 0.00 O ATOM 342 CB ARG A 44 2.558 7.616 -5.785 1.00 0.00 C ATOM 343 CG ARG A 44 1.576 6.555 -5.331 1.00 0.00 C ATOM 344 CD ARG A 44 1.742 5.275 -6.142 1.00 0.00 C ATOM 345 NE ARG A 44 1.807 5.537 -7.582 1.00 0.00 N ATOM 346 CZ ARG A 44 2.049 4.599 -8.501 1.00 0.00 C ATOM 347 NH1 ARG A 44 2.206 3.334 -8.135 1.00 0.00 N ATOM 348 NH2 ARG A 44 2.128 4.926 -9.785 1.00 0.00 N ATOM 0 H ARG A 44 0.566 9.041 -5.289 1.00 0.00 H new ATOM 0 HA ARG A 44 2.899 8.506 -3.875 1.00 0.00 H new ATOM 0 HB2 ARG A 44 2.291 7.938 -6.791 1.00 0.00 H new ATOM 0 HB3 ARG A 44 3.553 7.175 -5.845 1.00 0.00 H new ATOM 0 HG2 ARG A 44 1.729 6.342 -4.273 1.00 0.00 H new ATOM 0 HG3 ARG A 44 0.557 6.928 -5.437 1.00 0.00 H new ATOM 0 HD2 ARG A 44 2.651 4.762 -5.826 1.00 0.00 H new ATOM 0 HD3 ARG A 44 0.909 4.604 -5.934 1.00 0.00 H new ATOM 0 HE ARG A 44 1.658 6.494 -7.902 1.00 0.00 H new ATOM 0 HH11 ARG A 44 2.142 3.076 -7.150 1.00 0.00 H new ATOM 0 HH12 ARG A 44 2.391 2.619 -8.838 1.00 0.00 H new ATOM 0 HH21 ARG A 44 2.004 5.897 -10.073 1.00 0.00 H new ATOM 0 HH22 ARG A 44 2.313 4.207 -10.484 1.00 0.00 H new ATOM 362 N THR A 45 3.261 10.584 -6.414 1.00 0.00 N ATOM 363 CA THR A 45 4.140 11.600 -6.986 1.00 0.00 C ATOM 364 C THR A 45 4.725 12.524 -5.913 1.00 0.00 C ATOM 365 O THR A 45 5.907 12.857 -5.957 1.00 0.00 O ATOM 366 CB THR A 45 3.380 12.436 -8.031 1.00 0.00 C ATOM 367 OG1 THR A 45 2.798 11.569 -9.015 1.00 0.00 O ATOM 368 CG2 THR A 45 4.301 13.432 -8.718 1.00 0.00 C ATOM 0 H THR A 45 2.344 10.526 -6.857 1.00 0.00 H new ATOM 0 HA THR A 45 4.968 11.078 -7.465 1.00 0.00 H new ATOM 0 HB THR A 45 2.598 12.991 -7.514 1.00 0.00 H new ATOM 0 HG1 THR A 45 2.314 12.105 -9.677 1.00 0.00 H new ATOM 0 HG21 THR A 45 3.734 14.007 -9.450 1.00 0.00 H new ATOM 0 HG22 THR A 45 4.725 14.108 -7.975 1.00 0.00 H new ATOM 0 HG23 THR A 45 5.105 12.896 -9.222 1.00 0.00 H new ATOM 376 N ALA A 46 3.913 12.898 -4.933 1.00 0.00 N ATOM 377 CA ALA A 46 4.383 13.741 -3.834 1.00 0.00 C ATOM 378 C ALA A 46 5.455 13.007 -3.029 1.00 0.00 C ATOM 379 O ALA A 46 6.441 13.597 -2.577 1.00 0.00 O ATOM 380 CB ALA A 46 3.218 14.132 -2.937 1.00 0.00 C ATOM 0 H ALA A 46 2.930 12.634 -4.874 1.00 0.00 H new ATOM 0 HA ALA A 46 4.821 14.649 -4.248 1.00 0.00 H new ATOM 0 HB1 ALA A 46 3.580 14.759 -2.123 1.00 0.00 H new ATOM 0 HB2 ALA A 46 2.480 14.684 -3.519 1.00 0.00 H new ATOM 0 HB3 ALA A 46 2.758 13.233 -2.526 1.00 0.00 H new ATOM 386 N VAL A 47 5.252 11.709 -2.880 1.00 0.00 N ATOM 387 CA VAL A 47 6.205 10.847 -2.192 1.00 0.00 C ATOM 388 C VAL A 47 7.450 10.637 -3.056 1.00 0.00 C ATOM 389 O VAL A 47 8.579 10.692 -2.566 1.00 0.00 O ATOM 390 CB VAL A 47 5.576 9.482 -1.831 1.00 0.00 C ATOM 391 CG1 VAL A 47 6.616 8.539 -1.238 1.00 0.00 C ATOM 392 CG2 VAL A 47 4.415 9.668 -0.862 1.00 0.00 C ATOM 0 H VAL A 47 4.427 11.222 -3.230 1.00 0.00 H new ATOM 0 HA VAL A 47 6.490 11.343 -1.264 1.00 0.00 H new ATOM 0 HB VAL A 47 5.196 9.034 -2.749 1.00 0.00 H new ATOM 0 HG11 VAL A 47 6.146 7.586 -0.993 1.00 0.00 H new ATOM 0 HG12 VAL A 47 7.413 8.375 -1.963 1.00 0.00 H new ATOM 0 HG13 VAL A 47 7.034 8.981 -0.333 1.00 0.00 H new ATOM 0 HG21 VAL A 47 3.985 8.696 -0.619 1.00 0.00 H new ATOM 0 HG22 VAL A 47 4.775 10.144 0.050 1.00 0.00 H new ATOM 0 HG23 VAL A 47 3.654 10.297 -1.323 1.00 0.00 H new ATOM 402 N GLU A 48 7.225 10.419 -4.349 1.00 0.00 N ATOM 403 CA GLU A 48 8.302 10.163 -5.299 1.00 0.00 C ATOM 404 C GLU A 48 9.238 11.356 -5.388 1.00 0.00 C ATOM 405 O GLU A 48 10.451 11.195 -5.374 1.00 0.00 O ATOM 406 CB GLU A 48 7.742 9.856 -6.694 1.00 0.00 C ATOM 407 CG GLU A 48 6.844 8.630 -6.755 1.00 0.00 C ATOM 408 CD GLU A 48 6.225 8.436 -8.123 1.00 0.00 C ATOM 409 OE1 GLU A 48 6.876 7.825 -8.995 1.00 0.00 O ATOM 410 OE2 GLU A 48 5.085 8.892 -8.337 1.00 0.00 O ATOM 0 H GLU A 48 6.294 10.415 -4.766 1.00 0.00 H new ATOM 0 HA GLU A 48 8.857 9.297 -4.938 1.00 0.00 H new ATOM 0 HB2 GLU A 48 7.179 10.721 -7.045 1.00 0.00 H new ATOM 0 HB3 GLU A 48 8.574 9.716 -7.384 1.00 0.00 H new ATOM 0 HG2 GLU A 48 7.424 7.745 -6.493 1.00 0.00 H new ATOM 0 HG3 GLU A 48 6.053 8.725 -6.011 1.00 0.00 H new ATOM 417 N LEU A 49 8.667 12.553 -5.469 1.00 0.00 N ATOM 418 CA LEU A 49 9.460 13.773 -5.558 1.00 0.00 C ATOM 419 C LEU A 49 10.379 13.903 -4.355 1.00 0.00 C ATOM 420 O LEU A 49 11.556 14.235 -4.492 1.00 0.00 O ATOM 421 CB LEU A 49 8.550 15.000 -5.661 1.00 0.00 C ATOM 422 CG LEU A 49 8.289 15.515 -7.081 1.00 0.00 C ATOM 423 CD1 LEU A 49 9.566 16.065 -7.692 1.00 0.00 C ATOM 424 CD2 LEU A 49 7.717 14.416 -7.964 1.00 0.00 C ATOM 0 H LEU A 49 7.658 12.704 -5.475 1.00 0.00 H new ATOM 0 HA LEU A 49 10.072 13.716 -6.458 1.00 0.00 H new ATOM 0 HB2 LEU A 49 7.592 14.759 -5.200 1.00 0.00 H new ATOM 0 HB3 LEU A 49 8.991 15.807 -5.077 1.00 0.00 H new ATOM 0 HG LEU A 49 7.556 16.319 -7.016 1.00 0.00 H new ATOM 0 HD11 LEU A 49 9.361 16.426 -8.700 1.00 0.00 H new ATOM 0 HD12 LEU A 49 9.937 16.888 -7.081 1.00 0.00 H new ATOM 0 HD13 LEU A 49 10.318 15.277 -7.735 1.00 0.00 H new ATOM 0 HD21 LEU A 49 7.541 14.808 -8.966 1.00 0.00 H new ATOM 0 HD22 LEU A 49 8.423 13.588 -8.018 1.00 0.00 H new ATOM 0 HD23 LEU A 49 6.776 14.063 -7.542 1.00 0.00 H new ATOM 436 N CYS A 50 9.839 13.615 -3.185 1.00 0.00 N ATOM 437 CA CYS A 50 10.616 13.635 -1.959 1.00 0.00 C ATOM 438 C CYS A 50 11.700 12.552 -1.994 1.00 0.00 C ATOM 439 O CYS A 50 12.875 12.821 -1.722 1.00 0.00 O ATOM 440 CB CYS A 50 9.684 13.440 -0.763 1.00 0.00 C ATOM 441 SG CYS A 50 10.533 13.141 0.815 1.00 0.00 S ATOM 0 H CYS A 50 8.859 13.363 -3.058 1.00 0.00 H new ATOM 0 HA CYS A 50 11.114 14.600 -1.862 1.00 0.00 H new ATOM 0 HB2 CYS A 50 9.055 14.325 -0.661 1.00 0.00 H new ATOM 0 HB3 CYS A 50 9.021 12.600 -0.969 1.00 0.00 H new ATOM 446 N ALA A 51 11.301 11.336 -2.359 1.00 0.00 N ATOM 447 CA ALA A 51 12.225 10.205 -2.449 1.00 0.00 C ATOM 448 C ALA A 51 13.297 10.424 -3.516 1.00 0.00 C ATOM 449 O ALA A 51 14.354 9.805 -3.477 1.00 0.00 O ATOM 450 CB ALA A 51 11.460 8.922 -2.741 1.00 0.00 C ATOM 0 H ALA A 51 10.337 11.106 -2.599 1.00 0.00 H new ATOM 0 HA ALA A 51 12.728 10.120 -1.486 1.00 0.00 H new ATOM 0 HB1 ALA A 51 12.159 8.088 -2.806 1.00 0.00 H new ATOM 0 HB2 ALA A 51 10.745 8.735 -1.940 1.00 0.00 H new ATOM 0 HB3 ALA A 51 10.928 9.023 -3.687 1.00 0.00 H new ATOM 456 N LEU A 52 13.003 11.269 -4.488 1.00 0.00 N ATOM 457 CA LEU A 52 13.966 11.603 -5.530 1.00 0.00 C ATOM 458 C LEU A 52 14.921 12.699 -5.067 1.00 0.00 C ATOM 459 O LEU A 52 16.138 12.560 -5.171 1.00 0.00 O ATOM 460 CB LEU A 52 13.249 12.047 -6.814 1.00 0.00 C ATOM 461 CG LEU A 52 12.484 10.946 -7.561 1.00 0.00 C ATOM 462 CD1 LEU A 52 11.681 11.544 -8.707 1.00 0.00 C ATOM 463 CD2 LEU A 52 13.439 9.885 -8.087 1.00 0.00 C ATOM 0 H LEU A 52 12.103 11.739 -4.580 1.00 0.00 H new ATOM 0 HA LEU A 52 14.545 10.704 -5.741 1.00 0.00 H new ATOM 0 HB2 LEU A 52 12.549 12.843 -6.561 1.00 0.00 H new ATOM 0 HB3 LEU A 52 13.988 12.475 -7.492 1.00 0.00 H new ATOM 0 HG LEU A 52 11.798 10.472 -6.859 1.00 0.00 H new ATOM 0 HD11 LEU A 52 11.144 10.751 -9.227 1.00 0.00 H new ATOM 0 HD12 LEU A 52 10.967 12.267 -8.313 1.00 0.00 H new ATOM 0 HD13 LEU A 52 12.356 12.042 -9.403 1.00 0.00 H new ATOM 0 HD21 LEU A 52 12.874 9.115 -8.613 1.00 0.00 H new ATOM 0 HD22 LEU A 52 14.151 10.344 -8.773 1.00 0.00 H new ATOM 0 HD23 LEU A 52 13.977 9.434 -7.253 1.00 0.00 H new ATOM 475 N GLU A 53 14.356 13.778 -4.539 1.00 0.00 N ATOM 476 CA GLU A 53 15.123 14.975 -4.206 1.00 0.00 C ATOM 477 C GLU A 53 16.049 14.745 -3.011 1.00 0.00 C ATOM 478 O GLU A 53 17.152 15.293 -2.956 1.00 0.00 O ATOM 479 CB GLU A 53 14.167 16.138 -3.936 1.00 0.00 C ATOM 480 CG GLU A 53 14.857 17.480 -3.773 1.00 0.00 C ATOM 481 CD GLU A 53 13.877 18.633 -3.761 1.00 0.00 C ATOM 482 OE1 GLU A 53 13.531 19.115 -2.666 1.00 0.00 O ATOM 483 OE2 GLU A 53 13.447 19.062 -4.853 1.00 0.00 O ATOM 0 H GLU A 53 13.360 13.850 -4.330 1.00 0.00 H new ATOM 0 HA GLU A 53 15.758 15.220 -5.057 1.00 0.00 H new ATOM 0 HB2 GLU A 53 13.453 16.206 -4.757 1.00 0.00 H new ATOM 0 HB3 GLU A 53 13.596 15.923 -3.033 1.00 0.00 H new ATOM 0 HG2 GLU A 53 15.428 17.482 -2.844 1.00 0.00 H new ATOM 0 HG3 GLU A 53 15.570 17.620 -4.586 1.00 0.00 H new ATOM 490 N HIS A 54 15.609 13.921 -2.073 1.00 0.00 N ATOM 491 CA HIS A 54 16.412 13.634 -0.885 1.00 0.00 C ATOM 492 C HIS A 54 16.994 12.226 -0.979 1.00 0.00 C ATOM 493 O HIS A 54 17.886 11.847 -0.220 1.00 0.00 O ATOM 494 CB HIS A 54 15.558 13.782 0.382 1.00 0.00 C ATOM 495 CG HIS A 54 16.342 13.690 1.659 1.00 0.00 C ATOM 496 ND1 HIS A 54 17.041 14.752 2.188 1.00 0.00 N ATOM 497 CD2 HIS A 54 16.535 12.654 2.510 1.00 0.00 C ATOM 498 CE1 HIS A 54 17.633 14.375 3.305 1.00 0.00 C ATOM 499 NE2 HIS A 54 17.342 13.105 3.524 1.00 0.00 N ATOM 0 H HIS A 54 14.710 13.441 -2.106 1.00 0.00 H new ATOM 0 HA HIS A 54 17.233 14.348 -0.830 1.00 0.00 H new ATOM 0 HB2 HIS A 54 15.044 14.743 0.351 1.00 0.00 H new ATOM 0 HB3 HIS A 54 14.790 13.009 0.383 1.00 0.00 H new ATOM 0 HD2 HIS A 54 16.129 11.658 2.409 1.00 0.00 H new ATOM 0 HE1 HIS A 54 18.251 14.999 3.934 1.00 0.00 H new ATOM 0 HE2 HIS A 54 17.664 12.551 4.317 1.00 0.00 H new ATOM 508 N GLY A 55 16.472 11.471 -1.934 1.00 0.00 N ATOM 509 CA GLY A 55 16.890 10.100 -2.195 1.00 0.00 C ATOM 510 C GLY A 55 16.542 9.123 -1.082 1.00 0.00 C ATOM 511 O GLY A 55 16.484 7.918 -1.317 1.00 0.00 O ATOM 0 H GLY A 55 15.735 11.798 -2.559 1.00 0.00 H new ATOM 0 HA2 GLY A 55 16.426 9.760 -3.121 1.00 0.00 H new ATOM 0 HA3 GLY A 55 17.968 10.084 -2.354 1.00 0.00 H new ATOM 515 N GLY A 56 16.306 9.623 0.122 1.00 0.00 N ATOM 516 CA GLY A 56 15.659 8.803 1.125 1.00 0.00 C ATOM 517 C GLY A 56 14.299 9.327 1.532 1.00 0.00 C ATOM 518 O GLY A 56 14.047 10.532 1.493 1.00 0.00 O ATOM 0 H GLY A 56 16.547 10.568 0.420 1.00 0.00 H new ATOM 0 HA2 GLY A 56 15.551 7.788 0.742 1.00 0.00 H new ATOM 0 HA3 GLY A 56 16.298 8.745 2.006 1.00 0.00 H new ATOM 522 N LEU A 57 13.440 8.406 1.948 1.00 0.00 N ATOM 523 CA LEU A 57 12.078 8.720 2.372 1.00 0.00 C ATOM 524 C LEU A 57 12.053 9.398 3.735 1.00 0.00 C ATOM 525 O LEU A 57 10.989 9.755 4.241 1.00 0.00 O ATOM 526 CB LEU A 57 11.246 7.443 2.421 1.00 0.00 C ATOM 527 CG LEU A 57 11.073 6.729 1.081 1.00 0.00 C ATOM 528 CD1 LEU A 57 10.743 5.269 1.309 1.00 0.00 C ATOM 529 CD2 LEU A 57 9.985 7.398 0.253 1.00 0.00 C ATOM 0 H LEU A 57 13.668 7.413 2.002 1.00 0.00 H new ATOM 0 HA LEU A 57 11.655 9.413 1.645 1.00 0.00 H new ATOM 0 HB2 LEU A 57 11.710 6.753 3.125 1.00 0.00 H new ATOM 0 HB3 LEU A 57 10.259 7.686 2.816 1.00 0.00 H new ATOM 0 HG LEU A 57 12.010 6.795 0.528 1.00 0.00 H new ATOM 0 HD11 LEU A 57 10.622 4.769 0.348 1.00 0.00 H new ATOM 0 HD12 LEU A 57 11.552 4.796 1.865 1.00 0.00 H new ATOM 0 HD13 LEU A 57 9.817 5.190 1.879 1.00 0.00 H new ATOM 0 HD21 LEU A 57 9.877 6.875 -0.697 1.00 0.00 H new ATOM 0 HD22 LEU A 57 9.041 7.362 0.796 1.00 0.00 H new ATOM 0 HD23 LEU A 57 10.257 8.437 0.066 1.00 0.00 H new ATOM 541 N ASP A 58 13.222 9.538 4.337 1.00 0.00 N ATOM 542 CA ASP A 58 13.360 10.126 5.665 1.00 0.00 C ATOM 543 C ASP A 58 12.650 11.475 5.766 1.00 0.00 C ATOM 544 O ASP A 58 12.059 11.800 6.795 1.00 0.00 O ATOM 545 CB ASP A 58 14.839 10.299 6.015 1.00 0.00 C ATOM 546 CG ASP A 58 15.609 8.995 5.973 1.00 0.00 C ATOM 547 OD1 ASP A 58 15.878 8.494 4.860 1.00 0.00 O ATOM 548 OD2 ASP A 58 15.959 8.459 7.049 1.00 0.00 O ATOM 0 H ASP A 58 14.106 9.247 3.920 1.00 0.00 H new ATOM 0 HA ASP A 58 12.891 9.443 6.373 1.00 0.00 H new ATOM 0 HB2 ASP A 58 15.292 11.006 5.320 1.00 0.00 H new ATOM 0 HB3 ASP A 58 14.923 10.734 7.011 1.00 0.00 H new ATOM 553 N THR A 59 12.715 12.263 4.706 1.00 0.00 N ATOM 554 CA THR A 59 12.068 13.568 4.686 1.00 0.00 C ATOM 555 C THR A 59 10.641 13.495 4.148 1.00 0.00 C ATOM 556 O THR A 59 9.984 14.519 3.967 1.00 0.00 O ATOM 557 CB THR A 59 12.878 14.560 3.835 1.00 0.00 C ATOM 558 OG1 THR A 59 13.226 13.952 2.583 1.00 0.00 O ATOM 559 CG2 THR A 59 14.140 14.992 4.564 1.00 0.00 C ATOM 0 H THR A 59 13.209 12.023 3.846 1.00 0.00 H new ATOM 0 HA THR A 59 12.026 13.914 5.719 1.00 0.00 H new ATOM 0 HB THR A 59 12.264 15.442 3.655 1.00 0.00 H new ATOM 0 HG1 THR A 59 12.409 13.726 2.091 1.00 0.00 H new ATOM 0 HG21 THR A 59 14.697 15.694 3.943 1.00 0.00 H new ATOM 0 HG22 THR A 59 13.870 15.474 5.504 1.00 0.00 H new ATOM 0 HG23 THR A 59 14.759 14.118 4.769 1.00 0.00 H new ATOM 567 N CYS A 60 10.156 12.290 3.906 1.00 0.00 N ATOM 568 CA CYS A 60 8.840 12.112 3.315 1.00 0.00 C ATOM 569 C CYS A 60 7.822 11.762 4.393 1.00 0.00 C ATOM 570 O CYS A 60 7.129 10.749 4.307 1.00 0.00 O ATOM 571 CB CYS A 60 8.888 11.010 2.257 1.00 0.00 C ATOM 572 SG CYS A 60 10.290 11.146 1.095 1.00 0.00 S ATOM 0 H CYS A 60 10.652 11.422 4.109 1.00 0.00 H new ATOM 0 HA CYS A 60 8.537 13.045 2.840 1.00 0.00 H new ATOM 0 HB2 CYS A 60 8.939 10.043 2.758 1.00 0.00 H new ATOM 0 HB3 CYS A 60 7.958 11.026 1.689 1.00 0.00 H new ATOM 577 N ASP A 61 7.735 12.602 5.409 1.00 0.00 N ATOM 578 CA ASP A 61 6.863 12.327 6.539 1.00 0.00 C ATOM 579 C ASP A 61 5.668 13.274 6.533 1.00 0.00 C ATOM 580 O ASP A 61 5.826 14.480 6.351 1.00 0.00 O ATOM 581 CB ASP A 61 7.641 12.469 7.842 1.00 0.00 C ATOM 582 CG ASP A 61 6.936 11.802 9.001 1.00 0.00 C ATOM 583 OD1 ASP A 61 6.340 12.518 9.832 1.00 0.00 O ATOM 584 OD2 ASP A 61 6.980 10.559 9.087 1.00 0.00 O ATOM 0 H ASP A 61 8.255 13.477 5.476 1.00 0.00 H new ATOM 0 HA ASP A 61 6.494 11.305 6.456 1.00 0.00 H new ATOM 0 HB2 ASP A 61 8.632 12.032 7.721 1.00 0.00 H new ATOM 0 HB3 ASP A 61 7.784 13.526 8.065 1.00 0.00 H new ATOM 589 N GLY A 62 4.482 12.721 6.742 1.00 0.00 N ATOM 590 CA GLY A 62 3.270 13.515 6.679 1.00 0.00 C ATOM 591 C GLY A 62 3.096 14.390 7.900 1.00 0.00 C ATOM 592 O GLY A 62 2.898 13.887 9.008 1.00 0.00 O ATOM 0 H GLY A 62 4.336 11.734 6.955 1.00 0.00 H new ATOM 0 HA2 GLY A 62 3.293 14.140 5.786 1.00 0.00 H new ATOM 0 HA3 GLY A 62 2.409 12.854 6.582 1.00 0.00 H new ATOM 596 N GLY A 63 3.181 15.696 7.704 1.00 0.00 N ATOM 597 CA GLY A 63 3.027 16.625 8.805 1.00 0.00 C ATOM 598 C GLY A 63 4.299 17.394 9.089 1.00 0.00 C ATOM 599 O GLY A 63 4.317 18.286 9.934 1.00 0.00 O ATOM 0 H GLY A 63 3.355 16.132 6.798 1.00 0.00 H new ATOM 0 HA2 GLY A 63 2.224 17.326 8.576 1.00 0.00 H new ATOM 0 HA3 GLY A 63 2.728 16.079 9.699 1.00 0.00 H new ATOM 603 N SER A 64 5.365 17.051 8.382 1.00 0.00 N ATOM 604 CA SER A 64 6.652 17.692 8.580 1.00 0.00 C ATOM 605 C SER A 64 7.424 17.735 7.264 1.00 0.00 C ATOM 606 O SER A 64 6.964 17.192 6.259 1.00 0.00 O ATOM 607 CB SER A 64 7.446 16.939 9.650 1.00 0.00 C ATOM 608 OG SER A 64 7.486 15.548 9.370 1.00 0.00 O ATOM 0 H SER A 64 5.362 16.328 7.663 1.00 0.00 H new ATOM 0 HA SER A 64 6.496 18.716 8.919 1.00 0.00 H new ATOM 0 HB2 SER A 64 8.461 17.333 9.699 1.00 0.00 H new ATOM 0 HB3 SER A 64 6.993 17.104 10.627 1.00 0.00 H new ATOM 0 HG SER A 64 8.000 15.089 10.067 1.00 0.00 H new ATOM 614 N ASN A 65 8.578 18.400 7.270 1.00 0.00 N ATOM 615 CA ASN A 65 9.460 18.457 6.099 1.00 0.00 C ATOM 616 C ASN A 65 8.776 19.116 4.906 1.00 0.00 C ATOM 617 O ASN A 65 9.070 18.795 3.755 1.00 0.00 O ATOM 618 CB ASN A 65 9.938 17.053 5.702 1.00 0.00 C ATOM 619 CG ASN A 65 10.699 16.345 6.812 1.00 0.00 C ATOM 620 OD1 ASN A 65 11.912 16.504 6.946 1.00 0.00 O ATOM 621 ND2 ASN A 65 9.999 15.549 7.610 1.00 0.00 N ATOM 0 H ASN A 65 8.929 18.912 8.079 1.00 0.00 H new ATOM 0 HA ASN A 65 10.320 19.064 6.382 1.00 0.00 H new ATOM 0 HB2 ASN A 65 9.076 16.449 5.418 1.00 0.00 H new ATOM 0 HB3 ASN A 65 10.577 17.129 4.823 1.00 0.00 H new ATOM 0 HD21 ASN A 65 10.465 15.045 8.364 1.00 0.00 H new ATOM 0 HD22 ASN A 65 8.995 15.441 7.469 1.00 0.00 H new ATOM 628 N GLY A 66 7.858 20.029 5.182 1.00 0.00 N ATOM 629 CA GLY A 66 7.160 20.721 4.117 1.00 0.00 C ATOM 630 C GLY A 66 5.962 19.946 3.613 1.00 0.00 C ATOM 631 O GLY A 66 5.170 20.456 2.822 1.00 0.00 O ATOM 0 H GLY A 66 7.583 20.304 6.125 1.00 0.00 H new ATOM 0 HA2 GLY A 66 6.833 21.697 4.475 1.00 0.00 H new ATOM 0 HA3 GLY A 66 7.848 20.898 3.291 1.00 0.00 H new ATOM 635 N ILE A 67 5.823 18.712 4.072 1.00 0.00 N ATOM 636 CA ILE A 67 4.713 17.874 3.671 1.00 0.00 C ATOM 637 C ILE A 67 3.573 18.019 4.669 1.00 0.00 C ATOM 638 O ILE A 67 3.754 17.778 5.864 1.00 0.00 O ATOM 639 CB ILE A 67 5.130 16.392 3.572 1.00 0.00 C ATOM 640 CG1 ILE A 67 6.290 16.239 2.583 1.00 0.00 C ATOM 641 CG2 ILE A 67 3.947 15.531 3.145 1.00 0.00 C ATOM 642 CD1 ILE A 67 6.718 14.805 2.363 1.00 0.00 C ATOM 0 H ILE A 67 6.470 18.271 4.725 1.00 0.00 H new ATOM 0 HA ILE A 67 4.385 18.200 2.684 1.00 0.00 H new ATOM 0 HB ILE A 67 5.460 16.055 4.555 1.00 0.00 H new ATOM 0 HG12 ILE A 67 5.999 16.673 1.626 1.00 0.00 H new ATOM 0 HG13 ILE A 67 7.143 16.812 2.946 1.00 0.00 H new ATOM 0 HG21 ILE A 67 4.260 14.489 3.080 1.00 0.00 H new ATOM 0 HG22 ILE A 67 3.146 15.625 3.878 1.00 0.00 H new ATOM 0 HG23 ILE A 67 3.588 15.863 2.171 1.00 0.00 H new ATOM 0 HD11 ILE A 67 7.543 14.777 1.651 1.00 0.00 H new ATOM 0 HD12 ILE A 67 7.041 14.372 3.310 1.00 0.00 H new ATOM 0 HD13 ILE A 67 5.879 14.231 1.969 1.00 0.00 H new ATOM 654 N PRO A 68 2.391 18.443 4.203 1.00 0.00 N ATOM 655 CA PRO A 68 1.226 18.623 5.067 1.00 0.00 C ATOM 656 C PRO A 68 0.744 17.302 5.653 1.00 0.00 C ATOM 657 O PRO A 68 0.861 16.251 5.015 1.00 0.00 O ATOM 658 CB PRO A 68 0.154 19.208 4.136 1.00 0.00 C ATOM 659 CG PRO A 68 0.887 19.668 2.923 1.00 0.00 C ATOM 660 CD PRO A 68 2.090 18.776 2.802 1.00 0.00 C ATOM 0 HA PRO A 68 1.454 19.262 5.920 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -0.595 18.459 3.881 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -0.372 20.035 4.614 1.00 0.00 H new ATOM 0 HG2 PRO A 68 0.257 19.596 2.036 1.00 0.00 H new ATOM 0 HG3 PRO A 68 1.184 20.712 3.019 1.00 0.00 H new ATOM 0 HD2 PRO A 68 1.875 17.885 2.212 1.00 0.00 H new ATOM 0 HD3 PRO A 68 2.924 19.285 2.319 1.00 0.00 H new ATOM 668 N SER A 69 0.249 17.365 6.885 1.00 0.00 N ATOM 669 CA SER A 69 -0.363 16.220 7.545 1.00 0.00 C ATOM 670 C SER A 69 -1.339 15.521 6.600 1.00 0.00 C ATOM 671 O SER A 69 -2.119 16.181 5.909 1.00 0.00 O ATOM 672 CB SER A 69 -1.081 16.696 8.807 1.00 0.00 C ATOM 673 OG SER A 69 -0.224 17.505 9.601 1.00 0.00 O ATOM 0 H SER A 69 0.261 18.212 7.453 1.00 0.00 H new ATOM 0 HA SER A 69 0.409 15.502 7.821 1.00 0.00 H new ATOM 0 HB2 SER A 69 -1.971 17.262 8.533 1.00 0.00 H new ATOM 0 HB3 SER A 69 -1.416 15.836 9.386 1.00 0.00 H new ATOM 0 HG SER A 69 -0.704 17.801 10.403 1.00 0.00 H new ATOM 679 N PRO A 70 -1.299 14.172 6.563 1.00 0.00 N ATOM 680 CA PRO A 70 -2.030 13.366 5.580 1.00 0.00 C ATOM 681 C PRO A 70 -3.491 13.763 5.460 1.00 0.00 C ATOM 682 O PRO A 70 -4.230 13.779 6.449 1.00 0.00 O ATOM 683 CB PRO A 70 -1.908 11.928 6.105 1.00 0.00 C ATOM 684 CG PRO A 70 -1.354 12.052 7.486 1.00 0.00 C ATOM 685 CD PRO A 70 -0.555 13.322 7.498 1.00 0.00 C ATOM 0 HA PRO A 70 -1.618 13.500 4.580 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -2.878 11.430 6.115 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -1.251 11.333 5.471 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -2.154 12.087 8.226 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -0.728 11.195 7.734 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -0.505 13.761 8.494 1.00 0.00 H new ATOM 0 HD3 PRO A 70 0.472 13.159 7.170 1.00 0.00 H new ATOM 693 N THR A 71 -3.897 14.068 4.243 1.00 0.00 N ATOM 694 CA THR A 71 -5.240 14.530 3.978 1.00 0.00 C ATOM 695 C THR A 71 -6.145 13.382 3.565 1.00 0.00 C ATOM 696 O THR A 71 -5.768 12.540 2.754 1.00 0.00 O ATOM 697 CB THR A 71 -5.235 15.603 2.871 1.00 0.00 C ATOM 698 OG1 THR A 71 -4.485 15.133 1.740 1.00 0.00 O ATOM 699 CG2 THR A 71 -4.629 16.903 3.378 1.00 0.00 C ATOM 0 H THR A 71 -3.306 14.002 3.415 1.00 0.00 H new ATOM 0 HA THR A 71 -5.626 14.964 4.901 1.00 0.00 H new ATOM 0 HB THR A 71 -6.267 15.793 2.574 1.00 0.00 H new ATOM 0 HG1 THR A 71 -4.487 15.818 1.039 1.00 0.00 H new ATOM 0 HG21 THR A 71 -4.637 17.644 2.579 1.00 0.00 H new ATOM 0 HG22 THR A 71 -5.213 17.272 4.221 1.00 0.00 H new ATOM 0 HG23 THR A 71 -3.602 16.725 3.698 1.00 0.00 H new ATOM 707 N THR A 72 -7.338 13.361 4.125 1.00 0.00 N ATOM 708 CA THR A 72 -8.308 12.345 3.783 1.00 0.00 C ATOM 709 C THR A 72 -9.366 12.922 2.861 1.00 0.00 C ATOM 710 O THR A 72 -9.986 13.946 3.162 1.00 0.00 O ATOM 711 CB THR A 72 -8.976 11.744 5.037 1.00 0.00 C ATOM 712 OG1 THR A 72 -9.325 12.781 5.969 1.00 0.00 O ATOM 713 CG2 THR A 72 -8.060 10.735 5.706 1.00 0.00 C ATOM 0 H THR A 72 -7.657 14.037 4.819 1.00 0.00 H new ATOM 0 HA THR A 72 -7.776 11.542 3.272 1.00 0.00 H new ATOM 0 HB THR A 72 -9.885 11.233 4.721 1.00 0.00 H new ATOM 0 HG1 THR A 72 -9.638 13.570 5.479 1.00 0.00 H new ATOM 0 HG21 THR A 72 -8.553 10.325 6.588 1.00 0.00 H new ATOM 0 HG22 THR A 72 -7.835 9.929 5.008 1.00 0.00 H new ATOM 0 HG23 THR A 72 -7.133 11.226 6.004 1.00 0.00 H new ATOM 721 N THR A 73 -9.552 12.266 1.732 1.00 0.00 N ATOM 722 CA THR A 73 -10.539 12.683 0.758 1.00 0.00 C ATOM 723 C THR A 73 -11.929 12.318 1.257 1.00 0.00 C ATOM 724 O THR A 73 -12.062 11.710 2.324 1.00 0.00 O ATOM 725 CB THR A 73 -10.289 12.030 -0.615 1.00 0.00 C ATOM 726 OG1 THR A 73 -10.496 10.617 -0.527 1.00 0.00 O ATOM 727 CG2 THR A 73 -8.872 12.305 -1.101 1.00 0.00 C ATOM 0 H THR A 73 -9.026 11.434 1.466 1.00 0.00 H new ATOM 0 HA THR A 73 -10.460 13.763 0.634 1.00 0.00 H new ATOM 0 HB THR A 73 -10.991 12.462 -1.328 1.00 0.00 H new ATOM 0 HG1 THR A 73 -10.337 10.208 -1.403 1.00 0.00 H new ATOM 0 HG21 THR A 73 -8.722 11.833 -2.072 1.00 0.00 H new ATOM 0 HG22 THR A 73 -8.721 13.381 -1.193 1.00 0.00 H new ATOM 0 HG23 THR A 73 -8.157 11.899 -0.386 1.00 0.00 H new ATOM 735 N ARG A 74 -12.958 12.691 0.516 1.00 0.00 N ATOM 736 CA ARG A 74 -14.320 12.388 0.923 1.00 0.00 C ATOM 737 C ARG A 74 -14.508 10.888 1.145 1.00 0.00 C ATOM 738 O ARG A 74 -15.116 10.469 2.132 1.00 0.00 O ATOM 739 CB ARG A 74 -15.315 12.885 -0.128 1.00 0.00 C ATOM 740 CG ARG A 74 -16.742 12.441 0.137 1.00 0.00 C ATOM 741 CD ARG A 74 -17.707 13.010 -0.889 1.00 0.00 C ATOM 742 NE ARG A 74 -19.090 12.623 -0.613 1.00 0.00 N ATOM 743 CZ ARG A 74 -20.058 12.634 -1.526 1.00 0.00 C ATOM 744 NH1 ARG A 74 -19.794 12.993 -2.776 1.00 0.00 N ATOM 745 NH2 ARG A 74 -21.293 12.284 -1.190 1.00 0.00 N ATOM 0 H ARG A 74 -12.878 13.200 -0.364 1.00 0.00 H new ATOM 0 HA ARG A 74 -14.508 12.902 1.865 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -15.282 13.974 -0.163 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -15.006 12.525 -1.109 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -16.793 11.352 0.120 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -17.043 12.759 1.135 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -17.629 14.097 -0.896 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -17.425 12.664 -1.883 1.00 0.00 H new ATOM 0 HE ARG A 74 -19.326 12.328 0.334 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -18.846 13.262 -3.040 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -20.539 13.000 -3.473 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -21.501 12.006 -0.231 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -22.034 12.293 -1.891 1.00 0.00 H new ATOM 759 N TYR A 75 -13.966 10.081 0.246 1.00 0.00 N ATOM 760 CA TYR A 75 -14.157 8.642 0.320 1.00 0.00 C ATOM 761 C TYR A 75 -13.064 7.944 1.129 1.00 0.00 C ATOM 762 O TYR A 75 -13.276 6.835 1.607 1.00 0.00 O ATOM 763 CB TYR A 75 -14.256 8.041 -1.082 1.00 0.00 C ATOM 764 CG TYR A 75 -15.500 8.474 -1.826 1.00 0.00 C ATOM 765 CD1 TYR A 75 -15.432 9.363 -2.889 1.00 0.00 C ATOM 766 CD2 TYR A 75 -16.747 7.997 -1.452 1.00 0.00 C ATOM 767 CE1 TYR A 75 -16.574 9.764 -3.559 1.00 0.00 C ATOM 768 CE2 TYR A 75 -17.892 8.389 -2.115 1.00 0.00 C ATOM 769 CZ TYR A 75 -17.801 9.274 -3.167 1.00 0.00 C ATOM 770 OH TYR A 75 -18.942 9.665 -3.829 1.00 0.00 O ATOM 0 H TYR A 75 -13.394 10.396 -0.538 1.00 0.00 H new ATOM 0 HA TYR A 75 -15.096 8.474 0.847 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -13.377 8.330 -1.658 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -14.245 6.954 -1.006 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -14.472 9.748 -3.199 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -16.824 7.305 -0.626 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -16.504 10.457 -4.384 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -18.854 8.004 -1.811 1.00 0.00 H new ATOM 0 HH TYR A 75 -19.720 9.226 -3.427 1.00 0.00 H new ATOM 780 N VAL A 76 -11.919 8.590 1.323 1.00 0.00 N ATOM 781 CA VAL A 76 -10.837 7.970 2.090 1.00 0.00 C ATOM 782 C VAL A 76 -11.082 8.143 3.583 1.00 0.00 C ATOM 783 O VAL A 76 -11.383 9.239 4.058 1.00 0.00 O ATOM 784 CB VAL A 76 -9.449 8.543 1.713 1.00 0.00 C ATOM 785 CG1 VAL A 76 -8.381 8.098 2.708 1.00 0.00 C ATOM 786 CG2 VAL A 76 -9.065 8.101 0.309 1.00 0.00 C ATOM 0 H VAL A 76 -11.715 9.525 0.969 1.00 0.00 H new ATOM 0 HA VAL A 76 -10.833 6.909 1.841 1.00 0.00 H new ATOM 0 HB VAL A 76 -9.513 9.631 1.744 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -7.417 8.515 2.418 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -8.644 8.450 3.705 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -8.319 7.010 2.712 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -8.087 8.509 0.054 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -9.025 7.012 0.268 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -9.807 8.464 -0.402 1.00 0.00 H new ATOM 796 N SER A 77 -10.968 7.038 4.309 1.00 0.00 N ATOM 797 CA SER A 77 -11.309 7.004 5.723 1.00 0.00 C ATOM 798 C SER A 77 -10.147 7.477 6.587 1.00 0.00 C ATOM 799 O SER A 77 -10.307 8.370 7.417 1.00 0.00 O ATOM 800 CB SER A 77 -11.729 5.589 6.140 1.00 0.00 C ATOM 801 OG SER A 77 -12.084 5.540 7.511 1.00 0.00 O ATOM 0 H SER A 77 -10.639 6.147 3.937 1.00 0.00 H new ATOM 0 HA SER A 77 -12.146 7.685 5.877 1.00 0.00 H new ATOM 0 HB2 SER A 77 -12.573 5.264 5.532 1.00 0.00 H new ATOM 0 HB3 SER A 77 -10.912 4.894 5.949 1.00 0.00 H new ATOM 0 HG SER A 77 -12.349 4.627 7.748 1.00 0.00 H new ATOM 807 N ALA A 78 -8.977 6.886 6.389 1.00 0.00 N ATOM 808 CA ALA A 78 -7.833 7.185 7.231 1.00 0.00 C ATOM 809 C ALA A 78 -6.544 6.767 6.552 1.00 0.00 C ATOM 810 O ALA A 78 -6.493 5.732 5.887 1.00 0.00 O ATOM 811 CB ALA A 78 -7.965 6.490 8.577 1.00 0.00 C ATOM 0 H ALA A 78 -8.798 6.200 5.656 1.00 0.00 H new ATOM 0 HA ALA A 78 -7.805 8.262 7.395 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -7.098 6.726 9.195 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.871 6.833 9.077 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -8.020 5.412 8.426 1.00 0.00 H new ATOM 817 N MET A 79 -5.511 7.574 6.730 1.00 0.00 N ATOM 818 CA MET A 79 -4.204 7.294 6.163 1.00 0.00 C ATOM 819 C MET A 79 -3.134 8.102 6.882 1.00 0.00 C ATOM 820 O MET A 79 -3.365 9.242 7.280 1.00 0.00 O ATOM 821 CB MET A 79 -4.176 7.593 4.659 1.00 0.00 C ATOM 822 CG MET A 79 -4.572 9.017 4.289 1.00 0.00 C ATOM 823 SD MET A 79 -4.380 9.357 2.527 1.00 0.00 S ATOM 824 CE MET A 79 -2.617 9.120 2.311 1.00 0.00 C ATOM 0 H MET A 79 -5.555 8.438 7.270 1.00 0.00 H new ATOM 0 HA MET A 79 -3.998 6.232 6.299 1.00 0.00 H new ATOM 0 HB2 MET A 79 -3.172 7.399 4.282 1.00 0.00 H new ATOM 0 HB3 MET A 79 -4.846 6.900 4.151 1.00 0.00 H new ATOM 0 HG2 MET A 79 -5.609 9.188 4.577 1.00 0.00 H new ATOM 0 HG3 MET A 79 -3.963 9.719 4.859 1.00 0.00 H new ATOM 0 HE1 MET A 79 -2.221 9.904 1.665 1.00 0.00 H new ATOM 0 HE2 MET A 79 -2.122 9.165 3.281 1.00 0.00 H new ATOM 0 HE3 MET A 79 -2.434 8.147 1.855 1.00 0.00 H new ATOM 834 N SER A 80 -1.972 7.499 7.055 1.00 0.00 N ATOM 835 CA SER A 80 -0.862 8.136 7.736 1.00 0.00 C ATOM 836 C SER A 80 0.415 7.937 6.934 1.00 0.00 C ATOM 837 O SER A 80 0.602 6.897 6.307 1.00 0.00 O ATOM 838 CB SER A 80 -0.707 7.553 9.145 1.00 0.00 C ATOM 839 OG SER A 80 0.456 8.044 9.788 1.00 0.00 O ATOM 0 H SER A 80 -1.772 6.554 6.727 1.00 0.00 H new ATOM 0 HA SER A 80 -1.059 9.205 7.823 1.00 0.00 H new ATOM 0 HB2 SER A 80 -1.585 7.802 9.741 1.00 0.00 H new ATOM 0 HB3 SER A 80 -0.659 6.466 9.086 1.00 0.00 H new ATOM 0 HG SER A 80 0.524 7.654 10.684 1.00 0.00 H new ATOM 845 N VAL A 81 1.286 8.932 6.954 1.00 0.00 N ATOM 846 CA VAL A 81 2.533 8.870 6.213 1.00 0.00 C ATOM 847 C VAL A 81 3.708 8.998 7.171 1.00 0.00 C ATOM 848 O VAL A 81 3.894 10.041 7.800 1.00 0.00 O ATOM 849 CB VAL A 81 2.623 9.984 5.147 1.00 0.00 C ATOM 850 CG1 VAL A 81 3.880 9.830 4.298 1.00 0.00 C ATOM 851 CG2 VAL A 81 1.381 9.988 4.271 1.00 0.00 C ATOM 0 H VAL A 81 1.151 9.796 7.478 1.00 0.00 H new ATOM 0 HA VAL A 81 2.565 7.907 5.702 1.00 0.00 H new ATOM 0 HB VAL A 81 2.683 10.941 5.665 1.00 0.00 H new ATOM 0 HG11 VAL A 81 3.918 10.627 3.556 1.00 0.00 H new ATOM 0 HG12 VAL A 81 4.761 9.888 4.938 1.00 0.00 H new ATOM 0 HG13 VAL A 81 3.862 8.864 3.792 1.00 0.00 H new ATOM 0 HG21 VAL A 81 1.463 10.780 3.526 1.00 0.00 H new ATOM 0 HG22 VAL A 81 1.287 9.025 3.768 1.00 0.00 H new ATOM 0 HG23 VAL A 81 0.500 10.162 4.889 1.00 0.00 H new ATOM 861 N ALA A 82 4.502 7.947 7.272 1.00 0.00 N ATOM 862 CA ALA A 82 5.631 7.939 8.175 1.00 0.00 C ATOM 863 C ALA A 82 6.879 7.523 7.415 1.00 0.00 C ATOM 864 O ALA A 82 7.050 6.357 7.060 1.00 0.00 O ATOM 865 CB ALA A 82 5.371 6.994 9.338 1.00 0.00 C ATOM 0 H ALA A 82 4.382 7.087 6.737 1.00 0.00 H new ATOM 0 HA ALA A 82 5.778 8.940 8.580 1.00 0.00 H new ATOM 0 HB1 ALA A 82 6.230 6.998 10.009 1.00 0.00 H new ATOM 0 HB2 ALA A 82 4.484 7.321 9.881 1.00 0.00 H new ATOM 0 HB3 ALA A 82 5.213 5.985 8.958 1.00 0.00 H new ATOM 871 N LYS A 83 7.751 8.496 7.211 1.00 0.00 N ATOM 872 CA LYS A 83 8.977 8.318 6.428 1.00 0.00 C ATOM 873 C LYS A 83 8.686 7.582 5.109 1.00 0.00 C ATOM 874 O LYS A 83 9.351 6.606 4.766 1.00 0.00 O ATOM 875 CB LYS A 83 10.029 7.554 7.244 1.00 0.00 C ATOM 876 CG LYS A 83 10.324 8.171 8.606 1.00 0.00 C ATOM 877 CD LYS A 83 10.773 9.619 8.484 1.00 0.00 C ATOM 878 CE LYS A 83 11.234 10.188 9.817 1.00 0.00 C ATOM 879 NZ LYS A 83 12.475 9.531 10.306 1.00 0.00 N ATOM 0 H LYS A 83 7.634 9.439 7.583 1.00 0.00 H new ATOM 0 HA LYS A 83 9.370 9.306 6.187 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.689 6.528 7.387 1.00 0.00 H new ATOM 0 HB3 LYS A 83 10.954 7.506 6.670 1.00 0.00 H new ATOM 0 HG2 LYS A 83 9.432 8.118 9.230 1.00 0.00 H new ATOM 0 HG3 LYS A 83 11.099 7.591 9.108 1.00 0.00 H new ATOM 0 HD2 LYS A 83 11.586 9.687 7.761 1.00 0.00 H new ATOM 0 HD3 LYS A 83 9.951 10.222 8.097 1.00 0.00 H new ATOM 0 HE2 LYS A 83 11.408 11.259 9.713 1.00 0.00 H new ATOM 0 HE3 LYS A 83 10.443 10.064 10.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 12.884 10.094 11.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 12.249 8.578 10.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 13.161 9.461 9.527 1.00 0.00 H new ATOM 893 N GLY A 84 7.661 8.045 4.395 1.00 0.00 N ATOM 894 CA GLY A 84 7.274 7.461 3.114 1.00 0.00 C ATOM 895 C GLY A 84 6.352 6.260 3.252 1.00 0.00 C ATOM 896 O GLY A 84 5.605 5.935 2.331 1.00 0.00 O ATOM 0 H GLY A 84 7.079 8.831 4.687 1.00 0.00 H new ATOM 0 HA2 GLY A 84 6.779 8.222 2.511 1.00 0.00 H new ATOM 0 HA3 GLY A 84 8.172 7.160 2.574 1.00 0.00 H new ATOM 900 N VAL A 85 6.416 5.606 4.397 1.00 0.00 N ATOM 901 CA VAL A 85 5.521 4.497 4.702 1.00 0.00 C ATOM 902 C VAL A 85 4.112 5.021 4.935 1.00 0.00 C ATOM 903 O VAL A 85 3.923 5.988 5.665 1.00 0.00 O ATOM 904 CB VAL A 85 6.005 3.706 5.936 1.00 0.00 C ATOM 905 CG1 VAL A 85 5.108 2.509 6.203 1.00 0.00 C ATOM 906 CG2 VAL A 85 7.448 3.264 5.746 1.00 0.00 C ATOM 0 H VAL A 85 7.082 5.823 5.138 1.00 0.00 H new ATOM 0 HA VAL A 85 5.519 3.817 3.850 1.00 0.00 H new ATOM 0 HB VAL A 85 5.953 4.363 6.805 1.00 0.00 H new ATOM 0 HG11 VAL A 85 5.472 1.970 7.078 1.00 0.00 H new ATOM 0 HG12 VAL A 85 4.089 2.851 6.386 1.00 0.00 H new ATOM 0 HG13 VAL A 85 5.119 1.846 5.338 1.00 0.00 H new ATOM 0 HG21 VAL A 85 7.777 2.707 6.624 1.00 0.00 H new ATOM 0 HG22 VAL A 85 7.520 2.627 4.864 1.00 0.00 H new ATOM 0 HG23 VAL A 85 8.083 4.140 5.614 1.00 0.00 H new ATOM 916 N VAL A 86 3.115 4.389 4.334 1.00 0.00 N ATOM 917 CA VAL A 86 1.761 4.916 4.371 1.00 0.00 C ATOM 918 C VAL A 86 0.778 3.841 4.814 1.00 0.00 C ATOM 919 O VAL A 86 0.554 2.855 4.109 1.00 0.00 O ATOM 920 CB VAL A 86 1.325 5.476 2.996 1.00 0.00 C ATOM 921 CG1 VAL A 86 -0.087 6.038 3.071 1.00 0.00 C ATOM 922 CG2 VAL A 86 2.296 6.543 2.513 1.00 0.00 C ATOM 0 H VAL A 86 3.218 3.515 3.818 1.00 0.00 H new ATOM 0 HA VAL A 86 1.756 5.734 5.092 1.00 0.00 H new ATOM 0 HB VAL A 86 1.334 4.656 2.278 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -0.376 6.427 2.095 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -0.778 5.248 3.366 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -0.120 6.842 3.806 1.00 0.00 H new ATOM 0 HG21 VAL A 86 1.969 6.921 1.545 1.00 0.00 H new ATOM 0 HG22 VAL A 86 2.324 7.362 3.232 1.00 0.00 H new ATOM 0 HG23 VAL A 86 3.292 6.111 2.416 1.00 0.00 H new ATOM 932 N SER A 87 0.215 4.029 5.994 1.00 0.00 N ATOM 933 CA SER A 87 -0.762 3.099 6.532 1.00 0.00 C ATOM 934 C SER A 87 -2.173 3.672 6.438 1.00 0.00 C ATOM 935 O SER A 87 -2.447 4.767 6.928 1.00 0.00 O ATOM 936 CB SER A 87 -0.431 2.771 7.990 1.00 0.00 C ATOM 937 OG SER A 87 0.882 2.244 8.113 1.00 0.00 O ATOM 0 H SER A 87 0.419 4.822 6.601 1.00 0.00 H new ATOM 0 HA SER A 87 -0.721 2.185 5.939 1.00 0.00 H new ATOM 0 HB2 SER A 87 -0.523 3.671 8.598 1.00 0.00 H new ATOM 0 HB3 SER A 87 -1.152 2.051 8.376 1.00 0.00 H new ATOM 0 HG SER A 87 1.068 2.045 9.054 1.00 0.00 H new ATOM 943 N LEU A 88 -3.054 2.927 5.790 1.00 0.00 N ATOM 944 CA LEU A 88 -4.453 3.311 5.662 1.00 0.00 C ATOM 945 C LEU A 88 -5.300 2.337 6.465 1.00 0.00 C ATOM 946 O LEU A 88 -4.934 1.171 6.601 1.00 0.00 O ATOM 947 CB LEU A 88 -4.891 3.317 4.191 1.00 0.00 C ATOM 948 CG LEU A 88 -4.044 4.192 3.255 1.00 0.00 C ATOM 949 CD1 LEU A 88 -2.861 3.411 2.697 1.00 0.00 C ATOM 950 CD2 LEU A 88 -4.893 4.758 2.128 1.00 0.00 C ATOM 0 H LEU A 88 -2.822 2.042 5.339 1.00 0.00 H new ATOM 0 HA LEU A 88 -4.586 4.322 6.046 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -4.871 2.292 3.820 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -5.926 3.655 4.139 1.00 0.00 H new ATOM 0 HG LEU A 88 -3.653 5.025 3.839 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -2.279 4.055 2.038 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -2.232 3.068 3.518 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -3.225 2.551 2.135 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -4.271 5.374 1.478 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -5.323 3.940 1.550 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -5.695 5.366 2.547 1.00 0.00 H new ATOM 962 N THR A 89 -6.415 2.792 7.015 1.00 0.00 N ATOM 963 CA THR A 89 -7.188 1.948 7.911 1.00 0.00 C ATOM 964 C THR A 89 -8.696 2.104 7.699 1.00 0.00 C ATOM 965 O THR A 89 -9.170 3.170 7.301 1.00 0.00 O ATOM 966 CB THR A 89 -6.831 2.269 9.381 1.00 0.00 C ATOM 967 OG1 THR A 89 -5.404 2.321 9.531 1.00 0.00 O ATOM 968 CG2 THR A 89 -7.390 1.223 10.336 1.00 0.00 C ATOM 0 H THR A 89 -6.799 3.724 6.861 1.00 0.00 H new ATOM 0 HA THR A 89 -6.930 0.914 7.684 1.00 0.00 H new ATOM 0 HB THR A 89 -7.276 3.233 9.627 1.00 0.00 H new ATOM 0 HG1 THR A 89 -5.180 2.526 10.463 1.00 0.00 H new ATOM 0 HG21 THR A 89 -7.119 1.483 11.359 1.00 0.00 H new ATOM 0 HG22 THR A 89 -8.476 1.191 10.245 1.00 0.00 H new ATOM 0 HG23 THR A 89 -6.976 0.246 10.088 1.00 0.00 H new ATOM 976 N GLY A 90 -9.418 1.010 7.960 1.00 0.00 N ATOM 977 CA GLY A 90 -10.879 1.011 7.951 1.00 0.00 C ATOM 978 C GLY A 90 -11.505 1.646 6.728 1.00 0.00 C ATOM 979 O GLY A 90 -12.450 2.430 6.849 1.00 0.00 O ATOM 0 H GLY A 90 -9.006 0.104 8.182 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -11.230 -0.018 8.029 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -11.234 1.536 8.838 1.00 0.00 H new ATOM 983 N GLN A 91 -11.012 1.306 5.555 1.00 0.00 N ATOM 984 CA GLN A 91 -11.510 1.927 4.341 1.00 0.00 C ATOM 985 C GLN A 91 -12.704 1.155 3.787 1.00 0.00 C ATOM 986 O GLN A 91 -12.605 -0.036 3.514 1.00 0.00 O ATOM 987 CB GLN A 91 -10.391 1.993 3.306 1.00 0.00 C ATOM 988 CG GLN A 91 -10.752 2.743 2.038 1.00 0.00 C ATOM 989 CD GLN A 91 -11.112 4.188 2.299 1.00 0.00 C ATOM 990 OE1 GLN A 91 -10.242 5.050 2.375 1.00 0.00 O ATOM 991 NE2 GLN A 91 -12.398 4.467 2.418 1.00 0.00 N ATOM 0 H GLN A 91 -10.277 0.613 5.415 1.00 0.00 H new ATOM 0 HA GLN A 91 -11.844 2.938 4.574 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -9.521 2.468 3.759 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -10.097 0.977 3.041 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -9.912 2.701 1.344 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -11.592 2.245 1.553 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -13.090 3.721 2.349 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -12.699 5.428 2.579 1.00 0.00 H new ATOM 1000 N GLU A 92 -13.814 1.864 3.602 1.00 0.00 N ATOM 1001 CA GLU A 92 -15.046 1.301 3.042 1.00 0.00 C ATOM 1002 C GLU A 92 -15.412 -0.048 3.668 1.00 0.00 C ATOM 1003 O GLU A 92 -15.649 -0.135 4.875 1.00 0.00 O ATOM 1004 CB GLU A 92 -14.939 1.182 1.521 1.00 0.00 C ATOM 1005 CG GLU A 92 -14.779 2.521 0.825 1.00 0.00 C ATOM 1006 CD GLU A 92 -15.786 3.545 1.303 1.00 0.00 C ATOM 1007 OE1 GLU A 92 -15.577 4.125 2.392 1.00 0.00 O ATOM 1008 OE2 GLU A 92 -16.790 3.776 0.604 1.00 0.00 O ATOM 0 H GLU A 92 -13.888 2.854 3.837 1.00 0.00 H new ATOM 0 HA GLU A 92 -15.853 1.991 3.287 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -14.089 0.547 1.272 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -15.831 0.686 1.138 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -13.771 2.899 0.998 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -14.888 2.383 -0.251 1.00 0.00 H new ATOM 1015 N SER A 93 -15.440 -1.090 2.849 1.00 0.00 N ATOM 1016 CA SER A 93 -15.836 -2.418 3.298 1.00 0.00 C ATOM 1017 C SER A 93 -14.734 -3.058 4.138 1.00 0.00 C ATOM 1018 O SER A 93 -14.968 -4.029 4.857 1.00 0.00 O ATOM 1019 CB SER A 93 -16.156 -3.295 2.085 1.00 0.00 C ATOM 1020 OG SER A 93 -16.800 -4.499 2.464 1.00 0.00 O ATOM 0 H SER A 93 -15.191 -1.040 1.861 1.00 0.00 H new ATOM 0 HA SER A 93 -16.725 -2.327 3.922 1.00 0.00 H new ATOM 0 HB2 SER A 93 -16.794 -2.743 1.395 1.00 0.00 H new ATOM 0 HB3 SER A 93 -15.235 -3.528 1.551 1.00 0.00 H new ATOM 0 HG SER A 93 -17.605 -4.625 1.920 1.00 0.00 H new ATOM 1026 N LEU A 94 -13.543 -2.483 4.072 1.00 0.00 N ATOM 1027 CA LEU A 94 -12.378 -3.036 4.740 1.00 0.00 C ATOM 1028 C LEU A 94 -12.258 -2.483 6.156 1.00 0.00 C ATOM 1029 O LEU A 94 -11.166 -2.170 6.627 1.00 0.00 O ATOM 1030 CB LEU A 94 -11.109 -2.726 3.941 1.00 0.00 C ATOM 1031 CG LEU A 94 -11.132 -3.165 2.474 1.00 0.00 C ATOM 1032 CD1 LEU A 94 -9.810 -2.827 1.808 1.00 0.00 C ATOM 1033 CD2 LEU A 94 -11.425 -4.655 2.351 1.00 0.00 C ATOM 0 H LEU A 94 -13.358 -1.623 3.555 1.00 0.00 H new ATOM 0 HA LEU A 94 -12.498 -4.118 4.801 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -10.930 -1.651 3.978 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -10.264 -3.207 4.433 1.00 0.00 H new ATOM 0 HG LEU A 94 -11.932 -2.624 1.968 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -9.837 -3.143 0.765 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -9.643 -1.751 1.857 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -9.000 -3.344 2.323 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -11.435 -4.938 1.298 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -10.653 -5.222 2.872 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -12.397 -4.873 2.795 1.00 0.00 H new ATOM 1045 N ASN A 95 -13.399 -2.310 6.804 1.00 0.00 N ATOM 1046 CA ASN A 95 -13.443 -1.904 8.204 1.00 0.00 C ATOM 1047 C ASN A 95 -12.594 -2.843 9.063 1.00 0.00 C ATOM 1048 O ASN A 95 -12.678 -4.065 8.933 1.00 0.00 O ATOM 1049 CB ASN A 95 -14.894 -1.889 8.699 1.00 0.00 C ATOM 1050 CG ASN A 95 -15.015 -1.546 10.175 1.00 0.00 C ATOM 1051 OD1 ASN A 95 -15.046 -2.434 11.027 1.00 0.00 O ATOM 1052 ND2 ASN A 95 -15.083 -0.262 10.490 1.00 0.00 N ATOM 0 H ASN A 95 -14.317 -2.445 6.380 1.00 0.00 H new ATOM 0 HA ASN A 95 -13.031 -0.898 8.290 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -15.463 -1.165 8.116 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -15.343 -2.866 8.521 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -15.164 0.020 11.467 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -15.054 0.445 9.756 1.00 0.00 H new ATOM 1059 N GLY A 96 -11.770 -2.262 9.928 1.00 0.00 N ATOM 1060 CA GLY A 96 -10.867 -3.045 10.753 1.00 0.00 C ATOM 1061 C GLY A 96 -9.551 -3.358 10.060 1.00 0.00 C ATOM 1062 O GLY A 96 -8.553 -3.666 10.713 1.00 0.00 O ATOM 0 H GLY A 96 -11.711 -1.254 10.074 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -10.665 -2.503 11.677 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -11.356 -3.979 11.032 1.00 0.00 H new ATOM 1066 N LEU A 97 -9.545 -3.269 8.742 1.00 0.00 N ATOM 1067 CA LEU A 97 -8.384 -3.637 7.952 1.00 0.00 C ATOM 1068 C LEU A 97 -7.425 -2.459 7.819 1.00 0.00 C ATOM 1069 O LEU A 97 -7.848 -1.306 7.737 1.00 0.00 O ATOM 1070 CB LEU A 97 -8.855 -4.130 6.579 1.00 0.00 C ATOM 1071 CG LEU A 97 -7.774 -4.624 5.615 1.00 0.00 C ATOM 1072 CD1 LEU A 97 -8.353 -5.676 4.686 1.00 0.00 C ATOM 1073 CD2 LEU A 97 -7.217 -3.472 4.794 1.00 0.00 C ATOM 0 H LEU A 97 -10.339 -2.942 8.192 1.00 0.00 H new ATOM 0 HA LEU A 97 -7.840 -4.439 8.451 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -9.567 -4.940 6.735 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -9.397 -3.318 6.094 1.00 0.00 H new ATOM 0 HG LEU A 97 -6.964 -5.059 6.201 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -7.579 -6.024 4.002 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -8.722 -6.517 5.273 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -9.174 -5.244 4.114 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -6.450 -3.846 4.116 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -8.021 -3.015 4.217 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -6.780 -2.728 5.460 1.00 0.00 H new ATOM 1085 N SER A 98 -6.136 -2.755 7.822 1.00 0.00 N ATOM 1086 CA SER A 98 -5.115 -1.739 7.644 1.00 0.00 C ATOM 1087 C SER A 98 -4.199 -2.107 6.477 1.00 0.00 C ATOM 1088 O SER A 98 -3.679 -3.220 6.415 1.00 0.00 O ATOM 1089 CB SER A 98 -4.301 -1.593 8.929 1.00 0.00 C ATOM 1090 OG SER A 98 -5.154 -1.456 10.052 1.00 0.00 O ATOM 0 H SER A 98 -5.771 -3.699 7.947 1.00 0.00 H new ATOM 0 HA SER A 98 -5.597 -0.788 7.419 1.00 0.00 H new ATOM 0 HB2 SER A 98 -3.659 -2.464 9.059 1.00 0.00 H new ATOM 0 HB3 SER A 98 -3.648 -0.723 8.854 1.00 0.00 H new ATOM 0 HG SER A 98 -4.613 -1.366 10.864 1.00 0.00 H new ATOM 1096 N VAL A 99 -4.023 -1.177 5.551 1.00 0.00 N ATOM 1097 CA VAL A 99 -3.118 -1.371 4.429 1.00 0.00 C ATOM 1098 C VAL A 99 -1.841 -0.601 4.700 1.00 0.00 C ATOM 1099 O VAL A 99 -1.897 0.581 5.032 1.00 0.00 O ATOM 1100 CB VAL A 99 -3.725 -0.875 3.097 1.00 0.00 C ATOM 1101 CG1 VAL A 99 -2.784 -1.151 1.932 1.00 0.00 C ATOM 1102 CG2 VAL A 99 -5.081 -1.510 2.848 1.00 0.00 C ATOM 0 H VAL A 99 -4.499 -0.275 5.555 1.00 0.00 H new ATOM 0 HA VAL A 99 -2.927 -2.440 4.331 1.00 0.00 H new ATOM 0 HB VAL A 99 -3.862 0.203 3.176 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -3.235 -0.792 1.007 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -1.838 -0.635 2.098 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -2.604 -2.223 1.856 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -5.486 -1.144 1.905 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -4.972 -2.594 2.800 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -5.760 -1.249 3.660 1.00 0.00 H new ATOM 1112 N VAL A 100 -0.696 -1.248 4.569 1.00 0.00 N ATOM 1113 CA VAL A 100 0.558 -0.611 4.905 1.00 0.00 C ATOM 1114 C VAL A 100 1.499 -0.635 3.708 1.00 0.00 C ATOM 1115 O VAL A 100 2.004 -1.688 3.316 1.00 0.00 O ATOM 1116 CB VAL A 100 1.245 -1.302 6.102 1.00 0.00 C ATOM 1117 CG1 VAL A 100 2.467 -0.516 6.552 1.00 0.00 C ATOM 1118 CG2 VAL A 100 0.270 -1.484 7.254 1.00 0.00 C ATOM 0 H VAL A 100 -0.612 -2.208 4.234 1.00 0.00 H new ATOM 0 HA VAL A 100 0.335 0.419 5.182 1.00 0.00 H new ATOM 0 HB VAL A 100 1.576 -2.289 5.777 1.00 0.00 H new ATOM 0 HG11 VAL A 100 2.934 -1.022 7.397 1.00 0.00 H new ATOM 0 HG12 VAL A 100 3.179 -0.449 5.730 1.00 0.00 H new ATOM 0 HG13 VAL A 100 2.164 0.487 6.853 1.00 0.00 H new ATOM 0 HG21 VAL A 100 0.777 -1.973 8.086 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -0.099 -0.510 7.576 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -0.568 -2.100 6.927 1.00 0.00 H new ATOM 1128 N MET A 101 1.708 0.524 3.117 1.00 0.00 N ATOM 1129 CA MET A 101 2.660 0.648 2.030 1.00 0.00 C ATOM 1130 C MET A 101 4.016 1.022 2.598 1.00 0.00 C ATOM 1131 O MET A 101 4.192 2.119 3.120 1.00 0.00 O ATOM 1132 CB MET A 101 2.222 1.698 1.010 1.00 0.00 C ATOM 1133 CG MET A 101 3.091 1.696 -0.238 1.00 0.00 C ATOM 1134 SD MET A 101 2.806 3.114 -1.306 1.00 0.00 S ATOM 1135 CE MET A 101 3.463 4.439 -0.291 1.00 0.00 C ATOM 0 H MET A 101 1.234 1.391 3.369 1.00 0.00 H new ATOM 0 HA MET A 101 2.716 -0.311 1.514 1.00 0.00 H new ATOM 0 HB2 MET A 101 1.185 1.515 0.727 1.00 0.00 H new ATOM 0 HB3 MET A 101 2.257 2.685 1.471 1.00 0.00 H new ATOM 0 HG2 MET A 101 4.140 1.678 0.058 1.00 0.00 H new ATOM 0 HG3 MET A 101 2.903 0.782 -0.801 1.00 0.00 H new ATOM 0 HE1 MET A 101 3.623 5.324 -0.907 1.00 0.00 H new ATOM 0 HE2 MET A 101 2.755 4.673 0.504 1.00 0.00 H new ATOM 0 HE3 MET A 101 4.411 4.126 0.147 1.00 0.00 H new ATOM 1145 N THR A 102 4.964 0.104 2.519 1.00 0.00 N ATOM 1146 CA THR A 102 6.291 0.334 3.062 1.00 0.00 C ATOM 1147 C THR A 102 7.340 0.342 1.949 1.00 0.00 C ATOM 1148 O THR A 102 7.980 -0.670 1.688 1.00 0.00 O ATOM 1149 CB THR A 102 6.650 -0.750 4.096 1.00 0.00 C ATOM 1150 OG1 THR A 102 5.556 -0.928 5.009 1.00 0.00 O ATOM 1151 CG2 THR A 102 7.902 -0.371 4.874 1.00 0.00 C ATOM 0 H THR A 102 4.839 -0.810 2.083 1.00 0.00 H new ATOM 0 HA THR A 102 6.285 1.308 3.551 1.00 0.00 H new ATOM 0 HB THR A 102 6.843 -1.680 3.562 1.00 0.00 H new ATOM 0 HG1 THR A 102 5.786 -1.619 5.665 1.00 0.00 H new ATOM 0 HG21 THR A 102 8.132 -1.154 5.597 1.00 0.00 H new ATOM 0 HG22 THR A 102 8.738 -0.257 4.184 1.00 0.00 H new ATOM 0 HG23 THR A 102 7.733 0.569 5.399 1.00 0.00 H new ATOM 1159 N PRO A 103 7.509 1.480 1.261 1.00 0.00 N ATOM 1160 CA PRO A 103 8.504 1.608 0.193 1.00 0.00 C ATOM 1161 C PRO A 103 9.933 1.492 0.725 1.00 0.00 C ATOM 1162 O PRO A 103 10.291 2.128 1.717 1.00 0.00 O ATOM 1163 CB PRO A 103 8.251 3.007 -0.381 1.00 0.00 C ATOM 1164 CG PRO A 103 7.526 3.748 0.696 1.00 0.00 C ATOM 1165 CD PRO A 103 6.748 2.723 1.468 1.00 0.00 C ATOM 0 HA PRO A 103 8.408 0.816 -0.550 1.00 0.00 H new ATOM 0 HB2 PRO A 103 9.187 3.502 -0.638 1.00 0.00 H new ATOM 0 HB3 PRO A 103 7.656 2.957 -1.293 1.00 0.00 H new ATOM 0 HG2 PRO A 103 8.227 4.273 1.345 1.00 0.00 H new ATOM 0 HG3 PRO A 103 6.861 4.500 0.270 1.00 0.00 H new ATOM 0 HD2 PRO A 103 6.683 2.982 2.525 1.00 0.00 H new ATOM 0 HD3 PRO A 103 5.726 2.634 1.098 1.00 0.00 H new ATOM 1173 N GLY A 104 10.731 0.658 0.077 1.00 0.00 N ATOM 1174 CA GLY A 104 12.112 0.483 0.483 1.00 0.00 C ATOM 1175 C GLY A 104 12.315 -0.848 1.170 1.00 0.00 C ATOM 1176 O GLY A 104 11.528 -1.218 2.043 1.00 0.00 O ATOM 0 H GLY A 104 10.447 0.097 -0.726 1.00 0.00 H new ATOM 0 HA2 GLY A 104 12.761 0.547 -0.390 1.00 0.00 H new ATOM 0 HA3 GLY A 104 12.401 1.290 1.156 1.00 0.00 H new ATOM 1180 N TRP A 105 13.379 -1.555 0.786 1.00 0.00 N ATOM 1181 CA TRP A 105 13.583 -2.941 1.202 1.00 0.00 C ATOM 1182 C TRP A 105 12.434 -3.780 0.643 1.00 0.00 C ATOM 1183 O TRP A 105 11.908 -4.693 1.283 1.00 0.00 O ATOM 1184 CB TRP A 105 13.687 -3.054 2.737 1.00 0.00 C ATOM 1185 CG TRP A 105 14.009 -4.439 3.225 1.00 0.00 C ATOM 1186 CD1 TRP A 105 15.143 -5.155 2.974 1.00 0.00 C ATOM 1187 CD2 TRP A 105 13.185 -5.270 4.052 1.00 0.00 C ATOM 1188 NE1 TRP A 105 15.069 -6.385 3.583 1.00 0.00 N ATOM 1189 CE2 TRP A 105 13.879 -6.477 4.254 1.00 0.00 C ATOM 1190 CE3 TRP A 105 11.926 -5.109 4.640 1.00 0.00 C ATOM 1191 CZ2 TRP A 105 13.355 -7.517 5.018 1.00 0.00 C ATOM 1192 CZ3 TRP A 105 11.407 -6.142 5.397 1.00 0.00 C ATOM 1193 CH2 TRP A 105 12.122 -7.332 5.582 1.00 0.00 C ATOM 0 H TRP A 105 14.116 -1.187 0.184 1.00 0.00 H new ATOM 0 HA TRP A 105 14.527 -3.315 0.807 1.00 0.00 H new ATOM 0 HB2 TRP A 105 14.455 -2.367 3.091 1.00 0.00 H new ATOM 0 HB3 TRP A 105 12.744 -2.733 3.180 1.00 0.00 H new ATOM 0 HD1 TRP A 105 15.977 -4.806 2.383 1.00 0.00 H new ATOM 0 HE1 TRP A 105 15.784 -7.111 3.542 1.00 0.00 H new ATOM 0 HE3 TRP A 105 11.369 -4.193 4.505 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 13.902 -8.437 5.160 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 10.435 -6.030 5.853 1.00 0.00 H new ATOM 0 HH2 TRP A 105 11.691 -8.120 6.182 1.00 0.00 H new ATOM 1204 N ASP A 106 12.063 -3.454 -0.587 1.00 0.00 N ATOM 1205 CA ASP A 106 10.921 -4.072 -1.251 1.00 0.00 C ATOM 1206 C ASP A 106 11.244 -5.508 -1.638 1.00 0.00 C ATOM 1207 O ASP A 106 10.374 -6.250 -2.094 1.00 0.00 O ATOM 1208 CB ASP A 106 10.537 -3.277 -2.501 1.00 0.00 C ATOM 1209 CG ASP A 106 10.445 -1.782 -2.255 1.00 0.00 C ATOM 1210 OD1 ASP A 106 9.559 -1.342 -1.497 1.00 0.00 O ATOM 1211 OD2 ASP A 106 11.271 -1.035 -2.831 1.00 0.00 O ATOM 0 H ASP A 106 12.544 -2.755 -1.153 1.00 0.00 H new ATOM 0 HA ASP A 106 10.081 -4.072 -0.556 1.00 0.00 H new ATOM 0 HB2 ASP A 106 11.272 -3.465 -3.283 1.00 0.00 H new ATOM 0 HB3 ASP A 106 9.577 -3.637 -2.872 1.00 0.00 H new ATOM 1216 N ASN A 107 12.502 -5.894 -1.435 1.00 0.00 N ATOM 1217 CA ASN A 107 12.981 -7.239 -1.747 1.00 0.00 C ATOM 1218 C ASN A 107 12.126 -8.316 -1.083 1.00 0.00 C ATOM 1219 O ASN A 107 11.951 -9.403 -1.632 1.00 0.00 O ATOM 1220 CB ASN A 107 14.441 -7.390 -1.307 1.00 0.00 C ATOM 1221 CG ASN A 107 14.986 -8.788 -1.542 1.00 0.00 C ATOM 1222 OD1 ASN A 107 14.927 -9.650 -0.662 1.00 0.00 O ATOM 1223 ND2 ASN A 107 15.514 -9.026 -2.729 1.00 0.00 N ATOM 0 H ASN A 107 13.220 -5.281 -1.048 1.00 0.00 H new ATOM 0 HA ASN A 107 12.906 -7.373 -2.826 1.00 0.00 H new ATOM 0 HB2 ASN A 107 15.055 -6.670 -1.848 1.00 0.00 H new ATOM 0 HB3 ASN A 107 14.523 -7.146 -0.248 1.00 0.00 H new ATOM 0 HD21 ASN A 107 15.891 -9.949 -2.944 1.00 0.00 H new ATOM 0 HD22 ASN A 107 15.545 -8.287 -3.431 1.00 0.00 H new ATOM 1230 N ALA A 108 11.577 -8.004 0.086 1.00 0.00 N ATOM 1231 CA ALA A 108 10.763 -8.960 0.826 1.00 0.00 C ATOM 1232 C ALA A 108 9.458 -9.262 0.094 1.00 0.00 C ATOM 1233 O ALA A 108 8.839 -10.305 0.306 1.00 0.00 O ATOM 1234 CB ALA A 108 10.482 -8.445 2.227 1.00 0.00 C ATOM 0 H ALA A 108 11.681 -7.097 0.541 1.00 0.00 H new ATOM 0 HA ALA A 108 11.325 -9.891 0.902 1.00 0.00 H new ATOM 0 HB1 ALA A 108 9.873 -9.171 2.766 1.00 0.00 H new ATOM 0 HB2 ALA A 108 11.424 -8.297 2.756 1.00 0.00 H new ATOM 0 HB3 ALA A 108 9.947 -7.497 2.166 1.00 0.00 H new ATOM 1240 N ASN A 109 9.041 -8.342 -0.766 1.00 0.00 N ATOM 1241 CA ASN A 109 7.830 -8.531 -1.558 1.00 0.00 C ATOM 1242 C ASN A 109 8.174 -8.852 -3.005 1.00 0.00 C ATOM 1243 O ASN A 109 7.411 -9.518 -3.698 1.00 0.00 O ATOM 1244 CB ASN A 109 6.941 -7.281 -1.498 1.00 0.00 C ATOM 1245 CG ASN A 109 6.162 -7.184 -0.199 1.00 0.00 C ATOM 1246 OD1 ASN A 109 6.755 -6.565 0.810 1.00 0.00 O flip ATOM 1247 ND2 ASN A 109 5.035 -7.663 -0.105 1.00 0.00 N flip ATOM 0 H ASN A 109 9.522 -7.458 -0.934 1.00 0.00 H new ATOM 0 HA ASN A 109 7.282 -9.373 -1.134 1.00 0.00 H new ATOM 0 HB2 ASN A 109 7.561 -6.392 -1.613 1.00 0.00 H new ATOM 0 HB3 ASN A 109 6.244 -7.294 -2.336 1.00 0.00 H new ATOM 0 HD21 ASN A 109 4.612 -8.133 -0.906 1.00 0.00 H new ATOM 0 HD22 ASN A 109 4.522 -7.591 0.774 1.00 0.00 H new ATOM 1254 N GLY A 110 9.323 -8.372 -3.456 1.00 0.00 N ATOM 1255 CA GLY A 110 9.762 -8.637 -4.810 1.00 0.00 C ATOM 1256 C GLY A 110 9.380 -7.523 -5.763 1.00 0.00 C ATOM 1257 O GLY A 110 9.820 -7.498 -6.914 1.00 0.00 O ATOM 0 H GLY A 110 9.963 -7.800 -2.904 1.00 0.00 H new ATOM 0 HA2 GLY A 110 10.844 -8.767 -4.821 1.00 0.00 H new ATOM 0 HA3 GLY A 110 9.325 -9.574 -5.155 1.00 0.00 H new ATOM 1261 N VAL A 111 8.563 -6.598 -5.282 1.00 0.00 N ATOM 1262 CA VAL A 111 8.102 -5.483 -6.096 1.00 0.00 C ATOM 1263 C VAL A 111 8.858 -4.215 -5.732 1.00 0.00 C ATOM 1264 O VAL A 111 8.516 -3.534 -4.768 1.00 0.00 O ATOM 1265 CB VAL A 111 6.589 -5.243 -5.919 1.00 0.00 C ATOM 1266 CG1 VAL A 111 6.092 -4.156 -6.863 1.00 0.00 C ATOM 1267 CG2 VAL A 111 5.818 -6.534 -6.135 1.00 0.00 C ATOM 0 H VAL A 111 8.204 -6.598 -4.327 1.00 0.00 H new ATOM 0 HA VAL A 111 8.293 -5.738 -7.138 1.00 0.00 H new ATOM 0 HB VAL A 111 6.417 -4.903 -4.898 1.00 0.00 H new ATOM 0 HG11 VAL A 111 5.022 -4.008 -6.716 1.00 0.00 H new ATOM 0 HG12 VAL A 111 6.619 -3.225 -6.655 1.00 0.00 H new ATOM 0 HG13 VAL A 111 6.279 -4.456 -7.894 1.00 0.00 H new ATOM 0 HG21 VAL A 111 4.752 -6.347 -6.006 1.00 0.00 H new ATOM 0 HG22 VAL A 111 6.002 -6.904 -7.144 1.00 0.00 H new ATOM 0 HG23 VAL A 111 6.146 -7.279 -5.410 1.00 0.00 H new ATOM 1277 N THR A 112 9.891 -3.917 -6.505 1.00 0.00 N ATOM 1278 CA THR A 112 10.718 -2.745 -6.268 1.00 0.00 C ATOM 1279 C THR A 112 9.899 -1.460 -6.335 1.00 0.00 C ATOM 1280 O THR A 112 9.161 -1.233 -7.296 1.00 0.00 O ATOM 1281 CB THR A 112 11.861 -2.668 -7.293 1.00 0.00 C ATOM 1282 OG1 THR A 112 11.346 -2.912 -8.609 1.00 0.00 O ATOM 1283 CG2 THR A 112 12.952 -3.677 -6.973 1.00 0.00 C ATOM 0 H THR A 112 10.178 -4.476 -7.308 1.00 0.00 H new ATOM 0 HA THR A 112 11.134 -2.844 -5.265 1.00 0.00 H new ATOM 0 HB THR A 112 12.296 -1.670 -7.247 1.00 0.00 H new ATOM 0 HG1 THR A 112 10.420 -2.596 -8.662 1.00 0.00 H new ATOM 0 HG21 THR A 112 13.747 -3.600 -7.714 1.00 0.00 H new ATOM 0 HG22 THR A 112 13.358 -3.472 -5.982 1.00 0.00 H new ATOM 0 HG23 THR A 112 12.534 -4.683 -6.993 1.00 0.00 H new ATOM 1291 N GLY A 113 10.019 -0.634 -5.310 1.00 0.00 N ATOM 1292 CA GLY A 113 9.327 0.632 -5.298 1.00 0.00 C ATOM 1293 C GLY A 113 8.474 0.799 -4.063 1.00 0.00 C ATOM 1294 O GLY A 113 8.752 1.654 -3.222 1.00 0.00 O ATOM 0 H GLY A 113 10.586 -0.820 -4.483 1.00 0.00 H new ATOM 0 HA2 GLY A 113 10.054 1.443 -5.349 1.00 0.00 H new ATOM 0 HA3 GLY A 113 8.699 0.710 -6.186 1.00 0.00 H new ATOM 1298 N TRP A 114 7.447 -0.031 -3.945 1.00 0.00 N ATOM 1299 CA TRP A 114 6.518 0.050 -2.828 1.00 0.00 C ATOM 1300 C TRP A 114 6.152 -1.344 -2.341 1.00 0.00 C ATOM 1301 O TRP A 114 5.643 -2.160 -3.110 1.00 0.00 O ATOM 1302 CB TRP A 114 5.239 0.788 -3.241 1.00 0.00 C ATOM 1303 CG TRP A 114 5.469 2.179 -3.752 1.00 0.00 C ATOM 1304 CD1 TRP A 114 5.665 3.303 -3.006 1.00 0.00 C ATOM 1305 CD2 TRP A 114 5.526 2.590 -5.122 1.00 0.00 C ATOM 1306 NE1 TRP A 114 5.836 4.391 -3.829 1.00 0.00 N ATOM 1307 CE2 TRP A 114 5.758 3.978 -5.133 1.00 0.00 C ATOM 1308 CE3 TRP A 114 5.407 1.918 -6.341 1.00 0.00 C ATOM 1309 CZ2 TRP A 114 5.871 4.705 -6.315 1.00 0.00 C ATOM 1310 CZ3 TRP A 114 5.519 2.640 -7.513 1.00 0.00 C ATOM 1311 CH2 TRP A 114 5.750 4.023 -7.492 1.00 0.00 C ATOM 0 H TRP A 114 7.236 -0.772 -4.614 1.00 0.00 H new ATOM 0 HA TRP A 114 7.007 0.600 -2.024 1.00 0.00 H new ATOM 0 HB2 TRP A 114 4.732 0.209 -4.013 1.00 0.00 H new ATOM 0 HB3 TRP A 114 4.567 0.834 -2.384 1.00 0.00 H new ATOM 0 HD1 TRP A 114 5.683 3.334 -1.927 1.00 0.00 H new ATOM 0 HE1 TRP A 114 5.995 5.350 -3.519 1.00 0.00 H new ATOM 0 HE3 TRP A 114 5.231 0.853 -6.366 1.00 0.00 H new ATOM 0 HZ2 TRP A 114 6.048 5.770 -6.302 1.00 0.00 H new ATOM 0 HZ3 TRP A 114 5.427 2.131 -8.461 1.00 0.00 H new ATOM 0 HH2 TRP A 114 5.834 4.560 -8.425 1.00 0.00 H new ATOM 1322 N ALA A 115 6.385 -1.614 -1.067 1.00 0.00 N ATOM 1323 CA ALA A 115 5.994 -2.887 -0.489 1.00 0.00 C ATOM 1324 C ALA A 115 4.573 -2.797 0.034 1.00 0.00 C ATOM 1325 O ALA A 115 4.219 -1.858 0.746 1.00 0.00 O ATOM 1326 CB ALA A 115 6.945 -3.296 0.618 1.00 0.00 C ATOM 0 H ALA A 115 6.840 -0.972 -0.418 1.00 0.00 H new ATOM 0 HA ALA A 115 6.040 -3.651 -1.265 1.00 0.00 H new ATOM 0 HB1 ALA A 115 6.629 -4.253 1.034 1.00 0.00 H new ATOM 0 HB2 ALA A 115 7.953 -3.390 0.215 1.00 0.00 H new ATOM 0 HB3 ALA A 115 6.937 -2.539 1.402 1.00 0.00 H new ATOM 1332 N ARG A 116 3.759 -3.768 -0.335 1.00 0.00 N ATOM 1333 CA ARG A 116 2.341 -3.725 -0.028 1.00 0.00 C ATOM 1334 C ARG A 116 1.995 -4.769 1.026 1.00 0.00 C ATOM 1335 O ARG A 116 2.216 -5.961 0.825 1.00 0.00 O ATOM 1336 CB ARG A 116 1.522 -3.992 -1.293 1.00 0.00 C ATOM 1337 CG ARG A 116 2.229 -3.591 -2.583 1.00 0.00 C ATOM 1338 CD ARG A 116 2.296 -2.083 -2.760 1.00 0.00 C ATOM 1339 NE ARG A 116 1.017 -1.541 -3.206 1.00 0.00 N ATOM 1340 CZ ARG A 116 0.837 -0.286 -3.607 1.00 0.00 C ATOM 1341 NH1 ARG A 116 1.846 0.575 -3.590 1.00 0.00 N ATOM 1342 NH2 ARG A 116 -0.355 0.106 -4.036 1.00 0.00 N ATOM 0 H ARG A 116 4.056 -4.598 -0.849 1.00 0.00 H new ATOM 0 HA ARG A 116 2.102 -2.734 0.358 1.00 0.00 H new ATOM 0 HB2 ARG A 116 1.278 -5.053 -1.339 1.00 0.00 H new ATOM 0 HB3 ARG A 116 0.578 -3.451 -1.224 1.00 0.00 H new ATOM 0 HG2 ARG A 116 3.239 -4.000 -2.583 1.00 0.00 H new ATOM 0 HG3 ARG A 116 1.707 -4.031 -3.433 1.00 0.00 H new ATOM 0 HD2 ARG A 116 2.581 -1.617 -1.817 1.00 0.00 H new ATOM 0 HD3 ARG A 116 3.071 -1.835 -3.485 1.00 0.00 H new ATOM 0 HE ARG A 116 0.210 -2.164 -3.211 1.00 0.00 H new ATOM 0 HH11 ARG A 116 2.766 0.276 -3.268 1.00 0.00 H new ATOM 0 HH12 ARG A 116 1.701 1.536 -3.899 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -1.132 -0.555 -4.058 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -0.495 1.068 -4.344 1.00 0.00 H new ATOM 1356 N ASN A 117 1.463 -4.319 2.147 1.00 0.00 N ATOM 1357 CA ASN A 117 1.054 -5.216 3.222 1.00 0.00 C ATOM 1358 C ASN A 117 -0.399 -4.946 3.590 1.00 0.00 C ATOM 1359 O ASN A 117 -0.816 -3.793 3.671 1.00 0.00 O ATOM 1360 CB ASN A 117 1.949 -5.030 4.456 1.00 0.00 C ATOM 1361 CG ASN A 117 3.204 -5.899 4.445 1.00 0.00 C ATOM 1362 OD1 ASN A 117 3.650 -6.316 3.267 1.00 0.00 O flip ATOM 1363 ND2 ASN A 117 3.759 -6.206 5.500 1.00 0.00 N flip ATOM 0 H ASN A 117 1.301 -3.331 2.341 1.00 0.00 H new ATOM 0 HA ASN A 117 1.156 -6.244 2.875 1.00 0.00 H new ATOM 0 HB2 ASN A 117 2.244 -3.983 4.524 1.00 0.00 H new ATOM 0 HB3 ASN A 117 1.369 -5.257 5.351 1.00 0.00 H new ATOM 0 HD21 ASN A 117 3.389 -5.868 6.388 1.00 0.00 H new ATOM 0 HD22 ASN A 117 4.589 -6.799 5.486 1.00 0.00 H new ATOM 1370 N CYS A 118 -1.169 -6.002 3.789 1.00 0.00 N ATOM 1371 CA CYS A 118 -2.568 -5.859 4.162 1.00 0.00 C ATOM 1372 C CYS A 118 -2.844 -6.625 5.451 1.00 0.00 C ATOM 1373 O CYS A 118 -2.581 -7.827 5.536 1.00 0.00 O ATOM 1374 CB CYS A 118 -3.467 -6.363 3.030 1.00 0.00 C ATOM 1375 SG CYS A 118 -5.241 -6.098 3.316 1.00 0.00 S ATOM 0 H CYS A 118 -0.851 -6.967 3.699 1.00 0.00 H new ATOM 0 HA CYS A 118 -2.787 -4.805 4.332 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -3.181 -5.864 2.104 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -3.289 -7.429 2.886 1.00 0.00 H new ATOM 1380 N ASN A 119 -3.364 -5.932 6.457 1.00 0.00 N ATOM 1381 CA ASN A 119 -3.566 -6.530 7.772 1.00 0.00 C ATOM 1382 C ASN A 119 -5.012 -6.402 8.239 1.00 0.00 C ATOM 1383 O ASN A 119 -5.485 -5.307 8.546 1.00 0.00 O ATOM 1384 CB ASN A 119 -2.629 -5.885 8.799 1.00 0.00 C ATOM 1385 CG ASN A 119 -2.848 -6.416 10.206 1.00 0.00 C ATOM 1386 OD1 ASN A 119 -2.284 -7.439 10.590 1.00 0.00 O ATOM 1387 ND2 ASN A 119 -3.659 -5.718 10.986 1.00 0.00 N ATOM 0 H ASN A 119 -3.653 -4.956 6.388 1.00 0.00 H new ATOM 0 HA ASN A 119 -3.336 -7.592 7.685 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -1.595 -6.064 8.504 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -2.780 -4.805 8.795 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -3.835 -6.024 11.943 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -4.108 -4.874 10.630 1.00 0.00 H new ATOM 1394 N ILE A 120 -5.707 -7.526 8.268 1.00 0.00 N ATOM 1395 CA ILE A 120 -7.043 -7.604 8.838 1.00 0.00 C ATOM 1396 C ILE A 120 -7.136 -8.851 9.729 1.00 0.00 C ATOM 1397 O ILE A 120 -7.093 -9.983 9.243 1.00 0.00 O ATOM 1398 CB ILE A 120 -8.120 -7.620 7.728 1.00 0.00 C ATOM 1399 CG1 ILE A 120 -9.515 -7.891 8.295 1.00 0.00 C ATOM 1400 CG2 ILE A 120 -7.768 -8.631 6.649 1.00 0.00 C ATOM 1401 CD1 ILE A 120 -10.073 -6.765 9.141 1.00 0.00 C ATOM 0 H ILE A 120 -5.362 -8.411 7.897 1.00 0.00 H new ATOM 0 HA ILE A 120 -7.229 -6.719 9.447 1.00 0.00 H new ATOM 0 HB ILE A 120 -8.139 -6.628 7.277 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -10.199 -8.083 7.469 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -9.480 -8.799 8.897 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -8.539 -8.625 5.879 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -6.808 -8.368 6.203 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -7.703 -9.626 7.090 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -11.064 -7.039 9.503 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -9.413 -6.586 9.990 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -10.144 -5.859 8.540 1.00 0.00 H new ATOM 1413 N GLN A 121 -7.237 -8.635 11.034 1.00 0.00 N ATOM 1414 CA GLN A 121 -7.071 -9.712 12.009 1.00 0.00 C ATOM 1415 C GLN A 121 -8.240 -10.701 12.025 1.00 0.00 C ATOM 1416 O GLN A 121 -8.033 -11.911 12.116 1.00 0.00 O ATOM 1417 CB GLN A 121 -6.890 -9.108 13.410 1.00 0.00 C ATOM 1418 CG GLN A 121 -8.077 -8.266 13.863 1.00 0.00 C ATOM 1419 CD GLN A 121 -7.888 -7.649 15.233 1.00 0.00 C ATOM 1420 OE1 GLN A 121 -6.772 -7.343 15.648 1.00 0.00 O ATOM 1421 NE2 GLN A 121 -8.987 -7.459 15.944 1.00 0.00 N ATOM 0 H GLN A 121 -7.433 -7.723 11.445 1.00 0.00 H new ATOM 0 HA GLN A 121 -6.187 -10.276 11.711 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -6.730 -9.913 14.127 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -5.992 -8.491 13.418 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -8.249 -7.472 13.136 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -8.972 -8.888 13.873 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -9.894 -7.727 15.562 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -8.927 -7.044 16.874 1.00 0.00 H new ATOM 1430 N SER A 122 -9.461 -10.203 11.911 1.00 0.00 N ATOM 1431 CA SER A 122 -10.629 -11.047 12.127 1.00 0.00 C ATOM 1432 C SER A 122 -11.399 -11.359 10.842 1.00 0.00 C ATOM 1433 O SER A 122 -12.508 -11.885 10.905 1.00 0.00 O ATOM 1434 CB SER A 122 -11.555 -10.388 13.145 1.00 0.00 C ATOM 1435 OG SER A 122 -10.856 -10.094 14.347 1.00 0.00 O ATOM 0 H SER A 122 -9.670 -9.233 11.674 1.00 0.00 H new ATOM 0 HA SER A 122 -10.264 -12.002 12.506 1.00 0.00 H new ATOM 0 HB2 SER A 122 -11.969 -9.471 12.726 1.00 0.00 H new ATOM 0 HB3 SER A 122 -12.395 -11.048 13.360 1.00 0.00 H new ATOM 0 HG SER A 122 -11.467 -9.671 14.986 1.00 0.00 H new ATOM 1441 N ASP A 123 -10.817 -11.065 9.686 1.00 0.00 N ATOM 1442 CA ASP A 123 -11.507 -11.304 8.417 1.00 0.00 C ATOM 1443 C ASP A 123 -10.530 -11.550 7.275 1.00 0.00 C ATOM 1444 O ASP A 123 -10.112 -10.620 6.589 1.00 0.00 O ATOM 1445 CB ASP A 123 -12.432 -10.137 8.055 1.00 0.00 C ATOM 1446 CG ASP A 123 -13.800 -10.257 8.695 1.00 0.00 C ATOM 1447 OD1 ASP A 123 -14.611 -11.086 8.226 1.00 0.00 O ATOM 1448 OD2 ASP A 123 -14.073 -9.525 9.669 1.00 0.00 O ATOM 0 H ASP A 123 -9.882 -10.666 9.597 1.00 0.00 H new ATOM 0 HA ASP A 123 -12.107 -12.203 8.558 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -11.969 -9.201 8.368 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -12.545 -10.090 6.972 1.00 0.00 H new ATOM 1453 N SER A 124 -10.183 -12.812 7.067 1.00 0.00 N ATOM 1454 CA SER A 124 -9.273 -13.200 5.996 1.00 0.00 C ATOM 1455 C SER A 124 -9.831 -12.823 4.617 1.00 0.00 C ATOM 1456 O SER A 124 -9.069 -12.561 3.682 1.00 0.00 O ATOM 1457 CB SER A 124 -9.017 -14.706 6.066 1.00 0.00 C ATOM 1458 OG SER A 124 -8.619 -15.093 7.373 1.00 0.00 O ATOM 0 H SER A 124 -10.521 -13.592 7.631 1.00 0.00 H new ATOM 0 HA SER A 124 -8.336 -12.660 6.131 1.00 0.00 H new ATOM 0 HB2 SER A 124 -9.920 -15.246 5.782 1.00 0.00 H new ATOM 0 HB3 SER A 124 -8.243 -14.981 5.350 1.00 0.00 H new ATOM 0 HG SER A 124 -8.462 -16.060 7.394 1.00 0.00 H new ATOM 1464 N ALA A 125 -11.158 -12.774 4.502 1.00 0.00 N ATOM 1465 CA ALA A 125 -11.814 -12.480 3.231 1.00 0.00 C ATOM 1466 C ALA A 125 -11.577 -11.038 2.802 1.00 0.00 C ATOM 1467 O ALA A 125 -11.410 -10.753 1.616 1.00 0.00 O ATOM 1468 CB ALA A 125 -13.303 -12.762 3.323 1.00 0.00 C ATOM 0 H ALA A 125 -11.801 -12.935 5.278 1.00 0.00 H new ATOM 0 HA ALA A 125 -11.376 -13.132 2.475 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -13.776 -12.537 2.367 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -13.460 -13.813 3.567 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -13.744 -12.139 4.101 1.00 0.00 H new ATOM 1474 N LEU A 126 -11.551 -10.129 3.767 1.00 0.00 N ATOM 1475 CA LEU A 126 -11.291 -8.729 3.470 1.00 0.00 C ATOM 1476 C LEU A 126 -9.887 -8.568 2.914 1.00 0.00 C ATOM 1477 O LEU A 126 -9.645 -7.733 2.042 1.00 0.00 O ATOM 1478 CB LEU A 126 -11.474 -7.858 4.713 1.00 0.00 C ATOM 1479 CG LEU A 126 -12.908 -7.765 5.245 1.00 0.00 C ATOM 1480 CD1 LEU A 126 -12.970 -6.843 6.453 1.00 0.00 C ATOM 1481 CD2 LEU A 126 -13.858 -7.278 4.159 1.00 0.00 C ATOM 0 H LEU A 126 -11.705 -10.334 4.754 1.00 0.00 H new ATOM 0 HA LEU A 126 -12.011 -8.399 2.721 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -10.835 -8.247 5.506 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -11.123 -6.851 4.486 1.00 0.00 H new ATOM 0 HG LEU A 126 -13.221 -8.763 5.552 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -13.996 -6.789 6.817 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -12.325 -7.232 7.241 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -12.633 -5.846 6.168 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -14.870 -7.220 4.560 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -13.546 -6.291 3.818 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -13.839 -7.974 3.320 1.00 0.00 H new ATOM 1493 N GLN A 127 -8.963 -9.387 3.405 1.00 0.00 N ATOM 1494 CA GLN A 127 -7.607 -9.380 2.886 1.00 0.00 C ATOM 1495 C GLN A 127 -7.589 -9.909 1.463 1.00 0.00 C ATOM 1496 O GLN A 127 -6.867 -9.391 0.622 1.00 0.00 O ATOM 1497 CB GLN A 127 -6.660 -10.210 3.753 1.00 0.00 C ATOM 1498 CG GLN A 127 -5.262 -10.318 3.158 1.00 0.00 C ATOM 1499 CD GLN A 127 -4.256 -10.960 4.090 1.00 0.00 C ATOM 1500 OE1 GLN A 127 -4.715 -11.864 4.938 1.00 0.00 O flip ATOM 1501 NE2 GLN A 127 -3.065 -10.650 4.040 1.00 0.00 N flip ATOM 0 H GLN A 127 -9.129 -10.058 4.155 1.00 0.00 H new ATOM 0 HA GLN A 127 -7.258 -8.347 2.901 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -6.595 -9.762 4.745 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -7.074 -11.210 3.882 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -5.312 -10.897 2.236 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -4.912 -9.321 2.890 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -2.748 -9.948 3.372 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -2.395 -11.096 4.667 1.00 0.00 H new ATOM 1510 N GLN A 128 -8.406 -10.923 1.196 1.00 0.00 N ATOM 1511 CA GLN A 128 -8.474 -11.523 -0.133 1.00 0.00 C ATOM 1512 C GLN A 128 -8.746 -10.461 -1.189 1.00 0.00 C ATOM 1513 O GLN A 128 -8.144 -10.467 -2.261 1.00 0.00 O ATOM 1514 CB GLN A 128 -9.561 -12.596 -0.195 1.00 0.00 C ATOM 1515 CG GLN A 128 -9.285 -13.806 0.680 1.00 0.00 C ATOM 1516 CD GLN A 128 -10.368 -14.860 0.564 1.00 0.00 C ATOM 1517 OE1 GLN A 128 -11.532 -14.550 0.310 1.00 0.00 O ATOM 1518 NE2 GLN A 128 -9.992 -16.114 0.750 1.00 0.00 N ATOM 0 H GLN A 128 -9.031 -11.347 1.882 1.00 0.00 H new ATOM 0 HA GLN A 128 -7.509 -11.988 -0.335 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -10.511 -12.154 0.104 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -9.673 -12.925 -1.228 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -8.326 -14.242 0.401 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -9.200 -13.488 1.719 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -9.017 -16.328 0.959 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -10.677 -16.867 0.685 1.00 0.00 H new ATOM 1527 N ALA A 129 -9.658 -9.554 -0.880 1.00 0.00 N ATOM 1528 CA ALA A 129 -9.961 -8.450 -1.771 1.00 0.00 C ATOM 1529 C ALA A 129 -8.851 -7.403 -1.735 1.00 0.00 C ATOM 1530 O ALA A 129 -8.375 -6.949 -2.775 1.00 0.00 O ATOM 1531 CB ALA A 129 -11.295 -7.823 -1.399 1.00 0.00 C ATOM 0 H ALA A 129 -10.201 -9.562 -0.017 1.00 0.00 H new ATOM 0 HA ALA A 129 -10.028 -8.839 -2.787 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -11.510 -6.996 -2.076 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -12.084 -8.571 -1.479 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -11.250 -7.452 -0.375 1.00 0.00 H new ATOM 1537 N CYS A 130 -8.438 -7.050 -0.525 1.00 0.00 N ATOM 1538 CA CYS A 130 -7.466 -5.983 -0.298 1.00 0.00 C ATOM 1539 C CYS A 130 -6.088 -6.295 -0.885 1.00 0.00 C ATOM 1540 O CYS A 130 -5.552 -5.510 -1.671 1.00 0.00 O ATOM 1541 CB CYS A 130 -7.358 -5.731 1.206 1.00 0.00 C ATOM 1542 SG CYS A 130 -5.815 -4.937 1.751 1.00 0.00 S ATOM 0 H CYS A 130 -8.767 -7.496 0.331 1.00 0.00 H new ATOM 0 HA CYS A 130 -7.821 -5.091 -0.814 1.00 0.00 H new ATOM 0 HB2 CYS A 130 -8.197 -5.107 1.515 1.00 0.00 H new ATOM 0 HB3 CYS A 130 -7.461 -6.684 1.726 1.00 0.00 H new ATOM 1547 N GLU A 131 -5.525 -7.445 -0.531 1.00 0.00 N ATOM 1548 CA GLU A 131 -4.174 -7.789 -0.954 1.00 0.00 C ATOM 1549 C GLU A 131 -4.136 -8.031 -2.457 1.00 0.00 C ATOM 1550 O GLU A 131 -3.110 -7.839 -3.103 1.00 0.00 O ATOM 1551 CB GLU A 131 -3.640 -9.002 -0.168 1.00 0.00 C ATOM 1552 CG GLU A 131 -4.251 -10.347 -0.554 1.00 0.00 C ATOM 1553 CD GLU A 131 -3.421 -11.103 -1.570 1.00 0.00 C ATOM 1554 OE1 GLU A 131 -3.887 -11.289 -2.714 1.00 0.00 O ATOM 1555 OE2 GLU A 131 -2.297 -11.523 -1.226 1.00 0.00 O ATOM 0 H GLU A 131 -5.982 -8.152 0.046 1.00 0.00 H new ATOM 0 HA GLU A 131 -3.516 -6.949 -0.733 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -2.560 -9.058 -0.307 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -3.816 -8.832 0.894 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -4.365 -10.958 0.341 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -5.250 -10.184 -0.958 1.00 0.00 H new ATOM 1562 N ASP A 132 -5.270 -8.439 -3.006 1.00 0.00 N ATOM 1563 CA ASP A 132 -5.375 -8.711 -4.435 1.00 0.00 C ATOM 1564 C ASP A 132 -5.272 -7.425 -5.248 1.00 0.00 C ATOM 1565 O ASP A 132 -4.638 -7.395 -6.303 1.00 0.00 O ATOM 1566 CB ASP A 132 -6.698 -9.409 -4.745 1.00 0.00 C ATOM 1567 CG ASP A 132 -6.798 -9.861 -6.189 1.00 0.00 C ATOM 1568 OD1 ASP A 132 -7.292 -9.083 -7.030 1.00 0.00 O ATOM 1569 OD2 ASP A 132 -6.408 -11.009 -6.486 1.00 0.00 O ATOM 0 H ASP A 132 -6.133 -8.590 -2.484 1.00 0.00 H new ATOM 0 HA ASP A 132 -4.547 -9.364 -4.713 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -6.810 -10.273 -4.090 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -7.522 -8.731 -4.523 1.00 0.00 H new ATOM 1574 N VAL A 133 -5.901 -6.365 -4.755 1.00 0.00 N ATOM 1575 CA VAL A 133 -5.903 -5.090 -5.460 1.00 0.00 C ATOM 1576 C VAL A 133 -4.624 -4.301 -5.184 1.00 0.00 C ATOM 1577 O VAL A 133 -4.059 -3.682 -6.085 1.00 0.00 O ATOM 1578 CB VAL A 133 -7.132 -4.234 -5.084 1.00 0.00 C ATOM 1579 CG1 VAL A 133 -7.096 -2.886 -5.793 1.00 0.00 C ATOM 1580 CG2 VAL A 133 -8.419 -4.976 -5.422 1.00 0.00 C ATOM 0 H VAL A 133 -6.414 -6.363 -3.873 1.00 0.00 H new ATOM 0 HA VAL A 133 -5.953 -5.319 -6.524 1.00 0.00 H new ATOM 0 HB VAL A 133 -7.103 -4.053 -4.009 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -7.973 -2.303 -5.511 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -6.194 -2.347 -5.504 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -7.096 -3.042 -6.872 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -9.276 -4.360 -5.151 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -8.447 -5.187 -6.491 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -8.456 -5.913 -4.866 1.00 0.00 H new ATOM 1590 N PHE A 134 -4.158 -4.328 -3.944 1.00 0.00 N ATOM 1591 CA PHE A 134 -2.994 -3.535 -3.574 1.00 0.00 C ATOM 1592 C PHE A 134 -1.682 -4.224 -3.920 1.00 0.00 C ATOM 1593 O PHE A 134 -0.645 -3.567 -3.993 1.00 0.00 O ATOM 1594 CB PHE A 134 -3.030 -3.161 -2.091 1.00 0.00 C ATOM 1595 CG PHE A 134 -3.975 -2.031 -1.805 1.00 0.00 C ATOM 1596 CD1 PHE A 134 -3.525 -0.719 -1.825 1.00 0.00 C ATOM 1597 CD2 PHE A 134 -5.313 -2.273 -1.540 1.00 0.00 C ATOM 1598 CE1 PHE A 134 -4.394 0.328 -1.583 1.00 0.00 C ATOM 1599 CE2 PHE A 134 -6.185 -1.232 -1.296 1.00 0.00 C ATOM 1600 CZ PHE A 134 -5.725 0.071 -1.319 1.00 0.00 C ATOM 0 H PHE A 134 -4.560 -4.881 -3.187 1.00 0.00 H new ATOM 0 HA PHE A 134 -3.042 -2.621 -4.166 1.00 0.00 H new ATOM 0 HB2 PHE A 134 -3.324 -4.033 -1.507 1.00 0.00 H new ATOM 0 HB3 PHE A 134 -2.028 -2.883 -1.765 1.00 0.00 H new ATOM 0 HD1 PHE A 134 -2.485 -0.514 -2.032 1.00 0.00 H new ATOM 0 HD2 PHE A 134 -5.678 -3.289 -1.524 1.00 0.00 H new ATOM 0 HE1 PHE A 134 -4.033 1.346 -1.600 1.00 0.00 H new ATOM 0 HE2 PHE A 134 -7.225 -1.435 -1.087 1.00 0.00 H new ATOM 0 HZ PHE A 134 -6.406 0.888 -1.131 1.00 0.00 H new ATOM 1610 N ARG A 135 -1.705 -5.531 -4.132 1.00 0.00 N ATOM 1611 CA ARG A 135 -0.498 -6.230 -4.547 1.00 0.00 C ATOM 1612 C ARG A 135 -0.604 -6.726 -5.978 1.00 0.00 C ATOM 1613 O ARG A 135 -1.354 -7.657 -6.261 1.00 0.00 O ATOM 1614 CB ARG A 135 -0.208 -7.433 -3.645 1.00 0.00 C ATOM 1615 CG ARG A 135 0.496 -7.095 -2.346 1.00 0.00 C ATOM 1616 CD ARG A 135 0.996 -8.354 -1.650 1.00 0.00 C ATOM 1617 NE ARG A 135 1.946 -9.088 -2.487 1.00 0.00 N ATOM 1618 CZ ARG A 135 2.458 -10.280 -2.181 1.00 0.00 C ATOM 1619 NH1 ARG A 135 2.112 -10.885 -1.051 1.00 0.00 N ATOM 1620 NH2 ARG A 135 3.314 -10.870 -3.009 1.00 0.00 N ATOM 0 H ARG A 135 -2.530 -6.121 -4.026 1.00 0.00 H new ATOM 0 HA ARG A 135 0.314 -5.507 -4.469 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -1.149 -7.932 -3.413 1.00 0.00 H new ATOM 0 HB3 ARG A 135 0.403 -8.146 -4.199 1.00 0.00 H new ATOM 0 HG2 ARG A 135 1.335 -6.429 -2.546 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -0.187 -6.558 -1.687 1.00 0.00 H new ATOM 0 HD2 ARG A 135 1.472 -8.085 -0.707 1.00 0.00 H new ATOM 0 HD3 ARG A 135 0.150 -8.997 -1.408 1.00 0.00 H new ATOM 0 HE ARG A 135 2.236 -8.658 -3.365 1.00 0.00 H new ATOM 0 HH11 ARG A 135 1.453 -10.438 -0.414 1.00 0.00 H new ATOM 0 HH12 ARG A 135 2.506 -11.797 -0.820 1.00 0.00 H new ATOM 0 HH21 ARG A 135 3.580 -10.411 -3.880 1.00 0.00 H new ATOM 0 HH22 ARG A 135 3.705 -11.782 -2.773 1.00 0.00 H new ATOM 1634 N PHE A 136 0.140 -6.110 -6.882 1.00 0.00 N ATOM 1635 CA PHE A 136 0.424 -6.752 -8.150 1.00 0.00 C ATOM 1636 C PHE A 136 1.916 -6.987 -8.266 1.00 0.00 C ATOM 1637 O PHE A 136 2.690 -6.055 -8.482 1.00 0.00 O ATOM 1638 CB PHE A 136 -0.053 -5.899 -9.334 1.00 0.00 C ATOM 1639 CG PHE A 136 -1.535 -5.640 -9.357 1.00 0.00 C ATOM 1640 CD1 PHE A 136 -2.425 -6.655 -9.676 1.00 0.00 C ATOM 1641 CD2 PHE A 136 -2.040 -4.378 -9.073 1.00 0.00 C ATOM 1642 CE1 PHE A 136 -3.785 -6.419 -9.706 1.00 0.00 C ATOM 1643 CE2 PHE A 136 -3.402 -4.139 -9.103 1.00 0.00 C ATOM 1644 CZ PHE A 136 -4.274 -5.161 -9.420 1.00 0.00 C ATOM 0 H PHE A 136 0.550 -5.184 -6.764 1.00 0.00 H new ATOM 0 HA PHE A 136 -0.113 -7.700 -8.180 1.00 0.00 H new ATOM 0 HB2 PHE A 136 0.470 -4.943 -9.311 1.00 0.00 H new ATOM 0 HB3 PHE A 136 0.231 -6.396 -10.262 1.00 0.00 H new ATOM 0 HD1 PHE A 136 -2.050 -7.642 -9.904 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -1.362 -3.574 -8.826 1.00 0.00 H new ATOM 0 HE1 PHE A 136 -4.466 -7.220 -9.953 1.00 0.00 H new ATOM 0 HE2 PHE A 136 -3.783 -3.154 -8.879 1.00 0.00 H new ATOM 0 HZ PHE A 136 -5.338 -4.976 -9.444 1.00 0.00 H new ATOM 1654 N ASP A 137 2.318 -8.230 -8.093 1.00 0.00 N ATOM 1655 CA ASP A 137 3.704 -8.611 -8.284 1.00 0.00 C ATOM 1656 C ASP A 137 4.088 -8.547 -9.747 1.00 0.00 C ATOM 1657 O ASP A 137 3.444 -9.167 -10.593 1.00 0.00 O ATOM 1658 CB ASP A 137 3.946 -10.020 -7.749 1.00 0.00 C ATOM 1659 CG ASP A 137 3.501 -10.175 -6.312 1.00 0.00 C ATOM 1660 OD1 ASP A 137 2.394 -10.697 -6.082 1.00 0.00 O ATOM 1661 OD2 ASP A 137 4.249 -9.760 -5.403 1.00 0.00 O ATOM 0 H ASP A 137 1.703 -8.996 -7.820 1.00 0.00 H new ATOM 0 HA ASP A 137 4.325 -7.906 -7.731 1.00 0.00 H new ATOM 0 HB2 ASP A 137 3.413 -10.739 -8.371 1.00 0.00 H new ATOM 0 HB3 ASP A 137 5.007 -10.258 -7.826 1.00 0.00 H new ATOM 1666 N ASP A 138 5.150 -7.802 -10.035 1.00 0.00 N ATOM 1667 CA ASP A 138 5.691 -7.712 -11.389 1.00 0.00 C ATOM 1668 C ASP A 138 6.178 -9.073 -11.863 1.00 0.00 C ATOM 1669 O ASP A 138 6.419 -9.281 -13.049 1.00 0.00 O ATOM 1670 CB ASP A 138 6.843 -6.703 -11.460 1.00 0.00 C ATOM 1671 CG ASP A 138 6.362 -5.266 -11.516 1.00 0.00 C ATOM 1672 OD1 ASP A 138 6.232 -4.635 -10.446 1.00 0.00 O ATOM 1673 OD2 ASP A 138 6.122 -4.761 -12.634 1.00 0.00 O ATOM 0 H ASP A 138 5.657 -7.248 -9.345 1.00 0.00 H new ATOM 0 HA ASP A 138 4.887 -7.370 -12.041 1.00 0.00 H new ATOM 0 HB2 ASP A 138 7.487 -6.832 -10.590 1.00 0.00 H new ATOM 0 HB3 ASP A 138 7.450 -6.913 -12.341 1.00 0.00 H new ATOM 1678 N ALA A 139 6.324 -9.993 -10.918 1.00 0.00 N ATOM 1679 CA ALA A 139 6.725 -11.355 -11.220 1.00 0.00 C ATOM 1680 C ALA A 139 5.549 -12.148 -11.767 1.00 0.00 C ATOM 1681 O ALA A 139 5.719 -13.049 -12.584 1.00 0.00 O ATOM 1682 CB ALA A 139 7.280 -12.020 -9.976 1.00 0.00 C ATOM 0 H ALA A 139 6.168 -9.814 -9.926 1.00 0.00 H new ATOM 0 HA ALA A 139 7.504 -11.330 -11.982 1.00 0.00 H new ATOM 0 HB1 ALA A 139 7.578 -13.042 -10.212 1.00 0.00 H new ATOM 0 HB2 ALA A 139 8.146 -11.462 -9.621 1.00 0.00 H new ATOM 0 HB3 ALA A 139 6.515 -12.035 -9.200 1.00 0.00 H new ATOM 1688 N ASN A 140 4.351 -11.802 -11.310 1.00 0.00 N ATOM 1689 CA ASN A 140 3.136 -12.438 -11.802 1.00 0.00 C ATOM 1690 C ASN A 140 2.707 -11.770 -13.097 1.00 0.00 C ATOM 1691 O ASN A 140 1.946 -12.330 -13.883 1.00 0.00 O ATOM 1692 CB ASN A 140 2.000 -12.349 -10.774 1.00 0.00 C ATOM 1693 CG ASN A 140 2.325 -13.044 -9.466 1.00 0.00 C ATOM 1694 OD1 ASN A 140 3.140 -13.964 -9.416 1.00 0.00 O ATOM 1695 ND2 ASN A 140 1.669 -12.624 -8.395 1.00 0.00 N ATOM 0 H ASN A 140 4.196 -11.086 -10.601 1.00 0.00 H new ATOM 0 HA ASN A 140 3.349 -13.493 -11.977 1.00 0.00 H new ATOM 0 HB2 ASN A 140 1.779 -11.300 -10.576 1.00 0.00 H new ATOM 0 HB3 ASN A 140 1.098 -12.790 -11.199 1.00 0.00 H new ATOM 0 HD21 ASN A 140 1.833 -13.067 -7.491 1.00 0.00 H new ATOM 0 HD22 ASN A 140 1.000 -11.858 -8.474 1.00 0.00 H new ATOM 1702 N LEU A 141 3.211 -10.565 -13.308 1.00 0.00 N ATOM 1703 CA LEU A 141 2.901 -9.802 -14.505 1.00 0.00 C ATOM 1704 C LEU A 141 3.886 -10.162 -15.607 1.00 0.00 C ATOM 1705 O LEU A 141 4.921 -10.781 -15.351 1.00 0.00 O ATOM 1706 CB LEU A 141 2.981 -8.295 -14.223 1.00 0.00 C ATOM 1707 CG LEU A 141 2.156 -7.789 -13.031 1.00 0.00 C ATOM 1708 CD1 LEU A 141 2.275 -6.278 -12.907 1.00 0.00 C ATOM 1709 CD2 LEU A 141 0.695 -8.196 -13.161 1.00 0.00 C ATOM 0 H LEU A 141 3.841 -10.092 -12.660 1.00 0.00 H new ATOM 0 HA LEU A 141 1.886 -10.046 -14.820 1.00 0.00 H new ATOM 0 HB2 LEU A 141 4.025 -8.032 -14.055 1.00 0.00 H new ATOM 0 HB3 LEU A 141 2.658 -7.761 -15.116 1.00 0.00 H new ATOM 0 HG LEU A 141 2.555 -8.249 -12.127 1.00 0.00 H new ATOM 0 HD11 LEU A 141 1.684 -5.935 -12.057 1.00 0.00 H new ATOM 0 HD12 LEU A 141 3.320 -6.006 -12.756 1.00 0.00 H new ATOM 0 HD13 LEU A 141 1.906 -5.808 -13.819 1.00 0.00 H new ATOM 0 HD21 LEU A 141 0.136 -7.824 -12.303 1.00 0.00 H new ATOM 0 HD22 LEU A 141 0.280 -7.773 -14.076 1.00 0.00 H new ATOM 0 HD23 LEU A 141 0.622 -9.283 -13.198 1.00 0.00 H new ATOM 1721 N VAL A 142 3.559 -9.785 -16.827 1.00 0.00 N ATOM 1722 CA VAL A 142 4.458 -9.992 -17.947 1.00 0.00 C ATOM 1723 C VAL A 142 5.272 -8.726 -18.194 1.00 0.00 C ATOM 1724 O VAL A 142 4.704 -7.647 -18.379 1.00 0.00 O ATOM 1725 CB VAL A 142 3.687 -10.362 -19.230 1.00 0.00 C ATOM 1726 CG1 VAL A 142 4.646 -10.570 -20.394 1.00 0.00 C ATOM 1727 CG2 VAL A 142 2.835 -11.603 -19.007 1.00 0.00 C ATOM 0 H VAL A 142 2.677 -9.333 -17.069 1.00 0.00 H new ATOM 0 HA VAL A 142 5.120 -10.820 -17.696 1.00 0.00 H new ATOM 0 HB VAL A 142 3.024 -9.534 -19.479 1.00 0.00 H new ATOM 0 HG11 VAL A 142 4.081 -10.830 -21.289 1.00 0.00 H new ATOM 0 HG12 VAL A 142 5.206 -9.652 -20.573 1.00 0.00 H new ATOM 0 HG13 VAL A 142 5.339 -11.377 -20.155 1.00 0.00 H new ATOM 0 HG21 VAL A 142 2.300 -11.846 -19.925 1.00 0.00 H new ATOM 0 HG22 VAL A 142 3.476 -12.439 -18.728 1.00 0.00 H new ATOM 0 HG23 VAL A 142 2.118 -11.413 -18.208 1.00 0.00 H new ATOM 1737 N PRO A 143 6.607 -8.832 -18.185 1.00 0.00 N ATOM 1738 CA PRO A 143 7.476 -7.682 -18.413 1.00 0.00 C ATOM 1739 C PRO A 143 7.338 -7.156 -19.834 1.00 0.00 C ATOM 1740 O PRO A 143 7.353 -7.925 -20.795 1.00 0.00 O ATOM 1741 CB PRO A 143 8.885 -8.230 -18.170 1.00 0.00 C ATOM 1742 CG PRO A 143 8.773 -9.703 -18.364 1.00 0.00 C ATOM 1743 CD PRO A 143 7.369 -10.074 -17.966 1.00 0.00 C ATOM 0 HA PRO A 143 7.230 -6.842 -17.763 1.00 0.00 H new ATOM 0 HB2 PRO A 143 9.602 -7.795 -18.867 1.00 0.00 H new ATOM 0 HB3 PRO A 143 9.232 -7.991 -17.165 1.00 0.00 H new ATOM 0 HG2 PRO A 143 8.968 -9.975 -19.401 1.00 0.00 H new ATOM 0 HG3 PRO A 143 9.504 -10.233 -17.753 1.00 0.00 H new ATOM 0 HD2 PRO A 143 6.983 -10.893 -18.573 1.00 0.00 H new ATOM 0 HD3 PRO A 143 7.319 -10.397 -16.926 1.00 0.00 H new ATOM 1751 N ARG A 144 7.195 -5.849 -19.962 1.00 0.00 N ATOM 1752 CA ARG A 144 7.020 -5.223 -21.263 1.00 0.00 C ATOM 1753 C ARG A 144 8.105 -4.184 -21.505 1.00 0.00 C ATOM 1754 O ARG A 144 8.160 -3.160 -20.820 1.00 0.00 O ATOM 1755 CB ARG A 144 5.635 -4.577 -21.376 1.00 0.00 C ATOM 1756 CG ARG A 144 4.491 -5.574 -21.494 1.00 0.00 C ATOM 1757 CD ARG A 144 4.626 -6.436 -22.743 1.00 0.00 C ATOM 1758 NE ARG A 144 4.953 -5.639 -23.927 1.00 0.00 N ATOM 1759 CZ ARG A 144 5.239 -6.150 -25.122 1.00 0.00 C ATOM 1760 NH1 ARG A 144 5.167 -7.460 -25.330 1.00 0.00 N ATOM 1761 NH2 ARG A 144 5.584 -5.346 -26.117 1.00 0.00 N ATOM 0 H ARG A 144 7.197 -5.197 -19.178 1.00 0.00 H new ATOM 0 HA ARG A 144 7.101 -5.999 -22.025 1.00 0.00 H new ATOM 0 HB2 ARG A 144 5.466 -3.949 -20.501 1.00 0.00 H new ATOM 0 HB3 ARG A 144 5.622 -3.921 -22.246 1.00 0.00 H new ATOM 0 HG2 ARG A 144 4.471 -6.212 -20.611 1.00 0.00 H new ATOM 0 HG3 ARG A 144 3.542 -5.038 -21.521 1.00 0.00 H new ATOM 0 HD2 ARG A 144 5.402 -7.185 -22.584 1.00 0.00 H new ATOM 0 HD3 ARG A 144 3.694 -6.974 -22.914 1.00 0.00 H new ATOM 0 HE ARG A 144 4.962 -4.624 -23.829 1.00 0.00 H new ATOM 0 HH11 ARG A 144 4.891 -8.083 -24.571 1.00 0.00 H new ATOM 0 HH12 ARG A 144 5.388 -7.843 -26.249 1.00 0.00 H new ATOM 0 HH21 ARG A 144 5.630 -4.338 -25.966 1.00 0.00 H new ATOM 0 HH22 ARG A 144 5.804 -5.735 -27.034 1.00 0.00 H new ATOM 1775 N GLY A 145 8.966 -4.453 -22.472 1.00 0.00 N ATOM 1776 CA GLY A 145 10.047 -3.542 -22.767 1.00 0.00 C ATOM 1777 C GLY A 145 10.823 -3.943 -23.997 1.00 0.00 C ATOM 1778 O GLY A 145 10.838 -5.114 -24.374 1.00 0.00 O ATOM 0 H GLY A 145 8.935 -5.287 -23.058 1.00 0.00 H new ATOM 0 HA2 GLY A 145 9.644 -2.539 -22.907 1.00 0.00 H new ATOM 0 HA3 GLY A 145 10.723 -3.498 -21.913 1.00 0.00 H new ATOM 1782 N SER A 146 11.453 -2.966 -24.632 1.00 0.00 N ATOM 1783 CA SER A 146 12.345 -3.230 -25.754 1.00 0.00 C ATOM 1784 C SER A 146 13.551 -4.040 -25.277 1.00 0.00 C ATOM 1785 O SER A 146 13.831 -4.089 -24.076 1.00 0.00 O ATOM 1786 CB SER A 146 12.800 -1.913 -26.381 1.00 0.00 C ATOM 1787 OG SER A 146 11.684 -1.107 -26.725 1.00 0.00 O ATOM 0 H SER A 146 11.363 -1.979 -24.389 1.00 0.00 H new ATOM 0 HA SER A 146 11.811 -3.807 -26.509 1.00 0.00 H new ATOM 0 HB2 SER A 146 13.441 -1.375 -25.683 1.00 0.00 H new ATOM 0 HB3 SER A 146 13.396 -2.115 -27.271 1.00 0.00 H new ATOM 0 HG SER A 146 11.997 -0.268 -27.123 1.00 0.00 H new ATOM 1793 N GLY A 147 14.269 -4.668 -26.196 1.00 0.00 N ATOM 1794 CA GLY A 147 15.364 -5.533 -25.800 1.00 0.00 C ATOM 1795 C GLY A 147 15.030 -6.998 -25.970 1.00 0.00 C ATOM 1796 O GLY A 147 15.528 -7.846 -25.228 1.00 0.00 O ATOM 0 H GLY A 147 14.116 -4.596 -27.202 1.00 0.00 H new ATOM 0 HA2 GLY A 147 16.246 -5.293 -26.393 1.00 0.00 H new ATOM 0 HA3 GLY A 147 15.618 -5.339 -24.758 1.00 0.00 H new ATOM 1800 N LEU A 148 14.196 -7.302 -26.951 1.00 0.00 N ATOM 1801 CA LEU A 148 13.813 -8.678 -27.220 1.00 0.00 C ATOM 1802 C LEU A 148 14.955 -9.406 -27.917 1.00 0.00 C ATOM 1803 O LEU A 148 15.293 -9.103 -29.063 1.00 0.00 O ATOM 1804 CB LEU A 148 12.539 -8.752 -28.084 1.00 0.00 C ATOM 1805 CG LEU A 148 11.218 -8.396 -27.383 1.00 0.00 C ATOM 1806 CD1 LEU A 148 11.146 -6.913 -27.058 1.00 0.00 C ATOM 1807 CD2 LEU A 148 10.036 -8.800 -28.252 1.00 0.00 C ATOM 0 H LEU A 148 13.772 -6.615 -27.574 1.00 0.00 H new ATOM 0 HA LEU A 148 13.599 -9.160 -26.266 1.00 0.00 H new ATOM 0 HB2 LEU A 148 12.665 -8.084 -28.936 1.00 0.00 H new ATOM 0 HB3 LEU A 148 12.454 -9.763 -28.481 1.00 0.00 H new ATOM 0 HG LEU A 148 11.177 -8.948 -26.444 1.00 0.00 H new ATOM 0 HD11 LEU A 148 10.200 -6.695 -26.563 1.00 0.00 H new ATOM 0 HD12 LEU A 148 11.971 -6.645 -26.398 1.00 0.00 H new ATOM 0 HD13 LEU A 148 11.215 -6.335 -27.979 1.00 0.00 H new ATOM 0 HD21 LEU A 148 9.106 -8.543 -27.744 1.00 0.00 H new ATOM 0 HD22 LEU A 148 10.087 -8.272 -29.204 1.00 0.00 H new ATOM 0 HD23 LEU A 148 10.066 -9.875 -28.431 1.00 0.00 H new ATOM 1819 N GLU A 149 15.563 -10.348 -27.215 1.00 0.00 N ATOM 1820 CA GLU A 149 16.648 -11.135 -27.779 1.00 0.00 C ATOM 1821 C GLU A 149 16.081 -12.350 -28.502 1.00 0.00 C ATOM 1822 O GLU A 149 16.684 -12.867 -29.443 1.00 0.00 O ATOM 1823 CB GLU A 149 17.645 -11.575 -26.690 1.00 0.00 C ATOM 1824 CG GLU A 149 17.093 -12.580 -25.682 1.00 0.00 C ATOM 1825 CD GLU A 149 16.047 -11.991 -24.755 1.00 0.00 C ATOM 1826 OE1 GLU A 149 16.401 -11.608 -23.620 1.00 0.00 O ATOM 1827 OE2 GLU A 149 14.871 -11.903 -25.160 1.00 0.00 O ATOM 0 H GLU A 149 15.324 -10.587 -26.253 1.00 0.00 H new ATOM 0 HA GLU A 149 17.189 -10.512 -28.491 1.00 0.00 H new ATOM 0 HB2 GLU A 149 18.520 -12.010 -27.173 1.00 0.00 H new ATOM 0 HB3 GLU A 149 17.985 -10.691 -26.151 1.00 0.00 H new ATOM 0 HG2 GLU A 149 16.658 -13.422 -26.221 1.00 0.00 H new ATOM 0 HG3 GLU A 149 17.916 -12.974 -25.086 1.00 0.00 H new ATOM 1834 N HIS A 150 14.910 -12.793 -28.054 1.00 0.00 N ATOM 1835 CA HIS A 150 14.227 -13.919 -28.674 1.00 0.00 C ATOM 1836 C HIS A 150 13.591 -13.497 -29.990 1.00 0.00 C ATOM 1837 O HIS A 150 12.514 -12.895 -30.006 1.00 0.00 O ATOM 1838 CB HIS A 150 13.155 -14.496 -27.744 1.00 0.00 C ATOM 1839 CG HIS A 150 13.696 -15.107 -26.486 1.00 0.00 C ATOM 1840 ND1 HIS A 150 14.400 -16.291 -26.467 1.00 0.00 N ATOM 1841 CD2 HIS A 150 13.631 -14.691 -25.199 1.00 0.00 C ATOM 1842 CE1 HIS A 150 14.742 -16.576 -25.225 1.00 0.00 C ATOM 1843 NE2 HIS A 150 14.288 -15.622 -24.438 1.00 0.00 N ATOM 0 H HIS A 150 14.414 -12.386 -27.261 1.00 0.00 H new ATOM 0 HA HIS A 150 14.971 -14.692 -28.867 1.00 0.00 H new ATOM 0 HB2 HIS A 150 12.456 -13.703 -27.478 1.00 0.00 H new ATOM 0 HB3 HIS A 150 12.588 -15.252 -28.287 1.00 0.00 H new ATOM 0 HD2 HIS A 150 13.151 -13.793 -24.839 1.00 0.00 H new ATOM 0 HE1 HIS A 150 15.300 -17.444 -24.907 1.00 0.00 H new ATOM 0 HE2 HIS A 150 14.406 -15.583 -23.426 1.00 0.00 H new ATOM 1852 N HIS A 151 14.277 -13.799 -31.085 1.00 0.00 N ATOM 1853 CA HIS A 151 13.780 -13.477 -32.421 1.00 0.00 C ATOM 1854 C HIS A 151 12.398 -14.079 -32.635 1.00 0.00 C ATOM 1855 O HIS A 151 12.181 -15.271 -32.399 1.00 0.00 O ATOM 1856 CB HIS A 151 14.745 -13.972 -33.499 1.00 0.00 C ATOM 1857 CG HIS A 151 16.091 -13.316 -33.444 1.00 0.00 C ATOM 1858 ND1 HIS A 151 17.231 -13.966 -33.024 1.00 0.00 N ATOM 1859 CD2 HIS A 151 16.475 -12.057 -33.759 1.00 0.00 C ATOM 1860 CE1 HIS A 151 18.255 -13.133 -33.083 1.00 0.00 C ATOM 1861 NE2 HIS A 151 17.822 -11.971 -33.525 1.00 0.00 N ATOM 0 H HIS A 151 15.183 -14.268 -31.076 1.00 0.00 H new ATOM 0 HA HIS A 151 13.707 -12.392 -32.500 1.00 0.00 H new ATOM 0 HB2 HIS A 151 14.871 -15.050 -33.396 1.00 0.00 H new ATOM 0 HB3 HIS A 151 14.303 -13.795 -34.480 1.00 0.00 H new ATOM 0 HD2 HIS A 151 15.838 -11.267 -34.127 1.00 0.00 H new ATOM 0 HE1 HIS A 151 19.275 -13.366 -32.814 1.00 0.00 H new ATOM 0 HE2 HIS A 151 18.397 -11.141 -33.670 1.00 0.00 H new ATOM 1870 N HIS A 152 11.470 -13.247 -33.086 1.00 0.00 N ATOM 1871 CA HIS A 152 10.065 -13.623 -33.176 1.00 0.00 C ATOM 1872 C HIS A 152 9.783 -14.409 -34.456 1.00 0.00 C ATOM 1873 O HIS A 152 8.882 -14.075 -35.226 1.00 0.00 O ATOM 1874 CB HIS A 152 9.187 -12.367 -33.115 1.00 0.00 C ATOM 1875 CG HIS A 152 7.745 -12.647 -32.815 1.00 0.00 C ATOM 1876 ND1 HIS A 152 6.777 -12.768 -33.788 1.00 0.00 N ATOM 1877 CD2 HIS A 152 7.111 -12.822 -31.633 1.00 0.00 C ATOM 1878 CE1 HIS A 152 5.610 -13.006 -33.218 1.00 0.00 C ATOM 1879 NE2 HIS A 152 5.788 -13.043 -31.911 1.00 0.00 N ATOM 0 H HIS A 152 11.668 -12.296 -33.399 1.00 0.00 H new ATOM 0 HA HIS A 152 9.827 -14.269 -32.331 1.00 0.00 H new ATOM 0 HB2 HIS A 152 9.583 -11.696 -32.353 1.00 0.00 H new ATOM 0 HB3 HIS A 152 9.254 -11.842 -34.068 1.00 0.00 H new ATOM 0 HD2 HIS A 152 7.564 -12.793 -30.653 1.00 0.00 H new ATOM 0 HE1 HIS A 152 4.671 -13.146 -33.733 1.00 0.00 H new ATOM 0 HE2 HIS A 152 5.058 -13.209 -31.219 1.00 0.00 H new ATOM 1888 N HIS A 153 10.559 -15.454 -34.682 1.00 0.00 N ATOM 1889 CA HIS A 153 10.345 -16.332 -35.816 1.00 0.00 C ATOM 1890 C HIS A 153 10.646 -17.769 -35.418 1.00 0.00 C ATOM 1891 O HIS A 153 11.804 -18.169 -35.318 1.00 0.00 O ATOM 1892 CB HIS A 153 11.204 -15.915 -37.015 1.00 0.00 C ATOM 1893 CG HIS A 153 10.946 -16.739 -38.241 1.00 0.00 C ATOM 1894 ND1 HIS A 153 11.932 -17.110 -39.124 1.00 0.00 N ATOM 1895 CD2 HIS A 153 9.798 -17.273 -38.719 1.00 0.00 C ATOM 1896 CE1 HIS A 153 11.402 -17.838 -40.089 1.00 0.00 C ATOM 1897 NE2 HIS A 153 10.106 -17.956 -39.866 1.00 0.00 N ATOM 0 H HIS A 153 11.348 -15.715 -34.090 1.00 0.00 H new ATOM 0 HA HIS A 153 9.300 -16.255 -36.117 1.00 0.00 H new ATOM 0 HB2 HIS A 153 11.013 -14.866 -37.243 1.00 0.00 H new ATOM 0 HB3 HIS A 153 12.257 -15.996 -36.745 1.00 0.00 H new ATOM 0 HD2 HIS A 153 8.817 -17.178 -38.277 1.00 0.00 H new ATOM 0 HE1 HIS A 153 11.939 -18.266 -40.922 1.00 0.00 H new ATOM 0 HE2 HIS A 153 9.445 -18.469 -40.449 1.00 0.00 H new ATOM 1906 N HIS A 154 9.593 -18.532 -35.184 1.00 0.00 N ATOM 1907 CA HIS A 154 9.718 -19.923 -34.777 1.00 0.00 C ATOM 1908 C HIS A 154 8.798 -20.798 -35.621 1.00 0.00 C ATOM 1909 O HIS A 154 8.041 -21.619 -35.101 1.00 0.00 O ATOM 1910 CB HIS A 154 9.412 -20.088 -33.278 1.00 0.00 C ATOM 1911 CG HIS A 154 8.105 -19.491 -32.840 1.00 0.00 C ATOM 1912 ND1 HIS A 154 6.976 -20.243 -32.594 1.00 0.00 N ATOM 1913 CD2 HIS A 154 7.759 -18.206 -32.586 1.00 0.00 C ATOM 1914 CE1 HIS A 154 5.996 -19.446 -32.212 1.00 0.00 C ATOM 1915 NE2 HIS A 154 6.445 -18.207 -32.198 1.00 0.00 N ATOM 0 H HIS A 154 8.630 -18.208 -35.270 1.00 0.00 H new ATOM 0 HA HIS A 154 10.747 -20.242 -34.940 1.00 0.00 H new ATOM 0 HB2 HIS A 154 9.411 -21.151 -33.035 1.00 0.00 H new ATOM 0 HB3 HIS A 154 10.217 -19.630 -32.703 1.00 0.00 H new ATOM 0 HD2 HIS A 154 8.400 -17.341 -32.673 1.00 0.00 H new ATOM 0 HE1 HIS A 154 4.994 -19.757 -31.954 1.00 0.00 H new ATOM 0 HE2 HIS A 154 5.902 -17.383 -31.940 1.00 0.00 H new ATOM 1924 N HIS A 155 8.876 -20.606 -36.930 1.00 0.00 N ATOM 1925 CA HIS A 155 8.030 -21.322 -37.869 1.00 0.00 C ATOM 1926 C HIS A 155 8.543 -21.115 -39.289 1.00 0.00 C ATOM 1927 O HIS A 155 8.312 -20.027 -39.856 1.00 0.00 O ATOM 1928 CB HIS A 155 6.577 -20.848 -37.756 1.00 0.00 C ATOM 1929 CG HIS A 155 5.608 -21.678 -38.540 1.00 0.00 C ATOM 1930 ND1 HIS A 155 4.822 -21.168 -39.551 1.00 0.00 N ATOM 1931 CD2 HIS A 155 5.284 -22.990 -38.443 1.00 0.00 C ATOM 1932 CE1 HIS A 155 4.062 -22.128 -40.041 1.00 0.00 C ATOM 1933 NE2 HIS A 155 4.322 -23.244 -39.389 1.00 0.00 N ATOM 1934 OXT HIS A 155 9.178 -22.037 -39.834 1.00 0.00 O ATOM 0 H HIS A 155 9.525 -19.952 -37.368 1.00 0.00 H new ATOM 0 HA HIS A 155 8.063 -22.385 -37.629 1.00 0.00 H new ATOM 0 HB2 HIS A 155 6.282 -20.856 -36.707 1.00 0.00 H new ATOM 0 HB3 HIS A 155 6.514 -19.814 -38.096 1.00 0.00 H new ATOM 0 HD2 HIS A 155 5.705 -23.704 -37.750 1.00 0.00 H new ATOM 0 HE1 HIS A 155 3.346 -22.018 -40.842 1.00 0.00 H new ATOM 0 HE2 HIS A 155 3.881 -24.148 -39.559 1.00 0.00 H new TER 1943 HIS A 155