USER MOD reduce.3.24.130724 H: found=0, std=0, add=781, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 779 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 23 THR OG1 : rot -5:sc= 0.207 USER MOD Set 1.2: A 27 LYS NZ :NH3+ -176:sc= 0.464 (180deg=0.456) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot -134:sc= 1.21 USER MOD Single : A 3 SER OG : rot 57:sc= 1.24 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=-0.075) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 MET CE :methyl -120:sc= -0.0126 (180deg=-0.693) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 157:sc= 1.27 USER MOD Single : A 25 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 CYS SG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc=-0.00382 X(o=-0.0038,f=0) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 55 MET CE :methyl -159:sc= -0.546 (180deg=-1.69!) USER MOD Single : A 57 SER OG : rot 78:sc= 0.344 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0.371 USER MOD Single : A 67 GLN : amide:sc= -0.0627 X(o=-0.063,f=-0.31) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= -0.0127 X(o=-0.013,f=-0.1) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 83 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=-0.052) USER MOD Single : A 90 GLN : amide:sc= -0.224 K(o=-0.22,f=-3.6!) USER MOD Single : A 91 GLN : amide:sc= -0.0392 X(o=-0.039,f=0) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0.0141 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0.00434 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 16.196 -6.559 -13.537 1.00 0.00 N ATOM 2 CA GLY A 1 15.407 -6.596 -12.298 1.00 0.00 C ATOM 3 C GLY A 1 14.090 -5.850 -12.430 1.00 0.00 C ATOM 4 O GLY A 1 13.072 -6.448 -12.787 1.00 0.00 O ATOM 0 H1 GLY A 1 17.085 -7.081 -13.398 1.00 0.00 H new ATOM 0 H2 GLY A 1 15.653 -6.999 -14.308 1.00 0.00 H new ATOM 0 H3 GLY A 1 16.409 -5.571 -13.783 1.00 0.00 H new ATOM 0 HA2 GLY A 1 15.209 -7.633 -12.027 1.00 0.00 H new ATOM 0 HA3 GLY A 1 15.989 -6.160 -11.486 1.00 0.00 H new ATOM 8 N SER A 2 14.076 -4.565 -12.098 1.00 0.00 N ATOM 9 CA SER A 2 12.862 -3.800 -11.862 1.00 0.00 C ATOM 10 C SER A 2 12.541 -2.984 -13.113 1.00 0.00 C ATOM 11 O SER A 2 13.005 -1.853 -13.269 1.00 0.00 O ATOM 12 CB SER A 2 13.043 -2.954 -10.597 1.00 0.00 C ATOM 13 OG SER A 2 13.588 -3.768 -9.569 1.00 0.00 O ATOM 0 H SER A 2 14.928 -4.016 -11.983 1.00 0.00 H new ATOM 0 HA SER A 2 12.004 -4.447 -11.682 1.00 0.00 H new ATOM 0 HB2 SER A 2 13.704 -2.111 -10.799 1.00 0.00 H new ATOM 0 HB3 SER A 2 12.085 -2.540 -10.281 1.00 0.00 H new ATOM 0 HG SER A 2 13.101 -3.610 -8.734 1.00 0.00 H new ATOM 19 N SER A 3 11.840 -3.605 -14.062 1.00 0.00 N ATOM 20 CA SER A 3 11.235 -2.987 -15.235 1.00 0.00 C ATOM 21 C SER A 3 10.227 -3.977 -15.828 1.00 0.00 C ATOM 22 O SER A 3 10.305 -5.182 -15.562 1.00 0.00 O ATOM 23 CB SER A 3 12.320 -2.613 -16.252 1.00 0.00 C ATOM 24 OG SER A 3 12.917 -1.386 -15.867 1.00 0.00 O ATOM 0 H SER A 3 11.671 -4.610 -14.028 1.00 0.00 H new ATOM 0 HA SER A 3 10.718 -2.067 -14.962 1.00 0.00 H new ATOM 0 HB2 SER A 3 13.074 -3.398 -16.302 1.00 0.00 H new ATOM 0 HB3 SER A 3 11.886 -2.523 -17.248 1.00 0.00 H new ATOM 0 HG SER A 3 13.280 -1.469 -14.960 1.00 0.00 H new ATOM 30 N GLY A 4 9.297 -3.454 -16.634 1.00 0.00 N ATOM 31 CA GLY A 4 8.185 -4.156 -17.256 1.00 0.00 C ATOM 32 C GLY A 4 7.480 -5.047 -16.247 1.00 0.00 C ATOM 33 O GLY A 4 6.910 -4.535 -15.275 1.00 0.00 O ATOM 0 H GLY A 4 9.308 -2.464 -16.881 1.00 0.00 H new ATOM 0 HA2 GLY A 4 7.479 -3.435 -17.668 1.00 0.00 H new ATOM 0 HA3 GLY A 4 8.549 -4.758 -18.089 1.00 0.00 H new ATOM 37 N SER A 5 7.596 -6.360 -16.461 1.00 0.00 N ATOM 38 CA SER A 5 6.961 -7.421 -15.693 1.00 0.00 C ATOM 39 C SER A 5 5.442 -7.438 -15.930 1.00 0.00 C ATOM 40 O SER A 5 4.834 -6.450 -16.349 1.00 0.00 O ATOM 41 CB SER A 5 7.370 -7.295 -14.210 1.00 0.00 C ATOM 42 OG SER A 5 6.997 -8.403 -13.421 1.00 0.00 O ATOM 0 H SER A 5 8.170 -6.727 -17.220 1.00 0.00 H new ATOM 0 HA SER A 5 7.311 -8.396 -16.033 1.00 0.00 H new ATOM 0 HB2 SER A 5 8.451 -7.166 -14.150 1.00 0.00 H new ATOM 0 HB3 SER A 5 6.918 -6.395 -13.793 1.00 0.00 H new ATOM 0 HG SER A 5 7.287 -8.259 -12.496 1.00 0.00 H new ATOM 48 N SER A 6 4.828 -8.578 -15.636 1.00 0.00 N ATOM 49 CA SER A 6 3.390 -8.775 -15.556 1.00 0.00 C ATOM 50 C SER A 6 3.161 -9.748 -14.396 1.00 0.00 C ATOM 51 O SER A 6 4.053 -10.531 -14.059 1.00 0.00 O ATOM 52 CB SER A 6 2.848 -9.354 -16.872 1.00 0.00 C ATOM 53 OG SER A 6 3.368 -8.705 -18.025 1.00 0.00 O ATOM 0 H SER A 6 5.349 -9.432 -15.437 1.00 0.00 H new ATOM 0 HA SER A 6 2.867 -7.833 -15.391 1.00 0.00 H new ATOM 0 HB2 SER A 6 3.089 -10.416 -16.921 1.00 0.00 H new ATOM 0 HB3 SER A 6 1.761 -9.273 -16.877 1.00 0.00 H new ATOM 0 HG SER A 6 2.990 -9.116 -18.830 1.00 0.00 H new ATOM 59 N GLY A 7 1.981 -9.725 -13.793 1.00 0.00 N ATOM 60 CA GLY A 7 1.653 -10.561 -12.650 1.00 0.00 C ATOM 61 C GLY A 7 0.226 -10.243 -12.245 1.00 0.00 C ATOM 62 O GLY A 7 -0.581 -9.861 -13.098 1.00 0.00 O ATOM 0 H GLY A 7 1.216 -9.118 -14.088 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.753 -11.616 -12.906 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.338 -10.367 -11.824 1.00 0.00 H new ATOM 66 N GLN A 8 -0.088 -10.387 -10.960 1.00 0.00 N ATOM 67 CA GLN A 8 -1.180 -9.668 -10.330 1.00 0.00 C ATOM 68 C GLN A 8 -0.988 -9.702 -8.818 1.00 0.00 C ATOM 69 O GLN A 8 -0.022 -10.281 -8.312 1.00 0.00 O ATOM 70 CB GLN A 8 -2.549 -10.217 -10.800 1.00 0.00 C ATOM 71 CG GLN A 8 -3.305 -9.073 -11.493 1.00 0.00 C ATOM 72 CD GLN A 8 -4.435 -9.537 -12.402 1.00 0.00 C ATOM 73 OE1 GLN A 8 -5.082 -10.559 -12.182 1.00 0.00 O ATOM 74 NE2 GLN A 8 -4.687 -8.789 -13.460 1.00 0.00 N ATOM 0 H GLN A 8 0.414 -11.010 -10.327 1.00 0.00 H new ATOM 0 HA GLN A 8 -1.173 -8.622 -10.635 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -2.410 -11.053 -11.486 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -3.121 -10.593 -9.952 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -3.714 -8.409 -10.732 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -2.598 -8.487 -12.080 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -4.141 -7.944 -13.629 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -5.427 -9.056 -14.109 1.00 0.00 H new ATOM 83 N TYR A 9 -1.951 -9.118 -8.104 1.00 0.00 N ATOM 84 CA TYR A 9 -2.100 -9.202 -6.658 1.00 0.00 C ATOM 85 C TYR A 9 -1.893 -10.630 -6.148 1.00 0.00 C ATOM 86 O TYR A 9 -1.232 -10.810 -5.132 1.00 0.00 O ATOM 87 CB TYR A 9 -3.479 -8.640 -6.260 1.00 0.00 C ATOM 88 CG TYR A 9 -4.617 -9.071 -7.175 1.00 0.00 C ATOM 89 CD1 TYR A 9 -5.180 -10.352 -7.033 1.00 0.00 C ATOM 90 CD2 TYR A 9 -5.055 -8.231 -8.220 1.00 0.00 C ATOM 91 CE1 TYR A 9 -6.137 -10.816 -7.948 1.00 0.00 C ATOM 92 CE2 TYR A 9 -6.034 -8.681 -9.126 1.00 0.00 C ATOM 93 CZ TYR A 9 -6.572 -9.982 -8.998 1.00 0.00 C ATOM 94 OH TYR A 9 -7.506 -10.442 -9.871 1.00 0.00 O ATOM 0 H TYR A 9 -2.677 -8.550 -8.540 1.00 0.00 H new ATOM 0 HA TYR A 9 -1.325 -8.599 -6.184 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -3.707 -8.955 -5.242 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -3.427 -7.551 -6.252 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -4.873 -10.984 -6.213 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -4.638 -7.240 -8.325 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -6.541 -11.813 -7.848 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -6.374 -8.032 -9.919 1.00 0.00 H new ATOM 0 HH TYR A 9 -7.701 -9.749 -10.536 1.00 0.00 H new ATOM 104 N GLU A 10 -2.422 -11.629 -6.861 1.00 0.00 N ATOM 105 CA GLU A 10 -2.292 -13.050 -6.546 1.00 0.00 C ATOM 106 C GLU A 10 -0.836 -13.484 -6.576 1.00 0.00 C ATOM 107 O GLU A 10 -0.334 -13.999 -5.583 1.00 0.00 O ATOM 108 CB GLU A 10 -3.132 -13.897 -7.511 1.00 0.00 C ATOM 109 CG GLU A 10 -4.461 -14.251 -6.837 1.00 0.00 C ATOM 110 CD GLU A 10 -5.353 -15.086 -7.750 1.00 0.00 C ATOM 111 OE1 GLU A 10 -4.886 -16.074 -8.355 1.00 0.00 O ATOM 112 OE2 GLU A 10 -6.568 -14.782 -7.795 1.00 0.00 O ATOM 0 H GLU A 10 -2.972 -11.461 -7.703 1.00 0.00 H new ATOM 0 HA GLU A 10 -2.668 -13.208 -5.535 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.313 -13.347 -8.435 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.593 -14.805 -7.781 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -4.267 -14.801 -5.916 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -4.982 -13.335 -6.557 1.00 0.00 H new ATOM 119 N LEU A 11 -0.152 -13.236 -7.693 1.00 0.00 N ATOM 120 CA LEU A 11 1.260 -13.552 -7.852 1.00 0.00 C ATOM 121 C LEU A 11 2.064 -12.943 -6.697 1.00 0.00 C ATOM 122 O LEU A 11 2.871 -13.632 -6.072 1.00 0.00 O ATOM 123 CB LEU A 11 1.688 -13.174 -9.282 1.00 0.00 C ATOM 124 CG LEU A 11 3.185 -13.109 -9.640 1.00 0.00 C ATOM 125 CD1 LEU A 11 3.767 -11.785 -9.185 1.00 0.00 C ATOM 126 CD2 LEU A 11 4.089 -14.201 -9.064 1.00 0.00 C ATOM 0 H LEU A 11 -0.570 -12.806 -8.518 1.00 0.00 H new ATOM 0 HA LEU A 11 1.468 -14.619 -7.770 1.00 0.00 H new ATOM 0 HB2 LEU A 11 1.222 -13.888 -9.961 1.00 0.00 H new ATOM 0 HB3 LEU A 11 1.258 -12.197 -9.503 1.00 0.00 H new ATOM 0 HG LEU A 11 3.182 -13.249 -10.721 1.00 0.00 H new ATOM 0 HD11 LEU A 11 4.826 -11.746 -9.441 1.00 0.00 H new ATOM 0 HD12 LEU A 11 3.243 -10.968 -9.681 1.00 0.00 H new ATOM 0 HD13 LEU A 11 3.651 -11.688 -8.105 1.00 0.00 H new ATOM 0 HD21 LEU A 11 5.115 -14.036 -9.394 1.00 0.00 H new ATOM 0 HD22 LEU A 11 4.049 -14.170 -7.975 1.00 0.00 H new ATOM 0 HD23 LEU A 11 3.749 -15.176 -9.412 1.00 0.00 H new ATOM 138 N TYR A 12 1.809 -11.679 -6.352 1.00 0.00 N ATOM 139 CA TYR A 12 2.468 -11.043 -5.214 1.00 0.00 C ATOM 140 C TYR A 12 2.115 -11.738 -3.895 1.00 0.00 C ATOM 141 O TYR A 12 3.006 -11.932 -3.068 1.00 0.00 O ATOM 142 CB TYR A 12 2.170 -9.535 -5.167 1.00 0.00 C ATOM 143 CG TYR A 12 2.530 -8.733 -6.413 1.00 0.00 C ATOM 144 CD1 TYR A 12 3.568 -9.142 -7.271 1.00 0.00 C ATOM 145 CD2 TYR A 12 1.812 -7.566 -6.727 1.00 0.00 C ATOM 146 CE1 TYR A 12 3.825 -8.474 -8.479 1.00 0.00 C ATOM 147 CE2 TYR A 12 2.111 -6.841 -7.894 1.00 0.00 C ATOM 148 CZ TYR A 12 3.104 -7.297 -8.789 1.00 0.00 C ATOM 149 OH TYR A 12 3.383 -6.556 -9.896 1.00 0.00 O ATOM 0 H TYR A 12 1.150 -11.077 -6.846 1.00 0.00 H new ATOM 0 HA TYR A 12 3.543 -11.155 -5.352 1.00 0.00 H new ATOM 0 HB2 TYR A 12 1.106 -9.403 -4.972 1.00 0.00 H new ATOM 0 HB3 TYR A 12 2.705 -9.107 -4.319 1.00 0.00 H new ATOM 0 HD1 TYR A 12 4.180 -9.988 -6.994 1.00 0.00 H new ATOM 0 HD2 TYR A 12 1.027 -7.225 -6.069 1.00 0.00 H new ATOM 0 HE1 TYR A 12 4.567 -8.855 -9.165 1.00 0.00 H new ATOM 0 HE2 TYR A 12 1.577 -5.927 -8.108 1.00 0.00 H new ATOM 0 HH TYR A 12 2.778 -5.786 -9.935 1.00 0.00 H new ATOM 159 N MET A 13 0.856 -12.147 -3.704 1.00 0.00 N ATOM 160 CA MET A 13 0.333 -12.829 -2.523 1.00 0.00 C ATOM 161 C MET A 13 1.133 -14.079 -2.148 1.00 0.00 C ATOM 162 O MET A 13 1.079 -14.483 -0.984 1.00 0.00 O ATOM 163 CB MET A 13 -1.128 -13.260 -2.782 1.00 0.00 C ATOM 164 CG MET A 13 -2.094 -12.929 -1.644 1.00 0.00 C ATOM 165 SD MET A 13 -2.952 -11.329 -1.774 1.00 0.00 S ATOM 166 CE MET A 13 -4.032 -11.640 -3.210 1.00 0.00 C ATOM 0 H MET A 13 0.136 -12.001 -4.412 1.00 0.00 H new ATOM 0 HA MET A 13 0.406 -12.120 -1.698 1.00 0.00 H new ATOM 0 HB2 MET A 13 -1.480 -12.778 -3.694 1.00 0.00 H new ATOM 0 HB3 MET A 13 -1.151 -14.335 -2.961 1.00 0.00 H new ATOM 0 HG2 MET A 13 -2.844 -13.718 -1.588 1.00 0.00 H new ATOM 0 HG3 MET A 13 -1.540 -12.948 -0.705 1.00 0.00 H new ATOM 0 HE1 MET A 13 -3.799 -10.928 -4.002 1.00 0.00 H new ATOM 0 HE2 MET A 13 -3.870 -12.654 -3.574 1.00 0.00 H new ATOM 0 HE3 MET A 13 -5.074 -11.524 -2.913 1.00 0.00 H new ATOM 176 N TYR A 14 1.801 -14.719 -3.112 1.00 0.00 N ATOM 177 CA TYR A 14 2.523 -15.972 -2.910 1.00 0.00 C ATOM 178 C TYR A 14 3.999 -15.769 -2.590 1.00 0.00 C ATOM 179 O TYR A 14 4.644 -16.695 -2.092 1.00 0.00 O ATOM 180 CB TYR A 14 2.460 -16.814 -4.187 1.00 0.00 C ATOM 181 CG TYR A 14 1.087 -16.964 -4.801 1.00 0.00 C ATOM 182 CD1 TYR A 14 -0.007 -17.352 -4.003 1.00 0.00 C ATOM 183 CD2 TYR A 14 0.911 -16.698 -6.173 1.00 0.00 C ATOM 184 CE1 TYR A 14 -1.286 -17.465 -4.571 1.00 0.00 C ATOM 185 CE2 TYR A 14 -0.364 -16.853 -6.753 1.00 0.00 C ATOM 186 CZ TYR A 14 -1.465 -17.241 -5.954 1.00 0.00 C ATOM 187 OH TYR A 14 -2.691 -17.408 -6.517 1.00 0.00 O ATOM 0 H TYR A 14 1.854 -14.373 -4.070 1.00 0.00 H new ATOM 0 HA TYR A 14 2.042 -16.462 -2.063 1.00 0.00 H new ATOM 0 HB2 TYR A 14 3.123 -16.368 -4.928 1.00 0.00 H new ATOM 0 HB3 TYR A 14 2.850 -17.807 -3.966 1.00 0.00 H new ATOM 0 HD1 TYR A 14 0.138 -17.563 -2.954 1.00 0.00 H new ATOM 0 HD2 TYR A 14 1.747 -16.377 -6.776 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -2.132 -17.723 -3.951 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -0.501 -16.675 -7.809 1.00 0.00 H new ATOM 0 HH TYR A 14 -2.640 -17.212 -7.476 1.00 0.00 H new ATOM 197 N ARG A 15 4.553 -14.606 -2.931 1.00 0.00 N ATOM 198 CA ARG A 15 5.991 -14.408 -3.065 1.00 0.00 C ATOM 199 C ARG A 15 6.415 -13.248 -2.178 1.00 0.00 C ATOM 200 O ARG A 15 5.777 -13.022 -1.154 1.00 0.00 O ATOM 201 CB ARG A 15 6.343 -14.304 -4.570 1.00 0.00 C ATOM 202 CG ARG A 15 7.166 -15.507 -5.056 1.00 0.00 C ATOM 203 CD ARG A 15 8.504 -15.610 -4.312 1.00 0.00 C ATOM 204 NE ARG A 15 9.496 -16.381 -5.066 1.00 0.00 N ATOM 205 CZ ARG A 15 10.814 -16.260 -4.899 1.00 0.00 C ATOM 206 NH1 ARG A 15 11.318 -15.614 -3.855 1.00 0.00 N ATOM 207 NH2 ARG A 15 11.658 -16.759 -5.785 1.00 0.00 N ATOM 0 H ARG A 15 4.007 -13.766 -3.124 1.00 0.00 H new ATOM 0 HA ARG A 15 6.576 -15.254 -2.704 1.00 0.00 H new ATOM 0 HB2 ARG A 15 5.424 -14.235 -5.153 1.00 0.00 H new ATOM 0 HB3 ARG A 15 6.903 -13.386 -4.748 1.00 0.00 H new ATOM 0 HG2 ARG A 15 6.595 -16.424 -4.908 1.00 0.00 H new ATOM 0 HG3 ARG A 15 7.350 -15.415 -6.126 1.00 0.00 H new ATOM 0 HD2 ARG A 15 8.891 -14.609 -4.123 1.00 0.00 H new ATOM 0 HD3 ARG A 15 8.343 -16.078 -3.341 1.00 0.00 H new ATOM 0 HE ARG A 15 9.159 -17.049 -5.759 1.00 0.00 H new ATOM 0 HH11 ARG A 15 10.695 -15.199 -3.162 1.00 0.00 H new ATOM 0 HH12 ARG A 15 12.329 -15.532 -3.745 1.00 0.00 H new ATOM 0 HH21 ARG A 15 11.304 -17.244 -6.610 1.00 0.00 H new ATOM 0 HH22 ARG A 15 12.663 -16.659 -5.644 1.00 0.00 H new ATOM 221 N GLU A 16 7.523 -12.576 -2.476 1.00 0.00 N ATOM 222 CA GLU A 16 8.017 -11.442 -1.707 1.00 0.00 C ATOM 223 C GLU A 16 8.361 -10.313 -2.661 1.00 0.00 C ATOM 224 O GLU A 16 8.363 -10.496 -3.881 1.00 0.00 O ATOM 225 CB GLU A 16 9.230 -11.846 -0.847 1.00 0.00 C ATOM 226 CG GLU A 16 8.819 -12.843 0.239 1.00 0.00 C ATOM 227 CD GLU A 16 9.928 -13.164 1.233 1.00 0.00 C ATOM 228 OE1 GLU A 16 10.975 -13.698 0.800 1.00 0.00 O ATOM 229 OE2 GLU A 16 9.696 -12.985 2.454 1.00 0.00 O ATOM 0 H GLU A 16 8.113 -12.810 -3.274 1.00 0.00 H new ATOM 0 HA GLU A 16 7.242 -11.101 -1.020 1.00 0.00 H new ATOM 0 HB2 GLU A 16 9.999 -12.288 -1.480 1.00 0.00 H new ATOM 0 HB3 GLU A 16 9.666 -10.960 -0.387 1.00 0.00 H new ATOM 0 HG2 GLU A 16 7.963 -12.442 0.782 1.00 0.00 H new ATOM 0 HG3 GLU A 16 8.491 -13.768 -0.236 1.00 0.00 H new ATOM 236 N VAL A 17 8.643 -9.145 -2.104 1.00 0.00 N ATOM 237 CA VAL A 17 9.080 -7.968 -2.836 1.00 0.00 C ATOM 238 C VAL A 17 10.063 -7.199 -1.946 1.00 0.00 C ATOM 239 O VAL A 17 10.059 -7.370 -0.721 1.00 0.00 O ATOM 240 CB VAL A 17 7.837 -7.152 -3.279 1.00 0.00 C ATOM 241 CG1 VAL A 17 6.934 -6.784 -2.093 1.00 0.00 C ATOM 242 CG2 VAL A 17 8.182 -5.879 -4.061 1.00 0.00 C ATOM 0 H VAL A 17 8.572 -8.986 -1.099 1.00 0.00 H new ATOM 0 HA VAL A 17 9.610 -8.219 -3.755 1.00 0.00 H new ATOM 0 HB VAL A 17 7.299 -7.820 -3.952 1.00 0.00 H new ATOM 0 HG11 VAL A 17 6.077 -6.214 -2.451 1.00 0.00 H new ATOM 0 HG12 VAL A 17 6.586 -7.694 -1.605 1.00 0.00 H new ATOM 0 HG13 VAL A 17 7.497 -6.183 -1.380 1.00 0.00 H new ATOM 0 HG21 VAL A 17 7.263 -5.361 -4.337 1.00 0.00 H new ATOM 0 HG22 VAL A 17 8.794 -5.225 -3.440 1.00 0.00 H new ATOM 0 HG23 VAL A 17 8.734 -6.144 -4.963 1.00 0.00 H new ATOM 252 N ASP A 18 10.894 -6.345 -2.542 1.00 0.00 N ATOM 253 CA ASP A 18 11.687 -5.349 -1.830 1.00 0.00 C ATOM 254 C ASP A 18 10.740 -4.245 -1.402 1.00 0.00 C ATOM 255 O ASP A 18 10.491 -3.326 -2.180 1.00 0.00 O ATOM 256 CB ASP A 18 12.790 -4.735 -2.718 1.00 0.00 C ATOM 257 CG ASP A 18 14.121 -5.453 -2.582 1.00 0.00 C ATOM 258 OD1 ASP A 18 14.134 -6.695 -2.438 1.00 0.00 O ATOM 259 OD2 ASP A 18 15.168 -4.777 -2.595 1.00 0.00 O ATOM 0 H ASP A 18 11.036 -6.327 -3.552 1.00 0.00 H new ATOM 0 HA ASP A 18 12.178 -5.829 -0.984 1.00 0.00 H new ATOM 0 HB2 ASP A 18 12.471 -4.765 -3.760 1.00 0.00 H new ATOM 0 HB3 ASP A 18 12.920 -3.685 -2.455 1.00 0.00 H new ATOM 264 N THR A 19 10.214 -4.286 -0.178 1.00 0.00 N ATOM 265 CA THR A 19 9.325 -3.222 0.277 1.00 0.00 C ATOM 266 C THR A 19 10.045 -1.860 0.316 1.00 0.00 C ATOM 267 O THR A 19 9.378 -0.826 0.305 1.00 0.00 O ATOM 268 CB THR A 19 8.672 -3.598 1.618 1.00 0.00 C ATOM 269 OG1 THR A 19 9.630 -4.005 2.575 1.00 0.00 O ATOM 270 CG2 THR A 19 7.667 -4.741 1.435 1.00 0.00 C ATOM 0 H THR A 19 10.384 -5.027 0.502 1.00 0.00 H new ATOM 0 HA THR A 19 8.518 -3.111 -0.447 1.00 0.00 H new ATOM 0 HB THR A 19 8.165 -2.702 1.975 1.00 0.00 H new ATOM 0 HG1 THR A 19 9.263 -3.886 3.476 1.00 0.00 H new ATOM 0 HG21 THR A 19 7.219 -4.989 2.397 1.00 0.00 H new ATOM 0 HG22 THR A 19 6.887 -4.431 0.740 1.00 0.00 H new ATOM 0 HG23 THR A 19 8.180 -5.617 1.038 1.00 0.00 H new ATOM 278 N LEU A 20 11.385 -1.832 0.321 1.00 0.00 N ATOM 279 CA LEU A 20 12.188 -0.623 0.407 1.00 0.00 C ATOM 280 C LEU A 20 12.484 -0.023 -0.960 1.00 0.00 C ATOM 281 O LEU A 20 12.365 1.190 -1.109 1.00 0.00 O ATOM 282 CB LEU A 20 13.504 -0.948 1.121 1.00 0.00 C ATOM 283 CG LEU A 20 13.477 -0.769 2.645 1.00 0.00 C ATOM 284 CD1 LEU A 20 13.221 0.680 3.079 1.00 0.00 C ATOM 285 CD2 LEU A 20 12.528 -1.745 3.345 1.00 0.00 C ATOM 0 H LEU A 20 11.949 -2.680 0.263 1.00 0.00 H new ATOM 0 HA LEU A 20 11.617 0.117 0.967 1.00 0.00 H new ATOM 0 HB2 LEU A 20 13.777 -1.979 0.896 1.00 0.00 H new ATOM 0 HB3 LEU A 20 14.289 -0.314 0.710 1.00 0.00 H new ATOM 0 HG LEU A 20 14.485 -1.018 2.976 1.00 0.00 H new ATOM 0 HD11 LEU A 20 13.214 0.738 4.167 1.00 0.00 H new ATOM 0 HD12 LEU A 20 14.009 1.322 2.686 1.00 0.00 H new ATOM 0 HD13 LEU A 20 12.257 1.011 2.692 1.00 0.00 H new ATOM 0 HD21 LEU A 20 12.553 -1.569 4.420 1.00 0.00 H new ATOM 0 HD22 LEU A 20 11.514 -1.594 2.976 1.00 0.00 H new ATOM 0 HD23 LEU A 20 12.841 -2.768 3.138 1.00 0.00 H new ATOM 297 N GLU A 21 12.858 -0.837 -1.952 1.00 0.00 N ATOM 298 CA GLU A 21 12.948 -0.337 -3.321 1.00 0.00 C ATOM 299 C GLU A 21 11.552 0.107 -3.757 1.00 0.00 C ATOM 300 O GLU A 21 11.406 1.130 -4.422 1.00 0.00 O ATOM 301 CB GLU A 21 13.492 -1.423 -4.268 1.00 0.00 C ATOM 302 CG GLU A 21 13.476 -0.950 -5.721 1.00 0.00 C ATOM 303 CD GLU A 21 13.976 -1.976 -6.730 1.00 0.00 C ATOM 304 OE1 GLU A 21 13.140 -2.734 -7.259 1.00 0.00 O ATOM 305 OE2 GLU A 21 15.147 -1.869 -7.176 1.00 0.00 O ATOM 0 H GLU A 21 13.098 -1.822 -1.835 1.00 0.00 H new ATOM 0 HA GLU A 21 13.639 0.505 -3.363 1.00 0.00 H new ATOM 0 HB2 GLU A 21 14.510 -1.684 -3.979 1.00 0.00 H new ATOM 0 HB3 GLU A 21 12.892 -2.327 -4.171 1.00 0.00 H new ATOM 0 HG2 GLU A 21 12.457 -0.667 -5.986 1.00 0.00 H new ATOM 0 HG3 GLU A 21 14.088 -0.052 -5.803 1.00 0.00 H new ATOM 312 N LEU A 22 10.519 -0.633 -3.346 1.00 0.00 N ATOM 313 CA LEU A 22 9.141 -0.292 -3.620 1.00 0.00 C ATOM 314 C LEU A 22 8.809 1.106 -3.100 1.00 0.00 C ATOM 315 O LEU A 22 8.350 1.918 -3.894 1.00 0.00 O ATOM 316 CB LEU A 22 8.237 -1.384 -3.050 1.00 0.00 C ATOM 317 CG LEU A 22 6.733 -1.134 -3.188 1.00 0.00 C ATOM 318 CD1 LEU A 22 6.296 -0.998 -4.637 1.00 0.00 C ATOM 319 CD2 LEU A 22 5.989 -2.300 -2.531 1.00 0.00 C ATOM 0 H LEU A 22 10.628 -1.493 -2.809 1.00 0.00 H new ATOM 0 HA LEU A 22 8.969 -0.249 -4.696 1.00 0.00 H new ATOM 0 HB2 LEU A 22 8.478 -2.325 -3.544 1.00 0.00 H new ATOM 0 HB3 LEU A 22 8.471 -1.510 -1.993 1.00 0.00 H new ATOM 0 HG LEU A 22 6.497 -0.190 -2.697 1.00 0.00 H new ATOM 0 HD11 LEU A 22 5.221 -0.822 -4.678 1.00 0.00 H new ATOM 0 HD12 LEU A 22 6.819 -0.160 -5.098 1.00 0.00 H new ATOM 0 HD13 LEU A 22 6.534 -1.915 -5.176 1.00 0.00 H new ATOM 0 HD21 LEU A 22 4.914 -2.141 -2.618 1.00 0.00 H new ATOM 0 HD22 LEU A 22 6.260 -3.231 -3.029 1.00 0.00 H new ATOM 0 HD23 LEU A 22 6.263 -2.359 -1.478 1.00 0.00 H new ATOM 331 N THR A 23 9.038 1.443 -1.820 1.00 0.00 N ATOM 332 CA THR A 23 8.766 2.810 -1.372 1.00 0.00 C ATOM 333 C THR A 23 9.603 3.795 -2.190 1.00 0.00 C ATOM 334 O THR A 23 9.093 4.841 -2.575 1.00 0.00 O ATOM 335 CB THR A 23 9.041 2.990 0.128 1.00 0.00 C ATOM 336 OG1 THR A 23 10.311 2.475 0.448 1.00 0.00 O ATOM 337 CG2 THR A 23 8.004 2.244 0.954 1.00 0.00 C ATOM 0 H THR A 23 9.397 0.812 -1.104 1.00 0.00 H new ATOM 0 HA THR A 23 7.706 3.011 -1.530 1.00 0.00 H new ATOM 0 HB THR A 23 8.995 4.055 0.354 1.00 0.00 H new ATOM 0 HG1 THR A 23 10.700 2.049 -0.344 1.00 0.00 H new ATOM 0 HG21 THR A 23 8.215 2.383 2.014 1.00 0.00 H new ATOM 0 HG22 THR A 23 7.011 2.632 0.728 1.00 0.00 H new ATOM 0 HG23 THR A 23 8.042 1.182 0.713 1.00 0.00 H new ATOM 345 N ARG A 24 10.872 3.475 -2.449 1.00 0.00 N ATOM 346 CA ARG A 24 11.786 4.278 -3.280 1.00 0.00 C ATOM 347 C ARG A 24 11.128 4.678 -4.606 1.00 0.00 C ATOM 348 O ARG A 24 10.958 5.873 -4.856 1.00 0.00 O ATOM 349 CB ARG A 24 13.121 3.546 -3.526 1.00 0.00 C ATOM 350 CG ARG A 24 14.340 4.468 -3.391 1.00 0.00 C ATOM 351 CD ARG A 24 15.018 4.236 -2.037 1.00 0.00 C ATOM 352 NE ARG A 24 16.186 5.125 -1.860 1.00 0.00 N ATOM 353 CZ ARG A 24 17.475 4.774 -2.012 1.00 0.00 C ATOM 354 NH1 ARG A 24 17.816 3.514 -2.254 1.00 0.00 N ATOM 355 NH2 ARG A 24 18.437 5.686 -1.927 1.00 0.00 N ATOM 0 H ARG A 24 11.308 2.630 -2.080 1.00 0.00 H new ATOM 0 HA ARG A 24 12.007 5.191 -2.726 1.00 0.00 H new ATOM 0 HB2 ARG A 24 13.214 2.723 -2.818 1.00 0.00 H new ATOM 0 HB3 ARG A 24 13.111 3.108 -4.524 1.00 0.00 H new ATOM 0 HG2 ARG A 24 15.045 4.274 -4.199 1.00 0.00 H new ATOM 0 HG3 ARG A 24 14.031 5.510 -3.480 1.00 0.00 H new ATOM 0 HD2 ARG A 24 14.301 4.410 -1.235 1.00 0.00 H new ATOM 0 HD3 ARG A 24 15.335 3.196 -1.961 1.00 0.00 H new ATOM 0 HE ARG A 24 15.997 6.093 -1.599 1.00 0.00 H new ATOM 0 HH11 ARG A 24 17.096 2.796 -2.327 1.00 0.00 H new ATOM 0 HH12 ARG A 24 18.798 3.264 -2.367 1.00 0.00 H new ATOM 0 HH21 ARG A 24 18.200 6.661 -1.745 1.00 0.00 H new ATOM 0 HH22 ARG A 24 19.412 5.411 -2.044 1.00 0.00 H new ATOM 369 N GLN A 25 10.743 3.693 -5.420 1.00 0.00 N ATOM 370 CA GLN A 25 10.147 3.860 -6.743 1.00 0.00 C ATOM 371 C GLN A 25 8.860 4.681 -6.652 1.00 0.00 C ATOM 372 O GLN A 25 8.597 5.523 -7.512 1.00 0.00 O ATOM 373 CB GLN A 25 9.837 2.472 -7.333 1.00 0.00 C ATOM 374 CG GLN A 25 11.077 1.704 -7.808 1.00 0.00 C ATOM 375 CD GLN A 25 11.422 1.977 -9.272 1.00 0.00 C ATOM 376 OE1 GLN A 25 11.490 3.121 -9.721 1.00 0.00 O ATOM 377 NE2 GLN A 25 11.654 0.948 -10.067 1.00 0.00 N ATOM 0 H GLN A 25 10.844 2.712 -5.160 1.00 0.00 H new ATOM 0 HA GLN A 25 10.849 4.390 -7.387 1.00 0.00 H new ATOM 0 HB2 GLN A 25 9.320 1.876 -6.581 1.00 0.00 H new ATOM 0 HB3 GLN A 25 9.152 2.590 -8.173 1.00 0.00 H new ATOM 0 HG2 GLN A 25 11.928 1.976 -7.183 1.00 0.00 H new ATOM 0 HG3 GLN A 25 10.910 0.635 -7.673 1.00 0.00 H new ATOM 0 HE21 GLN A 25 11.599 -0.002 -9.700 1.00 0.00 H new ATOM 0 HE22 GLN A 25 11.888 1.104 -11.047 1.00 0.00 H new ATOM 386 N VAL A 26 8.057 4.431 -5.618 1.00 0.00 N ATOM 387 CA VAL A 26 6.786 5.091 -5.356 1.00 0.00 C ATOM 388 C VAL A 26 7.039 6.577 -5.088 1.00 0.00 C ATOM 389 O VAL A 26 6.466 7.425 -5.774 1.00 0.00 O ATOM 390 CB VAL A 26 6.107 4.352 -4.183 1.00 0.00 C ATOM 391 CG1 VAL A 26 4.895 5.081 -3.601 1.00 0.00 C ATOM 392 CG2 VAL A 26 5.685 2.948 -4.636 1.00 0.00 C ATOM 0 H VAL A 26 8.288 3.732 -4.912 1.00 0.00 H new ATOM 0 HA VAL A 26 6.109 5.047 -6.210 1.00 0.00 H new ATOM 0 HB VAL A 26 6.849 4.304 -3.386 1.00 0.00 H new ATOM 0 HG11 VAL A 26 4.477 4.495 -2.782 1.00 0.00 H new ATOM 0 HG12 VAL A 26 5.203 6.058 -3.228 1.00 0.00 H new ATOM 0 HG13 VAL A 26 4.141 5.210 -4.377 1.00 0.00 H new ATOM 0 HG21 VAL A 26 5.206 2.427 -3.807 1.00 0.00 H new ATOM 0 HG22 VAL A 26 4.985 3.029 -5.467 1.00 0.00 H new ATOM 0 HG23 VAL A 26 6.565 2.389 -4.956 1.00 0.00 H new ATOM 402 N LYS A 27 7.919 6.901 -4.131 1.00 0.00 N ATOM 403 CA LYS A 27 8.285 8.267 -3.775 1.00 0.00 C ATOM 404 C LYS A 27 8.746 9.044 -5.005 1.00 0.00 C ATOM 405 O LYS A 27 8.347 10.203 -5.154 1.00 0.00 O ATOM 406 CB LYS A 27 9.370 8.232 -2.683 1.00 0.00 C ATOM 407 CG LYS A 27 8.793 7.814 -1.323 1.00 0.00 C ATOM 408 CD LYS A 27 9.852 7.603 -0.231 1.00 0.00 C ATOM 409 CE LYS A 27 10.669 6.318 -0.377 1.00 0.00 C ATOM 410 NZ LYS A 27 11.441 6.003 0.844 1.00 0.00 N ATOM 0 H LYS A 27 8.405 6.199 -3.573 1.00 0.00 H new ATOM 0 HA LYS A 27 7.412 8.787 -3.381 1.00 0.00 H new ATOM 0 HB2 LYS A 27 10.157 7.536 -2.974 1.00 0.00 H new ATOM 0 HB3 LYS A 27 9.831 9.216 -2.596 1.00 0.00 H new ATOM 0 HG2 LYS A 27 8.089 8.576 -0.989 1.00 0.00 H new ATOM 0 HG3 LYS A 27 8.227 6.891 -1.449 1.00 0.00 H new ATOM 0 HD2 LYS A 27 10.533 8.454 -0.235 1.00 0.00 H new ATOM 0 HD3 LYS A 27 9.357 7.595 0.740 1.00 0.00 H new ATOM 0 HE2 LYS A 27 10.000 5.488 -0.605 1.00 0.00 H new ATOM 0 HE3 LYS A 27 11.352 6.418 -1.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 12.030 5.163 0.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 12.050 6.810 1.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 10.786 5.814 1.630 1.00 0.00 H new ATOM 424 N GLU A 28 9.522 8.410 -5.889 1.00 0.00 N ATOM 425 CA GLU A 28 9.947 9.015 -7.148 1.00 0.00 C ATOM 426 C GLU A 28 8.745 9.281 -8.053 1.00 0.00 C ATOM 427 O GLU A 28 8.533 10.427 -8.432 1.00 0.00 O ATOM 428 CB GLU A 28 11.005 8.158 -7.860 1.00 0.00 C ATOM 429 CG GLU A 28 12.301 8.144 -7.044 1.00 0.00 C ATOM 430 CD GLU A 28 13.464 7.392 -7.678 1.00 0.00 C ATOM 431 OE1 GLU A 28 13.267 6.407 -8.428 1.00 0.00 O ATOM 432 OE2 GLU A 28 14.617 7.713 -7.312 1.00 0.00 O ATOM 0 H GLU A 28 9.872 7.462 -5.749 1.00 0.00 H new ATOM 0 HA GLU A 28 10.414 9.972 -6.916 1.00 0.00 H new ATOM 0 HB2 GLU A 28 10.635 7.141 -7.988 1.00 0.00 H new ATOM 0 HB3 GLU A 28 11.197 8.556 -8.857 1.00 0.00 H new ATOM 0 HG2 GLU A 28 12.610 9.174 -6.867 1.00 0.00 H new ATOM 0 HG3 GLU A 28 12.092 7.702 -6.070 1.00 0.00 H new ATOM 439 N LYS A 29 7.927 8.273 -8.383 1.00 0.00 N ATOM 440 CA LYS A 29 6.806 8.458 -9.313 1.00 0.00 C ATOM 441 C LYS A 29 5.807 9.507 -8.822 1.00 0.00 C ATOM 442 O LYS A 29 5.156 10.162 -9.635 1.00 0.00 O ATOM 443 CB LYS A 29 6.109 7.151 -9.606 1.00 0.00 C ATOM 444 CG LYS A 29 5.339 7.263 -10.937 1.00 0.00 C ATOM 445 CD LYS A 29 4.959 5.849 -11.323 1.00 0.00 C ATOM 446 CE LYS A 29 3.948 5.766 -12.467 1.00 0.00 C ATOM 447 NZ LYS A 29 4.584 5.861 -13.796 1.00 0.00 N ATOM 0 H LYS A 29 8.020 7.324 -8.021 1.00 0.00 H new ATOM 0 HA LYS A 29 7.235 8.832 -10.243 1.00 0.00 H new ATOM 0 HB2 LYS A 29 6.838 6.343 -9.663 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.422 6.904 -8.796 1.00 0.00 H new ATOM 0 HG2 LYS A 29 4.453 7.887 -10.823 1.00 0.00 H new ATOM 0 HG3 LYS A 29 5.957 7.724 -11.707 1.00 0.00 H new ATOM 0 HD2 LYS A 29 5.860 5.307 -11.609 1.00 0.00 H new ATOM 0 HD3 LYS A 29 4.546 5.344 -10.450 1.00 0.00 H new ATOM 0 HE2 LYS A 29 3.402 4.825 -12.396 1.00 0.00 H new ATOM 0 HE3 LYS A 29 3.217 6.568 -12.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 3.855 5.799 -14.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 5.084 6.769 -13.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 5.262 5.081 -13.913 1.00 0.00 H new ATOM 461 N LEU A 30 5.647 9.652 -7.507 1.00 0.00 N ATOM 462 CA LEU A 30 4.868 10.723 -6.908 1.00 0.00 C ATOM 463 C LEU A 30 5.549 12.056 -7.200 1.00 0.00 C ATOM 464 O LEU A 30 4.928 12.920 -7.817 1.00 0.00 O ATOM 465 CB LEU A 30 4.704 10.491 -5.398 1.00 0.00 C ATOM 466 CG LEU A 30 3.740 9.339 -5.058 1.00 0.00 C ATOM 467 CD1 LEU A 30 3.884 8.979 -3.581 1.00 0.00 C ATOM 468 CD2 LEU A 30 2.279 9.722 -5.331 1.00 0.00 C ATOM 0 H LEU A 30 6.062 9.019 -6.824 1.00 0.00 H new ATOM 0 HA LEU A 30 3.868 10.739 -7.341 1.00 0.00 H new ATOM 0 HB2 LEU A 30 5.680 10.279 -4.962 1.00 0.00 H new ATOM 0 HB3 LEU A 30 4.341 11.408 -4.934 1.00 0.00 H new ATOM 0 HG LEU A 30 3.998 8.490 -5.691 1.00 0.00 H new ATOM 0 HD11 LEU A 30 3.203 8.164 -3.337 1.00 0.00 H new ATOM 0 HD12 LEU A 30 4.909 8.668 -3.381 1.00 0.00 H new ATOM 0 HD13 LEU A 30 3.643 9.848 -2.969 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.630 8.883 -5.079 1.00 0.00 H new ATOM 0 HD22 LEU A 30 2.009 10.585 -4.723 1.00 0.00 H new ATOM 0 HD23 LEU A 30 2.159 9.970 -6.386 1.00 0.00 H new ATOM 480 N ALA A 31 6.817 12.214 -6.802 1.00 0.00 N ATOM 481 CA ALA A 31 7.611 13.427 -6.998 1.00 0.00 C ATOM 482 C ALA A 31 7.748 13.824 -8.477 1.00 0.00 C ATOM 483 O ALA A 31 7.859 15.008 -8.800 1.00 0.00 O ATOM 484 CB ALA A 31 8.992 13.219 -6.370 1.00 0.00 C ATOM 0 H ALA A 31 7.332 11.477 -6.320 1.00 0.00 H new ATOM 0 HA ALA A 31 7.089 14.251 -6.511 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.594 14.117 -6.509 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.881 13.019 -5.304 1.00 0.00 H new ATOM 0 HB3 ALA A 31 9.486 12.373 -6.849 1.00 0.00 H new ATOM 490 N LYS A 32 7.661 12.856 -9.395 1.00 0.00 N ATOM 491 CA LYS A 32 7.696 13.051 -10.841 1.00 0.00 C ATOM 492 C LYS A 32 6.697 14.117 -11.277 1.00 0.00 C ATOM 493 O LYS A 32 6.988 14.857 -12.218 1.00 0.00 O ATOM 494 CB LYS A 32 7.396 11.716 -11.550 1.00 0.00 C ATOM 495 CG LYS A 32 8.132 11.570 -12.888 1.00 0.00 C ATOM 496 CD LYS A 32 7.601 10.389 -13.723 1.00 0.00 C ATOM 497 CE LYS A 32 6.674 10.876 -14.848 1.00 0.00 C ATOM 498 NZ LYS A 32 7.424 11.323 -16.041 1.00 0.00 N ATOM 0 H LYS A 32 7.560 11.875 -9.136 1.00 0.00 H new ATOM 0 HA LYS A 32 8.692 13.394 -11.120 1.00 0.00 H new ATOM 0 HB2 LYS A 32 7.677 10.892 -10.895 1.00 0.00 H new ATOM 0 HB3 LYS A 32 6.323 11.635 -11.721 1.00 0.00 H new ATOM 0 HG2 LYS A 32 8.028 12.492 -13.460 1.00 0.00 H new ATOM 0 HG3 LYS A 32 9.197 11.430 -12.701 1.00 0.00 H new ATOM 0 HD2 LYS A 32 8.438 9.838 -14.151 1.00 0.00 H new ATOM 0 HD3 LYS A 32 7.061 9.697 -13.077 1.00 0.00 H new ATOM 0 HE2 LYS A 32 5.995 10.071 -15.129 1.00 0.00 H new ATOM 0 HE3 LYS A 32 6.060 11.697 -14.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 6.756 11.642 -16.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 8.054 12.109 -15.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 7.991 10.533 -16.411 1.00 0.00 H new ATOM 512 N ASN A 33 5.535 14.168 -10.620 1.00 0.00 N ATOM 513 CA ASN A 33 4.437 15.093 -10.875 1.00 0.00 C ATOM 514 C ASN A 33 4.029 15.837 -9.593 1.00 0.00 C ATOM 515 O ASN A 33 2.959 16.441 -9.553 1.00 0.00 O ATOM 516 CB ASN A 33 3.255 14.298 -11.456 1.00 0.00 C ATOM 517 CG ASN A 33 3.549 13.715 -12.828 1.00 0.00 C ATOM 518 OD1 ASN A 33 3.903 14.428 -13.766 1.00 0.00 O ATOM 519 ND2 ASN A 33 3.430 12.411 -12.991 1.00 0.00 N ATOM 0 H ASN A 33 5.328 13.527 -9.854 1.00 0.00 H new ATOM 0 HA ASN A 33 4.756 15.850 -11.591 1.00 0.00 H new ATOM 0 HB2 ASN A 33 2.996 13.490 -10.772 1.00 0.00 H new ATOM 0 HB3 ASN A 33 2.384 14.950 -11.523 1.00 0.00 H new ATOM 0 HD21 ASN A 33 3.632 11.990 -13.898 1.00 0.00 H new ATOM 0 HD22 ASN A 33 3.136 11.824 -12.210 1.00 0.00 H new ATOM 526 N GLY A 34 4.836 15.748 -8.528 1.00 0.00 N ATOM 527 CA GLY A 34 4.530 16.204 -7.176 1.00 0.00 C ATOM 528 C GLY A 34 3.101 15.864 -6.755 1.00 0.00 C ATOM 529 O GLY A 34 2.323 16.770 -6.455 1.00 0.00 O ATOM 0 H GLY A 34 5.766 15.334 -8.595 1.00 0.00 H new ATOM 0 HA2 GLY A 34 5.230 15.749 -6.475 1.00 0.00 H new ATOM 0 HA3 GLY A 34 4.676 17.283 -7.118 1.00 0.00 H new ATOM 533 N ILE A 35 2.714 14.589 -6.790 1.00 0.00 N ATOM 534 CA ILE A 35 1.377 14.158 -6.379 1.00 0.00 C ATOM 535 C ILE A 35 1.285 14.233 -4.849 1.00 0.00 C ATOM 536 O ILE A 35 2.225 13.857 -4.145 1.00 0.00 O ATOM 537 CB ILE A 35 1.071 12.758 -6.958 1.00 0.00 C ATOM 538 CG1 ILE A 35 0.886 12.905 -8.485 1.00 0.00 C ATOM 539 CG2 ILE A 35 -0.178 12.099 -6.336 1.00 0.00 C ATOM 540 CD1 ILE A 35 0.794 11.580 -9.239 1.00 0.00 C ATOM 0 H ILE A 35 3.316 13.827 -7.103 1.00 0.00 H new ATOM 0 HA ILE A 35 0.608 14.818 -6.780 1.00 0.00 H new ATOM 0 HB ILE A 35 1.907 12.102 -6.717 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -0.019 13.481 -8.675 1.00 0.00 H new ATOM 0 HG13 ILE A 35 1.720 13.480 -8.886 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -0.335 11.119 -6.787 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -0.032 11.985 -5.262 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -1.050 12.727 -6.519 1.00 0.00 H new ATOM 0 HD11 ILE A 35 0.665 11.775 -10.304 1.00 0.00 H new ATOM 0 HD12 ILE A 35 1.709 11.008 -9.083 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -0.058 11.009 -8.869 1.00 0.00 H new ATOM 552 N CYS A 36 0.128 14.674 -4.340 1.00 0.00 N ATOM 553 CA CYS A 36 -0.177 14.676 -2.915 1.00 0.00 C ATOM 554 C CYS A 36 -0.187 13.243 -2.376 1.00 0.00 C ATOM 555 O CYS A 36 -1.155 12.509 -2.595 1.00 0.00 O ATOM 556 CB CYS A 36 -1.534 15.344 -2.643 1.00 0.00 C ATOM 557 SG CYS A 36 -1.350 17.137 -2.426 1.00 0.00 S ATOM 0 H CYS A 36 -0.627 15.043 -4.918 1.00 0.00 H new ATOM 0 HA CYS A 36 0.597 15.248 -2.404 1.00 0.00 H new ATOM 0 HB2 CYS A 36 -2.214 15.143 -3.471 1.00 0.00 H new ATOM 0 HB3 CYS A 36 -1.983 14.911 -1.749 1.00 0.00 H new ATOM 0 HG CYS A 36 -2.515 17.669 -2.201 1.00 0.00 H new ATOM 563 N GLN A 37 0.846 12.879 -1.611 1.00 0.00 N ATOM 564 CA GLN A 37 0.955 11.618 -0.882 1.00 0.00 C ATOM 565 C GLN A 37 -0.323 11.333 -0.087 1.00 0.00 C ATOM 566 O GLN A 37 -0.791 10.199 -0.085 1.00 0.00 O ATOM 567 CB GLN A 37 2.153 11.650 0.083 1.00 0.00 C ATOM 568 CG GLN A 37 3.517 11.394 -0.577 1.00 0.00 C ATOM 569 CD GLN A 37 4.678 11.506 0.413 1.00 0.00 C ATOM 570 OE1 GLN A 37 4.512 11.336 1.617 1.00 0.00 O ATOM 571 NE2 GLN A 37 5.890 11.742 -0.045 1.00 0.00 N ATOM 0 H GLN A 37 1.660 13.480 -1.479 1.00 0.00 H new ATOM 0 HA GLN A 37 1.103 10.826 -1.616 1.00 0.00 H new ATOM 0 HB2 GLN A 37 2.180 12.622 0.575 1.00 0.00 H new ATOM 0 HB3 GLN A 37 1.995 10.903 0.861 1.00 0.00 H new ATOM 0 HG2 GLN A 37 3.520 10.400 -1.024 1.00 0.00 H new ATOM 0 HG3 GLN A 37 3.665 12.108 -1.387 1.00 0.00 H new ATOM 0 HE21 GLN A 37 6.039 11.885 -1.044 1.00 0.00 H new ATOM 0 HE22 GLN A 37 6.680 11.782 0.599 1.00 0.00 H new ATOM 580 N ARG A 38 -0.911 12.347 0.563 1.00 0.00 N ATOM 581 CA ARG A 38 -2.128 12.176 1.355 1.00 0.00 C ATOM 582 C ARG A 38 -3.294 11.667 0.513 1.00 0.00 C ATOM 583 O ARG A 38 -4.044 10.816 0.980 1.00 0.00 O ATOM 584 CB ARG A 38 -2.483 13.503 2.049 1.00 0.00 C ATOM 585 CG ARG A 38 -3.666 13.407 3.016 1.00 0.00 C ATOM 586 CD ARG A 38 -4.996 13.802 2.376 1.00 0.00 C ATOM 587 NE ARG A 38 -5.004 15.213 1.955 1.00 0.00 N ATOM 588 CZ ARG A 38 -5.177 16.272 2.758 1.00 0.00 C ATOM 589 NH1 ARG A 38 -5.656 16.135 3.996 1.00 0.00 N ATOM 590 NH2 ARG A 38 -4.843 17.475 2.317 1.00 0.00 N ATOM 0 H ARG A 38 -0.555 13.303 0.552 1.00 0.00 H new ATOM 0 HA ARG A 38 -1.937 11.416 2.112 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -1.610 13.860 2.595 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -2.710 14.249 1.288 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -3.739 12.386 3.391 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -3.478 14.050 3.876 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -5.187 13.164 1.513 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -5.806 13.630 3.085 1.00 0.00 H new ATOM 0 HE ARG A 38 -4.865 15.402 0.962 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -5.899 15.210 4.349 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -5.779 16.956 4.589 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -4.460 17.586 1.378 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -4.969 18.291 2.916 1.00 0.00 H new ATOM 604 N ILE A 39 -3.516 12.231 -0.676 1.00 0.00 N ATOM 605 CA ILE A 39 -4.667 11.874 -1.501 1.00 0.00 C ATOM 606 C ILE A 39 -4.414 10.504 -2.100 1.00 0.00 C ATOM 607 O ILE A 39 -5.314 9.667 -2.032 1.00 0.00 O ATOM 608 CB ILE A 39 -4.922 12.935 -2.588 1.00 0.00 C ATOM 609 CG1 ILE A 39 -5.353 14.251 -1.899 1.00 0.00 C ATOM 610 CG2 ILE A 39 -5.946 12.412 -3.625 1.00 0.00 C ATOM 611 CD1 ILE A 39 -5.511 15.423 -2.868 1.00 0.00 C ATOM 0 H ILE A 39 -2.910 12.940 -1.089 1.00 0.00 H new ATOM 0 HA ILE A 39 -5.568 11.840 -0.889 1.00 0.00 H new ATOM 0 HB ILE A 39 -4.013 13.141 -3.153 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -6.298 14.088 -1.381 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -4.615 14.514 -1.141 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -6.115 13.174 -4.386 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -5.558 11.509 -4.096 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -6.887 12.185 -3.124 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -5.815 16.313 -2.316 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -4.561 15.612 -3.368 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -6.270 15.180 -3.612 1.00 0.00 H new ATOM 623 N PHE A 40 -3.205 10.280 -2.631 1.00 0.00 N ATOM 624 CA PHE A 40 -2.778 8.963 -3.069 1.00 0.00 C ATOM 625 C PHE A 40 -3.147 7.971 -1.975 1.00 0.00 C ATOM 626 O PHE A 40 -3.925 7.053 -2.233 1.00 0.00 O ATOM 627 CB PHE A 40 -1.271 8.953 -3.391 1.00 0.00 C ATOM 628 CG PHE A 40 -0.664 7.563 -3.521 1.00 0.00 C ATOM 629 CD1 PHE A 40 -1.075 6.694 -4.553 1.00 0.00 C ATOM 630 CD2 PHE A 40 0.273 7.110 -2.571 1.00 0.00 C ATOM 631 CE1 PHE A 40 -0.587 5.373 -4.601 1.00 0.00 C ATOM 632 CE2 PHE A 40 0.761 5.792 -2.624 1.00 0.00 C ATOM 633 CZ PHE A 40 0.310 4.910 -3.621 1.00 0.00 C ATOM 0 H PHE A 40 -2.505 11.009 -2.765 1.00 0.00 H new ATOM 0 HA PHE A 40 -3.281 8.680 -3.994 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -1.107 9.496 -4.322 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -0.741 9.496 -2.608 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -1.765 7.042 -5.308 1.00 0.00 H new ATOM 0 HD2 PHE A 40 0.619 7.779 -1.797 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -0.903 4.712 -5.395 1.00 0.00 H new ATOM 0 HE2 PHE A 40 1.485 5.456 -1.896 1.00 0.00 H new ATOM 0 HZ PHE A 40 0.649 3.885 -3.635 1.00 0.00 H new ATOM 643 N GLY A 41 -2.611 8.153 -0.767 1.00 0.00 N ATOM 644 CA GLY A 41 -2.782 7.266 0.374 1.00 0.00 C ATOM 645 C GLY A 41 -4.235 7.044 0.753 1.00 0.00 C ATOM 646 O GLY A 41 -4.629 5.907 1.004 1.00 0.00 O ATOM 0 H GLY A 41 -2.022 8.958 -0.553 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -2.322 6.304 0.149 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -2.250 7.681 1.230 1.00 0.00 H new ATOM 650 N GLU A 42 -5.041 8.107 0.772 1.00 0.00 N ATOM 651 CA GLU A 42 -6.471 8.028 1.026 1.00 0.00 C ATOM 652 C GLU A 42 -7.148 7.062 0.053 1.00 0.00 C ATOM 653 O GLU A 42 -8.029 6.301 0.451 1.00 0.00 O ATOM 654 CB GLU A 42 -7.113 9.414 0.842 1.00 0.00 C ATOM 655 CG GLU A 42 -7.246 10.242 2.127 1.00 0.00 C ATOM 656 CD GLU A 42 -8.538 11.060 2.200 1.00 0.00 C ATOM 657 OE1 GLU A 42 -9.197 11.287 1.156 1.00 0.00 O ATOM 658 OE2 GLU A 42 -8.926 11.466 3.315 1.00 0.00 O ATOM 0 H GLU A 42 -4.709 9.058 0.609 1.00 0.00 H new ATOM 0 HA GLU A 42 -6.606 7.673 2.048 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -6.521 9.980 0.123 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -8.104 9.284 0.407 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -7.201 9.573 2.986 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -6.394 10.917 2.204 1.00 0.00 H new ATOM 665 N LYS A 43 -6.800 7.140 -1.231 1.00 0.00 N ATOM 666 CA LYS A 43 -7.644 6.631 -2.300 1.00 0.00 C ATOM 667 C LYS A 43 -7.147 5.302 -2.833 1.00 0.00 C ATOM 668 O LYS A 43 -7.955 4.377 -2.944 1.00 0.00 O ATOM 669 CB LYS A 43 -7.789 7.715 -3.363 1.00 0.00 C ATOM 670 CG LYS A 43 -8.739 8.793 -2.820 1.00 0.00 C ATOM 671 CD LYS A 43 -9.393 9.552 -3.965 1.00 0.00 C ATOM 672 CE LYS A 43 -10.501 10.469 -3.440 1.00 0.00 C ATOM 673 NZ LYS A 43 -11.808 9.795 -3.287 1.00 0.00 N ATOM 0 H LYS A 43 -5.927 7.557 -1.554 1.00 0.00 H new ATOM 0 HA LYS A 43 -8.639 6.406 -1.916 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -6.817 8.148 -3.599 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -8.183 7.292 -4.287 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.505 8.331 -2.198 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -8.187 9.486 -2.185 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -8.644 10.143 -4.492 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -9.808 8.847 -4.686 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -10.197 10.876 -2.476 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -10.615 11.313 -4.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -12.509 10.474 -2.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -12.120 9.430 -4.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -11.715 9.006 -2.615 1.00 0.00 H new ATOM 687 N VAL A 44 -5.864 5.191 -3.160 1.00 0.00 N ATOM 688 CA VAL A 44 -5.294 3.943 -3.651 1.00 0.00 C ATOM 689 C VAL A 44 -5.090 2.990 -2.463 1.00 0.00 C ATOM 690 O VAL A 44 -5.841 2.023 -2.335 1.00 0.00 O ATOM 691 CB VAL A 44 -4.029 4.217 -4.489 1.00 0.00 C ATOM 692 CG1 VAL A 44 -3.397 2.914 -4.998 1.00 0.00 C ATOM 693 CG2 VAL A 44 -4.337 5.125 -5.688 1.00 0.00 C ATOM 0 H VAL A 44 -5.195 5.958 -3.093 1.00 0.00 H new ATOM 0 HA VAL A 44 -5.975 3.441 -4.338 1.00 0.00 H new ATOM 0 HB VAL A 44 -3.323 4.721 -3.829 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -2.508 3.146 -5.585 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -3.119 2.289 -4.150 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -4.115 2.381 -5.622 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -3.424 5.298 -6.257 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -5.078 4.645 -6.327 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.729 6.078 -5.332 1.00 0.00 H new ATOM 703 N LEU A 45 -4.104 3.230 -1.589 1.00 0.00 N ATOM 704 CA LEU A 45 -3.752 2.314 -0.500 1.00 0.00 C ATOM 705 C LEU A 45 -4.844 2.255 0.578 1.00 0.00 C ATOM 706 O LEU A 45 -4.906 1.266 1.309 1.00 0.00 O ATOM 707 CB LEU A 45 -2.415 2.705 0.159 1.00 0.00 C ATOM 708 CG LEU A 45 -1.154 2.680 -0.735 1.00 0.00 C ATOM 709 CD1 LEU A 45 0.001 3.456 -0.092 1.00 0.00 C ATOM 710 CD2 LEU A 45 -0.664 1.286 -1.013 1.00 0.00 C ATOM 0 H LEU A 45 -3.526 4.070 -1.619 1.00 0.00 H new ATOM 0 HA LEU A 45 -3.654 1.328 -0.954 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -2.520 3.710 0.567 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -2.245 2.035 1.002 1.00 0.00 H new ATOM 0 HG LEU A 45 -1.458 3.147 -1.672 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.873 3.419 -0.746 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.297 4.494 0.058 1.00 0.00 H new ATOM 0 HD13 LEU A 45 0.250 3.008 0.870 1.00 0.00 H new ATOM 0 HD21 LEU A 45 0.223 1.331 -1.645 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -0.415 0.794 -0.073 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -1.444 0.721 -1.523 1.00 0.00 H new ATOM 722 N GLY A 46 -5.711 3.267 0.675 1.00 0.00 N ATOM 723 CA GLY A 46 -6.886 3.246 1.538 1.00 0.00 C ATOM 724 C GLY A 46 -6.557 3.498 3.010 1.00 0.00 C ATOM 725 O GLY A 46 -7.115 2.824 3.882 1.00 0.00 O ATOM 0 H GLY A 46 -5.611 4.134 0.147 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -7.593 4.001 1.196 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -7.381 2.280 1.443 1.00 0.00 H new ATOM 729 N LEU A 47 -5.653 4.433 3.319 1.00 0.00 N ATOM 730 CA LEU A 47 -5.105 4.650 4.662 1.00 0.00 C ATOM 731 C LEU A 47 -5.092 6.138 5.019 1.00 0.00 C ATOM 732 O LEU A 47 -5.033 6.984 4.125 1.00 0.00 O ATOM 733 CB LEU A 47 -3.670 4.097 4.710 1.00 0.00 C ATOM 734 CG LEU A 47 -3.559 2.570 4.526 1.00 0.00 C ATOM 735 CD1 LEU A 47 -2.094 2.216 4.269 1.00 0.00 C ATOM 736 CD2 LEU A 47 -4.072 1.803 5.749 1.00 0.00 C ATOM 0 H LEU A 47 -5.272 5.076 2.625 1.00 0.00 H new ATOM 0 HA LEU A 47 -5.736 4.133 5.386 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.081 4.586 3.934 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -3.223 4.367 5.667 1.00 0.00 H new ATOM 0 HG LEU A 47 -4.181 2.279 3.680 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.998 1.138 4.137 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -1.749 2.724 3.369 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -1.489 2.532 5.118 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -3.974 0.732 5.574 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.487 2.082 6.625 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.120 2.049 5.919 1.00 0.00 H new ATOM 748 N SER A 48 -5.057 6.463 6.316 1.00 0.00 N ATOM 749 CA SER A 48 -4.848 7.814 6.827 1.00 0.00 C ATOM 750 C SER A 48 -3.466 8.364 6.452 1.00 0.00 C ATOM 751 O SER A 48 -2.535 7.636 6.087 1.00 0.00 O ATOM 752 CB SER A 48 -4.993 7.824 8.357 1.00 0.00 C ATOM 753 OG SER A 48 -6.346 7.858 8.784 1.00 0.00 O ATOM 0 H SER A 48 -5.177 5.771 7.056 1.00 0.00 H new ATOM 0 HA SER A 48 -5.604 8.453 6.370 1.00 0.00 H new ATOM 0 HB2 SER A 48 -4.510 6.938 8.768 1.00 0.00 H new ATOM 0 HB3 SER A 48 -4.468 8.690 8.761 1.00 0.00 H new ATOM 0 HG SER A 48 -6.380 7.861 9.763 1.00 0.00 H new ATOM 759 N GLN A 49 -3.349 9.685 6.578 1.00 0.00 N ATOM 760 CA GLN A 49 -2.215 10.503 6.167 1.00 0.00 C ATOM 761 C GLN A 49 -0.933 9.989 6.817 1.00 0.00 C ATOM 762 O GLN A 49 0.014 9.635 6.115 1.00 0.00 O ATOM 763 CB GLN A 49 -2.520 11.972 6.521 1.00 0.00 C ATOM 764 CG GLN A 49 -1.378 12.950 6.183 1.00 0.00 C ATOM 765 CD GLN A 49 -1.665 14.380 6.654 1.00 0.00 C ATOM 766 OE1 GLN A 49 -1.624 15.335 5.878 1.00 0.00 O ATOM 767 NE2 GLN A 49 -1.921 14.570 7.936 1.00 0.00 N ATOM 0 H GLN A 49 -4.092 10.245 6.996 1.00 0.00 H new ATOM 0 HA GLN A 49 -2.059 10.440 5.090 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -3.420 12.283 5.990 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -2.739 12.040 7.587 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -0.455 12.598 6.645 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -1.214 12.953 5.105 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -1.953 13.774 8.573 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -2.086 15.513 8.289 1.00 0.00 H new ATOM 776 N GLY A 50 -0.893 9.940 8.148 1.00 0.00 N ATOM 777 CA GLY A 50 0.312 9.605 8.884 1.00 0.00 C ATOM 778 C GLY A 50 0.637 8.119 8.796 1.00 0.00 C ATOM 779 O GLY A 50 1.814 7.771 8.800 1.00 0.00 O ATOM 0 H GLY A 50 -1.700 10.133 8.742 1.00 0.00 H new ATOM 0 HA2 GLY A 50 1.149 10.183 8.493 1.00 0.00 H new ATOM 0 HA3 GLY A 50 0.190 9.889 9.929 1.00 0.00 H new ATOM 783 N SER A 51 -0.375 7.254 8.655 1.00 0.00 N ATOM 784 CA SER A 51 -0.190 5.832 8.402 1.00 0.00 C ATOM 785 C SER A 51 0.659 5.637 7.151 1.00 0.00 C ATOM 786 O SER A 51 1.701 4.983 7.206 1.00 0.00 O ATOM 787 CB SER A 51 -1.549 5.148 8.227 1.00 0.00 C ATOM 788 OG SER A 51 -2.276 5.181 9.435 1.00 0.00 O ATOM 0 H SER A 51 -1.355 7.532 8.715 1.00 0.00 H new ATOM 0 HA SER A 51 0.322 5.382 9.253 1.00 0.00 H new ATOM 0 HB2 SER A 51 -2.116 5.647 7.441 1.00 0.00 H new ATOM 0 HB3 SER A 51 -1.405 4.115 7.910 1.00 0.00 H new ATOM 0 HG SER A 51 -3.143 4.742 9.307 1.00 0.00 H new ATOM 794 N VAL A 52 0.211 6.199 6.028 1.00 0.00 N ATOM 795 CA VAL A 52 0.872 6.066 4.749 1.00 0.00 C ATOM 796 C VAL A 52 2.227 6.789 4.757 1.00 0.00 C ATOM 797 O VAL A 52 3.173 6.308 4.128 1.00 0.00 O ATOM 798 CB VAL A 52 -0.124 6.544 3.663 1.00 0.00 C ATOM 799 CG1 VAL A 52 0.175 7.924 3.075 1.00 0.00 C ATOM 800 CG2 VAL A 52 -0.214 5.465 2.597 1.00 0.00 C ATOM 0 H VAL A 52 -0.636 6.767 5.991 1.00 0.00 H new ATOM 0 HA VAL A 52 1.131 5.031 4.525 1.00 0.00 H new ATOM 0 HB VAL A 52 -1.093 6.689 4.142 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -0.576 8.170 2.324 1.00 0.00 H new ATOM 0 HG12 VAL A 52 0.153 8.670 3.869 1.00 0.00 H new ATOM 0 HG13 VAL A 52 1.162 7.916 2.612 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -0.911 5.779 1.820 1.00 0.00 H new ATOM 0 HG22 VAL A 52 0.771 5.304 2.158 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -0.567 4.537 3.047 1.00 0.00 H new ATOM 810 N SER A 53 2.334 7.905 5.491 1.00 0.00 N ATOM 811 CA SER A 53 3.565 8.660 5.642 1.00 0.00 C ATOM 812 C SER A 53 4.621 7.769 6.282 1.00 0.00 C ATOM 813 O SER A 53 5.678 7.551 5.691 1.00 0.00 O ATOM 814 CB SER A 53 3.300 9.944 6.434 1.00 0.00 C ATOM 815 OG SER A 53 4.267 10.918 6.109 1.00 0.00 O ATOM 0 H SER A 53 1.548 8.308 6.002 1.00 0.00 H new ATOM 0 HA SER A 53 3.947 8.971 4.670 1.00 0.00 H new ATOM 0 HB2 SER A 53 2.302 10.321 6.209 1.00 0.00 H new ATOM 0 HB3 SER A 53 3.328 9.734 7.503 1.00 0.00 H new ATOM 0 HG SER A 53 4.090 11.737 6.618 1.00 0.00 H new ATOM 821 N ASP A 54 4.321 7.183 7.444 1.00 0.00 N ATOM 822 CA ASP A 54 5.277 6.335 8.146 1.00 0.00 C ATOM 823 C ASP A 54 5.609 5.069 7.358 1.00 0.00 C ATOM 824 O ASP A 54 6.676 4.492 7.543 1.00 0.00 O ATOM 825 CB ASP A 54 4.757 5.976 9.539 1.00 0.00 C ATOM 826 CG ASP A 54 5.909 5.557 10.453 1.00 0.00 C ATOM 827 OD1 ASP A 54 6.840 6.377 10.630 1.00 0.00 O ATOM 828 OD2 ASP A 54 5.850 4.471 11.072 1.00 0.00 O ATOM 0 H ASP A 54 3.422 7.283 7.916 1.00 0.00 H new ATOM 0 HA ASP A 54 6.200 6.906 8.249 1.00 0.00 H new ATOM 0 HB2 ASP A 54 4.236 6.831 9.970 1.00 0.00 H new ATOM 0 HB3 ASP A 54 4.032 5.166 9.465 1.00 0.00 H new ATOM 833 N MET A 55 4.724 4.654 6.449 1.00 0.00 N ATOM 834 CA MET A 55 4.972 3.575 5.508 1.00 0.00 C ATOM 835 C MET A 55 6.079 3.951 4.535 1.00 0.00 C ATOM 836 O MET A 55 7.100 3.273 4.510 1.00 0.00 O ATOM 837 CB MET A 55 3.671 3.181 4.790 1.00 0.00 C ATOM 838 CG MET A 55 3.446 1.687 5.003 1.00 0.00 C ATOM 839 SD MET A 55 1.798 1.038 4.667 1.00 0.00 S ATOM 840 CE MET A 55 0.865 1.755 6.046 1.00 0.00 C ATOM 0 H MET A 55 3.798 5.071 6.350 1.00 0.00 H new ATOM 0 HA MET A 55 5.317 2.699 6.056 1.00 0.00 H new ATOM 0 HB2 MET A 55 2.831 3.752 5.184 1.00 0.00 H new ATOM 0 HB3 MET A 55 3.740 3.408 3.726 1.00 0.00 H new ATOM 0 HG2 MET A 55 4.155 1.147 4.375 1.00 0.00 H new ATOM 0 HG3 MET A 55 3.695 1.453 6.038 1.00 0.00 H new ATOM 0 HE1 MET A 55 -0.046 1.179 6.207 1.00 0.00 H new ATOM 0 HE2 MET A 55 1.475 1.731 6.949 1.00 0.00 H new ATOM 0 HE3 MET A 55 0.605 2.787 5.812 1.00 0.00 H new ATOM 850 N LEU A 56 5.889 5.006 3.739 1.00 0.00 N ATOM 851 CA LEU A 56 6.917 5.485 2.811 1.00 0.00 C ATOM 852 C LEU A 56 8.237 5.815 3.520 1.00 0.00 C ATOM 853 O LEU A 56 9.306 5.511 2.979 1.00 0.00 O ATOM 854 CB LEU A 56 6.439 6.711 2.021 1.00 0.00 C ATOM 855 CG LEU A 56 5.228 6.498 1.087 1.00 0.00 C ATOM 856 CD1 LEU A 56 5.177 7.637 0.061 1.00 0.00 C ATOM 857 CD2 LEU A 56 5.250 5.165 0.325 1.00 0.00 C ATOM 0 H LEU A 56 5.026 5.549 3.719 1.00 0.00 H new ATOM 0 HA LEU A 56 7.099 4.664 2.117 1.00 0.00 H new ATOM 0 HB2 LEU A 56 6.188 7.498 2.732 1.00 0.00 H new ATOM 0 HB3 LEU A 56 7.272 7.077 1.421 1.00 0.00 H new ATOM 0 HG LEU A 56 4.349 6.484 1.731 1.00 0.00 H new ATOM 0 HD11 LEU A 56 4.324 7.492 -0.602 1.00 0.00 H new ATOM 0 HD12 LEU A 56 5.075 8.590 0.580 1.00 0.00 H new ATOM 0 HD13 LEU A 56 6.096 7.640 -0.526 1.00 0.00 H new ATOM 0 HD21 LEU A 56 4.366 5.093 -0.308 1.00 0.00 H new ATOM 0 HD22 LEU A 56 6.145 5.115 -0.295 1.00 0.00 H new ATOM 0 HD23 LEU A 56 5.255 4.339 1.036 1.00 0.00 H new ATOM 869 N SER A 57 8.178 6.415 4.711 1.00 0.00 N ATOM 870 CA SER A 57 9.354 6.741 5.506 1.00 0.00 C ATOM 871 C SER A 57 10.103 5.480 5.949 1.00 0.00 C ATOM 872 O SER A 57 11.304 5.361 5.701 1.00 0.00 O ATOM 873 CB SER A 57 8.910 7.513 6.753 1.00 0.00 C ATOM 874 OG SER A 57 8.319 8.765 6.463 1.00 0.00 O ATOM 0 H SER A 57 7.300 6.689 5.152 1.00 0.00 H new ATOM 0 HA SER A 57 10.025 7.340 4.891 1.00 0.00 H new ATOM 0 HB2 SER A 57 8.198 6.905 7.312 1.00 0.00 H new ATOM 0 HB3 SER A 57 9.773 7.669 7.400 1.00 0.00 H new ATOM 0 HG SER A 57 7.394 8.630 6.169 1.00 0.00 H new ATOM 880 N ARG A 58 9.414 4.533 6.598 1.00 0.00 N ATOM 881 CA ARG A 58 10.039 3.402 7.281 1.00 0.00 C ATOM 882 C ARG A 58 9.148 2.160 7.137 1.00 0.00 C ATOM 883 O ARG A 58 8.485 1.761 8.095 1.00 0.00 O ATOM 884 CB ARG A 58 10.384 3.776 8.746 1.00 0.00 C ATOM 885 CG ARG A 58 9.229 4.313 9.619 1.00 0.00 C ATOM 886 CD ARG A 58 9.706 4.639 11.043 1.00 0.00 C ATOM 887 NE ARG A 58 8.644 4.398 12.032 1.00 0.00 N ATOM 888 CZ ARG A 58 8.816 4.163 13.337 1.00 0.00 C ATOM 889 NH1 ARG A 58 9.977 4.421 13.934 1.00 0.00 N ATOM 890 NH2 ARG A 58 7.821 3.662 14.054 1.00 0.00 N ATOM 0 H ARG A 58 8.396 4.534 6.662 1.00 0.00 H new ATOM 0 HA ARG A 58 10.992 3.152 6.815 1.00 0.00 H new ATOM 0 HB2 ARG A 58 10.796 2.893 9.234 1.00 0.00 H new ATOM 0 HB3 ARG A 58 11.173 4.527 8.728 1.00 0.00 H new ATOM 0 HG2 ARG A 58 8.810 5.209 9.160 1.00 0.00 H new ATOM 0 HG3 ARG A 58 8.429 3.573 9.662 1.00 0.00 H new ATOM 0 HD2 ARG A 58 10.576 4.029 11.285 1.00 0.00 H new ATOM 0 HD3 ARG A 58 10.023 5.681 11.093 1.00 0.00 H new ATOM 0 HE ARG A 58 7.683 4.411 11.689 1.00 0.00 H new ATOM 0 HH11 ARG A 58 10.754 4.804 13.395 1.00 0.00 H new ATOM 0 HH12 ARG A 58 10.090 4.235 14.931 1.00 0.00 H new ATOM 0 HH21 ARG A 58 6.926 3.456 13.610 1.00 0.00 H new ATOM 0 HH22 ARG A 58 7.950 3.482 15.050 1.00 0.00 H new ATOM 904 N PRO A 59 9.124 1.499 5.971 1.00 0.00 N ATOM 905 CA PRO A 59 8.276 0.330 5.765 1.00 0.00 C ATOM 906 C PRO A 59 8.774 -0.864 6.587 1.00 0.00 C ATOM 907 O PRO A 59 9.875 -0.834 7.148 1.00 0.00 O ATOM 908 CB PRO A 59 8.293 0.073 4.255 1.00 0.00 C ATOM 909 CG PRO A 59 9.641 0.634 3.823 1.00 0.00 C ATOM 910 CD PRO A 59 9.881 1.806 4.769 1.00 0.00 C ATOM 0 HA PRO A 59 7.254 0.492 6.108 1.00 0.00 H new ATOM 0 HB2 PRO A 59 8.207 -0.989 4.026 1.00 0.00 H new ATOM 0 HB3 PRO A 59 7.467 0.576 3.751 1.00 0.00 H new ATOM 0 HG2 PRO A 59 10.429 -0.114 3.908 1.00 0.00 H new ATOM 0 HG3 PRO A 59 9.622 0.960 2.783 1.00 0.00 H new ATOM 0 HD2 PRO A 59 10.942 1.919 4.992 1.00 0.00 H new ATOM 0 HD3 PRO A 59 9.547 2.744 4.324 1.00 0.00 H new ATOM 918 N LYS A 60 7.957 -1.920 6.648 1.00 0.00 N ATOM 919 CA LYS A 60 8.275 -3.199 7.279 1.00 0.00 C ATOM 920 C LYS A 60 8.759 -4.179 6.205 1.00 0.00 C ATOM 921 O LYS A 60 8.456 -3.955 5.025 1.00 0.00 O ATOM 922 CB LYS A 60 7.005 -3.745 7.962 1.00 0.00 C ATOM 923 CG LYS A 60 6.550 -2.965 9.207 1.00 0.00 C ATOM 924 CD LYS A 60 7.410 -3.220 10.457 1.00 0.00 C ATOM 925 CE LYS A 60 6.785 -2.457 11.635 1.00 0.00 C ATOM 926 NZ LYS A 60 7.372 -2.800 12.945 1.00 0.00 N ATOM 0 H LYS A 60 7.021 -1.904 6.243 1.00 0.00 H new ATOM 0 HA LYS A 60 9.059 -3.071 8.025 1.00 0.00 H new ATOM 0 HB2 LYS A 60 6.192 -3.747 7.236 1.00 0.00 H new ATOM 0 HB3 LYS A 60 7.181 -4.783 8.246 1.00 0.00 H new ATOM 0 HG2 LYS A 60 6.565 -1.899 8.980 1.00 0.00 H new ATOM 0 HG3 LYS A 60 5.516 -3.229 9.430 1.00 0.00 H new ATOM 0 HD2 LYS A 60 7.455 -4.287 10.676 1.00 0.00 H new ATOM 0 HD3 LYS A 60 8.434 -2.886 10.288 1.00 0.00 H new ATOM 0 HE2 LYS A 60 6.900 -1.387 11.465 1.00 0.00 H new ATOM 0 HE3 LYS A 60 5.715 -2.662 11.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 6.902 -2.248 13.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 7.240 -3.815 13.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 8.388 -2.579 12.939 1.00 0.00 H new ATOM 940 N PRO A 61 9.419 -5.289 6.581 1.00 0.00 N ATOM 941 CA PRO A 61 9.704 -6.360 5.635 1.00 0.00 C ATOM 942 C PRO A 61 8.391 -7.037 5.239 1.00 0.00 C ATOM 943 O PRO A 61 7.467 -7.106 6.055 1.00 0.00 O ATOM 944 CB PRO A 61 10.642 -7.319 6.377 1.00 0.00 C ATOM 945 CG PRO A 61 10.344 -7.077 7.852 1.00 0.00 C ATOM 946 CD PRO A 61 9.918 -5.612 7.914 1.00 0.00 C ATOM 0 HA PRO A 61 10.170 -6.009 4.714 1.00 0.00 H new ATOM 0 HB2 PRO A 61 10.452 -8.355 6.098 1.00 0.00 H new ATOM 0 HB3 PRO A 61 11.687 -7.113 6.144 1.00 0.00 H new ATOM 0 HG2 PRO A 61 9.554 -7.737 8.212 1.00 0.00 H new ATOM 0 HG3 PRO A 61 11.222 -7.263 8.471 1.00 0.00 H new ATOM 0 HD2 PRO A 61 9.146 -5.460 8.668 1.00 0.00 H new ATOM 0 HD3 PRO A 61 10.757 -4.971 8.184 1.00 0.00 H new ATOM 954 N TRP A 62 8.329 -7.618 4.037 1.00 0.00 N ATOM 955 CA TRP A 62 7.147 -8.343 3.570 1.00 0.00 C ATOM 956 C TRP A 62 6.767 -9.476 4.533 1.00 0.00 C ATOM 957 O TRP A 62 5.582 -9.748 4.747 1.00 0.00 O ATOM 958 CB TRP A 62 7.417 -8.878 2.164 1.00 0.00 C ATOM 959 CG TRP A 62 6.234 -9.443 1.461 1.00 0.00 C ATOM 960 CD1 TRP A 62 5.949 -10.756 1.380 1.00 0.00 C ATOM 961 CD2 TRP A 62 5.206 -8.764 0.684 1.00 0.00 C ATOM 962 NE1 TRP A 62 4.887 -10.950 0.530 1.00 0.00 N ATOM 963 CE2 TRP A 62 4.413 -9.757 0.042 1.00 0.00 C ATOM 964 CE3 TRP A 62 4.881 -7.416 0.426 1.00 0.00 C ATOM 965 CZ2 TRP A 62 3.402 -9.436 -0.866 1.00 0.00 C ATOM 966 CZ3 TRP A 62 3.849 -7.082 -0.469 1.00 0.00 C ATOM 967 CH2 TRP A 62 3.135 -8.091 -1.137 1.00 0.00 C ATOM 0 H TRP A 62 9.095 -7.598 3.364 1.00 0.00 H new ATOM 0 HA TRP A 62 6.298 -7.660 3.539 1.00 0.00 H new ATOM 0 HB2 TRP A 62 7.827 -8.070 1.558 1.00 0.00 H new ATOM 0 HB3 TRP A 62 8.184 -9.650 2.228 1.00 0.00 H new ATOM 0 HD1 TRP A 62 6.476 -11.539 1.904 1.00 0.00 H new ATOM 0 HE1 TRP A 62 4.500 -11.863 0.292 1.00 0.00 H new ATOM 0 HE3 TRP A 62 5.432 -6.630 0.922 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 2.834 -10.216 -1.352 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 3.604 -6.045 -0.644 1.00 0.00 H new ATOM 0 HH2 TRP A 62 2.379 -7.827 -1.861 1.00 0.00 H new ATOM 978 N SER A 63 7.766 -10.078 5.179 1.00 0.00 N ATOM 979 CA SER A 63 7.634 -11.058 6.240 1.00 0.00 C ATOM 980 C SER A 63 6.713 -10.574 7.364 1.00 0.00 C ATOM 981 O SER A 63 5.858 -11.331 7.821 1.00 0.00 O ATOM 982 CB SER A 63 9.038 -11.334 6.791 1.00 0.00 C ATOM 983 OG SER A 63 9.109 -12.629 7.351 1.00 0.00 O ATOM 0 H SER A 63 8.742 -9.878 4.958 1.00 0.00 H new ATOM 0 HA SER A 63 7.182 -11.964 5.836 1.00 0.00 H new ATOM 0 HB2 SER A 63 9.773 -11.237 5.992 1.00 0.00 H new ATOM 0 HB3 SER A 63 9.290 -10.591 7.548 1.00 0.00 H new ATOM 0 HG SER A 63 10.013 -12.787 7.696 1.00 0.00 H new ATOM 989 N LYS A 64 6.885 -9.332 7.830 1.00 0.00 N ATOM 990 CA LYS A 64 6.135 -8.784 8.959 1.00 0.00 C ATOM 991 C LYS A 64 4.717 -8.381 8.567 1.00 0.00 C ATOM 992 O LYS A 64 3.919 -8.050 9.448 1.00 0.00 O ATOM 993 CB LYS A 64 6.897 -7.583 9.548 1.00 0.00 C ATOM 994 CG LYS A 64 8.008 -8.007 10.523 1.00 0.00 C ATOM 995 CD LYS A 64 7.392 -8.380 11.883 1.00 0.00 C ATOM 996 CE LYS A 64 8.370 -8.910 12.937 1.00 0.00 C ATOM 997 NZ LYS A 64 9.405 -7.928 13.319 1.00 0.00 N ATOM 0 H LYS A 64 7.555 -8.676 7.429 1.00 0.00 H new ATOM 0 HA LYS A 64 6.044 -9.565 9.714 1.00 0.00 H new ATOM 0 HB2 LYS A 64 7.334 -7.001 8.736 1.00 0.00 H new ATOM 0 HB3 LYS A 64 6.194 -6.930 10.066 1.00 0.00 H new ATOM 0 HG2 LYS A 64 8.557 -8.857 10.117 1.00 0.00 H new ATOM 0 HG3 LYS A 64 8.724 -7.195 10.648 1.00 0.00 H new ATOM 0 HD2 LYS A 64 6.893 -7.499 12.288 1.00 0.00 H new ATOM 0 HD3 LYS A 64 6.623 -9.134 11.717 1.00 0.00 H new ATOM 0 HE2 LYS A 64 7.812 -9.203 13.826 1.00 0.00 H new ATOM 0 HE3 LYS A 64 8.855 -9.808 12.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 10.034 -8.347 14.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 9.961 -7.665 12.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 8.950 -7.080 13.713 1.00 0.00 H new ATOM 1011 N LEU A 65 4.407 -8.363 7.271 1.00 0.00 N ATOM 1012 CA LEU A 65 3.088 -8.025 6.778 1.00 0.00 C ATOM 1013 C LEU A 65 2.292 -9.324 6.666 1.00 0.00 C ATOM 1014 O LEU A 65 2.724 -10.291 6.035 1.00 0.00 O ATOM 1015 CB LEU A 65 3.182 -7.312 5.420 1.00 0.00 C ATOM 1016 CG LEU A 65 4.010 -6.014 5.390 1.00 0.00 C ATOM 1017 CD1 LEU A 65 4.095 -5.515 3.944 1.00 0.00 C ATOM 1018 CD2 LEU A 65 3.396 -4.922 6.274 1.00 0.00 C ATOM 0 H LEU A 65 5.076 -8.586 6.534 1.00 0.00 H new ATOM 0 HA LEU A 65 2.588 -7.338 7.461 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.608 -8.007 4.697 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.171 -7.082 5.083 1.00 0.00 H new ATOM 0 HG LEU A 65 5.003 -6.233 5.781 1.00 0.00 H new ATOM 0 HD11 LEU A 65 4.679 -4.596 3.910 1.00 0.00 H new ATOM 0 HD12 LEU A 65 4.575 -6.273 3.325 1.00 0.00 H new ATOM 0 HD13 LEU A 65 3.091 -5.321 3.566 1.00 0.00 H new ATOM 0 HD21 LEU A 65 4.012 -4.024 6.223 1.00 0.00 H new ATOM 0 HD22 LEU A 65 2.390 -4.692 5.923 1.00 0.00 H new ATOM 0 HD23 LEU A 65 3.349 -5.272 7.305 1.00 0.00 H new ATOM 1030 N THR A 66 1.100 -9.346 7.245 1.00 0.00 N ATOM 1031 CA THR A 66 0.059 -10.320 6.936 1.00 0.00 C ATOM 1032 C THR A 66 -0.413 -10.092 5.490 1.00 0.00 C ATOM 1033 O THR A 66 -0.096 -9.053 4.914 1.00 0.00 O ATOM 1034 CB THR A 66 -1.073 -10.090 7.950 1.00 0.00 C ATOM 1035 OG1 THR A 66 -1.442 -8.726 7.939 1.00 0.00 O ATOM 1036 CG2 THR A 66 -0.614 -10.441 9.369 1.00 0.00 C ATOM 0 H THR A 66 0.822 -8.673 7.959 1.00 0.00 H new ATOM 0 HA THR A 66 0.410 -11.349 7.009 1.00 0.00 H new ATOM 0 HB THR A 66 -1.913 -10.726 7.670 1.00 0.00 H new ATOM 0 HG1 THR A 66 -2.165 -8.577 8.584 1.00 0.00 H new ATOM 0 HG21 THR A 66 -1.432 -10.270 10.069 1.00 0.00 H new ATOM 0 HG22 THR A 66 -0.317 -11.489 9.407 1.00 0.00 H new ATOM 0 HG23 THR A 66 0.234 -9.814 9.643 1.00 0.00 H new ATOM 1044 N GLN A 67 -1.233 -10.972 4.897 1.00 0.00 N ATOM 1045 CA GLN A 67 -1.913 -10.626 3.637 1.00 0.00 C ATOM 1046 C GLN A 67 -2.695 -9.312 3.795 1.00 0.00 C ATOM 1047 O GLN A 67 -2.626 -8.433 2.939 1.00 0.00 O ATOM 1048 CB GLN A 67 -2.862 -11.735 3.181 1.00 0.00 C ATOM 1049 CG GLN A 67 -2.166 -13.003 2.652 1.00 0.00 C ATOM 1050 CD GLN A 67 -2.889 -14.276 3.088 1.00 0.00 C ATOM 1051 OE1 GLN A 67 -3.183 -14.435 4.273 1.00 0.00 O ATOM 1052 NE2 GLN A 67 -3.120 -15.224 2.198 1.00 0.00 N ATOM 0 H GLN A 67 -1.439 -11.904 5.256 1.00 0.00 H new ATOM 0 HA GLN A 67 -1.143 -10.504 2.875 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -3.504 -12.012 4.018 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -3.511 -11.340 2.399 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -2.122 -12.965 1.564 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -1.137 -13.029 3.012 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -2.871 -15.077 1.220 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -3.548 -16.103 2.489 1.00 0.00 H new ATOM 1061 N LYS A 68 -3.377 -9.139 4.929 1.00 0.00 N ATOM 1062 CA LYS A 68 -4.127 -7.928 5.246 1.00 0.00 C ATOM 1063 C LYS A 68 -3.220 -6.693 5.284 1.00 0.00 C ATOM 1064 O LYS A 68 -3.629 -5.621 4.846 1.00 0.00 O ATOM 1065 CB LYS A 68 -4.863 -8.155 6.577 1.00 0.00 C ATOM 1066 CG LYS A 68 -6.312 -7.646 6.585 1.00 0.00 C ATOM 1067 CD LYS A 68 -6.500 -6.380 7.423 1.00 0.00 C ATOM 1068 CE LYS A 68 -7.996 -6.084 7.491 1.00 0.00 C ATOM 1069 NZ LYS A 68 -8.325 -4.992 8.428 1.00 0.00 N ATOM 0 H LYS A 68 -3.423 -9.848 5.661 1.00 0.00 H new ATOM 0 HA LYS A 68 -4.857 -7.728 4.462 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -4.862 -9.221 6.803 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -4.310 -7.659 7.375 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -6.626 -7.446 5.561 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -6.964 -8.430 6.971 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -6.092 -6.520 8.424 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -5.965 -5.543 6.975 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -8.355 -5.822 6.496 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -8.526 -6.987 7.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -9.353 -4.836 8.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -8.010 -5.249 9.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -7.844 -4.120 8.128 1.00 0.00 H new ATOM 1083 N GLY A 69 -1.979 -6.831 5.755 1.00 0.00 N ATOM 1084 CA GLY A 69 -0.984 -5.769 5.745 1.00 0.00 C ATOM 1085 C GLY A 69 -0.281 -5.628 4.392 1.00 0.00 C ATOM 1086 O GLY A 69 0.301 -4.576 4.132 1.00 0.00 O ATOM 0 H GLY A 69 -1.636 -7.702 6.160 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -1.465 -4.824 6.000 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -0.240 -5.967 6.517 1.00 0.00 H new ATOM 1090 N ARG A 70 -0.304 -6.648 3.528 1.00 0.00 N ATOM 1091 CA ARG A 70 0.235 -6.602 2.169 1.00 0.00 C ATOM 1092 C ARG A 70 -0.748 -5.932 1.220 1.00 0.00 C ATOM 1093 O ARG A 70 -0.277 -5.352 0.250 1.00 0.00 O ATOM 1094 CB ARG A 70 0.576 -8.018 1.661 1.00 0.00 C ATOM 1095 CG ARG A 70 1.791 -8.616 2.385 1.00 0.00 C ATOM 1096 CD ARG A 70 1.876 -10.139 2.264 1.00 0.00 C ATOM 1097 NE ARG A 70 2.963 -10.686 3.093 1.00 0.00 N ATOM 1098 CZ ARG A 70 3.217 -11.981 3.313 1.00 0.00 C ATOM 1099 NH1 ARG A 70 2.509 -12.921 2.702 1.00 0.00 N ATOM 1100 NH2 ARG A 70 4.172 -12.331 4.163 1.00 0.00 N ATOM 0 H ARG A 70 -0.710 -7.553 3.764 1.00 0.00 H new ATOM 0 HA ARG A 70 1.152 -6.013 2.197 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -0.286 -8.670 1.802 1.00 0.00 H new ATOM 0 HB3 ARG A 70 0.776 -7.980 0.590 1.00 0.00 H new ATOM 0 HG2 ARG A 70 2.701 -8.174 1.979 1.00 0.00 H new ATOM 0 HG3 ARG A 70 1.748 -8.344 3.440 1.00 0.00 H new ATOM 0 HD2 ARG A 70 0.928 -10.583 2.567 1.00 0.00 H new ATOM 0 HD3 ARG A 70 2.038 -10.414 1.222 1.00 0.00 H new ATOM 0 HE ARG A 70 3.582 -10.012 3.543 1.00 0.00 H new ATOM 0 HH11 ARG A 70 1.763 -12.660 2.057 1.00 0.00 H new ATOM 0 HH12 ARG A 70 2.710 -13.906 2.876 1.00 0.00 H new ATOM 0 HH21 ARG A 70 4.711 -11.614 4.648 1.00 0.00 H new ATOM 0 HH22 ARG A 70 4.367 -13.318 4.332 1.00 0.00 H new ATOM 1114 N GLU A 71 -2.059 -5.954 1.493 1.00 0.00 N ATOM 1115 CA GLU A 71 -3.081 -5.313 0.658 1.00 0.00 C ATOM 1116 C GLU A 71 -2.702 -3.899 0.205 1.00 0.00 C ATOM 1117 O GLU A 71 -2.803 -3.624 -0.991 1.00 0.00 O ATOM 1118 CB GLU A 71 -4.436 -5.251 1.375 1.00 0.00 C ATOM 1119 CG GLU A 71 -5.327 -6.468 1.128 1.00 0.00 C ATOM 1120 CD GLU A 71 -6.784 -6.021 1.115 1.00 0.00 C ATOM 1121 OE1 GLU A 71 -7.202 -5.487 0.062 1.00 0.00 O ATOM 1122 OE2 GLU A 71 -7.478 -6.218 2.140 1.00 0.00 O ATOM 0 H GLU A 71 -2.444 -6.424 2.312 1.00 0.00 H new ATOM 0 HA GLU A 71 -3.154 -5.943 -0.229 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -4.264 -5.151 2.447 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -4.965 -4.355 1.052 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -5.069 -6.937 0.179 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -5.169 -7.215 1.906 1.00 0.00 H new ATOM 1129 N PRO A 72 -2.287 -2.979 1.095 1.00 0.00 N ATOM 1130 CA PRO A 72 -1.833 -1.678 0.647 1.00 0.00 C ATOM 1131 C PRO A 72 -0.552 -1.855 -0.189 1.00 0.00 C ATOM 1132 O PRO A 72 -0.546 -1.495 -1.362 1.00 0.00 O ATOM 1133 CB PRO A 72 -1.755 -0.815 1.916 1.00 0.00 C ATOM 1134 CG PRO A 72 -1.543 -1.815 3.049 1.00 0.00 C ATOM 1135 CD PRO A 72 -2.291 -3.051 2.551 1.00 0.00 C ATOM 0 HA PRO A 72 -2.495 -1.153 -0.042 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -0.934 -0.100 1.859 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -2.669 -0.240 2.061 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -0.486 -2.021 3.214 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -1.948 -1.450 3.993 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -1.805 -3.964 2.896 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -3.311 -3.068 2.936 1.00 0.00 H new ATOM 1143 N PHE A 73 0.507 -2.485 0.323 1.00 0.00 N ATOM 1144 CA PHE A 73 1.769 -2.630 -0.409 1.00 0.00 C ATOM 1145 C PHE A 73 1.616 -3.223 -1.819 1.00 0.00 C ATOM 1146 O PHE A 73 2.393 -2.886 -2.705 1.00 0.00 O ATOM 1147 CB PHE A 73 2.731 -3.505 0.398 1.00 0.00 C ATOM 1148 CG PHE A 73 3.438 -2.776 1.530 1.00 0.00 C ATOM 1149 CD1 PHE A 73 2.841 -2.615 2.796 1.00 0.00 C ATOM 1150 CD2 PHE A 73 4.709 -2.217 1.297 1.00 0.00 C ATOM 1151 CE1 PHE A 73 3.514 -1.913 3.818 1.00 0.00 C ATOM 1152 CE2 PHE A 73 5.387 -1.539 2.325 1.00 0.00 C ATOM 1153 CZ PHE A 73 4.792 -1.372 3.580 1.00 0.00 C ATOM 0 H PHE A 73 0.516 -2.907 1.251 1.00 0.00 H new ATOM 0 HA PHE A 73 2.159 -1.620 -0.538 1.00 0.00 H new ATOM 0 HB2 PHE A 73 2.177 -4.347 0.813 1.00 0.00 H new ATOM 0 HB3 PHE A 73 3.481 -3.919 -0.277 1.00 0.00 H new ATOM 0 HD1 PHE A 73 1.863 -3.031 2.985 1.00 0.00 H new ATOM 0 HD2 PHE A 73 5.166 -2.310 0.323 1.00 0.00 H new ATOM 0 HE1 PHE A 73 3.048 -1.790 4.785 1.00 0.00 H new ATOM 0 HE2 PHE A 73 6.376 -1.144 2.144 1.00 0.00 H new ATOM 0 HZ PHE A 73 5.309 -0.833 4.360 1.00 0.00 H new ATOM 1163 N ILE A 74 0.653 -4.109 -2.057 1.00 0.00 N ATOM 1164 CA ILE A 74 0.312 -4.659 -3.370 1.00 0.00 C ATOM 1165 C ILE A 74 -0.129 -3.536 -4.291 1.00 0.00 C ATOM 1166 O ILE A 74 0.366 -3.431 -5.406 1.00 0.00 O ATOM 1167 CB ILE A 74 -0.805 -5.717 -3.166 1.00 0.00 C ATOM 1168 CG1 ILE A 74 -0.134 -7.006 -2.658 1.00 0.00 C ATOM 1169 CG2 ILE A 74 -1.681 -5.984 -4.406 1.00 0.00 C ATOM 1170 CD1 ILE A 74 -1.062 -7.927 -1.870 1.00 0.00 C ATOM 0 H ILE A 74 0.064 -4.480 -1.312 1.00 0.00 H new ATOM 0 HA ILE A 74 1.172 -5.139 -3.837 1.00 0.00 H new ATOM 0 HB ILE A 74 -1.512 -5.321 -2.437 1.00 0.00 H new ATOM 0 HG12 ILE A 74 0.265 -7.555 -3.511 1.00 0.00 H new ATOM 0 HG13 ILE A 74 0.713 -6.737 -2.027 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -2.432 -6.737 -4.166 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -2.176 -5.061 -4.707 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -1.055 -6.344 -5.223 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -0.511 -8.811 -1.549 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -1.442 -7.399 -0.995 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -1.897 -8.230 -2.502 1.00 0.00 H new ATOM 1182 N ARG A 75 -1.052 -2.692 -3.848 1.00 0.00 N ATOM 1183 CA ARG A 75 -1.507 -1.557 -4.614 1.00 0.00 C ATOM 1184 C ARG A 75 -0.360 -0.596 -4.884 1.00 0.00 C ATOM 1185 O ARG A 75 -0.303 -0.045 -5.980 1.00 0.00 O ATOM 1186 CB ARG A 75 -2.655 -0.916 -3.849 1.00 0.00 C ATOM 1187 CG ARG A 75 -3.843 -1.873 -3.741 1.00 0.00 C ATOM 1188 CD ARG A 75 -4.989 -1.179 -3.008 1.00 0.00 C ATOM 1189 NE ARG A 75 -6.241 -1.891 -3.279 1.00 0.00 N ATOM 1190 CZ ARG A 75 -6.772 -2.944 -2.657 1.00 0.00 C ATOM 1191 NH1 ARG A 75 -6.186 -3.480 -1.593 1.00 0.00 N ATOM 1192 NH2 ARG A 75 -7.902 -3.438 -3.138 1.00 0.00 N ATOM 0 H ARG A 75 -1.505 -2.784 -2.939 1.00 0.00 H new ATOM 0 HA ARG A 75 -1.868 -1.863 -5.596 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -2.319 -0.633 -2.851 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -2.966 -0.000 -4.352 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -4.167 -2.182 -4.735 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -3.549 -2.776 -3.206 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -4.792 -1.162 -1.936 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -5.069 -0.142 -3.334 1.00 0.00 H new ATOM 0 HE ARG A 75 -6.787 -1.527 -4.060 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -5.315 -3.086 -1.238 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -6.607 -4.286 -1.130 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -8.336 -3.013 -3.958 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -8.338 -4.243 -2.689 1.00 0.00 H new ATOM 1206 N MET A 76 0.589 -0.447 -3.947 1.00 0.00 N ATOM 1207 CA MET A 76 1.809 0.303 -4.206 1.00 0.00 C ATOM 1208 C MET A 76 2.561 -0.262 -5.425 1.00 0.00 C ATOM 1209 O MET A 76 2.963 0.505 -6.305 1.00 0.00 O ATOM 1210 CB MET A 76 2.684 0.318 -2.936 1.00 0.00 C ATOM 1211 CG MET A 76 3.137 1.723 -2.560 1.00 0.00 C ATOM 1212 SD MET A 76 4.518 1.840 -1.387 1.00 0.00 S ATOM 1213 CE MET A 76 3.626 1.547 0.140 1.00 0.00 C ATOM 0 H MET A 76 0.527 -0.839 -3.007 1.00 0.00 H new ATOM 0 HA MET A 76 1.552 1.333 -4.454 1.00 0.00 H new ATOM 0 HB2 MET A 76 2.124 -0.114 -2.107 1.00 0.00 H new ATOM 0 HB3 MET A 76 3.559 -0.313 -3.093 1.00 0.00 H new ATOM 0 HG2 MET A 76 3.419 2.247 -3.473 1.00 0.00 H new ATOM 0 HG3 MET A 76 2.284 2.255 -2.138 1.00 0.00 H new ATOM 0 HE1 MET A 76 4.320 1.582 0.979 1.00 0.00 H new ATOM 0 HE2 MET A 76 2.862 2.314 0.268 1.00 0.00 H new ATOM 0 HE3 MET A 76 3.152 0.566 0.102 1.00 0.00 H new ATOM 1223 N GLN A 77 2.729 -1.594 -5.479 1.00 0.00 N ATOM 1224 CA GLN A 77 3.418 -2.302 -6.564 1.00 0.00 C ATOM 1225 C GLN A 77 2.665 -2.139 -7.875 1.00 0.00 C ATOM 1226 O GLN A 77 3.282 -1.918 -8.913 1.00 0.00 O ATOM 1227 CB GLN A 77 3.548 -3.813 -6.276 1.00 0.00 C ATOM 1228 CG GLN A 77 4.409 -4.096 -5.044 1.00 0.00 C ATOM 1229 CD GLN A 77 4.218 -5.479 -4.435 1.00 0.00 C ATOM 1230 OE1 GLN A 77 4.717 -6.484 -4.921 1.00 0.00 O ATOM 1231 NE2 GLN A 77 3.558 -5.547 -3.297 1.00 0.00 N ATOM 0 H GLN A 77 2.381 -2.219 -4.752 1.00 0.00 H new ATOM 0 HA GLN A 77 4.413 -1.862 -6.636 1.00 0.00 H new ATOM 0 HB2 GLN A 77 2.556 -4.239 -6.129 1.00 0.00 H new ATOM 0 HB3 GLN A 77 3.983 -4.310 -7.143 1.00 0.00 H new ATOM 0 HG2 GLN A 77 5.458 -3.976 -5.316 1.00 0.00 H new ATOM 0 HG3 GLN A 77 4.189 -3.346 -4.284 1.00 0.00 H new ATOM 0 HE21 GLN A 77 3.144 -4.705 -2.896 1.00 0.00 H new ATOM 0 HE22 GLN A 77 3.461 -6.441 -2.816 1.00 0.00 H new ATOM 1240 N LEU A 78 1.343 -2.286 -7.848 1.00 0.00 N ATOM 1241 CA LEU A 78 0.520 -2.232 -9.041 1.00 0.00 C ATOM 1242 C LEU A 78 0.539 -0.829 -9.595 1.00 0.00 C ATOM 1243 O LEU A 78 1.016 -0.672 -10.715 1.00 0.00 O ATOM 1244 CB LEU A 78 -0.908 -2.722 -8.752 1.00 0.00 C ATOM 1245 CG LEU A 78 -0.987 -4.230 -8.438 1.00 0.00 C ATOM 1246 CD1 LEU A 78 -2.356 -4.592 -7.856 1.00 0.00 C ATOM 1247 CD2 LEU A 78 -0.713 -5.087 -9.675 1.00 0.00 C ATOM 0 H LEU A 78 0.815 -2.447 -6.990 1.00 0.00 H new ATOM 0 HA LEU A 78 0.929 -2.905 -9.795 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.313 -2.161 -7.909 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -1.540 -2.504 -9.613 1.00 0.00 H new ATOM 0 HG LEU A 78 -0.213 -4.441 -7.701 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -2.389 -5.660 -7.642 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.519 -4.032 -6.935 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -3.135 -4.342 -8.576 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.779 -6.142 -9.409 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -1.450 -4.861 -10.445 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.286 -4.870 -10.054 1.00 0.00 H new ATOM 1259 N TRP A 79 0.106 0.171 -8.822 1.00 0.00 N ATOM 1260 CA TRP A 79 0.013 1.574 -9.216 1.00 0.00 C ATOM 1261 C TRP A 79 1.256 2.061 -9.967 1.00 0.00 C ATOM 1262 O TRP A 79 1.115 2.856 -10.893 1.00 0.00 O ATOM 1263 CB TRP A 79 -0.246 2.417 -7.956 1.00 0.00 C ATOM 1264 CG TRP A 79 -0.248 3.910 -8.117 1.00 0.00 C ATOM 1265 CD1 TRP A 79 -1.327 4.717 -8.249 1.00 0.00 C ATOM 1266 CD2 TRP A 79 0.906 4.801 -8.113 1.00 0.00 C ATOM 1267 NE1 TRP A 79 -0.918 6.038 -8.276 1.00 0.00 N ATOM 1268 CE2 TRP A 79 0.451 6.146 -8.219 1.00 0.00 C ATOM 1269 CE3 TRP A 79 2.296 4.603 -7.985 1.00 0.00 C ATOM 1270 CZ2 TRP A 79 1.327 7.243 -8.207 1.00 0.00 C ATOM 1271 CZ3 TRP A 79 3.184 5.692 -7.973 1.00 0.00 C ATOM 1272 CH2 TRP A 79 2.709 7.012 -8.102 1.00 0.00 C ATOM 0 H TRP A 79 -0.202 0.015 -7.862 1.00 0.00 H new ATOM 0 HA TRP A 79 -0.814 1.685 -9.917 1.00 0.00 H new ATOM 0 HB2 TRP A 79 -1.210 2.121 -7.544 1.00 0.00 H new ATOM 0 HB3 TRP A 79 0.510 2.158 -7.215 1.00 0.00 H new ATOM 0 HD1 TRP A 79 -2.351 4.381 -8.322 1.00 0.00 H new ATOM 0 HE1 TRP A 79 -1.554 6.834 -8.331 1.00 0.00 H new ATOM 0 HE3 TRP A 79 2.684 3.599 -7.895 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 0.944 8.250 -8.277 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 4.244 5.515 -7.864 1.00 0.00 H new ATOM 0 HH2 TRP A 79 3.402 7.840 -8.120 1.00 0.00 H new ATOM 1283 N LEU A 80 2.446 1.558 -9.615 1.00 0.00 N ATOM 1284 CA LEU A 80 3.700 1.878 -10.289 1.00 0.00 C ATOM 1285 C LEU A 80 3.604 1.667 -11.800 1.00 0.00 C ATOM 1286 O LEU A 80 3.987 2.576 -12.537 1.00 0.00 O ATOM 1287 CB LEU A 80 4.868 1.066 -9.698 1.00 0.00 C ATOM 1288 CG LEU A 80 5.641 1.857 -8.631 1.00 0.00 C ATOM 1289 CD1 LEU A 80 6.381 0.884 -7.719 1.00 0.00 C ATOM 1290 CD2 LEU A 80 6.658 2.826 -9.245 1.00 0.00 C ATOM 0 H LEU A 80 2.561 0.906 -8.839 1.00 0.00 H new ATOM 0 HA LEU A 80 3.896 2.936 -10.118 1.00 0.00 H new ATOM 0 HB2 LEU A 80 4.483 0.146 -9.258 1.00 0.00 H new ATOM 0 HB3 LEU A 80 5.549 0.777 -10.498 1.00 0.00 H new ATOM 0 HG LEU A 80 4.913 2.444 -8.071 1.00 0.00 H new ATOM 0 HD11 LEU A 80 6.930 1.442 -6.961 1.00 0.00 H new ATOM 0 HD12 LEU A 80 5.663 0.223 -7.234 1.00 0.00 H new ATOM 0 HD13 LEU A 80 7.079 0.291 -8.310 1.00 0.00 H new ATOM 0 HD21 LEU A 80 7.177 3.360 -8.450 1.00 0.00 H new ATOM 0 HD22 LEU A 80 7.381 2.267 -9.839 1.00 0.00 H new ATOM 0 HD23 LEU A 80 6.140 3.541 -9.884 1.00 0.00 H new ATOM 1302 N SER A 81 3.159 0.492 -12.270 1.00 0.00 N ATOM 1303 CA SER A 81 2.940 0.280 -13.706 1.00 0.00 C ATOM 1304 C SER A 81 1.482 0.483 -14.150 1.00 0.00 C ATOM 1305 O SER A 81 1.238 0.733 -15.329 1.00 0.00 O ATOM 1306 CB SER A 81 3.521 -1.074 -14.143 1.00 0.00 C ATOM 1307 OG SER A 81 4.458 -0.903 -15.197 1.00 0.00 O ATOM 0 H SER A 81 2.946 -0.316 -11.684 1.00 0.00 H new ATOM 0 HA SER A 81 3.486 1.064 -14.231 1.00 0.00 H new ATOM 0 HB2 SER A 81 4.005 -1.558 -13.295 1.00 0.00 H new ATOM 0 HB3 SER A 81 2.716 -1.732 -14.469 1.00 0.00 H new ATOM 0 HG SER A 81 4.818 -1.776 -15.460 1.00 0.00 H new ATOM 1313 N ASP A 82 0.520 0.337 -13.239 1.00 0.00 N ATOM 1314 CA ASP A 82 -0.905 0.193 -13.542 1.00 0.00 C ATOM 1315 C ASP A 82 -1.585 1.560 -13.668 1.00 0.00 C ATOM 1316 O ASP A 82 -2.374 1.781 -14.592 1.00 0.00 O ATOM 1317 CB ASP A 82 -1.563 -0.646 -12.431 1.00 0.00 C ATOM 1318 CG ASP A 82 -3.036 -0.986 -12.671 1.00 0.00 C ATOM 1319 OD1 ASP A 82 -3.857 -0.052 -12.780 1.00 0.00 O ATOM 1320 OD2 ASP A 82 -3.392 -2.184 -12.642 1.00 0.00 O ATOM 0 H ASP A 82 0.716 0.315 -12.238 1.00 0.00 H new ATOM 0 HA ASP A 82 -1.021 -0.312 -14.501 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -1.004 -1.575 -12.317 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -1.478 -0.105 -11.488 1.00 0.00 H new ATOM 1325 N GLN A 83 -1.246 2.475 -12.754 1.00 0.00 N ATOM 1326 CA GLN A 83 -1.817 3.799 -12.503 1.00 0.00 C ATOM 1327 C GLN A 83 -3.312 3.831 -12.126 1.00 0.00 C ATOM 1328 O GLN A 83 -3.804 4.914 -11.817 1.00 0.00 O ATOM 1329 CB GLN A 83 -1.453 4.786 -13.627 1.00 0.00 C ATOM 1330 CG GLN A 83 0.061 5.043 -13.697 1.00 0.00 C ATOM 1331 CD GLN A 83 0.382 6.233 -14.601 1.00 0.00 C ATOM 1332 OE1 GLN A 83 0.062 6.227 -15.786 1.00 0.00 O ATOM 1333 NE2 GLN A 83 1.008 7.280 -14.084 1.00 0.00 N ATOM 0 H GLN A 83 -0.484 2.284 -12.104 1.00 0.00 H new ATOM 0 HA GLN A 83 -1.338 4.138 -11.585 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -1.799 4.391 -14.582 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -1.974 5.729 -13.464 1.00 0.00 H new ATOM 0 HG2 GLN A 83 0.447 5.231 -12.695 1.00 0.00 H new ATOM 0 HG3 GLN A 83 0.566 4.153 -14.071 1.00 0.00 H new ATOM 0 HE21 GLN A 83 1.272 7.281 -13.099 1.00 0.00 H new ATOM 0 HE22 GLN A 83 1.226 8.085 -14.671 1.00 0.00 H new ATOM 1342 N LEU A 84 -4.009 2.688 -12.025 1.00 0.00 N ATOM 1343 CA LEU A 84 -5.416 2.552 -11.627 1.00 0.00 C ATOM 1344 C LEU A 84 -6.342 3.508 -12.372 1.00 0.00 C ATOM 1345 O LEU A 84 -6.684 4.581 -11.873 1.00 0.00 O ATOM 1346 CB LEU A 84 -5.616 2.724 -10.127 1.00 0.00 C ATOM 1347 CG LEU A 84 -5.049 1.557 -9.299 1.00 0.00 C ATOM 1348 CD1 LEU A 84 -3.691 1.917 -8.699 1.00 0.00 C ATOM 1349 CD2 LEU A 84 -6.024 1.217 -8.177 1.00 0.00 C ATOM 0 H LEU A 84 -3.581 1.785 -12.231 1.00 0.00 H new ATOM 0 HA LEU A 84 -5.685 1.532 -11.903 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -5.140 3.651 -9.808 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -6.681 2.824 -9.919 1.00 0.00 H new ATOM 0 HG LEU A 84 -4.917 0.698 -9.957 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -3.314 1.074 -8.119 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -2.989 2.149 -9.500 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -3.799 2.785 -8.049 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -5.627 0.391 -7.588 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -6.159 2.088 -7.536 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -6.984 0.929 -8.604 1.00 0.00 H new ATOM 1361 N GLY A 85 -6.778 3.114 -13.564 1.00 0.00 N ATOM 1362 CA GLY A 85 -7.210 4.076 -14.560 1.00 0.00 C ATOM 1363 C GLY A 85 -8.470 4.898 -14.261 1.00 0.00 C ATOM 1364 O GLY A 85 -8.699 5.908 -14.931 1.00 0.00 O ATOM 0 H GLY A 85 -6.840 2.139 -13.859 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -6.389 4.772 -14.732 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -7.374 3.540 -15.495 1.00 0.00 H new ATOM 1368 N GLN A 86 -9.278 4.523 -13.266 1.00 0.00 N ATOM 1369 CA GLN A 86 -10.258 5.372 -12.631 1.00 0.00 C ATOM 1370 C GLN A 86 -10.072 5.167 -11.133 1.00 0.00 C ATOM 1371 O GLN A 86 -9.341 5.918 -10.481 1.00 0.00 O ATOM 1372 CB GLN A 86 -11.685 5.080 -13.128 1.00 0.00 C ATOM 1373 CG GLN A 86 -11.951 3.747 -13.842 1.00 0.00 C ATOM 1374 CD GLN A 86 -11.690 3.809 -15.344 1.00 0.00 C ATOM 1375 OE1 GLN A 86 -12.297 4.606 -16.055 1.00 0.00 O ATOM 1376 NE2 GLN A 86 -10.829 2.952 -15.871 1.00 0.00 N ATOM 0 H GLN A 86 -9.257 3.581 -12.874 1.00 0.00 H new ATOM 0 HA GLN A 86 -10.113 6.422 -12.885 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -12.354 5.136 -12.269 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -11.971 5.883 -13.807 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -11.321 2.974 -13.402 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -12.986 3.451 -13.671 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -10.331 2.295 -15.270 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -10.664 2.949 -16.878 1.00 0.00 H new ATOM 1385 N ALA A 87 -10.683 4.095 -10.639 1.00 0.00 N ATOM 1386 CA ALA A 87 -10.735 3.588 -9.291 1.00 0.00 C ATOM 1387 C ALA A 87 -11.121 2.116 -9.446 1.00 0.00 C ATOM 1388 O ALA A 87 -11.767 1.749 -10.441 1.00 0.00 O ATOM 1389 CB ALA A 87 -11.808 4.361 -8.519 1.00 0.00 C ATOM 0 H ALA A 87 -11.219 3.492 -11.263 1.00 0.00 H new ATOM 0 HA ALA A 87 -9.797 3.696 -8.746 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -11.860 3.988 -7.496 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -11.555 5.421 -8.507 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -12.775 4.224 -9.004 1.00 0.00 H new ATOM 1395 N VAL A 88 -10.736 1.275 -8.494 1.00 0.00 N ATOM 1396 CA VAL A 88 -10.885 -0.178 -8.584 1.00 0.00 C ATOM 1397 C VAL A 88 -11.183 -0.674 -7.162 1.00 0.00 C ATOM 1398 O VAL A 88 -10.399 -1.421 -6.579 1.00 0.00 O ATOM 1399 CB VAL A 88 -9.603 -0.804 -9.200 1.00 0.00 C ATOM 1400 CG1 VAL A 88 -9.796 -2.283 -9.567 1.00 0.00 C ATOM 1401 CG2 VAL A 88 -9.072 -0.103 -10.469 1.00 0.00 C ATOM 0 H VAL A 88 -10.305 1.585 -7.623 1.00 0.00 H new ATOM 0 HA VAL A 88 -11.701 -0.475 -9.243 1.00 0.00 H new ATOM 0 HB VAL A 88 -8.873 -0.676 -8.401 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -8.873 -2.675 -9.994 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -10.052 -2.850 -8.672 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -10.601 -2.375 -10.297 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -8.176 -0.616 -10.820 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -9.835 -0.132 -11.247 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -8.829 0.934 -10.237 1.00 0.00 H new ATOM 1411 N GLY A 89 -12.275 -0.188 -6.569 1.00 0.00 N ATOM 1412 CA GLY A 89 -12.561 -0.393 -5.153 1.00 0.00 C ATOM 1413 C GLY A 89 -12.376 0.907 -4.391 1.00 0.00 C ATOM 1414 O GLY A 89 -11.236 1.279 -4.103 1.00 0.00 O ATOM 0 H GLY A 89 -12.984 0.358 -7.059 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -13.582 -0.755 -5.029 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -11.900 -1.159 -4.747 1.00 0.00 H new ATOM 1418 N GLN A 90 -13.449 1.642 -4.103 1.00 0.00 N ATOM 1419 CA GLN A 90 -13.373 2.937 -3.426 1.00 0.00 C ATOM 1420 C GLN A 90 -14.560 3.109 -2.483 1.00 0.00 C ATOM 1421 O GLN A 90 -15.628 2.547 -2.738 1.00 0.00 O ATOM 1422 CB GLN A 90 -13.266 4.058 -4.479 1.00 0.00 C ATOM 1423 CG GLN A 90 -14.466 4.222 -5.430 1.00 0.00 C ATOM 1424 CD GLN A 90 -15.516 5.221 -4.946 1.00 0.00 C ATOM 1425 OE1 GLN A 90 -15.597 5.568 -3.770 1.00 0.00 O ATOM 1426 NE2 GLN A 90 -16.332 5.731 -5.850 1.00 0.00 N ATOM 0 H GLN A 90 -14.400 1.355 -4.334 1.00 0.00 H new ATOM 0 HA GLN A 90 -12.478 2.990 -2.805 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -13.112 5.003 -3.958 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -12.375 3.877 -5.081 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -14.101 4.540 -6.406 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -14.941 3.251 -5.568 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -16.260 5.439 -6.825 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -17.034 6.417 -5.574 1.00 0.00 H new ATOM 1435 N GLN A 91 -14.385 3.897 -1.419 1.00 0.00 N ATOM 1436 CA GLN A 91 -15.426 4.272 -0.466 1.00 0.00 C ATOM 1437 C GLN A 91 -15.238 5.738 -0.036 1.00 0.00 C ATOM 1438 O GLN A 91 -14.100 6.226 -0.004 1.00 0.00 O ATOM 1439 CB GLN A 91 -15.380 3.335 0.757 1.00 0.00 C ATOM 1440 CG GLN A 91 -16.188 2.033 0.579 1.00 0.00 C ATOM 1441 CD GLN A 91 -15.383 0.769 0.860 1.00 0.00 C ATOM 1442 OE1 GLN A 91 -15.398 -0.187 0.086 1.00 0.00 O ATOM 1443 NE2 GLN A 91 -14.685 0.700 1.980 1.00 0.00 N ATOM 0 H GLN A 91 -13.479 4.306 -1.191 1.00 0.00 H new ATOM 0 HA GLN A 91 -16.402 4.173 -0.940 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -14.341 3.080 0.968 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -15.760 3.871 1.627 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -17.052 2.058 1.243 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -16.571 1.990 -0.441 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -14.672 1.492 2.622 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -14.159 -0.145 2.202 1.00 0.00 H new ATOM 1452 N PRO A 92 -16.322 6.437 0.342 1.00 0.00 N ATOM 1453 CA PRO A 92 -16.276 7.807 0.828 1.00 0.00 C ATOM 1454 C PRO A 92 -15.796 7.878 2.283 1.00 0.00 C ATOM 1455 O PRO A 92 -15.931 6.917 3.049 1.00 0.00 O ATOM 1456 CB PRO A 92 -17.722 8.297 0.717 1.00 0.00 C ATOM 1457 CG PRO A 92 -18.525 7.036 1.022 1.00 0.00 C ATOM 1458 CD PRO A 92 -17.692 5.953 0.347 1.00 0.00 C ATOM 0 HA PRO A 92 -15.575 8.415 0.256 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -17.935 9.095 1.428 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -17.943 8.688 -0.276 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -18.623 6.865 2.094 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -19.534 7.087 0.614 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -17.769 5.010 0.887 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -18.043 5.768 -0.668 1.00 0.00 H new ATOM 1466 N GLY A 93 -15.313 9.056 2.671 1.00 0.00 N ATOM 1467 CA GLY A 93 -14.908 9.422 4.016 1.00 0.00 C ATOM 1468 C GLY A 93 -15.161 10.916 4.200 1.00 0.00 C ATOM 1469 O GLY A 93 -16.260 11.388 3.891 1.00 0.00 O ATOM 0 H GLY A 93 -15.188 9.823 2.011 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -15.471 8.848 4.752 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -13.854 9.193 4.171 1.00 0.00 H new ATOM 1473 N ALA A 94 -14.186 11.648 4.740 1.00 0.00 N ATOM 1474 CA ALA A 94 -14.063 13.106 4.758 1.00 0.00 C ATOM 1475 C ALA A 94 -12.614 13.406 5.146 1.00 0.00 C ATOM 1476 O ALA A 94 -12.163 12.883 6.170 1.00 0.00 O ATOM 1477 CB ALA A 94 -15.003 13.724 5.797 1.00 0.00 C ATOM 0 H ALA A 94 -13.400 11.202 5.213 1.00 0.00 H new ATOM 0 HA ALA A 94 -14.326 13.525 3.787 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -14.891 14.808 5.789 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -16.034 13.464 5.556 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -14.754 13.341 6.787 1.00 0.00 H new ATOM 1483 N SER A 95 -11.870 14.175 4.343 1.00 0.00 N ATOM 1484 CA SER A 95 -10.425 14.267 4.541 1.00 0.00 C ATOM 1485 C SER A 95 -10.052 15.031 5.817 1.00 0.00 C ATOM 1486 O SER A 95 -9.175 14.573 6.555 1.00 0.00 O ATOM 1487 CB SER A 95 -9.714 14.809 3.293 1.00 0.00 C ATOM 1488 OG SER A 95 -10.231 16.043 2.831 1.00 0.00 O ATOM 0 H SER A 95 -12.236 14.729 3.569 1.00 0.00 H new ATOM 0 HA SER A 95 -10.061 13.251 4.691 1.00 0.00 H new ATOM 0 HB2 SER A 95 -8.654 14.930 3.514 1.00 0.00 H new ATOM 0 HB3 SER A 95 -9.791 14.072 2.494 1.00 0.00 H new ATOM 0 HG SER A 95 -9.733 16.330 2.037 1.00 0.00 H new ATOM 1494 N SER A 96 -10.713 16.161 6.086 1.00 0.00 N ATOM 1495 CA SER A 96 -10.407 17.088 7.173 1.00 0.00 C ATOM 1496 C SER A 96 -8.925 17.522 7.174 1.00 0.00 C ATOM 1497 O SER A 96 -8.131 17.181 6.287 1.00 0.00 O ATOM 1498 CB SER A 96 -10.917 16.507 8.507 1.00 0.00 C ATOM 1499 OG SER A 96 -11.111 17.516 9.486 1.00 0.00 O ATOM 0 H SER A 96 -11.510 16.465 5.526 1.00 0.00 H new ATOM 0 HA SER A 96 -10.944 18.023 7.017 1.00 0.00 H new ATOM 0 HB2 SER A 96 -11.856 15.981 8.338 1.00 0.00 H new ATOM 0 HB3 SER A 96 -10.203 15.773 8.880 1.00 0.00 H new ATOM 0 HG SER A 96 -11.436 17.108 10.316 1.00 0.00 H new ATOM 1505 N GLY A 97 -8.524 18.303 8.174 1.00 0.00 N ATOM 1506 CA GLY A 97 -7.151 18.753 8.363 1.00 0.00 C ATOM 1507 C GLY A 97 -6.762 18.648 9.833 1.00 0.00 C ATOM 1508 O GLY A 97 -7.648 18.610 10.690 1.00 0.00 O ATOM 0 H GLY A 97 -9.162 18.648 8.892 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -6.476 18.150 7.756 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -7.048 19.784 8.025 1.00 0.00 H new ATOM 1512 N PRO A 98 -5.462 18.624 10.162 1.00 0.00 N ATOM 1513 CA PRO A 98 -5.004 18.897 11.510 1.00 0.00 C ATOM 1514 C PRO A 98 -5.319 20.353 11.840 1.00 0.00 C ATOM 1515 O PRO A 98 -4.682 21.265 11.302 1.00 0.00 O ATOM 1516 CB PRO A 98 -3.504 18.605 11.527 1.00 0.00 C ATOM 1517 CG PRO A 98 -3.084 18.737 10.063 1.00 0.00 C ATOM 1518 CD PRO A 98 -4.341 18.369 9.273 1.00 0.00 C ATOM 0 HA PRO A 98 -5.496 18.281 12.263 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -2.967 19.311 12.161 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -3.296 17.607 11.913 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -2.753 19.750 9.834 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -2.256 18.070 9.825 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -4.420 18.966 8.365 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -4.317 17.323 8.966 1.00 0.00 H new ATOM 1526 N SER A 99 -6.286 20.568 12.724 1.00 0.00 N ATOM 1527 CA SER A 99 -6.628 21.867 13.272 1.00 0.00 C ATOM 1528 C SER A 99 -6.671 21.675 14.786 1.00 0.00 C ATOM 1529 O SER A 99 -7.701 21.290 15.337 1.00 0.00 O ATOM 1530 CB SER A 99 -7.932 22.381 12.652 1.00 0.00 C ATOM 1531 OG SER A 99 -7.829 22.412 11.233 1.00 0.00 O ATOM 0 H SER A 99 -6.870 19.816 13.088 1.00 0.00 H new ATOM 0 HA SER A 99 -5.900 22.643 13.035 1.00 0.00 H new ATOM 0 HB2 SER A 99 -8.761 21.739 12.949 1.00 0.00 H new ATOM 0 HB3 SER A 99 -8.152 23.380 13.029 1.00 0.00 H new ATOM 0 HG SER A 99 -8.670 22.741 10.851 1.00 0.00 H new ATOM 1537 N SER A 100 -5.517 21.856 15.432 1.00 0.00 N ATOM 1538 CA SER A 100 -5.221 21.452 16.800 1.00 0.00 C ATOM 1539 C SER A 100 -5.255 19.920 16.958 1.00 0.00 C ATOM 1540 O SER A 100 -5.372 19.155 15.992 1.00 0.00 O ATOM 1541 CB SER A 100 -6.138 22.202 17.786 1.00 0.00 C ATOM 1542 OG SER A 100 -5.509 22.359 19.046 1.00 0.00 O ATOM 0 H SER A 100 -4.723 22.314 14.986 1.00 0.00 H new ATOM 0 HA SER A 100 -4.199 21.739 17.045 1.00 0.00 H new ATOM 0 HB2 SER A 100 -6.393 23.180 17.379 1.00 0.00 H new ATOM 0 HB3 SER A 100 -7.072 21.654 17.908 1.00 0.00 H new ATOM 0 HG SER A 100 -6.109 22.839 19.654 1.00 0.00 H new ATOM 1548 N GLY A 101 -5.061 19.449 18.183 1.00 0.00 N ATOM 1549 CA GLY A 101 -5.049 18.052 18.579 1.00 0.00 C ATOM 1550 C GLY A 101 -4.771 18.041 20.059 1.00 0.00 C ATOM 1551 O GLY A 101 -5.576 18.644 20.802 1.00 0.00 O ATOM 0 H GLY A 101 -4.898 20.073 18.973 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -6.004 17.576 18.358 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -4.284 17.499 18.034 1.00 0.00 H new TER 1555 GLY A 101