USER MOD reduce.3.24.130724 H: found=0, std=0, add=1194, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1197 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 110 THR OG1 : rot 40:sc= 0.387 USER MOD Set 1.2: A 113 LYS NZ :NH3+ -125:sc= -0.523 (180deg=-0.181) USER MOD Set 2.1: A 73 TYR OH : rot -170:sc= 0.0874 USER MOD Set 2.2: A 168 CYS SG : rot 68:sc= 0.851 USER MOD Set 3.1: A 15 ASN : amide:sc= -5.7! C(o=-5.2!,f=-13!) USER MOD Set 3.2: A 63 THR OG1 : rot -113:sc= 0.485 USER MOD Set 4.1: A 58 GLN : amide:sc= -2.34 K(o=-3,f=-7.5!) USER MOD Set 4.2: A 62 GLN :FLIP amide:sc= -0.663 F(o=-3.7,f=-3) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0.00418 USER MOD Single : A 21 HIS :FLIP no HD1:sc= -3.27 F(o=-5.8!,f=-3.3) USER MOD Single : A 25 HIS : no HD1:sc= -0.204 X(o=-0.2,f=-0.061) USER MOD Single : A 28 HIS : no HD1:sc= -0.766 K(o=-0.77,f=-2.2!) USER MOD Single : A 29 TYR OH : rot 110:sc= -1.68 USER MOD Single : A 31 LYS NZ :NH3+ -156:sc= 0.139 (180deg=-0.847) USER MOD Single : A 53 SER OG : rot 120:sc= -0.0684 USER MOD Single : A 54 ASN : amide:sc= -2.29! C(o=-2.3!,f=-11!) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -0.144 K(o=-0.14,f=-3.1!) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 161:sc= -0.0796 (180deg=-0.454) USER MOD Single : A 83 TYR OH : rot 88:sc= -0.947! USER MOD Single : A 88 LYS NZ :NH3+ -136:sc= -0.997 (180deg=-3.06!) USER MOD Single : A 96 GLN :FLIP amide:sc= -0.361 F(o=-1.1,f=-0.36) USER MOD Single : A 97 SER OG : rot -124:sc= -0.242 USER MOD Single : A 98 GLN : amide:sc= -0.134 K(o=-0.13,f=-0.75) USER MOD Single : A 99 GLN : amide:sc= -1.42 X(o=-1.4,f=-1.7) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 ASN :FLIP amide:sc= 0.0879 F(o=-2.1,f=0.088) USER MOD Single : A 109 HIS : no HD1:sc= -0.137 X(o=-0.14,f=0.00064) USER MOD Single : A 123 HIS : no HD1:sc= -0.381 X(o=-0.38,f=-0.12) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot -78:sc= 0.685 USER MOD Single : A 127 HIS : no HD1:sc= -0.636 K(o=-0.64,f=-4!) USER MOD Single : A 134 SER OG : rot 180:sc= -0.287 USER MOD Single : A 136 LYS NZ :NH3+ -114:sc= -1.33 (180deg=-1.82) USER MOD Single : A 137 LYS NZ :NH3+ -154:sc= -0.196 (180deg=-0.812) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.616 X(o=-0.62,f=-0.32) USER MOD Single : A 147 SER OG : rot 180:sc= -0.145 USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 SER OG : rot 80:sc= 0.712 USER MOD Single : A 159 LYS NZ :NH3+ 164:sc= -0.0321 (180deg=-0.271) USER MOD Single : A 161 TYR OH : rot 180:sc= 0 USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 164 ASN : amide:sc= -3.91 K(o=-3.9,f=-9!) USER MOD Single : A 166 LYS NZ :NH3+ 167:sc= -2.46! (180deg=-3.12!) USER MOD Single : A 173 MET CE :methyl -148:sc= -0.529 (180deg=-2.02) USER MOD Single : A 174 LYS NZ :NH3+ -151:sc= -0.185 (180deg=-0.921) USER MOD Single : A 176 THR OG1 : rot 180:sc= -0.604 USER MOD ----------------------------------------------------------------- ATOM 55 N LEU A 6 12.499 12.201 -3.436 1.00 0.41 N ATOM 56 CA LEU A 6 11.932 10.892 -3.138 1.00 0.33 C ATOM 57 C LEU A 6 11.887 10.031 -4.396 1.00 0.26 C ATOM 58 O LEU A 6 12.224 8.846 -4.375 1.00 0.25 O ATOM 59 CB LEU A 6 10.521 11.061 -2.549 1.00 0.29 C ATOM 60 CG LEU A 6 9.794 9.760 -2.164 1.00 0.28 C ATOM 61 CD1 LEU A 6 10.669 8.859 -1.306 1.00 0.36 C ATOM 62 CD2 LEU A 6 8.471 10.037 -1.450 1.00 0.30 C ATOM 0 HA LEU A 6 12.564 10.390 -2.406 1.00 0.33 H new ATOM 0 HB2 LEU A 6 10.591 11.691 -1.663 1.00 0.29 H new ATOM 0 HB3 LEU A 6 9.907 11.597 -3.273 1.00 0.29 H new ATOM 0 HG LEU A 6 9.576 9.241 -3.098 1.00 0.28 H new ATOM 0 HD11 LEU A 6 10.120 7.951 -1.055 1.00 0.36 H new ATOM 0 HD12 LEU A 6 11.572 8.597 -1.857 1.00 0.36 H new ATOM 0 HD13 LEU A 6 10.942 9.383 -0.390 1.00 0.36 H new ATOM 0 HD21 LEU A 6 7.990 9.092 -1.196 1.00 0.30 H new ATOM 0 HD22 LEU A 6 8.661 10.604 -0.539 1.00 0.30 H new ATOM 0 HD23 LEU A 6 7.817 10.612 -2.106 1.00 0.30 H new ATOM 74 N ALA A 7 11.454 10.646 -5.484 1.00 0.26 N ATOM 75 CA ALA A 7 11.373 9.981 -6.778 1.00 0.26 C ATOM 76 C ALA A 7 12.725 9.398 -7.185 1.00 0.25 C ATOM 77 O ALA A 7 12.800 8.509 -8.030 1.00 0.28 O ATOM 78 CB ALA A 7 10.895 10.970 -7.838 1.00 0.33 C ATOM 0 H ALA A 7 11.149 11.619 -5.497 1.00 0.26 H new ATOM 0 HA ALA A 7 10.660 9.160 -6.695 1.00 0.26 H new ATOM 0 HB1 ALA A 7 10.836 10.468 -8.804 1.00 0.33 H new ATOM 0 HB2 ALA A 7 9.910 11.348 -7.565 1.00 0.33 H new ATOM 0 HB3 ALA A 7 11.597 11.801 -7.903 1.00 0.33 H new ATOM 84 N ASP A 8 13.793 9.922 -6.592 1.00 0.26 N ATOM 85 CA ASP A 8 15.145 9.478 -6.916 1.00 0.28 C ATOM 86 C ASP A 8 15.458 8.115 -6.303 1.00 0.26 C ATOM 87 O ASP A 8 16.393 7.440 -6.734 1.00 0.34 O ATOM 88 CB ASP A 8 16.168 10.513 -6.437 1.00 0.32 C ATOM 89 CG ASP A 8 17.570 10.214 -6.931 1.00 1.10 C ATOM 90 OD1 ASP A 8 17.930 10.696 -8.026 1.00 0.91 O ATOM 91 OD2 ASP A 8 18.308 9.498 -6.222 1.00 2.09 O ATOM 0 H ASP A 8 13.749 10.655 -5.884 1.00 0.26 H new ATOM 0 HA ASP A 8 15.207 9.377 -8.000 1.00 0.28 H new ATOM 0 HB2 ASP A 8 15.868 11.503 -6.782 1.00 0.32 H new ATOM 0 HB3 ASP A 8 16.168 10.542 -5.347 1.00 0.32 H new ATOM 96 N LYS A 9 14.681 7.706 -5.301 1.00 0.23 N ATOM 97 CA LYS A 9 14.915 6.416 -4.653 1.00 0.23 C ATOM 98 C LYS A 9 13.892 5.376 -5.104 1.00 0.19 C ATOM 99 O LYS A 9 14.175 4.177 -5.067 1.00 0.20 O ATOM 100 CB LYS A 9 14.883 6.547 -3.115 1.00 0.28 C ATOM 101 CG LYS A 9 15.242 7.950 -2.600 1.00 0.45 C ATOM 102 CD LYS A 9 16.710 8.302 -2.884 1.00 1.04 C ATOM 103 CE LYS A 9 17.090 9.671 -2.313 1.00 1.27 C ATOM 104 NZ LYS A 9 18.491 10.040 -2.659 1.00 1.99 N ATOM 0 H LYS A 9 13.897 8.239 -4.925 1.00 0.23 H new ATOM 0 HA LYS A 9 15.908 6.082 -4.954 1.00 0.23 H new ATOM 0 HB2 LYS A 9 13.887 6.284 -2.759 1.00 0.28 H new ATOM 0 HB3 LYS A 9 15.576 5.825 -2.684 1.00 0.28 H new ATOM 0 HG2 LYS A 9 14.593 8.688 -3.072 1.00 0.45 H new ATOM 0 HG3 LYS A 9 15.056 8.002 -1.527 1.00 0.45 H new ATOM 0 HD2 LYS A 9 17.356 7.537 -2.454 1.00 1.04 H new ATOM 0 HD3 LYS A 9 16.883 8.297 -3.960 1.00 1.04 H new ATOM 0 HE2 LYS A 9 16.408 10.429 -2.699 1.00 1.27 H new ATOM 0 HE3 LYS A 9 16.973 9.659 -1.229 1.00 1.27 H new ATOM 0 HZ1 LYS A 9 18.714 10.973 -2.256 1.00 1.99 H new ATOM 0 HZ2 LYS A 9 19.143 9.330 -2.270 1.00 1.99 H new ATOM 0 HZ3 LYS A 9 18.595 10.076 -3.693 1.00 1.99 H new ATOM 118 N VAL A 10 12.703 5.826 -5.515 1.00 0.18 N ATOM 119 CA VAL A 10 11.659 4.907 -5.971 1.00 0.17 C ATOM 120 C VAL A 10 12.217 3.822 -6.878 1.00 0.17 C ATOM 121 O VAL A 10 13.144 4.064 -7.654 1.00 0.19 O ATOM 122 CB VAL A 10 10.545 5.635 -6.744 1.00 0.18 C ATOM 123 CG1 VAL A 10 11.062 6.114 -8.101 1.00 0.21 C ATOM 124 CG2 VAL A 10 9.339 4.711 -6.934 1.00 0.21 C ATOM 0 H VAL A 10 12.442 6.812 -5.541 1.00 0.18 H new ATOM 0 HA VAL A 10 11.249 4.461 -5.065 1.00 0.17 H new ATOM 0 HB VAL A 10 10.233 6.504 -6.164 1.00 0.18 H new ATOM 0 HG11 VAL A 10 10.262 6.627 -8.635 1.00 0.21 H new ATOM 0 HG12 VAL A 10 11.896 6.800 -7.951 1.00 0.21 H new ATOM 0 HG13 VAL A 10 11.397 5.257 -8.686 1.00 0.21 H new ATOM 0 HG21 VAL A 10 8.559 5.239 -7.482 1.00 0.21 H new ATOM 0 HG22 VAL A 10 9.642 3.827 -7.496 1.00 0.21 H new ATOM 0 HG23 VAL A 10 8.956 4.408 -5.960 1.00 0.21 H new ATOM 134 N ILE A 11 11.657 2.623 -6.778 1.00 0.18 N ATOM 135 CA ILE A 11 12.099 1.529 -7.632 1.00 0.21 C ATOM 136 C ILE A 11 10.913 0.746 -8.159 1.00 0.19 C ATOM 137 O ILE A 11 10.997 0.107 -9.209 1.00 0.20 O ATOM 138 CB ILE A 11 13.044 0.562 -6.892 1.00 0.26 C ATOM 139 CG1 ILE A 11 12.521 0.322 -5.480 1.00 0.63 C ATOM 140 CG2 ILE A 11 14.469 1.117 -6.849 1.00 0.86 C ATOM 141 CD1 ILE A 11 13.125 -0.891 -4.809 1.00 0.76 C ATOM 0 H ILE A 11 10.909 2.386 -6.126 1.00 0.18 H new ATOM 0 HA ILE A 11 12.644 1.982 -8.460 1.00 0.21 H new ATOM 0 HB ILE A 11 13.072 -0.385 -7.431 1.00 0.26 H new ATOM 0 HG12 ILE A 11 12.725 1.203 -4.871 1.00 0.63 H new ATOM 0 HG13 ILE A 11 11.438 0.204 -5.518 1.00 0.63 H new ATOM 0 HG21 ILE A 11 15.117 0.416 -6.322 1.00 0.86 H new ATOM 0 HG22 ILE A 11 14.836 1.256 -7.866 1.00 0.86 H new ATOM 0 HG23 ILE A 11 14.471 2.075 -6.329 1.00 0.86 H new ATOM 0 HD11 ILE A 11 12.707 -0.999 -3.808 1.00 0.76 H new ATOM 0 HD12 ILE A 11 12.899 -1.782 -5.395 1.00 0.76 H new ATOM 0 HD13 ILE A 11 14.206 -0.768 -4.739 1.00 0.76 H new ATOM 153 N TRP A 12 9.804 0.801 -7.431 1.00 0.18 N ATOM 154 CA TRP A 12 8.606 0.082 -7.833 1.00 0.18 C ATOM 155 C TRP A 12 7.432 0.501 -6.942 1.00 0.17 C ATOM 156 O TRP A 12 7.597 0.672 -5.736 1.00 0.22 O ATOM 157 CB TRP A 12 8.898 -1.421 -7.737 1.00 0.20 C ATOM 158 CG TRP A 12 7.819 -2.309 -8.255 1.00 0.21 C ATOM 159 CD1 TRP A 12 7.806 -3.008 -9.427 1.00 0.27 C ATOM 160 CD2 TRP A 12 6.604 -2.614 -7.592 1.00 0.21 C ATOM 161 NE1 TRP A 12 6.640 -3.725 -9.528 1.00 0.28 N ATOM 162 CE2 TRP A 12 5.884 -3.496 -8.412 1.00 0.24 C ATOM 163 CE3 TRP A 12 6.059 -2.214 -6.381 1.00 0.23 C ATOM 164 CZ2 TRP A 12 4.639 -3.991 -8.053 1.00 0.26 C ATOM 165 CZ3 TRP A 12 4.828 -2.698 -6.017 1.00 0.27 C ATOM 166 CH2 TRP A 12 4.120 -3.581 -6.849 1.00 0.27 C ATOM 0 H TRP A 12 9.711 1.333 -6.565 1.00 0.18 H new ATOM 0 HA TRP A 12 8.329 0.318 -8.860 1.00 0.18 H new ATOM 0 HB2 TRP A 12 9.816 -1.633 -8.285 1.00 0.20 H new ATOM 0 HB3 TRP A 12 9.085 -1.673 -6.693 1.00 0.20 H new ATOM 0 HD1 TRP A 12 8.595 -2.998 -10.164 1.00 0.27 H new ATOM 0 HE1 TRP A 12 6.380 -4.329 -10.308 1.00 0.28 H new ATOM 0 HE3 TRP A 12 6.594 -1.533 -5.736 1.00 0.23 H new ATOM 0 HZ2 TRP A 12 4.099 -4.672 -8.695 1.00 0.26 H new ATOM 0 HZ3 TRP A 12 4.396 -2.395 -5.075 1.00 0.27 H new ATOM 0 HH2 TRP A 12 3.152 -3.944 -6.537 1.00 0.27 H new ATOM 177 N ALA A 13 6.249 0.683 -7.530 1.00 0.18 N ATOM 178 CA ALA A 13 5.082 1.111 -6.753 1.00 0.18 C ATOM 179 C ALA A 13 3.771 0.781 -7.454 1.00 0.18 C ATOM 180 O ALA A 13 3.681 0.860 -8.680 1.00 0.19 O ATOM 181 CB ALA A 13 5.160 2.615 -6.506 1.00 0.20 C ATOM 0 H ALA A 13 6.073 0.544 -8.525 1.00 0.18 H new ATOM 0 HA ALA A 13 5.098 0.567 -5.808 1.00 0.18 H new ATOM 0 HB1 ALA A 13 4.293 2.934 -5.928 1.00 0.20 H new ATOM 0 HB2 ALA A 13 6.070 2.846 -5.952 1.00 0.20 H new ATOM 0 HB3 ALA A 13 5.173 3.140 -7.461 1.00 0.20 H new ATOM 187 N VAL A 14 2.747 0.414 -6.674 1.00 0.18 N ATOM 188 CA VAL A 14 1.451 0.099 -7.260 1.00 0.20 C ATOM 189 C VAL A 14 0.264 0.443 -6.372 1.00 0.20 C ATOM 190 O VAL A 14 0.222 0.094 -5.187 1.00 0.23 O ATOM 191 CB VAL A 14 1.340 -1.390 -7.672 1.00 0.25 C ATOM 192 CG1 VAL A 14 -0.087 -1.909 -7.503 1.00 0.55 C ATOM 193 CG2 VAL A 14 1.759 -1.582 -9.118 1.00 0.67 C ATOM 0 H VAL A 14 2.793 0.331 -5.658 1.00 0.18 H new ATOM 0 HA VAL A 14 1.404 0.736 -8.143 1.00 0.20 H new ATOM 0 HB VAL A 14 2.006 -1.952 -7.018 1.00 0.25 H new ATOM 0 HG11 VAL A 14 -0.131 -2.957 -7.801 1.00 0.55 H new ATOM 0 HG12 VAL A 14 -0.387 -1.815 -6.459 1.00 0.55 H new ATOM 0 HG13 VAL A 14 -0.763 -1.326 -8.128 1.00 0.55 H new ATOM 0 HG21 VAL A 14 1.673 -2.635 -9.385 1.00 0.67 H new ATOM 0 HG22 VAL A 14 1.113 -0.989 -9.766 1.00 0.67 H new ATOM 0 HG23 VAL A 14 2.793 -1.259 -9.243 1.00 0.67 H new ATOM 203 N ASN A 15 -0.710 1.128 -6.966 1.00 0.19 N ATOM 204 CA ASN A 15 -1.935 1.441 -6.260 1.00 0.20 C ATOM 205 C ASN A 15 -3.082 0.720 -6.920 1.00 0.21 C ATOM 206 O ASN A 15 -3.743 1.250 -7.813 1.00 0.24 O ATOM 207 CB ASN A 15 -2.240 2.944 -6.166 1.00 0.21 C ATOM 208 CG ASN A 15 -3.500 3.200 -5.369 1.00 0.37 C ATOM 209 OD1 ASN A 15 -3.462 3.329 -4.148 1.00 1.27 O ATOM 210 ND2 ASN A 15 -4.632 3.268 -6.060 1.00 1.11 N ATOM 0 H ASN A 15 -0.670 1.471 -7.926 1.00 0.19 H new ATOM 0 HA ASN A 15 -1.800 1.104 -5.232 1.00 0.20 H new ATOM 0 HB2 ASN A 15 -1.401 3.459 -5.699 1.00 0.21 H new ATOM 0 HB3 ASN A 15 -2.350 3.358 -7.168 1.00 0.21 H new ATOM 0 HD21 ASN A 15 -5.515 3.433 -5.577 1.00 1.11 H new ATOM 0 HD22 ASN A 15 -4.618 3.155 -7.074 1.00 1.11 H new ATOM 217 N ALA A 16 -3.315 -0.496 -6.465 1.00 0.26 N ATOM 218 CA ALA A 16 -4.366 -1.312 -7.019 1.00 0.31 C ATOM 219 C ALA A 16 -5.712 -0.633 -6.830 1.00 0.30 C ATOM 220 O ALA A 16 -6.234 -0.549 -5.703 1.00 0.31 O ATOM 221 CB ALA A 16 -4.349 -2.702 -6.384 1.00 0.37 C ATOM 0 H ALA A 16 -2.787 -0.937 -5.712 1.00 0.26 H new ATOM 0 HA ALA A 16 -4.197 -1.432 -8.089 1.00 0.31 H new ATOM 0 HB1 ALA A 16 -5.148 -3.307 -6.812 1.00 0.37 H new ATOM 0 HB2 ALA A 16 -3.388 -3.179 -6.578 1.00 0.37 H new ATOM 0 HB3 ALA A 16 -4.498 -2.612 -5.308 1.00 0.37 H new ATOM 227 N GLY A 17 -6.233 -0.098 -7.940 1.00 0.36 N ATOM 228 CA GLY A 17 -7.530 0.565 -7.915 1.00 0.42 C ATOM 229 C GLY A 17 -7.791 1.473 -9.103 1.00 0.43 C ATOM 230 O GLY A 17 -8.854 1.403 -9.720 1.00 0.67 O ATOM 0 H GLY A 17 -5.779 -0.113 -8.853 1.00 0.36 H new ATOM 0 HA2 GLY A 17 -8.312 -0.193 -7.874 1.00 0.42 H new ATOM 0 HA3 GLY A 17 -7.607 1.152 -7.000 1.00 0.42 H new ATOM 234 N GLY A 18 -6.828 2.323 -9.424 1.00 0.60 N ATOM 235 CA GLY A 18 -7.001 3.260 -10.527 1.00 0.71 C ATOM 236 C GLY A 18 -6.234 2.883 -11.777 1.00 0.71 C ATOM 237 O GLY A 18 -6.315 1.749 -12.249 1.00 1.12 O ATOM 0 H GLY A 18 -5.930 2.385 -8.945 1.00 0.60 H new ATOM 0 HA2 GLY A 18 -8.061 3.329 -10.770 1.00 0.71 H new ATOM 0 HA3 GLY A 18 -6.683 4.251 -10.202 1.00 0.71 H new ATOM 241 N GLU A 19 -5.504 3.856 -12.326 1.00 0.43 N ATOM 242 CA GLU A 19 -4.703 3.647 -13.528 1.00 0.44 C ATOM 243 C GLU A 19 -3.508 4.595 -13.563 1.00 0.38 C ATOM 244 O GLU A 19 -3.682 5.813 -13.574 1.00 0.50 O ATOM 245 CB GLU A 19 -5.554 3.861 -14.785 1.00 0.59 C ATOM 246 CG GLU A 19 -6.502 2.706 -15.093 1.00 1.32 C ATOM 247 CD GLU A 19 -7.407 2.995 -16.274 1.00 1.63 C ATOM 248 OE1 GLU A 19 -8.262 3.899 -16.160 1.00 2.02 O ATOM 249 OE2 GLU A 19 -7.264 2.319 -17.314 1.00 1.88 O ATOM 0 H GLU A 19 -5.453 4.803 -11.951 1.00 0.43 H new ATOM 0 HA GLU A 19 -4.339 2.620 -13.506 1.00 0.44 H new ATOM 0 HB2 GLU A 19 -6.136 4.775 -14.666 1.00 0.59 H new ATOM 0 HB3 GLU A 19 -4.893 4.013 -15.638 1.00 0.59 H new ATOM 0 HG2 GLU A 19 -5.920 1.807 -15.297 1.00 1.32 H new ATOM 0 HG3 GLU A 19 -7.112 2.497 -14.214 1.00 1.32 H new ATOM 256 N SER A 20 -2.307 4.011 -13.592 1.00 0.35 N ATOM 257 CA SER A 20 -1.043 4.760 -13.647 1.00 0.33 C ATOM 258 C SER A 20 -1.156 6.182 -13.094 1.00 0.29 C ATOM 259 O SER A 20 -1.626 7.084 -13.789 1.00 0.36 O ATOM 260 CB SER A 20 -0.533 4.809 -15.092 1.00 0.43 C ATOM 261 OG SER A 20 -0.151 3.522 -15.541 1.00 1.22 O ATOM 0 H SER A 20 -2.181 2.999 -13.578 1.00 0.35 H new ATOM 0 HA SER A 20 -0.337 4.229 -13.008 1.00 0.33 H new ATOM 0 HB2 SER A 20 -1.311 5.208 -15.742 1.00 0.43 H new ATOM 0 HB3 SER A 20 0.317 5.488 -15.158 1.00 0.43 H new ATOM 0 HG SER A 20 0.169 3.580 -16.466 1.00 1.22 H new ATOM 267 N HIS A 21 -0.700 6.398 -11.855 1.00 0.23 N ATOM 268 CA HIS A 21 -0.775 7.747 -11.268 1.00 0.23 C ATOM 269 C HIS A 21 0.582 8.223 -10.756 1.00 0.21 C ATOM 270 O HIS A 21 1.418 7.430 -10.343 1.00 0.34 O ATOM 271 CB HIS A 21 -1.810 7.794 -10.131 1.00 0.32 C ATOM 272 CG HIS A 21 -1.795 9.069 -9.340 1.00 0.28 C ATOM 273 ND1 HIS A 21 -0.912 9.526 -8.420 1.00 0.31 N flip ATOM 274 CD2 HIS A 21 -2.773 10.034 -9.430 1.00 0.30 C flip ATOM 275 CE1 HIS A 21 -1.364 10.735 -7.977 1.00 0.31 C flip ATOM 276 NE2 HIS A 21 -2.485 11.022 -8.598 1.00 0.29 N flip ATOM 0 H HIS A 21 -0.288 5.685 -11.254 1.00 0.23 H new ATOM 0 HA HIS A 21 -1.089 8.422 -12.064 1.00 0.23 H new ATOM 0 HB2 HIS A 21 -2.805 7.653 -10.554 1.00 0.32 H new ATOM 0 HB3 HIS A 21 -1.630 6.958 -9.455 1.00 0.32 H new ATOM 0 HD2 HIS A 21 -3.637 9.991 -10.076 1.00 0.30 H new ATOM 0 HE1 HIS A 21 -0.879 11.354 -7.237 1.00 0.31 H new ATOM 0 HE2 HIS A 21 -3.041 11.866 -8.462 1.00 0.29 H new ATOM 285 N VAL A 22 0.778 9.539 -10.784 1.00 0.21 N ATOM 286 CA VAL A 22 2.017 10.154 -10.319 1.00 0.22 C ATOM 287 C VAL A 22 1.755 11.062 -9.119 1.00 0.21 C ATOM 288 O VAL A 22 1.217 12.161 -9.265 1.00 0.27 O ATOM 289 CB VAL A 22 2.673 10.971 -11.450 1.00 0.34 C ATOM 290 CG1 VAL A 22 3.787 11.868 -10.905 1.00 0.92 C ATOM 291 CG2 VAL A 22 3.220 10.042 -12.533 1.00 1.18 C ATOM 0 H VAL A 22 0.086 10.205 -11.128 1.00 0.21 H new ATOM 0 HA VAL A 22 2.693 9.355 -10.016 1.00 0.22 H new ATOM 0 HB VAL A 22 1.908 11.610 -11.891 1.00 0.34 H new ATOM 0 HG11 VAL A 22 4.233 12.433 -11.724 1.00 0.92 H new ATOM 0 HG12 VAL A 22 3.372 12.559 -10.171 1.00 0.92 H new ATOM 0 HG13 VAL A 22 4.551 11.252 -10.431 1.00 0.92 H new ATOM 0 HG21 VAL A 22 3.679 10.635 -13.323 1.00 1.18 H new ATOM 0 HG22 VAL A 22 3.966 9.376 -12.099 1.00 1.18 H new ATOM 0 HG23 VAL A 22 2.405 9.450 -12.951 1.00 1.18 H new ATOM 301 N ASP A 23 2.136 10.597 -7.928 1.00 0.20 N ATOM 302 CA ASP A 23 1.934 11.373 -6.708 1.00 0.22 C ATOM 303 C ASP A 23 2.855 12.583 -6.692 1.00 0.23 C ATOM 304 O ASP A 23 3.925 12.553 -7.303 1.00 0.23 O ATOM 305 CB ASP A 23 2.176 10.506 -5.458 1.00 0.26 C ATOM 306 CG ASP A 23 3.236 11.086 -4.542 1.00 0.70 C ATOM 307 OD1 ASP A 23 2.879 11.882 -3.649 1.00 1.17 O ATOM 308 OD2 ASP A 23 4.422 10.742 -4.719 1.00 0.94 O ATOM 0 H ASP A 23 2.584 9.692 -7.785 1.00 0.20 H new ATOM 0 HA ASP A 23 0.899 11.716 -6.692 1.00 0.22 H new ATOM 0 HB2 ASP A 23 1.242 10.402 -4.906 1.00 0.26 H new ATOM 0 HB3 ASP A 23 2.477 9.505 -5.767 1.00 0.26 H new ATOM 313 N VAL A 24 2.438 13.620 -5.964 1.00 0.26 N ATOM 314 CA VAL A 24 3.185 14.876 -5.865 1.00 0.28 C ATOM 315 C VAL A 24 4.685 14.666 -5.653 1.00 0.27 C ATOM 316 O VAL A 24 5.498 15.244 -6.376 1.00 0.31 O ATOM 317 CB VAL A 24 2.636 15.769 -4.722 1.00 0.32 C ATOM 318 CG1 VAL A 24 1.290 16.386 -5.110 1.00 0.58 C ATOM 319 CG2 VAL A 24 2.481 14.965 -3.432 1.00 0.60 C ATOM 0 H VAL A 24 1.572 13.613 -5.426 1.00 0.26 H new ATOM 0 HA VAL A 24 3.046 15.374 -6.825 1.00 0.28 H new ATOM 0 HB VAL A 24 3.355 16.571 -4.554 1.00 0.32 H new ATOM 0 HG11 VAL A 24 0.926 17.008 -4.292 1.00 0.58 H new ATOM 0 HG12 VAL A 24 1.414 16.998 -6.004 1.00 0.58 H new ATOM 0 HG13 VAL A 24 0.570 15.592 -5.311 1.00 0.58 H new ATOM 0 HG21 VAL A 24 2.095 15.612 -2.644 1.00 0.60 H new ATOM 0 HG22 VAL A 24 1.787 14.141 -3.598 1.00 0.60 H new ATOM 0 HG23 VAL A 24 3.451 14.568 -3.132 1.00 0.60 H new ATOM 329 N HIS A 25 5.057 13.840 -4.677 1.00 0.31 N ATOM 330 CA HIS A 25 6.469 13.595 -4.395 1.00 0.31 C ATOM 331 C HIS A 25 7.165 13.031 -5.629 1.00 0.31 C ATOM 332 O HIS A 25 8.391 13.043 -5.732 1.00 0.40 O ATOM 333 CB HIS A 25 6.628 12.634 -3.212 1.00 0.29 C ATOM 334 CG HIS A 25 5.845 13.039 -2.000 1.00 0.32 C ATOM 335 ND1 HIS A 25 6.149 14.155 -1.249 1.00 0.42 N ATOM 336 CD2 HIS A 25 4.765 12.473 -1.410 1.00 0.35 C ATOM 337 CE1 HIS A 25 5.291 14.258 -0.250 1.00 0.46 C ATOM 338 NE2 HIS A 25 4.440 13.251 -0.325 1.00 0.42 N ATOM 0 H HIS A 25 4.408 13.334 -4.074 1.00 0.31 H new ATOM 0 HA HIS A 25 6.935 14.545 -4.131 1.00 0.31 H new ATOM 0 HB2 HIS A 25 6.314 11.637 -3.520 1.00 0.29 H new ATOM 0 HB3 HIS A 25 7.683 12.569 -2.947 1.00 0.29 H new ATOM 0 HD2 HIS A 25 4.255 11.577 -1.732 1.00 0.35 H new ATOM 0 HE1 HIS A 25 5.286 15.034 0.501 1.00 0.46 H new ATOM 0 HE2 HIS A 25 3.667 13.079 0.318 1.00 0.42 H new ATOM 347 N GLY A 26 6.359 12.541 -6.558 1.00 0.28 N ATOM 348 CA GLY A 26 6.874 11.981 -7.791 1.00 0.29 C ATOM 349 C GLY A 26 6.909 10.470 -7.759 1.00 0.27 C ATOM 350 O GLY A 26 7.806 9.849 -8.329 1.00 0.29 O ATOM 0 H GLY A 26 5.342 12.521 -6.478 1.00 0.28 H new ATOM 0 HA2 GLY A 26 6.255 12.311 -8.625 1.00 0.29 H new ATOM 0 HA3 GLY A 26 7.879 12.363 -7.970 1.00 0.29 H new ATOM 354 N ILE A 27 5.925 9.877 -7.092 1.00 0.24 N ATOM 355 CA ILE A 27 5.852 8.417 -6.991 1.00 0.23 C ATOM 356 C ILE A 27 4.773 7.880 -7.932 1.00 0.23 C ATOM 357 O ILE A 27 3.603 8.232 -7.817 1.00 0.29 O ATOM 358 CB ILE A 27 5.611 7.952 -5.532 1.00 0.21 C ATOM 359 CG1 ILE A 27 6.819 8.260 -4.639 1.00 0.23 C ATOM 360 CG2 ILE A 27 5.348 6.455 -5.463 1.00 0.22 C ATOM 361 CD1 ILE A 27 8.092 7.605 -5.103 1.00 0.43 C ATOM 0 H ILE A 27 5.172 10.375 -6.616 1.00 0.24 H new ATOM 0 HA ILE A 27 6.815 8.007 -7.296 1.00 0.23 H new ATOM 0 HB ILE A 27 4.738 8.499 -5.177 1.00 0.21 H new ATOM 0 HG12 ILE A 27 6.968 9.339 -4.602 1.00 0.23 H new ATOM 0 HG13 ILE A 27 6.602 7.933 -3.622 1.00 0.23 H new ATOM 0 HG21 ILE A 27 5.183 6.162 -4.426 1.00 0.22 H new ATOM 0 HG22 ILE A 27 4.464 6.213 -6.053 1.00 0.22 H new ATOM 0 HG23 ILE A 27 6.208 5.916 -5.860 1.00 0.22 H new ATOM 0 HD11 ILE A 27 8.904 7.867 -4.425 1.00 0.43 H new ATOM 0 HD12 ILE A 27 7.962 6.523 -5.113 1.00 0.43 H new ATOM 0 HD13 ILE A 27 8.334 7.951 -6.108 1.00 0.43 H new ATOM 373 N HIS A 28 5.182 7.008 -8.850 1.00 0.22 N ATOM 374 CA HIS A 28 4.278 6.475 -9.869 1.00 0.22 C ATOM 375 C HIS A 28 3.733 5.077 -9.568 1.00 0.23 C ATOM 376 O HIS A 28 4.459 4.185 -9.135 1.00 0.27 O ATOM 377 CB HIS A 28 5.017 6.459 -11.210 1.00 0.25 C ATOM 378 CG HIS A 28 4.167 6.090 -12.387 1.00 0.32 C ATOM 379 ND1 HIS A 28 3.769 7.003 -13.341 1.00 0.38 N ATOM 380 CD2 HIS A 28 3.654 4.898 -12.774 1.00 0.50 C ATOM 381 CE1 HIS A 28 3.049 6.389 -14.262 1.00 0.43 C ATOM 382 NE2 HIS A 28 2.964 5.112 -13.942 1.00 0.52 N ATOM 0 H HIS A 28 6.137 6.654 -8.910 1.00 0.22 H new ATOM 0 HA HIS A 28 3.407 7.130 -9.890 1.00 0.22 H new ATOM 0 HB2 HIS A 28 5.447 7.445 -11.384 1.00 0.25 H new ATOM 0 HB3 HIS A 28 5.847 5.756 -11.144 1.00 0.25 H new ATOM 0 HD2 HIS A 28 3.767 3.955 -12.260 1.00 0.50 H new ATOM 0 HE1 HIS A 28 2.605 6.853 -15.130 1.00 0.43 H new ATOM 0 HE2 HIS A 28 2.466 4.399 -14.476 1.00 0.52 H new ATOM 391 N TYR A 29 2.429 4.917 -9.822 1.00 0.24 N ATOM 392 CA TYR A 29 1.742 3.629 -9.660 1.00 0.28 C ATOM 393 C TYR A 29 1.570 3.002 -11.037 1.00 0.31 C ATOM 394 O TYR A 29 1.105 3.665 -11.961 1.00 0.40 O ATOM 395 CB TYR A 29 0.364 3.797 -8.936 1.00 0.33 C ATOM 396 CG TYR A 29 -0.842 3.076 -9.576 1.00 0.98 C ATOM 397 CD1 TYR A 29 -0.735 1.772 -10.070 1.00 1.34 C ATOM 398 CD2 TYR A 29 -2.075 3.710 -9.729 1.00 1.39 C ATOM 399 CE1 TYR A 29 -1.813 1.140 -10.673 1.00 2.00 C ATOM 400 CE2 TYR A 29 -3.145 3.083 -10.336 1.00 2.05 C ATOM 401 CZ TYR A 29 -3.043 1.738 -10.665 1.00 2.32 C ATOM 402 OH TYR A 29 -4.077 1.191 -11.406 1.00 3.00 O ATOM 0 H TYR A 29 1.823 5.671 -10.144 1.00 0.24 H new ATOM 0 HA TYR A 29 2.343 2.974 -9.029 1.00 0.28 H new ATOM 0 HB2 TYR A 29 0.471 3.440 -7.912 1.00 0.33 H new ATOM 0 HB3 TYR A 29 0.135 4.861 -8.880 1.00 0.33 H new ATOM 0 HD1 TYR A 29 0.205 1.247 -9.980 1.00 1.34 H new ATOM 0 HD2 TYR A 29 -2.196 4.719 -9.363 1.00 1.39 H new ATOM 0 HE1 TYR A 29 -1.681 0.179 -11.147 1.00 2.00 H new ATOM 0 HE2 TYR A 29 -4.050 3.632 -10.552 1.00 2.05 H new ATOM 0 HH TYR A 29 -4.745 0.806 -10.801 1.00 3.00 H new ATOM 412 N ARG A 30 1.938 1.725 -11.157 1.00 0.37 N ATOM 413 CA ARG A 30 1.846 1.002 -12.427 1.00 0.41 C ATOM 414 C ARG A 30 0.489 0.312 -12.606 1.00 0.53 C ATOM 415 O ARG A 30 0.184 -0.658 -11.917 1.00 1.08 O ATOM 416 CB ARG A 30 2.956 -0.051 -12.499 1.00 0.56 C ATOM 417 CG ARG A 30 4.353 0.512 -12.231 1.00 0.84 C ATOM 418 CD ARG A 30 5.302 -0.563 -11.695 1.00 0.89 C ATOM 419 NE ARG A 30 6.700 -0.163 -11.821 1.00 1.70 N ATOM 420 CZ ARG A 30 7.678 -0.988 -12.186 1.00 2.02 C ATOM 421 NH1 ARG A 30 7.412 -2.258 -12.463 1.00 1.89 N ATOM 422 NH2 ARG A 30 8.923 -0.543 -12.274 1.00 2.90 N ATOM 0 H ARG A 30 2.305 1.168 -10.385 1.00 0.37 H new ATOM 0 HA ARG A 30 1.957 1.734 -13.227 1.00 0.41 H new ATOM 0 HB2 ARG A 30 2.746 -0.838 -11.775 1.00 0.56 H new ATOM 0 HB3 ARG A 30 2.943 -0.514 -13.486 1.00 0.56 H new ATOM 0 HG2 ARG A 30 4.760 0.931 -13.152 1.00 0.84 H new ATOM 0 HG3 ARG A 30 4.285 1.329 -11.512 1.00 0.84 H new ATOM 0 HD2 ARG A 30 5.073 -0.760 -10.648 1.00 0.89 H new ATOM 0 HD3 ARG A 30 5.140 -1.494 -12.238 1.00 0.89 H new ATOM 0 HE ARG A 30 6.942 0.807 -11.617 1.00 1.70 H new ATOM 0 HH11 ARG A 30 6.455 -2.605 -12.396 1.00 1.89 H new ATOM 0 HH12 ARG A 30 8.164 -2.887 -12.743 1.00 1.89 H new ATOM 0 HH21 ARG A 30 9.132 0.433 -12.062 1.00 2.90 H new ATOM 0 HH22 ARG A 30 9.672 -1.176 -12.554 1.00 2.90 H new ATOM 436 N LYS A 31 -0.305 0.849 -13.536 1.00 0.41 N ATOM 437 CA LYS A 31 -1.634 0.329 -13.900 1.00 0.42 C ATOM 438 C LYS A 31 -1.883 -1.104 -13.417 1.00 0.52 C ATOM 439 O LYS A 31 -1.098 -2.003 -13.710 1.00 0.82 O ATOM 440 CB LYS A 31 -1.763 0.364 -15.427 1.00 0.63 C ATOM 441 CG LYS A 31 -3.182 0.626 -15.940 1.00 0.99 C ATOM 442 CD LYS A 31 -3.319 0.246 -17.419 1.00 1.42 C ATOM 443 CE LYS A 31 -4.622 0.780 -18.021 1.00 2.16 C ATOM 444 NZ LYS A 31 -4.671 2.268 -17.989 1.00 2.71 N ATOM 0 H LYS A 31 -0.040 1.676 -14.071 1.00 0.41 H new ATOM 0 HA LYS A 31 -2.375 0.961 -13.410 1.00 0.42 H new ATOM 0 HB2 LYS A 31 -1.101 1.137 -15.817 1.00 0.63 H new ATOM 0 HB3 LYS A 31 -1.415 -0.587 -15.830 1.00 0.63 H new ATOM 0 HG2 LYS A 31 -3.896 0.054 -15.348 1.00 0.99 H new ATOM 0 HG3 LYS A 31 -3.430 1.679 -15.809 1.00 0.99 H new ATOM 0 HD2 LYS A 31 -2.471 0.642 -17.977 1.00 1.42 H new ATOM 0 HD3 LYS A 31 -3.289 -0.839 -17.521 1.00 1.42 H new ATOM 0 HE2 LYS A 31 -4.716 0.434 -19.050 1.00 2.16 H new ATOM 0 HE3 LYS A 31 -5.471 0.375 -17.470 1.00 2.16 H new ATOM 0 HZ1 LYS A 31 -5.662 2.583 -18.008 1.00 2.71 H new ATOM 0 HZ2 LYS A 31 -4.215 2.612 -17.120 1.00 2.71 H new ATOM 0 HZ3 LYS A 31 -4.170 2.650 -18.817 1.00 2.71 H new ATOM 458 N ASP A 32 -3.011 -1.287 -12.703 1.00 0.46 N ATOM 459 CA ASP A 32 -3.445 -2.589 -12.158 1.00 0.64 C ATOM 460 C ASP A 32 -2.765 -3.785 -12.838 1.00 0.66 C ATOM 461 O ASP A 32 -3.327 -4.376 -13.762 1.00 0.90 O ATOM 462 CB ASP A 32 -4.969 -2.716 -12.319 1.00 0.96 C ATOM 463 CG ASP A 32 -5.422 -2.453 -13.744 1.00 1.36 C ATOM 464 OD1 ASP A 32 -5.494 -1.268 -14.133 1.00 1.87 O ATOM 465 OD2 ASP A 32 -5.704 -3.429 -14.469 1.00 1.98 O ATOM 0 H ASP A 32 -3.654 -0.526 -12.486 1.00 0.46 H new ATOM 0 HA ASP A 32 -3.154 -2.612 -11.108 1.00 0.64 H new ATOM 0 HB2 ASP A 32 -5.282 -3.716 -12.020 1.00 0.96 H new ATOM 0 HB3 ASP A 32 -5.463 -2.013 -11.648 1.00 0.96 H new ATOM 470 N PRO A 33 -1.547 -4.164 -12.396 1.00 0.52 N ATOM 471 CA PRO A 33 -0.810 -5.285 -12.963 1.00 0.69 C ATOM 472 C PRO A 33 -0.822 -6.523 -12.063 1.00 0.84 C ATOM 473 O PRO A 33 0.237 -7.030 -11.687 1.00 1.53 O ATOM 474 CB PRO A 33 0.592 -4.686 -13.014 1.00 0.79 C ATOM 475 CG PRO A 33 0.691 -3.944 -11.700 1.00 0.53 C ATOM 476 CD PRO A 33 -0.741 -3.508 -11.348 1.00 0.40 C ATOM 0 HA PRO A 33 -1.217 -5.640 -13.910 1.00 0.69 H new ATOM 0 HB2 PRO A 33 1.358 -5.457 -13.101 1.00 0.79 H new ATOM 0 HB3 PRO A 33 0.715 -4.017 -13.866 1.00 0.79 H new ATOM 0 HG2 PRO A 33 1.106 -4.584 -10.921 1.00 0.53 H new ATOM 0 HG3 PRO A 33 1.351 -3.081 -11.789 1.00 0.53 H new ATOM 0 HD2 PRO A 33 -1.030 -3.836 -10.350 1.00 0.40 H new ATOM 0 HD3 PRO A 33 -0.851 -2.424 -11.371 1.00 0.40 H new ATOM 729 N ILE A 50 -10.494 10.690 -0.107 1.00 0.51 N ATOM 730 CA ILE A 50 -9.675 10.579 1.087 1.00 0.38 C ATOM 731 C ILE A 50 -9.227 11.976 1.521 1.00 0.45 C ATOM 732 O ILE A 50 -8.690 12.745 0.722 1.00 0.81 O ATOM 733 CB ILE A 50 -8.454 9.645 0.841 1.00 0.27 C ATOM 734 CG1 ILE A 50 -8.675 8.264 1.477 1.00 0.33 C ATOM 735 CG2 ILE A 50 -7.180 10.254 1.397 1.00 0.37 C ATOM 736 CD1 ILE A 50 -9.835 7.495 0.890 1.00 0.83 C ATOM 0 HA ILE A 50 -10.264 10.131 1.887 1.00 0.38 H new ATOM 0 HB ILE A 50 -8.352 9.527 -0.238 1.00 0.27 H new ATOM 0 HG12 ILE A 50 -7.766 7.673 1.363 1.00 0.33 H new ATOM 0 HG13 ILE A 50 -8.841 8.391 2.547 1.00 0.33 H new ATOM 0 HG21 ILE A 50 -6.343 9.580 1.211 1.00 0.37 H new ATOM 0 HG22 ILE A 50 -6.991 11.210 0.909 1.00 0.37 H new ATOM 0 HG23 ILE A 50 -7.289 10.409 2.470 1.00 0.37 H new ATOM 0 HD11 ILE A 50 -9.924 6.532 1.392 1.00 0.83 H new ATOM 0 HD12 ILE A 50 -10.755 8.063 1.028 1.00 0.83 H new ATOM 0 HD13 ILE A 50 -9.664 7.335 -0.174 1.00 0.83 H new ATOM 748 N LEU A 51 -9.461 12.296 2.789 1.00 0.43 N ATOM 749 CA LEU A 51 -9.139 13.616 3.323 1.00 0.47 C ATOM 750 C LEU A 51 -7.678 13.760 3.743 1.00 0.49 C ATOM 751 O LEU A 51 -7.115 14.850 3.647 1.00 0.75 O ATOM 752 CB LEU A 51 -10.050 13.926 4.517 1.00 0.53 C ATOM 753 CG LEU A 51 -11.511 14.278 4.168 1.00 0.76 C ATOM 754 CD1 LEU A 51 -12.277 13.039 3.724 1.00 1.58 C ATOM 755 CD2 LEU A 51 -12.212 14.932 5.351 1.00 1.69 C ATOM 0 H LEU A 51 -9.874 11.657 3.469 1.00 0.43 H new ATOM 0 HA LEU A 51 -9.306 14.329 2.516 1.00 0.47 H new ATOM 0 HB2 LEU A 51 -10.052 13.063 5.183 1.00 0.53 H new ATOM 0 HB3 LEU A 51 -9.618 14.757 5.074 1.00 0.53 H new ATOM 0 HG LEU A 51 -11.492 14.989 3.342 1.00 0.76 H new ATOM 0 HD11 LEU A 51 -13.304 13.313 3.484 1.00 1.58 H new ATOM 0 HD12 LEU A 51 -11.799 12.613 2.842 1.00 1.58 H new ATOM 0 HD13 LEU A 51 -12.277 12.303 4.528 1.00 1.58 H new ATOM 0 HD21 LEU A 51 -13.240 15.170 5.078 1.00 1.69 H new ATOM 0 HD22 LEU A 51 -12.211 14.247 6.199 1.00 1.69 H new ATOM 0 HD23 LEU A 51 -11.688 15.848 5.624 1.00 1.69 H new ATOM 767 N ARG A 52 -7.061 12.681 4.208 1.00 0.47 N ATOM 768 CA ARG A 52 -5.671 12.754 4.648 1.00 0.50 C ATOM 769 C ARG A 52 -4.701 12.730 3.464 1.00 0.50 C ATOM 770 O ARG A 52 -3.599 12.189 3.563 1.00 0.64 O ATOM 771 CB ARG A 52 -5.347 11.618 5.631 1.00 0.54 C ATOM 772 CG ARG A 52 -5.160 12.066 7.094 1.00 0.82 C ATOM 773 CD ARG A 52 -6.476 12.529 7.734 1.00 0.81 C ATOM 774 NE ARG A 52 -6.262 13.085 9.067 1.00 1.32 N ATOM 775 CZ ARG A 52 -7.247 13.494 9.862 1.00 1.95 C ATOM 776 NH1 ARG A 52 -8.508 13.406 9.460 1.00 2.26 N ATOM 777 NH2 ARG A 52 -6.971 13.989 11.061 1.00 2.56 N ATOM 0 H ARG A 52 -7.491 11.760 4.290 1.00 0.47 H new ATOM 0 HA ARG A 52 -5.544 13.706 5.163 1.00 0.50 H new ATOM 0 HB2 ARG A 52 -6.149 10.881 5.591 1.00 0.54 H new ATOM 0 HB3 ARG A 52 -4.437 11.117 5.299 1.00 0.54 H new ATOM 0 HG2 ARG A 52 -4.747 11.241 7.674 1.00 0.82 H new ATOM 0 HG3 ARG A 52 -4.434 12.878 7.133 1.00 0.82 H new ATOM 0 HD2 ARG A 52 -6.946 13.279 7.098 1.00 0.81 H new ATOM 0 HD3 ARG A 52 -7.166 11.687 7.797 1.00 0.81 H new ATOM 0 HE ARG A 52 -5.304 13.164 9.408 1.00 1.32 H new ATOM 0 HH11 ARG A 52 -8.724 13.024 8.539 1.00 2.26 H new ATOM 0 HH12 ARG A 52 -9.261 13.720 10.072 1.00 2.26 H new ATOM 0 HH21 ARG A 52 -6.003 14.056 11.374 1.00 2.56 H new ATOM 0 HH22 ARG A 52 -7.727 14.302 11.670 1.00 2.56 H new ATOM 791 N SER A 53 -5.118 13.321 2.346 1.00 0.43 N ATOM 792 CA SER A 53 -4.279 13.395 1.150 1.00 0.46 C ATOM 793 C SER A 53 -4.853 14.409 0.156 1.00 0.48 C ATOM 794 O SER A 53 -6.070 14.518 0.001 1.00 0.57 O ATOM 795 CB SER A 53 -4.149 12.019 0.489 1.00 0.46 C ATOM 796 OG SER A 53 -2.813 11.775 0.090 1.00 0.97 O ATOM 0 H SER A 53 -6.034 13.757 2.243 1.00 0.43 H new ATOM 0 HA SER A 53 -3.285 13.725 1.453 1.00 0.46 H new ATOM 0 HB2 SER A 53 -4.472 11.245 1.185 1.00 0.46 H new ATOM 0 HB3 SER A 53 -4.808 11.964 -0.378 1.00 0.46 H new ATOM 0 HG SER A 53 -2.478 10.973 0.543 1.00 0.97 H new ATOM 802 N ASN A 54 -3.968 15.153 -0.516 1.00 0.51 N ATOM 803 CA ASN A 54 -4.389 16.167 -1.486 1.00 0.56 C ATOM 804 C ASN A 54 -5.187 15.527 -2.642 1.00 0.50 C ATOM 805 O ASN A 54 -5.144 14.313 -2.813 1.00 0.45 O ATOM 806 CB ASN A 54 -3.153 16.939 -2.007 1.00 0.68 C ATOM 807 CG ASN A 54 -2.759 16.561 -3.422 1.00 0.98 C ATOM 808 OD1 ASN A 54 -3.318 17.073 -4.391 1.00 1.96 O ATOM 809 ND2 ASN A 54 -1.774 15.681 -3.548 1.00 0.90 N ATOM 0 H ASN A 54 -2.957 15.072 -0.406 1.00 0.51 H new ATOM 0 HA ASN A 54 -5.053 16.876 -0.992 1.00 0.56 H new ATOM 0 HB2 ASN A 54 -3.359 18.009 -1.969 1.00 0.68 H new ATOM 0 HB3 ASN A 54 -2.310 16.753 -1.341 1.00 0.68 H new ATOM 0 HD21 ASN A 54 -1.453 15.405 -4.476 1.00 0.90 H new ATOM 0 HD22 ASN A 54 -1.338 15.281 -2.717 1.00 0.90 H new ATOM 816 N PRO A 55 -5.932 16.321 -3.454 1.00 0.53 N ATOM 817 CA PRO A 55 -6.747 15.777 -4.567 1.00 0.51 C ATOM 818 C PRO A 55 -6.024 14.765 -5.467 1.00 0.45 C ATOM 819 O PRO A 55 -6.598 13.733 -5.840 1.00 0.46 O ATOM 820 CB PRO A 55 -7.090 17.035 -5.376 1.00 0.59 C ATOM 821 CG PRO A 55 -7.201 18.094 -4.330 1.00 0.66 C ATOM 822 CD PRO A 55 -6.060 17.802 -3.374 1.00 0.62 C ATOM 0 HA PRO A 55 -7.597 15.215 -4.180 1.00 0.51 H new ATOM 0 HB2 PRO A 55 -6.314 17.269 -6.105 1.00 0.59 H new ATOM 0 HB3 PRO A 55 -8.022 16.916 -5.929 1.00 0.59 H new ATOM 0 HG2 PRO A 55 -7.112 19.090 -4.763 1.00 0.66 H new ATOM 0 HG3 PRO A 55 -8.165 18.052 -3.823 1.00 0.66 H new ATOM 0 HD2 PRO A 55 -5.141 18.304 -3.676 1.00 0.62 H new ATOM 0 HD3 PRO A 55 -6.286 18.134 -2.361 1.00 0.62 H new ATOM 830 N GLU A 56 -4.766 15.037 -5.802 1.00 0.42 N ATOM 831 CA GLU A 56 -4.024 14.161 -6.702 1.00 0.39 C ATOM 832 C GLU A 56 -3.637 12.871 -5.999 1.00 0.34 C ATOM 833 O GLU A 56 -4.005 11.766 -6.417 1.00 0.32 O ATOM 834 CB GLU A 56 -2.760 14.874 -7.205 1.00 0.41 C ATOM 835 CG GLU A 56 -3.032 16.270 -7.772 1.00 0.61 C ATOM 836 CD GLU A 56 -3.991 16.239 -8.946 1.00 1.36 C ATOM 837 OE1 GLU A 56 -3.531 16.000 -10.082 1.00 1.82 O ATOM 838 OE2 GLU A 56 -5.202 16.450 -8.729 1.00 1.78 O ATOM 0 H GLU A 56 -4.244 15.847 -5.468 1.00 0.42 H new ATOM 0 HA GLU A 56 -4.665 13.918 -7.549 1.00 0.39 H new ATOM 0 HB2 GLU A 56 -2.048 14.956 -6.384 1.00 0.41 H new ATOM 0 HB3 GLU A 56 -2.290 14.263 -7.975 1.00 0.41 H new ATOM 0 HG2 GLU A 56 -3.443 16.905 -6.987 1.00 0.61 H new ATOM 0 HG3 GLU A 56 -2.091 16.721 -8.087 1.00 0.61 H new ATOM 845 N ASP A 57 -2.951 13.005 -4.889 1.00 0.34 N ATOM 846 CA ASP A 57 -2.535 11.838 -4.165 1.00 0.32 C ATOM 847 C ASP A 57 -3.754 11.169 -3.531 1.00 0.31 C ATOM 848 O ASP A 57 -3.645 10.118 -2.900 1.00 0.33 O ATOM 849 CB ASP A 57 -1.462 12.190 -3.134 1.00 0.36 C ATOM 850 CG ASP A 57 -1.937 13.181 -2.099 1.00 1.24 C ATOM 851 OD1 ASP A 57 -3.166 13.324 -1.932 1.00 1.91 O ATOM 852 OD2 ASP A 57 -1.084 13.814 -1.456 1.00 1.78 O ATOM 0 H ASP A 57 -2.675 13.896 -4.477 1.00 0.34 H new ATOM 0 HA ASP A 57 -2.081 11.125 -4.853 1.00 0.32 H new ATOM 0 HB2 ASP A 57 -1.136 11.279 -2.633 1.00 0.36 H new ATOM 0 HB3 ASP A 57 -0.593 12.600 -3.649 1.00 0.36 H new ATOM 857 N GLN A 58 -4.917 11.804 -3.707 1.00 0.30 N ATOM 858 CA GLN A 58 -6.178 11.266 -3.217 1.00 0.31 C ATOM 859 C GLN A 58 -6.588 10.115 -4.113 1.00 0.33 C ATOM 860 O GLN A 58 -6.714 8.989 -3.653 1.00 0.30 O ATOM 861 CB GLN A 58 -7.265 12.355 -3.205 1.00 0.36 C ATOM 862 CG GLN A 58 -8.672 11.846 -2.866 1.00 0.52 C ATOM 863 CD GLN A 58 -9.422 11.352 -4.089 1.00 0.77 C ATOM 864 OE1 GLN A 58 -9.382 10.168 -4.422 1.00 1.50 O ATOM 865 NE2 GLN A 58 -10.112 12.263 -4.765 1.00 1.44 N ATOM 0 H GLN A 58 -5.005 12.698 -4.190 1.00 0.30 H new ATOM 0 HA GLN A 58 -6.055 10.913 -2.193 1.00 0.31 H new ATOM 0 HB2 GLN A 58 -6.986 13.121 -2.482 1.00 0.36 H new ATOM 0 HB3 GLN A 58 -7.292 12.835 -4.183 1.00 0.36 H new ATOM 0 HG2 GLN A 58 -8.597 11.037 -2.139 1.00 0.52 H new ATOM 0 HG3 GLN A 58 -9.241 12.647 -2.394 1.00 0.52 H new ATOM 0 HE21 GLN A 58 -10.117 13.234 -4.453 1.00 1.44 H new ATOM 0 HE22 GLN A 58 -10.637 11.992 -5.596 1.00 1.44 H new ATOM 874 N VAL A 59 -6.790 10.403 -5.401 1.00 0.42 N ATOM 875 CA VAL A 59 -7.149 9.366 -6.357 1.00 0.50 C ATOM 876 C VAL A 59 -6.190 8.186 -6.222 1.00 0.50 C ATOM 877 O VAL A 59 -6.602 7.033 -6.342 1.00 0.57 O ATOM 878 CB VAL A 59 -7.123 9.877 -7.820 1.00 0.63 C ATOM 879 CG1 VAL A 59 -5.769 10.456 -8.149 1.00 1.22 C ATOM 880 CG2 VAL A 59 -7.411 8.749 -8.794 1.00 1.03 C ATOM 0 H VAL A 59 -6.711 11.339 -5.799 1.00 0.42 H new ATOM 0 HA VAL A 59 -8.170 9.058 -6.130 1.00 0.50 H new ATOM 0 HB VAL A 59 -7.892 10.644 -7.914 1.00 0.63 H new ATOM 0 HG11 VAL A 59 -5.766 10.811 -9.180 1.00 1.22 H new ATOM 0 HG12 VAL A 59 -5.556 11.288 -7.478 1.00 1.22 H new ATOM 0 HG13 VAL A 59 -5.005 9.688 -8.027 1.00 1.22 H new ATOM 0 HG21 VAL A 59 -7.387 9.134 -9.814 1.00 1.03 H new ATOM 0 HG22 VAL A 59 -6.657 7.970 -8.682 1.00 1.03 H new ATOM 0 HG23 VAL A 59 -8.397 8.332 -8.587 1.00 1.03 H new ATOM 890 N LEU A 60 -4.907 8.472 -5.968 1.00 0.48 N ATOM 891 CA LEU A 60 -3.925 7.396 -5.801 1.00 0.51 C ATOM 892 C LEU A 60 -4.192 6.632 -4.501 1.00 0.54 C ATOM 893 O LEU A 60 -4.585 5.473 -4.525 1.00 1.02 O ATOM 894 CB LEU A 60 -2.508 7.984 -5.779 1.00 0.50 C ATOM 895 CG LEU A 60 -1.377 7.001 -5.413 1.00 0.63 C ATOM 896 CD1 LEU A 60 -0.941 6.187 -6.616 1.00 1.05 C ATOM 897 CD2 LEU A 60 -0.165 7.729 -4.851 1.00 0.89 C ATOM 0 H LEU A 60 -4.532 9.416 -5.876 1.00 0.48 H new ATOM 0 HA LEU A 60 -4.014 6.705 -6.639 1.00 0.51 H new ATOM 0 HB2 LEU A 60 -2.294 8.404 -6.762 1.00 0.50 H new ATOM 0 HB3 LEU A 60 -2.489 8.810 -5.068 1.00 0.50 H new ATOM 0 HG LEU A 60 -1.781 6.334 -4.651 1.00 0.63 H new ATOM 0 HD11 LEU A 60 -0.143 5.504 -6.324 1.00 1.05 H new ATOM 0 HD12 LEU A 60 -1.788 5.614 -6.994 1.00 1.05 H new ATOM 0 HD13 LEU A 60 -0.578 6.856 -7.396 1.00 1.05 H new ATOM 0 HD21 LEU A 60 0.612 7.005 -4.604 1.00 0.89 H new ATOM 0 HD22 LEU A 60 0.215 8.430 -5.594 1.00 0.89 H new ATOM 0 HD23 LEU A 60 -0.452 8.274 -3.952 1.00 0.89 H new ATOM 909 N TYR A 61 -4.004 7.312 -3.372 1.00 0.34 N ATOM 910 CA TYR A 61 -4.252 6.734 -2.039 1.00 0.36 C ATOM 911 C TYR A 61 -5.677 6.190 -1.930 1.00 0.41 C ATOM 912 O TYR A 61 -6.067 5.624 -0.909 1.00 0.63 O ATOM 913 CB TYR A 61 -4.027 7.788 -0.949 1.00 0.30 C ATOM 914 CG TYR A 61 -2.571 8.141 -0.637 1.00 0.37 C ATOM 915 CD1 TYR A 61 -1.508 7.722 -1.442 1.00 0.53 C ATOM 916 CD2 TYR A 61 -2.266 8.913 0.481 1.00 0.63 C ATOM 917 CE1 TYR A 61 -0.197 8.063 -1.134 1.00 0.63 C ATOM 918 CE2 TYR A 61 -0.959 9.255 0.790 1.00 0.80 C ATOM 919 CZ TYR A 61 0.066 8.827 -0.021 1.00 0.70 C ATOM 920 OH TYR A 61 1.365 9.166 0.283 1.00 0.90 O ATOM 0 H TYR A 61 -3.676 8.278 -3.348 1.00 0.34 H new ATOM 0 HA TYR A 61 -3.551 5.911 -1.900 1.00 0.36 H new ATOM 0 HB2 TYR A 61 -4.545 8.701 -1.244 1.00 0.30 H new ATOM 0 HB3 TYR A 61 -4.498 7.437 -0.031 1.00 0.30 H new ATOM 0 HD1 TYR A 61 -1.709 7.123 -2.318 1.00 0.53 H new ATOM 0 HD2 TYR A 61 -3.066 9.253 1.122 1.00 0.63 H new ATOM 0 HE1 TYR A 61 0.613 7.729 -1.766 1.00 0.63 H new ATOM 0 HE2 TYR A 61 -0.747 9.854 1.663 1.00 0.80 H new ATOM 0 HH TYR A 61 1.379 9.709 1.099 1.00 0.90 H new ATOM 930 N GLN A 62 -6.441 6.375 -2.995 1.00 0.36 N ATOM 931 CA GLN A 62 -7.824 5.914 -3.069 1.00 0.42 C ATOM 932 C GLN A 62 -7.958 4.866 -4.178 1.00 0.55 C ATOM 933 O GLN A 62 -7.124 3.971 -4.275 1.00 1.13 O ATOM 934 CB GLN A 62 -8.770 7.094 -3.329 1.00 0.39 C ATOM 935 CG GLN A 62 -10.250 6.779 -3.074 1.00 0.54 C ATOM 936 CD GLN A 62 -11.172 7.604 -3.950 1.00 0.78 C ATOM 937 OE1 GLN A 62 -11.503 8.804 -3.492 1.00 1.80 O flip ATOM 938 NE2 GLN A 62 -11.572 7.171 -5.031 1.00 0.95 N flip ATOM 0 H GLN A 62 -6.120 6.851 -3.838 1.00 0.36 H new ATOM 0 HA GLN A 62 -8.099 5.461 -2.116 1.00 0.42 H new ATOM 0 HB2 GLN A 62 -8.473 7.930 -2.696 1.00 0.39 H new ATOM 0 HB3 GLN A 62 -8.652 7.420 -4.363 1.00 0.39 H new ATOM 0 HG2 GLN A 62 -10.431 5.720 -3.256 1.00 0.54 H new ATOM 0 HG3 GLN A 62 -10.484 6.966 -2.026 1.00 0.54 H new ATOM 0 HE21 GLN A 62 -11.291 6.241 -5.343 1.00 0.95 H new ATOM 0 HE22 GLN A 62 -12.184 7.742 -5.614 1.00 0.95 H new ATOM 947 N THR A 63 -8.968 5.026 -5.041 1.00 0.34 N ATOM 948 CA THR A 63 -9.237 4.088 -6.149 1.00 0.38 C ATOM 949 C THR A 63 -9.144 2.605 -5.734 1.00 0.47 C ATOM 950 O THR A 63 -8.172 2.173 -5.120 1.00 1.05 O ATOM 951 CB THR A 63 -8.296 4.371 -7.339 1.00 0.52 C ATOM 952 OG1 THR A 63 -6.956 4.560 -6.870 1.00 0.98 O ATOM 953 CG2 THR A 63 -8.757 5.611 -8.097 1.00 0.83 C ATOM 0 H THR A 63 -9.623 5.806 -4.995 1.00 0.34 H new ATOM 0 HA THR A 63 -10.270 4.261 -6.450 1.00 0.38 H new ATOM 0 HB THR A 63 -8.322 3.516 -8.014 1.00 0.52 H new ATOM 0 HG1 THR A 63 -6.682 5.488 -7.027 1.00 0.98 H new ATOM 0 HG21 THR A 63 -8.083 5.798 -8.933 1.00 0.83 H new ATOM 0 HG22 THR A 63 -9.768 5.453 -8.473 1.00 0.83 H new ATOM 0 HG23 THR A 63 -8.750 6.471 -7.427 1.00 0.83 H new ATOM 961 N GLU A 64 -10.158 1.816 -6.109 1.00 0.41 N ATOM 962 CA GLU A 64 -10.199 0.391 -5.747 1.00 0.40 C ATOM 963 C GLU A 64 -10.430 -0.520 -6.954 1.00 0.53 C ATOM 964 O GLU A 64 -11.084 -0.135 -7.925 1.00 1.26 O ATOM 965 CB GLU A 64 -11.332 0.146 -4.739 1.00 0.49 C ATOM 966 CG GLU A 64 -12.725 0.343 -5.335 1.00 0.80 C ATOM 967 CD GLU A 64 -13.827 0.107 -4.322 1.00 1.37 C ATOM 968 OE1 GLU A 64 -14.266 -1.053 -4.180 1.00 1.74 O ATOM 969 OE2 GLU A 64 -14.253 1.084 -3.669 1.00 2.05 O ATOM 0 H GLU A 64 -10.956 2.135 -6.659 1.00 0.41 H new ATOM 0 HA GLU A 64 -9.226 0.149 -5.319 1.00 0.40 H new ATOM 0 HB2 GLU A 64 -11.251 -0.870 -4.351 1.00 0.49 H new ATOM 0 HB3 GLU A 64 -11.208 0.821 -3.892 1.00 0.49 H new ATOM 0 HG2 GLU A 64 -12.808 1.356 -5.729 1.00 0.80 H new ATOM 0 HG3 GLU A 64 -12.857 -0.338 -6.176 1.00 0.80 H new ATOM 976 N ARG A 65 -9.876 -1.733 -6.878 1.00 0.75 N ATOM 977 CA ARG A 65 -10.049 -2.734 -7.931 1.00 0.82 C ATOM 978 C ARG A 65 -11.408 -3.421 -7.769 1.00 0.96 C ATOM 979 O ARG A 65 -12.323 -2.857 -7.168 1.00 1.54 O ATOM 980 CB ARG A 65 -8.931 -3.791 -7.873 1.00 0.90 C ATOM 981 CG ARG A 65 -7.512 -3.211 -7.872 1.00 1.01 C ATOM 982 CD ARG A 65 -7.057 -2.790 -9.289 1.00 1.01 C ATOM 983 NE ARG A 65 -8.173 -2.335 -10.112 1.00 1.85 N ATOM 984 CZ ARG A 65 -8.684 -3.044 -11.116 1.00 2.65 C ATOM 985 NH1 ARG A 65 -8.152 -4.212 -11.446 1.00 3.02 N ATOM 986 NH2 ARG A 65 -9.727 -2.583 -11.791 1.00 3.58 N ATOM 0 H ARG A 65 -9.302 -2.045 -6.095 1.00 0.75 H new ATOM 0 HA ARG A 65 -10.001 -2.230 -8.896 1.00 0.82 H new ATOM 0 HB2 ARG A 65 -9.064 -4.395 -6.975 1.00 0.90 H new ATOM 0 HB3 ARG A 65 -9.036 -4.461 -8.726 1.00 0.90 H new ATOM 0 HG2 ARG A 65 -7.474 -2.348 -7.208 1.00 1.01 H new ATOM 0 HG3 ARG A 65 -6.818 -3.951 -7.473 1.00 1.01 H new ATOM 0 HD2 ARG A 65 -6.317 -1.993 -9.210 1.00 1.01 H new ATOM 0 HD3 ARG A 65 -6.567 -3.633 -9.777 1.00 1.01 H new ATOM 0 HE ARG A 65 -8.584 -1.424 -9.907 1.00 1.85 H new ATOM 0 HH11 ARG A 65 -7.348 -4.570 -10.930 1.00 3.02 H new ATOM 0 HH12 ARG A 65 -8.546 -4.753 -12.216 1.00 3.02 H new ATOM 0 HH21 ARG A 65 -10.139 -1.684 -11.541 1.00 3.58 H new ATOM 0 HH22 ARG A 65 -10.118 -3.127 -12.560 1.00 3.58 H new ATOM 1000 N TYR A 66 -11.538 -4.638 -8.297 1.00 0.96 N ATOM 1001 CA TYR A 66 -12.792 -5.381 -8.196 1.00 1.08 C ATOM 1002 C TYR A 66 -12.854 -6.187 -6.895 1.00 0.98 C ATOM 1003 O TYR A 66 -13.369 -5.700 -5.889 1.00 1.66 O ATOM 1004 CB TYR A 66 -12.970 -6.303 -9.413 1.00 1.68 C ATOM 1005 CG TYR A 66 -14.283 -7.071 -9.409 1.00 2.01 C ATOM 1006 CD1 TYR A 66 -15.468 -6.452 -9.797 1.00 2.30 C ATOM 1007 CD2 TYR A 66 -14.341 -8.410 -9.018 1.00 2.84 C ATOM 1008 CE1 TYR A 66 -16.670 -7.142 -9.797 1.00 2.97 C ATOM 1009 CE2 TYR A 66 -15.542 -9.101 -9.018 1.00 3.50 C ATOM 1010 CZ TYR A 66 -16.699 -8.463 -9.407 1.00 3.42 C ATOM 1011 OH TYR A 66 -17.891 -9.150 -9.407 1.00 4.25 O ATOM 0 H TYR A 66 -10.795 -5.127 -8.796 1.00 0.96 H new ATOM 0 HA TYR A 66 -13.610 -4.661 -8.183 1.00 1.08 H new ATOM 0 HB2 TYR A 66 -12.911 -5.705 -10.323 1.00 1.68 H new ATOM 0 HB3 TYR A 66 -12.144 -7.013 -9.444 1.00 1.68 H new ATOM 0 HD1 TYR A 66 -15.450 -5.416 -10.103 1.00 2.30 H new ATOM 0 HD2 TYR A 66 -13.437 -8.914 -8.711 1.00 2.84 H new ATOM 0 HE1 TYR A 66 -17.580 -6.646 -10.101 1.00 2.97 H new ATOM 0 HE2 TYR A 66 -15.571 -10.137 -8.714 1.00 3.50 H new ATOM 0 HH TYR A 66 -17.738 -10.070 -9.107 1.00 4.25 H new ATOM 1021 N ASN A 67 -12.322 -7.414 -6.916 1.00 1.10 N ATOM 1022 CA ASN A 67 -12.330 -8.278 -5.732 1.00 1.55 C ATOM 1023 C ASN A 67 -11.658 -9.619 -6.029 1.00 1.17 C ATOM 1024 O ASN A 67 -11.599 -10.049 -7.182 1.00 1.36 O ATOM 1025 CB ASN A 67 -13.769 -8.522 -5.260 1.00 2.60 C ATOM 1026 CG ASN A 67 -13.828 -9.285 -3.951 1.00 3.63 C ATOM 1027 OD1 ASN A 67 -12.939 -9.165 -3.106 1.00 4.20 O ATOM 1028 ND2 ASN A 67 -14.879 -10.079 -3.775 1.00 4.35 N ATOM 0 H ASN A 67 -11.882 -7.829 -7.737 1.00 1.10 H new ATOM 0 HA ASN A 67 -11.771 -7.772 -4.945 1.00 1.55 H new ATOM 0 HB2 ASN A 67 -14.277 -7.565 -5.142 1.00 2.60 H new ATOM 0 HB3 ASN A 67 -14.310 -9.078 -6.026 1.00 2.60 H new ATOM 0 HD21 ASN A 67 -14.972 -10.618 -2.914 1.00 4.35 H new ATOM 0 HD22 ASN A 67 -15.592 -10.149 -4.501 1.00 4.35 H new ATOM 1035 N GLU A 68 -11.156 -10.273 -4.981 1.00 0.99 N ATOM 1036 CA GLU A 68 -10.493 -11.571 -5.123 1.00 0.98 C ATOM 1037 C GLU A 68 -10.096 -12.127 -3.751 1.00 0.86 C ATOM 1038 O GLU A 68 -10.655 -11.730 -2.729 1.00 0.93 O ATOM 1039 CB GLU A 68 -9.257 -11.442 -6.025 1.00 1.43 C ATOM 1040 CG GLU A 68 -9.087 -12.596 -7.018 1.00 1.83 C ATOM 1041 CD GLU A 68 -7.815 -12.473 -7.835 1.00 2.55 C ATOM 1042 OE1 GLU A 68 -7.846 -11.798 -8.884 1.00 2.84 O ATOM 1043 OE2 GLU A 68 -6.786 -13.052 -7.424 1.00 3.17 O ATOM 0 H GLU A 68 -11.196 -9.925 -4.023 1.00 0.99 H new ATOM 0 HA GLU A 68 -11.193 -12.267 -5.586 1.00 0.98 H new ATOM 0 HB2 GLU A 68 -9.321 -10.506 -6.579 1.00 1.43 H new ATOM 0 HB3 GLU A 68 -8.367 -11.382 -5.398 1.00 1.43 H new ATOM 0 HG2 GLU A 68 -9.077 -13.541 -6.475 1.00 1.83 H new ATOM 0 HG3 GLU A 68 -9.945 -12.624 -7.689 1.00 1.83 H new ATOM 1050 N ASP A 69 -9.128 -13.044 -3.738 1.00 0.82 N ATOM 1051 CA ASP A 69 -8.667 -13.660 -2.495 1.00 0.76 C ATOM 1052 C ASP A 69 -7.214 -14.115 -2.616 1.00 0.74 C ATOM 1053 O ASP A 69 -6.828 -14.710 -3.622 1.00 0.84 O ATOM 1054 CB ASP A 69 -9.549 -14.860 -2.147 1.00 0.90 C ATOM 1055 CG ASP A 69 -9.110 -15.549 -0.870 1.00 1.58 C ATOM 1056 OD1 ASP A 69 -8.555 -14.863 0.013 1.00 2.39 O ATOM 1057 OD2 ASP A 69 -9.315 -16.776 -0.756 1.00 1.90 O ATOM 0 H ASP A 69 -8.648 -13.376 -4.575 1.00 0.82 H new ATOM 0 HA ASP A 69 -8.734 -12.914 -1.703 1.00 0.76 H new ATOM 0 HB2 ASP A 69 -10.582 -14.529 -2.042 1.00 0.90 H new ATOM 0 HB3 ASP A 69 -9.525 -15.575 -2.969 1.00 0.90 H new ATOM 1062 N SER A 70 -6.415 -13.838 -1.582 1.00 0.64 N ATOM 1063 CA SER A 70 -5.004 -14.223 -1.583 1.00 0.65 C ATOM 1064 C SER A 70 -4.331 -13.765 -2.866 1.00 0.69 C ATOM 1065 O SER A 70 -4.126 -14.556 -3.787 1.00 0.79 O ATOM 1066 CB SER A 70 -4.866 -15.743 -1.434 1.00 0.74 C ATOM 1067 OG SER A 70 -3.510 -16.119 -1.263 1.00 0.99 O ATOM 0 H SER A 70 -6.720 -13.352 -0.739 1.00 0.64 H new ATOM 0 HA SER A 70 -4.515 -13.740 -0.737 1.00 0.65 H new ATOM 0 HB2 SER A 70 -5.451 -16.082 -0.579 1.00 0.74 H new ATOM 0 HB3 SER A 70 -5.275 -16.236 -2.316 1.00 0.74 H new ATOM 0 HG SER A 70 -3.450 -17.093 -1.169 1.00 0.99 H new ATOM 1073 N PHE A 71 -3.985 -12.483 -2.925 1.00 0.69 N ATOM 1074 CA PHE A 71 -3.339 -11.941 -4.115 1.00 0.79 C ATOM 1075 C PHE A 71 -2.435 -10.763 -3.766 1.00 0.48 C ATOM 1076 O PHE A 71 -2.633 -10.093 -2.751 1.00 0.61 O ATOM 1077 CB PHE A 71 -4.387 -11.563 -5.193 1.00 1.26 C ATOM 1078 CG PHE A 71 -5.504 -10.633 -4.745 1.00 0.99 C ATOM 1079 CD1 PHE A 71 -6.390 -11.032 -3.756 1.00 0.87 C ATOM 1080 CD2 PHE A 71 -5.700 -9.387 -5.346 1.00 1.04 C ATOM 1081 CE1 PHE A 71 -7.446 -10.216 -3.370 1.00 0.78 C ATOM 1082 CE2 PHE A 71 -6.751 -8.565 -4.957 1.00 1.01 C ATOM 1083 CZ PHE A 71 -7.626 -8.982 -3.969 1.00 0.87 C ATOM 0 H PHE A 71 -4.138 -11.809 -2.175 1.00 0.69 H new ATOM 0 HA PHE A 71 -2.703 -12.719 -4.537 1.00 0.79 H new ATOM 0 HB2 PHE A 71 -3.866 -11.095 -6.029 1.00 1.26 H new ATOM 0 HB3 PHE A 71 -4.836 -12.481 -5.571 1.00 1.26 H new ATOM 0 HD1 PHE A 71 -6.257 -11.992 -3.279 1.00 0.87 H new ATOM 0 HD2 PHE A 71 -5.026 -9.058 -6.123 1.00 1.04 H new ATOM 0 HE1 PHE A 71 -8.128 -10.546 -2.600 1.00 0.78 H new ATOM 0 HE2 PHE A 71 -6.885 -7.601 -5.426 1.00 1.01 H new ATOM 0 HZ PHE A 71 -8.446 -8.347 -3.667 1.00 0.87 H new ATOM 1093 N GLY A 72 -1.418 -10.537 -4.603 1.00 0.39 N ATOM 1094 CA GLY A 72 -0.481 -9.458 -4.353 1.00 0.66 C ATOM 1095 C GLY A 72 0.469 -9.192 -5.501 1.00 0.52 C ATOM 1096 O GLY A 72 0.234 -9.618 -6.627 1.00 0.63 O ATOM 0 H GLY A 72 -1.231 -11.082 -5.445 1.00 0.39 H new ATOM 0 HA2 GLY A 72 -1.040 -8.547 -4.138 1.00 0.66 H new ATOM 0 HA3 GLY A 72 0.100 -9.693 -3.461 1.00 0.66 H new ATOM 1100 N TYR A 73 1.576 -8.524 -5.199 1.00 0.44 N ATOM 1101 CA TYR A 73 2.543 -8.163 -6.228 1.00 0.37 C ATOM 1102 C TYR A 73 3.931 -8.741 -5.968 1.00 0.33 C ATOM 1103 O TYR A 73 4.255 -9.171 -4.857 1.00 0.38 O ATOM 1104 CB TYR A 73 2.644 -6.636 -6.309 1.00 0.48 C ATOM 1105 CG TYR A 73 1.361 -5.934 -5.902 1.00 0.48 C ATOM 1106 CD1 TYR A 73 0.358 -5.680 -6.834 1.00 0.56 C ATOM 1107 CD2 TYR A 73 1.160 -5.505 -4.595 1.00 0.61 C ATOM 1108 CE1 TYR A 73 -0.804 -5.021 -6.473 1.00 0.64 C ATOM 1109 CE2 TYR A 73 -0.003 -4.847 -4.228 1.00 0.72 C ATOM 1110 CZ TYR A 73 -1.007 -4.682 -5.139 1.00 0.68 C ATOM 1111 OH TYR A 73 -2.129 -3.950 -4.818 1.00 0.83 O ATOM 0 H TYR A 73 1.825 -8.223 -4.257 1.00 0.44 H new ATOM 0 HA TYR A 73 2.187 -8.585 -7.168 1.00 0.37 H new ATOM 0 HB2 TYR A 73 3.457 -6.297 -5.667 1.00 0.48 H new ATOM 0 HB3 TYR A 73 2.902 -6.348 -7.328 1.00 0.48 H new ATOM 0 HD1 TYR A 73 0.489 -6.003 -7.856 1.00 0.56 H new ATOM 0 HD2 TYR A 73 1.923 -5.688 -3.853 1.00 0.61 H new ATOM 0 HE1 TYR A 73 -1.545 -4.773 -7.218 1.00 0.64 H new ATOM 0 HE2 TYR A 73 -0.115 -4.466 -3.224 1.00 0.72 H new ATOM 0 HH TYR A 73 -2.067 -3.647 -3.888 1.00 0.83 H new ATOM 1121 N ASP A 74 4.743 -8.721 -7.022 1.00 0.32 N ATOM 1122 CA ASP A 74 6.113 -9.208 -6.978 1.00 0.32 C ATOM 1123 C ASP A 74 7.074 -8.057 -7.270 1.00 0.31 C ATOM 1124 O ASP A 74 6.953 -7.389 -8.299 1.00 0.45 O ATOM 1125 CB ASP A 74 6.301 -10.328 -8.006 1.00 0.35 C ATOM 1126 CG ASP A 74 6.403 -11.700 -7.369 1.00 1.40 C ATOM 1127 OD1 ASP A 74 6.253 -11.791 -6.132 1.00 1.74 O ATOM 1128 OD2 ASP A 74 6.634 -12.684 -8.103 1.00 2.27 O ATOM 0 H ASP A 74 4.464 -8.363 -7.935 1.00 0.32 H new ATOM 0 HA ASP A 74 6.324 -9.605 -5.985 1.00 0.32 H new ATOM 0 HB2 ASP A 74 5.464 -10.318 -8.704 1.00 0.35 H new ATOM 0 HB3 ASP A 74 7.203 -10.134 -8.587 1.00 0.35 H new ATOM 1133 N ILE A 75 8.024 -7.823 -6.369 1.00 0.24 N ATOM 1134 CA ILE A 75 8.977 -6.731 -6.539 1.00 0.24 C ATOM 1135 C ILE A 75 10.413 -7.236 -6.710 1.00 0.23 C ATOM 1136 O ILE A 75 11.142 -7.368 -5.728 1.00 0.34 O ATOM 1137 CB ILE A 75 8.987 -5.796 -5.316 1.00 0.23 C ATOM 1138 CG1 ILE A 75 7.623 -5.187 -5.011 1.00 0.25 C ATOM 1139 CG2 ILE A 75 9.979 -4.670 -5.521 1.00 0.27 C ATOM 1140 CD1 ILE A 75 6.666 -6.089 -4.293 1.00 0.25 C ATOM 0 H ILE A 75 8.154 -8.371 -5.519 1.00 0.24 H new ATOM 0 HA ILE A 75 8.651 -6.203 -7.435 1.00 0.24 H new ATOM 0 HB ILE A 75 9.273 -6.418 -4.468 1.00 0.23 H new ATOM 0 HG12 ILE A 75 7.770 -4.289 -4.411 1.00 0.25 H new ATOM 0 HG13 ILE A 75 7.166 -4.872 -5.949 1.00 0.25 H new ATOM 0 HG21 ILE A 75 9.974 -4.018 -4.648 1.00 0.27 H new ATOM 0 HG22 ILE A 75 10.977 -5.085 -5.658 1.00 0.27 H new ATOM 0 HG23 ILE A 75 9.700 -4.096 -6.404 1.00 0.27 H new ATOM 0 HD11 ILE A 75 5.727 -5.562 -4.124 1.00 0.25 H new ATOM 0 HD12 ILE A 75 6.480 -6.977 -4.897 1.00 0.25 H new ATOM 0 HD13 ILE A 75 7.094 -6.385 -3.335 1.00 0.25 H new ATOM 1152 N PRO A 76 10.851 -7.523 -7.943 1.00 0.26 N ATOM 1153 CA PRO A 76 12.232 -7.964 -8.196 1.00 0.25 C ATOM 1154 C PRO A 76 13.264 -6.963 -7.668 1.00 0.25 C ATOM 1155 O PRO A 76 13.196 -5.774 -7.977 1.00 0.34 O ATOM 1156 CB PRO A 76 12.296 -8.022 -9.720 1.00 0.31 C ATOM 1157 CG PRO A 76 10.890 -8.335 -10.125 1.00 0.80 C ATOM 1158 CD PRO A 76 10.042 -7.512 -9.179 1.00 0.50 C ATOM 0 HA PRO A 76 12.461 -8.907 -7.700 1.00 0.25 H new ATOM 0 HB2 PRO A 76 12.633 -7.075 -10.142 1.00 0.31 H new ATOM 0 HB3 PRO A 76 12.991 -8.789 -10.062 1.00 0.31 H new ATOM 0 HG2 PRO A 76 10.705 -8.064 -11.164 1.00 0.80 H new ATOM 0 HG3 PRO A 76 10.675 -9.399 -10.030 1.00 0.80 H new ATOM 0 HD2 PRO A 76 9.882 -6.500 -9.552 1.00 0.50 H new ATOM 0 HD3 PRO A 76 9.058 -7.954 -9.025 1.00 0.50 H new ATOM 1166 N ILE A 77 14.218 -7.449 -6.873 1.00 0.21 N ATOM 1167 CA ILE A 77 15.262 -6.587 -6.316 1.00 0.21 C ATOM 1168 C ILE A 77 16.649 -7.085 -6.706 1.00 0.23 C ATOM 1169 O ILE A 77 16.855 -8.280 -6.920 1.00 0.31 O ATOM 1170 CB ILE A 77 15.175 -6.499 -4.773 1.00 0.24 C ATOM 1171 CG1 ILE A 77 13.832 -5.887 -4.345 1.00 0.25 C ATOM 1172 CG2 ILE A 77 16.341 -5.676 -4.212 1.00 0.38 C ATOM 1173 CD1 ILE A 77 13.647 -5.801 -2.846 1.00 0.31 C ATOM 0 H ILE A 77 14.290 -8.429 -6.601 1.00 0.21 H new ATOM 0 HA ILE A 77 15.099 -5.593 -6.733 1.00 0.21 H new ATOM 0 HB ILE A 77 15.241 -7.509 -4.368 1.00 0.24 H new ATOM 0 HG12 ILE A 77 13.748 -4.887 -4.769 1.00 0.25 H new ATOM 0 HG13 ILE A 77 13.022 -6.481 -4.768 1.00 0.25 H new ATOM 0 HG21 ILE A 77 16.262 -5.626 -3.126 1.00 0.38 H new ATOM 0 HG22 ILE A 77 17.285 -6.148 -4.486 1.00 0.38 H new ATOM 0 HG23 ILE A 77 16.307 -4.668 -4.625 1.00 0.38 H new ATOM 0 HD11 ILE A 77 12.676 -5.359 -2.624 1.00 0.31 H new ATOM 0 HD12 ILE A 77 13.697 -6.801 -2.415 1.00 0.31 H new ATOM 0 HD13 ILE A 77 14.435 -5.181 -2.417 1.00 0.31 H new ATOM 1185 N LYS A 78 17.601 -6.158 -6.794 1.00 0.25 N ATOM 1186 CA LYS A 78 18.969 -6.501 -7.159 1.00 0.33 C ATOM 1187 C LYS A 78 19.980 -5.699 -6.338 1.00 0.28 C ATOM 1188 O LYS A 78 21.188 -5.865 -6.503 1.00 0.31 O ATOM 1189 CB LYS A 78 19.198 -6.241 -8.655 1.00 0.48 C ATOM 1190 CG LYS A 78 18.193 -6.959 -9.563 1.00 1.10 C ATOM 1191 CD LYS A 78 18.473 -6.700 -11.049 1.00 1.50 C ATOM 1192 CE LYS A 78 17.355 -7.261 -11.932 1.00 2.16 C ATOM 1193 NZ LYS A 78 16.051 -6.596 -11.651 1.00 2.96 N ATOM 0 H LYS A 78 17.448 -5.165 -6.617 1.00 0.25 H new ATOM 0 HA LYS A 78 19.116 -7.560 -6.946 1.00 0.33 H new ATOM 0 HB2 LYS A 78 19.142 -5.169 -8.842 1.00 0.48 H new ATOM 0 HB3 LYS A 78 20.206 -6.559 -8.920 1.00 0.48 H new ATOM 0 HG2 LYS A 78 18.230 -8.031 -9.369 1.00 1.10 H new ATOM 0 HG3 LYS A 78 17.184 -6.626 -9.321 1.00 1.10 H new ATOM 0 HD2 LYS A 78 18.572 -5.628 -11.221 1.00 1.50 H new ATOM 0 HD3 LYS A 78 19.423 -7.157 -11.327 1.00 1.50 H new ATOM 0 HE2 LYS A 78 17.616 -7.124 -12.982 1.00 2.16 H new ATOM 0 HE3 LYS A 78 17.261 -8.334 -11.764 1.00 2.16 H new ATOM 0 HZ1 LYS A 78 15.404 -6.749 -12.451 1.00 2.96 H new ATOM 0 HZ2 LYS A 78 15.635 -6.999 -10.787 1.00 2.96 H new ATOM 0 HZ3 LYS A 78 16.203 -5.576 -11.519 1.00 2.96 H new ATOM 1207 N GLU A 79 19.487 -4.832 -5.450 1.00 0.26 N ATOM 1208 CA GLU A 79 20.368 -4.012 -4.625 1.00 0.23 C ATOM 1209 C GLU A 79 20.040 -4.174 -3.146 1.00 0.19 C ATOM 1210 O GLU A 79 19.012 -4.753 -2.791 1.00 0.17 O ATOM 1211 CB GLU A 79 20.232 -2.544 -5.030 1.00 0.30 C ATOM 1212 CG GLU A 79 20.823 -2.227 -6.404 1.00 0.83 C ATOM 1213 CD GLU A 79 20.530 -0.808 -6.847 1.00 1.37 C ATOM 1214 OE1 GLU A 79 19.486 -0.591 -7.497 1.00 2.13 O ATOM 1215 OE2 GLU A 79 21.345 0.089 -6.543 1.00 1.48 O ATOM 0 H GLU A 79 18.491 -4.683 -5.287 1.00 0.26 H new ATOM 0 HA GLU A 79 21.395 -4.342 -4.784 1.00 0.23 H new ATOM 0 HB2 GLU A 79 19.176 -2.272 -5.027 1.00 0.30 H new ATOM 0 HB3 GLU A 79 20.723 -1.923 -4.281 1.00 0.30 H new ATOM 0 HG2 GLU A 79 21.902 -2.380 -6.376 1.00 0.83 H new ATOM 0 HG3 GLU A 79 20.421 -2.924 -7.139 1.00 0.83 H new ATOM 1222 N GLU A 80 20.918 -3.667 -2.285 1.00 0.23 N ATOM 1223 CA GLU A 80 20.708 -3.754 -0.851 1.00 0.21 C ATOM 1224 C GLU A 80 20.704 -2.373 -0.200 1.00 0.21 C ATOM 1225 O GLU A 80 21.072 -1.373 -0.816 1.00 0.31 O ATOM 1226 CB GLU A 80 21.776 -4.645 -0.212 1.00 0.21 C ATOM 1227 CG GLU A 80 21.696 -6.115 -0.647 1.00 0.22 C ATOM 1228 CD GLU A 80 22.878 -6.531 -1.499 1.00 0.28 C ATOM 1229 OE1 GLU A 80 22.797 -6.389 -2.736 1.00 0.37 O ATOM 1230 OE2 GLU A 80 23.888 -6.997 -0.928 1.00 0.37 O ATOM 0 H GLU A 80 21.779 -3.193 -2.559 1.00 0.23 H new ATOM 0 HA GLU A 80 19.728 -4.200 -0.683 1.00 0.21 H new ATOM 0 HB2 GLU A 80 22.761 -4.254 -0.465 1.00 0.21 H new ATOM 0 HB3 GLU A 80 21.680 -4.591 0.872 1.00 0.21 H new ATOM 0 HG2 GLU A 80 21.648 -6.750 0.237 1.00 0.22 H new ATOM 0 HG3 GLU A 80 20.774 -6.276 -1.206 1.00 0.22 H new ATOM 1237 N GLY A 81 20.284 -2.348 1.058 1.00 0.19 N ATOM 1238 CA GLY A 81 20.190 -1.116 1.820 1.00 0.20 C ATOM 1239 C GLY A 81 18.963 -1.154 2.703 1.00 0.18 C ATOM 1240 O GLY A 81 18.540 -2.242 3.094 1.00 0.21 O ATOM 0 H GLY A 81 20.000 -3.180 1.575 1.00 0.19 H new ATOM 0 HA2 GLY A 81 21.084 -0.985 2.429 1.00 0.20 H new ATOM 0 HA3 GLY A 81 20.137 -0.262 1.144 1.00 0.20 H new ATOM 1244 N GLU A 82 18.369 -0.008 3.036 1.00 0.17 N ATOM 1245 CA GLU A 82 17.173 -0.051 3.854 1.00 0.16 C ATOM 1246 C GLU A 82 15.963 0.170 2.965 1.00 0.16 C ATOM 1247 O GLU A 82 15.712 1.285 2.522 1.00 0.18 O ATOM 1248 CB GLU A 82 17.218 0.997 4.970 1.00 0.18 C ATOM 1249 CG GLU A 82 18.508 0.986 5.788 1.00 0.24 C ATOM 1250 CD GLU A 82 18.386 1.793 7.066 1.00 1.16 C ATOM 1251 OE1 GLU A 82 17.741 1.305 8.017 1.00 1.26 O ATOM 1252 OE2 GLU A 82 18.937 2.913 7.117 1.00 2.03 O ATOM 0 H GLU A 82 18.685 0.922 2.762 1.00 0.17 H new ATOM 0 HA GLU A 82 17.108 -1.028 4.333 1.00 0.16 H new ATOM 0 HB2 GLU A 82 17.089 1.986 4.530 1.00 0.18 H new ATOM 0 HB3 GLU A 82 16.374 0.834 5.641 1.00 0.18 H new ATOM 0 HG2 GLU A 82 18.771 -0.043 6.034 1.00 0.24 H new ATOM 0 HG3 GLU A 82 19.322 1.387 5.184 1.00 0.24 H new ATOM 1259 N TYR A 83 15.187 -0.880 2.722 1.00 0.15 N ATOM 1260 CA TYR A 83 14.034 -0.735 1.850 1.00 0.15 C ATOM 1261 C TYR A 83 12.816 -0.475 2.684 1.00 0.16 C ATOM 1262 O TYR A 83 12.490 -1.227 3.600 1.00 0.16 O ATOM 1263 CB TYR A 83 13.824 -1.962 0.950 1.00 0.15 C ATOM 1264 CG TYR A 83 14.886 -2.109 -0.121 1.00 0.16 C ATOM 1265 CD1 TYR A 83 16.244 -2.022 0.174 1.00 0.22 C ATOM 1266 CD2 TYR A 83 14.521 -2.355 -1.438 1.00 0.24 C ATOM 1267 CE1 TYR A 83 17.196 -2.177 -0.810 1.00 0.25 C ATOM 1268 CE2 TYR A 83 15.471 -2.507 -2.426 1.00 0.25 C ATOM 1269 CZ TYR A 83 16.858 -2.342 -2.066 1.00 0.22 C ATOM 1270 OH TYR A 83 17.757 -2.579 -3.086 1.00 0.26 O ATOM 0 H TYR A 83 15.330 -1.814 3.105 1.00 0.15 H new ATOM 0 HA TYR A 83 14.215 0.110 1.185 1.00 0.15 H new ATOM 0 HB2 TYR A 83 13.815 -2.860 1.568 1.00 0.15 H new ATOM 0 HB3 TYR A 83 12.846 -1.892 0.475 1.00 0.15 H new ATOM 0 HD1 TYR A 83 16.556 -1.830 1.190 1.00 0.22 H new ATOM 0 HD2 TYR A 83 13.474 -2.429 -1.693 1.00 0.24 H new ATOM 0 HE1 TYR A 83 18.242 -2.162 -0.541 1.00 0.25 H new ATOM 0 HE2 TYR A 83 15.185 -2.743 -3.440 1.00 0.25 H new ATOM 0 HH TYR A 83 17.917 -3.543 -3.164 1.00 0.26 H new ATOM 1280 N VAL A 84 12.139 0.598 2.346 1.00 0.17 N ATOM 1281 CA VAL A 84 10.978 1.007 3.095 1.00 0.18 C ATOM 1282 C VAL A 84 9.707 0.796 2.304 1.00 0.19 C ATOM 1283 O VAL A 84 9.470 1.436 1.275 1.00 0.25 O ATOM 1284 CB VAL A 84 11.121 2.467 3.555 1.00 0.21 C ATOM 1285 CG1 VAL A 84 9.948 2.874 4.450 1.00 0.54 C ATOM 1286 CG2 VAL A 84 12.452 2.615 4.282 1.00 0.54 C ATOM 0 H VAL A 84 12.373 1.202 1.558 1.00 0.17 H new ATOM 0 HA VAL A 84 10.909 0.379 3.983 1.00 0.18 H new ATOM 0 HB VAL A 84 11.105 3.131 2.691 1.00 0.21 H new ATOM 0 HG11 VAL A 84 10.072 3.911 4.763 1.00 0.54 H new ATOM 0 HG12 VAL A 84 9.015 2.771 3.896 1.00 0.54 H new ATOM 0 HG13 VAL A 84 9.921 2.231 5.329 1.00 0.54 H new ATOM 0 HG21 VAL A 84 12.571 3.646 4.616 1.00 0.54 H new ATOM 0 HG22 VAL A 84 12.471 1.949 5.145 1.00 0.54 H new ATOM 0 HG23 VAL A 84 13.267 2.356 3.606 1.00 0.54 H new ATOM 1296 N LEU A 85 8.903 -0.134 2.799 1.00 0.19 N ATOM 1297 CA LEU A 85 7.653 -0.480 2.160 1.00 0.22 C ATOM 1298 C LEU A 85 6.484 0.214 2.850 1.00 0.25 C ATOM 1299 O LEU A 85 6.073 -0.175 3.944 1.00 0.32 O ATOM 1300 CB LEU A 85 7.473 -2.000 2.200 1.00 0.33 C ATOM 1301 CG LEU A 85 6.275 -2.539 1.402 1.00 0.69 C ATOM 1302 CD1 LEU A 85 6.611 -2.772 -0.059 1.00 0.90 C ATOM 1303 CD2 LEU A 85 5.730 -3.816 2.021 1.00 1.23 C ATOM 0 H LEU A 85 9.101 -0.663 3.648 1.00 0.19 H new ATOM 0 HA LEU A 85 7.675 -0.144 1.123 1.00 0.22 H new ATOM 0 HB2 LEU A 85 8.382 -2.467 1.820 1.00 0.33 H new ATOM 0 HB3 LEU A 85 7.365 -2.310 3.240 1.00 0.33 H new ATOM 0 HG LEU A 85 5.505 -1.769 1.446 1.00 0.69 H new ATOM 0 HD11 LEU A 85 5.732 -3.153 -0.578 1.00 0.90 H new ATOM 0 HD12 LEU A 85 6.923 -1.832 -0.515 1.00 0.90 H new ATOM 0 HD13 LEU A 85 7.420 -3.499 -0.135 1.00 0.90 H new ATOM 0 HD21 LEU A 85 4.884 -4.172 1.434 1.00 1.23 H new ATOM 0 HD22 LEU A 85 6.510 -4.577 2.032 1.00 1.23 H new ATOM 0 HD23 LEU A 85 5.405 -3.615 3.042 1.00 1.23 H new ATOM 1315 N VAL A 86 5.959 1.245 2.199 1.00 0.28 N ATOM 1316 CA VAL A 86 4.831 1.998 2.729 1.00 0.38 C ATOM 1317 C VAL A 86 3.608 1.795 1.842 1.00 0.35 C ATOM 1318 O VAL A 86 3.702 1.840 0.613 1.00 0.38 O ATOM 1319 CB VAL A 86 5.161 3.510 2.848 1.00 0.52 C ATOM 1320 CG1 VAL A 86 5.968 3.970 1.637 1.00 1.28 C ATOM 1321 CG2 VAL A 86 3.879 4.337 2.982 1.00 1.31 C ATOM 0 H VAL A 86 6.300 1.580 1.298 1.00 0.28 H new ATOM 0 HA VAL A 86 4.618 1.625 3.731 1.00 0.38 H new ATOM 0 HB VAL A 86 5.759 3.662 3.746 1.00 0.52 H new ATOM 0 HG11 VAL A 86 6.193 5.032 1.732 1.00 1.28 H new ATOM 0 HG12 VAL A 86 6.899 3.405 1.584 1.00 1.28 H new ATOM 0 HG13 VAL A 86 5.389 3.802 0.729 1.00 1.28 H new ATOM 0 HG21 VAL A 86 4.134 5.393 3.064 1.00 1.31 H new ATOM 0 HG22 VAL A 86 3.253 4.182 2.103 1.00 1.31 H new ATOM 0 HG23 VAL A 86 3.336 4.025 3.874 1.00 1.31 H new ATOM 1331 N LEU A 87 2.465 1.561 2.475 1.00 0.35 N ATOM 1332 CA LEU A 87 1.224 1.320 1.743 1.00 0.36 C ATOM 1333 C LEU A 87 0.075 2.137 2.306 1.00 0.27 C ATOM 1334 O LEU A 87 -0.102 2.212 3.524 1.00 0.30 O ATOM 1335 CB LEU A 87 0.838 -0.170 1.841 1.00 0.50 C ATOM 1336 CG LEU A 87 1.678 -0.982 2.837 1.00 0.58 C ATOM 1337 CD1 LEU A 87 0.944 -2.231 3.297 1.00 1.34 C ATOM 1338 CD2 LEU A 87 3.011 -1.358 2.229 1.00 1.37 C ATOM 0 H LEU A 87 2.370 1.533 3.490 1.00 0.35 H new ATOM 0 HA LEU A 87 1.399 1.611 0.707 1.00 0.36 H new ATOM 0 HB2 LEU A 87 -0.211 -0.242 2.127 1.00 0.50 H new ATOM 0 HB3 LEU A 87 0.931 -0.622 0.854 1.00 0.50 H new ATOM 0 HG LEU A 87 1.851 -0.351 3.709 1.00 0.58 H new ATOM 0 HD11 LEU A 87 1.568 -2.781 4.001 1.00 1.34 H new ATOM 0 HD12 LEU A 87 0.012 -1.946 3.784 1.00 1.34 H new ATOM 0 HD13 LEU A 87 0.725 -2.862 2.436 1.00 1.34 H new ATOM 0 HD21 LEU A 87 3.591 -1.933 2.951 1.00 1.37 H new ATOM 0 HD22 LEU A 87 2.846 -1.959 1.335 1.00 1.37 H new ATOM 0 HD23 LEU A 87 3.558 -0.453 1.963 1.00 1.37 H new ATOM 1350 N LYS A 88 -0.706 2.754 1.422 1.00 0.22 N ATOM 1351 CA LYS A 88 -1.881 3.503 1.883 1.00 0.19 C ATOM 1352 C LYS A 88 -3.131 2.671 1.616 1.00 0.18 C ATOM 1353 O LYS A 88 -3.479 2.402 0.465 1.00 0.20 O ATOM 1354 CB LYS A 88 -2.003 4.906 1.232 1.00 0.21 C ATOM 1355 CG LYS A 88 -2.474 6.008 2.190 1.00 0.47 C ATOM 1356 CD LYS A 88 -1.309 6.590 3.008 1.00 1.52 C ATOM 1357 CE LYS A 88 -1.788 7.620 4.034 1.00 2.25 C ATOM 1358 NZ LYS A 88 -0.658 8.173 4.831 1.00 2.97 N ATOM 0 H LYS A 88 -0.558 2.755 0.413 1.00 0.22 H new ATOM 0 HA LYS A 88 -1.766 3.681 2.952 1.00 0.19 H new ATOM 0 HB2 LYS A 88 -1.034 5.188 0.821 1.00 0.21 H new ATOM 0 HB3 LYS A 88 -2.699 4.846 0.395 1.00 0.21 H new ATOM 0 HG2 LYS A 88 -2.952 6.805 1.620 1.00 0.47 H new ATOM 0 HG3 LYS A 88 -3.227 5.604 2.867 1.00 0.47 H new ATOM 0 HD2 LYS A 88 -0.787 5.782 3.521 1.00 1.52 H new ATOM 0 HD3 LYS A 88 -0.590 7.056 2.334 1.00 1.52 H new ATOM 0 HE2 LYS A 88 -2.303 8.432 3.521 1.00 2.25 H new ATOM 0 HE3 LYS A 88 -2.513 7.156 4.704 1.00 2.25 H new ATOM 0 HZ1 LYS A 88 -0.928 8.212 5.835 1.00 2.97 H new ATOM 0 HZ2 LYS A 88 0.176 7.562 4.720 1.00 2.97 H new ATOM 0 HZ3 LYS A 88 -0.433 9.131 4.495 1.00 2.97 H new ATOM 1372 N PHE A 89 -3.801 2.260 2.689 1.00 0.18 N ATOM 1373 CA PHE A 89 -5.011 1.450 2.575 1.00 0.18 C ATOM 1374 C PHE A 89 -6.220 2.336 2.838 1.00 0.19 C ATOM 1375 O PHE A 89 -6.176 3.198 3.714 1.00 0.22 O ATOM 1376 CB PHE A 89 -5.000 0.293 3.600 1.00 0.20 C ATOM 1377 CG PHE A 89 -4.307 -0.977 3.142 1.00 0.20 C ATOM 1378 CD1 PHE A 89 -4.708 -1.663 1.986 1.00 0.24 C ATOM 1379 CD2 PHE A 89 -3.230 -1.481 3.861 1.00 0.23 C ATOM 1380 CE1 PHE A 89 -4.042 -2.802 1.581 1.00 0.30 C ATOM 1381 CE2 PHE A 89 -2.573 -2.627 3.452 1.00 0.27 C ATOM 1382 CZ PHE A 89 -3.088 -3.337 2.295 1.00 0.29 C ATOM 0 H PHE A 89 -3.527 2.474 3.648 1.00 0.18 H new ATOM 0 HA PHE A 89 -5.056 1.024 1.573 1.00 0.18 H new ATOM 0 HB2 PHE A 89 -4.515 0.643 4.512 1.00 0.20 H new ATOM 0 HB3 PHE A 89 -6.030 0.051 3.860 1.00 0.20 H new ATOM 0 HD1 PHE A 89 -5.544 -1.297 1.409 1.00 0.24 H new ATOM 0 HD2 PHE A 89 -2.901 -0.970 4.753 1.00 0.23 H new ATOM 0 HE1 PHE A 89 -4.318 -3.265 0.645 1.00 0.30 H new ATOM 0 HE2 PHE A 89 -1.701 -2.984 3.979 1.00 0.27 H new ATOM 0 HZ PHE A 89 -2.685 -4.302 2.026 1.00 0.29 H new ATOM 1392 N ALA A 90 -7.303 2.135 2.089 1.00 0.22 N ATOM 1393 CA ALA A 90 -8.484 2.983 2.286 1.00 0.28 C ATOM 1394 C ALA A 90 -9.796 2.312 1.860 1.00 0.36 C ATOM 1395 O ALA A 90 -9.803 1.240 1.246 1.00 0.38 O ATOM 1396 CB ALA A 90 -8.303 4.297 1.528 1.00 0.41 C ATOM 0 H ALA A 90 -7.391 1.421 1.366 1.00 0.22 H new ATOM 0 HA ALA A 90 -8.564 3.166 3.357 1.00 0.28 H new ATOM 0 HB1 ALA A 90 -9.181 4.926 1.675 1.00 0.41 H new ATOM 0 HB2 ALA A 90 -7.419 4.814 1.902 1.00 0.41 H new ATOM 0 HB3 ALA A 90 -8.179 4.090 0.465 1.00 0.41 H new ATOM 1484 N GLN A 96 -17.072 -0.914 9.990 1.00 0.79 N ATOM 1485 CA GLN A 96 -17.239 -1.807 11.133 1.00 0.78 C ATOM 1486 C GLN A 96 -15.890 -2.073 11.797 1.00 0.62 C ATOM 1487 O GLN A 96 -14.860 -2.119 11.125 1.00 0.61 O ATOM 1488 CB GLN A 96 -17.886 -3.124 10.696 1.00 0.91 C ATOM 1489 CG GLN A 96 -18.571 -3.870 11.844 1.00 1.56 C ATOM 1490 CD GLN A 96 -19.756 -3.104 12.401 1.00 2.25 C ATOM 1491 OE1 GLN A 96 -19.501 -2.266 13.399 1.00 2.80 O flip ATOM 1492 NE2 GLN A 96 -20.885 -3.265 11.941 1.00 2.96 N flip ATOM 0 HA GLN A 96 -17.896 -1.324 11.856 1.00 0.78 H new ATOM 0 HB2 GLN A 96 -18.619 -2.920 9.916 1.00 0.91 H new ATOM 0 HB3 GLN A 96 -17.124 -3.768 10.257 1.00 0.91 H new ATOM 0 HG2 GLN A 96 -18.905 -4.846 11.492 1.00 1.56 H new ATOM 0 HG3 GLN A 96 -17.849 -4.048 12.641 1.00 1.56 H new ATOM 0 HE21 GLN A 96 -21.034 -3.920 11.173 1.00 2.96 H new ATOM 0 HE22 GLN A 96 -21.672 -2.744 12.327 1.00 2.96 H new ATOM 1501 N SER A 97 -15.899 -2.252 13.116 1.00 0.65 N ATOM 1502 CA SER A 97 -14.665 -2.490 13.862 1.00 0.59 C ATOM 1503 C SER A 97 -14.582 -3.917 14.402 1.00 0.68 C ATOM 1504 O SER A 97 -15.598 -4.540 14.712 1.00 1.18 O ATOM 1505 CB SER A 97 -14.553 -1.496 15.020 1.00 0.75 C ATOM 1506 OG SER A 97 -14.279 -0.188 14.548 1.00 1.55 O ATOM 0 H SER A 97 -16.743 -2.237 13.688 1.00 0.65 H new ATOM 0 HA SER A 97 -13.836 -2.350 13.168 1.00 0.59 H new ATOM 0 HB2 SER A 97 -15.482 -1.492 15.591 1.00 0.75 H new ATOM 0 HB3 SER A 97 -13.762 -1.813 15.700 1.00 0.75 H new ATOM 0 HG SER A 97 -13.461 0.148 14.971 1.00 1.55 H new ATOM 1512 N GLN A 98 -13.348 -4.413 14.517 1.00 0.61 N ATOM 1513 CA GLN A 98 -13.080 -5.758 15.029 1.00 0.71 C ATOM 1514 C GLN A 98 -13.994 -6.802 14.389 1.00 0.84 C ATOM 1515 O GLN A 98 -14.371 -7.787 15.024 1.00 1.48 O ATOM 1516 CB GLN A 98 -13.235 -5.788 16.554 1.00 0.95 C ATOM 1517 CG GLN A 98 -12.570 -7.002 17.211 1.00 1.55 C ATOM 1518 CD GLN A 98 -11.068 -7.021 17.002 1.00 1.83 C ATOM 1519 OE1 GLN A 98 -10.430 -5.973 16.900 1.00 2.32 O ATOM 1520 NE2 GLN A 98 -10.497 -8.218 16.933 1.00 2.33 N ATOM 0 H GLN A 98 -12.508 -3.895 14.258 1.00 0.61 H new ATOM 0 HA GLN A 98 -12.053 -6.010 14.766 1.00 0.71 H new ATOM 0 HB2 GLN A 98 -12.806 -4.878 16.973 1.00 0.95 H new ATOM 0 HB3 GLN A 98 -14.296 -5.785 16.804 1.00 0.95 H new ATOM 0 HG2 GLN A 98 -12.786 -6.997 18.279 1.00 1.55 H new ATOM 0 HG3 GLN A 98 -13.003 -7.915 16.803 1.00 1.55 H new ATOM 0 HE21 GLN A 98 -11.065 -9.060 17.023 1.00 2.33 H new ATOM 0 HE22 GLN A 98 -9.490 -8.295 16.790 1.00 2.33 H new ATOM 1529 N GLN A 99 -14.348 -6.580 13.131 1.00 0.77 N ATOM 1530 CA GLN A 99 -15.204 -7.509 12.403 1.00 0.86 C ATOM 1531 C GLN A 99 -14.593 -7.814 11.042 1.00 0.79 C ATOM 1532 O GLN A 99 -14.595 -8.959 10.589 1.00 0.97 O ATOM 1533 CB GLN A 99 -16.612 -6.927 12.234 1.00 0.96 C ATOM 1534 CG GLN A 99 -17.652 -7.958 11.790 1.00 1.43 C ATOM 1535 CD GLN A 99 -19.002 -7.333 11.499 1.00 1.89 C ATOM 1536 OE1 GLN A 99 -19.282 -6.931 10.369 1.00 2.51 O ATOM 1537 NE2 GLN A 99 -19.848 -7.249 12.519 1.00 2.47 N ATOM 0 H GLN A 99 -14.056 -5.765 12.592 1.00 0.77 H new ATOM 0 HA GLN A 99 -15.283 -8.434 12.975 1.00 0.86 H new ATOM 0 HB2 GLN A 99 -16.930 -6.487 13.179 1.00 0.96 H new ATOM 0 HB3 GLN A 99 -16.577 -6.120 11.502 1.00 0.96 H new ATOM 0 HG2 GLN A 99 -17.293 -8.471 10.898 1.00 1.43 H new ATOM 0 HG3 GLN A 99 -17.765 -8.713 12.568 1.00 1.43 H new ATOM 0 HE21 GLN A 99 -19.574 -7.595 13.439 1.00 2.47 H new ATOM 0 HE22 GLN A 99 -20.772 -6.839 12.383 1.00 2.47 H new ATOM 1546 N LYS A 100 -14.074 -6.775 10.397 1.00 0.65 N ATOM 1547 CA LYS A 100 -13.435 -6.918 9.097 1.00 0.71 C ATOM 1548 C LYS A 100 -11.925 -6.773 9.248 1.00 0.57 C ATOM 1549 O LYS A 100 -11.367 -5.698 9.028 1.00 0.58 O ATOM 1550 CB LYS A 100 -13.977 -5.870 8.116 1.00 0.89 C ATOM 1551 CG LYS A 100 -15.486 -6.001 7.855 1.00 1.35 C ATOM 1552 CD LYS A 100 -16.001 -4.973 6.827 1.00 1.70 C ATOM 1553 CE LYS A 100 -15.896 -5.484 5.385 1.00 2.39 C ATOM 1554 NZ LYS A 100 -16.295 -4.439 4.402 1.00 3.10 N ATOM 0 H LYS A 100 -14.084 -5.821 10.757 1.00 0.65 H new ATOM 0 HA LYS A 100 -13.659 -7.908 8.699 1.00 0.71 H new ATOM 0 HB2 LYS A 100 -13.769 -4.874 8.508 1.00 0.89 H new ATOM 0 HB3 LYS A 100 -13.443 -5.958 7.170 1.00 0.89 H new ATOM 0 HG2 LYS A 100 -15.703 -7.007 7.497 1.00 1.35 H new ATOM 0 HG3 LYS A 100 -16.026 -5.873 8.793 1.00 1.35 H new ATOM 0 HD2 LYS A 100 -17.040 -4.731 7.049 1.00 1.70 H new ATOM 0 HD3 LYS A 100 -15.431 -4.049 6.924 1.00 1.70 H new ATOM 0 HE2 LYS A 100 -14.873 -5.801 5.184 1.00 2.39 H new ATOM 0 HE3 LYS A 100 -16.531 -6.361 5.262 1.00 2.39 H new ATOM 0 HZ1 LYS A 100 -16.212 -4.820 3.438 1.00 3.10 H new ATOM 0 HZ2 LYS A 100 -17.280 -4.155 4.578 1.00 3.10 H new ATOM 0 HZ3 LYS A 100 -15.673 -3.612 4.503 1.00 3.10 H new ATOM 1568 N VAL A 101 -11.272 -7.867 9.626 1.00 0.50 N ATOM 1569 CA VAL A 101 -9.828 -7.872 9.822 1.00 0.42 C ATOM 1570 C VAL A 101 -9.158 -8.676 8.706 1.00 0.42 C ATOM 1571 O VAL A 101 -9.713 -9.667 8.235 1.00 0.58 O ATOM 1572 CB VAL A 101 -9.465 -8.458 11.216 1.00 0.44 C ATOM 1573 CG1 VAL A 101 -10.573 -8.145 12.222 1.00 1.25 C ATOM 1574 CG2 VAL A 101 -9.238 -9.968 11.139 1.00 1.31 C ATOM 0 H VAL A 101 -11.723 -8.765 9.803 1.00 0.50 H new ATOM 0 HA VAL A 101 -9.463 -6.846 9.785 1.00 0.42 H new ATOM 0 HB VAL A 101 -8.537 -7.992 11.547 1.00 0.44 H new ATOM 0 HG11 VAL A 101 -10.309 -8.560 13.195 1.00 1.25 H new ATOM 0 HG12 VAL A 101 -10.692 -7.065 12.308 1.00 1.25 H new ATOM 0 HG13 VAL A 101 -11.509 -8.587 11.881 1.00 1.25 H new ATOM 0 HG21 VAL A 101 -8.986 -10.349 12.129 1.00 1.31 H new ATOM 0 HG22 VAL A 101 -10.146 -10.455 10.783 1.00 1.31 H new ATOM 0 HG23 VAL A 101 -8.420 -10.178 10.450 1.00 1.31 H new ATOM 1584 N PHE A 102 -7.974 -8.245 8.280 1.00 0.32 N ATOM 1585 CA PHE A 102 -7.270 -8.917 7.186 1.00 0.32 C ATOM 1586 C PHE A 102 -5.835 -9.279 7.541 1.00 0.28 C ATOM 1587 O PHE A 102 -5.396 -9.046 8.656 1.00 0.29 O ATOM 1588 CB PHE A 102 -7.260 -7.993 5.980 1.00 0.34 C ATOM 1589 CG PHE A 102 -8.634 -7.746 5.407 1.00 0.45 C ATOM 1590 CD1 PHE A 102 -9.331 -8.755 4.744 1.00 0.56 C ATOM 1591 CD2 PHE A 102 -9.226 -6.497 5.522 1.00 0.50 C ATOM 1592 CE1 PHE A 102 -10.589 -8.515 4.213 1.00 0.67 C ATOM 1593 CE2 PHE A 102 -10.484 -6.253 4.995 1.00 0.62 C ATOM 1594 CZ PHE A 102 -11.182 -7.314 4.357 1.00 0.69 C ATOM 0 H PHE A 102 -7.483 -7.441 8.670 1.00 0.32 H new ATOM 0 HA PHE A 102 -7.796 -9.848 6.976 1.00 0.32 H new ATOM 0 HB2 PHE A 102 -6.816 -7.039 6.265 1.00 0.34 H new ATOM 0 HB3 PHE A 102 -6.623 -8.423 5.207 1.00 0.34 H new ATOM 0 HD1 PHE A 102 -8.886 -9.734 4.643 1.00 0.56 H new ATOM 0 HD2 PHE A 102 -8.699 -5.703 6.030 1.00 0.50 H new ATOM 0 HE1 PHE A 102 -11.100 -9.301 3.677 1.00 0.67 H new ATOM 0 HE2 PHE A 102 -10.928 -5.271 5.068 1.00 0.62 H new ATOM 0 HZ PHE A 102 -12.185 -7.158 3.989 1.00 0.69 H new ATOM 1604 N ASP A 103 -5.105 -9.862 6.581 1.00 0.29 N ATOM 1605 CA ASP A 103 -3.709 -10.223 6.824 1.00 0.27 C ATOM 1606 C ASP A 103 -2.778 -9.679 5.741 1.00 0.25 C ATOM 1607 O ASP A 103 -3.135 -9.630 4.563 1.00 0.27 O ATOM 1608 CB ASP A 103 -3.549 -11.739 6.969 1.00 0.34 C ATOM 1609 CG ASP A 103 -2.097 -12.167 7.034 1.00 1.25 C ATOM 1610 OD1 ASP A 103 -1.468 -12.286 5.962 1.00 2.01 O ATOM 1611 OD2 ASP A 103 -1.588 -12.381 8.154 1.00 1.45 O ATOM 0 H ASP A 103 -5.452 -10.089 5.649 1.00 0.29 H new ATOM 0 HA ASP A 103 -3.418 -9.756 7.765 1.00 0.27 H new ATOM 0 HB2 ASP A 103 -4.063 -12.070 7.872 1.00 0.34 H new ATOM 0 HB3 ASP A 103 -4.033 -12.234 6.127 1.00 0.34 H new ATOM 1616 N VAL A 104 -1.570 -9.277 6.159 1.00 0.23 N ATOM 1617 CA VAL A 104 -0.580 -8.709 5.243 1.00 0.22 C ATOM 1618 C VAL A 104 0.839 -9.211 5.531 1.00 0.20 C ATOM 1619 O VAL A 104 1.308 -9.169 6.681 1.00 0.20 O ATOM 1620 CB VAL A 104 -0.607 -7.164 5.317 1.00 0.24 C ATOM 1621 CG1 VAL A 104 0.800 -6.585 5.206 1.00 0.37 C ATOM 1622 CG2 VAL A 104 -1.497 -6.582 4.220 1.00 0.46 C ATOM 0 H VAL A 104 -1.257 -9.336 7.128 1.00 0.23 H new ATOM 0 HA VAL A 104 -0.850 -9.039 4.240 1.00 0.22 H new ATOM 0 HB VAL A 104 -1.020 -6.888 6.287 1.00 0.24 H new ATOM 0 HG11 VAL A 104 0.751 -5.497 5.261 1.00 0.37 H new ATOM 0 HG12 VAL A 104 1.414 -6.963 6.023 1.00 0.37 H new ATOM 0 HG13 VAL A 104 1.241 -6.881 4.254 1.00 0.37 H new ATOM 0 HG21 VAL A 104 -1.500 -5.494 4.293 1.00 0.46 H new ATOM 0 HG22 VAL A 104 -1.113 -6.879 3.244 1.00 0.46 H new ATOM 0 HG23 VAL A 104 -2.514 -6.956 4.340 1.00 0.46 H new ATOM 1632 N ARG A 105 1.526 -9.639 4.455 1.00 0.23 N ATOM 1633 CA ARG A 105 2.892 -10.160 4.553 1.00 0.24 C ATOM 1634 C ARG A 105 3.818 -9.577 3.495 1.00 0.21 C ATOM 1635 O ARG A 105 3.397 -9.240 2.387 1.00 0.23 O ATOM 1636 CB ARG A 105 2.904 -11.700 4.423 1.00 0.29 C ATOM 1637 CG ARG A 105 1.581 -12.294 3.926 1.00 0.53 C ATOM 1638 CD ARG A 105 1.666 -13.817 3.769 1.00 0.52 C ATOM 1639 NE ARG A 105 0.448 -14.384 3.197 1.00 0.98 N ATOM 1640 CZ ARG A 105 0.252 -15.691 3.036 1.00 1.40 C ATOM 1641 NH1 ARG A 105 1.176 -16.557 3.428 1.00 1.41 N ATOM 1642 NH2 ARG A 105 -0.869 -16.133 2.484 1.00 1.85 N ATOM 0 H ARG A 105 1.151 -9.632 3.507 1.00 0.23 H new ATOM 0 HA ARG A 105 3.259 -9.861 5.535 1.00 0.24 H new ATOM 0 HB2 ARG A 105 3.701 -11.990 3.738 1.00 0.29 H new ATOM 0 HB3 ARG A 105 3.144 -12.134 5.394 1.00 0.29 H new ATOM 0 HG2 ARG A 105 0.784 -12.044 4.627 1.00 0.53 H new ATOM 0 HG3 ARG A 105 1.317 -11.844 2.969 1.00 0.53 H new ATOM 0 HD2 ARG A 105 2.515 -14.068 3.132 1.00 0.52 H new ATOM 0 HD3 ARG A 105 1.853 -14.271 4.742 1.00 0.52 H new ATOM 0 HE ARG A 105 -0.292 -13.745 2.905 1.00 0.98 H new ATOM 0 HH11 ARG A 105 2.040 -16.223 3.854 1.00 1.41 H new ATOM 0 HH12 ARG A 105 1.023 -17.558 3.303 1.00 1.41 H new ATOM 0 HH21 ARG A 105 -1.584 -15.471 2.181 1.00 1.85 H new ATOM 0 HH22 ARG A 105 -1.017 -17.135 2.362 1.00 1.85 H new ATOM 1656 N VAL A 106 5.098 -9.481 3.865 1.00 0.24 N ATOM 1657 CA VAL A 106 6.131 -8.971 2.983 1.00 0.23 C ATOM 1658 C VAL A 106 7.186 -10.059 2.736 1.00 0.19 C ATOM 1659 O VAL A 106 7.847 -10.531 3.660 1.00 0.18 O ATOM 1660 CB VAL A 106 6.760 -7.666 3.545 1.00 0.28 C ATOM 1661 CG1 VAL A 106 5.650 -6.694 3.950 1.00 1.10 C ATOM 1662 CG2 VAL A 106 7.660 -7.943 4.744 1.00 1.07 C ATOM 0 H VAL A 106 5.439 -9.757 4.786 1.00 0.24 H new ATOM 0 HA VAL A 106 5.681 -8.710 2.025 1.00 0.23 H new ATOM 0 HB VAL A 106 7.375 -7.226 2.760 1.00 0.28 H new ATOM 0 HG11 VAL A 106 6.093 -5.779 4.344 1.00 1.10 H new ATOM 0 HG12 VAL A 106 5.040 -6.456 3.079 1.00 1.10 H new ATOM 0 HG13 VAL A 106 5.025 -7.154 4.716 1.00 1.10 H new ATOM 0 HG21 VAL A 106 8.080 -7.005 5.108 1.00 1.07 H new ATOM 0 HG22 VAL A 106 7.076 -8.411 5.537 1.00 1.07 H new ATOM 0 HG23 VAL A 106 8.468 -8.611 4.446 1.00 1.07 H new ATOM 1672 N ASN A 107 7.315 -10.461 1.474 1.00 0.22 N ATOM 1673 CA ASN A 107 8.221 -11.540 1.082 1.00 0.25 C ATOM 1674 C ASN A 107 7.891 -12.786 1.872 1.00 0.26 C ATOM 1675 O ASN A 107 8.738 -13.649 2.105 1.00 0.31 O ATOM 1676 CB ASN A 107 9.679 -11.168 1.277 1.00 0.28 C ATOM 1677 CG ASN A 107 10.577 -11.838 0.265 1.00 0.76 C ATOM 1678 OD1 ASN A 107 11.432 -11.048 -0.354 1.00 1.77 O flip ATOM 1679 ND2 ASN A 107 10.489 -13.043 0.032 1.00 1.04 N flip ATOM 0 H ASN A 107 6.797 -10.051 0.697 1.00 0.22 H new ATOM 0 HA ASN A 107 8.078 -11.724 0.017 1.00 0.25 H new ATOM 0 HB2 ASN A 107 9.790 -10.086 1.200 1.00 0.28 H new ATOM 0 HB3 ASN A 107 9.993 -11.449 2.282 1.00 0.28 H new ATOM 0 HD21 ASN A 107 9.811 -13.612 0.538 1.00 1.04 H new ATOM 0 HD22 ASN A 107 11.094 -13.473 -0.667 1.00 1.04 H new ATOM 1686 N GLY A 108 6.638 -12.855 2.282 1.00 0.26 N ATOM 1687 CA GLY A 108 6.158 -13.989 3.034 1.00 0.29 C ATOM 1688 C GLY A 108 6.201 -13.775 4.532 1.00 0.26 C ATOM 1689 O GLY A 108 6.118 -14.732 5.301 1.00 0.41 O ATOM 0 H GLY A 108 5.937 -12.136 2.104 1.00 0.26 H new ATOM 0 HA2 GLY A 108 5.133 -14.207 2.734 1.00 0.29 H new ATOM 0 HA3 GLY A 108 6.757 -14.864 2.781 1.00 0.29 H new ATOM 1693 N HIS A 109 6.332 -12.525 4.950 1.00 0.25 N ATOM 1694 CA HIS A 109 6.423 -12.205 6.363 1.00 0.22 C ATOM 1695 C HIS A 109 5.238 -11.370 6.872 1.00 0.24 C ATOM 1696 O HIS A 109 5.134 -10.188 6.554 1.00 0.46 O ATOM 1697 CB HIS A 109 7.711 -11.427 6.575 1.00 0.21 C ATOM 1698 CG HIS A 109 8.954 -12.257 6.546 1.00 0.27 C ATOM 1699 ND1 HIS A 109 9.451 -12.911 7.653 1.00 0.39 N ATOM 1700 CD2 HIS A 109 9.815 -12.525 5.531 1.00 0.31 C ATOM 1701 CE1 HIS A 109 10.564 -13.542 7.324 1.00 0.46 C ATOM 1702 NE2 HIS A 109 10.805 -13.325 6.044 1.00 0.41 N ATOM 0 H HIS A 109 6.377 -11.717 4.329 1.00 0.25 H new ATOM 0 HA HIS A 109 6.408 -13.139 6.925 1.00 0.22 H new ATOM 0 HB2 HIS A 109 7.786 -10.658 5.806 1.00 0.21 H new ATOM 0 HB3 HIS A 109 7.656 -10.914 7.535 1.00 0.21 H new ATOM 0 HD2 HIS A 109 9.736 -12.175 4.512 1.00 0.31 H new ATOM 0 HE1 HIS A 109 11.174 -14.135 7.989 1.00 0.46 H new ATOM 0 HE2 HIS A 109 11.599 -13.693 5.521 1.00 0.41 H new ATOM 1711 N THR A 110 4.364 -11.971 7.689 1.00 0.27 N ATOM 1712 CA THR A 110 3.218 -11.235 8.234 1.00 0.26 C ATOM 1713 C THR A 110 3.665 -10.157 9.197 1.00 0.27 C ATOM 1714 O THR A 110 4.199 -10.443 10.269 1.00 0.46 O ATOM 1715 CB THR A 110 2.197 -12.127 8.959 1.00 0.34 C ATOM 1716 OG1 THR A 110 2.871 -13.060 9.814 1.00 0.66 O ATOM 1717 CG2 THR A 110 1.315 -12.873 7.963 1.00 0.44 C ATOM 0 H THR A 110 4.426 -12.946 7.983 1.00 0.27 H new ATOM 0 HA THR A 110 2.730 -10.798 7.363 1.00 0.26 H new ATOM 0 HB THR A 110 1.559 -11.484 9.566 1.00 0.34 H new ATOM 0 HG1 THR A 110 3.628 -12.616 10.250 1.00 0.66 H new ATOM 0 HG21 THR A 110 0.602 -13.496 8.503 1.00 0.44 H new ATOM 0 HG22 THR A 110 0.774 -12.155 7.347 1.00 0.44 H new ATOM 0 HG23 THR A 110 1.937 -13.502 7.326 1.00 0.44 H new ATOM 1725 N VAL A 111 3.440 -8.914 8.805 1.00 0.21 N ATOM 1726 CA VAL A 111 3.800 -7.786 9.636 1.00 0.23 C ATOM 1727 C VAL A 111 2.553 -7.185 10.260 1.00 0.23 C ATOM 1728 O VAL A 111 2.601 -6.638 11.362 1.00 0.24 O ATOM 1729 CB VAL A 111 4.551 -6.708 8.839 1.00 0.29 C ATOM 1730 CG1 VAL A 111 5.315 -5.781 9.789 1.00 0.80 C ATOM 1731 CG2 VAL A 111 5.496 -7.360 7.833 1.00 0.72 C ATOM 0 H VAL A 111 3.009 -8.664 7.915 1.00 0.21 H new ATOM 0 HA VAL A 111 4.466 -8.150 10.418 1.00 0.23 H new ATOM 0 HB VAL A 111 3.828 -6.107 8.288 1.00 0.29 H new ATOM 0 HG11 VAL A 111 5.842 -5.022 9.211 1.00 0.80 H new ATOM 0 HG12 VAL A 111 4.613 -5.297 10.468 1.00 0.80 H new ATOM 0 HG13 VAL A 111 6.034 -6.363 10.365 1.00 0.80 H new ATOM 0 HG21 VAL A 111 6.023 -6.586 7.274 1.00 0.72 H new ATOM 0 HG22 VAL A 111 6.219 -7.981 8.362 1.00 0.72 H new ATOM 0 HG23 VAL A 111 4.922 -7.979 7.143 1.00 0.72 H new ATOM 1741 N VAL A 112 1.428 -7.285 9.548 1.00 0.24 N ATOM 1742 CA VAL A 112 0.167 -6.769 10.069 1.00 0.27 C ATOM 1743 C VAL A 112 -0.944 -7.777 9.829 1.00 0.28 C ATOM 1744 O VAL A 112 -1.584 -7.767 8.777 1.00 0.28 O ATOM 1745 CB VAL A 112 -0.231 -5.400 9.444 1.00 0.29 C ATOM 1746 CG1 VAL A 112 -1.095 -4.594 10.420 1.00 0.51 C ATOM 1747 CG2 VAL A 112 1.010 -4.603 9.052 1.00 0.45 C ATOM 0 H VAL A 112 1.367 -7.712 8.624 1.00 0.24 H new ATOM 0 HA VAL A 112 0.310 -6.608 11.138 1.00 0.27 H new ATOM 0 HB VAL A 112 -0.813 -5.594 8.543 1.00 0.29 H new ATOM 0 HG11 VAL A 112 -1.364 -3.640 9.966 1.00 0.51 H new ATOM 0 HG12 VAL A 112 -2.001 -5.154 10.651 1.00 0.51 H new ATOM 0 HG13 VAL A 112 -0.536 -4.414 11.338 1.00 0.51 H new ATOM 0 HG21 VAL A 112 0.708 -3.650 8.617 1.00 0.45 H new ATOM 0 HG22 VAL A 112 1.620 -4.421 9.937 1.00 0.45 H new ATOM 0 HG23 VAL A 112 1.589 -5.168 8.321 1.00 0.45 H new ATOM 1757 N LYS A 113 -1.171 -8.658 10.806 1.00 0.31 N ATOM 1758 CA LYS A 113 -2.207 -9.663 10.669 1.00 0.35 C ATOM 1759 C LYS A 113 -3.402 -9.372 11.554 1.00 0.47 C ATOM 1760 O LYS A 113 -3.546 -9.899 12.657 1.00 1.03 O ATOM 1761 CB LYS A 113 -1.679 -11.071 10.924 1.00 0.40 C ATOM 1762 CG LYS A 113 -1.056 -11.270 12.311 1.00 0.90 C ATOM 1763 CD LYS A 113 -1.241 -12.710 12.807 1.00 1.29 C ATOM 1764 CE LYS A 113 -0.591 -13.718 11.853 1.00 1.78 C ATOM 1765 NZ LYS A 113 0.872 -13.480 11.714 1.00 2.44 N ATOM 0 H LYS A 113 -0.655 -8.690 11.685 1.00 0.31 H new ATOM 0 HA LYS A 113 -2.540 -9.617 9.632 1.00 0.35 H new ATOM 0 HB2 LYS A 113 -2.497 -11.781 10.801 1.00 0.40 H new ATOM 0 HB3 LYS A 113 -0.933 -11.309 10.166 1.00 0.40 H new ATOM 0 HG2 LYS A 113 0.007 -11.031 12.272 1.00 0.90 H new ATOM 0 HG3 LYS A 113 -1.512 -10.578 13.019 1.00 0.90 H new ATOM 0 HD2 LYS A 113 -0.804 -12.813 13.800 1.00 1.29 H new ATOM 0 HD3 LYS A 113 -2.304 -12.930 12.902 1.00 1.29 H new ATOM 0 HE2 LYS A 113 -0.762 -14.730 12.221 1.00 1.78 H new ATOM 0 HE3 LYS A 113 -1.065 -13.651 10.874 1.00 1.78 H new ATOM 0 HZ1 LYS A 113 1.111 -13.364 10.708 1.00 2.44 H new ATOM 0 HZ2 LYS A 113 1.135 -12.618 12.234 1.00 2.44 H new ATOM 0 HZ3 LYS A 113 1.394 -14.291 12.102 1.00 2.44 H new ATOM 1779 N ASP A 114 -4.257 -8.542 10.994 1.00 0.40 N ATOM 1780 CA ASP A 114 -5.509 -8.091 11.602 1.00 0.45 C ATOM 1781 C ASP A 114 -5.840 -6.705 11.071 1.00 0.37 C ATOM 1782 O ASP A 114 -6.347 -5.852 11.800 1.00 0.45 O ATOM 1783 CB ASP A 114 -5.445 -8.038 13.140 1.00 0.60 C ATOM 1784 CG ASP A 114 -4.363 -7.103 13.648 1.00 1.63 C ATOM 1785 OD1 ASP A 114 -3.210 -7.556 13.807 1.00 1.65 O ATOM 1786 OD2 ASP A 114 -4.673 -5.918 13.892 1.00 2.56 O ATOM 0 H ASP A 114 -4.101 -8.143 10.068 1.00 0.40 H new ATOM 0 HA ASP A 114 -6.280 -8.814 11.337 1.00 0.45 H new ATOM 0 HB2 ASP A 114 -6.411 -7.715 13.529 1.00 0.60 H new ATOM 0 HB3 ASP A 114 -5.264 -9.041 13.527 1.00 0.60 H new ATOM 1791 N LEU A 115 -5.550 -6.486 9.791 1.00 0.29 N ATOM 1792 CA LEU A 115 -5.783 -5.190 9.181 1.00 0.27 C ATOM 1793 C LEU A 115 -7.252 -4.807 9.173 1.00 0.25 C ATOM 1794 O LEU A 115 -8.001 -5.164 8.265 1.00 0.29 O ATOM 1795 CB LEU A 115 -5.203 -5.116 7.764 1.00 0.31 C ATOM 1796 CG LEU A 115 -4.153 -4.009 7.550 1.00 0.44 C ATOM 1797 CD1 LEU A 115 -3.713 -3.957 6.110 1.00 1.10 C ATOM 1798 CD2 LEU A 115 -4.672 -2.639 7.974 1.00 1.05 C ATOM 0 H LEU A 115 -5.156 -7.187 9.164 1.00 0.29 H new ATOM 0 HA LEU A 115 -5.259 -4.465 9.804 1.00 0.27 H new ATOM 0 HB2 LEU A 115 -4.750 -6.078 7.522 1.00 0.31 H new ATOM 0 HB3 LEU A 115 -6.021 -4.962 7.060 1.00 0.31 H new ATOM 0 HG LEU A 115 -3.300 -4.260 8.180 1.00 0.44 H new ATOM 0 HD11 LEU A 115 -2.972 -3.168 5.984 1.00 1.10 H new ATOM 0 HD12 LEU A 115 -3.275 -4.915 5.829 1.00 1.10 H new ATOM 0 HD13 LEU A 115 -4.574 -3.751 5.474 1.00 1.10 H new ATOM 0 HD21 LEU A 115 -3.899 -1.889 7.806 1.00 1.05 H new ATOM 0 HD22 LEU A 115 -5.556 -2.387 7.388 1.00 1.05 H new ATOM 0 HD23 LEU A 115 -4.933 -2.660 9.032 1.00 1.05 H new ATOM 1810 N ASP A 116 -7.649 -4.095 10.220 1.00 0.26 N ATOM 1811 CA ASP A 116 -9.001 -3.584 10.345 1.00 0.29 C ATOM 1812 C ASP A 116 -8.933 -2.092 10.046 1.00 0.30 C ATOM 1813 O ASP A 116 -8.850 -1.262 10.951 1.00 0.32 O ATOM 1814 CB ASP A 116 -9.552 -3.848 11.751 1.00 0.34 C ATOM 1815 CG ASP A 116 -11.041 -3.580 11.851 1.00 1.35 C ATOM 1816 OD1 ASP A 116 -11.429 -2.394 11.885 1.00 1.92 O ATOM 1817 OD2 ASP A 116 -11.818 -4.555 11.895 1.00 1.99 O ATOM 0 H ASP A 116 -7.041 -3.858 11.004 1.00 0.26 H new ATOM 0 HA ASP A 116 -9.677 -4.082 9.650 1.00 0.29 H new ATOM 0 HB2 ASP A 116 -9.353 -4.884 12.027 1.00 0.34 H new ATOM 0 HB3 ASP A 116 -9.024 -3.220 12.468 1.00 0.34 H new ATOM 1822 N ILE A 117 -8.977 -1.772 8.757 1.00 0.29 N ATOM 1823 CA ILE A 117 -8.835 -0.400 8.283 1.00 0.31 C ATOM 1824 C ILE A 117 -9.756 0.588 9.007 1.00 0.34 C ATOM 1825 O ILE A 117 -9.350 1.713 9.304 1.00 0.36 O ATOM 1826 CB ILE A 117 -9.101 -0.308 6.761 1.00 0.33 C ATOM 1827 CG1 ILE A 117 -8.211 -1.297 5.992 1.00 0.59 C ATOM 1828 CG2 ILE A 117 -8.861 1.119 6.260 1.00 0.47 C ATOM 1829 CD1 ILE A 117 -8.630 -1.500 4.551 1.00 0.63 C ATOM 0 H ILE A 117 -9.112 -2.456 8.012 1.00 0.29 H new ATOM 0 HA ILE A 117 -7.805 -0.120 8.503 1.00 0.31 H new ATOM 0 HB ILE A 117 -10.144 -0.571 6.582 1.00 0.33 H new ATOM 0 HG12 ILE A 117 -7.182 -0.939 6.015 1.00 0.59 H new ATOM 0 HG13 ILE A 117 -8.225 -2.259 6.504 1.00 0.59 H new ATOM 0 HG21 ILE A 117 -9.053 1.165 5.188 1.00 0.47 H new ATOM 0 HG22 ILE A 117 -9.532 1.804 6.778 1.00 0.47 H new ATOM 0 HG23 ILE A 117 -7.828 1.405 6.456 1.00 0.47 H new ATOM 0 HD11 ILE A 117 -7.956 -2.210 4.073 1.00 0.63 H new ATOM 0 HD12 ILE A 117 -9.648 -1.888 4.519 1.00 0.63 H new ATOM 0 HD13 ILE A 117 -8.588 -0.548 4.022 1.00 0.63 H new ATOM 1841 N PHE A 118 -10.983 0.171 9.301 1.00 0.39 N ATOM 1842 CA PHE A 118 -11.945 1.051 9.970 1.00 0.44 C ATOM 1843 C PHE A 118 -11.503 1.420 11.387 1.00 0.46 C ATOM 1844 O PHE A 118 -11.454 2.594 11.740 1.00 0.52 O ATOM 1845 CB PHE A 118 -13.330 0.397 10.021 1.00 0.52 C ATOM 1846 CG PHE A 118 -14.413 1.327 10.521 1.00 0.63 C ATOM 1847 CD1 PHE A 118 -14.888 2.348 9.707 1.00 0.71 C ATOM 1848 CD2 PHE A 118 -14.951 1.190 11.798 1.00 0.74 C ATOM 1849 CE1 PHE A 118 -15.876 3.212 10.153 1.00 0.85 C ATOM 1850 CE2 PHE A 118 -15.940 2.050 12.247 1.00 0.87 C ATOM 1851 CZ PHE A 118 -16.404 3.062 11.424 1.00 0.90 C ATOM 0 H PHE A 118 -11.336 -0.762 9.090 1.00 0.39 H new ATOM 0 HA PHE A 118 -11.994 1.968 9.383 1.00 0.44 H new ATOM 0 HB2 PHE A 118 -13.595 0.045 9.024 1.00 0.52 H new ATOM 0 HB3 PHE A 118 -13.287 -0.480 10.667 1.00 0.52 H new ATOM 0 HD1 PHE A 118 -14.482 2.470 8.714 1.00 0.71 H new ATOM 0 HD2 PHE A 118 -14.593 0.404 12.446 1.00 0.74 H new ATOM 0 HE1 PHE A 118 -16.234 4.002 9.509 1.00 0.85 H new ATOM 0 HE2 PHE A 118 -16.349 1.931 13.239 1.00 0.87 H new ATOM 0 HZ PHE A 118 -17.176 3.732 11.772 1.00 0.90 H new ATOM 1861 N ASP A 119 -11.195 0.417 12.200 1.00 0.47 N ATOM 1862 CA ASP A 119 -10.781 0.651 13.584 1.00 0.52 C ATOM 1863 C ASP A 119 -9.395 1.288 13.668 1.00 0.50 C ATOM 1864 O ASP A 119 -9.090 1.999 14.626 1.00 0.58 O ATOM 1865 CB ASP A 119 -10.785 -0.664 14.368 1.00 0.54 C ATOM 1866 CG ASP A 119 -10.763 -0.444 15.869 1.00 0.64 C ATOM 1867 OD1 ASP A 119 -9.656 -0.339 16.437 1.00 0.67 O ATOM 1868 OD2 ASP A 119 -11.853 -0.377 16.474 1.00 0.76 O ATOM 0 H ASP A 119 -11.223 -0.566 11.929 1.00 0.47 H new ATOM 0 HA ASP A 119 -11.498 1.346 14.021 1.00 0.52 H new ATOM 0 HB2 ASP A 119 -11.671 -1.240 14.101 1.00 0.54 H new ATOM 0 HB3 ASP A 119 -9.919 -1.259 14.078 1.00 0.54 H new ATOM 1873 N ARG A 120 -8.560 1.033 12.668 1.00 0.45 N ATOM 1874 CA ARG A 120 -7.201 1.568 12.655 1.00 0.49 C ATOM 1875 C ARG A 120 -7.184 3.091 12.556 1.00 0.52 C ATOM 1876 O ARG A 120 -6.635 3.766 13.427 1.00 0.60 O ATOM 1877 CB ARG A 120 -6.406 0.973 11.487 1.00 0.48 C ATOM 1878 CG ARG A 120 -6.008 -0.501 11.683 1.00 0.59 C ATOM 1879 CD ARG A 120 -4.681 -0.648 12.439 1.00 0.76 C ATOM 1880 NE ARG A 120 -4.342 -2.050 12.669 1.00 1.42 N ATOM 1881 CZ ARG A 120 -3.210 -2.450 13.236 1.00 1.86 C ATOM 1882 NH1 ARG A 120 -2.311 -1.560 13.637 1.00 1.72 N ATOM 1883 NH2 ARG A 120 -2.973 -3.744 13.403 1.00 2.68 N ATOM 0 H ARG A 120 -8.797 0.461 11.857 1.00 0.45 H new ATOM 0 HA ARG A 120 -6.738 1.287 13.601 1.00 0.49 H new ATOM 0 HB2 ARG A 120 -6.999 1.060 10.576 1.00 0.48 H new ATOM 0 HB3 ARG A 120 -5.503 1.565 11.337 1.00 0.48 H new ATOM 0 HG2 ARG A 120 -6.796 -1.018 12.231 1.00 0.59 H new ATOM 0 HG3 ARG A 120 -5.925 -0.986 10.710 1.00 0.59 H new ATOM 0 HD2 ARG A 120 -3.884 -0.169 11.871 1.00 0.76 H new ATOM 0 HD3 ARG A 120 -4.747 -0.128 13.395 1.00 0.76 H new ATOM 0 HE ARG A 120 -5.012 -2.762 12.378 1.00 1.42 H new ATOM 0 HH11 ARG A 120 -2.488 -0.564 13.510 1.00 1.72 H new ATOM 0 HH12 ARG A 120 -1.443 -1.872 14.072 1.00 1.72 H new ATOM 0 HH21 ARG A 120 -3.660 -4.432 13.096 1.00 2.68 H new ATOM 0 HH22 ARG A 120 -2.103 -4.051 13.839 1.00 2.68 H new ATOM 1897 N VAL A 121 -7.786 3.633 11.500 1.00 0.49 N ATOM 1898 CA VAL A 121 -7.799 5.079 11.302 1.00 0.55 C ATOM 1899 C VAL A 121 -9.112 5.712 11.760 1.00 0.61 C ATOM 1900 O VAL A 121 -9.112 6.788 12.357 1.00 0.70 O ATOM 1901 CB VAL A 121 -7.534 5.450 9.823 1.00 0.56 C ATOM 1902 CG1 VAL A 121 -8.703 5.012 8.937 1.00 1.18 C ATOM 1903 CG2 VAL A 121 -7.288 6.953 9.683 1.00 1.41 C ATOM 0 H VAL A 121 -8.266 3.099 10.776 1.00 0.49 H new ATOM 0 HA VAL A 121 -6.994 5.478 11.919 1.00 0.55 H new ATOM 0 HB VAL A 121 -6.639 4.922 9.493 1.00 0.56 H new ATOM 0 HG11 VAL A 121 -8.496 5.282 7.902 1.00 1.18 H new ATOM 0 HG12 VAL A 121 -8.831 3.932 9.011 1.00 1.18 H new ATOM 0 HG13 VAL A 121 -9.615 5.509 9.266 1.00 1.18 H new ATOM 0 HG21 VAL A 121 -7.103 7.196 8.636 1.00 1.41 H new ATOM 0 HG22 VAL A 121 -8.164 7.499 10.033 1.00 1.41 H new ATOM 0 HG23 VAL A 121 -6.421 7.237 10.280 1.00 1.41 H new ATOM 1913 N GLY A 122 -10.227 5.046 11.480 1.00 0.62 N ATOM 1914 CA GLY A 122 -11.521 5.572 11.875 1.00 0.76 C ATOM 1915 C GLY A 122 -12.425 5.847 10.689 1.00 0.81 C ATOM 1916 O GLY A 122 -12.510 5.038 9.766 1.00 1.06 O ATOM 0 H GLY A 122 -10.258 4.153 10.988 1.00 0.62 H new ATOM 0 HA2 GLY A 122 -12.009 4.862 12.543 1.00 0.76 H new ATOM 0 HA3 GLY A 122 -11.378 6.493 12.439 1.00 0.76 H new ATOM 1920 N HIS A 123 -13.101 6.993 10.718 1.00 0.81 N ATOM 1921 CA HIS A 123 -14.003 7.381 9.637 1.00 0.90 C ATOM 1922 C HIS A 123 -13.269 7.406 8.299 1.00 0.76 C ATOM 1923 O HIS A 123 -12.043 7.306 8.256 1.00 1.00 O ATOM 1924 CB HIS A 123 -14.628 8.757 9.928 1.00 1.17 C ATOM 1925 CG HIS A 123 -13.633 9.877 9.977 1.00 1.87 C ATOM 1926 ND1 HIS A 123 -13.740 11.009 9.195 1.00 2.64 N ATOM 1927 CD2 HIS A 123 -12.515 10.046 10.726 1.00 2.72 C ATOM 1928 CE1 HIS A 123 -12.735 11.824 9.461 1.00 3.47 C ATOM 1929 NE2 HIS A 123 -11.978 11.264 10.386 1.00 3.51 N ATOM 0 H HIS A 123 -13.041 7.670 11.479 1.00 0.81 H new ATOM 0 HA HIS A 123 -14.799 6.639 9.576 1.00 0.90 H new ATOM 0 HB2 HIS A 123 -15.371 8.977 9.161 1.00 1.17 H new ATOM 0 HB3 HIS A 123 -15.156 8.711 10.880 1.00 1.17 H new ATOM 0 HD2 HIS A 123 -12.120 9.352 11.454 1.00 2.72 H new ATOM 0 HE1 HIS A 123 -12.562 12.785 9.000 1.00 3.47 H new ATOM 0 HE2 HIS A 123 -11.131 11.670 10.784 1.00 3.51 H new ATOM 1938 N SER A 124 -14.029 7.534 7.213 1.00 0.89 N ATOM 1939 CA SER A 124 -13.459 7.563 5.866 1.00 0.80 C ATOM 1940 C SER A 124 -12.245 8.488 5.791 1.00 0.86 C ATOM 1941 O SER A 124 -12.380 9.704 5.649 1.00 1.68 O ATOM 1942 CB SER A 124 -14.518 8.013 4.854 1.00 0.91 C ATOM 1943 OG SER A 124 -14.042 7.882 3.525 1.00 1.65 O ATOM 0 H SER A 124 -15.045 7.620 7.239 1.00 0.89 H new ATOM 0 HA SER A 124 -13.130 6.553 5.623 1.00 0.80 H new ATOM 0 HB2 SER A 124 -15.422 7.418 4.980 1.00 0.91 H new ATOM 0 HB3 SER A 124 -14.791 9.051 5.045 1.00 0.91 H new ATOM 0 HG SER A 124 -14.737 8.174 2.898 1.00 1.65 H new ATOM 1949 N THR A 125 -11.061 7.891 5.880 1.00 0.47 N ATOM 1950 CA THR A 125 -9.802 8.629 5.827 1.00 0.38 C ATOM 1951 C THR A 125 -8.693 7.730 5.292 1.00 0.33 C ATOM 1952 O THR A 125 -8.948 6.593 4.893 1.00 0.40 O ATOM 1953 CB THR A 125 -9.395 9.148 7.225 1.00 0.47 C ATOM 1954 OG1 THR A 125 -9.555 8.102 8.189 1.00 0.80 O ATOM 1955 CG2 THR A 125 -10.236 10.356 7.643 1.00 0.53 C ATOM 0 H THR A 125 -10.946 6.884 5.991 1.00 0.47 H new ATOM 0 HA THR A 125 -9.946 9.482 5.164 1.00 0.38 H new ATOM 0 HB THR A 125 -8.352 9.460 7.177 1.00 0.47 H new ATOM 0 HG1 THR A 125 -10.504 8.010 8.417 1.00 0.80 H new ATOM 0 HG21 THR A 125 -9.922 10.694 8.631 1.00 0.53 H new ATOM 0 HG22 THR A 125 -10.098 11.162 6.923 1.00 0.53 H new ATOM 0 HG23 THR A 125 -11.288 10.074 7.674 1.00 0.53 H new ATOM 1963 N ALA A 126 -7.466 8.237 5.282 1.00 0.31 N ATOM 1964 CA ALA A 126 -6.334 7.460 4.788 1.00 0.32 C ATOM 1965 C ALA A 126 -5.648 6.675 5.898 1.00 0.27 C ATOM 1966 O ALA A 126 -5.465 7.173 7.010 1.00 0.34 O ATOM 1967 CB ALA A 126 -5.310 8.368 4.114 1.00 0.44 C ATOM 0 H ALA A 126 -7.230 9.174 5.607 1.00 0.31 H new ATOM 0 HA ALA A 126 -6.735 6.751 4.063 1.00 0.32 H new ATOM 0 HB1 ALA A 126 -4.474 7.769 3.753 1.00 0.44 H new ATOM 0 HB2 ALA A 126 -5.777 8.883 3.274 1.00 0.44 H new ATOM 0 HB3 ALA A 126 -4.946 9.102 4.833 1.00 0.44 H new ATOM 1973 N HIS A 127 -5.274 5.445 5.579 1.00 0.23 N ATOM 1974 CA HIS A 127 -4.575 4.579 6.516 1.00 0.22 C ATOM 1975 C HIS A 127 -3.148 4.372 6.025 1.00 0.23 C ATOM 1976 O HIS A 127 -2.905 4.375 4.818 1.00 0.26 O ATOM 1977 CB HIS A 127 -5.292 3.236 6.635 1.00 0.24 C ATOM 1978 CG HIS A 127 -4.722 2.346 7.695 1.00 0.27 C ATOM 1979 ND1 HIS A 127 -3.860 2.789 8.674 1.00 0.32 N ATOM 1980 CD2 HIS A 127 -4.889 1.024 7.916 1.00 0.34 C ATOM 1981 CE1 HIS A 127 -3.521 1.775 9.451 1.00 0.36 C ATOM 1982 NE2 HIS A 127 -4.134 0.693 9.013 1.00 0.38 N ATOM 0 H HIS A 127 -5.446 5.021 4.667 1.00 0.23 H new ATOM 0 HA HIS A 127 -4.560 5.045 7.501 1.00 0.22 H new ATOM 0 HB2 HIS A 127 -6.346 3.414 6.849 1.00 0.24 H new ATOM 0 HB3 HIS A 127 -5.244 2.721 5.675 1.00 0.24 H new ATOM 0 HD2 HIS A 127 -5.504 0.351 7.336 1.00 0.34 H new ATOM 0 HE1 HIS A 127 -2.855 1.824 10.300 1.00 0.36 H new ATOM 0 HE2 HIS A 127 -4.059 -0.238 9.423 1.00 0.38 H new ATOM 1991 N ASP A 128 -2.204 4.189 6.941 1.00 0.24 N ATOM 1992 CA ASP A 128 -0.814 4.013 6.536 1.00 0.27 C ATOM 1993 C ASP A 128 -0.080 2.987 7.386 1.00 0.27 C ATOM 1994 O ASP A 128 -0.183 2.981 8.613 1.00 0.37 O ATOM 1995 CB ASP A 128 -0.069 5.354 6.613 1.00 0.36 C ATOM 1996 CG ASP A 128 0.031 5.873 8.034 1.00 1.23 C ATOM 1997 OD1 ASP A 128 0.993 5.499 8.737 1.00 1.34 O ATOM 1998 OD2 ASP A 128 -0.852 6.656 8.443 1.00 2.09 O ATOM 0 H ASP A 128 -2.369 4.159 7.947 1.00 0.24 H new ATOM 0 HA ASP A 128 -0.831 3.644 5.511 1.00 0.27 H new ATOM 0 HB2 ASP A 128 0.933 5.235 6.200 1.00 0.36 H new ATOM 0 HB3 ASP A 128 -0.584 6.090 5.995 1.00 0.36 H new ATOM 2003 N GLU A 129 0.666 2.122 6.708 1.00 0.24 N ATOM 2004 CA GLU A 129 1.468 1.104 7.366 1.00 0.29 C ATOM 2005 C GLU A 129 2.898 1.144 6.820 1.00 0.26 C ATOM 2006 O GLU A 129 3.131 0.846 5.644 1.00 0.36 O ATOM 2007 CB GLU A 129 0.850 -0.282 7.153 1.00 0.37 C ATOM 2008 CG GLU A 129 -0.529 -0.438 7.801 1.00 0.77 C ATOM 2009 CD GLU A 129 -0.460 -0.422 9.316 1.00 1.31 C ATOM 2010 OE1 GLU A 129 -0.542 0.679 9.901 1.00 2.28 O ATOM 2011 OE2 GLU A 129 -0.324 -1.508 9.916 1.00 1.67 O ATOM 0 H GLU A 129 0.730 2.109 5.690 1.00 0.24 H new ATOM 0 HA GLU A 129 1.492 1.305 8.437 1.00 0.29 H new ATOM 0 HB2 GLU A 129 0.765 -0.473 6.083 1.00 0.37 H new ATOM 0 HB3 GLU A 129 1.522 -1.038 7.559 1.00 0.37 H new ATOM 0 HG2 GLU A 129 -1.181 0.367 7.461 1.00 0.77 H new ATOM 0 HG3 GLU A 129 -0.979 -1.374 7.470 1.00 0.77 H new ATOM 2018 N ILE A 130 3.844 1.540 7.674 1.00 0.24 N ATOM 2019 CA ILE A 130 5.251 1.635 7.281 1.00 0.24 C ATOM 2020 C ILE A 130 6.046 0.439 7.797 1.00 0.22 C ATOM 2021 O ILE A 130 5.896 0.038 8.951 1.00 0.29 O ATOM 2022 CB ILE A 130 5.895 2.932 7.815 1.00 0.30 C ATOM 2023 CG1 ILE A 130 4.946 4.120 7.607 1.00 0.38 C ATOM 2024 CG2 ILE A 130 7.232 3.191 7.115 1.00 0.34 C ATOM 2025 CD1 ILE A 130 5.387 5.384 8.318 1.00 0.71 C ATOM 0 H ILE A 130 3.661 1.800 8.643 1.00 0.24 H new ATOM 0 HA ILE A 130 5.277 1.644 6.191 1.00 0.24 H new ATOM 0 HB ILE A 130 6.080 2.815 8.883 1.00 0.30 H new ATOM 0 HG12 ILE A 130 4.863 4.324 6.540 1.00 0.38 H new ATOM 0 HG13 ILE A 130 3.951 3.845 7.958 1.00 0.38 H new ATOM 0 HG21 ILE A 130 7.674 4.109 7.502 1.00 0.34 H new ATOM 0 HG22 ILE A 130 7.908 2.356 7.301 1.00 0.34 H new ATOM 0 HG23 ILE A 130 7.067 3.292 6.042 1.00 0.34 H new ATOM 0 HD11 ILE A 130 4.668 6.180 8.125 1.00 0.71 H new ATOM 0 HD12 ILE A 130 5.443 5.198 9.390 1.00 0.71 H new ATOM 0 HD13 ILE A 130 6.368 5.685 7.951 1.00 0.71 H new ATOM 2037 N ILE A 131 6.892 -0.129 6.938 1.00 0.19 N ATOM 2038 CA ILE A 131 7.698 -1.289 7.314 1.00 0.20 C ATOM 2039 C ILE A 131 9.157 -1.143 6.861 1.00 0.18 C ATOM 2040 O ILE A 131 9.501 -1.581 5.758 1.00 0.18 O ATOM 2041 CB ILE A 131 7.143 -2.594 6.694 1.00 0.26 C ATOM 2042 CG1 ILE A 131 5.668 -2.817 7.062 1.00 0.35 C ATOM 2043 CG2 ILE A 131 7.985 -3.793 7.140 1.00 0.30 C ATOM 2044 CD1 ILE A 131 4.693 -2.029 6.215 1.00 1.38 C ATOM 0 H ILE A 131 7.036 0.194 5.981 1.00 0.19 H new ATOM 0 HA ILE A 131 7.652 -1.341 8.402 1.00 0.20 H new ATOM 0 HB ILE A 131 7.203 -2.495 5.610 1.00 0.26 H new ATOM 0 HG12 ILE A 131 5.438 -3.878 6.969 1.00 0.35 H new ATOM 0 HG13 ILE A 131 5.522 -2.550 8.109 1.00 0.35 H new ATOM 0 HG21 ILE A 131 7.584 -4.704 6.697 1.00 0.30 H new ATOM 0 HG22 ILE A 131 9.016 -3.655 6.815 1.00 0.30 H new ATOM 0 HG23 ILE A 131 7.955 -3.874 8.227 1.00 0.30 H new ATOM 0 HD11 ILE A 131 3.674 -2.243 6.539 1.00 1.38 H new ATOM 0 HD12 ILE A 131 4.893 -0.963 6.326 1.00 1.38 H new ATOM 0 HD13 ILE A 131 4.808 -2.312 5.169 1.00 1.38 H new ATOM 2056 N PRO A 132 10.034 -0.496 7.660 1.00 0.18 N ATOM 2057 CA PRO A 132 11.458 -0.377 7.304 1.00 0.17 C ATOM 2058 C PRO A 132 12.115 -1.752 7.230 1.00 0.17 C ATOM 2059 O PRO A 132 11.853 -2.617 8.067 1.00 0.22 O ATOM 2060 CB PRO A 132 12.051 0.455 8.456 1.00 0.19 C ATOM 2061 CG PRO A 132 10.873 1.225 8.964 1.00 0.21 C ATOM 2062 CD PRO A 132 9.735 0.225 8.916 1.00 0.20 C ATOM 0 HA PRO A 132 11.615 0.081 6.327 1.00 0.17 H new ATOM 0 HB2 PRO A 132 12.482 -0.179 9.231 1.00 0.19 H new ATOM 0 HB3 PRO A 132 12.845 1.116 8.108 1.00 0.19 H new ATOM 0 HG2 PRO A 132 11.041 1.590 9.977 1.00 0.21 H new ATOM 0 HG3 PRO A 132 10.666 2.096 8.342 1.00 0.21 H new ATOM 0 HD2 PRO A 132 9.735 -0.439 9.781 1.00 0.20 H new ATOM 0 HD3 PRO A 132 8.761 0.713 8.888 1.00 0.20 H new ATOM 2070 N ILE A 133 12.965 -1.950 6.230 1.00 0.15 N ATOM 2071 CA ILE A 133 13.627 -3.234 6.043 1.00 0.14 C ATOM 2072 C ILE A 133 15.129 -3.069 5.867 1.00 0.14 C ATOM 2073 O ILE A 133 15.601 -2.014 5.448 1.00 0.15 O ATOM 2074 CB ILE A 133 13.075 -3.953 4.797 1.00 0.15 C ATOM 2075 CG1 ILE A 133 11.545 -3.900 4.775 1.00 0.17 C ATOM 2076 CG2 ILE A 133 13.558 -5.401 4.743 1.00 0.15 C ATOM 2077 CD1 ILE A 133 10.947 -4.359 3.460 1.00 0.21 C ATOM 0 H ILE A 133 13.211 -1.241 5.539 1.00 0.15 H new ATOM 0 HA ILE A 133 13.430 -3.823 6.939 1.00 0.14 H new ATOM 0 HB ILE A 133 13.452 -3.434 3.916 1.00 0.15 H new ATOM 0 HG12 ILE A 133 11.155 -4.523 5.580 1.00 0.17 H new ATOM 0 HG13 ILE A 133 11.221 -2.879 4.977 1.00 0.17 H new ATOM 0 HG21 ILE A 133 13.154 -5.886 3.854 1.00 0.15 H new ATOM 0 HG22 ILE A 133 14.647 -5.420 4.704 1.00 0.15 H new ATOM 0 HG23 ILE A 133 13.218 -5.932 5.632 1.00 0.15 H new ATOM 0 HD11 ILE A 133 9.860 -4.296 3.513 1.00 0.21 H new ATOM 0 HD12 ILE A 133 11.308 -3.721 2.654 1.00 0.21 H new ATOM 0 HD13 ILE A 133 11.242 -5.390 3.267 1.00 0.21 H new ATOM 2089 N SER A 134 15.872 -4.122 6.184 1.00 0.13 N ATOM 2090 CA SER A 134 17.319 -4.103 6.036 1.00 0.13 C ATOM 2091 C SER A 134 17.796 -5.337 5.275 1.00 0.13 C ATOM 2092 O SER A 134 17.786 -6.452 5.801 1.00 0.14 O ATOM 2093 CB SER A 134 17.997 -4.022 7.412 1.00 0.15 C ATOM 2094 OG SER A 134 17.498 -5.023 8.282 1.00 1.11 O ATOM 0 H SER A 134 15.495 -4.999 6.545 1.00 0.13 H new ATOM 0 HA SER A 134 17.596 -3.219 5.462 1.00 0.13 H new ATOM 0 HB2 SER A 134 19.075 -4.138 7.298 1.00 0.15 H new ATOM 0 HB3 SER A 134 17.827 -3.038 7.848 1.00 0.15 H new ATOM 0 HG SER A 134 17.945 -4.953 9.151 1.00 1.11 H new ATOM 2100 N ILE A 135 18.193 -5.124 4.022 1.00 0.15 N ATOM 2101 CA ILE A 135 18.686 -6.200 3.171 1.00 0.16 C ATOM 2102 C ILE A 135 20.201 -6.096 3.027 1.00 0.17 C ATOM 2103 O ILE A 135 20.720 -5.048 2.650 1.00 0.19 O ATOM 2104 CB ILE A 135 18.044 -6.155 1.765 1.00 0.17 C ATOM 2105 CG1 ILE A 135 16.526 -6.089 1.870 1.00 0.21 C ATOM 2106 CG2 ILE A 135 18.458 -7.376 0.943 1.00 0.21 C ATOM 2107 CD1 ILE A 135 15.845 -5.596 0.610 1.00 0.23 C ATOM 0 H ILE A 135 18.182 -4.208 3.573 1.00 0.15 H new ATOM 0 HA ILE A 135 18.415 -7.143 3.645 1.00 0.16 H new ATOM 0 HB ILE A 135 18.400 -5.257 1.260 1.00 0.17 H new ATOM 0 HG12 ILE A 135 16.145 -7.081 2.113 1.00 0.21 H new ATOM 0 HG13 ILE A 135 16.257 -5.433 2.697 1.00 0.21 H new ATOM 0 HG21 ILE A 135 17.995 -7.325 -0.043 1.00 0.21 H new ATOM 0 HG22 ILE A 135 19.542 -7.391 0.835 1.00 0.21 H new ATOM 0 HG23 ILE A 135 18.132 -8.284 1.450 1.00 0.21 H new ATOM 0 HD11 ILE A 135 14.766 -5.577 0.763 1.00 0.23 H new ATOM 0 HD12 ILE A 135 16.196 -4.591 0.376 1.00 0.23 H new ATOM 0 HD13 ILE A 135 16.082 -6.265 -0.217 1.00 0.23 H new ATOM 2119 N LYS A 136 20.907 -7.179 3.336 1.00 0.20 N ATOM 2120 CA LYS A 136 22.364 -7.188 3.242 1.00 0.22 C ATOM 2121 C LYS A 136 22.875 -8.567 2.835 1.00 0.25 C ATOM 2122 O LYS A 136 22.319 -9.590 3.236 1.00 0.26 O ATOM 2123 CB LYS A 136 22.987 -6.782 4.586 1.00 0.27 C ATOM 2124 CG LYS A 136 22.770 -5.304 4.956 1.00 0.37 C ATOM 2125 CD LYS A 136 23.874 -4.398 4.393 1.00 0.82 C ATOM 2126 CE LYS A 136 23.507 -2.918 4.543 1.00 1.01 C ATOM 2127 NZ LYS A 136 22.293 -2.570 3.755 1.00 1.91 N ATOM 0 H LYS A 136 20.497 -8.058 3.652 1.00 0.20 H new ATOM 0 HA LYS A 136 22.657 -6.468 2.477 1.00 0.22 H new ATOM 0 HB2 LYS A 136 22.567 -7.408 5.373 1.00 0.27 H new ATOM 0 HB3 LYS A 136 24.058 -6.985 4.554 1.00 0.27 H new ATOM 0 HG2 LYS A 136 21.803 -4.974 4.576 1.00 0.37 H new ATOM 0 HG3 LYS A 136 22.738 -5.204 6.041 1.00 0.37 H new ATOM 0 HD2 LYS A 136 24.811 -4.597 4.912 1.00 0.82 H new ATOM 0 HD3 LYS A 136 24.037 -4.630 3.341 1.00 0.82 H new ATOM 0 HE2 LYS A 136 23.336 -2.690 5.595 1.00 1.01 H new ATOM 0 HE3 LYS A 136 24.343 -2.300 4.215 1.00 1.01 H new ATOM 0 HZ1 LYS A 136 22.551 -1.912 2.992 1.00 1.91 H new ATOM 0 HZ2 LYS A 136 21.886 -3.434 3.344 1.00 1.91 H new ATOM 0 HZ3 LYS A 136 21.592 -2.120 4.378 1.00 1.91 H new ATOM 2141 N LYS A 137 23.938 -8.582 2.036 1.00 0.27 N ATOM 2142 CA LYS A 137 24.544 -9.827 1.567 1.00 0.32 C ATOM 2143 C LYS A 137 23.556 -10.665 0.758 1.00 0.31 C ATOM 2144 O LYS A 137 23.825 -11.828 0.455 1.00 0.37 O ATOM 2145 CB LYS A 137 25.071 -10.646 2.753 1.00 0.36 C ATOM 2146 CG LYS A 137 26.221 -9.964 3.507 1.00 1.09 C ATOM 2147 CD LYS A 137 26.613 -10.724 4.786 1.00 1.61 C ATOM 2148 CE LYS A 137 25.802 -10.247 5.998 1.00 2.47 C ATOM 2149 NZ LYS A 137 26.045 -8.807 6.290 1.00 3.11 N ATOM 0 H LYS A 137 24.402 -7.739 1.697 1.00 0.27 H new ATOM 0 HA LYS A 137 25.375 -9.560 0.914 1.00 0.32 H new ATOM 0 HB2 LYS A 137 24.252 -10.832 3.448 1.00 0.36 H new ATOM 0 HB3 LYS A 137 25.410 -11.617 2.392 1.00 0.36 H new ATOM 0 HG2 LYS A 137 27.088 -9.889 2.851 1.00 1.09 H new ATOM 0 HG3 LYS A 137 25.929 -8.946 3.767 1.00 1.09 H new ATOM 0 HD2 LYS A 137 26.453 -11.792 4.638 1.00 1.61 H new ATOM 0 HD3 LYS A 137 27.676 -10.584 4.981 1.00 1.61 H new ATOM 0 HE2 LYS A 137 24.740 -10.406 5.811 1.00 2.47 H new ATOM 0 HE3 LYS A 137 26.065 -10.845 6.870 1.00 2.47 H new ATOM 0 HZ1 LYS A 137 25.868 -8.623 7.298 1.00 3.11 H new ATOM 0 HZ2 LYS A 137 27.031 -8.568 6.062 1.00 3.11 H new ATOM 0 HZ3 LYS A 137 25.405 -8.223 5.714 1.00 3.11 H new ATOM 2163 N GLY A 138 22.416 -10.075 0.411 1.00 0.27 N ATOM 2164 CA GLY A 138 21.422 -10.790 -0.364 1.00 0.27 C ATOM 2165 C GLY A 138 20.350 -11.434 0.494 1.00 0.25 C ATOM 2166 O GLY A 138 19.651 -12.338 0.040 1.00 0.32 O ATOM 0 H GLY A 138 22.165 -9.117 0.653 1.00 0.27 H new ATOM 0 HA2 GLY A 138 20.952 -10.101 -1.066 1.00 0.27 H new ATOM 0 HA3 GLY A 138 21.916 -11.560 -0.956 1.00 0.27 H new ATOM 2170 N LYS A 139 20.216 -10.976 1.738 1.00 0.24 N ATOM 2171 CA LYS A 139 19.206 -11.525 2.635 1.00 0.25 C ATOM 2172 C LYS A 139 18.260 -10.435 3.122 1.00 0.22 C ATOM 2173 O LYS A 139 18.631 -9.265 3.191 1.00 0.25 O ATOM 2174 CB LYS A 139 19.854 -12.247 3.825 1.00 0.32 C ATOM 2175 CG LYS A 139 20.901 -13.294 3.413 1.00 0.96 C ATOM 2176 CD LYS A 139 21.128 -14.363 4.501 1.00 1.18 C ATOM 2177 CE LYS A 139 21.489 -13.751 5.859 1.00 1.44 C ATOM 2178 NZ LYS A 139 22.009 -14.777 6.803 1.00 2.19 N ATOM 0 H LYS A 139 20.788 -10.235 2.142 1.00 0.24 H new ATOM 0 HA LYS A 139 18.626 -12.256 2.071 1.00 0.25 H new ATOM 0 HB2 LYS A 139 20.326 -11.509 4.474 1.00 0.32 H new ATOM 0 HB3 LYS A 139 19.075 -12.735 4.411 1.00 0.32 H new ATOM 0 HG2 LYS A 139 20.580 -13.780 2.492 1.00 0.96 H new ATOM 0 HG3 LYS A 139 21.845 -12.794 3.197 1.00 0.96 H new ATOM 0 HD2 LYS A 139 20.227 -14.967 4.606 1.00 1.18 H new ATOM 0 HD3 LYS A 139 21.926 -15.035 4.185 1.00 1.18 H new ATOM 0 HE2 LYS A 139 22.238 -12.972 5.720 1.00 1.44 H new ATOM 0 HE3 LYS A 139 20.608 -13.274 6.289 1.00 1.44 H new ATOM 0 HZ1 LYS A 139 22.243 -14.327 7.711 1.00 2.19 H new ATOM 0 HZ2 LYS A 139 21.285 -15.508 6.955 1.00 2.19 H new ATOM 0 HZ3 LYS A 139 22.864 -15.215 6.404 1.00 2.19 H new ATOM 2192 N LEU A 140 17.042 -10.834 3.473 1.00 0.26 N ATOM 2193 CA LEU A 140 16.022 -9.890 3.919 1.00 0.26 C ATOM 2194 C LEU A 140 15.749 -10.018 5.413 1.00 0.27 C ATOM 2195 O LEU A 140 15.475 -11.108 5.915 1.00 0.37 O ATOM 2196 CB LEU A 140 14.729 -10.130 3.124 1.00 0.27 C ATOM 2197 CG LEU A 140 13.668 -9.012 3.166 1.00 0.27 C ATOM 2198 CD1 LEU A 140 12.597 -9.250 2.115 1.00 0.36 C ATOM 2199 CD2 LEU A 140 13.032 -8.890 4.541 1.00 0.25 C ATOM 0 H LEU A 140 16.736 -11.807 3.457 1.00 0.26 H new ATOM 0 HA LEU A 140 16.389 -8.879 3.740 1.00 0.26 H new ATOM 0 HB2 LEU A 140 14.998 -10.303 2.082 1.00 0.27 H new ATOM 0 HB3 LEU A 140 14.270 -11.048 3.492 1.00 0.27 H new ATOM 0 HG LEU A 140 14.178 -8.073 2.949 1.00 0.27 H new ATOM 0 HD11 LEU A 140 11.858 -8.450 2.161 1.00 0.36 H new ATOM 0 HD12 LEU A 140 13.055 -9.265 1.126 1.00 0.36 H new ATOM 0 HD13 LEU A 140 12.109 -10.206 2.303 1.00 0.36 H new ATOM 0 HD21 LEU A 140 12.290 -8.092 4.529 1.00 0.25 H new ATOM 0 HD22 LEU A 140 12.548 -9.831 4.803 1.00 0.25 H new ATOM 0 HD23 LEU A 140 13.801 -8.660 5.278 1.00 0.25 H new ATOM 2211 N SER A 141 15.827 -8.891 6.114 1.00 0.21 N ATOM 2212 CA SER A 141 15.565 -8.863 7.545 1.00 0.23 C ATOM 2213 C SER A 141 14.395 -7.930 7.848 1.00 0.20 C ATOM 2214 O SER A 141 14.514 -6.709 7.729 1.00 0.24 O ATOM 2215 CB SER A 141 16.813 -8.406 8.307 1.00 0.29 C ATOM 2216 OG SER A 141 16.651 -8.580 9.705 1.00 0.90 O ATOM 0 H SER A 141 16.070 -7.986 5.712 1.00 0.21 H new ATOM 0 HA SER A 141 15.306 -9.871 7.871 1.00 0.23 H new ATOM 0 HB2 SER A 141 17.679 -8.973 7.965 1.00 0.29 H new ATOM 0 HB3 SER A 141 17.012 -7.357 8.089 1.00 0.29 H new ATOM 0 HG SER A 141 17.462 -8.282 10.168 1.00 0.90 H new ATOM 2222 N VAL A 142 13.262 -8.516 8.235 1.00 0.21 N ATOM 2223 CA VAL A 142 12.069 -7.741 8.557 1.00 0.23 C ATOM 2224 C VAL A 142 11.906 -7.629 10.075 1.00 0.25 C ATOM 2225 O VAL A 142 12.077 -8.610 10.790 1.00 0.31 O ATOM 2226 CB VAL A 142 10.793 -8.381 7.940 1.00 0.27 C ATOM 2227 CG1 VAL A 142 10.260 -9.493 8.844 1.00 0.53 C ATOM 2228 CG2 VAL A 142 9.714 -7.323 7.718 1.00 0.48 C ATOM 0 H VAL A 142 13.148 -9.525 8.332 1.00 0.21 H new ATOM 0 HA VAL A 142 12.194 -6.746 8.129 1.00 0.23 H new ATOM 0 HB VAL A 142 11.061 -8.812 6.976 1.00 0.27 H new ATOM 0 HG11 VAL A 142 9.367 -9.929 8.396 1.00 0.53 H new ATOM 0 HG12 VAL A 142 11.022 -10.264 8.960 1.00 0.53 H new ATOM 0 HG13 VAL A 142 10.011 -9.079 9.821 1.00 0.53 H new ATOM 0 HG21 VAL A 142 8.829 -7.791 7.286 1.00 0.48 H new ATOM 0 HG22 VAL A 142 9.453 -6.864 8.672 1.00 0.48 H new ATOM 0 HG23 VAL A 142 10.089 -6.558 7.038 1.00 0.48 H new ATOM 2238 N GLN A 143 11.588 -6.429 10.556 1.00 0.32 N ATOM 2239 CA GLN A 143 11.405 -6.188 11.992 1.00 0.36 C ATOM 2240 C GLN A 143 12.446 -6.933 12.834 1.00 0.38 C ATOM 2241 O GLN A 143 13.529 -6.410 13.101 1.00 0.44 O ATOM 2242 CB GLN A 143 9.992 -6.585 12.435 1.00 0.36 C ATOM 2243 CG GLN A 143 8.897 -5.668 11.878 1.00 0.44 C ATOM 2244 CD GLN A 143 9.209 -4.202 12.087 1.00 1.06 C ATOM 2245 OE1 GLN A 143 8.859 -3.618 13.113 1.00 2.05 O ATOM 2246 NE2 GLN A 143 9.875 -3.601 11.109 1.00 0.96 N ATOM 0 H GLN A 143 11.451 -5.604 9.973 1.00 0.32 H new ATOM 0 HA GLN A 143 11.543 -5.119 12.157 1.00 0.36 H new ATOM 0 HB2 GLN A 143 9.794 -7.609 12.117 1.00 0.36 H new ATOM 0 HB3 GLN A 143 9.945 -6.575 13.524 1.00 0.36 H new ATOM 0 HG2 GLN A 143 8.772 -5.862 10.813 1.00 0.44 H new ATOM 0 HG3 GLN A 143 7.948 -5.907 12.359 1.00 0.44 H new ATOM 0 HE21 GLN A 143 10.144 -4.126 10.277 1.00 0.96 H new ATOM 0 HE22 GLN A 143 10.118 -2.614 11.189 1.00 0.96 H new ATOM 2255 N GLY A 144 12.109 -8.155 13.248 1.00 0.40 N ATOM 2256 CA GLY A 144 13.021 -8.952 14.051 1.00 0.46 C ATOM 2257 C GLY A 144 13.094 -10.395 13.581 1.00 0.46 C ATOM 2258 O GLY A 144 13.014 -11.324 14.385 1.00 0.60 O ATOM 0 H GLY A 144 11.218 -8.606 13.040 1.00 0.40 H new ATOM 0 HA2 GLY A 144 14.016 -8.509 14.013 1.00 0.46 H new ATOM 0 HA3 GLY A 144 12.701 -8.927 15.093 1.00 0.46 H new ATOM 2262 N GLU A 145 13.247 -10.577 12.273 1.00 0.36 N ATOM 2263 CA GLU A 145 13.334 -11.907 11.679 1.00 0.35 C ATOM 2264 C GLU A 145 14.306 -11.891 10.505 1.00 0.35 C ATOM 2265 O GLU A 145 14.242 -11.008 9.649 1.00 0.38 O ATOM 2266 CB GLU A 145 11.948 -12.378 11.206 1.00 0.36 C ATOM 2267 CG GLU A 145 11.711 -13.885 11.384 1.00 0.64 C ATOM 2268 CD GLU A 145 12.776 -14.724 10.703 1.00 1.34 C ATOM 2269 OE1 GLU A 145 12.617 -15.024 9.501 1.00 2.02 O ATOM 2270 OE2 GLU A 145 13.768 -15.083 11.373 1.00 1.90 O ATOM 0 H GLU A 145 13.314 -9.814 11.600 1.00 0.36 H new ATOM 0 HA GLU A 145 13.698 -12.602 12.436 1.00 0.35 H new ATOM 0 HB2 GLU A 145 11.182 -11.832 11.756 1.00 0.36 H new ATOM 0 HB3 GLU A 145 11.828 -12.123 10.153 1.00 0.36 H new ATOM 0 HG2 GLU A 145 11.690 -14.123 12.447 1.00 0.64 H new ATOM 0 HG3 GLU A 145 10.733 -14.146 10.979 1.00 0.64 H new ATOM 2277 N VAL A 146 15.203 -12.869 10.467 1.00 0.37 N ATOM 2278 CA VAL A 146 16.187 -12.955 9.396 1.00 0.39 C ATOM 2279 C VAL A 146 15.824 -14.061 8.412 1.00 0.37 C ATOM 2280 O VAL A 146 15.454 -15.166 8.810 1.00 0.46 O ATOM 2281 CB VAL A 146 17.610 -13.206 9.953 1.00 0.51 C ATOM 2282 CG1 VAL A 146 17.663 -14.536 10.706 1.00 1.30 C ATOM 2283 CG2 VAL A 146 18.643 -13.190 8.825 1.00 1.12 C ATOM 0 H VAL A 146 15.269 -13.611 11.163 1.00 0.37 H new ATOM 0 HA VAL A 146 16.181 -11.997 8.877 1.00 0.39 H new ATOM 0 HB VAL A 146 17.851 -12.403 10.650 1.00 0.51 H new ATOM 0 HG11 VAL A 146 18.670 -14.696 11.091 1.00 1.30 H new ATOM 0 HG12 VAL A 146 16.957 -14.513 11.536 1.00 1.30 H new ATOM 0 HG13 VAL A 146 17.400 -15.348 10.029 1.00 1.30 H new ATOM 0 HG21 VAL A 146 19.636 -13.368 9.238 1.00 1.12 H new ATOM 0 HG22 VAL A 146 18.405 -13.971 8.103 1.00 1.12 H new ATOM 0 HG23 VAL A 146 18.625 -12.219 8.329 1.00 1.12 H new ATOM 2293 N SER A 147 15.924 -13.753 7.123 1.00 0.34 N ATOM 2294 CA SER A 147 15.604 -14.715 6.081 1.00 0.35 C ATOM 2295 C SER A 147 16.390 -14.402 4.818 1.00 0.38 C ATOM 2296 O SER A 147 17.046 -13.365 4.726 1.00 0.74 O ATOM 2297 CB SER A 147 14.102 -14.697 5.781 1.00 0.39 C ATOM 2298 OG SER A 147 13.746 -15.744 4.895 1.00 1.12 O ATOM 0 H SER A 147 16.225 -12.842 6.777 1.00 0.34 H new ATOM 0 HA SER A 147 15.879 -15.710 6.432 1.00 0.35 H new ATOM 0 HB2 SER A 147 13.541 -14.796 6.710 1.00 0.39 H new ATOM 0 HB3 SER A 147 13.827 -13.737 5.344 1.00 0.39 H new ATOM 0 HG SER A 147 12.782 -15.712 4.721 1.00 1.12 H new ATOM 2304 N THR A 148 16.316 -15.299 3.846 1.00 0.32 N ATOM 2305 CA THR A 148 17.029 -15.117 2.589 1.00 0.30 C ATOM 2306 C THR A 148 16.133 -14.483 1.531 1.00 0.28 C ATOM 2307 O THR A 148 14.969 -14.855 1.383 1.00 0.31 O ATOM 2308 CB THR A 148 17.583 -16.458 2.026 1.00 0.35 C ATOM 2309 OG1 THR A 148 17.162 -16.621 0.666 1.00 1.11 O ATOM 2310 CG2 THR A 148 17.091 -17.646 2.849 1.00 0.90 C ATOM 0 H THR A 148 15.771 -16.159 3.903 1.00 0.32 H new ATOM 0 HA THR A 148 17.866 -14.455 2.813 1.00 0.30 H new ATOM 0 HB THR A 148 18.671 -16.424 2.080 1.00 0.35 H new ATOM 0 HG1 THR A 148 17.513 -17.465 0.314 1.00 1.11 H new ATOM 0 HG21 THR A 148 17.494 -18.569 2.432 1.00 0.90 H new ATOM 0 HG22 THR A 148 17.425 -17.537 3.881 1.00 0.90 H new ATOM 0 HG23 THR A 148 16.002 -17.681 2.822 1.00 0.90 H new ATOM 2318 N PHE A 149 16.690 -13.521 0.802 1.00 0.25 N ATOM 2319 CA PHE A 149 15.962 -12.854 -0.267 1.00 0.24 C ATOM 2320 C PHE A 149 15.979 -13.755 -1.490 1.00 0.25 C ATOM 2321 O PHE A 149 17.046 -14.187 -1.928 1.00 0.28 O ATOM 2322 CB PHE A 149 16.607 -11.496 -0.607 1.00 0.21 C ATOM 2323 CG PHE A 149 16.171 -10.957 -1.946 1.00 0.20 C ATOM 2324 CD1 PHE A 149 14.973 -10.263 -2.077 1.00 0.20 C ATOM 2325 CD2 PHE A 149 16.947 -11.171 -3.081 1.00 0.25 C ATOM 2326 CE1 PHE A 149 14.562 -9.794 -3.309 1.00 0.23 C ATOM 2327 CE2 PHE A 149 16.535 -10.708 -4.317 1.00 0.28 C ATOM 2328 CZ PHE A 149 15.342 -10.020 -4.431 1.00 0.27 C ATOM 0 H PHE A 149 17.645 -13.187 0.934 1.00 0.25 H new ATOM 0 HA PHE A 149 14.937 -12.666 0.054 1.00 0.24 H new ATOM 0 HB2 PHE A 149 16.353 -10.774 0.169 1.00 0.21 H new ATOM 0 HB3 PHE A 149 17.692 -11.603 -0.600 1.00 0.21 H new ATOM 0 HD1 PHE A 149 14.358 -10.089 -1.206 1.00 0.20 H new ATOM 0 HD2 PHE A 149 17.882 -11.705 -2.996 1.00 0.25 H new ATOM 0 HE1 PHE A 149 13.633 -9.251 -3.398 1.00 0.23 H new ATOM 0 HE2 PHE A 149 17.144 -10.884 -5.191 1.00 0.28 H new ATOM 0 HZ PHE A 149 15.018 -9.658 -5.396 1.00 0.27 H new ATOM 2338 N THR A 150 14.810 -14.043 -2.047 1.00 0.35 N ATOM 2339 CA THR A 150 14.748 -14.929 -3.198 1.00 0.41 C ATOM 2340 C THR A 150 14.054 -14.297 -4.404 1.00 0.40 C ATOM 2341 O THR A 150 12.830 -14.342 -4.527 1.00 0.78 O ATOM 2342 CB THR A 150 14.031 -16.244 -2.830 1.00 0.59 C ATOM 2343 OG1 THR A 150 14.353 -16.606 -1.480 1.00 1.55 O ATOM 2344 CG2 THR A 150 14.445 -17.380 -3.766 1.00 1.37 C ATOM 0 H THR A 150 13.910 -13.684 -1.728 1.00 0.35 H new ATOM 0 HA THR A 150 15.781 -15.130 -3.482 1.00 0.41 H new ATOM 0 HB THR A 150 12.957 -16.084 -2.931 1.00 0.59 H new ATOM 0 HG1 THR A 150 13.895 -17.441 -1.247 1.00 1.55 H new ATOM 0 HG21 THR A 150 13.923 -18.294 -3.482 1.00 1.37 H new ATOM 0 HG22 THR A 150 14.186 -17.119 -4.792 1.00 1.37 H new ATOM 0 HG23 THR A 150 15.521 -17.538 -3.692 1.00 1.37 H new ATOM 2352 N GLY A 151 14.862 -13.721 -5.293 1.00 0.45 N ATOM 2353 CA GLY A 151 14.355 -13.126 -6.520 1.00 0.46 C ATOM 2354 C GLY A 151 13.588 -11.825 -6.363 1.00 0.37 C ATOM 2355 O GLY A 151 13.913 -10.843 -7.031 1.00 0.38 O ATOM 0 H GLY A 151 15.874 -13.656 -5.182 1.00 0.45 H new ATOM 0 HA2 GLY A 151 15.197 -12.949 -7.189 1.00 0.46 H new ATOM 0 HA3 GLY A 151 13.705 -13.851 -7.010 1.00 0.46 H new ATOM 2359 N LYS A 152 12.576 -11.791 -5.503 1.00 0.39 N ATOM 2360 CA LYS A 152 11.783 -10.572 -5.357 1.00 0.35 C ATOM 2361 C LYS A 152 11.115 -10.458 -3.999 1.00 0.32 C ATOM 2362 O LYS A 152 11.117 -11.394 -3.198 1.00 0.38 O ATOM 2363 CB LYS A 152 10.689 -10.533 -6.447 1.00 0.52 C ATOM 2364 CG LYS A 152 9.368 -11.199 -6.030 1.00 0.35 C ATOM 2365 CD LYS A 152 9.551 -12.672 -5.633 1.00 0.79 C ATOM 2366 CE LYS A 152 9.458 -13.608 -6.836 1.00 1.12 C ATOM 2367 NZ LYS A 152 9.731 -15.021 -6.457 1.00 1.80 N ATOM 0 H LYS A 152 12.289 -12.570 -4.910 1.00 0.39 H new ATOM 0 HA LYS A 152 12.474 -9.735 -5.459 1.00 0.35 H new ATOM 0 HB2 LYS A 152 10.492 -9.494 -6.713 1.00 0.52 H new ATOM 0 HB3 LYS A 152 11.066 -11.026 -7.343 1.00 0.52 H new ATOM 0 HG2 LYS A 152 8.937 -10.651 -5.192 1.00 0.35 H new ATOM 0 HG3 LYS A 152 8.656 -11.134 -6.853 1.00 0.35 H new ATOM 0 HD2 LYS A 152 10.520 -12.799 -5.150 1.00 0.79 H new ATOM 0 HD3 LYS A 152 8.791 -12.947 -4.901 1.00 0.79 H new ATOM 0 HE2 LYS A 152 8.464 -13.535 -7.278 1.00 1.12 H new ATOM 0 HE3 LYS A 152 10.170 -13.292 -7.599 1.00 1.12 H new ATOM 0 HZ1 LYS A 152 9.659 -15.627 -7.299 1.00 1.80 H new ATOM 0 HZ2 LYS A 152 10.689 -15.095 -6.059 1.00 1.80 H new ATOM 0 HZ3 LYS A 152 9.036 -15.331 -5.748 1.00 1.80 H new ATOM 2381 N LEU A 153 10.544 -9.283 -3.760 1.00 0.30 N ATOM 2382 CA LEU A 153 9.802 -9.029 -2.532 1.00 0.27 C ATOM 2383 C LEU A 153 8.339 -9.310 -2.830 1.00 0.26 C ATOM 2384 O LEU A 153 7.781 -8.730 -3.756 1.00 0.33 O ATOM 2385 CB LEU A 153 10.018 -7.596 -2.033 1.00 0.28 C ATOM 2386 CG LEU A 153 10.279 -7.447 -0.525 1.00 0.37 C ATOM 2387 CD1 LEU A 153 10.943 -6.119 -0.217 1.00 0.90 C ATOM 2388 CD2 LEU A 153 8.983 -7.570 0.258 1.00 1.24 C ATOM 0 H LEU A 153 10.581 -8.491 -4.401 1.00 0.30 H new ATOM 0 HA LEU A 153 10.154 -9.677 -1.729 1.00 0.27 H new ATOM 0 HB2 LEU A 153 10.861 -7.166 -2.573 1.00 0.28 H new ATOM 0 HB3 LEU A 153 9.139 -7.005 -2.291 1.00 0.28 H new ATOM 0 HG LEU A 153 10.952 -8.250 -0.223 1.00 0.37 H new ATOM 0 HD11 LEU A 153 11.116 -6.039 0.856 1.00 0.90 H new ATOM 0 HD12 LEU A 153 11.895 -6.057 -0.744 1.00 0.90 H new ATOM 0 HD13 LEU A 153 10.295 -5.304 -0.541 1.00 0.90 H new ATOM 0 HD21 LEU A 153 9.190 -7.462 1.323 1.00 1.24 H new ATOM 0 HD22 LEU A 153 8.291 -6.790 -0.059 1.00 1.24 H new ATOM 0 HD23 LEU A 153 8.537 -8.547 0.072 1.00 1.24 H new ATOM 2400 N SER A 154 7.701 -10.193 -2.064 1.00 0.26 N ATOM 2401 CA SER A 154 6.327 -10.560 -2.387 1.00 0.28 C ATOM 2402 C SER A 154 5.324 -10.166 -1.315 1.00 0.29 C ATOM 2403 O SER A 154 5.279 -10.759 -0.241 1.00 0.44 O ATOM 2404 CB SER A 154 6.248 -12.066 -2.636 1.00 0.38 C ATOM 2405 OG SER A 154 5.173 -12.387 -3.501 1.00 1.28 O ATOM 0 H SER A 154 8.097 -10.653 -1.244 1.00 0.26 H new ATOM 0 HA SER A 154 6.056 -10.003 -3.284 1.00 0.28 H new ATOM 0 HB2 SER A 154 7.185 -12.415 -3.071 1.00 0.38 H new ATOM 0 HB3 SER A 154 6.123 -12.588 -1.687 1.00 0.38 H new ATOM 0 HG SER A 154 5.438 -12.217 -4.429 1.00 1.28 H new ATOM 2411 N VAL A 155 4.483 -9.194 -1.639 1.00 0.30 N ATOM 2412 CA VAL A 155 3.467 -8.733 -0.707 1.00 0.33 C ATOM 2413 C VAL A 155 2.125 -9.365 -1.033 1.00 0.40 C ATOM 2414 O VAL A 155 1.551 -9.114 -2.093 1.00 0.52 O ATOM 2415 CB VAL A 155 3.332 -7.202 -0.736 1.00 0.42 C ATOM 2416 CG1 VAL A 155 2.455 -6.718 0.422 1.00 0.59 C ATOM 2417 CG2 VAL A 155 4.715 -6.560 -0.679 1.00 0.46 C ATOM 0 H VAL A 155 4.485 -8.711 -2.538 1.00 0.30 H new ATOM 0 HA VAL A 155 3.779 -9.033 0.293 1.00 0.33 H new ATOM 0 HB VAL A 155 2.849 -6.905 -1.667 1.00 0.42 H new ATOM 0 HG11 VAL A 155 2.371 -5.632 0.385 1.00 0.59 H new ATOM 0 HG12 VAL A 155 1.463 -7.162 0.337 1.00 0.59 H new ATOM 0 HG13 VAL A 155 2.906 -7.015 1.369 1.00 0.59 H new ATOM 0 HG21 VAL A 155 4.614 -5.475 -0.700 1.00 0.46 H new ATOM 0 HG22 VAL A 155 5.218 -6.860 0.240 1.00 0.46 H new ATOM 0 HG23 VAL A 155 5.303 -6.886 -1.537 1.00 0.46 H new ATOM 2427 N GLU A 156 1.630 -10.186 -0.114 1.00 0.43 N ATOM 2428 CA GLU A 156 0.360 -10.872 -0.307 1.00 0.57 C ATOM 2429 C GLU A 156 -0.606 -10.592 0.829 1.00 0.44 C ATOM 2430 O GLU A 156 -0.227 -10.603 2.000 1.00 0.45 O ATOM 2431 CB GLU A 156 0.570 -12.383 -0.414 1.00 0.81 C ATOM 2432 CG GLU A 156 1.397 -12.812 -1.626 1.00 0.85 C ATOM 2433 CD GLU A 156 0.751 -12.424 -2.941 1.00 1.79 C ATOM 2434 OE1 GLU A 156 -0.390 -12.866 -3.195 1.00 2.24 O ATOM 2435 OE2 GLU A 156 1.387 -11.682 -3.717 1.00 2.48 O ATOM 0 H GLU A 156 2.090 -10.392 0.773 1.00 0.43 H new ATOM 0 HA GLU A 156 -0.066 -10.492 -1.235 1.00 0.57 H new ATOM 0 HB2 GLU A 156 1.062 -12.736 0.492 1.00 0.81 H new ATOM 0 HB3 GLU A 156 -0.403 -12.872 -0.459 1.00 0.81 H new ATOM 0 HG2 GLU A 156 2.387 -12.359 -1.564 1.00 0.85 H new ATOM 0 HG3 GLU A 156 1.539 -13.892 -1.600 1.00 0.85 H new ATOM 2442 N PHE A 157 -1.855 -10.337 0.472 1.00 0.43 N ATOM 2443 CA PHE A 157 -2.886 -10.092 1.462 1.00 0.39 C ATOM 2444 C PHE A 157 -3.967 -11.157 1.347 1.00 0.43 C ATOM 2445 O PHE A 157 -4.435 -11.472 0.243 1.00 0.51 O ATOM 2446 CB PHE A 157 -3.485 -8.682 1.311 1.00 0.45 C ATOM 2447 CG PHE A 157 -3.553 -8.192 -0.114 1.00 0.68 C ATOM 2448 CD1 PHE A 157 -2.481 -7.526 -0.688 1.00 1.11 C ATOM 2449 CD2 PHE A 157 -4.690 -8.413 -0.883 1.00 0.89 C ATOM 2450 CE1 PHE A 157 -2.539 -7.088 -2.000 1.00 1.51 C ATOM 2451 CE2 PHE A 157 -4.754 -7.977 -2.195 1.00 1.26 C ATOM 2452 CZ PHE A 157 -3.682 -7.261 -2.736 1.00 1.54 C ATOM 0 H PHE A 157 -2.177 -10.295 -0.495 1.00 0.43 H new ATOM 0 HA PHE A 157 -2.436 -10.147 2.453 1.00 0.39 H new ATOM 0 HB2 PHE A 157 -4.490 -8.678 1.734 1.00 0.45 H new ATOM 0 HB3 PHE A 157 -2.890 -7.981 1.897 1.00 0.45 H new ATOM 0 HD1 PHE A 157 -1.590 -7.347 -0.105 1.00 1.11 H new ATOM 0 HD2 PHE A 157 -5.534 -8.931 -0.451 1.00 0.89 H new ATOM 0 HE1 PHE A 157 -1.680 -6.608 -2.445 1.00 1.51 H new ATOM 0 HE2 PHE A 157 -5.626 -8.188 -2.796 1.00 1.26 H new ATOM 0 HZ PHE A 157 -3.754 -6.846 -3.730 1.00 1.54 H new ATOM 2462 N VAL A 158 -4.332 -11.728 2.494 1.00 0.42 N ATOM 2463 CA VAL A 158 -5.346 -12.777 2.541 1.00 0.48 C ATOM 2464 C VAL A 158 -6.659 -12.258 3.113 1.00 0.50 C ATOM 2465 O VAL A 158 -6.672 -11.428 4.035 1.00 0.48 O ATOM 2466 CB VAL A 158 -4.878 -13.990 3.373 1.00 0.52 C ATOM 2467 CG1 VAL A 158 -5.823 -15.177 3.170 1.00 0.77 C ATOM 2468 CG2 VAL A 158 -3.445 -14.371 3.004 1.00 0.75 C ATOM 0 H VAL A 158 -3.940 -11.481 3.403 1.00 0.42 H new ATOM 0 HA VAL A 158 -5.505 -13.096 1.511 1.00 0.48 H new ATOM 0 HB VAL A 158 -4.898 -13.714 4.427 1.00 0.52 H new ATOM 0 HG11 VAL A 158 -5.477 -16.023 3.764 1.00 0.77 H new ATOM 0 HG12 VAL A 158 -6.829 -14.899 3.485 1.00 0.77 H new ATOM 0 HG13 VAL A 158 -5.837 -15.455 2.116 1.00 0.77 H new ATOM 0 HG21 VAL A 158 -3.131 -15.228 3.600 1.00 0.75 H new ATOM 0 HG22 VAL A 158 -3.398 -14.628 1.946 1.00 0.75 H new ATOM 0 HG23 VAL A 158 -2.782 -13.529 3.202 1.00 0.75 H new ATOM 2478 N LYS A 159 -7.756 -12.772 2.553 1.00 0.56 N ATOM 2479 CA LYS A 159 -9.102 -12.385 2.957 1.00 0.62 C ATOM 2480 C LYS A 159 -9.364 -12.703 4.424 1.00 0.62 C ATOM 2481 O LYS A 159 -8.831 -13.667 4.972 1.00 0.66 O ATOM 2482 CB LYS A 159 -10.152 -13.104 2.089 1.00 0.76 C ATOM 2483 CG LYS A 159 -10.315 -14.591 2.428 1.00 0.80 C ATOM 2484 CD LYS A 159 -11.410 -15.254 1.582 1.00 1.03 C ATOM 2485 CE LYS A 159 -11.655 -16.701 2.018 1.00 1.25 C ATOM 2486 NZ LYS A 159 -12.188 -16.773 3.406 1.00 1.97 N ATOM 0 H LYS A 159 -7.732 -13.468 1.807 1.00 0.56 H new ATOM 0 HA LYS A 159 -9.182 -11.307 2.817 1.00 0.62 H new ATOM 0 HB2 LYS A 159 -11.114 -12.605 2.209 1.00 0.76 H new ATOM 0 HB3 LYS A 159 -9.872 -13.008 1.040 1.00 0.76 H new ATOM 0 HG2 LYS A 159 -9.368 -15.106 2.265 1.00 0.80 H new ATOM 0 HG3 LYS A 159 -10.558 -14.698 3.485 1.00 0.80 H new ATOM 0 HD2 LYS A 159 -12.335 -14.684 1.671 1.00 1.03 H new ATOM 0 HD3 LYS A 159 -11.122 -15.233 0.531 1.00 1.03 H new ATOM 0 HE2 LYS A 159 -12.358 -17.174 1.333 1.00 1.25 H new ATOM 0 HE3 LYS A 159 -10.723 -17.263 1.956 1.00 1.25 H new ATOM 0 HZ1 LYS A 159 -12.593 -17.716 3.574 1.00 1.97 H new ATOM 0 HZ2 LYS A 159 -11.417 -16.601 4.083 1.00 1.97 H new ATOM 0 HZ3 LYS A 159 -12.927 -16.052 3.532 1.00 1.97 H new ATOM 2500 N GLY A 160 -10.193 -11.876 5.046 1.00 0.70 N ATOM 2501 CA GLY A 160 -10.555 -12.075 6.433 1.00 0.79 C ATOM 2502 C GLY A 160 -12.058 -12.115 6.602 1.00 0.88 C ATOM 2503 O GLY A 160 -12.569 -12.435 7.676 1.00 1.12 O ATOM 0 H GLY A 160 -10.625 -11.062 4.608 1.00 0.70 H new ATOM 0 HA2 GLY A 160 -10.120 -13.006 6.796 1.00 0.79 H new ATOM 0 HA3 GLY A 160 -10.139 -11.271 7.040 1.00 0.79 H new ATOM 2507 N TYR A 161 -12.761 -11.786 5.522 1.00 0.90 N ATOM 2508 CA TYR A 161 -14.217 -11.781 5.514 1.00 1.04 C ATOM 2509 C TYR A 161 -14.739 -12.061 4.107 1.00 1.14 C ATOM 2510 O TYR A 161 -15.488 -13.015 3.893 1.00 1.83 O ATOM 2511 CB TYR A 161 -14.750 -10.434 6.017 1.00 1.22 C ATOM 2512 CG TYR A 161 -16.231 -10.457 6.358 1.00 1.69 C ATOM 2513 CD1 TYR A 161 -16.666 -10.834 7.627 1.00 2.41 C ATOM 2514 CD2 TYR A 161 -17.195 -10.102 5.415 1.00 2.21 C ATOM 2515 CE1 TYR A 161 -18.015 -10.858 7.943 1.00 3.08 C ATOM 2516 CE2 TYR A 161 -18.544 -10.124 5.729 1.00 2.78 C ATOM 2517 CZ TYR A 161 -18.945 -10.502 6.991 1.00 3.06 C ATOM 2518 OH TYR A 161 -20.285 -10.524 7.303 1.00 3.81 O ATOM 0 H TYR A 161 -12.339 -11.517 4.633 1.00 0.90 H new ATOM 0 HA TYR A 161 -14.570 -12.567 6.182 1.00 1.04 H new ATOM 0 HB2 TYR A 161 -14.186 -10.137 6.901 1.00 1.22 H new ATOM 0 HB3 TYR A 161 -14.572 -9.675 5.255 1.00 1.22 H new ATOM 0 HD1 TYR A 161 -15.940 -11.112 8.377 1.00 2.41 H new ATOM 0 HD2 TYR A 161 -16.885 -9.805 4.424 1.00 2.21 H new ATOM 0 HE1 TYR A 161 -18.336 -11.154 8.931 1.00 3.08 H new ATOM 0 HE2 TYR A 161 -19.278 -9.846 4.987 1.00 2.78 H new ATOM 0 HH TYR A 161 -20.807 -10.245 6.522 1.00 3.81 H new ATOM 2528 N TYR A 162 -14.332 -11.226 3.150 1.00 0.94 N ATOM 2529 CA TYR A 162 -14.754 -11.389 1.759 1.00 0.99 C ATOM 2530 C TYR A 162 -14.040 -10.391 0.845 1.00 1.07 C ATOM 2531 O TYR A 162 -13.207 -10.775 0.024 1.00 2.04 O ATOM 2532 CB TYR A 162 -16.272 -11.217 1.635 1.00 1.14 C ATOM 2533 CG TYR A 162 -16.842 -11.767 0.340 1.00 1.59 C ATOM 2534 CD1 TYR A 162 -17.172 -13.116 0.209 1.00 2.11 C ATOM 2535 CD2 TYR A 162 -17.053 -10.933 -0.755 1.00 2.00 C ATOM 2536 CE1 TYR A 162 -17.689 -13.612 -0.978 1.00 2.79 C ATOM 2537 CE2 TYR A 162 -17.571 -11.426 -1.941 1.00 2.71 C ATOM 2538 CZ TYR A 162 -17.894 -12.792 -2.030 1.00 3.02 C ATOM 2539 OH TYR A 162 -18.402 -13.254 -3.222 1.00 3.82 O ATOM 0 H TYR A 162 -13.712 -10.432 3.312 1.00 0.94 H new ATOM 0 HA TYR A 162 -14.483 -12.397 1.445 1.00 0.99 H new ATOM 0 HB2 TYR A 162 -16.756 -11.715 2.475 1.00 1.14 H new ATOM 0 HB3 TYR A 162 -16.516 -10.157 1.709 1.00 1.14 H new ATOM 0 HD1 TYR A 162 -17.023 -13.784 1.044 1.00 2.11 H new ATOM 0 HD2 TYR A 162 -16.809 -9.884 -0.678 1.00 2.00 H new ATOM 0 HE1 TYR A 162 -17.929 -14.662 -1.061 1.00 2.79 H new ATOM 0 HE2 TYR A 162 -17.725 -10.771 -2.786 1.00 2.71 H new ATOM 0 HH TYR A 162 -18.477 -12.510 -3.856 1.00 3.82 H new ATOM 2549 N ASP A 163 -14.372 -9.112 0.997 1.00 0.73 N ATOM 2550 CA ASP A 163 -13.769 -8.052 0.188 1.00 0.68 C ATOM 2551 C ASP A 163 -12.390 -7.683 0.703 1.00 0.74 C ATOM 2552 O ASP A 163 -12.246 -6.816 1.565 1.00 1.40 O ATOM 2553 CB ASP A 163 -14.673 -6.815 0.177 1.00 0.76 C ATOM 2554 CG ASP A 163 -15.993 -7.070 -0.523 1.00 0.97 C ATOM 2555 OD1 ASP A 163 -16.031 -6.980 -1.768 1.00 1.32 O ATOM 2556 OD2 ASP A 163 -16.988 -7.361 0.173 1.00 1.14 O ATOM 0 H ASP A 163 -15.058 -8.782 1.676 1.00 0.73 H new ATOM 0 HA ASP A 163 -13.662 -8.427 -0.830 1.00 0.68 H new ATOM 0 HB2 ASP A 163 -14.864 -6.499 1.203 1.00 0.76 H new ATOM 0 HB3 ASP A 163 -14.155 -5.994 -0.319 1.00 0.76 H new ATOM 2561 N ASN A 164 -11.381 -8.362 0.168 1.00 0.63 N ATOM 2562 CA ASN A 164 -9.996 -8.105 0.532 1.00 0.62 C ATOM 2563 C ASN A 164 -9.730 -6.599 0.483 1.00 0.74 C ATOM 2564 O ASN A 164 -10.415 -5.896 -0.260 1.00 1.00 O ATOM 2565 CB ASN A 164 -9.085 -8.839 -0.454 1.00 0.77 C ATOM 2566 CG ASN A 164 -9.062 -10.337 -0.220 1.00 1.09 C ATOM 2567 OD1 ASN A 164 -10.061 -10.924 0.187 1.00 2.00 O ATOM 2568 ND2 ASN A 164 -7.917 -10.963 -0.480 1.00 0.87 N ATOM 0 H ASN A 164 -11.501 -9.101 -0.525 1.00 0.63 H new ATOM 0 HA ASN A 164 -9.797 -8.462 1.542 1.00 0.62 H new ATOM 0 HB2 ASN A 164 -9.421 -8.639 -1.472 1.00 0.77 H new ATOM 0 HB3 ASN A 164 -8.072 -8.446 -0.369 1.00 0.77 H new ATOM 0 HD21 ASN A 164 -7.844 -11.971 -0.343 1.00 0.87 H new ATOM 0 HD22 ASN A 164 -7.112 -10.435 -0.817 1.00 0.87 H new ATOM 2575 N PRO A 165 -8.757 -6.067 1.265 1.00 1.24 N ATOM 2576 CA PRO A 165 -8.452 -4.634 1.265 1.00 1.56 C ATOM 2577 C PRO A 165 -8.724 -3.987 -0.087 1.00 1.14 C ATOM 2578 O PRO A 165 -7.922 -4.084 -1.017 1.00 1.83 O ATOM 2579 CB PRO A 165 -6.967 -4.647 1.596 1.00 2.26 C ATOM 2580 CG PRO A 165 -6.867 -5.722 2.640 1.00 2.58 C ATOM 2581 CD PRO A 165 -7.865 -6.795 2.204 1.00 1.89 C ATOM 0 HA PRO A 165 -9.061 -4.053 1.958 1.00 1.56 H new ATOM 0 HB2 PRO A 165 -6.360 -4.876 0.720 1.00 2.26 H new ATOM 0 HB3 PRO A 165 -6.629 -3.683 1.975 1.00 2.26 H new ATOM 0 HG2 PRO A 165 -5.855 -6.124 2.696 1.00 2.58 H new ATOM 0 HG3 PRO A 165 -7.112 -5.335 3.629 1.00 2.58 H new ATOM 0 HD2 PRO A 165 -7.367 -7.634 1.718 1.00 1.89 H new ATOM 0 HD3 PRO A 165 -8.417 -7.200 3.052 1.00 1.89 H new ATOM 2589 N LYS A 166 -9.877 -3.330 -0.174 1.00 0.65 N ATOM 2590 CA LYS A 166 -10.316 -2.681 -1.405 1.00 0.43 C ATOM 2591 C LYS A 166 -9.242 -1.751 -1.970 1.00 0.40 C ATOM 2592 O LYS A 166 -8.656 -2.055 -3.008 1.00 0.55 O ATOM 2593 CB LYS A 166 -11.642 -1.915 -1.192 1.00 0.86 C ATOM 2594 CG LYS A 166 -11.965 -1.624 0.280 1.00 1.71 C ATOM 2595 CD LYS A 166 -12.693 -2.807 0.946 1.00 2.36 C ATOM 2596 CE LYS A 166 -14.198 -2.816 0.629 1.00 3.06 C ATOM 2597 NZ LYS A 166 -14.462 -2.902 -0.835 1.00 3.71 N ATOM 0 H LYS A 166 -10.531 -3.233 0.603 1.00 0.65 H new ATOM 0 HA LYS A 166 -10.490 -3.469 -2.137 1.00 0.43 H new ATOM 0 HB2 LYS A 166 -11.596 -0.972 -1.737 1.00 0.86 H new ATOM 0 HB3 LYS A 166 -12.458 -2.494 -1.625 1.00 0.86 H new ATOM 0 HG2 LYS A 166 -11.042 -1.413 0.821 1.00 1.71 H new ATOM 0 HG3 LYS A 166 -12.585 -0.730 0.347 1.00 1.71 H new ATOM 0 HD2 LYS A 166 -12.247 -3.742 0.608 1.00 2.36 H new ATOM 0 HD3 LYS A 166 -12.551 -2.757 2.026 1.00 2.36 H new ATOM 0 HE2 LYS A 166 -14.669 -3.661 1.132 1.00 3.06 H new ATOM 0 HE3 LYS A 166 -14.657 -1.911 1.027 1.00 3.06 H new ATOM 0 HZ1 LYS A 166 -15.465 -3.126 -0.994 1.00 3.71 H new ATOM 0 HZ2 LYS A 166 -14.235 -1.991 -1.283 1.00 3.71 H new ATOM 0 HZ3 LYS A 166 -13.870 -3.649 -1.251 1.00 3.71 H new ATOM 2611 N VAL A 167 -8.973 -0.618 -1.314 1.00 0.34 N ATOM 2612 CA VAL A 167 -7.952 0.288 -1.834 1.00 0.33 C ATOM 2613 C VAL A 167 -6.571 -0.115 -1.372 1.00 0.25 C ATOM 2614 O VAL A 167 -6.334 -0.266 -0.169 1.00 0.24 O ATOM 2615 CB VAL A 167 -8.180 1.748 -1.383 1.00 0.42 C ATOM 2616 CG1 VAL A 167 -6.910 2.578 -1.605 1.00 0.90 C ATOM 2617 CG2 VAL A 167 -9.362 2.371 -2.123 1.00 0.92 C ATOM 0 H VAL A 167 -9.430 -0.316 -0.454 1.00 0.34 H new ATOM 0 HA VAL A 167 -8.029 0.222 -2.919 1.00 0.33 H new ATOM 0 HB VAL A 167 -8.413 1.743 -0.318 1.00 0.42 H new ATOM 0 HG11 VAL A 167 -7.085 3.604 -1.283 1.00 0.90 H new ATOM 0 HG12 VAL A 167 -6.091 2.151 -1.027 1.00 0.90 H new ATOM 0 HG13 VAL A 167 -6.650 2.569 -2.664 1.00 0.90 H new ATOM 0 HG21 VAL A 167 -9.501 3.399 -1.787 1.00 0.92 H new ATOM 0 HG22 VAL A 167 -9.165 2.363 -3.195 1.00 0.92 H new ATOM 0 HG23 VAL A 167 -10.265 1.796 -1.916 1.00 0.92 H new ATOM 2627 N CYS A 168 -5.643 -0.179 -2.334 1.00 0.23 N ATOM 2628 CA CYS A 168 -4.259 -0.531 -2.042 1.00 0.21 C ATOM 2629 C CYS A 168 -3.322 0.459 -2.723 1.00 0.20 C ATOM 2630 O CYS A 168 -3.367 0.632 -3.938 1.00 0.28 O ATOM 2631 CB CYS A 168 -3.967 -1.950 -2.513 1.00 0.27 C ATOM 2632 SG CYS A 168 -2.466 -2.671 -1.808 1.00 1.20 S ATOM 0 H CYS A 168 -5.831 0.009 -3.319 1.00 0.23 H new ATOM 0 HA CYS A 168 -4.098 -0.486 -0.965 1.00 0.21 H new ATOM 0 HB2 CYS A 168 -4.815 -2.586 -2.261 1.00 0.27 H new ATOM 0 HB3 CYS A 168 -3.881 -1.950 -3.600 1.00 0.27 H new ATOM 0 HG CYS A 168 -2.639 -2.877 -0.536 1.00 1.20 H new ATOM 2638 N ALA A 169 -2.473 1.092 -1.923 1.00 0.19 N ATOM 2639 CA ALA A 169 -1.536 2.109 -2.400 1.00 0.18 C ATOM 2640 C ALA A 169 -0.078 1.699 -2.251 1.00 0.21 C ATOM 2641 O ALA A 169 0.730 2.494 -1.767 1.00 0.22 O ATOM 2642 CB ALA A 169 -1.788 3.449 -1.750 1.00 0.19 C ATOM 0 H ALA A 169 -2.413 0.916 -0.920 1.00 0.19 H new ATOM 0 HA ALA A 169 -1.725 2.206 -3.469 1.00 0.18 H new ATOM 0 HB1 ALA A 169 -1.072 4.178 -2.130 1.00 0.19 H new ATOM 0 HB2 ALA A 169 -2.800 3.781 -1.980 1.00 0.19 H new ATOM 0 HB3 ALA A 169 -1.673 3.357 -0.670 1.00 0.19 H new ATOM 2648 N LEU A 170 0.210 0.417 -2.494 1.00 0.22 N ATOM 2649 CA LEU A 170 1.575 -0.102 -2.399 1.00 0.28 C ATOM 2650 C LEU A 170 2.568 0.902 -2.977 1.00 0.23 C ATOM 2651 O LEU A 170 2.343 1.473 -4.044 1.00 0.32 O ATOM 2652 CB LEU A 170 1.687 -1.432 -3.166 1.00 0.47 C ATOM 2653 CG LEU A 170 2.790 -2.420 -2.701 1.00 0.37 C ATOM 2654 CD1 LEU A 170 4.109 -1.713 -2.424 1.00 0.50 C ATOM 2655 CD2 LEU A 170 2.346 -3.200 -1.465 1.00 1.02 C ATOM 0 H LEU A 170 -0.486 -0.280 -2.758 1.00 0.22 H new ATOM 0 HA LEU A 170 1.809 -0.268 -1.347 1.00 0.28 H new ATOM 0 HB2 LEU A 170 0.726 -1.942 -3.102 1.00 0.47 H new ATOM 0 HB3 LEU A 170 1.858 -1.204 -4.218 1.00 0.47 H new ATOM 0 HG LEU A 170 2.950 -3.120 -3.521 1.00 0.37 H new ATOM 0 HD11 LEU A 170 4.852 -2.442 -2.101 1.00 0.50 H new ATOM 0 HD12 LEU A 170 4.455 -1.220 -3.332 1.00 0.50 H new ATOM 0 HD13 LEU A 170 3.966 -0.970 -1.640 1.00 0.50 H new ATOM 0 HD21 LEU A 170 3.139 -3.884 -1.162 1.00 1.02 H new ATOM 0 HD22 LEU A 170 2.136 -2.505 -0.652 1.00 1.02 H new ATOM 0 HD23 LEU A 170 1.445 -3.768 -1.698 1.00 1.02 H new ATOM 2667 N PHE A 171 3.664 1.109 -2.260 1.00 0.21 N ATOM 2668 CA PHE A 171 4.699 2.035 -2.687 1.00 0.20 C ATOM 2669 C PHE A 171 6.054 1.610 -2.113 1.00 0.19 C ATOM 2670 O PHE A 171 6.320 1.840 -0.933 1.00 0.26 O ATOM 2671 CB PHE A 171 4.304 3.457 -2.225 1.00 0.23 C ATOM 2672 CG PHE A 171 5.435 4.455 -2.124 1.00 0.24 C ATOM 2673 CD1 PHE A 171 6.576 4.300 -2.903 1.00 0.24 C ATOM 2674 CD2 PHE A 171 5.365 5.539 -1.262 1.00 0.29 C ATOM 2675 CE1 PHE A 171 7.614 5.210 -2.824 1.00 0.28 C ATOM 2676 CE2 PHE A 171 6.392 6.448 -1.181 1.00 0.33 C ATOM 2677 CZ PHE A 171 7.511 6.291 -1.914 1.00 0.31 C ATOM 0 H PHE A 171 3.858 0.643 -1.374 1.00 0.21 H new ATOM 0 HA PHE A 171 4.792 2.030 -3.773 1.00 0.20 H new ATOM 0 HB2 PHE A 171 3.559 3.850 -2.917 1.00 0.23 H new ATOM 0 HB3 PHE A 171 3.824 3.381 -1.250 1.00 0.23 H new ATOM 0 HD1 PHE A 171 6.652 3.460 -3.577 1.00 0.24 H new ATOM 0 HD2 PHE A 171 4.489 5.671 -0.644 1.00 0.29 H new ATOM 0 HE1 PHE A 171 8.490 5.098 -3.446 1.00 0.28 H new ATOM 0 HE2 PHE A 171 6.301 7.299 -0.522 1.00 0.33 H new ATOM 0 HZ PHE A 171 8.329 6.988 -1.808 1.00 0.31 H new ATOM 2687 N ILE A 172 6.917 0.981 -2.936 1.00 0.17 N ATOM 2688 CA ILE A 172 8.224 0.576 -2.429 1.00 0.17 C ATOM 2689 C ILE A 172 9.367 1.475 -2.927 1.00 0.17 C ATOM 2690 O ILE A 172 9.602 1.668 -4.152 1.00 0.17 O ATOM 2691 CB ILE A 172 8.598 -0.910 -2.665 1.00 0.19 C ATOM 2692 CG1 ILE A 172 9.590 -1.350 -1.568 1.00 0.29 C ATOM 2693 CG2 ILE A 172 9.243 -1.115 -4.023 1.00 0.22 C ATOM 2694 CD1 ILE A 172 10.229 -2.696 -1.808 1.00 0.69 C ATOM 0 H ILE A 172 6.736 0.754 -3.914 1.00 0.17 H new ATOM 0 HA ILE A 172 8.107 0.702 -1.353 1.00 0.17 H new ATOM 0 HB ILE A 172 7.685 -1.504 -2.630 1.00 0.19 H new ATOM 0 HG12 ILE A 172 10.375 -0.599 -1.483 1.00 0.29 H new ATOM 0 HG13 ILE A 172 9.068 -1.375 -0.612 1.00 0.29 H new ATOM 0 HG21 ILE A 172 9.491 -2.168 -4.153 1.00 0.22 H new ATOM 0 HG22 ILE A 172 8.550 -0.807 -4.805 1.00 0.22 H new ATOM 0 HG23 ILE A 172 10.152 -0.517 -4.088 1.00 0.22 H new ATOM 0 HD11 ILE A 172 10.911 -2.926 -0.989 1.00 0.69 H new ATOM 0 HD12 ILE A 172 9.455 -3.462 -1.862 1.00 0.69 H new ATOM 0 HD13 ILE A 172 10.783 -2.674 -2.746 1.00 0.69 H new ATOM 2706 N MET A 173 10.078 2.015 -1.946 1.00 0.18 N ATOM 2707 CA MET A 173 11.220 2.884 -2.192 1.00 0.19 C ATOM 2708 C MET A 173 12.478 2.235 -1.635 1.00 0.19 C ATOM 2709 O MET A 173 12.391 1.326 -0.806 1.00 0.21 O ATOM 2710 CB MET A 173 11.003 4.255 -1.540 1.00 0.21 C ATOM 2711 CG MET A 173 10.005 4.203 -0.384 1.00 0.36 C ATOM 2712 SD MET A 173 9.827 5.778 0.474 1.00 1.26 S ATOM 2713 CE MET A 173 11.521 6.128 0.934 1.00 0.61 C ATOM 0 H MET A 173 9.879 1.863 -0.957 1.00 0.18 H new ATOM 0 HA MET A 173 11.331 3.029 -3.267 1.00 0.19 H new ATOM 0 HB2 MET A 173 11.957 4.635 -1.175 1.00 0.21 H new ATOM 0 HB3 MET A 173 10.646 4.959 -2.292 1.00 0.21 H new ATOM 0 HG2 MET A 173 9.032 3.893 -0.766 1.00 0.36 H new ATOM 0 HG3 MET A 173 10.324 3.443 0.329 1.00 0.36 H new ATOM 0 HE1 MET A 173 11.536 6.677 1.876 1.00 0.61 H new ATOM 0 HE2 MET A 173 12.067 5.192 1.051 1.00 0.61 H new ATOM 0 HE3 MET A 173 11.993 6.729 0.156 1.00 0.61 H new ATOM 2723 N LYS A 174 13.648 2.705 -2.064 1.00 0.21 N ATOM 2724 CA LYS A 174 14.882 2.089 -1.603 1.00 0.24 C ATOM 2725 C LYS A 174 15.837 3.026 -0.863 1.00 0.24 C ATOM 2726 O LYS A 174 15.988 4.207 -1.177 1.00 0.32 O ATOM 2727 CB LYS A 174 15.644 1.448 -2.781 1.00 0.32 C ATOM 2728 CG LYS A 174 16.589 2.422 -3.502 1.00 0.62 C ATOM 2729 CD LYS A 174 17.561 1.698 -4.449 1.00 0.87 C ATOM 2730 CE LYS A 174 18.885 1.376 -3.746 1.00 0.78 C ATOM 2731 NZ LYS A 174 19.561 2.608 -3.254 1.00 1.82 N ATOM 0 H LYS A 174 13.764 3.486 -2.710 1.00 0.21 H new ATOM 0 HA LYS A 174 14.556 1.339 -0.882 1.00 0.24 H new ATOM 0 HB2 LYS A 174 16.221 0.600 -2.412 1.00 0.32 H new ATOM 0 HB3 LYS A 174 14.924 1.055 -3.498 1.00 0.32 H new ATOM 0 HG2 LYS A 174 16.000 3.142 -4.070 1.00 0.62 H new ATOM 0 HG3 LYS A 174 17.158 2.987 -2.763 1.00 0.62 H new ATOM 0 HD2 LYS A 174 17.104 0.776 -4.808 1.00 0.87 H new ATOM 0 HD3 LYS A 174 17.752 2.321 -5.323 1.00 0.87 H new ATOM 0 HE2 LYS A 174 18.698 0.704 -2.908 1.00 0.78 H new ATOM 0 HE3 LYS A 174 19.545 0.850 -4.436 1.00 0.78 H new ATOM 0 HZ1 LYS A 174 20.590 2.459 -3.243 1.00 1.82 H new ATOM 0 HZ2 LYS A 174 19.333 3.404 -3.883 1.00 1.82 H new ATOM 0 HZ3 LYS A 174 19.232 2.823 -2.291 1.00 1.82 H new ATOM 2745 N GLY A 175 16.456 2.425 0.134 1.00 0.20 N ATOM 2746 CA GLY A 175 17.505 3.028 0.930 1.00 0.21 C ATOM 2747 C GLY A 175 17.142 3.543 2.312 1.00 0.20 C ATOM 2748 O GLY A 175 17.951 3.341 3.220 1.00 0.22 O ATOM 0 H GLY A 175 16.235 1.472 0.421 1.00 0.20 H new ATOM 0 HA2 GLY A 175 18.301 2.293 1.046 1.00 0.21 H new ATOM 0 HA3 GLY A 175 17.920 3.860 0.361 1.00 0.21 H new ATOM 2752 N THR A 176 15.933 4.098 2.529 1.00 0.20 N ATOM 2753 CA THR A 176 15.576 4.604 3.872 1.00 0.22 C ATOM 2754 C THR A 176 14.198 5.259 3.951 1.00 0.25 C ATOM 2755 O THR A 176 13.635 5.686 2.944 1.00 0.27 O ATOM 2756 CB THR A 176 16.576 5.656 4.374 1.00 0.25 C ATOM 2757 OG1 THR A 176 17.382 6.131 3.288 1.00 0.25 O ATOM 2758 CG2 THR A 176 17.477 5.125 5.496 1.00 0.29 C ATOM 0 H THR A 176 15.208 4.206 1.819 1.00 0.20 H new ATOM 0 HA THR A 176 15.587 3.705 4.489 1.00 0.22 H new ATOM 0 HB THR A 176 15.991 6.477 4.788 1.00 0.25 H new ATOM 0 HG1 THR A 176 18.015 6.802 3.619 1.00 0.25 H new ATOM 0 HG21 THR A 176 18.164 5.910 5.813 1.00 0.29 H new ATOM 0 HG22 THR A 176 16.862 4.818 6.342 1.00 0.29 H new ATOM 0 HG23 THR A 176 18.046 4.270 5.132 1.00 0.29 H new ATOM 2766 N ALA A 177 13.672 5.332 5.183 1.00 0.30 N ATOM 2767 CA ALA A 177 12.391 5.984 5.458 1.00 0.36 C ATOM 2768 C ALA A 177 12.590 7.483 5.681 1.00 0.45 C ATOM 2769 O ALA A 177 11.641 8.262 5.615 1.00 0.57 O ATOM 2770 CB ALA A 177 11.729 5.364 6.691 1.00 0.41 C ATOM 0 H ALA A 177 14.123 4.942 6.010 1.00 0.30 H new ATOM 0 HA ALA A 177 11.743 5.837 4.594 1.00 0.36 H new ATOM 0 HB1 ALA A 177 10.777 5.860 6.881 1.00 0.41 H new ATOM 0 HB2 ALA A 177 11.556 4.302 6.516 1.00 0.41 H new ATOM 0 HB3 ALA A 177 12.382 5.487 7.555 1.00 0.41 H new ATOM 2776 N ASP A 178 13.830 7.874 5.966 1.00 0.48 N ATOM 2777 CA ASP A 178 14.156 9.274 6.224 1.00 0.57 C ATOM 2778 C ASP A 178 13.897 10.153 5.005 1.00 0.59 C ATOM 2779 O ASP A 178 13.821 11.376 5.120 1.00 0.81 O ATOM 2780 CB ASP A 178 15.622 9.406 6.657 1.00 0.70 C ATOM 2781 CG ASP A 178 15.882 8.778 8.012 1.00 1.34 C ATOM 2782 OD1 ASP A 178 16.197 7.570 8.056 1.00 2.31 O ATOM 2783 OD2 ASP A 178 15.774 9.495 9.029 1.00 1.41 O ATOM 0 H ASP A 178 14.627 7.240 6.024 1.00 0.48 H new ATOM 0 HA ASP A 178 13.504 9.617 7.028 1.00 0.57 H new ATOM 0 HB2 ASP A 178 16.262 8.934 5.912 1.00 0.70 H new ATOM 0 HB3 ASP A 178 15.895 10.461 6.690 1.00 0.70 H new