USER MOD reduce.3.24.130724 H: found=0, std=0, add=1361, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1362 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 123 HIS : no HD1:sc= -0.158 X(o=-0.27,f=-0.19) USER MOD Set 1.2: A 124 SER OG : rot -83:sc= -0.108 USER MOD Set 2.1: A 98 GLN : amide:sc= 0.287 K(o=0.55,f=-0.59) USER MOD Set 2.2: A 99 GLN : amide:sc= 0.267 K(o=0.55,f=-0.59) USER MOD Set 3.1: A 73 TYR OH : rot 14:sc= -0.372 USER MOD Set 3.2: A 168 CYS SG : rot 81:sc= 1.38 USER MOD Set 4.1: A 42 SER OG : rot -50:sc= 0.749 USER MOD Set 4.2: A 66 TYR OH : rot 30:sc= 0.233 USER MOD Set 5.1: A 15 ASN : amide:sc= 0.137 K(o=0.7,f=-2) USER MOD Set 5.2: A 29 TYR OH : rot 180:sc= -0.594 USER MOD Set 5.3: A 63 THR OG1 : rot 79:sc= 1.16 USER MOD Single : A 9 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0247) USER MOD Single : A 20 SER OG : rot 180:sc= 0.0492 USER MOD Single : A 21 HIS : no HD1:sc= -5.08! C(o=-5.1!,f=-7.1!) USER MOD Single : A 25 HIS : no HD1:sc= -0.124 X(o=-0.12,f=0) USER MOD Single : A 28 HIS : no HD1:sc= -1.84 K(o=-1.8,f=-2.9!) USER MOD Single : A 31 LYS NZ :NH3+ -160:sc= 1.23 (180deg=1.12) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 MET CE :methyl 177:sc= 0 (180deg=-0.0105) USER MOD Single : A 47 LYS NZ :NH3+ -176:sc= 1.26 (180deg=1.2) USER MOD Single : A 53 SER OG : rot 113:sc= 1.37 USER MOD Single : A 54 ASN : amide:sc= -0.619! C(o=-0.62!,f=-5.3!) USER MOD Single : A 58 GLN :FLIP amide:sc= 0.76 F(o=-0.72,f=0.76) USER MOD Single : A 61 TYR OH : rot 79:sc= 0.0694 USER MOD Single : A 62 GLN :FLIP amide:sc= 0.952 F(o=-2.7!,f=0.95) USER MOD Single : A 67 ASN : amide:sc= 0.00361 K(o=0.0036,f=-2.5!) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot -74:sc= -1.39 USER MOD Single : A 88 LYS NZ :NH3+ -126:sc= -0.388 (180deg=-2.96!) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 GLN :FLIP amide:sc= -0.0961 F(o=-2.4!,f=-0.096) USER MOD Single : A 97 SER OG : rot 180:sc= 0.0785 USER MOD Single : A 100 LYS NZ :NH3+ 151:sc= 0.897 (180deg=-0.339!) USER MOD Single : A 107 ASN : amide:sc= -0.208 K(o=-0.21,f=-0.91) USER MOD Single : A 109 HIS : no HE2:sc= 0.708 K(o=0.71,f=-6.4!) USER MOD Single : A 110 THR OG1 : rot 51:sc= 0.0339 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 THR OG1 : rot 8:sc= 1.03 USER MOD Single : A 127 HIS : no HD1:sc= -0.512 K(o=-0.51,f=-5!) USER MOD Single : A 134 SER OG : rot -100:sc= 1.33 USER MOD Single : A 136 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0781) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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= -0.0856 X(o=-0.086,f=-0.19) USER MOD Single : A 147 SER OG : rot 180:sc= 0 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 180:sc= 0 USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 TYR OH : rot 180:sc= 0 USER MOD Single : A 162 TYR OH : rot 18:sc= 1.04 USER MOD Single : A 164 ASN : amide:sc= -2.33! C(o=-2.3!,f=-6.6!) USER MOD Single : A 166 LYS NZ :NH3+ -174:sc= 1.17 (180deg=0.912) USER MOD Single : A 173 MET CE :methyl -163:sc= -3.18 (180deg=-5.87!) USER MOD Single : A 174 LYS NZ :NH3+ -154:sc= 0.879 (180deg=0.142!) USER MOD Single : A 176 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 5 -11.509 15.364 3.322 1.00 1.48 N ATOM 2 CA GLY A 5 -12.349 14.374 3.973 1.00 1.01 C ATOM 3 C GLY A 5 -11.803 12.969 3.814 1.00 0.78 C ATOM 4 O GLY A 5 -12.557 12.001 3.723 1.00 0.75 O ATOM 0 HA2 GLY A 5 -12.433 14.612 5.033 1.00 1.01 H new ATOM 0 HA3 GLY A 5 -13.355 14.421 3.555 1.00 1.01 H new ATOM 8 N LEU A 6 -10.479 12.867 3.803 1.00 0.72 N ATOM 9 CA LEU A 6 -9.794 11.605 3.602 1.00 0.55 C ATOM 10 C LEU A 6 -9.980 10.710 4.825 1.00 0.42 C ATOM 11 O LEU A 6 -10.152 9.494 4.705 1.00 0.36 O ATOM 12 CB LEU A 6 -8.307 11.878 3.350 1.00 0.53 C ATOM 13 CG LEU A 6 -7.488 10.682 2.872 1.00 0.44 C ATOM 14 CD1 LEU A 6 -7.956 10.233 1.500 1.00 0.52 C ATOM 15 CD2 LEU A 6 -6.011 11.025 2.838 1.00 0.47 C ATOM 0 H LEU A 6 -9.853 13.662 3.934 1.00 0.72 H new ATOM 0 HA LEU A 6 -10.213 11.090 2.738 1.00 0.55 H new ATOM 0 HB2 LEU A 6 -8.223 12.673 2.609 1.00 0.53 H new ATOM 0 HB3 LEU A 6 -7.864 12.254 4.272 1.00 0.53 H new ATOM 0 HG LEU A 6 -7.636 9.863 3.576 1.00 0.44 H new ATOM 0 HD11 LEU A 6 -7.362 9.379 1.174 1.00 0.52 H new ATOM 0 HD12 LEU A 6 -9.006 9.946 1.550 1.00 0.52 H new ATOM 0 HD13 LEU A 6 -7.837 11.051 0.789 1.00 0.52 H new ATOM 0 HD21 LEU A 6 -5.444 10.159 2.495 1.00 0.47 H new ATOM 0 HD22 LEU A 6 -5.847 11.860 2.157 1.00 0.47 H new ATOM 0 HD23 LEU A 6 -5.679 11.303 3.838 1.00 0.47 H new ATOM 27 N ALA A 7 -9.979 11.337 5.999 1.00 0.44 N ATOM 28 CA ALA A 7 -10.155 10.630 7.263 1.00 0.41 C ATOM 29 C ALA A 7 -11.554 10.037 7.375 1.00 0.39 C ATOM 30 O ALA A 7 -11.775 9.058 8.089 1.00 0.44 O ATOM 31 CB ALA A 7 -9.898 11.573 8.429 1.00 0.53 C ATOM 0 H ALA A 7 -9.857 12.345 6.100 1.00 0.44 H new ATOM 0 HA ALA A 7 -9.436 9.812 7.293 1.00 0.41 H new ATOM 0 HB1 ALA A 7 -10.032 11.036 9.368 1.00 0.53 H new ATOM 0 HB2 ALA A 7 -8.878 11.954 8.371 1.00 0.53 H new ATOM 0 HB3 ALA A 7 -10.599 12.406 8.385 1.00 0.53 H new ATOM 37 N ASP A 8 -12.496 10.632 6.659 1.00 0.41 N ATOM 38 CA ASP A 8 -13.880 10.189 6.701 1.00 0.48 C ATOM 39 C ASP A 8 -14.054 8.905 5.911 1.00 0.44 C ATOM 40 O ASP A 8 -14.868 8.051 6.262 1.00 0.60 O ATOM 41 CB ASP A 8 -14.813 11.258 6.129 1.00 0.61 C ATOM 42 CG ASP A 8 -14.848 12.519 6.962 1.00 1.30 C ATOM 43 OD1 ASP A 8 -15.653 12.587 7.915 1.00 1.44 O ATOM 44 OD2 ASP A 8 -14.057 13.441 6.680 1.00 2.18 O ATOM 0 H ASP A 8 -12.326 11.425 6.040 1.00 0.41 H new ATOM 0 HA ASP A 8 -14.137 10.011 7.745 1.00 0.48 H new ATOM 0 HB2 ASP A 8 -14.494 11.507 5.117 1.00 0.61 H new ATOM 0 HB3 ASP A 8 -15.821 10.850 6.055 1.00 0.61 H new ATOM 49 N LYS A 9 -13.273 8.763 4.851 1.00 0.33 N ATOM 50 CA LYS A 9 -13.468 7.664 3.924 1.00 0.34 C ATOM 51 C LYS A 9 -12.595 6.465 4.274 1.00 0.29 C ATOM 52 O LYS A 9 -12.954 5.334 3.964 1.00 0.36 O ATOM 53 CB LYS A 9 -13.192 8.106 2.483 1.00 0.44 C ATOM 54 CG LYS A 9 -13.821 9.441 2.102 1.00 0.65 C ATOM 55 CD LYS A 9 -15.333 9.415 2.264 1.00 0.86 C ATOM 56 CE LYS A 9 -15.971 10.733 1.852 1.00 1.24 C ATOM 57 NZ LYS A 9 -15.911 10.955 0.380 1.00 1.79 N ATOM 0 H LYS A 9 -12.505 9.391 4.614 1.00 0.33 H new ATOM 0 HA LYS A 9 -14.511 7.359 4.008 1.00 0.34 H new ATOM 0 HB2 LYS A 9 -12.114 8.171 2.336 1.00 0.44 H new ATOM 0 HB3 LYS A 9 -13.560 7.338 1.803 1.00 0.44 H new ATOM 0 HG2 LYS A 9 -13.402 10.232 2.724 1.00 0.65 H new ATOM 0 HG3 LYS A 9 -13.569 9.681 1.069 1.00 0.65 H new ATOM 0 HD2 LYS A 9 -15.749 8.607 1.662 1.00 0.86 H new ATOM 0 HD3 LYS A 9 -15.583 9.200 3.303 1.00 0.86 H new ATOM 0 HE2 LYS A 9 -17.011 10.748 2.177 1.00 1.24 H new ATOM 0 HE3 LYS A 9 -15.466 11.553 2.362 1.00 1.24 H new ATOM 0 HZ1 LYS A 9 -16.431 11.822 0.138 1.00 1.79 H new ATOM 0 HZ2 LYS A 9 -14.919 11.052 0.084 1.00 1.79 H new ATOM 0 HZ3 LYS A 9 -16.341 10.145 -0.111 1.00 1.79 H new ATOM 71 N VAL A 10 -11.440 6.695 4.891 1.00 0.26 N ATOM 72 CA VAL A 10 -10.553 5.591 5.241 1.00 0.24 C ATOM 73 C VAL A 10 -11.246 4.565 6.137 1.00 0.23 C ATOM 74 O VAL A 10 -11.709 4.875 7.236 1.00 0.30 O ATOM 75 CB VAL A 10 -9.263 6.087 5.917 1.00 0.28 C ATOM 76 CG1 VAL A 10 -9.560 6.836 7.211 1.00 0.33 C ATOM 77 CG2 VAL A 10 -8.305 4.932 6.168 1.00 0.28 C ATOM 0 H VAL A 10 -11.100 7.620 5.155 1.00 0.26 H new ATOM 0 HA VAL A 10 -10.287 5.104 4.303 1.00 0.24 H new ATOM 0 HB VAL A 10 -8.783 6.788 5.234 1.00 0.28 H new ATOM 0 HG11 VAL A 10 -8.625 7.171 7.660 1.00 0.33 H new ATOM 0 HG12 VAL A 10 -10.189 7.700 6.995 1.00 0.33 H new ATOM 0 HG13 VAL A 10 -10.078 6.173 7.904 1.00 0.33 H new ATOM 0 HG21 VAL A 10 -7.400 5.307 6.647 1.00 0.28 H new ATOM 0 HG22 VAL A 10 -8.782 4.198 6.818 1.00 0.28 H new ATOM 0 HG23 VAL A 10 -8.045 4.462 5.219 1.00 0.28 H new ATOM 87 N ILE A 11 -11.335 3.341 5.647 1.00 0.24 N ATOM 88 CA ILE A 11 -11.934 2.264 6.416 1.00 0.29 C ATOM 89 C ILE A 11 -10.853 1.384 7.014 1.00 0.26 C ATOM 90 O ILE A 11 -11.055 0.727 8.037 1.00 0.28 O ATOM 91 CB ILE A 11 -12.871 1.387 5.557 1.00 0.38 C ATOM 92 CG1 ILE A 11 -12.108 0.772 4.376 1.00 0.53 C ATOM 93 CG2 ILE A 11 -14.053 2.205 5.065 1.00 0.92 C ATOM 94 CD1 ILE A 11 -12.894 -0.285 3.632 1.00 0.62 C ATOM 0 H ILE A 11 -11.001 3.068 4.723 1.00 0.24 H new ATOM 0 HA ILE A 11 -12.526 2.728 7.205 1.00 0.29 H new ATOM 0 HB ILE A 11 -13.247 0.573 6.177 1.00 0.38 H new ATOM 0 HG12 ILE A 11 -11.832 1.564 3.680 1.00 0.53 H new ATOM 0 HG13 ILE A 11 -11.181 0.332 4.743 1.00 0.53 H new ATOM 0 HG21 ILE A 11 -14.705 1.575 4.461 1.00 0.92 H new ATOM 0 HG22 ILE A 11 -14.610 2.590 5.919 1.00 0.92 H new ATOM 0 HG23 ILE A 11 -13.693 3.038 4.461 1.00 0.92 H new ATOM 0 HD11 ILE A 11 -12.293 -0.675 2.811 1.00 0.62 H new ATOM 0 HD12 ILE A 11 -13.148 -1.097 4.314 1.00 0.62 H new ATOM 0 HD13 ILE A 11 -13.809 0.154 3.235 1.00 0.62 H new ATOM 106 N TRP A 12 -9.693 1.393 6.377 1.00 0.23 N ATOM 107 CA TRP A 12 -8.623 0.489 6.740 1.00 0.21 C ATOM 108 C TRP A 12 -7.295 1.043 6.231 1.00 0.21 C ATOM 109 O TRP A 12 -7.211 1.518 5.101 1.00 0.25 O ATOM 110 CB TRP A 12 -8.934 -0.885 6.129 1.00 0.23 C ATOM 111 CG TRP A 12 -7.987 -1.988 6.490 1.00 0.25 C ATOM 112 CD1 TRP A 12 -8.201 -2.991 7.390 1.00 0.31 C ATOM 113 CD2 TRP A 12 -6.689 -2.218 5.937 1.00 0.26 C ATOM 114 NE1 TRP A 12 -7.117 -3.832 7.423 1.00 0.33 N ATOM 115 CE2 TRP A 12 -6.176 -3.377 6.540 1.00 0.29 C ATOM 116 CE3 TRP A 12 -5.913 -1.555 4.985 1.00 0.30 C ATOM 117 CZ2 TRP A 12 -4.922 -3.881 6.220 1.00 0.33 C ATOM 118 CZ3 TRP A 12 -4.672 -2.057 4.677 1.00 0.36 C ATOM 119 CH2 TRP A 12 -4.188 -3.211 5.289 1.00 0.36 C ATOM 0 H TRP A 12 -9.472 2.020 5.604 1.00 0.23 H new ATOM 0 HA TRP A 12 -8.544 0.387 7.822 1.00 0.21 H new ATOM 0 HB2 TRP A 12 -9.938 -1.179 6.435 1.00 0.23 H new ATOM 0 HB3 TRP A 12 -8.948 -0.784 5.044 1.00 0.23 H new ATOM 0 HD1 TRP A 12 -9.093 -3.106 7.989 1.00 0.31 H new ATOM 0 HE1 TRP A 12 -7.027 -4.661 8.010 1.00 0.33 H new ATOM 0 HE3 TRP A 12 -6.282 -0.664 4.499 1.00 0.30 H new ATOM 0 HZ2 TRP A 12 -4.542 -4.774 6.694 1.00 0.33 H new ATOM 0 HZ3 TRP A 12 -4.060 -1.548 3.947 1.00 0.36 H new ATOM 0 HH2 TRP A 12 -3.210 -3.582 5.019 1.00 0.36 H new ATOM 130 N ALA A 13 -6.267 1.010 7.064 1.00 0.23 N ATOM 131 CA ALA A 13 -4.952 1.480 6.657 1.00 0.23 C ATOM 132 C ALA A 13 -3.864 0.809 7.475 1.00 0.25 C ATOM 133 O ALA A 13 -3.944 0.753 8.704 1.00 0.26 O ATOM 134 CB ALA A 13 -4.851 2.990 6.787 1.00 0.25 C ATOM 0 H ALA A 13 -6.317 0.664 8.022 1.00 0.23 H new ATOM 0 HA ALA A 13 -4.812 1.215 5.609 1.00 0.23 H new ATOM 0 HB1 ALA A 13 -3.858 3.316 6.477 1.00 0.25 H new ATOM 0 HB2 ALA A 13 -5.602 3.461 6.153 1.00 0.25 H new ATOM 0 HB3 ALA A 13 -5.020 3.278 7.825 1.00 0.25 H new ATOM 140 N VAL A 14 -2.855 0.299 6.794 1.00 0.27 N ATOM 141 CA VAL A 14 -1.744 -0.357 7.452 1.00 0.27 C ATOM 142 C VAL A 14 -0.421 -0.011 6.793 1.00 0.26 C ATOM 143 O VAL A 14 -0.236 -0.186 5.579 1.00 0.33 O ATOM 144 CB VAL A 14 -1.910 -1.895 7.487 1.00 0.33 C ATOM 145 CG1 VAL A 14 -0.570 -2.593 7.655 1.00 0.70 C ATOM 146 CG2 VAL A 14 -2.821 -2.301 8.624 1.00 0.79 C ATOM 0 H VAL A 14 -2.783 0.328 5.777 1.00 0.27 H new ATOM 0 HA VAL A 14 -1.741 0.014 8.477 1.00 0.27 H new ATOM 0 HB VAL A 14 -2.348 -2.197 6.536 1.00 0.33 H new ATOM 0 HG11 VAL A 14 -0.722 -3.672 7.676 1.00 0.70 H new ATOM 0 HG12 VAL A 14 0.082 -2.334 6.821 1.00 0.70 H new ATOM 0 HG13 VAL A 14 -0.108 -2.274 8.589 1.00 0.70 H new ATOM 0 HG21 VAL A 14 -2.928 -3.386 8.635 1.00 0.79 H new ATOM 0 HG22 VAL A 14 -2.393 -1.969 9.570 1.00 0.79 H new ATOM 0 HG23 VAL A 14 -3.800 -1.842 8.488 1.00 0.79 H new ATOM 156 N ASN A 15 0.494 0.485 7.604 1.00 0.26 N ATOM 157 CA ASN A 15 1.870 0.597 7.185 1.00 0.28 C ATOM 158 C ASN A 15 2.616 -0.604 7.725 1.00 0.28 C ATOM 159 O ASN A 15 3.096 -0.592 8.862 1.00 0.34 O ATOM 160 CB ASN A 15 2.535 1.892 7.658 1.00 0.32 C ATOM 161 CG ASN A 15 4.028 1.891 7.393 1.00 0.50 C ATOM 162 OD1 ASN A 15 4.811 2.384 8.206 1.00 1.49 O ATOM 163 ND2 ASN A 15 4.425 1.358 6.250 1.00 0.83 N ATOM 0 H ASN A 15 0.307 0.814 8.551 1.00 0.26 H new ATOM 0 HA ASN A 15 1.900 0.626 6.096 1.00 0.28 H new ATOM 0 HB2 ASN A 15 2.077 2.741 7.151 1.00 0.32 H new ATOM 0 HB3 ASN A 15 2.356 2.023 8.725 1.00 0.32 H new ATOM 0 HD21 ASN A 15 5.417 1.344 6.011 1.00 0.83 H new ATOM 0 HD22 ASN A 15 3.740 0.961 5.607 1.00 0.83 H new ATOM 170 N ALA A 16 2.652 -1.659 6.929 1.00 0.33 N ATOM 171 CA ALA A 16 3.331 -2.872 7.311 1.00 0.39 C ATOM 172 C ALA A 16 4.795 -2.589 7.495 1.00 0.37 C ATOM 173 O ALA A 16 5.540 -2.441 6.508 1.00 0.38 O ATOM 174 CB ALA A 16 3.137 -3.968 6.285 1.00 0.48 C ATOM 0 H ALA A 16 2.214 -1.693 6.009 1.00 0.33 H new ATOM 0 HA ALA A 16 2.902 -3.222 8.250 1.00 0.39 H new ATOM 0 HB1 ALA A 16 3.663 -4.866 6.608 1.00 0.48 H new ATOM 0 HB2 ALA A 16 2.074 -4.187 6.183 1.00 0.48 H new ATOM 0 HB3 ALA A 16 3.534 -3.641 5.324 1.00 0.48 H new ATOM 180 N GLY A 17 5.169 -2.481 8.763 1.00 0.40 N ATOM 181 CA GLY A 17 6.545 -2.255 9.130 1.00 0.45 C ATOM 182 C GLY A 17 6.675 -1.489 10.423 1.00 0.49 C ATOM 183 O GLY A 17 7.718 -1.522 11.068 1.00 0.76 O ATOM 0 H GLY A 17 4.528 -2.548 9.553 1.00 0.40 H new ATOM 0 HA2 GLY A 17 7.055 -3.213 9.225 1.00 0.45 H new ATOM 0 HA3 GLY A 17 7.046 -1.705 8.333 1.00 0.45 H new ATOM 187 N GLY A 18 5.619 -0.796 10.808 1.00 0.57 N ATOM 188 CA GLY A 18 5.677 0.004 12.015 1.00 0.66 C ATOM 189 C GLY A 18 4.435 -0.129 12.871 1.00 0.57 C ATOM 190 O GLY A 18 3.610 -1.019 12.649 1.00 0.74 O ATOM 0 H GLY A 18 4.728 -0.771 10.313 1.00 0.57 H new ATOM 0 HA2 GLY A 18 6.548 -0.292 12.599 1.00 0.66 H new ATOM 0 HA3 GLY A 18 5.815 1.051 11.745 1.00 0.66 H new ATOM 194 N GLU A 19 4.285 0.776 13.833 1.00 0.53 N ATOM 195 CA GLU A 19 3.142 0.743 14.727 1.00 0.50 C ATOM 196 C GLU A 19 2.328 2.027 14.652 1.00 0.45 C ATOM 197 O GLU A 19 2.847 3.103 14.940 1.00 0.64 O ATOM 198 CB GLU A 19 3.597 0.526 16.174 1.00 0.69 C ATOM 199 CG GLU A 19 2.479 0.704 17.192 1.00 1.27 C ATOM 200 CD GLU A 19 2.951 0.563 18.624 1.00 1.45 C ATOM 201 OE1 GLU A 19 3.383 1.574 19.215 1.00 1.75 O ATOM 202 OE2 GLU A 19 2.873 -0.553 19.171 1.00 1.77 O ATOM 0 H GLU A 19 4.940 1.537 14.010 1.00 0.53 H new ATOM 0 HA GLU A 19 2.512 -0.087 14.407 1.00 0.50 H new ATOM 0 HB2 GLU A 19 4.010 -0.478 16.271 1.00 0.69 H new ATOM 0 HB3 GLU A 19 4.402 1.225 16.403 1.00 0.69 H new ATOM 0 HG2 GLU A 19 2.028 1.688 17.060 1.00 1.27 H new ATOM 0 HG3 GLU A 19 1.699 -0.033 16.999 1.00 1.27 H new ATOM 209 N SER A 20 1.069 1.872 14.238 1.00 0.42 N ATOM 210 CA SER A 20 0.017 2.897 14.342 1.00 0.42 C ATOM 211 C SER A 20 0.481 4.357 14.125 1.00 0.38 C ATOM 212 O SER A 20 1.130 4.957 14.980 1.00 0.44 O ATOM 213 CB SER A 20 -0.662 2.758 15.704 1.00 0.59 C ATOM 214 OG SER A 20 -1.107 1.423 15.909 1.00 1.29 O ATOM 0 H SER A 20 0.739 1.008 13.809 1.00 0.42 H new ATOM 0 HA SER A 20 -0.672 2.708 13.519 1.00 0.42 H new ATOM 0 HB2 SER A 20 0.034 3.040 16.494 1.00 0.59 H new ATOM 0 HB3 SER A 20 -1.508 3.442 15.766 1.00 0.59 H new ATOM 0 HG SER A 20 -1.537 1.353 16.787 1.00 1.29 H new ATOM 220 N HIS A 21 0.090 4.951 13.000 1.00 0.34 N ATOM 221 CA HIS A 21 0.436 6.345 12.720 1.00 0.33 C ATOM 222 C HIS A 21 -0.664 7.029 11.926 1.00 0.32 C ATOM 223 O HIS A 21 -1.264 6.440 11.041 1.00 0.32 O ATOM 224 CB HIS A 21 1.763 6.444 11.962 1.00 0.35 C ATOM 225 CG HIS A 21 2.060 7.812 11.406 1.00 0.35 C ATOM 226 ND1 HIS A 21 2.571 8.851 12.152 1.00 0.41 N ATOM 227 CD2 HIS A 21 1.876 8.310 10.167 1.00 0.40 C ATOM 228 CE1 HIS A 21 2.677 9.926 11.386 1.00 0.42 C ATOM 229 NE2 HIS A 21 2.262 9.620 10.177 1.00 0.41 N ATOM 0 H HIS A 21 -0.461 4.495 12.273 1.00 0.34 H new ATOM 0 HA HIS A 21 0.545 6.853 13.678 1.00 0.33 H new ATOM 0 HB2 HIS A 21 2.573 6.153 12.631 1.00 0.35 H new ATOM 0 HB3 HIS A 21 1.754 5.726 11.142 1.00 0.35 H new ATOM 0 HD2 HIS A 21 1.491 7.768 9.316 1.00 0.40 H new ATOM 0 HE1 HIS A 21 3.043 10.892 11.702 1.00 0.42 H new ATOM 0 HE2 HIS A 21 2.233 10.255 9.379 1.00 0.41 H new ATOM 238 N VAL A 22 -0.877 8.289 12.231 1.00 0.41 N ATOM 239 CA VAL A 22 -1.898 9.095 11.586 1.00 0.40 C ATOM 240 C VAL A 22 -1.254 10.047 10.588 1.00 0.40 C ATOM 241 O VAL A 22 -0.448 10.896 10.966 1.00 0.48 O ATOM 242 CB VAL A 22 -2.696 9.931 12.609 1.00 0.49 C ATOM 243 CG1 VAL A 22 -3.847 10.663 11.933 1.00 0.84 C ATOM 244 CG2 VAL A 22 -3.207 9.065 13.742 1.00 1.01 C ATOM 0 H VAL A 22 -0.343 8.791 12.940 1.00 0.41 H new ATOM 0 HA VAL A 22 -2.580 8.410 11.081 1.00 0.40 H new ATOM 0 HB VAL A 22 -2.019 10.674 13.031 1.00 0.49 H new ATOM 0 HG11 VAL A 22 -4.394 11.245 12.675 1.00 0.84 H new ATOM 0 HG12 VAL A 22 -3.453 11.331 11.166 1.00 0.84 H new ATOM 0 HG13 VAL A 22 -4.519 9.938 11.473 1.00 0.84 H new ATOM 0 HG21 VAL A 22 -3.765 9.681 14.447 1.00 1.01 H new ATOM 0 HG22 VAL A 22 -3.860 8.290 13.341 1.00 1.01 H new ATOM 0 HG23 VAL A 22 -2.364 8.601 14.254 1.00 1.01 H new ATOM 254 N ASP A 23 -1.591 9.891 9.324 1.00 0.37 N ATOM 255 CA ASP A 23 -1.139 10.818 8.290 1.00 0.42 C ATOM 256 C ASP A 23 -1.859 12.147 8.459 1.00 0.36 C ATOM 257 O ASP A 23 -2.992 12.177 8.936 1.00 0.33 O ATOM 258 CB ASP A 23 -1.388 10.219 6.899 1.00 0.51 C ATOM 259 CG ASP A 23 -1.589 11.253 5.810 1.00 0.55 C ATOM 260 OD1 ASP A 23 -2.728 11.739 5.663 1.00 0.77 O ATOM 261 OD2 ASP A 23 -0.621 11.570 5.090 1.00 0.75 O ATOM 0 H ASP A 23 -2.178 9.131 8.981 1.00 0.37 H new ATOM 0 HA ASP A 23 -0.067 10.989 8.389 1.00 0.42 H new ATOM 0 HB2 ASP A 23 -0.543 9.584 6.632 1.00 0.51 H new ATOM 0 HB3 ASP A 23 -2.268 9.577 6.943 1.00 0.51 H new ATOM 266 N VAL A 24 -1.176 13.236 8.094 1.00 0.38 N ATOM 267 CA VAL A 24 -1.670 14.601 8.316 1.00 0.37 C ATOM 268 C VAL A 24 -3.043 14.879 7.702 1.00 0.38 C ATOM 269 O VAL A 24 -3.689 15.860 8.075 1.00 0.49 O ATOM 270 CB VAL A 24 -0.678 15.661 7.788 1.00 0.42 C ATOM 271 CG1 VAL A 24 0.574 15.707 8.647 1.00 0.59 C ATOM 272 CG2 VAL A 24 -0.317 15.386 6.336 1.00 0.62 C ATOM 0 H VAL A 24 -0.265 13.198 7.636 1.00 0.38 H new ATOM 0 HA VAL A 24 -1.768 14.676 9.399 1.00 0.37 H new ATOM 0 HB VAL A 24 -1.166 16.634 7.843 1.00 0.42 H new ATOM 0 HG11 VAL A 24 1.257 16.461 8.255 1.00 0.59 H new ATOM 0 HG12 VAL A 24 0.303 15.961 9.672 1.00 0.59 H new ATOM 0 HG13 VAL A 24 1.062 14.732 8.631 1.00 0.59 H new ATOM 0 HG21 VAL A 24 0.383 16.145 5.985 1.00 0.62 H new ATOM 0 HG22 VAL A 24 0.145 14.402 6.256 1.00 0.62 H new ATOM 0 HG23 VAL A 24 -1.219 15.414 5.725 1.00 0.62 H new ATOM 282 N HIS A 25 -3.489 14.048 6.767 1.00 0.37 N ATOM 283 CA HIS A 25 -4.817 14.218 6.184 1.00 0.43 C ATOM 284 C HIS A 25 -5.837 13.475 7.034 1.00 0.40 C ATOM 285 O HIS A 25 -7.047 13.629 6.863 1.00 0.51 O ATOM 286 CB HIS A 25 -4.874 13.706 4.742 1.00 0.53 C ATOM 287 CG HIS A 25 -3.761 14.197 3.872 1.00 0.61 C ATOM 288 ND1 HIS A 25 -3.568 15.525 3.559 1.00 0.73 N ATOM 289 CD2 HIS A 25 -2.769 13.521 3.253 1.00 0.72 C ATOM 290 CE1 HIS A 25 -2.507 15.638 2.783 1.00 0.86 C ATOM 291 NE2 HIS A 25 -2.000 14.436 2.583 1.00 0.86 N ATOM 0 H HIS A 25 -2.959 13.258 6.399 1.00 0.37 H new ATOM 0 HA HIS A 25 -5.046 15.284 6.166 1.00 0.43 H new ATOM 0 HB2 HIS A 25 -4.857 12.616 4.754 1.00 0.53 H new ATOM 0 HB3 HIS A 25 -5.824 14.005 4.300 1.00 0.53 H new ATOM 0 HD2 HIS A 25 -2.611 12.453 3.281 1.00 0.72 H new ATOM 0 HE1 HIS A 25 -2.118 16.561 2.379 1.00 0.86 H new ATOM 0 HE2 HIS A 25 -1.174 14.224 2.023 1.00 0.86 H new ATOM 300 N GLY A 26 -5.323 12.659 7.941 1.00 0.32 N ATOM 301 CA GLY A 26 -6.158 11.963 8.892 1.00 0.33 C ATOM 302 C GLY A 26 -6.260 10.475 8.622 1.00 0.30 C ATOM 303 O GLY A 26 -7.296 9.864 8.876 1.00 0.33 O ATOM 0 H GLY A 26 -4.326 12.466 8.034 1.00 0.32 H new ATOM 0 HA2 GLY A 26 -5.761 12.117 9.895 1.00 0.33 H new ATOM 0 HA3 GLY A 26 -7.157 12.398 8.875 1.00 0.33 H new ATOM 307 N ILE A 27 -5.190 9.871 8.120 1.00 0.26 N ATOM 308 CA ILE A 27 -5.219 8.436 7.852 1.00 0.24 C ATOM 309 C ILE A 27 -4.457 7.680 8.932 1.00 0.26 C ATOM 310 O ILE A 27 -3.228 7.702 8.973 1.00 0.28 O ATOM 311 CB ILE A 27 -4.660 8.063 6.455 1.00 0.24 C ATOM 312 CG1 ILE A 27 -5.541 8.631 5.341 1.00 0.26 C ATOM 313 CG2 ILE A 27 -4.562 6.553 6.300 1.00 0.27 C ATOM 314 CD1 ILE A 27 -7.008 8.373 5.548 1.00 0.31 C ATOM 0 H ILE A 27 -4.311 10.337 7.894 1.00 0.26 H new ATOM 0 HA ILE A 27 -6.269 8.143 7.862 1.00 0.24 H new ATOM 0 HB ILE A 27 -3.664 8.498 6.374 1.00 0.24 H new ATOM 0 HG12 ILE A 27 -5.375 9.706 5.270 1.00 0.26 H new ATOM 0 HG13 ILE A 27 -5.234 8.198 4.389 1.00 0.26 H new ATOM 0 HG21 ILE A 27 -4.167 6.313 5.313 1.00 0.27 H new ATOM 0 HG22 ILE A 27 -3.896 6.151 7.064 1.00 0.27 H new ATOM 0 HG23 ILE A 27 -5.552 6.111 6.412 1.00 0.27 H new ATOM 0 HD11 ILE A 27 -7.573 8.803 4.721 1.00 0.31 H new ATOM 0 HD12 ILE A 27 -7.186 7.298 5.589 1.00 0.31 H new ATOM 0 HD13 ILE A 27 -7.329 8.830 6.484 1.00 0.31 H new ATOM 326 N HIS A 28 -5.194 7.023 9.809 1.00 0.31 N ATOM 327 CA HIS A 28 -4.599 6.296 10.916 1.00 0.33 C ATOM 328 C HIS A 28 -4.310 4.854 10.517 1.00 0.33 C ATOM 329 O HIS A 28 -5.219 4.033 10.401 1.00 0.39 O ATOM 330 CB HIS A 28 -5.538 6.340 12.123 1.00 0.40 C ATOM 331 CG HIS A 28 -4.953 5.817 13.402 1.00 0.49 C ATOM 332 ND1 HIS A 28 -4.889 6.573 14.547 1.00 0.60 N ATOM 333 CD2 HIS A 28 -4.408 4.619 13.718 1.00 0.80 C ATOM 334 CE1 HIS A 28 -4.321 5.873 15.506 1.00 0.66 C ATOM 335 NE2 HIS A 28 -4.021 4.679 15.034 1.00 0.78 N ATOM 0 H HIS A 28 -6.212 6.978 9.775 1.00 0.31 H new ATOM 0 HA HIS A 28 -3.654 6.768 11.183 1.00 0.33 H new ATOM 0 HB2 HIS A 28 -5.854 7.371 12.281 1.00 0.40 H new ATOM 0 HB3 HIS A 28 -6.433 5.764 11.889 1.00 0.40 H new ATOM 0 HD2 HIS A 28 -4.298 3.772 13.057 1.00 0.80 H new ATOM 0 HE1 HIS A 28 -4.132 6.219 16.512 1.00 0.66 H new ATOM 0 HE2 HIS A 28 -3.576 3.926 15.559 1.00 0.78 H new ATOM 344 N TYR A 29 -3.041 4.563 10.304 1.00 0.32 N ATOM 345 CA TYR A 29 -2.605 3.218 10.005 1.00 0.35 C ATOM 346 C TYR A 29 -2.427 2.449 11.302 1.00 0.40 C ATOM 347 O TYR A 29 -1.939 3.001 12.285 1.00 0.44 O ATOM 348 CB TYR A 29 -1.320 3.264 9.161 1.00 0.42 C ATOM 349 CG TYR A 29 0.004 3.006 9.864 1.00 0.65 C ATOM 350 CD1 TYR A 29 0.352 1.754 10.364 1.00 0.80 C ATOM 351 CD2 TYR A 29 0.938 4.017 9.955 1.00 0.98 C ATOM 352 CE1 TYR A 29 1.594 1.534 10.934 1.00 1.17 C ATOM 353 CE2 TYR A 29 2.171 3.807 10.528 1.00 1.30 C ATOM 354 CZ TYR A 29 2.497 2.573 11.012 1.00 1.39 C ATOM 355 OH TYR A 29 3.735 2.379 11.563 1.00 1.75 O ATOM 0 H TYR A 29 -2.288 5.251 10.334 1.00 0.32 H new ATOM 0 HA TYR A 29 -3.356 2.694 9.414 1.00 0.35 H new ATOM 0 HB2 TYR A 29 -1.421 2.533 8.359 1.00 0.42 H new ATOM 0 HB3 TYR A 29 -1.263 4.246 8.692 1.00 0.42 H new ATOM 0 HD1 TYR A 29 -0.358 0.942 10.306 1.00 0.80 H new ATOM 0 HD2 TYR A 29 0.696 4.996 9.568 1.00 0.98 H new ATOM 0 HE1 TYR A 29 1.853 0.557 11.314 1.00 1.17 H new ATOM 0 HE2 TYR A 29 2.881 4.618 10.595 1.00 1.30 H new ATOM 0 HH TYR A 29 4.241 3.218 11.535 1.00 1.75 H new ATOM 365 N ARG A 30 -2.852 1.194 11.316 1.00 0.50 N ATOM 366 CA ARG A 30 -2.727 0.378 12.514 1.00 0.64 C ATOM 367 C ARG A 30 -1.455 -0.461 12.460 1.00 0.76 C ATOM 368 O ARG A 30 -0.976 -0.814 11.381 1.00 1.46 O ATOM 369 CB ARG A 30 -3.962 -0.517 12.716 1.00 0.83 C ATOM 370 CG ARG A 30 -4.108 -1.632 11.696 1.00 0.73 C ATOM 371 CD ARG A 30 -5.341 -2.482 11.972 1.00 0.93 C ATOM 372 NE ARG A 30 -5.345 -3.021 13.332 1.00 1.52 N ATOM 373 CZ ARG A 30 -6.202 -3.938 13.783 1.00 2.17 C ATOM 374 NH1 ARG A 30 -7.131 -4.452 12.988 1.00 2.48 N ATOM 375 NH2 ARG A 30 -6.118 -4.348 15.042 1.00 2.94 N ATOM 0 H ARG A 30 -3.282 0.723 10.520 1.00 0.50 H new ATOM 0 HA ARG A 30 -2.663 1.050 13.370 1.00 0.64 H new ATOM 0 HB2 ARG A 30 -3.916 -0.957 13.712 1.00 0.83 H new ATOM 0 HB3 ARG A 30 -4.855 0.106 12.684 1.00 0.83 H new ATOM 0 HG2 ARG A 30 -4.176 -1.205 10.695 1.00 0.73 H new ATOM 0 HG3 ARG A 30 -3.219 -2.262 11.714 1.00 0.73 H new ATOM 0 HD2 ARG A 30 -6.237 -1.881 11.818 1.00 0.93 H new ATOM 0 HD3 ARG A 30 -5.382 -3.304 11.257 1.00 0.93 H new ATOM 0 HE ARG A 30 -4.642 -2.670 13.982 1.00 1.52 H new ATOM 0 HH11 ARG A 30 -7.197 -4.147 12.017 1.00 2.48 H new ATOM 0 HH12 ARG A 30 -7.779 -5.153 13.348 1.00 2.48 H new ATOM 0 HH21 ARG A 30 -5.402 -3.962 15.657 1.00 2.94 H new ATOM 0 HH22 ARG A 30 -6.770 -5.049 15.395 1.00 2.94 H new ATOM 389 N LYS A 31 -0.908 -0.721 13.643 1.00 0.59 N ATOM 390 CA LYS A 31 0.302 -1.526 13.833 1.00 0.67 C ATOM 391 C LYS A 31 0.303 -2.782 12.967 1.00 0.86 C ATOM 392 O LYS A 31 -0.737 -3.411 12.770 1.00 1.37 O ATOM 393 CB LYS A 31 0.428 -1.915 15.310 1.00 0.99 C ATOM 394 CG LYS A 31 1.730 -2.623 15.657 1.00 1.25 C ATOM 395 CD LYS A 31 1.892 -2.775 17.162 1.00 1.61 C ATOM 396 CE LYS A 31 3.290 -3.246 17.533 1.00 2.18 C ATOM 397 NZ LYS A 31 3.561 -3.075 18.989 1.00 2.78 N ATOM 0 H LYS A 31 -1.299 -0.372 14.518 1.00 0.59 H new ATOM 0 HA LYS A 31 1.155 -0.920 13.527 1.00 0.67 H new ATOM 0 HB2 LYS A 31 0.342 -1.016 15.920 1.00 0.99 H new ATOM 0 HB3 LYS A 31 -0.407 -2.562 15.577 1.00 0.99 H new ATOM 0 HG2 LYS A 31 1.749 -3.606 15.186 1.00 1.25 H new ATOM 0 HG3 LYS A 31 2.572 -2.060 15.253 1.00 1.25 H new ATOM 0 HD2 LYS A 31 1.689 -1.821 17.648 1.00 1.61 H new ATOM 0 HD3 LYS A 31 1.157 -3.487 17.537 1.00 1.61 H new ATOM 0 HE2 LYS A 31 3.404 -4.296 17.262 1.00 2.18 H new ATOM 0 HE3 LYS A 31 4.027 -2.686 16.957 1.00 2.18 H new ATOM 0 HZ1 LYS A 31 4.588 -3.076 19.153 1.00 2.78 H new ATOM 0 HZ2 LYS A 31 3.160 -2.172 19.313 1.00 2.78 H new ATOM 0 HZ3 LYS A 31 3.125 -3.857 19.518 1.00 2.78 H new ATOM 411 N ASP A 32 1.498 -3.120 12.485 1.00 0.75 N ATOM 412 CA ASP A 32 1.727 -4.227 11.548 1.00 1.00 C ATOM 413 C ASP A 32 0.997 -5.517 11.940 1.00 0.93 C ATOM 414 O ASP A 32 1.353 -6.196 12.900 1.00 1.29 O ATOM 415 CB ASP A 32 3.235 -4.488 11.401 1.00 1.58 C ATOM 416 CG ASP A 32 3.904 -5.030 12.660 1.00 1.92 C ATOM 417 OD1 ASP A 32 3.738 -4.428 13.743 1.00 2.41 O ATOM 418 OD2 ASP A 32 4.616 -6.058 12.563 1.00 2.36 O ATOM 0 H ASP A 32 2.353 -2.624 12.738 1.00 0.75 H new ATOM 0 HA ASP A 32 1.308 -3.918 10.590 1.00 1.00 H new ATOM 0 HB2 ASP A 32 3.392 -5.196 10.587 1.00 1.58 H new ATOM 0 HB3 ASP A 32 3.726 -3.558 11.114 1.00 1.58 H new ATOM 423 N PRO A 33 -0.078 -5.833 11.204 1.00 0.72 N ATOM 424 CA PRO A 33 -0.832 -7.068 11.355 1.00 0.89 C ATOM 425 C PRO A 33 -0.468 -8.146 10.319 1.00 1.04 C ATOM 426 O PRO A 33 0.184 -9.140 10.648 1.00 1.87 O ATOM 427 CB PRO A 33 -2.273 -6.586 11.144 1.00 0.99 C ATOM 428 CG PRO A 33 -2.175 -5.296 10.372 1.00 0.86 C ATOM 429 CD PRO A 33 -0.708 -4.957 10.225 1.00 0.69 C ATOM 0 HA PRO A 33 -0.639 -7.552 12.312 1.00 0.89 H new ATOM 0 HB2 PRO A 33 -2.854 -7.326 10.594 1.00 0.99 H new ATOM 0 HB3 PRO A 33 -2.776 -6.431 12.099 1.00 0.99 H new ATOM 0 HG2 PRO A 33 -2.643 -5.400 9.393 1.00 0.86 H new ATOM 0 HG3 PRO A 33 -2.701 -4.497 10.894 1.00 0.86 H new ATOM 0 HD2 PRO A 33 -0.346 -5.152 9.215 1.00 0.69 H new ATOM 0 HD3 PRO A 33 -0.512 -3.906 10.437 1.00 0.69 H new ATOM 437 N LEU A 34 -0.902 -7.928 9.070 1.00 0.93 N ATOM 438 CA LEU A 34 -0.778 -8.897 7.976 1.00 1.04 C ATOM 439 C LEU A 34 -1.617 -10.131 8.243 1.00 1.44 C ATOM 440 O LEU A 34 -2.703 -10.302 7.691 1.00 1.99 O ATOM 441 CB LEU A 34 0.672 -9.325 7.704 1.00 0.94 C ATOM 442 CG LEU A 34 1.506 -8.374 6.844 1.00 1.11 C ATOM 443 CD1 LEU A 34 1.711 -7.043 7.538 1.00 1.93 C ATOM 444 CD2 LEU A 34 2.843 -9.011 6.509 1.00 1.40 C ATOM 0 H LEU A 34 -1.356 -7.059 8.789 1.00 0.93 H new ATOM 0 HA LEU A 34 -1.143 -8.382 7.087 1.00 1.04 H new ATOM 0 HB2 LEU A 34 1.177 -9.453 8.661 1.00 0.94 H new ATOM 0 HB3 LEU A 34 0.656 -10.301 7.219 1.00 0.94 H new ATOM 0 HG LEU A 34 0.962 -8.186 5.919 1.00 1.11 H new ATOM 0 HD11 LEU A 34 2.307 -6.389 6.902 1.00 1.93 H new ATOM 0 HD12 LEU A 34 0.743 -6.579 7.729 1.00 1.93 H new ATOM 0 HD13 LEU A 34 2.230 -7.202 8.483 1.00 1.93 H new ATOM 0 HD21 LEU A 34 3.429 -8.326 5.896 1.00 1.40 H new ATOM 0 HD22 LEU A 34 3.384 -9.227 7.430 1.00 1.40 H new ATOM 0 HD23 LEU A 34 2.677 -9.938 5.959 1.00 1.40 H new ATOM 456 N GLU A 35 -1.119 -10.955 9.133 1.00 1.59 N ATOM 457 CA GLU A 35 -1.690 -12.275 9.364 1.00 2.32 C ATOM 458 C GLU A 35 -1.361 -12.786 10.764 1.00 2.08 C ATOM 459 O GLU A 35 -0.678 -13.800 10.930 1.00 2.59 O ATOM 460 CB GLU A 35 -1.178 -13.245 8.292 1.00 3.27 C ATOM 461 CG GLU A 35 0.277 -13.008 7.917 1.00 3.88 C ATOM 462 CD GLU A 35 0.823 -14.025 6.940 1.00 4.71 C ATOM 463 OE1 GLU A 35 0.173 -14.248 5.900 1.00 5.06 O ATOM 464 OE2 GLU A 35 1.887 -14.619 7.212 1.00 5.31 O ATOM 0 H GLU A 35 -0.312 -10.739 9.718 1.00 1.59 H new ATOM 0 HA GLU A 35 -2.776 -12.205 9.295 1.00 2.32 H new ATOM 0 HB2 GLU A 35 -1.292 -14.268 8.652 1.00 3.27 H new ATOM 0 HB3 GLU A 35 -1.797 -13.150 7.400 1.00 3.27 H new ATOM 0 HG2 GLU A 35 0.375 -12.012 7.485 1.00 3.88 H new ATOM 0 HG3 GLU A 35 0.884 -13.023 8.822 1.00 3.88 H new ATOM 471 N GLY A 36 -1.838 -12.068 11.775 1.00 1.92 N ATOM 472 CA GLY A 36 -1.624 -12.493 13.147 1.00 2.13 C ATOM 473 C GLY A 36 -0.271 -12.076 13.676 1.00 2.00 C ATOM 474 O GLY A 36 0.076 -12.355 14.825 1.00 2.64 O ATOM 0 H GLY A 36 -2.367 -11.202 11.670 1.00 1.92 H new ATOM 0 HA2 GLY A 36 -2.404 -12.072 13.781 1.00 2.13 H new ATOM 0 HA3 GLY A 36 -1.716 -13.577 13.207 1.00 2.13 H new ATOM 478 N ARG A 37 0.500 -11.414 12.833 1.00 1.78 N ATOM 479 CA ARG A 37 1.865 -11.042 13.167 1.00 2.68 C ATOM 480 C ARG A 37 1.895 -9.656 13.782 1.00 2.85 C ATOM 481 O ARG A 37 2.583 -8.764 13.295 1.00 3.72 O ATOM 482 CB ARG A 37 2.745 -11.083 11.920 1.00 3.59 C ATOM 483 CG ARG A 37 2.086 -11.776 10.739 1.00 3.76 C ATOM 484 CD ARG A 37 3.109 -12.407 9.822 1.00 3.79 C ATOM 485 NE ARG A 37 3.931 -13.370 10.554 1.00 4.42 N ATOM 486 CZ ARG A 37 4.308 -14.563 10.096 1.00 4.86 C ATOM 487 NH1 ARG A 37 3.876 -15.017 8.927 1.00 4.81 N ATOM 488 NH2 ARG A 37 5.085 -15.326 10.846 1.00 5.64 N ATOM 0 H ARG A 37 0.201 -11.120 11.903 1.00 1.78 H new ATOM 0 HA ARG A 37 2.253 -11.757 13.893 1.00 2.68 H new ATOM 0 HB2 ARG A 37 3.006 -10.064 11.635 1.00 3.59 H new ATOM 0 HB3 ARG A 37 3.677 -11.595 12.159 1.00 3.59 H new ATOM 0 HG2 ARG A 37 1.401 -12.542 11.102 1.00 3.76 H new ATOM 0 HG3 ARG A 37 1.491 -11.055 10.179 1.00 3.76 H new ATOM 0 HD2 ARG A 37 2.605 -12.906 8.994 1.00 3.79 H new ATOM 0 HD3 ARG A 37 3.744 -11.634 9.389 1.00 3.79 H new ATOM 0 HE ARG A 37 4.240 -13.107 11.490 1.00 4.42 H new ATOM 0 HH11 ARG A 37 3.244 -14.450 8.362 1.00 4.81 H new ATOM 0 HH12 ARG A 37 4.176 -15.933 8.593 1.00 4.81 H new ATOM 0 HH21 ARG A 37 5.389 -14.999 11.763 1.00 5.64 H new ATOM 0 HH22 ARG A 37 5.381 -16.242 10.507 1.00 5.64 H new ATOM 502 N VAL A 38 1.174 -9.498 14.874 1.00 2.35 N ATOM 503 CA VAL A 38 1.017 -8.200 15.498 1.00 2.65 C ATOM 504 C VAL A 38 1.871 -8.097 16.750 1.00 2.33 C ATOM 505 O VAL A 38 1.902 -9.013 17.577 1.00 2.45 O ATOM 506 CB VAL A 38 -0.463 -7.922 15.855 1.00 3.31 C ATOM 507 CG1 VAL A 38 -1.300 -7.770 14.597 1.00 3.96 C ATOM 508 CG2 VAL A 38 -1.033 -9.033 16.726 1.00 3.90 C ATOM 0 H VAL A 38 0.685 -10.257 15.349 1.00 2.35 H new ATOM 0 HA VAL A 38 1.347 -7.451 14.778 1.00 2.65 H new ATOM 0 HB VAL A 38 -0.498 -6.989 16.417 1.00 3.31 H new ATOM 0 HG11 VAL A 38 -2.337 -7.575 14.871 1.00 3.96 H new ATOM 0 HG12 VAL A 38 -0.919 -6.938 14.005 1.00 3.96 H new ATOM 0 HG13 VAL A 38 -1.246 -8.687 14.011 1.00 3.96 H new ATOM 0 HG21 VAL A 38 -2.074 -8.812 16.962 1.00 3.90 H new ATOM 0 HG22 VAL A 38 -0.975 -9.981 16.191 1.00 3.90 H new ATOM 0 HG23 VAL A 38 -0.458 -9.102 17.650 1.00 3.90 H new ATOM 518 N GLY A 39 2.588 -6.992 16.872 1.00 2.49 N ATOM 519 CA GLY A 39 3.412 -6.779 18.041 1.00 2.46 C ATOM 520 C GLY A 39 4.891 -6.791 17.721 1.00 2.14 C ATOM 521 O GLY A 39 5.722 -6.880 18.624 1.00 2.56 O ATOM 0 H GLY A 39 2.614 -6.240 16.183 1.00 2.49 H new ATOM 0 HA2 GLY A 39 3.150 -5.824 18.496 1.00 2.46 H new ATOM 0 HA3 GLY A 39 3.197 -7.553 18.778 1.00 2.46 H new ATOM 525 N ARG A 40 5.228 -6.698 16.443 1.00 2.03 N ATOM 526 CA ARG A 40 6.625 -6.671 16.035 1.00 2.30 C ATOM 527 C ARG A 40 7.038 -5.260 15.632 1.00 2.00 C ATOM 528 O ARG A 40 7.829 -4.618 16.329 1.00 2.54 O ATOM 529 CB ARG A 40 6.868 -7.655 14.884 1.00 3.17 C ATOM 530 CG ARG A 40 8.292 -7.633 14.345 1.00 3.67 C ATOM 531 CD ARG A 40 9.319 -7.877 15.441 1.00 4.46 C ATOM 532 NE ARG A 40 10.686 -7.731 14.944 1.00 4.84 N ATOM 533 CZ ARG A 40 11.598 -6.920 15.487 1.00 5.53 C ATOM 534 NH1 ARG A 40 11.309 -6.224 16.581 1.00 5.88 N ATOM 535 NH2 ARG A 40 12.802 -6.815 14.940 1.00 6.20 N ATOM 0 H ARG A 40 4.559 -6.640 15.675 1.00 2.03 H new ATOM 0 HA ARG A 40 7.237 -6.977 16.883 1.00 2.30 H new ATOM 0 HB2 ARG A 40 6.635 -8.663 15.226 1.00 3.17 H new ATOM 0 HB3 ARG A 40 6.179 -7.426 14.071 1.00 3.17 H new ATOM 0 HG2 ARG A 40 8.399 -8.394 13.572 1.00 3.67 H new ATOM 0 HG3 ARG A 40 8.487 -6.670 13.873 1.00 3.67 H new ATOM 0 HD2 ARG A 40 9.152 -7.176 16.258 1.00 4.46 H new ATOM 0 HD3 ARG A 40 9.185 -8.879 15.848 1.00 4.46 H new ATOM 0 HE ARG A 40 10.961 -8.283 14.132 1.00 4.84 H new ATOM 0 HH11 ARG A 40 10.387 -6.308 17.010 1.00 5.88 H new ATOM 0 HH12 ARG A 40 12.009 -5.606 16.992 1.00 5.88 H new ATOM 0 HH21 ARG A 40 13.031 -7.354 14.105 1.00 6.20 H new ATOM 0 HH22 ARG A 40 13.498 -6.196 15.355 1.00 6.20 H new ATOM 549 N ALA A 41 6.480 -4.783 14.521 1.00 1.69 N ATOM 550 CA ALA A 41 6.797 -3.468 13.968 1.00 1.44 C ATOM 551 C ALA A 41 8.273 -3.360 13.585 1.00 1.34 C ATOM 552 O ALA A 41 8.635 -3.664 12.450 1.00 2.00 O ATOM 553 CB ALA A 41 6.391 -2.353 14.933 1.00 1.63 C ATOM 0 H ALA A 41 5.791 -5.301 13.976 1.00 1.69 H new ATOM 0 HA ALA A 41 6.215 -3.347 13.054 1.00 1.44 H new ATOM 0 HB1 ALA A 41 6.638 -1.386 14.496 1.00 1.63 H new ATOM 0 HB2 ALA A 41 5.318 -2.404 15.117 1.00 1.63 H new ATOM 0 HB3 ALA A 41 6.927 -2.474 15.874 1.00 1.63 H new ATOM 559 N SER A 42 9.114 -2.979 14.550 1.00 1.46 N ATOM 560 CA SER A 42 10.518 -2.659 14.300 1.00 1.66 C ATOM 561 C SER A 42 10.612 -1.291 13.618 1.00 1.61 C ATOM 562 O SER A 42 11.410 -1.082 12.701 1.00 1.90 O ATOM 563 CB SER A 42 11.209 -3.763 13.473 1.00 1.97 C ATOM 564 OG SER A 42 12.569 -3.459 13.207 1.00 2.52 O ATOM 0 H SER A 42 8.838 -2.884 15.527 1.00 1.46 H new ATOM 0 HA SER A 42 11.048 -2.611 15.251 1.00 1.66 H new ATOM 0 HB2 SER A 42 11.148 -4.709 14.010 1.00 1.97 H new ATOM 0 HB3 SER A 42 10.677 -3.896 12.531 1.00 1.97 H new ATOM 0 HG SER A 42 12.636 -2.551 12.843 1.00 2.52 H new ATOM 570 N ASP A 43 9.794 -0.354 14.101 1.00 1.58 N ATOM 571 CA ASP A 43 9.760 1.012 13.576 1.00 1.62 C ATOM 572 C ASP A 43 10.894 1.850 14.173 1.00 2.03 C ATOM 573 O ASP A 43 10.696 2.978 14.629 1.00 2.27 O ATOM 574 CB ASP A 43 8.395 1.663 13.861 1.00 1.71 C ATOM 575 CG ASP A 43 8.072 1.762 15.341 1.00 2.08 C ATOM 576 OD1 ASP A 43 7.955 0.710 16.004 1.00 2.17 O ATOM 577 OD2 ASP A 43 7.934 2.892 15.850 1.00 2.52 O ATOM 0 H ASP A 43 9.138 -0.520 14.865 1.00 1.58 H new ATOM 0 HA ASP A 43 9.902 0.969 12.496 1.00 1.62 H new ATOM 0 HB2 ASP A 43 8.379 2.662 13.426 1.00 1.71 H new ATOM 0 HB3 ASP A 43 7.615 1.086 13.364 1.00 1.71 H new ATOM 582 N TYR A 44 12.086 1.283 14.156 1.00 2.47 N ATOM 583 CA TYR A 44 13.275 1.953 14.652 1.00 2.99 C ATOM 584 C TYR A 44 14.393 1.817 13.632 1.00 2.89 C ATOM 585 O TYR A 44 14.695 0.711 13.177 1.00 3.07 O ATOM 586 CB TYR A 44 13.706 1.364 15.999 1.00 3.71 C ATOM 587 CG TYR A 44 15.034 1.888 16.492 1.00 4.28 C ATOM 588 CD1 TYR A 44 15.165 3.202 16.922 1.00 4.67 C ATOM 589 CD2 TYR A 44 16.156 1.069 16.534 1.00 4.82 C ATOM 590 CE1 TYR A 44 16.372 3.685 17.379 1.00 5.49 C ATOM 591 CE2 TYR A 44 17.368 1.545 16.993 1.00 5.71 C ATOM 592 CZ TYR A 44 17.484 2.847 17.383 1.00 6.00 C ATOM 593 OH TYR A 44 18.675 3.333 17.873 1.00 7.02 O ATOM 0 H TYR A 44 12.258 0.344 13.798 1.00 2.47 H new ATOM 0 HA TYR A 44 13.051 3.009 14.803 1.00 2.99 H new ATOM 0 HB2 TYR A 44 12.940 1.582 16.743 1.00 3.71 H new ATOM 0 HB3 TYR A 44 13.764 0.279 15.910 1.00 3.71 H new ATOM 0 HD1 TYR A 44 14.306 3.857 16.898 1.00 4.67 H new ATOM 0 HD2 TYR A 44 16.079 0.044 16.202 1.00 4.82 H new ATOM 0 HE1 TYR A 44 16.455 4.703 17.730 1.00 5.49 H new ATOM 0 HE2 TYR A 44 18.223 0.887 17.043 1.00 5.71 H new ATOM 0 HH TYR A 44 19.362 2.636 17.814 1.00 7.02 H new ATOM 603 N GLY A 45 14.998 2.938 13.272 1.00 2.99 N ATOM 604 CA GLY A 45 16.001 2.927 12.235 1.00 3.06 C ATOM 605 C GLY A 45 15.359 2.752 10.880 1.00 2.42 C ATOM 606 O GLY A 45 15.463 1.687 10.273 1.00 2.68 O ATOM 0 H GLY A 45 14.811 3.854 13.681 1.00 2.99 H new ATOM 0 HA2 GLY A 45 16.567 3.858 12.258 1.00 3.06 H new ATOM 0 HA3 GLY A 45 16.710 2.119 12.415 1.00 3.06 H new ATOM 610 N MET A 46 14.675 3.794 10.422 1.00 1.93 N ATOM 611 CA MET A 46 13.953 3.746 9.159 1.00 1.65 C ATOM 612 C MET A 46 14.904 3.487 8.009 1.00 1.66 C ATOM 613 O MET A 46 14.571 2.755 7.081 1.00 2.25 O ATOM 614 CB MET A 46 13.170 5.036 8.926 1.00 1.79 C ATOM 615 CG MET A 46 11.942 5.151 9.811 1.00 1.56 C ATOM 616 SD MET A 46 12.337 5.448 11.548 1.00 2.17 S ATOM 617 CE MET A 46 10.696 5.460 12.269 1.00 2.35 C ATOM 0 H MET A 46 14.606 4.687 10.911 1.00 1.93 H new ATOM 0 HA MET A 46 13.241 2.922 9.210 1.00 1.65 H new ATOM 0 HB2 MET A 46 13.823 5.889 9.108 1.00 1.79 H new ATOM 0 HB3 MET A 46 12.864 5.085 7.881 1.00 1.79 H new ATOM 0 HG2 MET A 46 11.314 5.963 9.445 1.00 1.56 H new ATOM 0 HG3 MET A 46 11.358 4.234 9.730 1.00 1.56 H new ATOM 0 HE1 MET A 46 10.774 5.580 13.350 1.00 2.35 H new ATOM 0 HE2 MET A 46 10.122 6.288 11.853 1.00 2.35 H new ATOM 0 HE3 MET A 46 10.193 4.520 12.044 1.00 2.35 H new ATOM 627 N LYS A 47 16.085 4.102 8.079 1.00 1.57 N ATOM 628 CA LYS A 47 17.195 3.757 7.193 1.00 1.68 C ATOM 629 C LYS A 47 17.032 4.287 5.770 1.00 1.61 C ATOM 630 O LYS A 47 17.945 4.929 5.248 1.00 2.34 O ATOM 631 CB LYS A 47 17.378 2.237 7.215 1.00 2.02 C ATOM 632 CG LYS A 47 18.157 1.656 6.050 1.00 2.44 C ATOM 633 CD LYS A 47 18.079 0.138 6.064 1.00 3.01 C ATOM 634 CE LYS A 47 16.640 -0.344 5.931 1.00 3.44 C ATOM 635 NZ LYS A 47 16.507 -1.796 6.219 1.00 4.25 N ATOM 0 H LYS A 47 16.297 4.845 8.744 1.00 1.57 H new ATOM 0 HA LYS A 47 18.093 4.249 7.567 1.00 1.68 H new ATOM 0 HB2 LYS A 47 17.884 1.963 8.141 1.00 2.02 H new ATOM 0 HB3 LYS A 47 16.393 1.770 7.240 1.00 2.02 H new ATOM 0 HG2 LYS A 47 17.758 2.038 5.111 1.00 2.44 H new ATOM 0 HG3 LYS A 47 19.198 1.973 6.106 1.00 2.44 H new ATOM 0 HD2 LYS A 47 18.677 -0.266 5.247 1.00 3.01 H new ATOM 0 HD3 LYS A 47 18.508 -0.242 6.991 1.00 3.01 H new ATOM 0 HE2 LYS A 47 16.005 0.220 6.614 1.00 3.44 H new ATOM 0 HE3 LYS A 47 16.282 -0.141 4.922 1.00 3.44 H new ATOM 0 HZ1 LYS A 47 15.525 -2.095 6.051 1.00 4.25 H new ATOM 0 HZ2 LYS A 47 17.144 -2.333 5.596 1.00 4.25 H new ATOM 0 HZ3 LYS A 47 16.759 -1.978 7.212 1.00 4.25 H new ATOM 649 N LEU A 48 15.898 4.037 5.143 1.00 1.41 N ATOM 650 CA LEU A 48 15.679 4.501 3.780 1.00 1.31 C ATOM 651 C LEU A 48 14.538 5.503 3.727 1.00 1.01 C ATOM 652 O LEU A 48 13.445 5.181 3.271 1.00 1.02 O ATOM 653 CB LEU A 48 15.378 3.319 2.861 1.00 1.59 C ATOM 654 CG LEU A 48 15.376 3.635 1.361 1.00 2.10 C ATOM 655 CD1 LEU A 48 16.760 4.065 0.899 1.00 2.56 C ATOM 656 CD2 LEU A 48 14.898 2.434 0.562 1.00 2.55 C ATOM 0 H LEU A 48 15.118 3.520 5.549 1.00 1.41 H new ATOM 0 HA LEU A 48 16.589 4.995 3.439 1.00 1.31 H new ATOM 0 HB2 LEU A 48 16.114 2.538 3.049 1.00 1.59 H new ATOM 0 HB3 LEU A 48 14.404 2.910 3.130 1.00 1.59 H new ATOM 0 HG LEU A 48 14.686 4.461 1.189 1.00 2.10 H new ATOM 0 HD11 LEU A 48 16.735 4.284 -0.168 1.00 2.56 H new ATOM 0 HD12 LEU A 48 17.065 4.957 1.446 1.00 2.56 H new ATOM 0 HD13 LEU A 48 17.472 3.262 1.088 1.00 2.56 H new ATOM 0 HD21 LEU A 48 14.904 2.678 -0.500 1.00 2.55 H new ATOM 0 HD22 LEU A 48 15.562 1.589 0.744 1.00 2.55 H new ATOM 0 HD23 LEU A 48 13.885 2.173 0.869 1.00 2.55 H new ATOM 668 N PRO A 49 14.770 6.734 4.199 1.00 1.03 N ATOM 669 CA PRO A 49 13.745 7.775 4.189 1.00 1.05 C ATOM 670 C PRO A 49 13.169 8.022 2.793 1.00 0.81 C ATOM 671 O PRO A 49 13.906 8.261 1.834 1.00 0.91 O ATOM 672 CB PRO A 49 14.484 9.016 4.700 1.00 1.47 C ATOM 673 CG PRO A 49 15.628 8.477 5.485 1.00 1.69 C ATOM 674 CD PRO A 49 16.034 7.209 4.792 1.00 1.37 C ATOM 0 HA PRO A 49 12.884 7.499 4.798 1.00 1.05 H new ATOM 0 HB2 PRO A 49 14.828 9.640 3.875 1.00 1.47 H new ATOM 0 HB3 PRO A 49 13.836 9.636 5.319 1.00 1.47 H new ATOM 0 HG2 PRO A 49 16.453 9.189 5.514 1.00 1.69 H new ATOM 0 HG3 PRO A 49 15.338 8.283 6.518 1.00 1.69 H new ATOM 0 HD2 PRO A 49 16.793 7.390 4.031 1.00 1.37 H new ATOM 0 HD3 PRO A 49 16.450 6.483 5.491 1.00 1.37 H new ATOM 682 N ILE A 50 11.846 7.940 2.688 1.00 0.66 N ATOM 683 CA ILE A 50 11.149 8.182 1.434 1.00 0.48 C ATOM 684 C ILE A 50 11.104 9.683 1.131 1.00 0.70 C ATOM 685 O ILE A 50 10.470 10.465 1.837 1.00 1.59 O ATOM 686 CB ILE A 50 9.724 7.552 1.458 1.00 0.38 C ATOM 687 CG1 ILE A 50 9.748 6.150 0.854 1.00 0.42 C ATOM 688 CG2 ILE A 50 8.716 8.388 0.699 1.00 0.42 C ATOM 689 CD1 ILE A 50 10.734 5.206 1.493 1.00 0.51 C ATOM 0 H ILE A 50 11.231 7.705 3.467 1.00 0.66 H new ATOM 0 HA ILE A 50 11.700 7.697 0.628 1.00 0.48 H new ATOM 0 HB ILE A 50 9.421 7.508 2.504 1.00 0.38 H new ATOM 0 HG12 ILE A 50 8.750 5.719 0.932 1.00 0.42 H new ATOM 0 HG13 ILE A 50 9.979 6.231 -0.208 1.00 0.42 H new ATOM 0 HG21 ILE A 50 7.738 7.909 0.744 1.00 0.42 H new ATOM 0 HG22 ILE A 50 8.655 9.380 1.147 1.00 0.42 H new ATOM 0 HG23 ILE A 50 9.028 8.479 -0.341 1.00 0.42 H new ATOM 0 HD11 ILE A 50 10.681 4.236 1.000 1.00 0.51 H new ATOM 0 HD12 ILE A 50 11.742 5.609 1.392 1.00 0.51 H new ATOM 0 HD13 ILE A 50 10.494 5.089 2.550 1.00 0.51 H new ATOM 701 N LEU A 51 11.786 10.068 0.059 1.00 0.60 N ATOM 702 CA LEU A 51 11.995 11.478 -0.271 1.00 0.60 C ATOM 703 C LEU A 51 10.743 12.144 -0.833 1.00 0.62 C ATOM 704 O LEU A 51 10.749 13.337 -1.121 1.00 0.90 O ATOM 705 CB LEU A 51 13.127 11.625 -1.296 1.00 0.66 C ATOM 706 CG LEU A 51 14.547 11.294 -0.812 1.00 0.92 C ATOM 707 CD1 LEU A 51 14.805 11.878 0.568 1.00 1.51 C ATOM 708 CD2 LEU A 51 14.798 9.792 -0.823 1.00 1.91 C ATOM 0 H LEU A 51 12.209 9.418 -0.604 1.00 0.60 H new ATOM 0 HA LEU A 51 12.255 11.975 0.664 1.00 0.60 H new ATOM 0 HB2 LEU A 51 12.900 10.983 -2.147 1.00 0.66 H new ATOM 0 HB3 LEU A 51 13.123 12.652 -1.661 1.00 0.66 H new ATOM 0 HG LEU A 51 15.248 11.754 -1.508 1.00 0.92 H new ATOM 0 HD11 LEU A 51 15.817 11.628 0.885 1.00 1.51 H new ATOM 0 HD12 LEU A 51 14.693 12.962 0.531 1.00 1.51 H new ATOM 0 HD13 LEU A 51 14.089 11.463 1.278 1.00 1.51 H new ATOM 0 HD21 LEU A 51 15.811 9.590 -0.475 1.00 1.91 H new ATOM 0 HD22 LEU A 51 14.083 9.299 -0.164 1.00 1.91 H new ATOM 0 HD23 LEU A 51 14.680 9.411 -1.837 1.00 1.91 H new ATOM 720 N ARG A 52 9.677 11.382 -1.004 1.00 0.56 N ATOM 721 CA ARG A 52 8.473 11.911 -1.635 1.00 0.60 C ATOM 722 C ARG A 52 7.320 11.994 -0.639 1.00 0.59 C ATOM 723 O ARG A 52 6.154 11.977 -1.030 1.00 0.83 O ATOM 724 CB ARG A 52 8.070 11.035 -2.825 1.00 0.70 C ATOM 725 CG ARG A 52 9.228 10.686 -3.748 1.00 0.93 C ATOM 726 CD ARG A 52 9.829 11.914 -4.413 1.00 1.14 C ATOM 727 NE ARG A 52 9.057 12.348 -5.572 1.00 1.80 N ATOM 728 CZ ARG A 52 9.572 12.469 -6.797 1.00 2.47 C ATOM 729 NH1 ARG A 52 10.855 12.194 -7.007 1.00 2.72 N ATOM 730 NH2 ARG A 52 8.811 12.862 -7.806 1.00 3.17 N ATOM 0 H ARG A 52 9.616 10.404 -0.719 1.00 0.56 H new ATOM 0 HA ARG A 52 8.694 12.918 -1.988 1.00 0.60 H new ATOM 0 HB2 ARG A 52 7.624 10.113 -2.452 1.00 0.70 H new ATOM 0 HB3 ARG A 52 7.301 11.551 -3.400 1.00 0.70 H new ATOM 0 HG2 ARG A 52 10.001 10.170 -3.178 1.00 0.93 H new ATOM 0 HG3 ARG A 52 8.882 9.993 -4.515 1.00 0.93 H new ATOM 0 HD2 ARG A 52 9.882 12.727 -3.689 1.00 1.14 H new ATOM 0 HD3 ARG A 52 10.851 11.694 -4.721 1.00 1.14 H new ATOM 0 HE ARG A 52 8.071 12.571 -5.439 1.00 1.80 H new ATOM 0 HH11 ARG A 52 11.445 11.891 -6.232 1.00 2.72 H new ATOM 0 HH12 ARG A 52 11.250 12.286 -7.943 1.00 2.72 H new ATOM 0 HH21 ARG A 52 7.826 13.074 -7.649 1.00 3.17 H new ATOM 0 HH22 ARG A 52 9.210 12.953 -8.740 1.00 3.17 H new ATOM 744 N SER A 53 7.644 12.062 0.647 1.00 0.49 N ATOM 745 CA SER A 53 6.614 12.166 1.675 1.00 0.47 C ATOM 746 C SER A 53 7.034 13.081 2.830 1.00 0.46 C ATOM 747 O SER A 53 8.222 13.326 3.056 1.00 0.54 O ATOM 748 CB SER A 53 6.282 10.777 2.219 1.00 0.47 C ATOM 749 OG SER A 53 5.205 10.832 3.138 1.00 0.97 O ATOM 0 H SER A 53 8.601 12.047 1.001 1.00 0.49 H new ATOM 0 HA SER A 53 5.734 12.608 1.208 1.00 0.47 H new ATOM 0 HB2 SER A 53 6.026 10.112 1.394 1.00 0.47 H new ATOM 0 HB3 SER A 53 7.160 10.355 2.708 1.00 0.47 H new ATOM 0 HG SER A 53 4.430 10.366 2.761 1.00 0.97 H new ATOM 755 N ASN A 54 6.027 13.591 3.539 1.00 0.46 N ATOM 756 CA ASN A 54 6.207 14.356 4.776 1.00 0.48 C ATOM 757 C ASN A 54 6.830 13.455 5.839 1.00 0.44 C ATOM 758 O ASN A 54 6.309 12.387 6.081 1.00 0.42 O ATOM 759 CB ASN A 54 4.830 14.845 5.251 1.00 0.60 C ATOM 760 CG ASN A 54 4.853 15.522 6.608 1.00 0.92 C ATOM 761 OD1 ASN A 54 5.766 16.277 6.931 1.00 1.92 O ATOM 762 ND2 ASN A 54 3.854 15.226 7.427 1.00 0.75 N ATOM 0 H ASN A 54 5.050 13.484 3.268 1.00 0.46 H new ATOM 0 HA ASN A 54 6.863 15.209 4.603 1.00 0.48 H new ATOM 0 HB2 ASN A 54 4.429 15.542 4.515 1.00 0.60 H new ATOM 0 HB3 ASN A 54 4.148 13.996 5.291 1.00 0.60 H new ATOM 0 HD21 ASN A 54 3.825 15.630 8.363 1.00 0.75 H new ATOM 0 HD22 ASN A 54 3.114 14.594 7.121 1.00 0.75 H new ATOM 769 N PRO A 55 7.923 13.883 6.507 1.00 0.47 N ATOM 770 CA PRO A 55 8.730 13.035 7.409 1.00 0.49 C ATOM 771 C PRO A 55 7.919 12.080 8.306 1.00 0.45 C ATOM 772 O PRO A 55 8.252 10.896 8.420 1.00 0.46 O ATOM 773 CB PRO A 55 9.494 14.052 8.273 1.00 0.57 C ATOM 774 CG PRO A 55 9.073 15.412 7.801 1.00 0.70 C ATOM 775 CD PRO A 55 8.490 15.230 6.430 1.00 0.53 C ATOM 0 HA PRO A 55 9.359 12.362 6.826 1.00 0.49 H new ATOM 0 HB2 PRO A 55 9.259 13.918 9.329 1.00 0.57 H new ATOM 0 HB3 PRO A 55 10.571 13.920 8.166 1.00 0.57 H new ATOM 0 HG2 PRO A 55 8.339 15.847 8.479 1.00 0.70 H new ATOM 0 HG3 PRO A 55 9.924 16.093 7.773 1.00 0.70 H new ATOM 0 HD2 PRO A 55 7.730 15.979 6.209 1.00 0.53 H new ATOM 0 HD3 PRO A 55 9.249 15.307 5.652 1.00 0.53 H new ATOM 783 N GLU A 56 6.845 12.578 8.912 1.00 0.47 N ATOM 784 CA GLU A 56 6.014 11.758 9.793 1.00 0.49 C ATOM 785 C GLU A 56 5.370 10.643 8.986 1.00 0.40 C ATOM 786 O GLU A 56 5.450 9.447 9.299 1.00 0.39 O ATOM 787 CB GLU A 56 4.895 12.603 10.402 1.00 0.62 C ATOM 788 CG GLU A 56 5.329 13.953 10.933 1.00 0.78 C ATOM 789 CD GLU A 56 6.299 13.842 12.087 1.00 1.73 C ATOM 790 OE1 GLU A 56 5.961 13.177 13.090 1.00 2.02 O ATOM 791 OE2 GLU A 56 7.402 14.413 11.995 1.00 2.71 O ATOM 0 H GLU A 56 6.529 13.542 8.811 1.00 0.47 H new ATOM 0 HA GLU A 56 6.645 11.350 10.583 1.00 0.49 H new ATOM 0 HB2 GLU A 56 4.124 12.757 9.647 1.00 0.62 H new ATOM 0 HB3 GLU A 56 4.436 12.040 11.215 1.00 0.62 H new ATOM 0 HG2 GLU A 56 5.792 14.524 10.128 1.00 0.78 H new ATOM 0 HG3 GLU A 56 4.450 14.512 11.255 1.00 0.78 H new ATOM 798 N ASP A 57 4.747 11.072 7.919 1.00 0.40 N ATOM 799 CA ASP A 57 3.975 10.208 7.066 1.00 0.38 C ATOM 800 C ASP A 57 4.900 9.488 6.095 1.00 0.35 C ATOM 801 O ASP A 57 4.487 8.616 5.353 1.00 0.38 O ATOM 802 CB ASP A 57 2.931 11.054 6.348 1.00 0.47 C ATOM 803 CG ASP A 57 2.159 11.920 7.324 1.00 0.92 C ATOM 804 OD1 ASP A 57 1.675 11.383 8.346 1.00 1.63 O ATOM 805 OD2 ASP A 57 2.071 13.145 7.104 1.00 1.36 O ATOM 0 H ASP A 57 4.762 12.045 7.614 1.00 0.40 H new ATOM 0 HA ASP A 57 3.460 9.442 7.645 1.00 0.38 H new ATOM 0 HB2 ASP A 57 3.419 11.685 5.606 1.00 0.47 H new ATOM 0 HB3 ASP A 57 2.241 10.404 5.810 1.00 0.47 H new ATOM 810 N GLN A 58 6.161 9.883 6.117 1.00 0.34 N ATOM 811 CA GLN A 58 7.224 9.175 5.433 1.00 0.36 C ATOM 812 C GLN A 58 7.420 7.834 6.114 1.00 0.34 C ATOM 813 O GLN A 58 7.598 6.808 5.461 1.00 0.35 O ATOM 814 CB GLN A 58 8.504 10.010 5.491 1.00 0.42 C ATOM 815 CG GLN A 58 9.737 9.318 4.948 1.00 0.51 C ATOM 816 CD GLN A 58 10.999 10.110 5.222 1.00 0.89 C ATOM 817 OE1 GLN A 58 11.616 9.858 6.361 1.00 1.52 O flip ATOM 818 NE2 GLN A 58 11.414 10.943 4.423 1.00 1.58 N flip ATOM 0 H GLN A 58 6.477 10.714 6.617 1.00 0.34 H new ATOM 0 HA GLN A 58 6.970 9.011 4.386 1.00 0.36 H new ATOM 0 HB2 GLN A 58 8.346 10.932 4.932 1.00 0.42 H new ATOM 0 HB3 GLN A 58 8.690 10.294 6.527 1.00 0.42 H new ATOM 0 HG2 GLN A 58 9.825 8.329 5.397 1.00 0.51 H new ATOM 0 HG3 GLN A 58 9.627 9.171 3.874 1.00 0.51 H new ATOM 0 HE21 GLN A 58 10.910 11.110 3.552 1.00 1.58 H new ATOM 0 HE22 GLN A 58 12.264 11.468 4.629 1.00 1.58 H new ATOM 827 N VAL A 59 7.368 7.858 7.440 1.00 0.35 N ATOM 828 CA VAL A 59 7.336 6.628 8.220 1.00 0.37 C ATOM 829 C VAL A 59 6.137 5.806 7.798 1.00 0.32 C ATOM 830 O VAL A 59 6.264 4.631 7.475 1.00 0.37 O ATOM 831 CB VAL A 59 7.228 6.902 9.732 1.00 0.45 C ATOM 832 CG1 VAL A 59 7.261 5.608 10.533 1.00 1.08 C ATOM 833 CG2 VAL A 59 8.323 7.839 10.186 1.00 1.27 C ATOM 0 H VAL A 59 7.347 8.713 7.996 1.00 0.35 H new ATOM 0 HA VAL A 59 8.269 6.096 8.034 1.00 0.37 H new ATOM 0 HB VAL A 59 6.267 7.382 9.914 1.00 0.45 H new ATOM 0 HG11 VAL A 59 7.183 5.836 11.596 1.00 1.08 H new ATOM 0 HG12 VAL A 59 6.425 4.974 10.235 1.00 1.08 H new ATOM 0 HG13 VAL A 59 8.198 5.086 10.342 1.00 1.08 H new ATOM 0 HG21 VAL A 59 8.227 8.019 11.257 1.00 1.27 H new ATOM 0 HG22 VAL A 59 9.295 7.391 9.979 1.00 1.27 H new ATOM 0 HG23 VAL A 59 8.238 8.785 9.651 1.00 1.27 H new ATOM 843 N LEU A 60 4.976 6.457 7.774 1.00 0.30 N ATOM 844 CA LEU A 60 3.738 5.804 7.366 1.00 0.31 C ATOM 845 C LEU A 60 3.890 5.198 5.966 1.00 0.33 C ATOM 846 O LEU A 60 3.343 4.147 5.662 1.00 0.41 O ATOM 847 CB LEU A 60 2.591 6.829 7.368 1.00 0.34 C ATOM 848 CG LEU A 60 1.187 6.285 7.675 1.00 0.56 C ATOM 849 CD1 LEU A 60 0.131 7.316 7.366 1.00 1.12 C ATOM 850 CD2 LEU A 60 0.902 5.038 6.897 1.00 1.18 C ATOM 0 H LEU A 60 4.869 7.438 8.033 1.00 0.30 H new ATOM 0 HA LEU A 60 3.512 5.003 8.070 1.00 0.31 H new ATOM 0 HB2 LEU A 60 2.825 7.602 8.100 1.00 0.34 H new ATOM 0 HB3 LEU A 60 2.564 7.313 6.392 1.00 0.34 H new ATOM 0 HG LEU A 60 1.161 6.049 8.739 1.00 0.56 H new ATOM 0 HD11 LEU A 60 -0.854 6.907 7.592 1.00 1.12 H new ATOM 0 HD12 LEU A 60 0.302 8.205 7.973 1.00 1.12 H new ATOM 0 HD13 LEU A 60 0.180 7.582 6.310 1.00 1.12 H new ATOM 0 HD21 LEU A 60 -0.099 4.680 7.138 1.00 1.18 H new ATOM 0 HD22 LEU A 60 0.964 5.253 5.830 1.00 1.18 H new ATOM 0 HD23 LEU A 60 1.633 4.272 7.156 1.00 1.18 H new ATOM 862 N TYR A 61 4.652 5.864 5.132 1.00 0.35 N ATOM 863 CA TYR A 61 4.783 5.472 3.737 1.00 0.40 C ATOM 864 C TYR A 61 5.999 4.578 3.526 1.00 0.45 C ATOM 865 O TYR A 61 6.296 4.181 2.399 1.00 0.56 O ATOM 866 CB TYR A 61 4.865 6.700 2.823 1.00 0.42 C ATOM 867 CG TYR A 61 3.585 7.518 2.752 1.00 0.47 C ATOM 868 CD1 TYR A 61 2.477 7.158 3.507 1.00 0.59 C ATOM 869 CD2 TYR A 61 3.479 8.635 1.927 1.00 0.82 C ATOM 870 CE1 TYR A 61 1.299 7.879 3.440 1.00 0.64 C ATOM 871 CE2 TYR A 61 2.306 9.363 1.857 1.00 0.99 C ATOM 872 CZ TYR A 61 1.264 9.051 2.629 1.00 0.78 C ATOM 873 OH TYR A 61 0.045 9.693 2.542 1.00 0.96 O ATOM 0 H TYR A 61 5.197 6.686 5.391 1.00 0.35 H new ATOM 0 HA TYR A 61 3.890 4.905 3.474 1.00 0.40 H new ATOM 0 HB2 TYR A 61 5.674 7.343 3.171 1.00 0.42 H new ATOM 0 HB3 TYR A 61 5.128 6.372 1.817 1.00 0.42 H new ATOM 0 HD1 TYR A 61 2.536 6.299 4.159 1.00 0.59 H new ATOM 0 HD2 TYR A 61 4.328 8.938 1.332 1.00 0.82 H new ATOM 0 HE1 TYR A 61 0.425 7.561 3.990 1.00 0.64 H new ATOM 0 HE2 TYR A 61 2.232 10.193 1.170 1.00 0.99 H new ATOM 0 HH TYR A 61 -0.101 10.229 3.350 1.00 0.96 H new ATOM 883 N GLN A 62 6.708 4.277 4.605 1.00 0.43 N ATOM 884 CA GLN A 62 7.860 3.393 4.528 1.00 0.58 C ATOM 885 C GLN A 62 7.768 2.263 5.559 1.00 0.73 C ATOM 886 O GLN A 62 6.907 1.406 5.447 1.00 1.49 O ATOM 887 CB GLN A 62 9.151 4.179 4.733 1.00 0.63 C ATOM 888 CG GLN A 62 10.397 3.402 4.340 1.00 0.99 C ATOM 889 CD GLN A 62 11.602 3.775 5.174 1.00 1.18 C ATOM 890 OE1 GLN A 62 11.614 4.993 5.693 1.00 1.97 O flip ATOM 891 NE2 GLN A 62 12.501 2.969 5.369 1.00 1.13 N flip ATOM 0 H GLN A 62 6.506 4.631 5.540 1.00 0.43 H new ATOM 0 HA GLN A 62 7.867 2.947 3.533 1.00 0.58 H new ATOM 0 HB2 GLN A 62 9.105 5.098 4.149 1.00 0.63 H new ATOM 0 HB3 GLN A 62 9.228 4.470 5.780 1.00 0.63 H new ATOM 0 HG2 GLN A 62 10.203 2.335 4.445 1.00 0.99 H new ATOM 0 HG3 GLN A 62 10.617 3.584 3.288 1.00 0.99 H new ATOM 0 HE21 GLN A 62 12.453 2.040 4.950 1.00 1.13 H new ATOM 0 HE22 GLN A 62 13.299 3.226 5.950 1.00 1.13 H new ATOM 900 N THR A 63 8.642 2.330 6.574 1.00 0.44 N ATOM 901 CA THR A 63 8.850 1.283 7.593 1.00 0.48 C ATOM 902 C THR A 63 8.572 -0.157 7.102 1.00 0.61 C ATOM 903 O THR A 63 7.427 -0.556 6.928 1.00 1.27 O ATOM 904 CB THR A 63 8.022 1.595 8.847 1.00 0.50 C ATOM 905 OG1 THR A 63 7.804 3.008 8.926 1.00 0.89 O ATOM 906 CG2 THR A 63 8.756 1.141 10.096 1.00 0.89 C ATOM 0 H THR A 63 9.245 3.140 6.715 1.00 0.44 H new ATOM 0 HA THR A 63 9.914 1.306 7.829 1.00 0.48 H new ATOM 0 HB THR A 63 7.071 1.066 8.781 1.00 0.50 H new ATOM 0 HG1 THR A 63 7.089 3.264 8.307 1.00 0.89 H new ATOM 0 HG21 THR A 63 8.154 1.370 10.975 1.00 0.89 H new ATOM 0 HG22 THR A 63 8.930 0.066 10.045 1.00 0.89 H new ATOM 0 HG23 THR A 63 9.712 1.660 10.165 1.00 0.89 H new ATOM 914 N GLU A 64 9.638 -0.944 6.933 1.00 0.53 N ATOM 915 CA GLU A 64 9.540 -2.292 6.346 1.00 0.53 C ATOM 916 C GLU A 64 9.077 -3.352 7.352 1.00 0.58 C ATOM 917 O GLU A 64 9.534 -3.387 8.493 1.00 0.99 O ATOM 918 CB GLU A 64 10.900 -2.718 5.768 1.00 0.67 C ATOM 919 CG GLU A 64 12.053 -2.647 6.770 1.00 1.00 C ATOM 920 CD GLU A 64 13.335 -3.290 6.262 1.00 1.42 C ATOM 921 OE1 GLU A 64 14.055 -2.647 5.468 1.00 1.96 O ATOM 922 OE2 GLU A 64 13.623 -4.446 6.639 1.00 1.78 O ATOM 0 H GLU A 64 10.586 -0.673 7.195 1.00 0.53 H new ATOM 0 HA GLU A 64 8.788 -2.230 5.559 1.00 0.53 H new ATOM 0 HB2 GLU A 64 10.820 -3.739 5.394 1.00 0.67 H new ATOM 0 HB3 GLU A 64 11.135 -2.083 4.914 1.00 0.67 H new ATOM 0 HG2 GLU A 64 12.250 -1.603 7.012 1.00 1.00 H new ATOM 0 HG3 GLU A 64 11.751 -3.137 7.695 1.00 1.00 H new ATOM 929 N ARG A 65 8.164 -4.219 6.910 1.00 0.85 N ATOM 930 CA ARG A 65 7.779 -5.396 7.685 1.00 0.96 C ATOM 931 C ARG A 65 8.237 -6.661 6.974 1.00 1.17 C ATOM 932 O ARG A 65 7.427 -7.382 6.385 1.00 2.02 O ATOM 933 CB ARG A 65 6.265 -5.476 7.893 1.00 0.96 C ATOM 934 CG ARG A 65 5.860 -5.763 9.332 1.00 1.17 C ATOM 935 CD ARG A 65 4.741 -6.794 9.414 1.00 1.09 C ATOM 936 NE ARG A 65 5.243 -8.154 9.258 1.00 1.70 N ATOM 937 CZ ARG A 65 5.477 -8.967 10.287 1.00 2.50 C ATOM 938 NH1 ARG A 65 5.274 -8.547 11.530 1.00 2.93 N ATOM 939 NH2 ARG A 65 5.925 -10.196 10.080 1.00 3.35 N ATOM 0 H ARG A 65 7.678 -4.126 6.018 1.00 0.85 H new ATOM 0 HA ARG A 65 8.259 -5.308 8.659 1.00 0.96 H new ATOM 0 HB2 ARG A 65 5.814 -4.535 7.579 1.00 0.96 H new ATOM 0 HB3 ARG A 65 5.859 -6.255 7.248 1.00 0.96 H new ATOM 0 HG2 ARG A 65 6.726 -6.123 9.888 1.00 1.17 H new ATOM 0 HG3 ARG A 65 5.537 -4.838 9.809 1.00 1.17 H new ATOM 0 HD2 ARG A 65 4.233 -6.702 10.374 1.00 1.09 H new ATOM 0 HD3 ARG A 65 4.001 -6.589 8.640 1.00 1.09 H new ATOM 0 HE ARG A 65 5.424 -8.500 8.315 1.00 1.70 H new ATOM 0 HH11 ARG A 65 4.938 -7.599 11.700 1.00 2.93 H new ATOM 0 HH12 ARG A 65 5.454 -9.172 12.315 1.00 2.93 H new ATOM 0 HH21 ARG A 65 6.093 -10.524 9.129 1.00 3.35 H new ATOM 0 HH22 ARG A 65 6.102 -10.814 10.872 1.00 3.35 H new ATOM 953 N TYR A 66 9.538 -6.910 7.022 1.00 1.04 N ATOM 954 CA TYR A 66 10.136 -8.110 6.438 1.00 1.21 C ATOM 955 C TYR A 66 9.400 -9.371 6.893 1.00 1.23 C ATOM 956 O TYR A 66 9.086 -9.528 8.074 1.00 1.84 O ATOM 957 CB TYR A 66 11.621 -8.183 6.819 1.00 1.67 C ATOM 958 CG TYR A 66 11.890 -7.835 8.266 1.00 2.01 C ATOM 959 CD1 TYR A 66 12.123 -6.523 8.658 1.00 2.29 C ATOM 960 CD2 TYR A 66 11.924 -8.826 9.238 1.00 2.73 C ATOM 961 CE1 TYR A 66 12.381 -6.211 9.978 1.00 3.11 C ATOM 962 CE2 TYR A 66 12.186 -8.523 10.556 1.00 3.58 C ATOM 963 CZ TYR A 66 12.354 -7.176 10.922 1.00 3.72 C ATOM 964 OH TYR A 66 12.682 -6.917 12.234 1.00 4.71 O ATOM 0 H TYR A 66 10.212 -6.287 7.467 1.00 1.04 H new ATOM 0 HA TYR A 66 10.047 -8.051 5.353 1.00 1.21 H new ATOM 0 HB2 TYR A 66 11.990 -9.189 6.621 1.00 1.67 H new ATOM 0 HB3 TYR A 66 12.186 -7.505 6.179 1.00 1.67 H new ATOM 0 HD1 TYR A 66 12.102 -5.735 7.919 1.00 2.29 H new ATOM 0 HD2 TYR A 66 11.742 -9.852 8.956 1.00 2.73 H new ATOM 0 HE1 TYR A 66 12.605 -5.192 10.256 1.00 3.11 H new ATOM 0 HE2 TYR A 66 12.261 -9.307 11.295 1.00 3.58 H new ATOM 0 HH TYR A 66 12.456 -5.988 12.450 1.00 4.71 H new ATOM 974 N ASN A 67 9.108 -10.258 5.951 1.00 1.36 N ATOM 975 CA ASN A 67 8.359 -11.466 6.269 1.00 1.73 C ATOM 976 C ASN A 67 9.012 -12.691 5.641 1.00 1.33 C ATOM 977 O ASN A 67 9.824 -13.357 6.285 1.00 1.73 O ATOM 978 CB ASN A 67 6.905 -11.334 5.802 1.00 2.80 C ATOM 979 CG ASN A 67 5.992 -12.364 6.438 1.00 3.74 C ATOM 980 OD1 ASN A 67 5.469 -12.146 7.528 1.00 4.33 O ATOM 981 ND2 ASN A 67 5.776 -13.483 5.758 1.00 4.38 N ATOM 0 H ASN A 67 9.375 -10.166 4.971 1.00 1.36 H new ATOM 0 HA ASN A 67 8.366 -11.595 7.351 1.00 1.73 H new ATOM 0 HB2 ASN A 67 6.540 -10.335 6.040 1.00 2.80 H new ATOM 0 HB3 ASN A 67 6.865 -11.438 4.718 1.00 2.80 H new ATOM 0 HD21 ASN A 67 5.157 -14.199 6.138 1.00 4.38 H new ATOM 0 HD22 ASN A 67 6.229 -13.627 4.856 1.00 4.38 H new ATOM 988 N GLU A 68 8.676 -12.969 4.376 1.00 1.25 N ATOM 989 CA GLU A 68 9.229 -14.118 3.658 1.00 1.47 C ATOM 990 C GLU A 68 8.643 -14.199 2.247 1.00 1.24 C ATOM 991 O GLU A 68 9.314 -13.888 1.266 1.00 1.43 O ATOM 992 CB GLU A 68 8.939 -15.423 4.411 1.00 2.17 C ATOM 993 CG GLU A 68 9.781 -16.602 3.949 1.00 2.67 C ATOM 994 CD GLU A 68 11.261 -16.395 4.206 1.00 3.24 C ATOM 995 OE1 GLU A 68 11.951 -15.838 3.329 1.00 3.64 O ATOM 996 OE2 GLU A 68 11.741 -16.785 5.287 1.00 3.70 O ATOM 0 H GLU A 68 8.021 -12.410 3.829 1.00 1.25 H new ATOM 0 HA GLU A 68 10.309 -13.984 3.591 1.00 1.47 H new ATOM 0 HB2 GLU A 68 9.110 -15.262 5.475 1.00 2.17 H new ATOM 0 HB3 GLU A 68 7.885 -15.673 4.292 1.00 2.17 H new ATOM 0 HG2 GLU A 68 9.449 -17.505 4.462 1.00 2.67 H new ATOM 0 HG3 GLU A 68 9.620 -16.764 2.883 1.00 2.67 H new ATOM 1003 N ASP A 69 7.377 -14.596 2.164 1.00 1.13 N ATOM 1004 CA ASP A 69 6.680 -14.754 0.888 1.00 0.98 C ATOM 1005 C ASP A 69 5.185 -14.887 1.141 1.00 0.97 C ATOM 1006 O ASP A 69 4.784 -15.275 2.240 1.00 1.66 O ATOM 1007 CB ASP A 69 7.210 -15.986 0.139 1.00 1.44 C ATOM 1008 CG ASP A 69 6.427 -16.312 -1.125 1.00 1.51 C ATOM 1009 OD1 ASP A 69 5.976 -15.374 -1.817 1.00 2.20 O ATOM 1010 OD2 ASP A 69 6.284 -17.510 -1.440 1.00 1.63 O ATOM 0 H ASP A 69 6.804 -14.818 2.978 1.00 1.13 H new ATOM 0 HA ASP A 69 6.861 -13.876 0.268 1.00 0.98 H new ATOM 0 HB2 ASP A 69 8.255 -15.820 -0.123 1.00 1.44 H new ATOM 0 HB3 ASP A 69 7.182 -16.847 0.807 1.00 1.44 H new ATOM 1015 N SER A 70 4.380 -14.548 0.132 1.00 0.78 N ATOM 1016 CA SER A 70 2.926 -14.624 0.216 1.00 0.76 C ATOM 1017 C SER A 70 2.422 -13.941 1.482 1.00 0.82 C ATOM 1018 O SER A 70 1.861 -14.582 2.375 1.00 1.01 O ATOM 1019 CB SER A 70 2.468 -16.091 0.168 1.00 0.96 C ATOM 1020 OG SER A 70 1.051 -16.197 0.141 1.00 1.41 O ATOM 0 H SER A 70 4.723 -14.212 -0.768 1.00 0.78 H new ATOM 0 HA SER A 70 2.501 -14.100 -0.640 1.00 0.76 H new ATOM 0 HB2 SER A 70 2.886 -16.574 -0.715 1.00 0.96 H new ATOM 0 HB3 SER A 70 2.857 -16.622 1.037 1.00 0.96 H new ATOM 0 HG SER A 70 0.794 -17.142 0.109 1.00 1.41 H new ATOM 1026 N PHE A 71 2.616 -12.636 1.559 1.00 0.78 N ATOM 1027 CA PHE A 71 2.230 -11.899 2.744 1.00 0.94 C ATOM 1028 C PHE A 71 1.339 -10.734 2.358 1.00 0.58 C ATOM 1029 O PHE A 71 1.561 -10.083 1.338 1.00 0.79 O ATOM 1030 CB PHE A 71 3.467 -11.482 3.576 1.00 1.57 C ATOM 1031 CG PHE A 71 4.473 -10.548 2.934 1.00 1.10 C ATOM 1032 CD1 PHE A 71 5.134 -10.930 1.774 1.00 1.38 C ATOM 1033 CD2 PHE A 71 4.712 -9.278 3.443 1.00 1.10 C ATOM 1034 CE1 PHE A 71 6.011 -10.068 1.138 1.00 1.18 C ATOM 1035 CE2 PHE A 71 5.598 -8.420 2.811 1.00 1.29 C ATOM 1036 CZ PHE A 71 6.402 -8.854 1.851 1.00 1.02 C ATOM 0 H PHE A 71 3.035 -12.071 0.820 1.00 0.78 H new ATOM 0 HA PHE A 71 1.645 -12.545 3.399 1.00 0.94 H new ATOM 0 HB2 PHE A 71 3.110 -11.010 4.492 1.00 1.57 H new ATOM 0 HB3 PHE A 71 3.994 -12.390 3.869 1.00 1.57 H new ATOM 0 HD1 PHE A 71 4.961 -11.913 1.362 1.00 1.38 H new ATOM 0 HD2 PHE A 71 4.203 -8.956 4.339 1.00 1.10 H new ATOM 0 HE1 PHE A 71 6.392 -10.285 0.151 1.00 1.18 H new ATOM 0 HE2 PHE A 71 5.634 -7.382 3.105 1.00 1.29 H new ATOM 0 HZ PHE A 71 7.313 -8.329 1.605 1.00 1.02 H new ATOM 1046 N GLY A 72 0.284 -10.525 3.134 1.00 0.46 N ATOM 1047 CA GLY A 72 -0.692 -9.519 2.792 1.00 0.78 C ATOM 1048 C GLY A 72 -1.657 -9.226 3.923 1.00 0.58 C ATOM 1049 O GLY A 72 -1.324 -9.413 5.089 1.00 0.74 O ATOM 0 H GLY A 72 0.090 -11.037 3.995 1.00 0.46 H new ATOM 0 HA2 GLY A 72 -0.177 -8.600 2.513 1.00 0.78 H new ATOM 0 HA3 GLY A 72 -1.254 -9.847 1.917 1.00 0.78 H new ATOM 1053 N TYR A 73 -2.858 -8.779 3.570 1.00 0.39 N ATOM 1054 CA TYR A 73 -3.834 -8.290 4.551 1.00 0.36 C ATOM 1055 C TYR A 73 -5.257 -8.659 4.157 1.00 0.34 C ATOM 1056 O TYR A 73 -5.521 -9.069 3.021 1.00 0.43 O ATOM 1057 CB TYR A 73 -3.782 -6.764 4.645 1.00 0.51 C ATOM 1058 CG TYR A 73 -2.404 -6.180 4.509 1.00 0.58 C ATOM 1059 CD1 TYR A 73 -1.868 -5.942 3.252 1.00 0.78 C ATOM 1060 CD2 TYR A 73 -1.639 -5.869 5.622 1.00 0.72 C ATOM 1061 CE1 TYR A 73 -0.613 -5.411 3.105 1.00 0.97 C ATOM 1062 CE2 TYR A 73 -0.376 -5.335 5.480 1.00 0.89 C ATOM 1063 CZ TYR A 73 0.127 -5.110 4.218 1.00 0.99 C ATOM 1064 OH TYR A 73 1.377 -4.586 4.064 1.00 1.21 O ATOM 0 H TYR A 73 -3.185 -8.743 2.605 1.00 0.39 H new ATOM 0 HA TYR A 73 -3.575 -8.754 5.503 1.00 0.36 H new ATOM 0 HB2 TYR A 73 -4.420 -6.342 3.868 1.00 0.51 H new ATOM 0 HB3 TYR A 73 -4.201 -6.457 5.603 1.00 0.51 H new ATOM 0 HD1 TYR A 73 -2.450 -6.179 2.374 1.00 0.78 H new ATOM 0 HD2 TYR A 73 -2.036 -6.047 6.610 1.00 0.72 H new ATOM 0 HE1 TYR A 73 -0.210 -5.231 2.119 1.00 0.97 H new ATOM 0 HE2 TYR A 73 0.214 -5.095 6.352 1.00 0.89 H new ATOM 0 HH TYR A 73 1.495 -4.288 3.138 1.00 1.21 H new ATOM 1074 N ASP A 74 -6.173 -8.474 5.100 1.00 0.35 N ATOM 1075 CA ASP A 74 -7.596 -8.591 4.833 1.00 0.39 C ATOM 1076 C ASP A 74 -8.284 -7.285 5.211 1.00 0.34 C ATOM 1077 O ASP A 74 -8.137 -6.799 6.333 1.00 0.44 O ATOM 1078 CB ASP A 74 -8.230 -9.743 5.621 1.00 0.57 C ATOM 1079 CG ASP A 74 -7.464 -11.043 5.503 1.00 1.58 C ATOM 1080 OD1 ASP A 74 -7.748 -11.826 4.576 1.00 2.47 O ATOM 1081 OD2 ASP A 74 -6.582 -11.295 6.349 1.00 1.92 O ATOM 0 H ASP A 74 -5.949 -8.240 6.067 1.00 0.35 H new ATOM 0 HA ASP A 74 -7.725 -8.800 3.771 1.00 0.39 H new ATOM 0 HB2 ASP A 74 -8.295 -9.462 6.672 1.00 0.57 H new ATOM 0 HB3 ASP A 74 -9.250 -9.897 5.268 1.00 0.57 H new ATOM 1086 N ILE A 75 -9.007 -6.712 4.264 1.00 0.28 N ATOM 1087 CA ILE A 75 -9.767 -5.493 4.488 1.00 0.27 C ATOM 1088 C ILE A 75 -11.245 -5.832 4.603 1.00 0.27 C ATOM 1089 O ILE A 75 -11.925 -5.976 3.590 1.00 0.26 O ATOM 1090 CB ILE A 75 -9.629 -4.472 3.330 1.00 0.25 C ATOM 1091 CG1 ILE A 75 -8.180 -4.089 3.038 1.00 0.28 C ATOM 1092 CG2 ILE A 75 -10.427 -3.222 3.636 1.00 0.29 C ATOM 1093 CD1 ILE A 75 -7.415 -5.106 2.239 1.00 0.38 C ATOM 0 H ILE A 75 -9.084 -7.080 3.316 1.00 0.28 H new ATOM 0 HA ILE A 75 -9.369 -5.048 5.400 1.00 0.27 H new ATOM 0 HB ILE A 75 -10.020 -4.963 2.439 1.00 0.25 H new ATOM 0 HG12 ILE A 75 -8.169 -3.141 2.501 1.00 0.28 H new ATOM 0 HG13 ILE A 75 -7.663 -3.925 3.984 1.00 0.28 H new ATOM 0 HG21 ILE A 75 -10.322 -2.513 2.815 1.00 0.29 H new ATOM 0 HG22 ILE A 75 -11.478 -3.482 3.758 1.00 0.29 H new ATOM 0 HG23 ILE A 75 -10.056 -2.770 4.556 1.00 0.29 H new ATOM 0 HD11 ILE A 75 -6.397 -4.752 2.079 1.00 0.38 H new ATOM 0 HD12 ILE A 75 -7.389 -6.051 2.782 1.00 0.38 H new ATOM 0 HD13 ILE A 75 -7.903 -5.254 1.276 1.00 0.38 H new ATOM 1105 N PRO A 76 -11.763 -5.991 5.818 1.00 0.32 N ATOM 1106 CA PRO A 76 -13.180 -6.278 6.022 1.00 0.35 C ATOM 1107 C PRO A 76 -14.075 -5.213 5.396 1.00 0.34 C ATOM 1108 O PRO A 76 -13.985 -4.034 5.739 1.00 0.41 O ATOM 1109 CB PRO A 76 -13.341 -6.262 7.534 1.00 0.45 C ATOM 1110 CG PRO A 76 -11.975 -6.489 8.084 1.00 0.59 C ATOM 1111 CD PRO A 76 -11.018 -5.916 7.082 1.00 0.41 C ATOM 0 HA PRO A 76 -13.470 -7.221 5.559 1.00 0.35 H new ATOM 0 HB2 PRO A 76 -13.748 -5.310 7.875 1.00 0.45 H new ATOM 0 HB3 PRO A 76 -14.030 -7.039 7.863 1.00 0.45 H new ATOM 0 HG2 PRO A 76 -11.860 -6.003 9.053 1.00 0.59 H new ATOM 0 HG3 PRO A 76 -11.789 -7.552 8.236 1.00 0.59 H new ATOM 0 HD2 PRO A 76 -10.746 -4.890 7.328 1.00 0.41 H new ATOM 0 HD3 PRO A 76 -10.092 -6.489 7.037 1.00 0.41 H new ATOM 1119 N ILE A 77 -14.931 -5.629 4.476 1.00 0.31 N ATOM 1120 CA ILE A 77 -15.812 -4.700 3.787 1.00 0.30 C ATOM 1121 C ILE A 77 -17.258 -5.160 3.897 1.00 0.36 C ATOM 1122 O ILE A 77 -17.562 -6.334 3.698 1.00 0.40 O ATOM 1123 CB ILE A 77 -15.432 -4.562 2.295 1.00 0.26 C ATOM 1124 CG1 ILE A 77 -14.005 -4.026 2.152 1.00 0.28 C ATOM 1125 CG2 ILE A 77 -16.414 -3.652 1.567 1.00 0.30 C ATOM 1126 CD1 ILE A 77 -13.544 -3.874 0.718 1.00 0.49 C ATOM 0 H ILE A 77 -15.034 -6.603 4.190 1.00 0.31 H new ATOM 0 HA ILE A 77 -15.699 -3.727 4.265 1.00 0.30 H new ATOM 0 HB ILE A 77 -15.480 -5.552 1.840 1.00 0.26 H new ATOM 0 HG12 ILE A 77 -13.940 -3.058 2.648 1.00 0.28 H new ATOM 0 HG13 ILE A 77 -13.322 -4.697 2.673 1.00 0.28 H new ATOM 0 HG21 ILE A 77 -16.126 -3.570 0.519 1.00 0.30 H new ATOM 0 HG22 ILE A 77 -17.418 -4.071 1.636 1.00 0.30 H new ATOM 0 HG23 ILE A 77 -16.402 -2.663 2.025 1.00 0.30 H new ATOM 0 HD11 ILE A 77 -12.524 -3.490 0.702 1.00 0.49 H new ATOM 0 HD12 ILE A 77 -13.574 -4.844 0.221 1.00 0.49 H new ATOM 0 HD13 ILE A 77 -14.202 -3.179 0.196 1.00 0.49 H new ATOM 1138 N LYS A 78 -18.144 -4.237 4.240 1.00 0.44 N ATOM 1139 CA LYS A 78 -19.570 -4.528 4.273 1.00 0.54 C ATOM 1140 C LYS A 78 -20.360 -3.439 3.567 1.00 0.55 C ATOM 1141 O LYS A 78 -21.574 -3.339 3.746 1.00 0.71 O ATOM 1142 CB LYS A 78 -20.082 -4.650 5.710 1.00 0.71 C ATOM 1143 CG LYS A 78 -19.556 -5.851 6.477 1.00 1.23 C ATOM 1144 CD LYS A 78 -20.320 -6.028 7.776 1.00 1.82 C ATOM 1145 CE LYS A 78 -19.788 -7.185 8.601 1.00 2.66 C ATOM 1146 NZ LYS A 78 -20.629 -7.431 9.800 1.00 3.32 N ATOM 0 H LYS A 78 -17.901 -3.281 4.499 1.00 0.44 H new ATOM 0 HA LYS A 78 -19.712 -5.479 3.760 1.00 0.54 H new ATOM 0 HB2 LYS A 78 -19.814 -3.744 6.254 1.00 0.71 H new ATOM 0 HB3 LYS A 78 -21.171 -4.699 5.689 1.00 0.71 H new ATOM 0 HG2 LYS A 78 -19.651 -6.749 5.867 1.00 1.23 H new ATOM 0 HG3 LYS A 78 -18.495 -5.719 6.687 1.00 1.23 H new ATOM 0 HD2 LYS A 78 -20.259 -5.109 8.360 1.00 1.82 H new ATOM 0 HD3 LYS A 78 -21.374 -6.196 7.556 1.00 1.82 H new ATOM 0 HE2 LYS A 78 -19.755 -8.085 7.988 1.00 2.66 H new ATOM 0 HE3 LYS A 78 -18.765 -6.972 8.911 1.00 2.66 H new ATOM 0 HZ1 LYS A 78 -20.237 -8.228 10.341 1.00 3.32 H new ATOM 0 HZ2 LYS A 78 -20.640 -6.579 10.397 1.00 3.32 H new ATOM 0 HZ3 LYS A 78 -21.599 -7.658 9.503 1.00 3.32 H new ATOM 1160 N GLU A 79 -19.685 -2.615 2.775 1.00 0.46 N ATOM 1161 CA GLU A 79 -20.342 -1.475 2.156 1.00 0.47 C ATOM 1162 C GLU A 79 -19.946 -1.364 0.693 1.00 0.36 C ATOM 1163 O GLU A 79 -19.078 -2.101 0.222 1.00 0.39 O ATOM 1164 CB GLU A 79 -19.979 -0.193 2.909 1.00 0.60 C ATOM 1165 CG GLU A 79 -20.272 -0.262 4.398 1.00 1.02 C ATOM 1166 CD GLU A 79 -19.875 0.999 5.124 1.00 1.41 C ATOM 1167 OE1 GLU A 79 -18.698 1.398 5.026 1.00 1.87 O ATOM 1168 OE2 GLU A 79 -20.742 1.613 5.780 1.00 2.16 O ATOM 0 H GLU A 79 -18.695 -2.714 2.549 1.00 0.46 H new ATOM 0 HA GLU A 79 -21.421 -1.619 2.207 1.00 0.47 H new ATOM 0 HB2 GLU A 79 -18.919 0.016 2.765 1.00 0.60 H new ATOM 0 HB3 GLU A 79 -20.531 0.642 2.476 1.00 0.60 H new ATOM 0 HG2 GLU A 79 -21.336 -0.444 4.548 1.00 1.02 H new ATOM 0 HG3 GLU A 79 -19.740 -1.109 4.831 1.00 1.02 H new ATOM 1175 N GLU A 80 -20.570 -0.434 -0.010 1.00 0.38 N ATOM 1176 CA GLU A 80 -20.324 -0.245 -1.430 1.00 0.34 C ATOM 1177 C GLU A 80 -19.866 1.182 -1.713 1.00 0.35 C ATOM 1178 O GLU A 80 -20.036 2.074 -0.882 1.00 0.52 O ATOM 1179 CB GLU A 80 -21.588 -0.585 -2.218 1.00 0.42 C ATOM 1180 CG GLU A 80 -21.791 -2.079 -2.409 1.00 0.71 C ATOM 1181 CD GLU A 80 -23.249 -2.470 -2.499 1.00 0.84 C ATOM 1182 OE1 GLU A 80 -23.987 -1.873 -3.312 1.00 0.90 O ATOM 1183 OE2 GLU A 80 -23.666 -3.389 -1.765 1.00 1.20 O ATOM 0 H GLU A 80 -21.258 0.208 0.384 1.00 0.38 H new ATOM 0 HA GLU A 80 -19.524 -0.915 -1.747 1.00 0.34 H new ATOM 0 HB2 GLU A 80 -22.453 -0.171 -1.701 1.00 0.42 H new ATOM 0 HB3 GLU A 80 -21.540 -0.104 -3.195 1.00 0.42 H new ATOM 0 HG2 GLU A 80 -21.279 -2.397 -3.317 1.00 0.71 H new ATOM 0 HG3 GLU A 80 -21.328 -2.612 -1.579 1.00 0.71 H new ATOM 1190 N GLY A 81 -19.292 1.387 -2.888 1.00 0.30 N ATOM 1191 CA GLY A 81 -18.707 2.666 -3.234 1.00 0.28 C ATOM 1192 C GLY A 81 -17.376 2.474 -3.924 1.00 0.24 C ATOM 1193 O GLY A 81 -16.990 1.335 -4.201 1.00 0.28 O ATOM 0 H GLY A 81 -19.220 0.679 -3.619 1.00 0.30 H new ATOM 0 HA2 GLY A 81 -19.384 3.217 -3.886 1.00 0.28 H new ATOM 0 HA3 GLY A 81 -18.573 3.266 -2.334 1.00 0.28 H new ATOM 1197 N GLU A 82 -16.655 3.557 -4.196 1.00 0.22 N ATOM 1198 CA GLU A 82 -15.374 3.426 -4.876 1.00 0.23 C ATOM 1199 C GLU A 82 -14.263 3.319 -3.839 1.00 0.22 C ATOM 1200 O GLU A 82 -13.865 4.316 -3.255 1.00 0.26 O ATOM 1201 CB GLU A 82 -15.093 4.626 -5.789 1.00 0.29 C ATOM 1202 CG GLU A 82 -16.271 5.090 -6.629 1.00 0.42 C ATOM 1203 CD GLU A 82 -16.721 4.072 -7.649 1.00 1.11 C ATOM 1204 OE1 GLU A 82 -15.944 3.788 -8.583 1.00 1.30 O ATOM 1205 OE2 GLU A 82 -17.835 3.531 -7.509 1.00 1.96 O ATOM 0 H GLU A 82 -16.927 4.512 -3.963 1.00 0.22 H new ATOM 0 HA GLU A 82 -15.411 2.529 -5.494 1.00 0.23 H new ATOM 0 HB2 GLU A 82 -14.756 5.460 -5.173 1.00 0.29 H new ATOM 0 HB3 GLU A 82 -14.270 4.370 -6.456 1.00 0.29 H new ATOM 0 HG2 GLU A 82 -17.106 5.326 -5.970 1.00 0.42 H new ATOM 0 HG3 GLU A 82 -16.000 6.012 -7.143 1.00 0.42 H new ATOM 1212 N TYR A 83 -13.725 2.134 -3.632 1.00 0.21 N ATOM 1213 CA TYR A 83 -12.695 1.977 -2.623 1.00 0.22 C ATOM 1214 C TYR A 83 -11.359 2.145 -3.278 1.00 0.22 C ATOM 1215 O TYR A 83 -11.014 1.428 -4.205 1.00 0.22 O ATOM 1216 CB TYR A 83 -12.749 0.596 -1.968 1.00 0.25 C ATOM 1217 CG TYR A 83 -13.961 0.367 -1.113 1.00 0.27 C ATOM 1218 CD1 TYR A 83 -15.119 -0.160 -1.655 1.00 0.59 C ATOM 1219 CD2 TYR A 83 -13.952 0.681 0.234 1.00 0.67 C ATOM 1220 CE1 TYR A 83 -16.231 -0.371 -0.881 1.00 0.60 C ATOM 1221 CE2 TYR A 83 -15.058 0.474 1.015 1.00 0.71 C ATOM 1222 CZ TYR A 83 -16.186 -0.058 0.471 1.00 0.39 C ATOM 1223 OH TYR A 83 -17.307 -0.264 1.230 1.00 0.44 O ATOM 0 H TYR A 83 -13.976 1.283 -4.135 1.00 0.21 H new ATOM 0 HA TYR A 83 -12.856 2.727 -1.849 1.00 0.22 H new ATOM 0 HB2 TYR A 83 -12.719 -0.165 -2.748 1.00 0.25 H new ATOM 0 HB3 TYR A 83 -11.857 0.461 -1.357 1.00 0.25 H new ATOM 0 HD1 TYR A 83 -15.148 -0.410 -2.705 1.00 0.59 H new ATOM 0 HD2 TYR A 83 -13.059 1.096 0.677 1.00 0.67 H new ATOM 0 HE1 TYR A 83 -17.132 -0.776 -1.318 1.00 0.60 H new ATOM 0 HE2 TYR A 83 -15.035 0.733 2.063 1.00 0.71 H new ATOM 0 HH TYR A 83 -17.972 0.426 1.025 1.00 0.44 H new ATOM 1233 N VAL A 84 -10.596 3.074 -2.773 1.00 0.22 N ATOM 1234 CA VAL A 84 -9.369 3.439 -3.424 1.00 0.22 C ATOM 1235 C VAL A 84 -8.191 3.116 -2.538 1.00 0.23 C ATOM 1236 O VAL A 84 -7.961 3.759 -1.512 1.00 0.24 O ATOM 1237 CB VAL A 84 -9.369 4.928 -3.844 1.00 0.22 C ATOM 1238 CG1 VAL A 84 -8.023 5.334 -4.426 1.00 0.26 C ATOM 1239 CG2 VAL A 84 -10.476 5.172 -4.852 1.00 0.25 C ATOM 0 H VAL A 84 -10.800 3.590 -1.917 1.00 0.22 H new ATOM 0 HA VAL A 84 -9.281 2.852 -4.338 1.00 0.22 H new ATOM 0 HB VAL A 84 -9.546 5.539 -2.959 1.00 0.22 H new ATOM 0 HG11 VAL A 84 -8.053 6.385 -4.712 1.00 0.26 H new ATOM 0 HG12 VAL A 84 -7.243 5.183 -3.679 1.00 0.26 H new ATOM 0 HG13 VAL A 84 -7.808 4.725 -5.304 1.00 0.26 H new ATOM 0 HG21 VAL A 84 -10.475 6.221 -5.147 1.00 0.25 H new ATOM 0 HG22 VAL A 84 -10.312 4.548 -5.731 1.00 0.25 H new ATOM 0 HG23 VAL A 84 -11.438 4.922 -4.404 1.00 0.25 H new ATOM 1249 N LEU A 85 -7.481 2.074 -2.916 1.00 0.25 N ATOM 1250 CA LEU A 85 -6.306 1.664 -2.192 1.00 0.30 C ATOM 1251 C LEU A 85 -5.110 2.425 -2.710 1.00 0.29 C ATOM 1252 O LEU A 85 -4.624 2.155 -3.805 1.00 0.31 O ATOM 1253 CB LEU A 85 -6.051 0.159 -2.341 1.00 0.40 C ATOM 1254 CG LEU A 85 -7.114 -0.769 -1.748 1.00 0.92 C ATOM 1255 CD1 LEU A 85 -8.347 -0.840 -2.638 1.00 1.56 C ATOM 1256 CD2 LEU A 85 -6.532 -2.152 -1.532 1.00 1.13 C ATOM 0 H LEU A 85 -7.702 1.495 -3.726 1.00 0.25 H new ATOM 0 HA LEU A 85 -6.466 1.879 -1.135 1.00 0.30 H new ATOM 0 HB2 LEU A 85 -5.952 -0.068 -3.402 1.00 0.40 H new ATOM 0 HB3 LEU A 85 -5.094 -0.074 -1.874 1.00 0.40 H new ATOM 0 HG LEU A 85 -7.425 -0.360 -0.787 1.00 0.92 H new ATOM 0 HD11 LEU A 85 -9.082 -1.507 -2.188 1.00 1.56 H new ATOM 0 HD12 LEU A 85 -8.777 0.156 -2.744 1.00 1.56 H new ATOM 0 HD13 LEU A 85 -8.065 -1.220 -3.620 1.00 1.56 H new ATOM 0 HD21 LEU A 85 -7.295 -2.806 -1.110 1.00 1.13 H new ATOM 0 HD22 LEU A 85 -6.194 -2.557 -2.486 1.00 1.13 H new ATOM 0 HD23 LEU A 85 -5.688 -2.088 -0.845 1.00 1.13 H new ATOM 1268 N VAL A 86 -4.661 3.395 -1.946 1.00 0.31 N ATOM 1269 CA VAL A 86 -3.431 4.083 -2.259 1.00 0.34 C ATOM 1270 C VAL A 86 -2.357 3.551 -1.332 1.00 0.32 C ATOM 1271 O VAL A 86 -2.319 3.888 -0.148 1.00 0.32 O ATOM 1272 CB VAL A 86 -3.554 5.612 -2.085 1.00 0.41 C ATOM 1273 CG1 VAL A 86 -2.256 6.307 -2.475 1.00 1.05 C ATOM 1274 CG2 VAL A 86 -4.716 6.155 -2.902 1.00 1.14 C ATOM 0 H VAL A 86 -5.130 3.725 -1.103 1.00 0.31 H new ATOM 0 HA VAL A 86 -3.183 3.902 -3.305 1.00 0.34 H new ATOM 0 HB VAL A 86 -3.749 5.818 -1.032 1.00 0.41 H new ATOM 0 HG11 VAL A 86 -2.366 7.384 -2.344 1.00 1.05 H new ATOM 0 HG12 VAL A 86 -1.445 5.946 -1.842 1.00 1.05 H new ATOM 0 HG13 VAL A 86 -2.026 6.090 -3.518 1.00 1.05 H new ATOM 0 HG21 VAL A 86 -4.784 7.234 -2.765 1.00 1.14 H new ATOM 0 HG22 VAL A 86 -4.554 5.933 -3.957 1.00 1.14 H new ATOM 0 HG23 VAL A 86 -5.643 5.688 -2.571 1.00 1.14 H new ATOM 1284 N LEU A 87 -1.511 2.690 -1.851 1.00 0.33 N ATOM 1285 CA LEU A 87 -0.494 2.075 -1.031 1.00 0.32 C ATOM 1286 C LEU A 87 0.881 2.537 -1.457 1.00 0.28 C ATOM 1287 O LEU A 87 1.198 2.563 -2.647 1.00 0.29 O ATOM 1288 CB LEU A 87 -0.585 0.536 -1.074 1.00 0.42 C ATOM 1289 CG LEU A 87 -0.710 -0.121 -2.452 1.00 0.57 C ATOM 1290 CD1 LEU A 87 -0.198 -1.547 -2.389 1.00 1.37 C ATOM 1291 CD2 LEU A 87 -2.159 -0.132 -2.911 1.00 1.44 C ATOM 0 H LEU A 87 -1.507 2.402 -2.829 1.00 0.33 H new ATOM 0 HA LEU A 87 -0.666 2.388 -0.001 1.00 0.32 H new ATOM 0 HB2 LEU A 87 0.302 0.132 -0.587 1.00 0.42 H new ATOM 0 HB3 LEU A 87 -1.444 0.232 -0.476 1.00 0.42 H new ATOM 0 HG LEU A 87 -0.117 0.455 -3.162 1.00 0.57 H new ATOM 0 HD11 LEU A 87 -0.289 -2.010 -3.372 1.00 1.37 H new ATOM 0 HD12 LEU A 87 0.849 -1.545 -2.085 1.00 1.37 H new ATOM 0 HD13 LEU A 87 -0.785 -2.113 -1.666 1.00 1.37 H new ATOM 0 HD21 LEU A 87 -2.226 -0.603 -3.892 1.00 1.44 H new ATOM 0 HD22 LEU A 87 -2.763 -0.693 -2.197 1.00 1.44 H new ATOM 0 HD23 LEU A 87 -2.529 0.892 -2.974 1.00 1.44 H new ATOM 1303 N LYS A 88 1.698 2.911 -0.486 1.00 0.28 N ATOM 1304 CA LYS A 88 3.065 3.304 -0.785 1.00 0.28 C ATOM 1305 C LYS A 88 3.985 2.104 -0.687 1.00 0.28 C ATOM 1306 O LYS A 88 4.023 1.410 0.327 1.00 0.39 O ATOM 1307 CB LYS A 88 3.557 4.417 0.143 1.00 0.35 C ATOM 1308 CG LYS A 88 3.668 5.789 -0.505 1.00 0.67 C ATOM 1309 CD LYS A 88 2.329 6.285 -1.024 1.00 1.91 C ATOM 1310 CE LYS A 88 2.420 7.719 -1.525 1.00 2.70 C ATOM 1311 NZ LYS A 88 3.411 7.876 -2.627 1.00 3.73 N ATOM 0 H LYS A 88 1.444 2.951 0.501 1.00 0.28 H new ATOM 0 HA LYS A 88 3.079 3.693 -1.803 1.00 0.28 H new ATOM 0 HB2 LYS A 88 2.879 4.487 0.994 1.00 0.35 H new ATOM 0 HB3 LYS A 88 4.534 4.137 0.536 1.00 0.35 H new ATOM 0 HG2 LYS A 88 4.062 6.501 0.220 1.00 0.67 H new ATOM 0 HG3 LYS A 88 4.381 5.744 -1.328 1.00 0.67 H new ATOM 0 HD2 LYS A 88 1.989 5.637 -1.832 1.00 1.91 H new ATOM 0 HD3 LYS A 88 1.585 6.223 -0.230 1.00 1.91 H new ATOM 0 HE2 LYS A 88 1.439 8.042 -1.874 1.00 2.70 H new ATOM 0 HE3 LYS A 88 2.695 8.373 -0.697 1.00 2.70 H new ATOM 0 HZ1 LYS A 88 4.089 8.625 -2.380 1.00 3.73 H new ATOM 0 HZ2 LYS A 88 3.920 6.980 -2.766 1.00 3.73 H new ATOM 0 HZ3 LYS A 88 2.916 8.133 -3.505 1.00 3.73 H new ATOM 1325 N PHE A 89 4.701 1.854 -1.755 1.00 0.27 N ATOM 1326 CA PHE A 89 5.675 0.792 -1.793 1.00 0.28 C ATOM 1327 C PHE A 89 7.074 1.369 -1.809 1.00 0.28 C ATOM 1328 O PHE A 89 7.329 2.391 -2.450 1.00 0.29 O ATOM 1329 CB PHE A 89 5.487 -0.076 -3.031 1.00 0.32 C ATOM 1330 CG PHE A 89 4.520 -1.206 -2.853 1.00 0.32 C ATOM 1331 CD1 PHE A 89 4.550 -1.971 -1.704 1.00 0.37 C ATOM 1332 CD2 PHE A 89 3.609 -1.529 -3.846 1.00 0.37 C ATOM 1333 CE1 PHE A 89 3.691 -3.036 -1.542 1.00 0.44 C ATOM 1334 CE2 PHE A 89 2.757 -2.600 -3.695 1.00 0.42 C ATOM 1335 CZ PHE A 89 2.797 -3.354 -2.547 1.00 0.45 C ATOM 0 H PHE A 89 4.625 2.382 -2.624 1.00 0.27 H new ATOM 0 HA PHE A 89 5.535 0.179 -0.903 1.00 0.28 H new ATOM 0 HB2 PHE A 89 5.145 0.553 -3.852 1.00 0.32 H new ATOM 0 HB3 PHE A 89 6.454 -0.484 -3.324 1.00 0.32 H new ATOM 0 HD1 PHE A 89 5.256 -1.732 -0.922 1.00 0.37 H new ATOM 0 HD2 PHE A 89 3.567 -0.935 -4.747 1.00 0.37 H new ATOM 0 HE1 PHE A 89 3.716 -3.620 -0.634 1.00 0.44 H new ATOM 0 HE2 PHE A 89 2.057 -2.848 -4.479 1.00 0.42 H new ATOM 0 HZ PHE A 89 2.130 -4.195 -2.430 1.00 0.45 H new ATOM 1345 N ALA A 90 7.969 0.714 -1.106 1.00 0.32 N ATOM 1346 CA ALA A 90 9.377 1.087 -1.128 1.00 0.36 C ATOM 1347 C ALA A 90 10.245 -0.149 -0.914 1.00 0.42 C ATOM 1348 O ALA A 90 10.181 -0.784 0.140 1.00 0.51 O ATOM 1349 CB ALA A 90 9.680 2.140 -0.073 1.00 0.44 C ATOM 0 H ALA A 90 7.753 -0.083 -0.508 1.00 0.32 H new ATOM 0 HA ALA A 90 9.605 1.517 -2.103 1.00 0.36 H new ATOM 0 HB1 ALA A 90 10.738 2.400 -0.112 1.00 0.44 H new ATOM 0 HB2 ALA A 90 9.080 3.030 -0.264 1.00 0.44 H new ATOM 0 HB3 ALA A 90 9.439 1.746 0.914 1.00 0.44 H new ATOM 1355 N GLU A 91 11.019 -0.522 -1.926 1.00 0.59 N ATOM 1356 CA GLU A 91 11.947 -1.634 -1.786 1.00 0.75 C ATOM 1357 C GLU A 91 13.306 -1.106 -1.350 1.00 1.10 C ATOM 1358 O GLU A 91 13.834 -0.157 -1.928 1.00 1.80 O ATOM 1359 CB GLU A 91 12.059 -2.443 -3.089 1.00 1.45 C ATOM 1360 CG GLU A 91 12.500 -1.642 -4.306 1.00 1.95 C ATOM 1361 CD GLU A 91 12.737 -2.523 -5.518 1.00 2.17 C ATOM 1362 OE1 GLU A 91 13.810 -3.147 -5.609 1.00 2.62 O ATOM 1363 OE2 GLU A 91 11.853 -2.576 -6.398 1.00 2.51 O ATOM 0 H GLU A 91 11.022 -0.075 -2.843 1.00 0.59 H new ATOM 0 HA GLU A 91 11.566 -2.313 -1.023 1.00 0.75 H new ATOM 0 HB2 GLU A 91 12.766 -3.258 -2.934 1.00 1.45 H new ATOM 0 HB3 GLU A 91 11.091 -2.896 -3.302 1.00 1.45 H new ATOM 0 HG2 GLU A 91 11.740 -0.897 -4.543 1.00 1.95 H new ATOM 0 HG3 GLU A 91 13.415 -1.099 -4.069 1.00 1.95 H new ATOM 1370 N VAL A 92 13.854 -1.703 -0.301 1.00 1.37 N ATOM 1371 CA VAL A 92 15.105 -1.231 0.271 1.00 2.09 C ATOM 1372 C VAL A 92 16.294 -1.785 -0.507 1.00 1.99 C ATOM 1373 O VAL A 92 17.341 -1.141 -0.604 1.00 2.61 O ATOM 1374 CB VAL A 92 15.227 -1.616 1.762 1.00 2.95 C ATOM 1375 CG1 VAL A 92 16.482 -1.014 2.377 1.00 3.64 C ATOM 1376 CG2 VAL A 92 13.992 -1.171 2.531 1.00 3.77 C ATOM 0 H VAL A 92 13.452 -2.514 0.170 1.00 1.37 H new ATOM 0 HA VAL A 92 15.107 -0.143 0.199 1.00 2.09 H new ATOM 0 HB VAL A 92 15.303 -2.701 1.826 1.00 2.95 H new ATOM 0 HG11 VAL A 92 16.545 -1.299 3.427 1.00 3.64 H new ATOM 0 HG12 VAL A 92 17.360 -1.383 1.847 1.00 3.64 H new ATOM 0 HG13 VAL A 92 16.441 0.072 2.298 1.00 3.64 H new ATOM 0 HG21 VAL A 92 14.096 -1.451 3.579 1.00 3.77 H new ATOM 0 HG22 VAL A 92 13.885 -0.089 2.453 1.00 3.77 H new ATOM 0 HG23 VAL A 92 13.109 -1.654 2.112 1.00 3.77 H new ATOM 1386 N TYR A 93 16.123 -2.970 -1.076 1.00 1.71 N ATOM 1387 CA TYR A 93 17.165 -3.571 -1.892 1.00 1.99 C ATOM 1388 C TYR A 93 16.880 -3.295 -3.365 1.00 1.66 C ATOM 1389 O TYR A 93 16.837 -4.208 -4.194 1.00 1.98 O ATOM 1390 CB TYR A 93 17.262 -5.078 -1.620 1.00 2.71 C ATOM 1391 CG TYR A 93 18.524 -5.712 -2.167 1.00 3.21 C ATOM 1392 CD1 TYR A 93 19.703 -4.986 -2.274 1.00 3.58 C ATOM 1393 CD2 TYR A 93 18.531 -7.040 -2.576 1.00 3.71 C ATOM 1394 CE1 TYR A 93 20.853 -5.567 -2.774 1.00 4.35 C ATOM 1395 CE2 TYR A 93 19.675 -7.627 -3.074 1.00 4.48 C ATOM 1396 CZ TYR A 93 20.847 -6.863 -3.167 1.00 4.77 C ATOM 1397 OH TYR A 93 21.976 -7.472 -3.672 1.00 5.68 O ATOM 0 H TYR A 93 15.276 -3.531 -0.987 1.00 1.71 H new ATOM 0 HA TYR A 93 18.126 -3.128 -1.632 1.00 1.99 H new ATOM 0 HB2 TYR A 93 17.216 -5.248 -0.544 1.00 2.71 H new ATOM 0 HB3 TYR A 93 16.396 -5.574 -2.058 1.00 2.71 H new ATOM 0 HD1 TYR A 93 19.722 -3.952 -1.962 1.00 3.58 H new ATOM 0 HD2 TYR A 93 17.625 -7.623 -2.503 1.00 3.71 H new ATOM 0 HE1 TYR A 93 21.760 -4.985 -2.852 1.00 4.35 H new ATOM 0 HE2 TYR A 93 19.668 -8.660 -3.388 1.00 4.48 H new ATOM 0 HH TYR A 93 21.772 -8.404 -3.897 1.00 5.68 H new ATOM 1407 N PHE A 94 16.674 -2.022 -3.678 1.00 1.60 N ATOM 1408 CA PHE A 94 16.354 -1.605 -5.033 1.00 1.62 C ATOM 1409 C PHE A 94 17.604 -1.600 -5.911 1.00 1.50 C ATOM 1410 O PHE A 94 18.436 -0.699 -5.837 1.00 1.99 O ATOM 1411 CB PHE A 94 15.671 -0.222 -5.028 1.00 2.15 C ATOM 1412 CG PHE A 94 16.481 0.890 -4.406 1.00 2.79 C ATOM 1413 CD1 PHE A 94 16.606 0.997 -3.029 1.00 3.28 C ATOM 1414 CD2 PHE A 94 17.109 1.834 -5.202 1.00 3.42 C ATOM 1415 CE1 PHE A 94 17.344 2.017 -2.461 1.00 4.15 C ATOM 1416 CE2 PHE A 94 17.849 2.856 -4.641 1.00 4.37 C ATOM 1417 CZ PHE A 94 17.967 2.948 -3.269 1.00 4.65 C ATOM 0 H PHE A 94 16.724 -1.257 -3.005 1.00 1.60 H new ATOM 0 HA PHE A 94 15.654 -2.325 -5.457 1.00 1.62 H new ATOM 0 HB2 PHE A 94 15.435 0.053 -6.056 1.00 2.15 H new ATOM 0 HB3 PHE A 94 14.724 -0.303 -4.494 1.00 2.15 H new ATOM 0 HD1 PHE A 94 16.120 0.273 -2.392 1.00 3.28 H new ATOM 0 HD2 PHE A 94 17.019 1.770 -6.276 1.00 3.42 H new ATOM 0 HE1 PHE A 94 17.434 2.086 -1.387 1.00 4.15 H new ATOM 0 HE2 PHE A 94 18.335 3.583 -5.275 1.00 4.37 H new ATOM 0 HZ PHE A 94 18.545 3.746 -2.828 1.00 4.65 H new ATOM 1427 N ALA A 95 17.756 -2.640 -6.719 1.00 1.26 N ATOM 1428 CA ALA A 95 18.862 -2.693 -7.666 1.00 1.24 C ATOM 1429 C ALA A 95 18.541 -3.555 -8.886 1.00 1.19 C ATOM 1430 O ALA A 95 19.438 -3.904 -9.656 1.00 1.37 O ATOM 1431 CB ALA A 95 20.119 -3.208 -6.980 1.00 1.39 C ATOM 0 H ALA A 95 17.136 -3.450 -6.739 1.00 1.26 H new ATOM 0 HA ALA A 95 19.030 -1.676 -8.021 1.00 1.24 H new ATOM 0 HB1 ALA A 95 20.938 -3.243 -7.699 1.00 1.39 H new ATOM 0 HB2 ALA A 95 20.385 -2.542 -6.159 1.00 1.39 H new ATOM 0 HB3 ALA A 95 19.936 -4.209 -6.590 1.00 1.39 H new ATOM 1437 N GLN A 96 17.269 -3.884 -9.079 1.00 1.05 N ATOM 1438 CA GLN A 96 16.873 -4.733 -10.192 1.00 1.05 C ATOM 1439 C GLN A 96 15.382 -4.588 -10.451 1.00 0.91 C ATOM 1440 O GLN A 96 14.588 -4.507 -9.517 1.00 0.88 O ATOM 1441 CB GLN A 96 17.216 -6.193 -9.885 1.00 1.21 C ATOM 1442 CG GLN A 96 16.988 -7.137 -11.055 1.00 1.54 C ATOM 1443 CD GLN A 96 17.330 -8.573 -10.718 1.00 2.09 C ATOM 1444 OE1 GLN A 96 16.346 -9.318 -10.243 1.00 2.63 O flip ATOM 1445 NE2 GLN A 96 18.468 -9.012 -10.891 1.00 2.75 N flip ATOM 0 H GLN A 96 16.500 -3.577 -8.483 1.00 1.05 H new ATOM 0 HA GLN A 96 17.417 -4.425 -11.085 1.00 1.05 H new ATOM 0 HB2 GLN A 96 18.260 -6.254 -9.579 1.00 1.21 H new ATOM 0 HB3 GLN A 96 16.616 -6.527 -9.039 1.00 1.21 H new ATOM 0 HG2 GLN A 96 15.945 -7.079 -11.366 1.00 1.54 H new ATOM 0 HG3 GLN A 96 17.592 -6.812 -11.902 1.00 1.54 H new ATOM 0 HE21 GLN A 96 19.199 -8.403 -11.260 1.00 2.75 H new ATOM 0 HE22 GLN A 96 18.679 -9.984 -10.665 1.00 2.75 H new ATOM 1454 N SER A 97 15.014 -4.544 -11.721 1.00 0.94 N ATOM 1455 CA SER A 97 13.621 -4.442 -12.107 1.00 0.92 C ATOM 1456 C SER A 97 13.097 -5.789 -12.584 1.00 0.95 C ATOM 1457 O SER A 97 12.421 -6.501 -11.844 1.00 1.17 O ATOM 1458 CB SER A 97 13.453 -3.387 -13.195 1.00 1.04 C ATOM 1459 OG SER A 97 14.541 -3.414 -14.108 1.00 1.40 O ATOM 0 H SER A 97 15.667 -4.578 -12.504 1.00 0.94 H new ATOM 0 HA SER A 97 13.040 -4.140 -11.235 1.00 0.92 H new ATOM 0 HB2 SER A 97 12.520 -3.559 -13.732 1.00 1.04 H new ATOM 0 HB3 SER A 97 13.381 -2.399 -12.740 1.00 1.04 H new ATOM 0 HG SER A 97 14.408 -2.729 -14.796 1.00 1.40 H new ATOM 1465 N GLN A 98 13.428 -6.151 -13.813 1.00 0.89 N ATOM 1466 CA GLN A 98 13.009 -7.429 -14.348 1.00 0.97 C ATOM 1467 C GLN A 98 13.672 -8.552 -13.562 1.00 1.04 C ATOM 1468 O GLN A 98 14.822 -8.426 -13.142 1.00 1.44 O ATOM 1469 CB GLN A 98 13.341 -7.539 -15.839 1.00 1.14 C ATOM 1470 CG GLN A 98 12.876 -8.841 -16.474 1.00 1.77 C ATOM 1471 CD GLN A 98 11.375 -9.042 -16.372 1.00 1.94 C ATOM 1472 OE1 GLN A 98 10.603 -8.084 -16.382 1.00 2.33 O ATOM 1473 NE2 GLN A 98 10.956 -10.292 -16.247 1.00 2.38 N ATOM 0 H GLN A 98 13.982 -5.580 -14.452 1.00 0.89 H new ATOM 0 HA GLN A 98 11.927 -7.514 -14.247 1.00 0.97 H new ATOM 0 HB2 GLN A 98 12.882 -6.703 -16.367 1.00 1.14 H new ATOM 0 HB3 GLN A 98 14.419 -7.446 -15.970 1.00 1.14 H new ATOM 0 HG2 GLN A 98 13.169 -8.853 -17.524 1.00 1.77 H new ATOM 0 HG3 GLN A 98 13.383 -9.677 -15.992 1.00 1.77 H new ATOM 0 HE21 GLN A 98 11.630 -11.058 -16.243 1.00 2.38 H new ATOM 0 HE22 GLN A 98 9.960 -10.489 -16.154 1.00 2.38 H new ATOM 1482 N GLN A 99 12.914 -9.625 -13.343 1.00 1.05 N ATOM 1483 CA GLN A 99 13.342 -10.772 -12.533 1.00 1.16 C ATOM 1484 C GLN A 99 13.243 -10.435 -11.045 1.00 1.02 C ATOM 1485 O GLN A 99 13.531 -11.262 -10.186 1.00 1.16 O ATOM 1486 CB GLN A 99 14.759 -11.244 -12.897 1.00 1.35 C ATOM 1487 CG GLN A 99 14.924 -11.628 -14.363 1.00 1.82 C ATOM 1488 CD GLN A 99 13.945 -12.697 -14.806 1.00 2.26 C ATOM 1489 OE1 GLN A 99 12.840 -12.391 -15.260 1.00 2.73 O ATOM 1490 NE2 GLN A 99 14.345 -13.955 -14.692 1.00 2.89 N ATOM 0 H GLN A 99 11.974 -9.727 -13.726 1.00 1.05 H new ATOM 0 HA GLN A 99 12.668 -11.600 -12.753 1.00 1.16 H new ATOM 0 HB2 GLN A 99 15.468 -10.452 -12.657 1.00 1.35 H new ATOM 0 HB3 GLN A 99 15.017 -12.102 -12.276 1.00 1.35 H new ATOM 0 HG2 GLN A 99 14.791 -10.741 -14.983 1.00 1.82 H new ATOM 0 HG3 GLN A 99 15.941 -11.983 -14.528 1.00 1.82 H new ATOM 0 HE21 GLN A 99 15.268 -14.164 -14.311 1.00 2.89 H new ATOM 0 HE22 GLN A 99 13.730 -14.714 -14.985 1.00 2.89 H new ATOM 1499 N LYS A 100 12.842 -9.204 -10.753 1.00 0.87 N ATOM 1500 CA LYS A 100 12.494 -8.798 -9.402 1.00 0.84 C ATOM 1501 C LYS A 100 11.104 -8.179 -9.449 1.00 0.66 C ATOM 1502 O LYS A 100 10.867 -7.078 -8.958 1.00 0.63 O ATOM 1503 CB LYS A 100 13.525 -7.806 -8.830 1.00 1.00 C ATOM 1504 CG LYS A 100 13.367 -7.537 -7.333 1.00 1.33 C ATOM 1505 CD LYS A 100 14.488 -6.653 -6.796 1.00 1.75 C ATOM 1506 CE LYS A 100 14.422 -6.502 -5.277 1.00 2.23 C ATOM 1507 NZ LYS A 100 13.306 -5.620 -4.835 1.00 2.79 N ATOM 0 H LYS A 100 12.750 -8.462 -11.447 1.00 0.87 H new ATOM 0 HA LYS A 100 12.499 -9.664 -8.740 1.00 0.84 H new ATOM 0 HB2 LYS A 100 14.527 -8.193 -9.015 1.00 1.00 H new ATOM 0 HB3 LYS A 100 13.443 -6.862 -9.369 1.00 1.00 H new ATOM 0 HG2 LYS A 100 12.406 -7.057 -7.149 1.00 1.33 H new ATOM 0 HG3 LYS A 100 13.359 -8.483 -6.792 1.00 1.33 H new ATOM 0 HD2 LYS A 100 15.451 -7.079 -7.076 1.00 1.75 H new ATOM 0 HD3 LYS A 100 14.428 -5.669 -7.261 1.00 1.75 H new ATOM 0 HE2 LYS A 100 14.304 -7.486 -4.823 1.00 2.23 H new ATOM 0 HE3 LYS A 100 15.366 -6.095 -4.915 1.00 2.23 H new ATOM 0 HZ1 LYS A 100 12.986 -5.912 -3.889 1.00 2.79 H new ATOM 0 HZ2 LYS A 100 13.636 -4.634 -4.800 1.00 2.79 H new ATOM 0 HZ3 LYS A 100 12.516 -5.697 -5.507 1.00 2.79 H new ATOM 1521 N VAL A 101 10.182 -8.917 -10.047 1.00 0.62 N ATOM 1522 CA VAL A 101 8.845 -8.412 -10.296 1.00 0.51 C ATOM 1523 C VAL A 101 7.847 -9.078 -9.360 1.00 0.49 C ATOM 1524 O VAL A 101 7.684 -10.300 -9.353 1.00 0.64 O ATOM 1525 CB VAL A 101 8.418 -8.621 -11.771 1.00 0.60 C ATOM 1526 CG1 VAL A 101 9.190 -7.682 -12.691 1.00 1.22 C ATOM 1527 CG2 VAL A 101 8.618 -10.068 -12.202 1.00 1.20 C ATOM 0 H VAL A 101 10.338 -9.872 -10.369 1.00 0.62 H new ATOM 0 HA VAL A 101 8.856 -7.339 -10.104 1.00 0.51 H new ATOM 0 HB VAL A 101 7.356 -8.389 -11.847 1.00 0.60 H new ATOM 0 HG11 VAL A 101 8.876 -7.844 -13.722 1.00 1.22 H new ATOM 0 HG12 VAL A 101 8.989 -6.649 -12.408 1.00 1.22 H new ATOM 0 HG13 VAL A 101 10.258 -7.881 -12.601 1.00 1.22 H new ATOM 0 HG21 VAL A 101 8.310 -10.184 -13.241 1.00 1.20 H new ATOM 0 HG22 VAL A 101 9.670 -10.335 -12.104 1.00 1.20 H new ATOM 0 HG23 VAL A 101 8.017 -10.722 -11.570 1.00 1.20 H new ATOM 1537 N PHE A 102 7.209 -8.259 -8.547 1.00 0.43 N ATOM 1538 CA PHE A 102 6.334 -8.741 -7.495 1.00 0.43 C ATOM 1539 C PHE A 102 4.903 -8.881 -7.983 1.00 0.35 C ATOM 1540 O PHE A 102 4.506 -8.248 -8.948 1.00 0.34 O ATOM 1541 CB PHE A 102 6.397 -7.776 -6.317 1.00 0.47 C ATOM 1542 CG PHE A 102 7.796 -7.578 -5.802 1.00 0.63 C ATOM 1543 CD1 PHE A 102 8.631 -8.664 -5.594 1.00 0.80 C ATOM 1544 CD2 PHE A 102 8.267 -6.307 -5.504 1.00 0.76 C ATOM 1545 CE1 PHE A 102 9.909 -8.487 -5.100 1.00 0.97 C ATOM 1546 CE2 PHE A 102 9.542 -6.125 -5.006 1.00 0.91 C ATOM 1547 CZ PHE A 102 10.397 -7.210 -4.897 1.00 0.99 C ATOM 0 H PHE A 102 7.282 -7.243 -8.596 1.00 0.43 H new ATOM 0 HA PHE A 102 6.671 -9.730 -7.185 1.00 0.43 H new ATOM 0 HB2 PHE A 102 5.986 -6.813 -6.619 1.00 0.47 H new ATOM 0 HB3 PHE A 102 5.767 -8.152 -5.511 1.00 0.47 H new ATOM 0 HD1 PHE A 102 8.279 -9.660 -5.820 1.00 0.80 H new ATOM 0 HD2 PHE A 102 7.629 -5.450 -5.663 1.00 0.76 H new ATOM 0 HE1 PHE A 102 10.525 -9.344 -4.873 1.00 0.97 H new ATOM 0 HE2 PHE A 102 9.871 -5.142 -4.703 1.00 0.91 H new ATOM 0 HZ PHE A 102 11.439 -7.059 -4.655 1.00 0.99 H new ATOM 1557 N ASP A 103 4.134 -9.715 -7.321 1.00 0.35 N ATOM 1558 CA ASP A 103 2.736 -9.887 -7.676 1.00 0.34 C ATOM 1559 C ASP A 103 1.862 -9.237 -6.621 1.00 0.33 C ATOM 1560 O ASP A 103 2.122 -9.370 -5.433 1.00 0.40 O ATOM 1561 CB ASP A 103 2.425 -11.376 -7.830 1.00 0.45 C ATOM 1562 CG ASP A 103 0.950 -11.686 -7.954 1.00 0.86 C ATOM 1563 OD1 ASP A 103 0.437 -11.702 -9.087 1.00 1.46 O ATOM 1564 OD2 ASP A 103 0.297 -11.878 -6.911 1.00 1.53 O ATOM 0 H ASP A 103 4.448 -10.285 -6.536 1.00 0.35 H new ATOM 0 HA ASP A 103 2.528 -9.402 -8.630 1.00 0.34 H new ATOM 0 HB2 ASP A 103 2.941 -11.755 -8.712 1.00 0.45 H new ATOM 0 HB3 ASP A 103 2.827 -11.912 -6.970 1.00 0.45 H new ATOM 1569 N VAL A 104 0.846 -8.522 -7.065 1.00 0.30 N ATOM 1570 CA VAL A 104 0.004 -7.737 -6.175 1.00 0.31 C ATOM 1571 C VAL A 104 -1.465 -7.878 -6.547 1.00 0.28 C ATOM 1572 O VAL A 104 -1.870 -7.579 -7.679 1.00 0.30 O ATOM 1573 CB VAL A 104 0.424 -6.246 -6.180 1.00 0.36 C ATOM 1574 CG1 VAL A 104 -0.749 -5.336 -5.862 1.00 0.45 C ATOM 1575 CG2 VAL A 104 1.550 -6.017 -5.188 1.00 0.63 C ATOM 0 H VAL A 104 0.580 -8.467 -8.048 1.00 0.30 H new ATOM 0 HA VAL A 104 0.140 -8.125 -5.166 1.00 0.31 H new ATOM 0 HB VAL A 104 0.774 -6.000 -7.183 1.00 0.36 H new ATOM 0 HG11 VAL A 104 -0.418 -4.298 -5.874 1.00 0.45 H new ATOM 0 HG12 VAL A 104 -1.531 -5.476 -6.608 1.00 0.45 H new ATOM 0 HG13 VAL A 104 -1.142 -5.580 -4.875 1.00 0.45 H new ATOM 0 HG21 VAL A 104 1.837 -4.966 -5.200 1.00 0.63 H new ATOM 0 HG22 VAL A 104 1.215 -6.290 -4.188 1.00 0.63 H new ATOM 0 HG23 VAL A 104 2.408 -6.631 -5.463 1.00 0.63 H new ATOM 1585 N ARG A 105 -2.254 -8.332 -5.575 1.00 0.28 N ATOM 1586 CA ARG A 105 -3.663 -8.636 -5.787 1.00 0.26 C ATOM 1587 C ARG A 105 -4.548 -7.872 -4.805 1.00 0.28 C ATOM 1588 O ARG A 105 -4.211 -7.735 -3.633 1.00 0.39 O ATOM 1589 CB ARG A 105 -3.902 -10.134 -5.600 1.00 0.37 C ATOM 1590 CG ARG A 105 -2.771 -10.991 -6.133 1.00 0.64 C ATOM 1591 CD ARG A 105 -3.001 -12.466 -5.880 1.00 0.57 C ATOM 1592 NE ARG A 105 -1.846 -13.253 -6.304 1.00 1.11 N ATOM 1593 CZ ARG A 105 -1.844 -14.571 -6.461 1.00 1.36 C ATOM 1594 NH1 ARG A 105 -2.947 -15.278 -6.248 1.00 1.37 N ATOM 1595 NH2 ARG A 105 -0.734 -15.180 -6.852 1.00 1.95 N ATOM 0 H ARG A 105 -1.933 -8.498 -4.621 1.00 0.28 H new ATOM 0 HA ARG A 105 -3.921 -8.334 -6.802 1.00 0.26 H new ATOM 0 HB2 ARG A 105 -4.039 -10.344 -4.539 1.00 0.37 H new ATOM 0 HB3 ARG A 105 -4.828 -10.413 -6.102 1.00 0.37 H new ATOM 0 HG2 ARG A 105 -2.662 -10.821 -7.204 1.00 0.64 H new ATOM 0 HG3 ARG A 105 -1.835 -10.686 -5.665 1.00 0.64 H new ATOM 0 HD2 ARG A 105 -3.190 -12.632 -4.819 1.00 0.57 H new ATOM 0 HD3 ARG A 105 -3.889 -12.797 -6.418 1.00 0.57 H new ATOM 0 HE ARG A 105 -0.977 -12.753 -6.493 1.00 1.11 H new ATOM 0 HH11 ARG A 105 -3.806 -14.809 -5.961 1.00 1.37 H new ATOM 0 HH12 ARG A 105 -2.936 -16.290 -6.371 1.00 1.37 H new ATOM 0 HH21 ARG A 105 0.110 -14.636 -7.030 1.00 1.95 H new ATOM 0 HH22 ARG A 105 -0.724 -16.193 -6.975 1.00 1.95 H new ATOM 1609 N VAL A 106 -5.680 -7.387 -5.296 1.00 0.28 N ATOM 1610 CA VAL A 106 -6.685 -6.760 -4.455 1.00 0.31 C ATOM 1611 C VAL A 106 -7.985 -7.566 -4.520 1.00 0.28 C ATOM 1612 O VAL A 106 -8.696 -7.554 -5.525 1.00 0.34 O ATOM 1613 CB VAL A 106 -6.917 -5.278 -4.846 1.00 0.39 C ATOM 1614 CG1 VAL A 106 -7.310 -5.137 -6.307 1.00 1.44 C ATOM 1615 CG2 VAL A 106 -7.959 -4.638 -3.947 1.00 1.41 C ATOM 0 H VAL A 106 -5.925 -7.418 -6.286 1.00 0.28 H new ATOM 0 HA VAL A 106 -6.324 -6.758 -3.427 1.00 0.31 H new ATOM 0 HB VAL A 106 -5.972 -4.753 -4.707 1.00 0.39 H new ATOM 0 HG11 VAL A 106 -7.464 -4.084 -6.542 1.00 1.44 H new ATOM 0 HG12 VAL A 106 -6.516 -5.538 -6.938 1.00 1.44 H new ATOM 0 HG13 VAL A 106 -8.232 -5.688 -6.491 1.00 1.44 H new ATOM 0 HG21 VAL A 106 -8.104 -3.599 -4.241 1.00 1.41 H new ATOM 0 HG22 VAL A 106 -8.902 -5.177 -4.042 1.00 1.41 H new ATOM 0 HG23 VAL A 106 -7.620 -4.678 -2.912 1.00 1.41 H new ATOM 1625 N ASN A 107 -8.256 -8.311 -3.451 1.00 0.28 N ATOM 1626 CA ASN A 107 -9.360 -9.273 -3.423 1.00 0.28 C ATOM 1627 C ASN A 107 -9.106 -10.321 -4.502 1.00 0.29 C ATOM 1628 O ASN A 107 -9.989 -10.720 -5.255 1.00 0.38 O ATOM 1629 CB ASN A 107 -10.719 -8.570 -3.604 1.00 0.30 C ATOM 1630 CG ASN A 107 -11.914 -9.510 -3.521 1.00 0.96 C ATOM 1631 OD1 ASN A 107 -12.432 -9.968 -4.538 1.00 1.57 O ATOM 1632 ND2 ASN A 107 -12.364 -9.806 -2.309 1.00 1.65 N ATOM 0 H ASN A 107 -7.721 -8.267 -2.583 1.00 0.28 H new ATOM 0 HA ASN A 107 -9.404 -9.764 -2.451 1.00 0.28 H new ATOM 0 HB2 ASN A 107 -10.822 -7.798 -2.841 1.00 0.30 H new ATOM 0 HB3 ASN A 107 -10.731 -8.067 -4.571 1.00 0.30 H new ATOM 0 HD21 ASN A 107 -13.163 -10.431 -2.200 1.00 1.65 H new ATOM 0 HD22 ASN A 107 -11.911 -9.409 -1.486 1.00 1.65 H new ATOM 1639 N GLY A 108 -7.848 -10.728 -4.595 1.00 0.29 N ATOM 1640 CA GLY A 108 -7.466 -11.719 -5.570 1.00 0.35 C ATOM 1641 C GLY A 108 -7.084 -11.110 -6.904 1.00 0.32 C ATOM 1642 O GLY A 108 -6.369 -11.723 -7.695 1.00 0.42 O ATOM 0 H GLY A 108 -7.086 -10.386 -4.009 1.00 0.29 H new ATOM 0 HA2 GLY A 108 -6.626 -12.297 -5.185 1.00 0.35 H new ATOM 0 HA3 GLY A 108 -8.291 -12.416 -5.716 1.00 0.35 H new ATOM 1646 N HIS A 109 -7.551 -9.895 -7.138 1.00 0.26 N ATOM 1647 CA HIS A 109 -7.373 -9.219 -8.412 1.00 0.27 C ATOM 1648 C HIS A 109 -5.944 -8.730 -8.595 1.00 0.23 C ATOM 1649 O HIS A 109 -5.542 -7.744 -7.986 1.00 0.24 O ATOM 1650 CB HIS A 109 -8.328 -8.033 -8.489 1.00 0.33 C ATOM 1651 CG HIS A 109 -9.758 -8.416 -8.699 1.00 0.44 C ATOM 1652 ND1 HIS A 109 -10.332 -8.496 -9.940 1.00 0.57 N ATOM 1653 CD2 HIS A 109 -10.729 -8.743 -7.815 1.00 0.53 C ATOM 1654 CE1 HIS A 109 -11.594 -8.853 -9.818 1.00 0.68 C ATOM 1655 NE2 HIS A 109 -11.864 -9.014 -8.536 1.00 0.65 N ATOM 0 H HIS A 109 -8.066 -9.348 -6.448 1.00 0.26 H new ATOM 0 HA HIS A 109 -7.587 -9.933 -9.207 1.00 0.27 H new ATOM 0 HB2 HIS A 109 -8.249 -7.456 -7.568 1.00 0.33 H new ATOM 0 HB3 HIS A 109 -8.014 -7.379 -9.303 1.00 0.33 H new ATOM 0 HD1 HIS A 109 -9.856 -8.308 -10.822 1.00 0.57 H new ATOM 0 HD2 HIS A 109 -10.629 -8.783 -6.740 1.00 0.53 H new ATOM 0 HE1 HIS A 109 -12.291 -8.991 -10.631 1.00 0.68 H new ATOM 1664 N THR A 110 -5.185 -9.414 -9.434 1.00 0.27 N ATOM 1665 CA THR A 110 -3.811 -9.024 -9.706 1.00 0.30 C ATOM 1666 C THR A 110 -3.746 -7.735 -10.513 1.00 0.30 C ATOM 1667 O THR A 110 -3.794 -7.753 -11.743 1.00 0.48 O ATOM 1668 CB THR A 110 -3.047 -10.126 -10.454 1.00 0.40 C ATOM 1669 OG1 THR A 110 -3.900 -10.751 -11.426 1.00 0.77 O ATOM 1670 CG2 THR A 110 -2.520 -11.163 -9.486 1.00 0.61 C ATOM 0 H THR A 110 -5.497 -10.243 -9.939 1.00 0.27 H new ATOM 0 HA THR A 110 -3.339 -8.862 -8.737 1.00 0.30 H new ATOM 0 HB THR A 110 -2.201 -9.668 -10.966 1.00 0.40 H new ATOM 0 HG1 THR A 110 -4.325 -10.063 -11.979 1.00 0.77 H new ATOM 0 HG21 THR A 110 -1.982 -11.935 -10.037 1.00 0.61 H new ATOM 0 HG22 THR A 110 -1.845 -10.687 -8.775 1.00 0.61 H new ATOM 0 HG23 THR A 110 -3.353 -11.615 -8.948 1.00 0.61 H new ATOM 1678 N VAL A 111 -3.646 -6.619 -9.812 1.00 0.26 N ATOM 1679 CA VAL A 111 -3.540 -5.324 -10.459 1.00 0.29 C ATOM 1680 C VAL A 111 -2.134 -5.130 -10.993 1.00 0.29 C ATOM 1681 O VAL A 111 -1.941 -4.637 -12.105 1.00 0.38 O ATOM 1682 CB VAL A 111 -3.875 -4.175 -9.490 1.00 0.32 C ATOM 1683 CG1 VAL A 111 -3.957 -2.848 -10.231 1.00 0.93 C ATOM 1684 CG2 VAL A 111 -5.165 -4.463 -8.748 1.00 0.94 C ATOM 0 H VAL A 111 -3.636 -6.584 -8.793 1.00 0.26 H new ATOM 0 HA VAL A 111 -4.260 -5.304 -11.277 1.00 0.29 H new ATOM 0 HB VAL A 111 -3.071 -4.100 -8.757 1.00 0.32 H new ATOM 0 HG11 VAL A 111 -4.195 -2.052 -9.526 1.00 0.93 H new ATOM 0 HG12 VAL A 111 -2.999 -2.637 -10.707 1.00 0.93 H new ATOM 0 HG13 VAL A 111 -4.736 -2.904 -10.992 1.00 0.93 H new ATOM 0 HG21 VAL A 111 -5.385 -3.640 -8.068 1.00 0.94 H new ATOM 0 HG22 VAL A 111 -5.980 -4.570 -9.464 1.00 0.94 H new ATOM 0 HG23 VAL A 111 -5.059 -5.386 -8.178 1.00 0.94 H new ATOM 1694 N VAL A 112 -1.149 -5.530 -10.201 1.00 0.27 N ATOM 1695 CA VAL A 112 0.239 -5.398 -10.610 1.00 0.28 C ATOM 1696 C VAL A 112 0.983 -6.695 -10.359 1.00 0.28 C ATOM 1697 O VAL A 112 1.528 -6.913 -9.281 1.00 0.27 O ATOM 1698 CB VAL A 112 0.970 -4.262 -9.861 1.00 0.29 C ATOM 1699 CG1 VAL A 112 2.309 -3.964 -10.521 1.00 0.35 C ATOM 1700 CG2 VAL A 112 0.114 -3.009 -9.791 1.00 0.33 C ATOM 0 H VAL A 112 -1.285 -5.945 -9.279 1.00 0.27 H new ATOM 0 HA VAL A 112 0.229 -5.157 -11.673 1.00 0.28 H new ATOM 0 HB VAL A 112 1.154 -4.596 -8.840 1.00 0.29 H new ATOM 0 HG11 VAL A 112 2.810 -3.161 -9.980 1.00 0.35 H new ATOM 0 HG12 VAL A 112 2.931 -4.859 -10.501 1.00 0.35 H new ATOM 0 HG13 VAL A 112 2.145 -3.658 -11.554 1.00 0.35 H new ATOM 0 HG21 VAL A 112 0.656 -2.228 -9.258 1.00 0.33 H new ATOM 0 HG22 VAL A 112 -0.115 -2.668 -10.801 1.00 0.33 H new ATOM 0 HG23 VAL A 112 -0.814 -3.231 -9.264 1.00 0.33 H new ATOM 1710 N LYS A 113 0.998 -7.554 -11.355 1.00 0.33 N ATOM 1711 CA LYS A 113 1.761 -8.783 -11.275 1.00 0.37 C ATOM 1712 C LYS A 113 3.016 -8.667 -12.130 1.00 0.41 C ATOM 1713 O LYS A 113 3.156 -9.321 -13.166 1.00 0.68 O ATOM 1714 CB LYS A 113 0.890 -9.976 -11.700 1.00 0.44 C ATOM 1715 CG LYS A 113 -0.262 -9.632 -12.653 1.00 1.24 C ATOM 1716 CD LYS A 113 0.203 -9.040 -13.977 1.00 2.09 C ATOM 1717 CE LYS A 113 0.761 -10.101 -14.903 1.00 3.07 C ATOM 1718 NZ LYS A 113 1.359 -9.497 -16.125 1.00 4.01 N ATOM 0 H LYS A 113 0.491 -7.425 -12.230 1.00 0.33 H new ATOM 0 HA LYS A 113 2.072 -8.954 -10.244 1.00 0.37 H new ATOM 0 HB2 LYS A 113 1.527 -10.719 -12.178 1.00 0.44 H new ATOM 0 HB3 LYS A 113 0.475 -10.440 -10.805 1.00 0.44 H new ATOM 0 HG2 LYS A 113 -0.842 -10.534 -12.851 1.00 1.24 H new ATOM 0 HG3 LYS A 113 -0.930 -8.925 -12.162 1.00 1.24 H new ATOM 0 HD2 LYS A 113 -0.632 -8.536 -14.463 1.00 2.09 H new ATOM 0 HD3 LYS A 113 0.965 -8.284 -13.789 1.00 2.09 H new ATOM 0 HE2 LYS A 113 1.517 -10.684 -14.377 1.00 3.07 H new ATOM 0 HE3 LYS A 113 -0.033 -10.791 -15.188 1.00 3.07 H new ATOM 0 HZ1 LYS A 113 1.732 -10.250 -16.738 1.00 4.01 H new ATOM 0 HZ2 LYS A 113 0.631 -8.961 -16.639 1.00 4.01 H new ATOM 0 HZ3 LYS A 113 2.133 -8.857 -15.853 1.00 4.01 H new ATOM 1732 N ASP A 114 3.938 -7.867 -11.613 1.00 0.39 N ATOM 1733 CA ASP A 114 5.217 -7.543 -12.252 1.00 0.45 C ATOM 1734 C ASP A 114 5.766 -6.275 -11.605 1.00 0.38 C ATOM 1735 O ASP A 114 6.442 -5.469 -12.241 1.00 0.45 O ATOM 1736 CB ASP A 114 5.080 -7.345 -13.777 1.00 0.63 C ATOM 1737 CG ASP A 114 4.366 -6.064 -14.174 1.00 1.33 C ATOM 1738 OD1 ASP A 114 3.205 -5.880 -13.753 1.00 1.52 O ATOM 1739 OD2 ASP A 114 4.961 -5.231 -14.884 1.00 1.96 O ATOM 0 H ASP A 114 3.818 -7.409 -10.710 1.00 0.39 H new ATOM 0 HA ASP A 114 5.899 -8.381 -12.107 1.00 0.45 H new ATOM 0 HB2 ASP A 114 6.074 -7.348 -14.224 1.00 0.63 H new ATOM 0 HB3 ASP A 114 4.540 -8.194 -14.196 1.00 0.63 H new ATOM 1744 N LEU A 115 5.466 -6.128 -10.315 1.00 0.33 N ATOM 1745 CA LEU A 115 5.800 -4.933 -9.556 1.00 0.34 C ATOM 1746 C LEU A 115 7.303 -4.824 -9.339 1.00 0.37 C ATOM 1747 O LEU A 115 7.834 -5.274 -8.325 1.00 0.47 O ATOM 1748 CB LEU A 115 5.058 -4.935 -8.210 1.00 0.38 C ATOM 1749 CG LEU A 115 4.547 -3.574 -7.738 1.00 0.45 C ATOM 1750 CD1 LEU A 115 4.277 -3.634 -6.258 1.00 1.18 C ATOM 1751 CD2 LEU A 115 5.525 -2.453 -8.060 1.00 1.07 C ATOM 0 H LEU A 115 4.982 -6.840 -9.768 1.00 0.33 H new ATOM 0 HA LEU A 115 5.482 -4.063 -10.131 1.00 0.34 H new ATOM 0 HB2 LEU A 115 4.210 -5.616 -8.283 1.00 0.38 H new ATOM 0 HB3 LEU A 115 5.725 -5.337 -7.448 1.00 0.38 H new ATOM 0 HG LEU A 115 3.624 -3.350 -8.273 1.00 0.45 H new ATOM 0 HD11 LEU A 115 3.912 -2.666 -5.915 1.00 1.18 H new ATOM 0 HD12 LEU A 115 3.526 -4.397 -6.056 1.00 1.18 H new ATOM 0 HD13 LEU A 115 5.198 -3.882 -5.730 1.00 1.18 H new ATOM 0 HD21 LEU A 115 5.121 -1.505 -7.707 1.00 1.07 H new ATOM 0 HD22 LEU A 115 6.477 -2.648 -7.567 1.00 1.07 H new ATOM 0 HD23 LEU A 115 5.679 -2.403 -9.138 1.00 1.07 H new ATOM 1763 N ASP A 116 7.978 -4.252 -10.314 1.00 0.39 N ATOM 1764 CA ASP A 116 9.386 -3.933 -10.200 1.00 0.44 C ATOM 1765 C ASP A 116 9.547 -2.462 -9.823 1.00 0.43 C ATOM 1766 O ASP A 116 9.647 -1.583 -10.682 1.00 0.48 O ATOM 1767 CB ASP A 116 10.129 -4.271 -11.503 1.00 0.53 C ATOM 1768 CG ASP A 116 9.520 -3.662 -12.761 1.00 1.28 C ATOM 1769 OD1 ASP A 116 8.315 -3.349 -12.736 1.00 1.93 O ATOM 1770 OD2 ASP A 116 10.243 -3.461 -13.765 1.00 1.83 O ATOM 0 H ASP A 116 7.565 -3.994 -11.210 1.00 0.39 H new ATOM 0 HA ASP A 116 9.831 -4.540 -9.412 1.00 0.44 H new ATOM 0 HB2 ASP A 116 11.161 -3.932 -11.415 1.00 0.53 H new ATOM 0 HB3 ASP A 116 10.158 -5.355 -11.618 1.00 0.53 H new ATOM 1775 N ILE A 117 9.553 -2.201 -8.520 1.00 0.44 N ATOM 1776 CA ILE A 117 9.549 -0.837 -7.997 1.00 0.46 C ATOM 1777 C ILE A 117 10.771 -0.058 -8.479 1.00 0.48 C ATOM 1778 O ILE A 117 10.667 1.124 -8.818 1.00 0.51 O ATOM 1779 CB ILE A 117 9.506 -0.832 -6.454 1.00 0.52 C ATOM 1780 CG1 ILE A 117 8.335 -1.679 -5.949 1.00 0.56 C ATOM 1781 CG2 ILE A 117 9.399 0.590 -5.922 1.00 0.58 C ATOM 1782 CD1 ILE A 117 8.313 -1.852 -4.446 1.00 0.82 C ATOM 0 H ILE A 117 9.561 -2.923 -7.800 1.00 0.44 H new ATOM 0 HA ILE A 117 8.650 -0.350 -8.375 1.00 0.46 H new ATOM 0 HB ILE A 117 10.435 -1.267 -6.085 1.00 0.52 H new ATOM 0 HG12 ILE A 117 7.400 -1.217 -6.266 1.00 0.56 H new ATOM 0 HG13 ILE A 117 8.380 -2.662 -6.418 1.00 0.56 H new ATOM 0 HG21 ILE A 117 9.370 0.570 -4.833 1.00 0.58 H new ATOM 0 HG22 ILE A 117 10.263 1.168 -6.251 1.00 0.58 H new ATOM 0 HG23 ILE A 117 8.487 1.052 -6.300 1.00 0.58 H new ATOM 0 HD11 ILE A 117 7.456 -2.463 -4.163 1.00 0.82 H new ATOM 0 HD12 ILE A 117 9.231 -2.343 -4.123 1.00 0.82 H new ATOM 0 HD13 ILE A 117 8.236 -0.875 -3.968 1.00 0.82 H new ATOM 1794 N PHE A 118 11.917 -0.731 -8.513 1.00 0.54 N ATOM 1795 CA PHE A 118 13.161 -0.147 -9.015 1.00 0.62 C ATOM 1796 C PHE A 118 12.979 0.450 -10.413 1.00 0.65 C ATOM 1797 O PHE A 118 13.559 1.482 -10.734 1.00 0.74 O ATOM 1798 CB PHE A 118 14.265 -1.210 -9.027 1.00 0.70 C ATOM 1799 CG PHE A 118 15.600 -0.691 -9.478 1.00 0.81 C ATOM 1800 CD1 PHE A 118 16.351 0.130 -8.655 1.00 0.89 C ATOM 1801 CD2 PHE A 118 16.106 -1.026 -10.724 1.00 0.92 C ATOM 1802 CE1 PHE A 118 17.578 0.612 -9.065 1.00 1.02 C ATOM 1803 CE2 PHE A 118 17.332 -0.547 -11.138 1.00 1.06 C ATOM 1804 CZ PHE A 118 18.068 0.272 -10.308 1.00 1.08 C ATOM 0 H PHE A 118 12.012 -1.695 -8.194 1.00 0.54 H new ATOM 0 HA PHE A 118 13.449 0.665 -8.347 1.00 0.62 H new ATOM 0 HB2 PHE A 118 14.367 -1.626 -8.025 1.00 0.70 H new ATOM 0 HB3 PHE A 118 13.963 -2.027 -9.682 1.00 0.70 H new ATOM 0 HD1 PHE A 118 15.972 0.397 -7.679 1.00 0.89 H new ATOM 0 HD2 PHE A 118 15.535 -1.669 -11.378 1.00 0.92 H new ATOM 0 HE1 PHE A 118 18.153 1.254 -8.414 1.00 1.02 H new ATOM 0 HE2 PHE A 118 17.715 -0.814 -12.112 1.00 1.06 H new ATOM 0 HZ PHE A 118 19.028 0.647 -10.631 1.00 1.08 H new ATOM 1814 N ASP A 119 12.182 -0.194 -11.251 1.00 0.61 N ATOM 1815 CA ASP A 119 11.900 0.342 -12.580 1.00 0.68 C ATOM 1816 C ASP A 119 10.952 1.530 -12.502 1.00 0.69 C ATOM 1817 O ASP A 119 11.097 2.508 -13.235 1.00 0.81 O ATOM 1818 CB ASP A 119 11.293 -0.725 -13.484 1.00 0.68 C ATOM 1819 CG ASP A 119 10.961 -0.193 -14.866 1.00 0.82 C ATOM 1820 OD1 ASP A 119 11.875 -0.109 -15.717 1.00 0.96 O ATOM 1821 OD2 ASP A 119 9.779 0.130 -15.117 1.00 0.89 O ATOM 0 H ASP A 119 11.722 -1.080 -11.041 1.00 0.61 H new ATOM 0 HA ASP A 119 12.850 0.670 -13.002 1.00 0.68 H new ATOM 0 HB2 ASP A 119 11.990 -1.558 -13.576 1.00 0.68 H new ATOM 0 HB3 ASP A 119 10.387 -1.117 -13.021 1.00 0.68 H new ATOM 1826 N ARG A 120 9.997 1.445 -11.586 1.00 0.61 N ATOM 1827 CA ARG A 120 8.908 2.409 -11.527 1.00 0.66 C ATOM 1828 C ARG A 120 9.395 3.748 -10.991 1.00 0.75 C ATOM 1829 O ARG A 120 9.171 4.789 -11.603 1.00 0.97 O ATOM 1830 CB ARG A 120 7.772 1.883 -10.645 1.00 0.63 C ATOM 1831 CG ARG A 120 7.369 0.449 -10.951 1.00 0.59 C ATOM 1832 CD ARG A 120 6.942 0.266 -12.399 1.00 0.72 C ATOM 1833 NE ARG A 120 6.738 -1.143 -12.724 1.00 1.02 N ATOM 1834 CZ ARG A 120 5.607 -1.647 -13.211 1.00 1.31 C ATOM 1835 NH1 ARG A 120 4.577 -0.852 -13.480 1.00 1.69 N ATOM 1836 NH2 ARG A 120 5.517 -2.949 -13.433 1.00 1.65 N ATOM 0 H ARG A 120 9.955 0.717 -10.873 1.00 0.61 H new ATOM 0 HA ARG A 120 8.535 2.553 -12.541 1.00 0.66 H new ATOM 0 HB2 ARG A 120 8.075 1.950 -9.600 1.00 0.63 H new ATOM 0 HB3 ARG A 120 6.902 2.528 -10.766 1.00 0.63 H new ATOM 0 HG2 ARG A 120 8.206 -0.215 -10.735 1.00 0.59 H new ATOM 0 HG3 ARG A 120 6.551 0.156 -10.293 1.00 0.59 H new ATOM 0 HD2 ARG A 120 6.020 0.819 -12.580 1.00 0.72 H new ATOM 0 HD3 ARG A 120 7.701 0.686 -13.059 1.00 0.72 H new ATOM 0 HE ARG A 120 7.515 -1.784 -12.567 1.00 1.02 H new ATOM 0 HH11 ARG A 120 4.650 0.152 -13.313 1.00 1.69 H new ATOM 0 HH12 ARG A 120 3.713 -1.245 -13.853 1.00 1.69 H new ATOM 0 HH21 ARG A 120 6.311 -3.557 -13.231 1.00 1.65 H new ATOM 0 HH22 ARG A 120 4.654 -3.344 -13.806 1.00 1.65 H new ATOM 1850 N VAL A 121 10.061 3.716 -9.848 1.00 0.65 N ATOM 1851 CA VAL A 121 10.540 4.945 -9.221 1.00 0.75 C ATOM 1852 C VAL A 121 12.021 5.182 -9.497 1.00 0.80 C ATOM 1853 O VAL A 121 12.500 6.315 -9.430 1.00 0.95 O ATOM 1854 CB VAL A 121 10.295 4.951 -7.698 1.00 0.79 C ATOM 1855 CG1 VAL A 121 8.806 4.980 -7.404 1.00 1.42 C ATOM 1856 CG2 VAL A 121 10.948 3.748 -7.035 1.00 1.49 C ATOM 0 H VAL A 121 10.283 2.862 -9.336 1.00 0.65 H new ATOM 0 HA VAL A 121 9.965 5.755 -9.669 1.00 0.75 H new ATOM 0 HB VAL A 121 10.750 5.850 -7.283 1.00 0.79 H new ATOM 0 HG11 VAL A 121 8.648 4.984 -6.326 1.00 1.42 H new ATOM 0 HG12 VAL A 121 8.367 5.878 -7.838 1.00 1.42 H new ATOM 0 HG13 VAL A 121 8.332 4.099 -7.837 1.00 1.42 H new ATOM 0 HG21 VAL A 121 10.760 3.777 -5.962 1.00 1.49 H new ATOM 0 HG22 VAL A 121 10.530 2.832 -7.452 1.00 1.49 H new ATOM 0 HG23 VAL A 121 12.023 3.772 -7.215 1.00 1.49 H new ATOM 1866 N GLY A 122 12.747 4.117 -9.802 1.00 0.76 N ATOM 1867 CA GLY A 122 14.150 4.259 -10.110 1.00 0.89 C ATOM 1868 C GLY A 122 15.012 4.220 -8.870 1.00 1.00 C ATOM 1869 O GLY A 122 15.543 3.175 -8.503 1.00 1.40 O ATOM 0 H GLY A 122 12.390 3.162 -9.841 1.00 0.76 H new ATOM 0 HA2 GLY A 122 14.454 3.461 -10.787 1.00 0.89 H new ATOM 0 HA3 GLY A 122 14.312 5.201 -10.634 1.00 0.89 H new ATOM 1873 N HIS A 123 15.137 5.356 -8.211 1.00 1.10 N ATOM 1874 CA HIS A 123 16.004 5.453 -7.053 1.00 1.36 C ATOM 1875 C HIS A 123 15.199 5.732 -5.788 1.00 1.08 C ATOM 1876 O HIS A 123 14.727 6.849 -5.582 1.00 1.41 O ATOM 1877 CB HIS A 123 17.046 6.555 -7.280 1.00 2.01 C ATOM 1878 CG HIS A 123 18.026 6.704 -6.159 1.00 2.61 C ATOM 1879 ND1 HIS A 123 17.968 7.728 -5.242 1.00 3.35 N ATOM 1880 CD2 HIS A 123 19.088 5.946 -5.807 1.00 3.26 C ATOM 1881 CE1 HIS A 123 18.950 7.592 -4.372 1.00 4.11 C ATOM 1882 NE2 HIS A 123 19.646 6.517 -4.691 1.00 4.08 N ATOM 0 H HIS A 123 14.652 6.220 -8.456 1.00 1.10 H new ATOM 0 HA HIS A 123 16.514 4.499 -6.919 1.00 1.36 H new ATOM 0 HB2 HIS A 123 17.591 6.342 -8.200 1.00 2.01 H new ATOM 0 HB3 HIS A 123 16.530 7.504 -7.427 1.00 2.01 H new ATOM 0 HD2 HIS A 123 19.434 5.055 -6.311 1.00 3.26 H new ATOM 0 HE1 HIS A 123 19.151 8.249 -3.539 1.00 4.11 H new ATOM 0 HE2 HIS A 123 20.464 6.168 -4.191 1.00 4.08 H new ATOM 1891 N SER A 124 15.092 4.714 -4.932 1.00 1.19 N ATOM 1892 CA SER A 124 14.407 4.819 -3.637 1.00 1.00 C ATOM 1893 C SER A 124 13.066 5.557 -3.755 1.00 1.02 C ATOM 1894 O SER A 124 12.209 5.167 -4.545 1.00 1.97 O ATOM 1895 CB SER A 124 15.322 5.499 -2.604 1.00 1.06 C ATOM 1896 OG SER A 124 15.750 6.778 -3.048 1.00 1.72 O ATOM 0 H SER A 124 15.479 3.788 -5.116 1.00 1.19 H new ATOM 0 HA SER A 124 14.184 3.808 -3.296 1.00 1.00 H new ATOM 0 HB2 SER A 124 14.791 5.600 -1.658 1.00 1.06 H new ATOM 0 HB3 SER A 124 16.191 4.869 -2.416 1.00 1.06 H new ATOM 0 HG SER A 124 16.521 6.676 -3.644 1.00 1.72 H new ATOM 1902 N THR A 125 12.913 6.631 -2.971 1.00 0.66 N ATOM 1903 CA THR A 125 11.712 7.471 -2.962 1.00 0.53 C ATOM 1904 C THR A 125 10.432 6.659 -2.731 1.00 0.48 C ATOM 1905 O THR A 125 10.483 5.495 -2.338 1.00 0.60 O ATOM 1906 CB THR A 125 11.586 8.322 -4.251 1.00 0.60 C ATOM 1907 OG1 THR A 125 11.451 7.499 -5.413 1.00 0.81 O ATOM 1908 CG2 THR A 125 12.794 9.232 -4.416 1.00 0.85 C ATOM 0 H THR A 125 13.630 6.944 -2.317 1.00 0.66 H new ATOM 0 HA THR A 125 11.831 8.151 -2.118 1.00 0.53 H new ATOM 0 HB THR A 125 10.686 8.929 -4.148 1.00 0.60 H new ATOM 0 HG1 THR A 125 11.337 6.565 -5.141 1.00 0.81 H new ATOM 0 HG21 THR A 125 12.685 9.820 -5.327 1.00 0.85 H new ATOM 0 HG22 THR A 125 12.865 9.901 -3.558 1.00 0.85 H new ATOM 0 HG23 THR A 125 13.699 8.628 -4.481 1.00 0.85 H new ATOM 1916 N ALA A 126 9.284 7.293 -2.924 1.00 0.44 N ATOM 1917 CA ALA A 126 8.008 6.633 -2.689 1.00 0.45 C ATOM 1918 C ALA A 126 7.367 6.143 -3.975 1.00 0.40 C ATOM 1919 O ALA A 126 7.218 6.896 -4.937 1.00 0.50 O ATOM 1920 CB ALA A 126 7.044 7.563 -1.975 1.00 0.57 C ATOM 0 H ALA A 126 9.210 8.260 -3.241 1.00 0.44 H new ATOM 0 HA ALA A 126 8.219 5.767 -2.062 1.00 0.45 H new ATOM 0 HB1 ALA A 126 6.097 7.049 -1.810 1.00 0.57 H new ATOM 0 HB2 ALA A 126 7.468 7.860 -1.016 1.00 0.57 H new ATOM 0 HB3 ALA A 126 6.874 8.449 -2.586 1.00 0.57 H new ATOM 1926 N HIS A 127 6.979 4.881 -3.976 1.00 0.33 N ATOM 1927 CA HIS A 127 6.147 4.339 -5.034 1.00 0.32 C ATOM 1928 C HIS A 127 4.724 4.259 -4.504 1.00 0.34 C ATOM 1929 O HIS A 127 4.531 4.073 -3.311 1.00 0.55 O ATOM 1930 CB HIS A 127 6.648 2.948 -5.458 1.00 0.34 C ATOM 1931 CG HIS A 127 5.835 2.301 -6.543 1.00 0.38 C ATOM 1932 ND1 HIS A 127 5.460 2.945 -7.700 1.00 0.44 N ATOM 1933 CD2 HIS A 127 5.303 1.059 -6.624 1.00 0.48 C ATOM 1934 CE1 HIS A 127 4.730 2.131 -8.438 1.00 0.50 C ATOM 1935 NE2 HIS A 127 4.619 0.978 -7.809 1.00 0.51 N ATOM 0 H HIS A 127 7.229 4.209 -3.251 1.00 0.33 H new ATOM 0 HA HIS A 127 6.187 4.980 -5.915 1.00 0.32 H new ATOM 0 HB2 HIS A 127 7.680 3.034 -5.797 1.00 0.34 H new ATOM 0 HB3 HIS A 127 6.652 2.295 -4.585 1.00 0.34 H new ATOM 0 HD2 HIS A 127 5.400 0.274 -5.888 1.00 0.48 H new ATOM 0 HE1 HIS A 127 4.296 2.370 -9.398 1.00 0.50 H new ATOM 0 HE2 HIS A 127 4.109 0.162 -8.148 1.00 0.51 H new ATOM 1944 N ASP A 128 3.732 4.438 -5.353 1.00 0.38 N ATOM 1945 CA ASP A 128 2.356 4.318 -4.903 1.00 0.47 C ATOM 1946 C ASP A 128 1.476 3.674 -5.947 1.00 0.46 C ATOM 1947 O ASP A 128 1.463 4.076 -7.109 1.00 0.61 O ATOM 1948 CB ASP A 128 1.772 5.670 -4.477 1.00 0.66 C ATOM 1949 CG ASP A 128 2.007 6.781 -5.480 1.00 0.99 C ATOM 1950 OD1 ASP A 128 1.218 6.881 -6.444 1.00 1.36 O ATOM 1951 OD2 ASP A 128 2.984 7.537 -5.328 1.00 1.64 O ATOM 0 H ASP A 128 3.846 4.663 -6.341 1.00 0.38 H new ATOM 0 HA ASP A 128 2.376 3.668 -4.028 1.00 0.47 H new ATOM 0 HB2 ASP A 128 0.700 5.558 -4.318 1.00 0.66 H new ATOM 0 HB3 ASP A 128 2.208 5.958 -3.521 1.00 0.66 H new ATOM 1956 N GLU A 129 0.772 2.646 -5.521 1.00 0.40 N ATOM 1957 CA GLU A 129 -0.235 2.012 -6.341 1.00 0.41 C ATOM 1958 C GLU A 129 -1.599 2.539 -5.935 1.00 0.33 C ATOM 1959 O GLU A 129 -2.021 2.354 -4.795 1.00 0.39 O ATOM 1960 CB GLU A 129 -0.186 0.492 -6.164 1.00 0.53 C ATOM 1961 CG GLU A 129 0.175 -0.270 -7.429 1.00 0.97 C ATOM 1962 CD GLU A 129 1.578 0.033 -7.921 1.00 0.72 C ATOM 1963 OE1 GLU A 129 2.544 -0.509 -7.350 1.00 0.75 O ATOM 1964 OE2 GLU A 129 1.723 0.819 -8.880 1.00 1.12 O ATOM 0 H GLU A 129 0.883 2.228 -4.597 1.00 0.40 H new ATOM 0 HA GLU A 129 -0.047 2.240 -7.390 1.00 0.41 H new ATOM 0 HB2 GLU A 129 0.540 0.251 -5.388 1.00 0.53 H new ATOM 0 HB3 GLU A 129 -1.157 0.147 -5.810 1.00 0.53 H new ATOM 0 HG2 GLU A 129 0.085 -1.340 -7.241 1.00 0.97 H new ATOM 0 HG3 GLU A 129 -0.541 -0.023 -8.213 1.00 0.97 H new ATOM 1971 N ILE A 130 -2.260 3.237 -6.840 1.00 0.28 N ATOM 1972 CA ILE A 130 -3.598 3.741 -6.582 1.00 0.24 C ATOM 1973 C ILE A 130 -4.614 2.842 -7.272 1.00 0.25 C ATOM 1974 O ILE A 130 -4.743 2.863 -8.496 1.00 0.31 O ATOM 1975 CB ILE A 130 -3.764 5.195 -7.079 1.00 0.29 C ATOM 1976 CG1 ILE A 130 -2.706 6.098 -6.441 1.00 0.39 C ATOM 1977 CG2 ILE A 130 -5.165 5.708 -6.766 1.00 0.31 C ATOM 1978 CD1 ILE A 130 -2.741 7.527 -6.940 1.00 0.74 C ATOM 0 H ILE A 130 -1.892 3.469 -7.763 1.00 0.28 H new ATOM 0 HA ILE A 130 -3.763 3.737 -5.505 1.00 0.24 H new ATOM 0 HB ILE A 130 -3.626 5.211 -8.160 1.00 0.29 H new ATOM 0 HG12 ILE A 130 -2.845 6.097 -5.360 1.00 0.39 H new ATOM 0 HG13 ILE A 130 -1.719 5.679 -6.636 1.00 0.39 H new ATOM 0 HG21 ILE A 130 -5.265 6.733 -7.123 1.00 0.31 H new ATOM 0 HG22 ILE A 130 -5.903 5.077 -7.262 1.00 0.31 H new ATOM 0 HG23 ILE A 130 -5.330 5.681 -5.689 1.00 0.31 H new ATOM 0 HD11 ILE A 130 -1.963 8.105 -6.442 1.00 0.74 H new ATOM 0 HD12 ILE A 130 -2.571 7.541 -8.017 1.00 0.74 H new ATOM 0 HD13 ILE A 130 -3.715 7.965 -6.721 1.00 0.74 H new ATOM 1990 N ILE A 131 -5.321 2.046 -6.489 1.00 0.24 N ATOM 1991 CA ILE A 131 -6.225 1.043 -7.035 1.00 0.28 C ATOM 1992 C ILE A 131 -7.669 1.334 -6.635 1.00 0.25 C ATOM 1993 O ILE A 131 -8.115 0.918 -5.565 1.00 0.26 O ATOM 1994 CB ILE A 131 -5.846 -0.372 -6.543 1.00 0.35 C ATOM 1995 CG1 ILE A 131 -4.364 -0.657 -6.817 1.00 0.40 C ATOM 1996 CG2 ILE A 131 -6.722 -1.421 -7.220 1.00 0.40 C ATOM 1997 CD1 ILE A 131 -3.871 -1.956 -6.216 1.00 1.25 C ATOM 0 H ILE A 131 -5.288 2.073 -5.470 1.00 0.24 H new ATOM 0 HA ILE A 131 -6.134 1.084 -8.120 1.00 0.28 H new ATOM 0 HB ILE A 131 -6.014 -0.420 -5.467 1.00 0.35 H new ATOM 0 HG12 ILE A 131 -4.201 -0.681 -7.895 1.00 0.40 H new ATOM 0 HG13 ILE A 131 -3.766 0.165 -6.423 1.00 0.40 H new ATOM 0 HG21 ILE A 131 -6.443 -2.413 -6.864 1.00 0.40 H new ATOM 0 HG22 ILE A 131 -7.768 -1.230 -6.981 1.00 0.40 H new ATOM 0 HG23 ILE A 131 -6.581 -1.371 -8.300 1.00 0.40 H new ATOM 0 HD11 ILE A 131 -2.815 -2.088 -6.452 1.00 1.25 H new ATOM 0 HD12 ILE A 131 -4.000 -1.929 -5.134 1.00 1.25 H new ATOM 0 HD13 ILE A 131 -4.442 -2.788 -6.629 1.00 1.25 H new ATOM 2009 N PRO A 132 -8.409 2.099 -7.455 1.00 0.24 N ATOM 2010 CA PRO A 132 -9.837 2.321 -7.247 1.00 0.23 C ATOM 2011 C PRO A 132 -10.679 1.124 -7.689 1.00 0.23 C ATOM 2012 O PRO A 132 -10.656 0.722 -8.858 1.00 0.25 O ATOM 2013 CB PRO A 132 -10.152 3.551 -8.115 1.00 0.26 C ATOM 2014 CG PRO A 132 -8.825 4.071 -8.557 1.00 0.29 C ATOM 2015 CD PRO A 132 -7.924 2.868 -8.605 1.00 0.28 C ATOM 0 HA PRO A 132 -10.073 2.464 -6.192 1.00 0.23 H new ATOM 0 HB2 PRO A 132 -10.773 3.281 -8.969 1.00 0.26 H new ATOM 0 HB3 PRO A 132 -10.700 4.303 -7.547 1.00 0.26 H new ATOM 0 HG2 PRO A 132 -8.895 4.549 -9.534 1.00 0.29 H new ATOM 0 HG3 PRO A 132 -8.445 4.820 -7.862 1.00 0.29 H new ATOM 0 HD2 PRO A 132 -8.024 2.317 -9.540 1.00 0.28 H new ATOM 0 HD3 PRO A 132 -6.873 3.138 -8.505 1.00 0.28 H new ATOM 2023 N ILE A 133 -11.407 0.562 -6.740 1.00 0.21 N ATOM 2024 CA ILE A 133 -12.328 -0.525 -6.998 1.00 0.21 C ATOM 2025 C ILE A 133 -13.740 0.013 -6.841 1.00 0.19 C ATOM 2026 O ILE A 133 -13.979 0.890 -6.020 1.00 0.26 O ATOM 2027 CB ILE A 133 -12.122 -1.710 -6.010 1.00 0.23 C ATOM 2028 CG1 ILE A 133 -12.985 -1.549 -4.756 1.00 0.25 C ATOM 2029 CG2 ILE A 133 -10.665 -1.817 -5.601 1.00 0.26 C ATOM 2030 CD1 ILE A 133 -12.732 -2.601 -3.695 1.00 0.27 C ATOM 0 H ILE A 133 -11.374 0.851 -5.762 1.00 0.21 H new ATOM 0 HA ILE A 133 -12.151 -0.903 -8.005 1.00 0.21 H new ATOM 0 HB ILE A 133 -12.424 -2.620 -6.529 1.00 0.23 H new ATOM 0 HG12 ILE A 133 -12.804 -0.564 -4.327 1.00 0.25 H new ATOM 0 HG13 ILE A 133 -14.036 -1.583 -5.044 1.00 0.25 H new ATOM 0 HG21 ILE A 133 -10.541 -2.651 -4.910 1.00 0.26 H new ATOM 0 HG22 ILE A 133 -10.050 -1.984 -6.485 1.00 0.26 H new ATOM 0 HG23 ILE A 133 -10.355 -0.893 -5.113 1.00 0.26 H new ATOM 0 HD11 ILE A 133 -13.382 -2.418 -2.839 1.00 0.27 H new ATOM 0 HD12 ILE A 133 -12.942 -3.589 -4.105 1.00 0.27 H new ATOM 0 HD13 ILE A 133 -11.691 -2.554 -3.377 1.00 0.27 H new ATOM 2042 N SER A 134 -14.662 -0.461 -7.637 1.00 0.19 N ATOM 2043 CA SER A 134 -16.018 -0.030 -7.508 1.00 0.21 C ATOM 2044 C SER A 134 -16.904 -1.184 -7.057 1.00 0.22 C ATOM 2045 O SER A 134 -17.169 -2.111 -7.824 1.00 0.25 O ATOM 2046 CB SER A 134 -16.477 0.521 -8.844 1.00 0.26 C ATOM 2047 OG SER A 134 -15.487 1.365 -9.413 1.00 1.24 O ATOM 0 H SER A 134 -14.494 -1.143 -8.377 1.00 0.19 H new ATOM 0 HA SER A 134 -16.091 0.751 -6.751 1.00 0.21 H new ATOM 0 HB2 SER A 134 -16.694 -0.302 -9.525 1.00 0.26 H new ATOM 0 HB3 SER A 134 -17.404 1.079 -8.712 1.00 0.26 H new ATOM 0 HG SER A 134 -15.724 2.302 -9.251 1.00 1.24 H new ATOM 2053 N ILE A 135 -17.338 -1.141 -5.805 1.00 0.23 N ATOM 2054 CA ILE A 135 -18.220 -2.171 -5.275 1.00 0.25 C ATOM 2055 C ILE A 135 -19.657 -1.676 -5.291 1.00 0.29 C ATOM 2056 O ILE A 135 -19.967 -0.654 -4.685 1.00 0.34 O ATOM 2057 CB ILE A 135 -17.863 -2.584 -3.829 1.00 0.26 C ATOM 2058 CG1 ILE A 135 -16.405 -3.026 -3.738 1.00 0.28 C ATOM 2059 CG2 ILE A 135 -18.784 -3.701 -3.347 1.00 0.30 C ATOM 2060 CD1 ILE A 135 -16.019 -3.547 -2.371 1.00 0.32 C ATOM 0 H ILE A 135 -17.095 -0.407 -5.140 1.00 0.23 H new ATOM 0 HA ILE A 135 -18.096 -3.045 -5.915 1.00 0.25 H new ATOM 0 HB ILE A 135 -18.002 -1.716 -3.185 1.00 0.26 H new ATOM 0 HG12 ILE A 135 -16.222 -3.803 -4.480 1.00 0.28 H new ATOM 0 HG13 ILE A 135 -15.761 -2.184 -3.993 1.00 0.28 H new ATOM 0 HG21 ILE A 135 -18.517 -3.978 -2.327 1.00 0.30 H new ATOM 0 HG22 ILE A 135 -19.818 -3.356 -3.371 1.00 0.30 H new ATOM 0 HG23 ILE A 135 -18.676 -4.568 -3.999 1.00 0.30 H new ATOM 0 HD11 ILE A 135 -14.970 -3.843 -2.377 1.00 0.32 H new ATOM 0 HD12 ILE A 135 -16.170 -2.765 -1.627 1.00 0.32 H new ATOM 0 HD13 ILE A 135 -16.638 -4.409 -2.122 1.00 0.32 H new ATOM 2072 N LYS A 136 -20.515 -2.395 -5.997 1.00 0.31 N ATOM 2073 CA LYS A 136 -21.936 -2.077 -6.066 1.00 0.37 C ATOM 2074 C LYS A 136 -22.732 -3.351 -6.262 1.00 0.40 C ATOM 2075 O LYS A 136 -22.323 -4.228 -7.025 1.00 0.42 O ATOM 2076 CB LYS A 136 -22.235 -1.095 -7.205 1.00 0.46 C ATOM 2077 CG LYS A 136 -21.734 0.308 -6.933 1.00 0.66 C ATOM 2078 CD LYS A 136 -22.514 0.968 -5.808 1.00 1.28 C ATOM 2079 CE LYS A 136 -21.813 2.216 -5.296 1.00 1.51 C ATOM 2080 NZ LYS A 136 -21.536 3.190 -6.383 1.00 1.95 N ATOM 0 H LYS A 136 -20.248 -3.216 -6.539 1.00 0.31 H new ATOM 0 HA LYS A 136 -22.225 -1.601 -5.129 1.00 0.37 H new ATOM 0 HB2 LYS A 136 -21.779 -1.465 -8.123 1.00 0.46 H new ATOM 0 HB3 LYS A 136 -23.311 -1.063 -7.374 1.00 0.46 H new ATOM 0 HG2 LYS A 136 -20.676 0.274 -6.673 1.00 0.66 H new ATOM 0 HG3 LYS A 136 -21.820 0.909 -7.839 1.00 0.66 H new ATOM 0 HD2 LYS A 136 -23.511 1.230 -6.161 1.00 1.28 H new ATOM 0 HD3 LYS A 136 -22.641 0.260 -4.989 1.00 1.28 H new ATOM 0 HE2 LYS A 136 -22.431 2.691 -4.534 1.00 1.51 H new ATOM 0 HE3 LYS A 136 -20.876 1.933 -4.816 1.00 1.51 H new ATOM 0 HZ1 LYS A 136 -21.215 4.089 -5.970 1.00 1.95 H new ATOM 0 HZ2 LYS A 136 -20.795 2.812 -7.008 1.00 1.95 H new ATOM 0 HZ3 LYS A 136 -22.403 3.352 -6.933 1.00 1.95 H new ATOM 2094 N LYS A 137 -23.847 -3.460 -5.545 1.00 0.46 N ATOM 2095 CA LYS A 137 -24.714 -4.634 -5.623 1.00 0.54 C ATOM 2096 C LYS A 137 -23.955 -5.876 -5.188 1.00 0.48 C ATOM 2097 O LYS A 137 -24.208 -6.988 -5.660 1.00 0.54 O ATOM 2098 CB LYS A 137 -25.296 -4.808 -7.027 1.00 0.65 C ATOM 2099 CG LYS A 137 -26.447 -3.872 -7.334 1.00 0.81 C ATOM 2100 CD LYS A 137 -26.005 -2.419 -7.366 1.00 1.53 C ATOM 2101 CE LYS A 137 -27.179 -1.490 -7.171 1.00 2.40 C ATOM 2102 NZ LYS A 137 -26.753 -0.069 -7.107 1.00 3.13 N ATOM 0 H LYS A 137 -24.174 -2.743 -4.898 1.00 0.46 H new ATOM 0 HA LYS A 137 -25.552 -4.483 -4.943 1.00 0.54 H new ATOM 0 HB2 LYS A 137 -24.505 -4.648 -7.760 1.00 0.65 H new ATOM 0 HB3 LYS A 137 -25.636 -5.837 -7.144 1.00 0.65 H new ATOM 0 HG2 LYS A 137 -26.885 -4.139 -8.296 1.00 0.81 H new ATOM 0 HG3 LYS A 137 -27.227 -3.997 -6.583 1.00 0.81 H new ATOM 0 HD2 LYS A 137 -25.265 -2.243 -6.585 1.00 1.53 H new ATOM 0 HD3 LYS A 137 -25.521 -2.204 -8.319 1.00 1.53 H new ATOM 0 HE2 LYS A 137 -27.886 -1.621 -7.990 1.00 2.40 H new ATOM 0 HE3 LYS A 137 -27.703 -1.754 -6.252 1.00 2.40 H new ATOM 0 HZ1 LYS A 137 -27.587 0.538 -6.973 1.00 3.13 H new ATOM 0 HZ2 LYS A 137 -26.098 0.061 -6.310 1.00 3.13 H new ATOM 0 HZ3 LYS A 137 -26.275 0.191 -7.994 1.00 3.13 H new ATOM 2116 N GLY A 138 -23.006 -5.661 -4.285 1.00 0.41 N ATOM 2117 CA GLY A 138 -22.207 -6.748 -3.755 1.00 0.40 C ATOM 2118 C GLY A 138 -21.160 -7.235 -4.738 1.00 0.37 C ATOM 2119 O GLY A 138 -20.547 -8.281 -4.531 1.00 0.39 O ATOM 0 H GLY A 138 -22.774 -4.742 -3.907 1.00 0.41 H new ATOM 0 HA2 GLY A 138 -21.715 -6.420 -2.839 1.00 0.40 H new ATOM 0 HA3 GLY A 138 -22.861 -7.577 -3.486 1.00 0.40 H new ATOM 2123 N LYS A 139 -20.953 -6.486 -5.810 1.00 0.37 N ATOM 2124 CA LYS A 139 -19.986 -6.864 -6.825 1.00 0.36 C ATOM 2125 C LYS A 139 -18.831 -5.873 -6.844 1.00 0.32 C ATOM 2126 O LYS A 139 -19.033 -4.675 -6.673 1.00 0.40 O ATOM 2127 CB LYS A 139 -20.654 -6.921 -8.195 1.00 0.44 C ATOM 2128 CG LYS A 139 -21.830 -7.878 -8.248 1.00 0.87 C ATOM 2129 CD LYS A 139 -22.630 -7.711 -9.528 1.00 1.14 C ATOM 2130 CE LYS A 139 -23.862 -8.600 -9.526 1.00 1.64 C ATOM 2131 NZ LYS A 139 -24.720 -8.362 -10.715 1.00 2.23 N ATOM 0 H LYS A 139 -21.443 -5.612 -5.998 1.00 0.37 H new ATOM 0 HA LYS A 139 -19.596 -7.853 -6.586 1.00 0.36 H new ATOM 0 HB2 LYS A 139 -20.994 -5.922 -8.468 1.00 0.44 H new ATOM 0 HB3 LYS A 139 -19.916 -7.221 -8.939 1.00 0.44 H new ATOM 0 HG2 LYS A 139 -21.469 -8.904 -8.176 1.00 0.87 H new ATOM 0 HG3 LYS A 139 -22.478 -7.707 -7.388 1.00 0.87 H new ATOM 0 HD2 LYS A 139 -22.930 -6.669 -9.639 1.00 1.14 H new ATOM 0 HD3 LYS A 139 -22.004 -7.955 -10.386 1.00 1.14 H new ATOM 0 HE2 LYS A 139 -23.555 -9.646 -9.504 1.00 1.64 H new ATOM 0 HE3 LYS A 139 -24.439 -8.418 -8.620 1.00 1.64 H new ATOM 0 HZ1 LYS A 139 -25.550 -8.988 -10.675 1.00 2.23 H new ATOM 0 HZ2 LYS A 139 -25.034 -7.371 -10.723 1.00 2.23 H new ATOM 0 HZ3 LYS A 139 -24.178 -8.560 -11.580 1.00 2.23 H new ATOM 2145 N LEU A 140 -17.634 -6.383 -7.061 1.00 0.33 N ATOM 2146 CA LEU A 140 -16.424 -5.584 -6.975 1.00 0.30 C ATOM 2147 C LEU A 140 -15.790 -5.440 -8.359 1.00 0.31 C ATOM 2148 O LEU A 140 -15.428 -6.432 -8.996 1.00 0.41 O ATOM 2149 CB LEU A 140 -15.455 -6.271 -6.000 1.00 0.32 C ATOM 2150 CG LEU A 140 -14.328 -5.411 -5.426 1.00 0.32 C ATOM 2151 CD1 LEU A 140 -13.724 -6.094 -4.213 1.00 0.39 C ATOM 2152 CD2 LEU A 140 -13.252 -5.158 -6.464 1.00 0.37 C ATOM 0 H LEU A 140 -17.472 -7.361 -7.302 1.00 0.33 H new ATOM 0 HA LEU A 140 -16.659 -4.584 -6.610 1.00 0.30 H new ATOM 0 HB2 LEU A 140 -16.036 -6.669 -5.168 1.00 0.32 H new ATOM 0 HB3 LEU A 140 -15.006 -7.122 -6.511 1.00 0.32 H new ATOM 0 HG LEU A 140 -14.749 -4.450 -5.130 1.00 0.32 H new ATOM 0 HD11 LEU A 140 -12.922 -5.476 -3.809 1.00 0.39 H new ATOM 0 HD12 LEU A 140 -14.493 -6.233 -3.453 1.00 0.39 H new ATOM 0 HD13 LEU A 140 -13.323 -7.065 -4.504 1.00 0.39 H new ATOM 0 HD21 LEU A 140 -12.464 -4.544 -6.029 1.00 0.37 H new ATOM 0 HD22 LEU A 140 -12.832 -6.109 -6.792 1.00 0.37 H new ATOM 0 HD23 LEU A 140 -13.686 -4.639 -7.319 1.00 0.37 H new ATOM 2164 N SER A 141 -15.667 -4.213 -8.833 1.00 0.28 N ATOM 2165 CA SER A 141 -15.057 -3.964 -10.128 1.00 0.31 C ATOM 2166 C SER A 141 -13.721 -3.242 -9.972 1.00 0.28 C ATOM 2167 O SER A 141 -13.681 -2.071 -9.611 1.00 0.36 O ATOM 2168 CB SER A 141 -16.000 -3.130 -10.998 1.00 0.39 C ATOM 2169 OG SER A 141 -17.287 -3.724 -11.069 1.00 1.19 O ATOM 0 H SER A 141 -15.980 -3.375 -8.343 1.00 0.28 H new ATOM 0 HA SER A 141 -14.874 -4.924 -10.610 1.00 0.31 H new ATOM 0 HB2 SER A 141 -16.083 -2.123 -10.589 1.00 0.39 H new ATOM 0 HB3 SER A 141 -15.585 -3.033 -12.001 1.00 0.39 H new ATOM 0 HG SER A 141 -17.872 -3.172 -11.629 1.00 1.19 H new ATOM 2175 N VAL A 142 -12.629 -3.937 -10.243 1.00 0.33 N ATOM 2176 CA VAL A 142 -11.315 -3.320 -10.206 1.00 0.35 C ATOM 2177 C VAL A 142 -10.957 -2.861 -11.608 1.00 0.43 C ATOM 2178 O VAL A 142 -10.467 -3.645 -12.425 1.00 0.48 O ATOM 2179 CB VAL A 142 -10.230 -4.281 -9.661 1.00 0.35 C ATOM 2180 CG1 VAL A 142 -8.838 -3.684 -9.828 1.00 0.92 C ATOM 2181 CG2 VAL A 142 -10.488 -4.598 -8.202 1.00 0.83 C ATOM 0 H VAL A 142 -12.627 -4.927 -10.490 1.00 0.33 H new ATOM 0 HA VAL A 142 -11.351 -2.471 -9.524 1.00 0.35 H new ATOM 0 HB VAL A 142 -10.279 -5.205 -10.238 1.00 0.35 H new ATOM 0 HG11 VAL A 142 -8.095 -4.379 -9.437 1.00 0.92 H new ATOM 0 HG12 VAL A 142 -8.644 -3.502 -10.885 1.00 0.92 H new ATOM 0 HG13 VAL A 142 -8.778 -2.743 -9.281 1.00 0.92 H new ATOM 0 HG21 VAL A 142 -9.716 -5.275 -7.835 1.00 0.83 H new ATOM 0 HG22 VAL A 142 -10.469 -3.676 -7.621 1.00 0.83 H new ATOM 0 HG23 VAL A 142 -11.464 -5.072 -8.100 1.00 0.83 H new ATOM 2191 N GLN A 143 -11.246 -1.593 -11.877 1.00 0.56 N ATOM 2192 CA GLN A 143 -11.069 -0.998 -13.197 1.00 0.70 C ATOM 2193 C GLN A 143 -11.900 -1.736 -14.249 1.00 0.82 C ATOM 2194 O GLN A 143 -13.054 -1.382 -14.490 1.00 1.45 O ATOM 2195 CB GLN A 143 -9.591 -0.953 -13.599 1.00 0.74 C ATOM 2196 CG GLN A 143 -8.745 -0.033 -12.728 1.00 0.83 C ATOM 2197 CD GLN A 143 -9.286 1.384 -12.677 1.00 1.15 C ATOM 2198 OE1 GLN A 143 -8.960 2.215 -13.523 1.00 1.88 O ATOM 2199 NE2 GLN A 143 -10.095 1.683 -11.670 1.00 1.11 N ATOM 0 H GLN A 143 -11.612 -0.944 -11.181 1.00 0.56 H new ATOM 0 HA GLN A 143 -11.427 0.030 -13.143 1.00 0.70 H new ATOM 0 HB2 GLN A 143 -9.180 -1.962 -13.552 1.00 0.74 H new ATOM 0 HB3 GLN A 143 -9.516 -0.626 -14.636 1.00 0.74 H new ATOM 0 HG2 GLN A 143 -8.700 -0.437 -11.717 1.00 0.83 H new ATOM 0 HG3 GLN A 143 -7.724 -0.015 -13.110 1.00 0.83 H new ATOM 0 HE21 GLN A 143 -10.344 0.968 -10.986 1.00 1.11 H new ATOM 0 HE22 GLN A 143 -10.468 2.628 -11.579 1.00 1.11 H new ATOM 2208 N GLY A 144 -11.333 -2.777 -14.845 1.00 0.86 N ATOM 2209 CA GLY A 144 -12.038 -3.508 -15.876 1.00 0.96 C ATOM 2210 C GLY A 144 -12.518 -4.872 -15.416 1.00 0.85 C ATOM 2211 O GLY A 144 -13.338 -5.504 -16.083 1.00 1.02 O ATOM 0 H GLY A 144 -10.399 -3.127 -14.632 1.00 0.86 H new ATOM 0 HA2 GLY A 144 -12.894 -2.921 -16.208 1.00 0.96 H new ATOM 0 HA3 GLY A 144 -11.383 -3.632 -16.738 1.00 0.96 H new ATOM 2215 N GLU A 145 -12.023 -5.330 -14.271 1.00 0.66 N ATOM 2216 CA GLU A 145 -12.387 -6.650 -13.775 1.00 0.65 C ATOM 2217 C GLU A 145 -13.618 -6.574 -12.887 1.00 0.52 C ATOM 2218 O GLU A 145 -13.563 -6.018 -11.792 1.00 0.55 O ATOM 2219 CB GLU A 145 -11.241 -7.273 -12.979 1.00 0.74 C ATOM 2220 CG GLU A 145 -9.987 -7.551 -13.789 1.00 1.06 C ATOM 2221 CD GLU A 145 -9.004 -8.402 -13.015 1.00 1.35 C ATOM 2222 OE1 GLU A 145 -8.660 -8.028 -11.879 1.00 1.95 O ATOM 2223 OE2 GLU A 145 -8.586 -9.459 -13.531 1.00 1.84 O ATOM 0 H GLU A 145 -11.376 -4.813 -13.676 1.00 0.66 H new ATOM 0 HA GLU A 145 -12.603 -7.273 -14.643 1.00 0.65 H new ATOM 0 HB2 GLU A 145 -10.985 -6.608 -12.154 1.00 0.74 H new ATOM 0 HB3 GLU A 145 -11.588 -8.208 -12.539 1.00 0.74 H new ATOM 0 HG2 GLU A 145 -10.256 -8.057 -14.716 1.00 1.06 H new ATOM 0 HG3 GLU A 145 -9.515 -6.608 -14.066 1.00 1.06 H new ATOM 2230 N VAL A 146 -14.715 -7.150 -13.346 1.00 0.59 N ATOM 2231 CA VAL A 146 -15.938 -7.173 -12.563 1.00 0.54 C ATOM 2232 C VAL A 146 -16.176 -8.570 -11.988 1.00 0.53 C ATOM 2233 O VAL A 146 -16.396 -9.536 -12.719 1.00 0.67 O ATOM 2234 CB VAL A 146 -17.160 -6.699 -13.390 1.00 0.64 C ATOM 2235 CG1 VAL A 146 -17.317 -7.503 -14.675 1.00 0.92 C ATOM 2236 CG2 VAL A 146 -18.432 -6.755 -12.553 1.00 0.92 C ATOM 0 H VAL A 146 -14.784 -7.607 -14.255 1.00 0.59 H new ATOM 0 HA VAL A 146 -15.817 -6.472 -11.737 1.00 0.54 H new ATOM 0 HB VAL A 146 -16.982 -5.662 -13.676 1.00 0.64 H new ATOM 0 HG11 VAL A 146 -18.184 -7.141 -15.227 1.00 0.92 H new ATOM 0 HG12 VAL A 146 -16.423 -7.388 -15.288 1.00 0.92 H new ATOM 0 HG13 VAL A 146 -17.456 -8.556 -14.431 1.00 0.92 H new ATOM 0 HG21 VAL A 146 -19.277 -6.418 -13.153 1.00 0.92 H new ATOM 0 HG22 VAL A 146 -18.606 -7.779 -12.224 1.00 0.92 H new ATOM 0 HG23 VAL A 146 -18.324 -6.108 -11.683 1.00 0.92 H new ATOM 2246 N SER A 147 -16.097 -8.669 -10.673 1.00 0.47 N ATOM 2247 CA SER A 147 -16.267 -9.936 -9.979 1.00 0.47 C ATOM 2248 C SER A 147 -16.910 -9.682 -8.626 1.00 0.48 C ATOM 2249 O SER A 147 -16.545 -8.736 -7.937 1.00 0.79 O ATOM 2250 CB SER A 147 -14.909 -10.628 -9.807 1.00 0.54 C ATOM 2251 OG SER A 147 -15.038 -11.861 -9.116 1.00 1.27 O ATOM 0 H SER A 147 -15.914 -7.877 -10.057 1.00 0.47 H new ATOM 0 HA SER A 147 -16.912 -10.590 -10.565 1.00 0.47 H new ATOM 0 HB2 SER A 147 -14.462 -10.803 -10.786 1.00 0.54 H new ATOM 0 HB3 SER A 147 -14.232 -9.972 -9.260 1.00 0.54 H new ATOM 0 HG SER A 147 -14.156 -12.278 -9.024 1.00 1.27 H new ATOM 2257 N THR A 148 -17.865 -10.518 -8.253 1.00 0.41 N ATOM 2258 CA THR A 148 -18.618 -10.322 -7.022 1.00 0.40 C ATOM 2259 C THR A 148 -17.704 -10.252 -5.801 1.00 0.39 C ATOM 2260 O THR A 148 -16.732 -11.004 -5.688 1.00 0.46 O ATOM 2261 CB THR A 148 -19.657 -11.439 -6.826 1.00 0.46 C ATOM 2262 OG1 THR A 148 -19.023 -12.723 -6.894 1.00 1.45 O ATOM 2263 CG2 THR A 148 -20.747 -11.356 -7.883 1.00 1.28 C ATOM 0 H THR A 148 -18.139 -11.343 -8.787 1.00 0.41 H new ATOM 0 HA THR A 148 -19.134 -9.367 -7.118 1.00 0.40 H new ATOM 0 HB THR A 148 -20.110 -11.309 -5.843 1.00 0.46 H new ATOM 0 HG1 THR A 148 -19.694 -13.426 -6.766 1.00 1.45 H new ATOM 0 HG21 THR A 148 -21.470 -12.156 -7.724 1.00 1.28 H new ATOM 0 HG22 THR A 148 -21.251 -10.392 -7.811 1.00 1.28 H new ATOM 0 HG23 THR A 148 -20.303 -11.460 -8.873 1.00 1.28 H new ATOM 2271 N PHE A 149 -18.029 -9.338 -4.896 1.00 0.35 N ATOM 2272 CA PHE A 149 -17.253 -9.134 -3.685 1.00 0.32 C ATOM 2273 C PHE A 149 -17.618 -10.191 -2.656 1.00 0.35 C ATOM 2274 O PHE A 149 -18.795 -10.408 -2.361 1.00 0.43 O ATOM 2275 CB PHE A 149 -17.502 -7.719 -3.137 1.00 0.30 C ATOM 2276 CG PHE A 149 -17.116 -7.543 -1.695 1.00 0.30 C ATOM 2277 CD1 PHE A 149 -15.803 -7.267 -1.325 1.00 0.34 C ATOM 2278 CD2 PHE A 149 -18.074 -7.665 -0.702 1.00 0.38 C ATOM 2279 CE1 PHE A 149 -15.467 -7.120 0.002 1.00 0.42 C ATOM 2280 CE2 PHE A 149 -17.738 -7.521 0.624 1.00 0.46 C ATOM 2281 CZ PHE A 149 -16.434 -7.250 0.975 1.00 0.47 C ATOM 0 H PHE A 149 -18.836 -8.720 -4.982 1.00 0.35 H new ATOM 0 HA PHE A 149 -16.191 -9.230 -3.912 1.00 0.32 H new ATOM 0 HB2 PHE A 149 -16.944 -7.004 -3.741 1.00 0.30 H new ATOM 0 HB3 PHE A 149 -18.559 -7.477 -3.251 1.00 0.30 H new ATOM 0 HD1 PHE A 149 -15.042 -7.167 -2.085 1.00 0.34 H new ATOM 0 HD2 PHE A 149 -19.098 -7.876 -0.972 1.00 0.38 H new ATOM 0 HE1 PHE A 149 -14.446 -6.903 0.280 1.00 0.42 H new ATOM 0 HE2 PHE A 149 -18.495 -7.620 1.388 1.00 0.46 H new ATOM 0 HZ PHE A 149 -16.169 -7.139 2.016 1.00 0.47 H new ATOM 2291 N THR A 150 -16.605 -10.844 -2.115 1.00 0.37 N ATOM 2292 CA THR A 150 -16.818 -11.959 -1.218 1.00 0.48 C ATOM 2293 C THR A 150 -16.157 -11.732 0.146 1.00 0.43 C ATOM 2294 O THR A 150 -14.943 -11.890 0.305 1.00 0.82 O ATOM 2295 CB THR A 150 -16.313 -13.275 -1.866 1.00 0.78 C ATOM 2296 OG1 THR A 150 -16.368 -14.357 -0.928 1.00 1.79 O ATOM 2297 CG2 THR A 150 -14.896 -13.123 -2.403 1.00 1.25 C ATOM 0 H THR A 150 -15.625 -10.618 -2.284 1.00 0.37 H new ATOM 0 HA THR A 150 -17.891 -12.043 -1.043 1.00 0.48 H new ATOM 0 HB THR A 150 -16.973 -13.500 -2.704 1.00 0.78 H new ATOM 0 HG1 THR A 150 -16.047 -15.178 -1.356 1.00 1.79 H new ATOM 0 HG21 THR A 150 -14.574 -14.063 -2.850 1.00 1.25 H new ATOM 0 HG22 THR A 150 -14.875 -12.337 -3.157 1.00 1.25 H new ATOM 0 HG23 THR A 150 -14.224 -12.860 -1.586 1.00 1.25 H new ATOM 2305 N GLY A 151 -16.963 -11.309 1.115 1.00 0.42 N ATOM 2306 CA GLY A 151 -16.516 -11.229 2.497 1.00 0.37 C ATOM 2307 C GLY A 151 -15.679 -10.005 2.802 1.00 0.32 C ATOM 2308 O GLY A 151 -16.112 -9.127 3.550 1.00 0.34 O ATOM 0 H GLY A 151 -17.929 -11.017 0.966 1.00 0.42 H new ATOM 0 HA2 GLY A 151 -17.388 -11.233 3.151 1.00 0.37 H new ATOM 0 HA3 GLY A 151 -15.936 -12.121 2.733 1.00 0.37 H new ATOM 2312 N LYS A 152 -14.487 -9.936 2.232 1.00 0.29 N ATOM 2313 CA LYS A 152 -13.585 -8.828 2.505 1.00 0.28 C ATOM 2314 C LYS A 152 -12.564 -8.700 1.389 1.00 0.27 C ATOM 2315 O LYS A 152 -12.427 -9.586 0.545 1.00 0.33 O ATOM 2316 CB LYS A 152 -12.890 -9.002 3.873 1.00 0.36 C ATOM 2317 CG LYS A 152 -11.595 -9.810 3.857 1.00 0.44 C ATOM 2318 CD LYS A 152 -11.814 -11.248 3.421 1.00 0.62 C ATOM 2319 CE LYS A 152 -10.495 -11.969 3.208 1.00 0.77 C ATOM 2320 NZ LYS A 152 -10.687 -13.389 2.806 1.00 1.23 N ATOM 0 H LYS A 152 -14.122 -10.631 1.580 1.00 0.29 H new ATOM 0 HA LYS A 152 -14.170 -7.909 2.548 1.00 0.28 H new ATOM 0 HB2 LYS A 152 -12.676 -8.014 4.280 1.00 0.36 H new ATOM 0 HB3 LYS A 152 -13.589 -9.483 4.557 1.00 0.36 H new ATOM 0 HG2 LYS A 152 -10.882 -9.334 3.184 1.00 0.44 H new ATOM 0 HG3 LYS A 152 -11.151 -9.799 4.852 1.00 0.44 H new ATOM 0 HD2 LYS A 152 -12.400 -11.773 4.175 1.00 0.62 H new ATOM 0 HD3 LYS A 152 -12.393 -11.266 2.498 1.00 0.62 H new ATOM 0 HE2 LYS A 152 -9.920 -11.451 2.441 1.00 0.77 H new ATOM 0 HE3 LYS A 152 -9.909 -11.930 4.126 1.00 0.77 H new ATOM 0 HZ1 LYS A 152 -9.760 -13.840 2.672 1.00 1.23 H new ATOM 0 HZ2 LYS A 152 -11.213 -13.892 3.549 1.00 1.23 H new ATOM 0 HZ3 LYS A 152 -11.223 -13.428 1.916 1.00 1.23 H new ATOM 2334 N LEU A 153 -11.860 -7.589 1.391 1.00 0.23 N ATOM 2335 CA LEU A 153 -10.837 -7.324 0.393 1.00 0.24 C ATOM 2336 C LEU A 153 -9.558 -8.036 0.809 1.00 0.26 C ATOM 2337 O LEU A 153 -9.286 -8.141 1.996 1.00 0.44 O ATOM 2338 CB LEU A 153 -10.611 -5.820 0.290 1.00 0.26 C ATOM 2339 CG LEU A 153 -9.911 -5.339 -0.975 1.00 0.35 C ATOM 2340 CD1 LEU A 153 -10.819 -5.516 -2.179 1.00 1.17 C ATOM 2341 CD2 LEU A 153 -9.503 -3.886 -0.820 1.00 1.16 C ATOM 0 H LEU A 153 -11.977 -6.845 2.079 1.00 0.23 H new ATOM 0 HA LEU A 153 -11.149 -7.692 -0.584 1.00 0.24 H new ATOM 0 HB2 LEU A 153 -11.578 -5.321 0.360 1.00 0.26 H new ATOM 0 HB3 LEU A 153 -10.024 -5.500 1.151 1.00 0.26 H new ATOM 0 HG LEU A 153 -9.014 -5.937 -1.134 1.00 0.35 H new ATOM 0 HD11 LEU A 153 -10.306 -5.168 -3.076 1.00 1.17 H new ATOM 0 HD12 LEU A 153 -11.073 -6.570 -2.292 1.00 1.17 H new ATOM 0 HD13 LEU A 153 -11.731 -4.937 -2.035 1.00 1.17 H new ATOM 0 HD21 LEU A 153 -9.003 -3.550 -1.728 1.00 1.16 H new ATOM 0 HD22 LEU A 153 -10.389 -3.276 -0.646 1.00 1.16 H new ATOM 0 HD23 LEU A 153 -8.823 -3.787 0.026 1.00 1.16 H new ATOM 2353 N SER A 154 -8.782 -8.561 -0.125 1.00 0.24 N ATOM 2354 CA SER A 154 -7.579 -9.272 0.272 1.00 0.27 C ATOM 2355 C SER A 154 -6.386 -8.820 -0.558 1.00 0.30 C ATOM 2356 O SER A 154 -6.297 -9.116 -1.748 1.00 0.50 O ATOM 2357 CB SER A 154 -7.792 -10.783 0.127 1.00 0.38 C ATOM 2358 OG SER A 154 -6.921 -11.517 0.975 1.00 1.35 O ATOM 0 H SER A 154 -8.954 -8.512 -1.129 1.00 0.24 H new ATOM 0 HA SER A 154 -7.369 -9.044 1.317 1.00 0.27 H new ATOM 0 HB2 SER A 154 -8.827 -11.030 0.366 1.00 0.38 H new ATOM 0 HB3 SER A 154 -7.625 -11.077 -0.909 1.00 0.38 H new ATOM 0 HG SER A 154 -7.084 -12.476 0.859 1.00 1.35 H new ATOM 2364 N VAL A 155 -5.479 -8.088 0.067 1.00 0.26 N ATOM 2365 CA VAL A 155 -4.295 -7.609 -0.626 1.00 0.28 C ATOM 2366 C VAL A 155 -3.141 -8.570 -0.416 1.00 0.29 C ATOM 2367 O VAL A 155 -2.600 -8.672 0.682 1.00 0.38 O ATOM 2368 CB VAL A 155 -3.884 -6.195 -0.168 1.00 0.34 C ATOM 2369 CG1 VAL A 155 -2.617 -5.740 -0.881 1.00 0.42 C ATOM 2370 CG2 VAL A 155 -5.017 -5.213 -0.413 1.00 0.39 C ATOM 0 H VAL A 155 -5.539 -7.814 1.048 1.00 0.26 H new ATOM 0 HA VAL A 155 -4.542 -7.555 -1.686 1.00 0.28 H new ATOM 0 HB VAL A 155 -3.676 -6.227 0.901 1.00 0.34 H new ATOM 0 HG11 VAL A 155 -2.347 -4.740 -0.541 1.00 0.42 H new ATOM 0 HG12 VAL A 155 -1.805 -6.431 -0.656 1.00 0.42 H new ATOM 0 HG13 VAL A 155 -2.791 -5.723 -1.957 1.00 0.42 H new ATOM 0 HG21 VAL A 155 -4.714 -4.219 -0.085 1.00 0.39 H new ATOM 0 HG22 VAL A 155 -5.253 -5.188 -1.477 1.00 0.39 H new ATOM 0 HG23 VAL A 155 -5.898 -5.527 0.147 1.00 0.39 H new ATOM 2380 N GLU A 156 -2.789 -9.283 -1.469 1.00 0.32 N ATOM 2381 CA GLU A 156 -1.717 -10.262 -1.418 1.00 0.40 C ATOM 2382 C GLU A 156 -0.569 -9.824 -2.303 1.00 0.36 C ATOM 2383 O GLU A 156 -0.792 -9.312 -3.401 1.00 0.42 O ATOM 2384 CB GLU A 156 -2.217 -11.622 -1.907 1.00 0.61 C ATOM 2385 CG GLU A 156 -3.361 -12.193 -1.092 1.00 0.73 C ATOM 2386 CD GLU A 156 -3.948 -13.437 -1.728 1.00 1.41 C ATOM 2387 OE1 GLU A 156 -4.712 -13.308 -2.707 1.00 1.98 O ATOM 2388 OE2 GLU A 156 -3.646 -14.554 -1.253 1.00 1.92 O ATOM 0 H GLU A 156 -3.236 -9.201 -2.382 1.00 0.32 H new ATOM 0 HA GLU A 156 -1.380 -10.343 -0.385 1.00 0.40 H new ATOM 0 HB2 GLU A 156 -2.537 -11.527 -2.945 1.00 0.61 H new ATOM 0 HB3 GLU A 156 -1.387 -12.328 -1.892 1.00 0.61 H new ATOM 0 HG2 GLU A 156 -3.007 -12.431 -0.089 1.00 0.73 H new ATOM 0 HG3 GLU A 156 -4.141 -11.439 -0.984 1.00 0.73 H new ATOM 2395 N PHE A 157 0.654 -9.997 -1.824 1.00 0.41 N ATOM 2396 CA PHE A 157 1.811 -9.836 -2.682 1.00 0.43 C ATOM 2397 C PHE A 157 2.734 -11.042 -2.573 1.00 0.43 C ATOM 2398 O PHE A 157 3.109 -11.473 -1.474 1.00 0.51 O ATOM 2399 CB PHE A 157 2.559 -8.515 -2.439 1.00 0.55 C ATOM 2400 CG PHE A 157 2.367 -7.894 -1.086 1.00 0.88 C ATOM 2401 CD1 PHE A 157 1.228 -7.154 -0.806 1.00 1.46 C ATOM 2402 CD2 PHE A 157 3.333 -8.025 -0.106 1.00 1.19 C ATOM 2403 CE1 PHE A 157 1.057 -6.562 0.429 1.00 2.17 C ATOM 2404 CE2 PHE A 157 3.169 -7.429 1.128 1.00 1.85 C ATOM 2405 CZ PHE A 157 2.030 -6.700 1.397 1.00 2.32 C ATOM 0 H PHE A 157 0.866 -10.246 -0.858 1.00 0.41 H new ATOM 0 HA PHE A 157 1.444 -9.781 -3.707 1.00 0.43 H new ATOM 0 HB2 PHE A 157 3.624 -8.690 -2.590 1.00 0.55 H new ATOM 0 HB3 PHE A 157 2.244 -7.796 -3.196 1.00 0.55 H new ATOM 0 HD1 PHE A 157 0.466 -7.040 -1.563 1.00 1.46 H new ATOM 0 HD2 PHE A 157 4.225 -8.599 -0.308 1.00 1.19 H new ATOM 0 HE1 PHE A 157 0.164 -5.992 0.637 1.00 2.17 H new ATOM 0 HE2 PHE A 157 3.934 -7.534 1.884 1.00 1.85 H new ATOM 0 HZ PHE A 157 1.900 -6.238 2.364 1.00 2.32 H new ATOM 2415 N VAL A 158 3.067 -11.585 -3.737 1.00 0.44 N ATOM 2416 CA VAL A 158 3.808 -12.834 -3.848 1.00 0.48 C ATOM 2417 C VAL A 158 5.253 -12.580 -4.282 1.00 0.48 C ATOM 2418 O VAL A 158 5.530 -11.662 -5.063 1.00 0.47 O ATOM 2419 CB VAL A 158 3.124 -13.782 -4.863 1.00 0.52 C ATOM 2420 CG1 VAL A 158 3.830 -15.129 -4.923 1.00 0.62 C ATOM 2421 CG2 VAL A 158 1.654 -13.965 -4.512 1.00 0.59 C ATOM 0 H VAL A 158 2.829 -11.168 -4.637 1.00 0.44 H new ATOM 0 HA VAL A 158 3.815 -13.303 -2.864 1.00 0.48 H new ATOM 0 HB VAL A 158 3.194 -13.324 -5.850 1.00 0.52 H new ATOM 0 HG11 VAL A 158 3.326 -15.772 -5.644 1.00 0.62 H new ATOM 0 HG12 VAL A 158 4.866 -14.983 -5.228 1.00 0.62 H new ATOM 0 HG13 VAL A 158 3.804 -15.597 -3.939 1.00 0.62 H new ATOM 0 HG21 VAL A 158 1.188 -14.634 -5.235 1.00 0.59 H new ATOM 0 HG22 VAL A 158 1.569 -14.394 -3.514 1.00 0.59 H new ATOM 0 HG23 VAL A 158 1.151 -12.998 -4.536 1.00 0.59 H new ATOM 2431 N LYS A 159 6.161 -13.396 -3.749 1.00 0.58 N ATOM 2432 CA LYS A 159 7.586 -13.309 -4.042 1.00 0.66 C ATOM 2433 C LYS A 159 7.875 -13.538 -5.523 1.00 0.63 C ATOM 2434 O LYS A 159 7.587 -14.606 -6.068 1.00 0.77 O ATOM 2435 CB LYS A 159 8.330 -14.343 -3.190 1.00 0.93 C ATOM 2436 CG LYS A 159 9.818 -14.464 -3.462 1.00 1.36 C ATOM 2437 CD LYS A 159 10.446 -15.517 -2.557 1.00 1.66 C ATOM 2438 CE LYS A 159 9.785 -16.880 -2.740 1.00 1.99 C ATOM 2439 NZ LYS A 159 10.283 -17.883 -1.760 1.00 2.26 N ATOM 0 H LYS A 159 5.923 -14.142 -3.096 1.00 0.58 H new ATOM 0 HA LYS A 159 7.930 -12.304 -3.799 1.00 0.66 H new ATOM 0 HB2 LYS A 159 8.190 -14.091 -2.139 1.00 0.93 H new ATOM 0 HB3 LYS A 159 7.869 -15.318 -3.348 1.00 0.93 H new ATOM 0 HG2 LYS A 159 9.982 -14.730 -4.506 1.00 1.36 H new ATOM 0 HG3 LYS A 159 10.302 -13.501 -3.299 1.00 1.36 H new ATOM 0 HD2 LYS A 159 11.511 -15.596 -2.774 1.00 1.66 H new ATOM 0 HD3 LYS A 159 10.355 -15.205 -1.517 1.00 1.66 H new ATOM 0 HE2 LYS A 159 8.705 -16.775 -2.633 1.00 1.99 H new ATOM 0 HE3 LYS A 159 9.972 -17.240 -3.752 1.00 1.99 H new ATOM 0 HZ1 LYS A 159 9.806 -18.793 -1.922 1.00 2.26 H new ATOM 0 HZ2 LYS A 159 11.309 -18.004 -1.878 1.00 2.26 H new ATOM 0 HZ3 LYS A 159 10.082 -17.554 -0.794 1.00 2.26 H new ATOM 2453 N GLY A 160 8.441 -12.530 -6.167 1.00 0.75 N ATOM 2454 CA GLY A 160 8.845 -12.664 -7.554 1.00 0.91 C ATOM 2455 C GLY A 160 10.328 -12.943 -7.680 1.00 0.98 C ATOM 2456 O GLY A 160 10.855 -13.081 -8.783 1.00 1.45 O ATOM 0 H GLY A 160 8.629 -11.617 -5.754 1.00 0.75 H new ATOM 0 HA2 GLY A 160 8.282 -13.472 -8.021 1.00 0.91 H new ATOM 0 HA3 GLY A 160 8.599 -11.750 -8.095 1.00 0.91 H new ATOM 2460 N TYR A 161 10.991 -13.021 -6.533 1.00 1.01 N ATOM 2461 CA TYR A 161 12.426 -13.270 -6.460 1.00 1.21 C ATOM 2462 C TYR A 161 12.808 -13.405 -4.995 1.00 1.36 C ATOM 2463 O TYR A 161 13.119 -14.495 -4.515 1.00 2.24 O ATOM 2464 CB TYR A 161 13.207 -12.117 -7.110 1.00 1.55 C ATOM 2465 CG TYR A 161 14.697 -12.356 -7.235 1.00 1.94 C ATOM 2466 CD1 TYR A 161 15.211 -13.077 -8.305 1.00 2.07 C ATOM 2467 CD2 TYR A 161 15.589 -11.846 -6.299 1.00 2.65 C ATOM 2468 CE1 TYR A 161 16.568 -13.287 -8.439 1.00 2.73 C ATOM 2469 CE2 TYR A 161 16.950 -12.050 -6.427 1.00 3.41 C ATOM 2470 CZ TYR A 161 17.433 -12.773 -7.497 1.00 3.40 C ATOM 2471 OH TYR A 161 18.787 -12.974 -7.629 1.00 4.24 O ATOM 0 H TYR A 161 10.546 -12.913 -5.622 1.00 1.01 H new ATOM 0 HA TYR A 161 12.673 -14.184 -6.999 1.00 1.21 H new ATOM 0 HB2 TYR A 161 12.797 -11.933 -8.103 1.00 1.55 H new ATOM 0 HB3 TYR A 161 13.045 -11.211 -6.525 1.00 1.55 H new ATOM 0 HD1 TYR A 161 14.536 -13.481 -9.045 1.00 2.07 H new ATOM 0 HD2 TYR A 161 15.213 -11.282 -5.459 1.00 2.65 H new ATOM 0 HE1 TYR A 161 16.950 -13.851 -9.277 1.00 2.73 H new ATOM 0 HE2 TYR A 161 17.631 -11.645 -5.693 1.00 3.41 H new ATOM 0 HH TYR A 161 19.256 -12.546 -6.882 1.00 4.24 H new ATOM 2481 N TYR A 162 12.749 -12.275 -4.302 1.00 1.19 N ATOM 2482 CA TYR A 162 12.885 -12.201 -2.856 1.00 1.26 C ATOM 2483 C TYR A 162 12.765 -10.734 -2.466 1.00 1.24 C ATOM 2484 O TYR A 162 12.547 -9.901 -3.351 1.00 2.08 O ATOM 2485 CB TYR A 162 14.212 -12.795 -2.362 1.00 1.59 C ATOM 2486 CG TYR A 162 14.176 -13.153 -0.892 1.00 2.17 C ATOM 2487 CD1 TYR A 162 13.016 -13.621 -0.284 1.00 2.54 C ATOM 2488 CD2 TYR A 162 15.318 -13.023 -0.115 1.00 2.97 C ATOM 2489 CE1 TYR A 162 13.003 -13.948 1.061 1.00 3.35 C ATOM 2490 CE2 TYR A 162 15.314 -13.350 1.221 1.00 3.90 C ATOM 2491 CZ TYR A 162 14.060 -13.810 1.804 1.00 3.99 C ATOM 2492 OH TYR A 162 14.158 -14.137 3.142 1.00 4.98 O ATOM 0 H TYR A 162 12.602 -11.366 -4.740 1.00 1.19 H new ATOM 0 HA TYR A 162 12.102 -12.796 -2.385 1.00 1.26 H new ATOM 0 HB2 TYR A 162 14.446 -13.686 -2.944 1.00 1.59 H new ATOM 0 HB3 TYR A 162 15.015 -12.079 -2.539 1.00 1.59 H new ATOM 0 HD1 TYR A 162 12.114 -13.731 -0.868 1.00 2.54 H new ATOM 0 HD2 TYR A 162 16.228 -12.658 -0.568 1.00 2.97 H new ATOM 0 HE1 TYR A 162 12.093 -14.327 1.503 1.00 3.35 H new ATOM 0 HE2 TYR A 162 16.210 -13.269 1.818 1.00 3.90 H new ATOM 0 HH TYR A 162 13.432 -14.749 3.383 1.00 4.98 H new ATOM 2502 N ASP A 163 12.887 -10.427 -1.167 1.00 1.09 N ATOM 2503 CA ASP A 163 12.756 -9.051 -0.652 1.00 1.04 C ATOM 2504 C ASP A 163 11.305 -8.628 -0.648 1.00 1.04 C ATOM 2505 O ASP A 163 10.786 -8.198 0.384 1.00 1.79 O ATOM 2506 CB ASP A 163 13.609 -8.069 -1.479 1.00 1.31 C ATOM 2507 CG ASP A 163 13.653 -6.658 -0.926 1.00 2.02 C ATOM 2508 OD1 ASP A 163 14.151 -6.476 0.203 1.00 2.55 O ATOM 2509 OD2 ASP A 163 13.236 -5.724 -1.646 1.00 2.64 O ATOM 0 H ASP A 163 13.079 -11.120 -0.444 1.00 1.09 H new ATOM 0 HA ASP A 163 13.125 -9.033 0.373 1.00 1.04 H new ATOM 0 HB2 ASP A 163 14.627 -8.454 -1.541 1.00 1.31 H new ATOM 0 HB3 ASP A 163 13.219 -8.035 -2.496 1.00 1.31 H new ATOM 2514 N ASN A 164 10.655 -8.776 -1.795 1.00 0.87 N ATOM 2515 CA ASN A 164 9.237 -8.490 -1.924 1.00 0.88 C ATOM 2516 C ASN A 164 8.981 -7.008 -1.666 1.00 1.12 C ATOM 2517 O ASN A 164 9.929 -6.227 -1.562 1.00 1.48 O ATOM 2518 CB ASN A 164 8.435 -9.360 -0.944 1.00 1.20 C ATOM 2519 CG ASN A 164 8.602 -10.846 -1.191 1.00 1.19 C ATOM 2520 OD1 ASN A 164 8.842 -11.278 -2.318 1.00 2.06 O ATOM 2521 ND2 ASN A 164 8.481 -11.639 -0.130 1.00 1.23 N ATOM 0 H ASN A 164 11.096 -9.096 -2.657 1.00 0.87 H new ATOM 0 HA ASN A 164 8.913 -8.725 -2.938 1.00 0.88 H new ATOM 0 HB2 ASN A 164 8.747 -9.130 0.075 1.00 1.20 H new ATOM 0 HB3 ASN A 164 7.379 -9.102 -1.020 1.00 1.20 H new ATOM 0 HD21 ASN A 164 8.588 -12.648 -0.233 1.00 1.23 H new ATOM 0 HD22 ASN A 164 8.282 -11.238 0.786 1.00 1.23 H new ATOM 2528 N PRO A 165 7.713 -6.572 -1.637 1.00 1.68 N ATOM 2529 CA PRO A 165 7.368 -5.260 -1.097 1.00 2.10 C ATOM 2530 C PRO A 165 7.910 -5.087 0.321 1.00 1.62 C ATOM 2531 O PRO A 165 7.235 -5.417 1.295 1.00 2.28 O ATOM 2532 CB PRO A 165 5.843 -5.279 -1.091 1.00 2.94 C ATOM 2533 CG PRO A 165 5.480 -6.203 -2.196 1.00 3.16 C ATOM 2534 CD PRO A 165 6.532 -7.271 -2.186 1.00 2.35 C ATOM 0 HA PRO A 165 7.789 -4.438 -1.676 1.00 2.10 H new ATOM 0 HB2 PRO A 165 5.454 -5.630 -0.135 1.00 2.94 H new ATOM 0 HB3 PRO A 165 5.433 -4.283 -1.255 1.00 2.94 H new ATOM 0 HG2 PRO A 165 4.488 -6.628 -2.043 1.00 3.16 H new ATOM 0 HG3 PRO A 165 5.459 -5.682 -3.153 1.00 3.16 H new ATOM 0 HD2 PRO A 165 6.240 -8.118 -1.566 1.00 2.35 H new ATOM 0 HD3 PRO A 165 6.722 -7.659 -3.187 1.00 2.35 H new ATOM 2542 N LYS A 166 9.146 -4.592 0.412 1.00 0.98 N ATOM 2543 CA LYS A 166 9.827 -4.419 1.688 1.00 0.66 C ATOM 2544 C LYS A 166 8.965 -3.632 2.667 1.00 0.59 C ATOM 2545 O LYS A 166 8.660 -4.099 3.763 1.00 0.75 O ATOM 2546 CB LYS A 166 11.159 -3.699 1.492 1.00 1.09 C ATOM 2547 CG LYS A 166 12.366 -4.560 1.814 1.00 1.74 C ATOM 2548 CD LYS A 166 12.271 -5.149 3.214 1.00 2.26 C ATOM 2549 CE LYS A 166 13.554 -5.859 3.614 1.00 2.74 C ATOM 2550 NZ LYS A 166 13.879 -6.995 2.711 1.00 3.18 N ATOM 0 H LYS A 166 9.698 -4.302 -0.396 1.00 0.98 H new ATOM 0 HA LYS A 166 10.011 -5.411 2.101 1.00 0.66 H new ATOM 0 HB2 LYS A 166 11.230 -3.359 0.459 1.00 1.09 H new ATOM 0 HB3 LYS A 166 11.178 -2.810 2.122 1.00 1.09 H new ATOM 0 HG2 LYS A 166 12.446 -5.365 1.084 1.00 1.74 H new ATOM 0 HG3 LYS A 166 13.274 -3.963 1.730 1.00 1.74 H new ATOM 0 HD2 LYS A 166 12.057 -4.355 3.929 1.00 2.26 H new ATOM 0 HD3 LYS A 166 11.438 -5.851 3.258 1.00 2.26 H new ATOM 0 HE2 LYS A 166 14.378 -5.146 3.607 1.00 2.74 H new ATOM 0 HE3 LYS A 166 13.459 -6.226 4.636 1.00 2.74 H new ATOM 0 HZ1 LYS A 166 14.703 -7.509 3.082 1.00 3.18 H new ATOM 0 HZ2 LYS A 166 13.065 -7.640 2.657 1.00 3.18 H new ATOM 0 HZ3 LYS A 166 14.096 -6.632 1.761 1.00 3.18 H new ATOM 2564 N VAL A 167 8.590 -2.425 2.268 1.00 0.49 N ATOM 2565 CA VAL A 167 7.711 -1.606 3.078 1.00 0.44 C ATOM 2566 C VAL A 167 6.374 -1.448 2.375 1.00 0.38 C ATOM 2567 O VAL A 167 6.329 -1.261 1.141 1.00 0.39 O ATOM 2568 CB VAL A 167 8.320 -0.215 3.385 1.00 0.53 C ATOM 2569 CG1 VAL A 167 9.832 -0.296 3.528 1.00 1.15 C ATOM 2570 CG2 VAL A 167 7.939 0.815 2.333 1.00 1.19 C ATOM 0 H VAL A 167 8.882 -1.995 1.390 1.00 0.49 H new ATOM 0 HA VAL A 167 7.572 -2.112 4.033 1.00 0.44 H new ATOM 0 HB VAL A 167 7.901 0.112 4.336 1.00 0.53 H new ATOM 0 HG11 VAL A 167 10.231 0.695 3.743 1.00 1.15 H new ATOM 0 HG12 VAL A 167 10.085 -0.974 4.344 1.00 1.15 H new ATOM 0 HG13 VAL A 167 10.266 -0.668 2.600 1.00 1.15 H new ATOM 0 HG21 VAL A 167 8.386 1.776 2.586 1.00 1.19 H new ATOM 0 HG22 VAL A 167 8.303 0.491 1.358 1.00 1.19 H new ATOM 0 HG23 VAL A 167 6.854 0.917 2.300 1.00 1.19 H new ATOM 2580 N CYS A 168 5.289 -1.543 3.141 1.00 0.38 N ATOM 2581 CA CYS A 168 3.967 -1.479 2.545 1.00 0.40 C ATOM 2582 C CYS A 168 3.047 -0.518 3.302 1.00 0.47 C ATOM 2583 O CYS A 168 2.488 -0.846 4.342 1.00 0.94 O ATOM 2584 CB CYS A 168 3.366 -2.877 2.480 1.00 0.48 C ATOM 2585 SG CYS A 168 1.813 -2.973 1.559 1.00 1.36 S ATOM 0 H CYS A 168 5.302 -1.662 4.154 1.00 0.38 H new ATOM 0 HA CYS A 168 4.067 -1.087 1.533 1.00 0.40 H new ATOM 0 HB2 CYS A 168 4.090 -3.551 2.021 1.00 0.48 H new ATOM 0 HB3 CYS A 168 3.196 -3.235 3.495 1.00 0.48 H new ATOM 0 HG CYS A 168 2.066 -3.016 0.285 1.00 1.36 H new ATOM 2591 N ALA A 169 2.891 0.659 2.731 1.00 0.29 N ATOM 2592 CA ALA A 169 2.098 1.753 3.287 1.00 0.28 C ATOM 2593 C ALA A 169 0.635 1.678 2.857 1.00 0.27 C ATOM 2594 O ALA A 169 0.048 2.692 2.484 1.00 0.28 O ATOM 2595 CB ALA A 169 2.691 3.080 2.892 1.00 0.31 C ATOM 0 H ALA A 169 3.324 0.895 1.838 1.00 0.29 H new ATOM 0 HA ALA A 169 2.124 1.655 4.372 1.00 0.28 H new ATOM 0 HB1 ALA A 169 2.091 3.887 3.313 1.00 0.31 H new ATOM 0 HB2 ALA A 169 3.710 3.150 3.272 1.00 0.31 H new ATOM 0 HB3 ALA A 169 2.702 3.165 1.805 1.00 0.31 H new ATOM 2601 N LEU A 170 0.110 0.465 2.763 1.00 0.28 N ATOM 2602 CA LEU A 170 -1.202 0.228 2.170 1.00 0.32 C ATOM 2603 C LEU A 170 -2.332 0.932 2.928 1.00 0.32 C ATOM 2604 O LEU A 170 -2.606 0.631 4.085 1.00 0.52 O ATOM 2605 CB LEU A 170 -1.464 -1.277 2.091 1.00 0.48 C ATOM 2606 CG LEU A 170 -2.927 -1.691 1.907 1.00 0.39 C ATOM 2607 CD1 LEU A 170 -3.518 -1.116 0.635 1.00 0.66 C ATOM 2608 CD2 LEU A 170 -3.051 -3.199 1.897 1.00 0.69 C ATOM 0 H LEU A 170 0.577 -0.380 3.093 1.00 0.28 H new ATOM 0 HA LEU A 170 -1.191 0.655 1.167 1.00 0.32 H new ATOM 0 HB2 LEU A 170 -0.884 -1.684 1.263 1.00 0.48 H new ATOM 0 HB3 LEU A 170 -1.087 -1.740 3.003 1.00 0.48 H new ATOM 0 HG LEU A 170 -3.489 -1.288 2.750 1.00 0.39 H new ATOM 0 HD11 LEU A 170 -4.557 -1.433 0.541 1.00 0.66 H new ATOM 0 HD12 LEU A 170 -3.472 -0.028 0.672 1.00 0.66 H new ATOM 0 HD13 LEU A 170 -2.950 -1.474 -0.224 1.00 0.66 H new ATOM 0 HD21 LEU A 170 -4.097 -3.477 1.765 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -2.461 -3.607 1.076 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -2.685 -3.600 2.842 1.00 0.69 H new ATOM 2620 N PHE A 171 -2.987 1.860 2.248 1.00 0.27 N ATOM 2621 CA PHE A 171 -4.131 2.574 2.801 1.00 0.27 C ATOM 2622 C PHE A 171 -5.347 2.421 1.881 1.00 0.27 C ATOM 2623 O PHE A 171 -5.275 2.733 0.694 1.00 0.34 O ATOM 2624 CB PHE A 171 -3.745 4.051 3.005 1.00 0.32 C ATOM 2625 CG PHE A 171 -4.800 5.051 2.623 1.00 0.29 C ATOM 2626 CD1 PHE A 171 -5.952 5.195 3.376 1.00 0.33 C ATOM 2627 CD2 PHE A 171 -4.627 5.852 1.507 1.00 0.38 C ATOM 2628 CE1 PHE A 171 -6.912 6.120 3.020 1.00 0.41 C ATOM 2629 CE2 PHE A 171 -5.583 6.778 1.147 1.00 0.48 C ATOM 2630 CZ PHE A 171 -6.727 6.914 1.906 1.00 0.47 C ATOM 0 H PHE A 171 -2.742 2.140 1.298 1.00 0.27 H new ATOM 0 HA PHE A 171 -4.407 2.153 3.768 1.00 0.27 H new ATOM 0 HB2 PHE A 171 -3.489 4.201 4.054 1.00 0.32 H new ATOM 0 HB3 PHE A 171 -2.846 4.257 2.425 1.00 0.32 H new ATOM 0 HD1 PHE A 171 -6.101 4.578 4.250 1.00 0.33 H new ATOM 0 HD2 PHE A 171 -3.732 5.750 0.911 1.00 0.38 H new ATOM 0 HE1 PHE A 171 -7.809 6.223 3.613 1.00 0.41 H new ATOM 0 HE2 PHE A 171 -5.437 7.395 0.273 1.00 0.48 H new ATOM 0 HZ PHE A 171 -7.477 7.640 1.629 1.00 0.47 H new ATOM 2640 N ILE A 172 -6.457 1.911 2.418 1.00 0.23 N ATOM 2641 CA ILE A 172 -7.685 1.815 1.636 1.00 0.23 C ATOM 2642 C ILE A 172 -8.769 2.750 2.182 1.00 0.23 C ATOM 2643 O ILE A 172 -9.154 2.694 3.364 1.00 0.24 O ATOM 2644 CB ILE A 172 -8.261 0.385 1.529 1.00 0.23 C ATOM 2645 CG1 ILE A 172 -9.554 0.430 0.699 1.00 0.26 C ATOM 2646 CG2 ILE A 172 -8.506 -0.225 2.896 1.00 0.21 C ATOM 2647 CD1 ILE A 172 -10.355 -0.853 0.725 1.00 0.30 C ATOM 0 H ILE A 172 -6.529 1.564 3.375 1.00 0.23 H new ATOM 0 HA ILE A 172 -7.394 2.119 0.631 1.00 0.23 H new ATOM 0 HB ILE A 172 -7.532 -0.254 1.031 1.00 0.23 H new ATOM 0 HG12 ILE A 172 -10.180 1.243 1.067 1.00 0.26 H new ATOM 0 HG13 ILE A 172 -9.300 0.666 -0.335 1.00 0.26 H new ATOM 0 HG21 ILE A 172 -8.911 -1.230 2.779 1.00 0.21 H new ATOM 0 HG22 ILE A 172 -7.566 -0.274 3.446 1.00 0.21 H new ATOM 0 HG23 ILE A 172 -9.217 0.391 3.447 1.00 0.21 H new ATOM 0 HD11 ILE A 172 -11.250 -0.735 0.115 1.00 0.30 H new ATOM 0 HD12 ILE A 172 -9.750 -1.668 0.328 1.00 0.30 H new ATOM 0 HD13 ILE A 172 -10.643 -1.081 1.751 1.00 0.30 H new ATOM 2659 N MET A 173 -9.250 3.613 1.311 1.00 0.24 N ATOM 2660 CA MET A 173 -10.317 4.534 1.651 1.00 0.25 C ATOM 2661 C MET A 173 -11.586 4.160 0.895 1.00 0.27 C ATOM 2662 O MET A 173 -11.533 3.395 -0.069 1.00 0.31 O ATOM 2663 CB MET A 173 -9.900 5.951 1.302 1.00 0.28 C ATOM 2664 CG MET A 173 -9.535 6.122 -0.160 1.00 0.33 C ATOM 2665 SD MET A 173 -9.257 7.841 -0.581 1.00 0.99 S ATOM 2666 CE MET A 173 -10.713 8.533 0.175 1.00 0.50 C ATOM 0 H MET A 173 -8.915 3.696 0.351 1.00 0.24 H new ATOM 0 HA MET A 173 -10.515 4.475 2.721 1.00 0.25 H new ATOM 0 HB2 MET A 173 -10.713 6.634 1.549 1.00 0.28 H new ATOM 0 HB3 MET A 173 -9.047 6.234 1.919 1.00 0.28 H new ATOM 0 HG2 MET A 173 -8.637 5.544 -0.380 1.00 0.33 H new ATOM 0 HG3 MET A 173 -10.334 5.720 -0.783 1.00 0.33 H new ATOM 0 HE1 MET A 173 -10.889 9.533 -0.222 1.00 0.50 H new ATOM 0 HE2 MET A 173 -11.572 7.899 -0.043 1.00 0.50 H new ATOM 0 HE3 MET A 173 -10.570 8.591 1.254 1.00 0.50 H new ATOM 2676 N LYS A 174 -12.722 4.694 1.320 1.00 0.30 N ATOM 2677 CA LYS A 174 -13.988 4.317 0.719 1.00 0.34 C ATOM 2678 C LYS A 174 -14.670 5.478 0.006 1.00 0.30 C ATOM 2679 O LYS A 174 -14.628 6.626 0.433 1.00 0.33 O ATOM 2680 CB LYS A 174 -14.960 3.756 1.763 1.00 0.50 C ATOM 2681 CG LYS A 174 -15.608 4.825 2.629 1.00 0.69 C ATOM 2682 CD LYS A 174 -16.753 4.269 3.458 1.00 0.77 C ATOM 2683 CE LYS A 174 -17.938 3.899 2.582 1.00 0.74 C ATOM 2684 NZ LYS A 174 -19.102 3.458 3.389 1.00 1.22 N ATOM 0 H LYS A 174 -12.791 5.382 2.070 1.00 0.30 H new ATOM 0 HA LYS A 174 -13.743 3.549 -0.015 1.00 0.34 H new ATOM 0 HB2 LYS A 174 -15.740 3.191 1.254 1.00 0.50 H new ATOM 0 HB3 LYS A 174 -14.426 3.055 2.405 1.00 0.50 H new ATOM 0 HG2 LYS A 174 -14.858 5.259 3.291 1.00 0.69 H new ATOM 0 HG3 LYS A 174 -15.978 5.631 1.995 1.00 0.69 H new ATOM 0 HD2 LYS A 174 -16.415 3.390 4.006 1.00 0.77 H new ATOM 0 HD3 LYS A 174 -17.061 5.007 4.198 1.00 0.77 H new ATOM 0 HE2 LYS A 174 -18.222 4.757 1.973 1.00 0.74 H new ATOM 0 HE3 LYS A 174 -17.649 3.103 1.896 1.00 0.74 H new ATOM 0 HZ1 LYS A 174 -19.698 2.823 2.821 1.00 1.22 H new ATOM 0 HZ2 LYS A 174 -18.767 2.954 4.235 1.00 1.22 H new ATOM 0 HZ3 LYS A 174 -19.658 4.288 3.678 1.00 1.22 H new ATOM 2698 N GLY A 175 -15.256 5.141 -1.109 1.00 0.28 N ATOM 2699 CA GLY A 175 -16.263 5.958 -1.738 1.00 0.28 C ATOM 2700 C GLY A 175 -15.787 6.736 -2.945 1.00 0.28 C ATOM 2701 O GLY A 175 -16.573 6.911 -3.875 1.00 0.31 O ATOM 0 H GLY A 175 -15.047 4.281 -1.615 1.00 0.28 H new ATOM 0 HA2 GLY A 175 -17.093 5.319 -2.040 1.00 0.28 H new ATOM 0 HA3 GLY A 175 -16.653 6.660 -1.001 1.00 0.28 H new ATOM 2705 N THR A 176 -14.504 7.101 -3.006 1.00 0.27 N ATOM 2706 CA THR A 176 -14.001 7.890 -4.130 1.00 0.32 C ATOM 2707 C THR A 176 -12.484 7.991 -4.154 1.00 0.38 C ATOM 2708 O THR A 176 -11.822 7.894 -3.123 1.00 0.44 O ATOM 2709 CB THR A 176 -14.521 9.329 -4.086 1.00 0.43 C ATOM 2710 OG1 THR A 176 -14.931 9.672 -2.751 1.00 0.57 O ATOM 2711 CG2 THR A 176 -15.670 9.550 -5.061 1.00 0.68 C ATOM 0 H THR A 176 -13.805 6.867 -2.301 1.00 0.27 H new ATOM 0 HA THR A 176 -14.356 7.361 -5.015 1.00 0.32 H new ATOM 0 HB THR A 176 -13.702 9.981 -4.390 1.00 0.43 H new ATOM 0 HG1 THR A 176 -15.260 10.595 -2.737 1.00 0.57 H new ATOM 0 HG21 THR A 176 -16.008 10.584 -4.997 1.00 0.68 H new ATOM 0 HG22 THR A 176 -15.331 9.342 -6.076 1.00 0.68 H new ATOM 0 HG23 THR A 176 -16.494 8.883 -4.809 1.00 0.68 H new ATOM 2719 N ALA A 177 -11.951 8.189 -5.358 1.00 0.50 N ATOM 2720 CA ALA A 177 -10.552 8.546 -5.552 1.00 0.65 C ATOM 2721 C ALA A 177 -10.382 10.060 -5.457 1.00 0.68 C ATOM 2722 O ALA A 177 -9.267 10.576 -5.440 1.00 0.86 O ATOM 2723 CB ALA A 177 -10.054 8.036 -6.897 1.00 0.82 C ATOM 0 H ALA A 177 -12.480 8.106 -6.226 1.00 0.50 H new ATOM 0 HA ALA A 177 -9.958 8.077 -4.768 1.00 0.65 H new ATOM 0 HB1 ALA A 177 -9.007 8.311 -7.026 1.00 0.82 H new ATOM 0 HB2 ALA A 177 -10.151 6.951 -6.933 1.00 0.82 H new ATOM 0 HB3 ALA A 177 -10.647 8.480 -7.697 1.00 0.82 H new ATOM 2729 N ASP A 178 -11.511 10.763 -5.430 1.00 0.61 N ATOM 2730 CA ASP A 178 -11.523 12.225 -5.398 1.00 0.68 C ATOM 2731 C ASP A 178 -11.002 12.758 -4.074 1.00 0.67 C ATOM 2732 O ASP A 178 -10.439 13.848 -4.013 1.00 0.79 O ATOM 2733 CB ASP A 178 -12.939 12.759 -5.624 1.00 0.82 C ATOM 2734 CG ASP A 178 -13.472 12.449 -7.005 1.00 1.38 C ATOM 2735 OD1 ASP A 178 -13.248 13.256 -7.927 1.00 1.60 O ATOM 2736 OD2 ASP A 178 -14.112 11.390 -7.175 1.00 2.16 O ATOM 0 H ASP A 178 -12.439 10.340 -5.430 1.00 0.61 H new ATOM 0 HA ASP A 178 -10.868 12.567 -6.199 1.00 0.68 H new ATOM 0 HB2 ASP A 178 -13.607 12.330 -4.877 1.00 0.82 H new ATOM 0 HB3 ASP A 178 -12.943 13.838 -5.472 1.00 0.82 H new TER 2741 ASP A 178