USER MOD reduce.3.24.130724 H: found=0, std=0, add=1079, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1076 hydrogens (30 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 90 HIS HE2 : A 90 HIS NE2 : A 148 HEMFE :(H bumps) USER MOD Set 1.1: A 41 MET CE :methyl 159:sc= -5.84! (180deg=-4.34!) USER MOD Set 1.2: A 148 HEM CMB :methyl -30:sc= -7.73! (180deg=-6.99!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= -0.555 USER MOD Single : A 6 GLN : amide:sc= -0.0365 X(o=-0.036,f=-0.43) USER MOD Single : A 8 GLN : amide:sc= -0.598 K(o=-0.6,f=-7.6!) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 69:sc= 1.06 USER MOD Single : A 15 LYS NZ :NH3+ -124:sc= -0.0105 (180deg=-0.133) USER MOD Single : A 20 SER OG : rot 180:sc= 0.00283 USER MOD Single : A 22 ASN : amide:sc= -7.26! C(o=-7.3!,f=-19!) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 CYS SG : rot -140:sc= -0.546 USER MOD Single : A 32 THR OG1 : rot -82:sc= -1.92! USER MOD Single : A 33 LYS NZ :NH3+ -175:sc= 0.365 (180deg=0.326) USER MOD Single : A 36 SER OG : rot 80:sc= -2.52! USER MOD Single : A 38 HIS : no HD1:sc= -7.42! C(o=-7.4!,f=-2.9!) USER MOD Single : A 39 HIS : no HD1:sc= -0.372 X(o=-0.37,f=-0.0057) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 GLN : amide:sc= -0.699 X(o=-0.7,f=-0.51) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 HIS : no HD1:sc= -0.0311 X(o=-0.031,f=-0.25) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 83 MET CE :methyl -176:sc= -0.353 (180deg=-0.387) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 TYR OH : rot -97:sc= 0.713 USER MOD Single : A 95 ASN : amide:sc= -15.1! C(o=-15!,f=-14!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 HIS : no HD1:sc= -0.0106 X(o=-0.011,f=0) USER MOD Single : A 99 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.38) USER MOD Single : A 102 TYR OH : rot 130:sc= 1.04 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 114 MET CE :methyl -152:sc= -8.8! (180deg=-11!) USER MOD Single : A 116 HIS : no HD1:sc= -2.75! X(o=-2.8!,f=-2.3) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 MET CE :methyl 175:sc= -0.267 (180deg=-0.321) USER MOD Single : A 123 ASN : amide:sc= -6.28! C(o=-6.3!,f=-10!) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 TYR OH : rot 30:sc= -0.71 USER MOD Single : A 138 SER OG : rot -160:sc= -0.182 USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 146 GLN : amide:sc= -2.71 X(o=-2.7,f=-2.6!) USER MOD Single : A 147 SER OG : rot -178:sc= 2.07 USER MOD Single : A 148 HEM CMA :methyl 150:sc= -6.03! (180deg=-6.03!) USER MOD Single : A 148 HEM CMC :methyl -30:sc= -7.52! (180deg=-11.8!) USER MOD Single : A 148 HEM CMD :methyl -30:sc= -1.93 (180deg=-1.94!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.113 7.503 10.580 1.00 0.00 N ATOM 2 CA GLY A 1 10.415 7.550 9.264 1.00 0.00 C ATOM 3 C GLY A 1 11.398 7.157 8.160 1.00 0.00 C ATOM 4 O GLY A 1 11.933 7.998 7.466 1.00 0.00 O ATOM 0 H1 GLY A 1 10.449 7.769 11.335 1.00 0.00 H new ATOM 0 H2 GLY A 1 11.465 6.539 10.752 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.913 8.167 10.572 1.00 0.00 H new ATOM 0 HA2 GLY A 1 9.562 6.871 9.267 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.025 8.551 9.081 1.00 0.00 H new ATOM 8 N LEU A 2 11.639 5.884 7.994 1.00 0.00 N ATOM 9 CA LEU A 2 12.589 5.433 6.936 1.00 0.00 C ATOM 10 C LEU A 2 13.956 6.086 7.153 1.00 0.00 C ATOM 11 O LEU A 2 14.086 7.052 7.878 1.00 0.00 O ATOM 12 CB LEU A 2 11.975 5.892 5.612 1.00 0.00 C ATOM 13 CG LEU A 2 11.071 4.791 5.058 1.00 0.00 C ATOM 14 CD1 LEU A 2 10.462 5.251 3.733 1.00 0.00 C ATOM 15 CD2 LEU A 2 11.898 3.524 4.825 1.00 0.00 C ATOM 0 H LEU A 2 11.219 5.136 8.546 1.00 0.00 H new ATOM 0 HA LEU A 2 12.741 4.354 6.951 1.00 0.00 H new ATOM 0 HB2 LEU A 2 11.401 6.806 5.763 1.00 0.00 H new ATOM 0 HB3 LEU A 2 12.763 6.125 4.895 1.00 0.00 H new ATOM 0 HG LEU A 2 10.274 4.581 5.771 1.00 0.00 H new ATOM 0 HD11 LEU A 2 9.817 4.466 3.337 1.00 0.00 H new ATOM 0 HD12 LEU A 2 9.875 6.155 3.897 1.00 0.00 H new ATOM 0 HD13 LEU A 2 11.259 5.460 3.019 1.00 0.00 H new ATOM 0 HD21 LEU A 2 11.255 2.737 4.430 1.00 0.00 H new ATOM 0 HD22 LEU A 2 12.694 3.735 4.111 1.00 0.00 H new ATOM 0 HD23 LEU A 2 12.335 3.196 5.768 1.00 0.00 H new ATOM 27 N SER A 3 14.977 5.566 6.529 1.00 0.00 N ATOM 28 CA SER A 3 16.332 6.160 6.702 1.00 0.00 C ATOM 29 C SER A 3 17.071 6.167 5.367 1.00 0.00 C ATOM 30 O SER A 3 16.476 6.107 4.309 1.00 0.00 O ATOM 31 CB SER A 3 17.048 5.255 7.701 1.00 0.00 C ATOM 32 OG SER A 3 17.661 4.178 7.004 1.00 0.00 O ATOM 0 H SER A 3 14.932 4.758 5.909 1.00 0.00 H new ATOM 0 HA SER A 3 16.286 7.191 7.053 1.00 0.00 H new ATOM 0 HB2 SER A 3 17.799 5.823 8.250 1.00 0.00 H new ATOM 0 HB3 SER A 3 16.339 4.872 8.435 1.00 0.00 H new ATOM 0 HG SER A 3 18.123 3.596 7.643 1.00 0.00 H new ATOM 38 N ALA A 4 18.370 6.237 5.414 1.00 0.00 N ATOM 39 CA ALA A 4 19.167 6.244 4.155 1.00 0.00 C ATOM 40 C ALA A 4 19.536 4.808 3.783 1.00 0.00 C ATOM 41 O ALA A 4 19.582 4.447 2.624 1.00 0.00 O ATOM 42 CB ALA A 4 20.419 7.063 4.474 1.00 0.00 C ATOM 0 H ALA A 4 18.918 6.290 6.273 1.00 0.00 H new ATOM 0 HA ALA A 4 18.621 6.669 3.313 1.00 0.00 H new ATOM 0 HB1 ALA A 4 21.056 7.112 3.591 1.00 0.00 H new ATOM 0 HB2 ALA A 4 20.129 8.071 4.769 1.00 0.00 H new ATOM 0 HB3 ALA A 4 20.965 6.590 5.290 1.00 0.00 H new ATOM 48 N ALA A 5 19.794 3.983 4.761 1.00 0.00 N ATOM 49 CA ALA A 5 20.154 2.568 4.467 1.00 0.00 C ATOM 50 C ALA A 5 18.886 1.714 4.453 1.00 0.00 C ATOM 51 O ALA A 5 18.851 0.648 3.870 1.00 0.00 O ATOM 52 CB ALA A 5 21.086 2.144 5.604 1.00 0.00 C ATOM 0 H ALA A 5 19.771 4.228 5.751 1.00 0.00 H new ATOM 0 HA ALA A 5 20.635 2.449 3.496 1.00 0.00 H new ATOM 0 HB1 ALA A 5 21.394 1.109 5.455 1.00 0.00 H new ATOM 0 HB2 ALA A 5 21.966 2.787 5.612 1.00 0.00 H new ATOM 0 HB3 ALA A 5 20.563 2.234 6.556 1.00 0.00 H new ATOM 58 N GLN A 6 17.839 2.175 5.085 1.00 0.00 N ATOM 59 CA GLN A 6 16.574 1.388 5.098 1.00 0.00 C ATOM 60 C GLN A 6 15.896 1.501 3.732 1.00 0.00 C ATOM 61 O GLN A 6 15.498 0.514 3.146 1.00 0.00 O ATOM 62 CB GLN A 6 15.713 2.016 6.195 1.00 0.00 C ATOM 63 CG GLN A 6 15.995 1.315 7.527 1.00 0.00 C ATOM 64 CD GLN A 6 15.342 2.086 8.675 1.00 0.00 C ATOM 65 OE1 GLN A 6 16.024 2.635 9.518 1.00 0.00 O ATOM 66 NE2 GLN A 6 14.041 2.150 8.746 1.00 0.00 N ATOM 0 H GLN A 6 17.806 3.060 5.591 1.00 0.00 H new ATOM 0 HA GLN A 6 16.739 0.328 5.291 1.00 0.00 H new ATOM 0 HB2 GLN A 6 15.931 3.081 6.279 1.00 0.00 H new ATOM 0 HB3 GLN A 6 14.657 1.926 5.940 1.00 0.00 H new ATOM 0 HG2 GLN A 6 15.611 0.295 7.499 1.00 0.00 H new ATOM 0 HG3 GLN A 6 17.071 1.246 7.690 1.00 0.00 H new ATOM 0 HE21 GLN A 6 13.468 1.689 8.039 1.00 0.00 H new ATOM 0 HE22 GLN A 6 13.596 2.661 9.509 1.00 0.00 H new ATOM 75 N ARG A 7 15.768 2.692 3.210 1.00 0.00 N ATOM 76 CA ARG A 7 15.124 2.840 1.876 1.00 0.00 C ATOM 77 C ARG A 7 15.848 1.938 0.878 1.00 0.00 C ATOM 78 O ARG A 7 15.235 1.259 0.079 1.00 0.00 O ATOM 79 CB ARG A 7 15.284 4.311 1.495 1.00 0.00 C ATOM 80 CG ARG A 7 14.596 4.561 0.152 1.00 0.00 C ATOM 81 CD ARG A 7 15.653 4.715 -0.944 1.00 0.00 C ATOM 82 NE ARG A 7 16.163 6.105 -0.803 1.00 0.00 N ATOM 83 CZ ARG A 7 17.147 6.520 -1.553 1.00 0.00 C ATOM 84 NH1 ARG A 7 16.903 7.013 -2.737 1.00 0.00 N ATOM 85 NH2 ARG A 7 18.376 6.443 -1.119 1.00 0.00 N ATOM 0 H ARG A 7 16.079 3.560 3.646 1.00 0.00 H new ATOM 0 HA ARG A 7 14.072 2.556 1.883 1.00 0.00 H new ATOM 0 HB2 ARG A 7 14.848 4.948 2.265 1.00 0.00 H new ATOM 0 HB3 ARG A 7 16.341 4.569 1.429 1.00 0.00 H new ATOM 0 HG2 ARG A 7 13.928 3.733 -0.086 1.00 0.00 H new ATOM 0 HG3 ARG A 7 13.982 5.460 0.208 1.00 0.00 H new ATOM 0 HD2 ARG A 7 16.455 3.987 -0.822 1.00 0.00 H new ATOM 0 HD3 ARG A 7 15.222 4.552 -1.932 1.00 0.00 H new ATOM 0 HE ARG A 7 15.743 6.735 -0.119 1.00 0.00 H new ATOM 0 HH11 ARG A 7 15.943 7.074 -3.076 1.00 0.00 H new ATOM 0 HH12 ARG A 7 17.672 7.337 -3.323 1.00 0.00 H new ATOM 0 HH21 ARG A 7 18.567 6.058 -0.194 1.00 0.00 H new ATOM 0 HH22 ARG A 7 19.145 6.767 -1.705 1.00 0.00 H new ATOM 99 N GLN A 8 17.154 1.913 0.926 1.00 0.00 N ATOM 100 CA GLN A 8 17.913 1.039 -0.011 1.00 0.00 C ATOM 101 C GLN A 8 17.353 -0.380 0.084 1.00 0.00 C ATOM 102 O GLN A 8 17.220 -1.077 -0.902 1.00 0.00 O ATOM 103 CB GLN A 8 19.364 1.091 0.474 1.00 0.00 C ATOM 104 CG GLN A 8 20.250 1.688 -0.621 1.00 0.00 C ATOM 105 CD GLN A 8 19.699 3.046 -1.061 1.00 0.00 C ATOM 106 OE1 GLN A 8 18.966 3.683 -0.331 1.00 0.00 O ATOM 107 NE2 GLN A 8 20.024 3.519 -2.233 1.00 0.00 N ATOM 0 H GLN A 8 17.725 2.459 1.572 1.00 0.00 H new ATOM 0 HA GLN A 8 17.839 1.356 -1.051 1.00 0.00 H new ATOM 0 HB2 GLN A 8 19.434 1.692 1.380 1.00 0.00 H new ATOM 0 HB3 GLN A 8 19.709 0.089 0.729 1.00 0.00 H new ATOM 0 HG2 GLN A 8 21.269 1.803 -0.253 1.00 0.00 H new ATOM 0 HG3 GLN A 8 20.293 1.011 -1.474 1.00 0.00 H new ATOM 0 HE21 GLN A 8 20.639 2.984 -2.846 1.00 0.00 H new ATOM 0 HE22 GLN A 8 19.663 4.423 -2.536 1.00 0.00 H new ATOM 116 N VAL A 9 17.004 -0.802 1.269 1.00 0.00 N ATOM 117 CA VAL A 9 16.430 -2.165 1.440 1.00 0.00 C ATOM 118 C VAL A 9 15.007 -2.169 0.880 1.00 0.00 C ATOM 119 O VAL A 9 14.495 -3.185 0.453 1.00 0.00 O ATOM 120 CB VAL A 9 16.423 -2.408 2.951 1.00 0.00 C ATOM 121 CG1 VAL A 9 15.936 -3.827 3.242 1.00 0.00 C ATOM 122 CG2 VAL A 9 17.841 -2.236 3.500 1.00 0.00 C ATOM 0 H VAL A 9 17.092 -0.259 2.128 1.00 0.00 H new ATOM 0 HA VAL A 9 16.994 -2.939 0.920 1.00 0.00 H new ATOM 0 HB VAL A 9 15.755 -1.691 3.429 1.00 0.00 H new ATOM 0 HG11 VAL A 9 15.932 -3.997 4.319 1.00 0.00 H new ATOM 0 HG12 VAL A 9 14.926 -3.952 2.851 1.00 0.00 H new ATOM 0 HG13 VAL A 9 16.602 -4.545 2.764 1.00 0.00 H new ATOM 0 HG21 VAL A 9 17.838 -2.409 4.576 1.00 0.00 H new ATOM 0 HG22 VAL A 9 18.507 -2.953 3.019 1.00 0.00 H new ATOM 0 HG23 VAL A 9 18.190 -1.224 3.296 1.00 0.00 H new ATOM 132 N VAL A 10 14.370 -1.029 0.874 1.00 0.00 N ATOM 133 CA VAL A 10 12.983 -0.943 0.337 1.00 0.00 C ATOM 134 C VAL A 10 13.033 -0.985 -1.191 1.00 0.00 C ATOM 135 O VAL A 10 12.280 -1.695 -1.829 1.00 0.00 O ATOM 136 CB VAL A 10 12.452 0.406 0.828 1.00 0.00 C ATOM 137 CG1 VAL A 10 11.074 0.675 0.220 1.00 0.00 C ATOM 138 CG2 VAL A 10 12.341 0.380 2.354 1.00 0.00 C ATOM 0 H VAL A 10 14.754 -0.150 1.220 1.00 0.00 H new ATOM 0 HA VAL A 10 12.346 -1.765 0.665 1.00 0.00 H new ATOM 0 HB VAL A 10 13.137 1.197 0.523 1.00 0.00 H new ATOM 0 HG11 VAL A 10 10.702 1.637 0.573 1.00 0.00 H new ATOM 0 HG12 VAL A 10 11.153 0.694 -0.867 1.00 0.00 H new ATOM 0 HG13 VAL A 10 10.384 -0.114 0.520 1.00 0.00 H new ATOM 0 HG21 VAL A 10 11.963 1.339 2.708 1.00 0.00 H new ATOM 0 HG22 VAL A 10 11.657 -0.413 2.656 1.00 0.00 H new ATOM 0 HG23 VAL A 10 13.324 0.195 2.787 1.00 0.00 H new ATOM 148 N ALA A 11 13.919 -0.232 -1.782 1.00 0.00 N ATOM 149 CA ALA A 11 14.025 -0.229 -3.267 1.00 0.00 C ATOM 150 C ALA A 11 14.678 -1.531 -3.742 1.00 0.00 C ATOM 151 O ALA A 11 14.659 -1.853 -4.913 1.00 0.00 O ATOM 152 CB ALA A 11 14.906 0.977 -3.601 1.00 0.00 C ATOM 0 H ALA A 11 14.575 0.382 -1.299 1.00 0.00 H new ATOM 0 HA ALA A 11 13.054 -0.162 -3.757 1.00 0.00 H new ATOM 0 HB1 ALA A 11 15.032 1.048 -4.681 1.00 0.00 H new ATOM 0 HB2 ALA A 11 14.433 1.887 -3.231 1.00 0.00 H new ATOM 0 HB3 ALA A 11 15.881 0.857 -3.129 1.00 0.00 H new ATOM 158 N SER A 12 15.260 -2.282 -2.844 1.00 0.00 N ATOM 159 CA SER A 12 15.915 -3.559 -3.251 1.00 0.00 C ATOM 160 C SER A 12 14.919 -4.716 -3.128 1.00 0.00 C ATOM 161 O SER A 12 15.006 -5.699 -3.837 1.00 0.00 O ATOM 162 CB SER A 12 17.079 -3.741 -2.278 1.00 0.00 C ATOM 163 OG SER A 12 17.888 -4.827 -2.713 1.00 0.00 O ATOM 0 H SER A 12 15.310 -2.066 -1.848 1.00 0.00 H new ATOM 0 HA SER A 12 16.257 -3.540 -4.286 1.00 0.00 H new ATOM 0 HB2 SER A 12 17.672 -2.828 -2.227 1.00 0.00 H new ATOM 0 HB3 SER A 12 16.702 -3.933 -1.273 1.00 0.00 H new ATOM 0 HG SER A 12 18.637 -4.946 -2.092 1.00 0.00 H new ATOM 169 N THR A 13 13.974 -4.610 -2.233 1.00 0.00 N ATOM 170 CA THR A 13 12.978 -5.707 -2.067 1.00 0.00 C ATOM 171 C THR A 13 11.767 -5.454 -2.968 1.00 0.00 C ATOM 172 O THR A 13 10.933 -6.317 -3.153 1.00 0.00 O ATOM 173 CB THR A 13 12.571 -5.661 -0.592 1.00 0.00 C ATOM 174 OG1 THR A 13 12.379 -4.310 -0.198 1.00 0.00 O ATOM 175 CG2 THR A 13 13.671 -6.293 0.263 1.00 0.00 C ATOM 0 H THR A 13 13.849 -3.812 -1.610 1.00 0.00 H new ATOM 0 HA THR A 13 13.385 -6.680 -2.342 1.00 0.00 H new ATOM 0 HB THR A 13 11.643 -6.216 -0.453 1.00 0.00 H new ATOM 0 HG1 THR A 13 11.581 -3.951 -0.639 1.00 0.00 H new ATOM 0 HG21 THR A 13 13.380 -6.260 1.313 1.00 0.00 H new ATOM 0 HG22 THR A 13 13.817 -7.330 -0.040 1.00 0.00 H new ATOM 0 HG23 THR A 13 14.601 -5.741 0.126 1.00 0.00 H new ATOM 183 N TRP A 14 11.657 -4.279 -3.528 1.00 0.00 N ATOM 184 CA TRP A 14 10.491 -3.988 -4.408 1.00 0.00 C ATOM 185 C TRP A 14 10.837 -4.352 -5.852 1.00 0.00 C ATOM 186 O TRP A 14 9.969 -4.584 -6.670 1.00 0.00 O ATOM 187 CB TRP A 14 10.234 -2.487 -4.266 1.00 0.00 C ATOM 188 CG TRP A 14 8.773 -2.258 -4.048 1.00 0.00 C ATOM 189 CD1 TRP A 14 8.176 -2.135 -2.840 1.00 0.00 C ATOM 190 CD2 TRP A 14 7.716 -2.127 -5.042 1.00 0.00 C ATOM 191 NE1 TRP A 14 6.819 -1.938 -3.030 1.00 0.00 N ATOM 192 CE2 TRP A 14 6.487 -1.925 -4.371 1.00 0.00 C ATOM 193 CE3 TRP A 14 7.706 -2.164 -6.447 1.00 0.00 C ATOM 194 CZ2 TRP A 14 5.290 -1.766 -5.070 1.00 0.00 C ATOM 195 CZ3 TRP A 14 6.503 -2.003 -7.153 1.00 0.00 C ATOM 196 CH2 TRP A 14 5.298 -1.805 -6.466 1.00 0.00 C ATOM 0 H TRP A 14 12.321 -3.513 -3.414 1.00 0.00 H new ATOM 0 HA TRP A 14 9.607 -4.564 -4.134 1.00 0.00 H new ATOM 0 HB2 TRP A 14 10.806 -2.085 -3.430 1.00 0.00 H new ATOM 0 HB3 TRP A 14 10.567 -1.962 -5.161 1.00 0.00 H new ATOM 0 HD1 TRP A 14 8.676 -2.183 -1.884 1.00 0.00 H new ATOM 0 HE1 TRP A 14 6.147 -1.817 -2.273 1.00 0.00 H new ATOM 0 HE3 TRP A 14 8.629 -2.317 -6.987 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 4.364 -1.614 -4.535 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 6.507 -2.032 -8.233 1.00 0.00 H new ATOM 0 HH2 TRP A 14 4.376 -1.683 -7.015 1.00 0.00 H new ATOM 207 N LYS A 15 12.100 -4.412 -6.171 1.00 0.00 N ATOM 208 CA LYS A 15 12.498 -4.771 -7.560 1.00 0.00 C ATOM 209 C LYS A 15 12.341 -6.283 -7.768 1.00 0.00 C ATOM 210 O LYS A 15 12.546 -6.792 -8.852 1.00 0.00 O ATOM 211 CB LYS A 15 13.965 -4.355 -7.679 1.00 0.00 C ATOM 212 CG LYS A 15 14.058 -2.829 -7.737 1.00 0.00 C ATOM 213 CD LYS A 15 15.528 -2.407 -7.749 1.00 0.00 C ATOM 214 CE LYS A 15 15.912 -1.935 -9.153 1.00 0.00 C ATOM 215 NZ LYS A 15 15.328 -0.570 -9.265 1.00 0.00 N ATOM 0 H LYS A 15 12.872 -4.228 -5.531 1.00 0.00 H new ATOM 0 HA LYS A 15 11.882 -4.277 -8.312 1.00 0.00 H new ATOM 0 HB2 LYS A 15 14.532 -4.733 -6.828 1.00 0.00 H new ATOM 0 HB3 LYS A 15 14.407 -4.791 -8.575 1.00 0.00 H new ATOM 0 HG2 LYS A 15 13.555 -2.457 -8.629 1.00 0.00 H new ATOM 0 HG3 LYS A 15 13.550 -2.390 -6.878 1.00 0.00 H new ATOM 0 HD2 LYS A 15 15.694 -1.607 -7.027 1.00 0.00 H new ATOM 0 HD3 LYS A 15 16.160 -3.243 -7.449 1.00 0.00 H new ATOM 0 HE2 LYS A 15 16.994 -1.915 -9.282 1.00 0.00 H new ATOM 0 HE3 LYS A 15 15.512 -2.601 -9.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 14.703 -0.527 -10.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 14.780 -0.355 -8.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 16.093 0.127 -9.371 1.00 0.00 H new ATOM 229 N ASP A 16 11.977 -7.006 -6.740 1.00 0.00 N ATOM 230 CA ASP A 16 11.808 -8.479 -6.886 1.00 0.00 C ATOM 231 C ASP A 16 10.320 -8.834 -6.805 1.00 0.00 C ATOM 232 O ASP A 16 9.771 -9.450 -7.696 1.00 0.00 O ATOM 233 CB ASP A 16 12.577 -9.090 -5.714 1.00 0.00 C ATOM 234 CG ASP A 16 13.169 -10.441 -6.122 1.00 0.00 C ATOM 235 OD1 ASP A 16 12.406 -11.383 -6.255 1.00 0.00 O ATOM 236 OD2 ASP A 16 14.375 -10.509 -6.295 1.00 0.00 O ATOM 0 H ASP A 16 11.790 -6.638 -5.807 1.00 0.00 H new ATOM 0 HA ASP A 16 12.178 -8.851 -7.841 1.00 0.00 H new ATOM 0 HB2 ASP A 16 13.373 -8.415 -5.400 1.00 0.00 H new ATOM 0 HB3 ASP A 16 11.912 -9.218 -4.860 1.00 0.00 H new ATOM 241 N ILE A 17 9.664 -8.447 -5.744 1.00 0.00 N ATOM 242 CA ILE A 17 8.212 -8.763 -5.611 1.00 0.00 C ATOM 243 C ILE A 17 7.439 -8.120 -6.765 1.00 0.00 C ATOM 244 O ILE A 17 6.534 -8.709 -7.322 1.00 0.00 O ATOM 245 CB ILE A 17 7.785 -8.159 -4.272 1.00 0.00 C ATOM 246 CG1 ILE A 17 8.583 -8.817 -3.140 1.00 0.00 C ATOM 247 CG2 ILE A 17 6.289 -8.407 -4.059 1.00 0.00 C ATOM 248 CD1 ILE A 17 8.033 -8.363 -1.785 1.00 0.00 C ATOM 0 H ILE A 17 10.069 -7.927 -4.966 1.00 0.00 H new ATOM 0 HA ILE A 17 8.015 -9.834 -5.645 1.00 0.00 H new ATOM 0 HB ILE A 17 7.978 -7.086 -4.274 1.00 0.00 H new ATOM 0 HG12 ILE A 17 8.521 -9.902 -3.223 1.00 0.00 H new ATOM 0 HG13 ILE A 17 9.637 -8.550 -3.223 1.00 0.00 H new ATOM 0 HG21 ILE A 17 5.981 -7.978 -3.106 1.00 0.00 H new ATOM 0 HG22 ILE A 17 5.724 -7.940 -4.866 1.00 0.00 H new ATOM 0 HG23 ILE A 17 6.095 -9.480 -4.054 1.00 0.00 H new ATOM 0 HD11 ILE A 17 8.604 -8.834 -0.984 1.00 0.00 H new ATOM 0 HD12 ILE A 17 8.118 -7.279 -1.702 1.00 0.00 H new ATOM 0 HD13 ILE A 17 6.985 -8.652 -1.702 1.00 0.00 H new ATOM 260 N ALA A 18 7.788 -6.916 -7.127 1.00 0.00 N ATOM 261 CA ALA A 18 7.073 -6.236 -8.244 1.00 0.00 C ATOM 262 C ALA A 18 7.866 -6.404 -9.542 1.00 0.00 C ATOM 263 O ALA A 18 7.872 -5.537 -10.393 1.00 0.00 O ATOM 264 CB ALA A 18 7.002 -4.764 -7.837 1.00 0.00 C ATOM 0 H ALA A 18 8.537 -6.374 -6.698 1.00 0.00 H new ATOM 0 HA ALA A 18 6.080 -6.650 -8.419 1.00 0.00 H new ATOM 0 HB1 ALA A 18 6.487 -4.197 -8.612 1.00 0.00 H new ATOM 0 HB2 ALA A 18 6.457 -4.672 -6.898 1.00 0.00 H new ATOM 0 HB3 ALA A 18 8.011 -4.372 -7.710 1.00 0.00 H new ATOM 270 N GLY A 19 8.534 -7.514 -9.702 1.00 0.00 N ATOM 271 CA GLY A 19 9.323 -7.735 -10.947 1.00 0.00 C ATOM 272 C GLY A 19 8.422 -7.493 -12.159 1.00 0.00 C ATOM 273 O GLY A 19 8.456 -6.444 -12.771 1.00 0.00 O ATOM 0 H GLY A 19 8.567 -8.276 -9.025 1.00 0.00 H new ATOM 0 HA2 GLY A 19 10.179 -7.061 -10.974 1.00 0.00 H new ATOM 0 HA3 GLY A 19 9.716 -8.751 -10.968 1.00 0.00 H new ATOM 277 N SER A 20 7.613 -8.455 -12.510 1.00 0.00 N ATOM 278 CA SER A 20 6.708 -8.278 -13.681 1.00 0.00 C ATOM 279 C SER A 20 5.253 -8.214 -13.208 1.00 0.00 C ATOM 280 O SER A 20 4.331 -8.307 -13.994 1.00 0.00 O ATOM 281 CB SER A 20 6.939 -9.509 -14.557 1.00 0.00 C ATOM 282 OG SER A 20 6.726 -10.682 -13.783 1.00 0.00 O ATOM 0 H SER A 20 7.540 -9.356 -12.037 1.00 0.00 H new ATOM 0 HA SER A 20 6.909 -7.356 -14.226 1.00 0.00 H new ATOM 0 HB2 SER A 20 6.261 -9.495 -15.411 1.00 0.00 H new ATOM 0 HB3 SER A 20 7.954 -9.501 -14.955 1.00 0.00 H new ATOM 0 HG SER A 20 6.872 -11.474 -14.342 1.00 0.00 H new ATOM 288 N ASP A 21 5.036 -8.056 -11.929 1.00 0.00 N ATOM 289 CA ASP A 21 3.639 -7.989 -11.413 1.00 0.00 C ATOM 290 C ASP A 21 3.401 -6.636 -10.734 1.00 0.00 C ATOM 291 O ASP A 21 2.276 -6.234 -10.512 1.00 0.00 O ATOM 292 CB ASP A 21 3.530 -9.130 -10.401 1.00 0.00 C ATOM 293 CG ASP A 21 4.636 -9.007 -9.352 1.00 0.00 C ATOM 294 OD1 ASP A 21 5.794 -9.005 -9.737 1.00 0.00 O ATOM 295 OD2 ASP A 21 4.307 -8.916 -8.180 1.00 0.00 O ATOM 0 H ASP A 21 5.765 -7.971 -11.221 1.00 0.00 H new ATOM 0 HA ASP A 21 2.897 -8.085 -12.206 1.00 0.00 H new ATOM 0 HB2 ASP A 21 2.554 -9.105 -9.917 1.00 0.00 H new ATOM 0 HB3 ASP A 21 3.608 -10.089 -10.913 1.00 0.00 H new ATOM 300 N ASN A 22 4.449 -5.933 -10.400 1.00 0.00 N ATOM 301 CA ASN A 22 4.278 -4.610 -9.735 1.00 0.00 C ATOM 302 C ASN A 22 3.434 -4.775 -8.469 1.00 0.00 C ATOM 303 O ASN A 22 2.732 -3.873 -8.057 1.00 0.00 O ATOM 304 CB ASN A 22 3.556 -3.732 -10.759 1.00 0.00 C ATOM 305 CG ASN A 22 3.420 -2.307 -10.223 1.00 0.00 C ATOM 306 OD1 ASN A 22 2.476 -1.995 -9.525 1.00 0.00 O ATOM 307 ND2 ASN A 22 4.329 -1.422 -10.524 1.00 0.00 N ATOM 0 H ASN A 22 5.416 -6.217 -10.559 1.00 0.00 H new ATOM 0 HA ASN A 22 5.228 -4.169 -9.434 1.00 0.00 H new ATOM 0 HB2 ASN A 22 4.109 -3.725 -11.698 1.00 0.00 H new ATOM 0 HB3 ASN A 22 2.570 -4.144 -10.973 1.00 0.00 H new ATOM 0 HD21 ASN A 22 4.247 -0.468 -10.173 1.00 0.00 H new ATOM 0 HD22 ASN A 22 5.122 -1.684 -11.110 1.00 0.00 H new ATOM 314 N GLY A 23 3.496 -5.922 -7.849 1.00 0.00 N ATOM 315 CA GLY A 23 2.697 -6.143 -6.611 1.00 0.00 C ATOM 316 C GLY A 23 1.335 -6.729 -6.990 1.00 0.00 C ATOM 317 O GLY A 23 0.374 -6.614 -6.256 1.00 0.00 O ATOM 0 H GLY A 23 4.065 -6.715 -8.146 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.224 -6.821 -5.940 1.00 0.00 H new ATOM 0 HA3 GLY A 23 2.566 -5.203 -6.076 1.00 0.00 H new ATOM 321 N ALA A 24 1.245 -7.357 -8.131 1.00 0.00 N ATOM 322 CA ALA A 24 -0.055 -7.949 -8.555 1.00 0.00 C ATOM 323 C ALA A 24 -0.488 -9.015 -7.545 1.00 0.00 C ATOM 324 O ALA A 24 -1.613 -9.028 -7.088 1.00 0.00 O ATOM 325 CB ALA A 24 0.214 -8.574 -9.924 1.00 0.00 C ATOM 0 H ALA A 24 2.015 -7.485 -8.787 1.00 0.00 H new ATOM 0 HA ALA A 24 -0.854 -7.210 -8.606 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -0.701 -9.031 -10.301 1.00 0.00 H new ATOM 0 HB2 ALA A 24 0.547 -7.802 -10.618 1.00 0.00 H new ATOM 0 HB3 ALA A 24 0.988 -9.335 -9.831 1.00 0.00 H new ATOM 331 N GLY A 25 0.398 -9.906 -7.191 1.00 0.00 N ATOM 332 CA GLY A 25 0.037 -10.969 -6.208 1.00 0.00 C ATOM 333 C GLY A 25 0.360 -10.484 -4.793 1.00 0.00 C ATOM 334 O GLY A 25 0.493 -11.267 -3.874 1.00 0.00 O ATOM 0 H GLY A 25 1.356 -9.944 -7.539 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -1.023 -11.209 -6.289 1.00 0.00 H new ATOM 0 HA3 GLY A 25 0.589 -11.883 -6.426 1.00 0.00 H new ATOM 338 N VAL A 26 0.480 -9.197 -4.610 1.00 0.00 N ATOM 339 CA VAL A 26 0.784 -8.659 -3.255 1.00 0.00 C ATOM 340 C VAL A 26 -0.414 -7.844 -2.760 1.00 0.00 C ATOM 341 O VAL A 26 -0.550 -7.572 -1.584 1.00 0.00 O ATOM 342 CB VAL A 26 2.022 -7.772 -3.444 1.00 0.00 C ATOM 343 CG1 VAL A 26 2.192 -6.841 -2.238 1.00 0.00 C ATOM 344 CG2 VAL A 26 3.263 -8.657 -3.577 1.00 0.00 C ATOM 0 H VAL A 26 0.380 -8.494 -5.343 1.00 0.00 H new ATOM 0 HA VAL A 26 0.971 -9.438 -2.516 1.00 0.00 H new ATOM 0 HB VAL A 26 1.896 -7.171 -4.345 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.073 -6.216 -2.382 1.00 0.00 H new ATOM 0 HG12 VAL A 26 1.310 -6.208 -2.140 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.314 -7.436 -1.333 1.00 0.00 H new ATOM 0 HG21 VAL A 26 4.144 -8.030 -3.711 1.00 0.00 H new ATOM 0 HG22 VAL A 26 3.379 -9.258 -2.675 1.00 0.00 H new ATOM 0 HG23 VAL A 26 3.150 -9.314 -4.439 1.00 0.00 H new ATOM 354 N GLY A 27 -1.284 -7.453 -3.649 1.00 0.00 N ATOM 355 CA GLY A 27 -2.469 -6.660 -3.231 1.00 0.00 C ATOM 356 C GLY A 27 -3.706 -7.556 -3.281 1.00 0.00 C ATOM 357 O GLY A 27 -4.676 -7.331 -2.586 1.00 0.00 O ATOM 0 H GLY A 27 -1.224 -7.650 -4.648 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -2.326 -6.271 -2.223 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -2.599 -5.801 -3.889 1.00 0.00 H new ATOM 361 N LYS A 28 -3.679 -8.574 -4.099 1.00 0.00 N ATOM 362 CA LYS A 28 -4.852 -9.483 -4.191 1.00 0.00 C ATOM 363 C LYS A 28 -4.884 -10.404 -2.968 1.00 0.00 C ATOM 364 O LYS A 28 -5.937 -10.775 -2.490 1.00 0.00 O ATOM 365 CB LYS A 28 -4.649 -10.282 -5.482 1.00 0.00 C ATOM 366 CG LYS A 28 -3.473 -11.249 -5.323 1.00 0.00 C ATOM 367 CD LYS A 28 -3.418 -12.195 -6.526 1.00 0.00 C ATOM 368 CE LYS A 28 -3.392 -11.383 -7.824 1.00 0.00 C ATOM 369 NZ LYS A 28 -3.471 -12.402 -8.907 1.00 0.00 N ATOM 0 H LYS A 28 -2.895 -8.813 -4.706 1.00 0.00 H new ATOM 0 HA LYS A 28 -5.800 -8.945 -4.210 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -5.556 -10.837 -5.722 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -4.461 -9.603 -6.314 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -2.540 -10.692 -5.243 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -3.582 -11.822 -4.402 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -2.532 -12.826 -6.463 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -4.283 -12.858 -6.518 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -4.229 -10.687 -7.873 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -2.480 -10.791 -7.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -3.459 -11.927 -9.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -2.657 -13.046 -8.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -4.352 -12.945 -8.809 1.00 0.00 H new ATOM 383 N GLU A 29 -3.740 -10.777 -2.457 1.00 0.00 N ATOM 384 CA GLU A 29 -3.723 -11.673 -1.266 1.00 0.00 C ATOM 385 C GLU A 29 -3.608 -10.831 0.015 1.00 0.00 C ATOM 386 O GLU A 29 -3.827 -11.314 1.108 1.00 0.00 O ATOM 387 CB GLU A 29 -2.509 -12.604 -1.471 1.00 0.00 C ATOM 388 CG GLU A 29 -1.235 -12.007 -0.855 1.00 0.00 C ATOM 389 CD GLU A 29 -0.998 -10.595 -1.392 1.00 0.00 C ATOM 390 OE1 GLU A 29 -1.285 -10.368 -2.556 1.00 0.00 O ATOM 391 OE2 GLU A 29 -0.532 -9.765 -0.631 1.00 0.00 O ATOM 0 H GLU A 29 -2.824 -10.502 -2.810 1.00 0.00 H new ATOM 0 HA GLU A 29 -4.636 -12.259 -1.160 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -2.713 -13.575 -1.020 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.355 -12.774 -2.537 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -1.326 -11.980 0.231 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -0.379 -12.640 -1.088 1.00 0.00 H new ATOM 398 N CYS A 30 -3.269 -9.575 -0.114 1.00 0.00 N ATOM 399 CA CYS A 30 -3.144 -8.708 1.091 1.00 0.00 C ATOM 400 C CYS A 30 -4.502 -8.079 1.413 1.00 0.00 C ATOM 401 O CYS A 30 -5.049 -8.274 2.481 1.00 0.00 O ATOM 402 CB CYS A 30 -2.122 -7.635 0.710 1.00 0.00 C ATOM 403 SG CYS A 30 -2.028 -6.391 2.023 1.00 0.00 S ATOM 0 H CYS A 30 -3.074 -9.114 -1.002 1.00 0.00 H new ATOM 0 HA CYS A 30 -2.828 -9.261 1.975 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -1.143 -8.089 0.555 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -2.407 -7.164 -0.231 1.00 0.00 H new ATOM 0 HG CYS A 30 -1.923 -5.208 1.494 1.00 0.00 H new ATOM 409 N PHE A 31 -5.052 -7.324 0.500 1.00 0.00 N ATOM 410 CA PHE A 31 -6.374 -6.686 0.761 1.00 0.00 C ATOM 411 C PHE A 31 -7.402 -7.764 1.112 1.00 0.00 C ATOM 412 O PHE A 31 -8.340 -7.525 1.846 1.00 0.00 O ATOM 413 CB PHE A 31 -6.748 -5.975 -0.542 1.00 0.00 C ATOM 414 CG PHE A 31 -6.218 -4.561 -0.511 1.00 0.00 C ATOM 415 CD1 PHE A 31 -6.974 -3.542 0.082 1.00 0.00 C ATOM 416 CD2 PHE A 31 -4.969 -4.270 -1.072 1.00 0.00 C ATOM 417 CE1 PHE A 31 -6.481 -2.232 0.112 1.00 0.00 C ATOM 418 CE2 PHE A 31 -4.477 -2.959 -1.042 1.00 0.00 C ATOM 419 CZ PHE A 31 -5.232 -1.941 -0.450 1.00 0.00 C ATOM 0 H PHE A 31 -4.644 -7.122 -0.413 1.00 0.00 H new ATOM 0 HA PHE A 31 -6.343 -5.986 1.596 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -6.333 -6.512 -1.395 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -7.831 -5.967 -0.667 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -7.937 -3.767 0.516 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -4.385 -5.056 -1.528 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -7.064 -1.446 0.569 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -3.514 -2.734 -1.476 1.00 0.00 H new ATOM 0 HZ PHE A 31 -4.851 -0.931 -0.426 1.00 0.00 H new ATOM 429 N THR A 32 -7.230 -8.952 0.599 1.00 0.00 N ATOM 430 CA THR A 32 -8.196 -10.045 0.912 1.00 0.00 C ATOM 431 C THR A 32 -8.312 -10.200 2.429 1.00 0.00 C ATOM 432 O THR A 32 -9.373 -10.041 3.000 1.00 0.00 O ATOM 433 CB THR A 32 -7.613 -11.319 0.283 1.00 0.00 C ATOM 434 OG1 THR A 32 -6.275 -11.085 -0.140 1.00 0.00 O ATOM 435 CG2 THR A 32 -8.468 -11.732 -0.917 1.00 0.00 C ATOM 0 H THR A 32 -6.464 -9.213 -0.022 1.00 0.00 H new ATOM 0 HA THR A 32 -9.192 -9.837 0.522 1.00 0.00 H new ATOM 0 HB THR A 32 -7.615 -12.118 1.024 1.00 0.00 H new ATOM 0 HG1 THR A 32 -6.281 -10.652 -1.019 1.00 0.00 H new ATOM 0 HG21 THR A 32 -8.055 -12.636 -1.364 1.00 0.00 H new ATOM 0 HG22 THR A 32 -9.489 -11.924 -0.587 1.00 0.00 H new ATOM 0 HG23 THR A 32 -8.470 -10.930 -1.656 1.00 0.00 H new ATOM 443 N LYS A 33 -7.228 -10.506 3.088 1.00 0.00 N ATOM 444 CA LYS A 33 -7.278 -10.667 4.569 1.00 0.00 C ATOM 445 C LYS A 33 -7.918 -9.427 5.194 1.00 0.00 C ATOM 446 O LYS A 33 -8.834 -9.522 5.986 1.00 0.00 O ATOM 447 CB LYS A 33 -5.820 -10.809 5.010 1.00 0.00 C ATOM 448 CG LYS A 33 -5.425 -12.287 5.000 1.00 0.00 C ATOM 449 CD LYS A 33 -4.675 -12.607 3.705 1.00 0.00 C ATOM 450 CE LYS A 33 -3.208 -12.905 4.025 1.00 0.00 C ATOM 451 NZ LYS A 33 -2.505 -11.610 3.806 1.00 0.00 N ATOM 0 H LYS A 33 -6.311 -10.651 2.666 1.00 0.00 H new ATOM 0 HA LYS A 33 -7.870 -11.528 4.878 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -5.170 -10.244 4.342 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -5.689 -10.393 6.009 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.797 -12.512 5.862 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -6.314 -12.912 5.082 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -5.132 -13.464 3.210 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -4.744 -11.766 3.015 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -3.089 -13.252 5.051 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -2.811 -13.686 3.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -1.481 -11.747 3.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -2.702 -11.266 2.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -2.841 -10.911 4.499 1.00 0.00 H new ATOM 465 N PHE A 34 -7.446 -8.261 4.841 1.00 0.00 N ATOM 466 CA PHE A 34 -8.034 -7.017 5.413 1.00 0.00 C ATOM 467 C PHE A 34 -9.555 -7.056 5.252 1.00 0.00 C ATOM 468 O PHE A 34 -10.294 -6.805 6.182 1.00 0.00 O ATOM 469 CB PHE A 34 -7.429 -5.871 4.597 1.00 0.00 C ATOM 470 CG PHE A 34 -7.327 -4.633 5.458 1.00 0.00 C ATOM 471 CD1 PHE A 34 -6.731 -4.705 6.723 1.00 0.00 C ATOM 472 CD2 PHE A 34 -7.829 -3.411 4.990 1.00 0.00 C ATOM 473 CE1 PHE A 34 -6.636 -3.557 7.519 1.00 0.00 C ATOM 474 CE2 PHE A 34 -7.734 -2.264 5.787 1.00 0.00 C ATOM 475 CZ PHE A 34 -7.138 -2.337 7.051 1.00 0.00 C ATOM 0 H PHE A 34 -6.680 -8.117 4.183 1.00 0.00 H new ATOM 0 HA PHE A 34 -7.821 -6.901 6.476 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -6.442 -6.154 4.231 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -8.047 -5.668 3.723 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -6.344 -5.646 7.085 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -8.289 -3.354 4.015 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -6.175 -3.613 8.494 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -8.121 -1.322 5.426 1.00 0.00 H new ATOM 0 HZ PHE A 34 -7.065 -1.452 7.666 1.00 0.00 H new ATOM 485 N LEU A 35 -10.028 -7.374 4.078 1.00 0.00 N ATOM 486 CA LEU A 35 -11.502 -7.433 3.858 1.00 0.00 C ATOM 487 C LEU A 35 -12.129 -8.440 4.825 1.00 0.00 C ATOM 488 O LEU A 35 -13.161 -8.190 5.415 1.00 0.00 O ATOM 489 CB LEU A 35 -11.672 -7.895 2.411 1.00 0.00 C ATOM 490 CG LEU A 35 -11.096 -6.837 1.470 1.00 0.00 C ATOM 491 CD1 LEU A 35 -10.737 -7.484 0.131 1.00 0.00 C ATOM 492 CD2 LEU A 35 -12.138 -5.741 1.243 1.00 0.00 C ATOM 0 H LEU A 35 -9.458 -7.596 3.262 1.00 0.00 H new ATOM 0 HA LEU A 35 -11.989 -6.474 4.032 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -11.164 -8.848 2.260 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -12.727 -8.058 2.191 1.00 0.00 H new ATOM 0 HG LEU A 35 -10.200 -6.404 1.914 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -10.326 -6.729 -0.539 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -9.996 -8.267 0.292 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -11.632 -7.917 -0.315 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -11.730 -4.985 0.572 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -13.033 -6.176 0.798 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.395 -5.280 2.197 1.00 0.00 H new ATOM 504 N SER A 36 -11.517 -9.579 4.988 1.00 0.00 N ATOM 505 CA SER A 36 -12.080 -10.604 5.913 1.00 0.00 C ATOM 506 C SER A 36 -12.006 -10.099 7.357 1.00 0.00 C ATOM 507 O SER A 36 -13.011 -9.811 7.976 1.00 0.00 O ATOM 508 CB SER A 36 -11.200 -11.840 5.726 1.00 0.00 C ATOM 509 OG SER A 36 -11.275 -12.268 4.372 1.00 0.00 O ATOM 0 H SER A 36 -10.650 -9.846 4.521 1.00 0.00 H new ATOM 0 HA SER A 36 -13.127 -10.822 5.704 1.00 0.00 H new ATOM 0 HB2 SER A 36 -10.168 -11.609 5.990 1.00 0.00 H new ATOM 0 HB3 SER A 36 -11.528 -12.639 6.391 1.00 0.00 H new ATOM 0 HG SER A 36 -10.685 -11.713 3.820 1.00 0.00 H new ATOM 515 N ALA A 37 -10.823 -9.993 7.899 1.00 0.00 N ATOM 516 CA ALA A 37 -10.685 -9.512 9.305 1.00 0.00 C ATOM 517 C ALA A 37 -11.465 -8.208 9.489 1.00 0.00 C ATOM 518 O ALA A 37 -11.861 -7.860 10.584 1.00 0.00 O ATOM 519 CB ALA A 37 -9.186 -9.280 9.504 1.00 0.00 C ATOM 0 H ALA A 37 -9.946 -10.218 7.430 1.00 0.00 H new ATOM 0 HA ALA A 37 -11.080 -10.225 10.029 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -9.004 -8.924 10.518 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -8.649 -10.215 9.346 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.835 -8.535 8.790 1.00 0.00 H new ATOM 525 N HIS A 38 -11.687 -7.481 8.429 1.00 0.00 N ATOM 526 CA HIS A 38 -12.438 -6.200 8.546 1.00 0.00 C ATOM 527 C HIS A 38 -13.589 -6.174 7.534 1.00 0.00 C ATOM 528 O HIS A 38 -13.388 -6.004 6.348 1.00 0.00 O ATOM 529 CB HIS A 38 -11.422 -5.096 8.239 1.00 0.00 C ATOM 530 CG HIS A 38 -10.180 -5.304 9.064 1.00 0.00 C ATOM 531 ND1 HIS A 38 -9.799 -4.423 10.064 1.00 0.00 N ATOM 532 CD2 HIS A 38 -9.223 -6.289 9.048 1.00 0.00 C ATOM 533 CE1 HIS A 38 -8.658 -4.890 10.603 1.00 0.00 C ATOM 534 NE2 HIS A 38 -8.264 -6.026 10.021 1.00 0.00 N ATOM 0 H HIS A 38 -11.380 -7.719 7.486 1.00 0.00 H new ATOM 0 HA HIS A 38 -12.877 -6.071 9.535 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -11.171 -5.104 7.178 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -11.855 -4.120 8.456 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -9.216 -7.139 8.381 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -8.126 -4.405 11.408 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -7.438 -6.581 10.242 1.00 0.00 H new ATOM 543 N HIS A 39 -14.797 -6.325 8.008 1.00 0.00 N ATOM 544 CA HIS A 39 -15.971 -6.296 7.093 1.00 0.00 C ATOM 545 C HIS A 39 -16.409 -4.846 6.879 1.00 0.00 C ATOM 546 O HIS A 39 -17.082 -4.527 5.919 1.00 0.00 O ATOM 547 CB HIS A 39 -17.063 -7.091 7.811 1.00 0.00 C ATOM 548 CG HIS A 39 -16.913 -8.553 7.492 1.00 0.00 C ATOM 549 ND1 HIS A 39 -17.792 -9.509 7.977 1.00 0.00 N ATOM 550 CD2 HIS A 39 -15.992 -9.239 6.740 1.00 0.00 C ATOM 551 CE1 HIS A 39 -17.385 -10.705 7.516 1.00 0.00 C ATOM 552 NE2 HIS A 39 -16.292 -10.597 6.756 1.00 0.00 N ATOM 0 H HIS A 39 -15.020 -6.468 8.993 1.00 0.00 H new ATOM 0 HA HIS A 39 -15.751 -6.720 6.113 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -16.993 -6.934 8.887 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -18.047 -6.739 7.501 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -15.160 -8.792 6.215 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -17.881 -11.639 7.734 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -15.786 -11.349 6.288 1.00 0.00 H new ATOM 561 N ASP A 40 -16.022 -3.962 7.757 1.00 0.00 N ATOM 562 CA ASP A 40 -16.407 -2.534 7.589 1.00 0.00 C ATOM 563 C ASP A 40 -15.639 -1.938 6.404 1.00 0.00 C ATOM 564 O ASP A 40 -15.987 -0.894 5.888 1.00 0.00 O ATOM 565 CB ASP A 40 -16.004 -1.850 8.897 1.00 0.00 C ATOM 566 CG ASP A 40 -14.483 -1.877 9.055 1.00 0.00 C ATOM 567 OD1 ASP A 40 -13.895 -2.903 8.758 1.00 0.00 O ATOM 568 OD2 ASP A 40 -13.933 -0.871 9.471 1.00 0.00 O ATOM 0 H ASP A 40 -15.457 -4.167 8.581 1.00 0.00 H new ATOM 0 HA ASP A 40 -17.470 -2.406 7.387 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -16.360 -0.820 8.903 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -16.474 -2.355 9.741 1.00 0.00 H new ATOM 573 N MET A 41 -14.596 -2.595 5.968 1.00 0.00 N ATOM 574 CA MET A 41 -13.806 -2.070 4.819 1.00 0.00 C ATOM 575 C MET A 41 -14.178 -2.832 3.542 1.00 0.00 C ATOM 576 O MET A 41 -13.878 -2.405 2.445 1.00 0.00 O ATOM 577 CB MET A 41 -12.344 -2.318 5.190 1.00 0.00 C ATOM 578 CG MET A 41 -11.864 -1.220 6.140 1.00 0.00 C ATOM 579 SD MET A 41 -10.512 -0.300 5.364 1.00 0.00 S ATOM 580 CE MET A 41 -11.175 1.359 5.651 1.00 0.00 C ATOM 0 H MET A 41 -14.258 -3.474 6.360 1.00 0.00 H new ATOM 0 HA MET A 41 -13.998 -1.014 4.630 1.00 0.00 H new ATOM 0 HB2 MET A 41 -12.239 -3.294 5.663 1.00 0.00 H new ATOM 0 HB3 MET A 41 -11.727 -2.331 4.291 1.00 0.00 H new ATOM 0 HG2 MET A 41 -12.687 -0.546 6.379 1.00 0.00 H new ATOM 0 HG3 MET A 41 -11.528 -1.658 7.080 1.00 0.00 H new ATOM 0 HE1 MET A 41 -10.366 2.088 5.598 1.00 0.00 H new ATOM 0 HE2 MET A 41 -11.921 1.589 4.891 1.00 0.00 H new ATOM 0 HE3 MET A 41 -11.637 1.400 6.637 1.00 0.00 H new ATOM 590 N ALA A 42 -14.829 -3.956 3.673 1.00 0.00 N ATOM 591 CA ALA A 42 -15.215 -4.732 2.461 1.00 0.00 C ATOM 592 C ALA A 42 -16.139 -3.879 1.589 1.00 0.00 C ATOM 593 O ALA A 42 -15.787 -3.486 0.495 1.00 0.00 O ATOM 594 CB ALA A 42 -15.947 -5.966 2.986 1.00 0.00 C ATOM 0 H ALA A 42 -15.109 -4.369 4.563 1.00 0.00 H new ATOM 0 HA ALA A 42 -14.358 -5.014 1.850 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -16.262 -6.587 2.147 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -15.280 -6.538 3.630 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -16.823 -5.655 3.556 1.00 0.00 H new ATOM 600 N ALA A 43 -17.317 -3.581 2.069 1.00 0.00 N ATOM 601 CA ALA A 43 -18.254 -2.745 1.268 1.00 0.00 C ATOM 602 C ALA A 43 -17.543 -1.458 0.848 1.00 0.00 C ATOM 603 O ALA A 43 -17.886 -0.837 -0.139 1.00 0.00 O ATOM 604 CB ALA A 43 -19.425 -2.441 2.203 1.00 0.00 C ATOM 0 H ALA A 43 -17.669 -3.880 2.978 1.00 0.00 H new ATOM 0 HA ALA A 43 -18.595 -3.242 0.360 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -20.158 -1.827 1.680 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -19.892 -3.375 2.517 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -19.061 -1.905 3.079 1.00 0.00 H new ATOM 610 N VAL A 44 -16.546 -1.060 1.590 1.00 0.00 N ATOM 611 CA VAL A 44 -15.798 0.180 1.240 1.00 0.00 C ATOM 612 C VAL A 44 -14.956 -0.087 -0.014 1.00 0.00 C ATOM 613 O VAL A 44 -15.072 0.600 -1.009 1.00 0.00 O ATOM 614 CB VAL A 44 -14.924 0.467 2.476 1.00 0.00 C ATOM 615 CG1 VAL A 44 -13.658 1.242 2.086 1.00 0.00 C ATOM 616 CG2 VAL A 44 -15.730 1.297 3.478 1.00 0.00 C ATOM 0 H VAL A 44 -16.216 -1.542 2.426 1.00 0.00 H new ATOM 0 HA VAL A 44 -16.437 1.033 1.012 1.00 0.00 H new ATOM 0 HB VAL A 44 -14.627 -0.483 2.919 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -13.059 1.432 2.976 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -13.076 0.655 1.375 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -13.939 2.191 1.629 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -15.117 1.504 4.355 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -16.029 2.237 3.014 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -16.619 0.742 3.779 1.00 0.00 H new ATOM 626 N PHE A 45 -14.114 -1.081 0.029 1.00 0.00 N ATOM 627 CA PHE A 45 -13.270 -1.393 -1.157 1.00 0.00 C ATOM 628 C PHE A 45 -14.168 -1.736 -2.348 1.00 0.00 C ATOM 629 O PHE A 45 -13.783 -1.589 -3.491 1.00 0.00 O ATOM 630 CB PHE A 45 -12.429 -2.600 -0.744 1.00 0.00 C ATOM 631 CG PHE A 45 -11.326 -2.150 0.183 1.00 0.00 C ATOM 632 CD1 PHE A 45 -10.397 -1.197 -0.247 1.00 0.00 C ATOM 633 CD2 PHE A 45 -11.232 -2.687 1.473 1.00 0.00 C ATOM 634 CE1 PHE A 45 -9.373 -0.780 0.611 1.00 0.00 C ATOM 635 CE2 PHE A 45 -10.208 -2.270 2.331 1.00 0.00 C ATOM 636 CZ PHE A 45 -9.278 -1.317 1.900 1.00 0.00 C ATOM 0 H PHE A 45 -13.974 -1.691 0.834 1.00 0.00 H new ATOM 0 HA PHE A 45 -12.641 -0.555 -1.458 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -13.056 -3.341 -0.248 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -12.005 -3.080 -1.626 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -10.470 -0.783 -1.242 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -11.949 -3.423 1.806 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -8.656 -0.044 0.278 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -10.135 -2.684 3.326 1.00 0.00 H new ATOM 0 HZ PHE A 45 -8.487 -0.996 2.562 1.00 0.00 H new ATOM 646 N GLY A 46 -15.363 -2.192 -2.088 1.00 0.00 N ATOM 647 CA GLY A 46 -16.285 -2.542 -3.204 1.00 0.00 C ATOM 648 C GLY A 46 -16.392 -4.064 -3.312 1.00 0.00 C ATOM 649 O GLY A 46 -16.658 -4.603 -4.367 1.00 0.00 O ATOM 0 H GLY A 46 -15.740 -2.337 -1.151 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -17.269 -2.108 -3.028 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -15.916 -2.124 -4.141 1.00 0.00 H new ATOM 653 N PHE A 47 -16.185 -4.762 -2.228 1.00 0.00 N ATOM 654 CA PHE A 47 -16.275 -6.250 -2.275 1.00 0.00 C ATOM 655 C PHE A 47 -17.300 -6.740 -1.251 1.00 0.00 C ATOM 656 O PHE A 47 -17.744 -6.000 -0.396 1.00 0.00 O ATOM 657 CB PHE A 47 -14.877 -6.757 -1.909 1.00 0.00 C ATOM 658 CG PHE A 47 -13.834 -6.046 -2.739 1.00 0.00 C ATOM 659 CD1 PHE A 47 -14.090 -5.742 -4.080 1.00 0.00 C ATOM 660 CD2 PHE A 47 -12.609 -5.693 -2.162 1.00 0.00 C ATOM 661 CE1 PHE A 47 -13.119 -5.084 -4.846 1.00 0.00 C ATOM 662 CE2 PHE A 47 -11.638 -5.036 -2.927 1.00 0.00 C ATOM 663 CZ PHE A 47 -11.893 -4.732 -4.268 1.00 0.00 C ATOM 0 H PHE A 47 -15.958 -4.368 -1.315 1.00 0.00 H new ATOM 0 HA PHE A 47 -16.591 -6.611 -3.254 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -14.686 -6.589 -0.849 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -14.816 -7.832 -2.077 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -15.036 -6.014 -4.525 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -12.413 -5.927 -1.126 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -13.316 -4.848 -5.881 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -10.692 -4.764 -2.482 1.00 0.00 H new ATOM 0 HZ PHE A 47 -11.144 -4.225 -4.858 1.00 0.00 H new ATOM 673 N SER A 48 -17.669 -7.989 -1.327 1.00 0.00 N ATOM 674 CA SER A 48 -18.655 -8.538 -0.354 1.00 0.00 C ATOM 675 C SER A 48 -17.931 -9.454 0.637 1.00 0.00 C ATOM 676 O SER A 48 -18.435 -9.757 1.700 1.00 0.00 O ATOM 677 CB SER A 48 -19.655 -9.330 -1.196 1.00 0.00 C ATOM 678 OG SER A 48 -20.413 -10.181 -0.347 1.00 0.00 O ATOM 0 H SER A 48 -17.330 -8.654 -2.022 1.00 0.00 H new ATOM 0 HA SER A 48 -19.154 -7.761 0.225 1.00 0.00 H new ATOM 0 HB2 SER A 48 -20.316 -8.649 -1.732 1.00 0.00 H new ATOM 0 HB3 SER A 48 -19.129 -9.920 -1.946 1.00 0.00 H new ATOM 0 HG SER A 48 -21.056 -10.689 -0.884 1.00 0.00 H new ATOM 684 N GLY A 49 -16.750 -9.896 0.294 1.00 0.00 N ATOM 685 CA GLY A 49 -15.989 -10.790 1.211 1.00 0.00 C ATOM 686 C GLY A 49 -14.672 -11.185 0.542 1.00 0.00 C ATOM 687 O GLY A 49 -14.347 -10.721 -0.533 1.00 0.00 O ATOM 0 H GLY A 49 -16.280 -9.675 -0.584 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -15.794 -10.282 2.156 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -16.575 -11.679 1.442 1.00 0.00 H new ATOM 691 N ALA A 50 -13.910 -12.040 1.167 1.00 0.00 N ATOM 692 CA ALA A 50 -12.614 -12.465 0.565 1.00 0.00 C ATOM 693 C ALA A 50 -12.870 -13.208 -0.750 1.00 0.00 C ATOM 694 O ALA A 50 -11.966 -13.431 -1.531 1.00 0.00 O ATOM 695 CB ALA A 50 -11.978 -13.397 1.597 1.00 0.00 C ATOM 0 H ALA A 50 -14.129 -12.463 2.069 1.00 0.00 H new ATOM 0 HA ALA A 50 -11.966 -11.619 0.335 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -11.017 -13.752 1.224 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -11.827 -12.856 2.531 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -12.636 -14.248 1.773 1.00 0.00 H new ATOM 701 N SER A 51 -14.092 -13.594 -1.004 1.00 0.00 N ATOM 702 CA SER A 51 -14.395 -14.322 -2.269 1.00 0.00 C ATOM 703 C SER A 51 -14.715 -13.320 -3.381 1.00 0.00 C ATOM 704 O SER A 51 -15.651 -13.495 -4.137 1.00 0.00 O ATOM 705 CB SER A 51 -15.616 -15.186 -1.951 1.00 0.00 C ATOM 706 OG SER A 51 -15.294 -16.553 -2.172 1.00 0.00 O ATOM 0 H SER A 51 -14.892 -13.437 -0.391 1.00 0.00 H new ATOM 0 HA SER A 51 -13.555 -14.925 -2.614 1.00 0.00 H new ATOM 0 HB2 SER A 51 -15.923 -15.035 -0.916 1.00 0.00 H new ATOM 0 HB3 SER A 51 -16.457 -14.892 -2.579 1.00 0.00 H new ATOM 0 HG SER A 51 -16.074 -17.110 -1.967 1.00 0.00 H new ATOM 712 N ASP A 52 -13.945 -12.271 -3.490 1.00 0.00 N ATOM 713 CA ASP A 52 -14.207 -11.262 -4.556 1.00 0.00 C ATOM 714 C ASP A 52 -12.908 -10.966 -5.314 1.00 0.00 C ATOM 715 O ASP A 52 -11.919 -10.587 -4.719 1.00 0.00 O ATOM 716 CB ASP A 52 -14.700 -10.016 -3.818 1.00 0.00 C ATOM 717 CG ASP A 52 -16.130 -10.232 -3.322 1.00 0.00 C ATOM 718 OD1 ASP A 52 -16.291 -10.875 -2.298 1.00 0.00 O ATOM 719 OD2 ASP A 52 -17.042 -9.751 -3.975 1.00 0.00 O ATOM 0 H ASP A 52 -13.147 -12.069 -2.888 1.00 0.00 H new ATOM 0 HA ASP A 52 -14.937 -11.607 -5.288 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -14.043 -9.799 -2.976 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -14.663 -9.152 -4.482 1.00 0.00 H new ATOM 724 N PRO A 53 -12.954 -11.152 -6.607 1.00 0.00 N ATOM 725 CA PRO A 53 -11.739 -10.892 -7.427 1.00 0.00 C ATOM 726 C PRO A 53 -11.400 -9.399 -7.406 1.00 0.00 C ATOM 727 O PRO A 53 -10.275 -9.005 -7.638 1.00 0.00 O ATOM 728 CB PRO A 53 -12.131 -11.350 -8.831 1.00 0.00 C ATOM 729 CG PRO A 53 -13.622 -11.402 -8.848 1.00 0.00 C ATOM 730 CD PRO A 53 -14.082 -11.606 -7.432 1.00 0.00 C ATOM 0 HA PRO A 53 -10.855 -11.412 -7.059 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -11.757 -10.658 -9.585 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -11.704 -12.328 -9.055 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -14.033 -10.479 -9.256 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -13.970 -12.215 -9.485 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -14.984 -11.031 -7.221 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -14.319 -12.652 -7.239 1.00 0.00 H new ATOM 738 N GLY A 54 -12.366 -8.566 -7.131 1.00 0.00 N ATOM 739 CA GLY A 54 -12.098 -7.100 -7.097 1.00 0.00 C ATOM 740 C GLY A 54 -10.903 -6.826 -6.184 1.00 0.00 C ATOM 741 O GLY A 54 -10.164 -5.881 -6.379 1.00 0.00 O ATOM 0 H GLY A 54 -13.328 -8.837 -6.929 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -11.894 -6.733 -8.103 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -12.977 -6.566 -6.735 1.00 0.00 H new ATOM 745 N VAL A 55 -10.705 -7.645 -5.188 1.00 0.00 N ATOM 746 CA VAL A 55 -9.555 -7.430 -4.264 1.00 0.00 C ATOM 747 C VAL A 55 -8.251 -7.430 -5.064 1.00 0.00 C ATOM 748 O VAL A 55 -7.376 -6.616 -4.843 1.00 0.00 O ATOM 749 CB VAL A 55 -9.595 -8.606 -3.287 1.00 0.00 C ATOM 750 CG1 VAL A 55 -8.483 -8.447 -2.247 1.00 0.00 C ATOM 751 CG2 VAL A 55 -10.952 -8.631 -2.582 1.00 0.00 C ATOM 0 H VAL A 55 -11.289 -8.453 -4.974 1.00 0.00 H new ATOM 0 HA VAL A 55 -9.612 -6.477 -3.738 1.00 0.00 H new ATOM 0 HB VAL A 55 -9.448 -9.538 -3.833 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -8.513 -9.286 -1.551 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -7.516 -8.426 -2.749 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -8.628 -7.516 -1.699 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -10.984 -9.468 -1.885 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -11.096 -7.698 -2.036 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -11.744 -8.744 -3.322 1.00 0.00 H new ATOM 761 N ALA A 56 -8.114 -8.335 -5.993 1.00 0.00 N ATOM 762 CA ALA A 56 -6.867 -8.383 -6.807 1.00 0.00 C ATOM 763 C ALA A 56 -6.800 -7.153 -7.714 1.00 0.00 C ATOM 764 O ALA A 56 -5.749 -6.784 -8.197 1.00 0.00 O ATOM 765 CB ALA A 56 -6.973 -9.665 -7.635 1.00 0.00 C ATOM 0 H ALA A 56 -8.811 -9.043 -6.224 1.00 0.00 H new ATOM 0 HA ALA A 56 -5.966 -8.381 -6.193 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -6.087 -9.768 -8.261 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -7.048 -10.524 -6.968 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -7.860 -9.618 -8.266 1.00 0.00 H new ATOM 771 N ASP A 57 -7.913 -6.513 -7.946 1.00 0.00 N ATOM 772 CA ASP A 57 -7.908 -5.305 -8.818 1.00 0.00 C ATOM 773 C ASP A 57 -7.489 -4.085 -7.995 1.00 0.00 C ATOM 774 O ASP A 57 -6.783 -3.217 -8.468 1.00 0.00 O ATOM 775 CB ASP A 57 -9.348 -5.159 -9.314 1.00 0.00 C ATOM 776 CG ASP A 57 -9.529 -5.924 -10.626 1.00 0.00 C ATOM 777 OD1 ASP A 57 -9.365 -7.132 -10.612 1.00 0.00 O ATOM 778 OD2 ASP A 57 -9.830 -5.287 -11.623 1.00 0.00 O ATOM 0 H ASP A 57 -8.825 -6.774 -7.570 1.00 0.00 H new ATOM 0 HA ASP A 57 -7.209 -5.390 -9.650 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -10.040 -5.539 -8.563 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -9.585 -4.106 -9.462 1.00 0.00 H new ATOM 783 N LEU A 58 -7.921 -4.012 -6.765 1.00 0.00 N ATOM 784 CA LEU A 58 -7.549 -2.849 -5.912 1.00 0.00 C ATOM 785 C LEU A 58 -6.102 -2.992 -5.438 1.00 0.00 C ATOM 786 O LEU A 58 -5.242 -2.213 -5.798 1.00 0.00 O ATOM 787 CB LEU A 58 -8.513 -2.894 -4.726 1.00 0.00 C ATOM 788 CG LEU A 58 -9.381 -1.636 -4.731 1.00 0.00 C ATOM 789 CD1 LEU A 58 -10.262 -1.613 -3.482 1.00 0.00 C ATOM 790 CD2 LEU A 58 -8.483 -0.398 -4.741 1.00 0.00 C ATOM 0 H LEU A 58 -8.515 -4.708 -6.315 1.00 0.00 H new ATOM 0 HA LEU A 58 -7.618 -1.903 -6.449 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -9.141 -3.783 -4.787 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -7.955 -2.961 -3.792 1.00 0.00 H new ATOM 0 HG LEU A 58 -10.013 -1.638 -5.619 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -10.879 -0.715 -3.489 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -10.903 -2.494 -3.473 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -9.632 -1.614 -2.592 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -9.101 0.500 -4.745 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -7.851 -0.400 -3.853 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -7.856 -0.410 -5.633 1.00 0.00 H new ATOM 802 N GLY A 59 -5.827 -3.979 -4.627 1.00 0.00 N ATOM 803 CA GLY A 59 -4.436 -4.170 -4.124 1.00 0.00 C ATOM 804 C GLY A 59 -3.449 -4.078 -5.291 1.00 0.00 C ATOM 805 O GLY A 59 -2.443 -3.401 -5.211 1.00 0.00 O ATOM 0 H GLY A 59 -6.507 -4.662 -4.291 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -4.202 -3.412 -3.376 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -4.346 -5.140 -3.634 1.00 0.00 H new ATOM 809 N ALA A 60 -3.725 -4.753 -6.372 1.00 0.00 N ATOM 810 CA ALA A 60 -2.797 -4.700 -7.538 1.00 0.00 C ATOM 811 C ALA A 60 -2.626 -3.249 -7.993 1.00 0.00 C ATOM 812 O ALA A 60 -1.550 -2.830 -8.372 1.00 0.00 O ATOM 813 CB ALA A 60 -3.469 -5.534 -8.629 1.00 0.00 C ATOM 0 H ALA A 60 -4.551 -5.338 -6.499 1.00 0.00 H new ATOM 0 HA ALA A 60 -1.805 -5.083 -7.299 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -2.842 -5.541 -9.520 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -3.606 -6.555 -8.274 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -4.440 -5.101 -8.872 1.00 0.00 H new ATOM 819 N LYS A 61 -3.678 -2.478 -7.958 1.00 0.00 N ATOM 820 CA LYS A 61 -3.573 -1.055 -8.388 1.00 0.00 C ATOM 821 C LYS A 61 -2.904 -0.233 -7.284 1.00 0.00 C ATOM 822 O LYS A 61 -2.259 0.764 -7.544 1.00 0.00 O ATOM 823 CB LYS A 61 -5.014 -0.593 -8.611 1.00 0.00 C ATOM 824 CG LYS A 61 -5.367 -0.721 -10.095 1.00 0.00 C ATOM 825 CD LYS A 61 -6.872 -0.521 -10.281 1.00 0.00 C ATOM 826 CE LYS A 61 -7.173 -0.252 -11.757 1.00 0.00 C ATOM 827 NZ LYS A 61 -8.219 0.808 -11.741 1.00 0.00 N ATOM 0 H LYS A 61 -4.605 -2.772 -7.650 1.00 0.00 H new ATOM 0 HA LYS A 61 -2.973 -0.934 -9.290 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -5.697 -1.194 -8.011 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -5.130 0.441 -8.286 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -4.817 0.019 -10.676 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -5.071 -1.702 -10.467 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -7.412 -1.406 -9.944 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -7.217 0.314 -9.671 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -6.281 0.079 -12.289 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -7.528 -1.152 -12.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -8.482 1.051 -12.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -9.057 0.461 -11.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -7.849 1.654 -11.262 1.00 0.00 H new ATOM 841 N VAL A 62 -3.051 -0.642 -6.054 1.00 0.00 N ATOM 842 CA VAL A 62 -2.421 0.117 -4.937 1.00 0.00 C ATOM 843 C VAL A 62 -0.941 -0.258 -4.833 1.00 0.00 C ATOM 844 O VAL A 62 -0.091 0.584 -4.623 1.00 0.00 O ATOM 845 CB VAL A 62 -3.179 -0.309 -3.679 1.00 0.00 C ATOM 846 CG1 VAL A 62 -2.653 0.475 -2.476 1.00 0.00 C ATOM 847 CG2 VAL A 62 -4.671 -0.020 -3.862 1.00 0.00 C ATOM 0 H VAL A 62 -3.580 -1.468 -5.774 1.00 0.00 H new ATOM 0 HA VAL A 62 -2.472 1.196 -5.084 1.00 0.00 H new ATOM 0 HB VAL A 62 -3.032 -1.376 -3.510 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -3.193 0.171 -1.579 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -1.590 0.271 -2.346 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -2.800 1.542 -2.644 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -5.213 -0.323 -2.966 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -4.817 1.047 -4.031 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -5.047 -0.578 -4.720 1.00 0.00 H new ATOM 857 N LEU A 63 -0.626 -1.517 -4.980 1.00 0.00 N ATOM 858 CA LEU A 63 0.799 -1.946 -4.892 1.00 0.00 C ATOM 859 C LEU A 63 1.674 -1.028 -5.751 1.00 0.00 C ATOM 860 O LEU A 63 2.682 -0.519 -5.304 1.00 0.00 O ATOM 861 CB LEU A 63 0.821 -3.377 -5.434 1.00 0.00 C ATOM 862 CG LEU A 63 1.128 -4.351 -4.297 1.00 0.00 C ATOM 863 CD1 LEU A 63 2.469 -3.985 -3.657 1.00 0.00 C ATOM 864 CD2 LEU A 63 0.022 -4.269 -3.243 1.00 0.00 C ATOM 0 H LEU A 63 -1.294 -2.267 -5.157 1.00 0.00 H new ATOM 0 HA LEU A 63 1.186 -1.896 -3.874 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -0.141 -3.621 -5.885 1.00 0.00 H new ATOM 0 HB3 LEU A 63 1.573 -3.468 -6.218 1.00 0.00 H new ATOM 0 HG LEU A 63 1.180 -5.365 -4.693 1.00 0.00 H new ATOM 0 HD11 LEU A 63 2.687 -4.680 -2.846 1.00 0.00 H new ATOM 0 HD12 LEU A 63 3.258 -4.043 -4.407 1.00 0.00 H new ATOM 0 HD13 LEU A 63 2.419 -2.971 -3.261 1.00 0.00 H new ATOM 0 HD21 LEU A 63 0.240 -4.963 -2.432 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -0.030 -3.254 -2.848 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -0.934 -4.531 -3.697 1.00 0.00 H new ATOM 876 N ALA A 64 1.299 -0.813 -6.981 1.00 0.00 N ATOM 877 CA ALA A 64 2.115 0.069 -7.864 1.00 0.00 C ATOM 878 C ALA A 64 2.425 1.383 -7.142 1.00 0.00 C ATOM 879 O ALA A 64 3.563 1.804 -7.067 1.00 0.00 O ATOM 880 CB ALA A 64 1.250 0.315 -9.101 1.00 0.00 C ATOM 0 H ALA A 64 0.464 -1.209 -7.413 1.00 0.00 H new ATOM 0 HA ALA A 64 3.071 -0.380 -8.132 1.00 0.00 H new ATOM 0 HB1 ALA A 64 1.787 0.958 -9.798 1.00 0.00 H new ATOM 0 HB2 ALA A 64 1.026 -0.636 -9.584 1.00 0.00 H new ATOM 0 HB3 ALA A 64 0.319 0.799 -8.804 1.00 0.00 H new ATOM 886 N GLN A 65 1.428 2.035 -6.605 1.00 0.00 N ATOM 887 CA GLN A 65 1.682 3.319 -5.886 1.00 0.00 C ATOM 888 C GLN A 65 2.833 3.127 -4.898 1.00 0.00 C ATOM 889 O GLN A 65 3.757 3.914 -4.843 1.00 0.00 O ATOM 890 CB GLN A 65 0.379 3.636 -5.150 1.00 0.00 C ATOM 891 CG GLN A 65 0.367 5.111 -4.744 1.00 0.00 C ATOM 892 CD GLN A 65 0.525 5.995 -5.982 1.00 0.00 C ATOM 893 OE1 GLN A 65 -0.407 6.169 -6.742 1.00 0.00 O ATOM 894 NE2 GLN A 65 1.675 6.564 -6.220 1.00 0.00 N ATOM 0 H GLN A 65 0.453 1.736 -6.632 1.00 0.00 H new ATOM 0 HA GLN A 65 1.962 4.130 -6.559 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -0.475 3.417 -5.791 1.00 0.00 H new ATOM 0 HB3 GLN A 65 0.285 3.004 -4.267 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -0.566 5.349 -4.234 1.00 0.00 H new ATOM 0 HG3 GLN A 65 1.175 5.310 -4.040 1.00 0.00 H new ATOM 0 HE21 GLN A 65 2.458 6.418 -5.582 1.00 0.00 H new ATOM 0 HE22 GLN A 65 1.791 7.154 -7.044 1.00 0.00 H new ATOM 903 N ILE A 66 2.789 2.077 -4.126 1.00 0.00 N ATOM 904 CA ILE A 66 3.884 1.823 -3.151 1.00 0.00 C ATOM 905 C ILE A 66 5.214 1.764 -3.902 1.00 0.00 C ATOM 906 O ILE A 66 6.197 2.356 -3.501 1.00 0.00 O ATOM 907 CB ILE A 66 3.546 0.469 -2.526 1.00 0.00 C ATOM 908 CG1 ILE A 66 2.220 0.584 -1.762 1.00 0.00 C ATOM 909 CG2 ILE A 66 4.668 0.046 -1.571 1.00 0.00 C ATOM 910 CD1 ILE A 66 2.424 1.419 -0.496 1.00 0.00 C ATOM 0 H ILE A 66 2.041 1.384 -4.129 1.00 0.00 H new ATOM 0 HA ILE A 66 3.973 2.599 -2.391 1.00 0.00 H new ATOM 0 HB ILE A 66 3.448 -0.283 -3.309 1.00 0.00 H new ATOM 0 HG12 ILE A 66 1.463 1.046 -2.396 1.00 0.00 H new ATOM 0 HG13 ILE A 66 1.853 -0.408 -1.499 1.00 0.00 H new ATOM 0 HG21 ILE A 66 4.424 -0.919 -1.127 1.00 0.00 H new ATOM 0 HG22 ILE A 66 5.604 -0.035 -2.123 1.00 0.00 H new ATOM 0 HG23 ILE A 66 4.775 0.791 -0.782 1.00 0.00 H new ATOM 0 HD11 ILE A 66 1.480 1.498 0.044 1.00 0.00 H new ATOM 0 HD12 ILE A 66 3.167 0.939 0.141 1.00 0.00 H new ATOM 0 HD13 ILE A 66 2.770 2.416 -0.769 1.00 0.00 H new ATOM 922 N GLY A 67 5.245 1.058 -4.997 1.00 0.00 N ATOM 923 CA GLY A 67 6.502 0.960 -5.792 1.00 0.00 C ATOM 924 C GLY A 67 6.899 2.357 -6.270 1.00 0.00 C ATOM 925 O GLY A 67 8.020 2.790 -6.095 1.00 0.00 O ATOM 0 H GLY A 67 4.451 0.542 -5.378 1.00 0.00 H new ATOM 0 HA2 GLY A 67 7.299 0.529 -5.185 1.00 0.00 H new ATOM 0 HA3 GLY A 67 6.357 0.297 -6.645 1.00 0.00 H new ATOM 929 N VAL A 68 5.984 3.064 -6.875 1.00 0.00 N ATOM 930 CA VAL A 68 6.302 4.433 -7.370 1.00 0.00 C ATOM 931 C VAL A 68 6.788 5.301 -6.209 1.00 0.00 C ATOM 932 O VAL A 68 7.597 6.191 -6.383 1.00 0.00 O ATOM 933 CB VAL A 68 4.987 4.971 -7.935 1.00 0.00 C ATOM 934 CG1 VAL A 68 5.192 6.402 -8.434 1.00 0.00 C ATOM 935 CG2 VAL A 68 4.533 4.086 -9.098 1.00 0.00 C ATOM 0 H VAL A 68 5.028 2.752 -7.048 1.00 0.00 H new ATOM 0 HA VAL A 68 7.090 4.432 -8.123 1.00 0.00 H new ATOM 0 HB VAL A 68 4.227 4.965 -7.154 1.00 0.00 H new ATOM 0 HG11 VAL A 68 4.254 6.785 -8.837 1.00 0.00 H new ATOM 0 HG12 VAL A 68 5.516 7.033 -7.606 1.00 0.00 H new ATOM 0 HG13 VAL A 68 5.952 6.410 -9.215 1.00 0.00 H new ATOM 0 HG21 VAL A 68 3.596 4.468 -9.502 1.00 0.00 H new ATOM 0 HG22 VAL A 68 5.294 4.092 -9.879 1.00 0.00 H new ATOM 0 HG23 VAL A 68 4.386 3.066 -8.743 1.00 0.00 H new ATOM 945 N ALA A 69 6.302 5.052 -5.024 1.00 0.00 N ATOM 946 CA ALA A 69 6.740 5.867 -3.856 1.00 0.00 C ATOM 947 C ALA A 69 8.073 5.330 -3.328 1.00 0.00 C ATOM 948 O ALA A 69 8.909 6.075 -2.857 1.00 0.00 O ATOM 949 CB ALA A 69 5.632 5.702 -2.815 1.00 0.00 C ATOM 0 H ALA A 69 5.622 4.321 -4.814 1.00 0.00 H new ATOM 0 HA ALA A 69 6.894 6.916 -4.108 1.00 0.00 H new ATOM 0 HB1 ALA A 69 5.883 6.275 -1.922 1.00 0.00 H new ATOM 0 HB2 ALA A 69 4.690 6.065 -3.226 1.00 0.00 H new ATOM 0 HB3 ALA A 69 5.532 4.649 -2.554 1.00 0.00 H new ATOM 955 N VAL A 70 8.279 4.044 -3.405 1.00 0.00 N ATOM 956 CA VAL A 70 9.560 3.462 -2.910 1.00 0.00 C ATOM 957 C VAL A 70 10.720 3.956 -3.780 1.00 0.00 C ATOM 958 O VAL A 70 11.869 3.901 -3.388 1.00 0.00 O ATOM 959 CB VAL A 70 9.389 1.945 -3.039 1.00 0.00 C ATOM 960 CG1 VAL A 70 10.735 1.253 -2.806 1.00 0.00 C ATOM 961 CG2 VAL A 70 8.382 1.457 -1.996 1.00 0.00 C ATOM 0 H VAL A 70 7.616 3.371 -3.789 1.00 0.00 H new ATOM 0 HA VAL A 70 9.783 3.752 -1.883 1.00 0.00 H new ATOM 0 HB VAL A 70 9.027 1.706 -4.039 1.00 0.00 H new ATOM 0 HG11 VAL A 70 10.610 0.174 -2.898 1.00 0.00 H new ATOM 0 HG12 VAL A 70 11.455 1.600 -3.547 1.00 0.00 H new ATOM 0 HG13 VAL A 70 11.099 1.492 -1.807 1.00 0.00 H new ATOM 0 HG21 VAL A 70 8.259 0.378 -2.086 1.00 0.00 H new ATOM 0 HG22 VAL A 70 8.746 1.698 -0.998 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.422 1.947 -2.160 1.00 0.00 H new ATOM 971 N SER A 71 10.430 4.435 -4.958 1.00 0.00 N ATOM 972 CA SER A 71 11.518 4.928 -5.851 1.00 0.00 C ATOM 973 C SER A 71 12.025 6.286 -5.357 1.00 0.00 C ATOM 974 O SER A 71 13.077 6.745 -5.754 1.00 0.00 O ATOM 975 CB SER A 71 10.876 5.060 -7.232 1.00 0.00 C ATOM 976 OG SER A 71 11.337 4.006 -8.067 1.00 0.00 O ATOM 0 H SER A 71 9.488 4.507 -5.341 1.00 0.00 H new ATOM 0 HA SER A 71 12.375 4.255 -5.870 1.00 0.00 H new ATOM 0 HB2 SER A 71 9.790 5.023 -7.146 1.00 0.00 H new ATOM 0 HB3 SER A 71 11.128 6.025 -7.672 1.00 0.00 H new ATOM 0 HG SER A 71 10.926 4.087 -8.953 1.00 0.00 H new ATOM 982 N HIS A 72 11.288 6.934 -4.496 1.00 0.00 N ATOM 983 CA HIS A 72 11.738 8.261 -3.986 1.00 0.00 C ATOM 984 C HIS A 72 12.010 8.173 -2.480 1.00 0.00 C ATOM 985 O HIS A 72 13.116 7.896 -2.063 1.00 0.00 O ATOM 986 CB HIS A 72 10.582 9.219 -4.283 1.00 0.00 C ATOM 987 CG HIS A 72 10.470 9.425 -5.768 1.00 0.00 C ATOM 988 ND1 HIS A 72 11.583 9.482 -6.593 1.00 0.00 N ATOM 989 CD2 HIS A 72 9.384 9.588 -6.593 1.00 0.00 C ATOM 990 CE1 HIS A 72 11.146 9.672 -7.851 1.00 0.00 C ATOM 991 NE2 HIS A 72 9.813 9.744 -7.907 1.00 0.00 N ATOM 0 H HIS A 72 10.397 6.604 -4.125 1.00 0.00 H new ATOM 0 HA HIS A 72 12.662 8.599 -4.455 1.00 0.00 H new ATOM 0 HB2 HIS A 72 9.650 8.814 -3.890 1.00 0.00 H new ATOM 0 HB3 HIS A 72 10.750 10.174 -3.784 1.00 0.00 H new ATOM 0 HD2 HIS A 72 8.353 9.594 -6.270 1.00 0.00 H new ATOM 0 HE1 HIS A 72 11.794 9.756 -8.711 1.00 0.00 H new ATOM 0 HE2 HIS A 72 9.234 9.883 -8.735 1.00 0.00 H new ATOM 1000 N LEU A 73 11.012 8.408 -1.665 1.00 0.00 N ATOM 1001 CA LEU A 73 11.205 8.343 -0.183 1.00 0.00 C ATOM 1002 C LEU A 73 12.196 9.424 0.264 1.00 0.00 C ATOM 1003 O LEU A 73 11.820 10.403 0.877 1.00 0.00 O ATOM 1004 CB LEU A 73 11.747 6.938 0.111 1.00 0.00 C ATOM 1005 CG LEU A 73 10.895 5.891 -0.611 1.00 0.00 C ATOM 1006 CD1 LEU A 73 11.324 4.491 -0.170 1.00 0.00 C ATOM 1007 CD2 LEU A 73 9.417 6.100 -0.264 1.00 0.00 C ATOM 0 H LEU A 73 10.066 8.644 -1.964 1.00 0.00 H new ATOM 0 HA LEU A 73 10.276 8.521 0.359 1.00 0.00 H new ATOM 0 HB2 LEU A 73 12.784 6.863 -0.215 1.00 0.00 H new ATOM 0 HB3 LEU A 73 11.736 6.751 1.185 1.00 0.00 H new ATOM 0 HG LEU A 73 11.034 5.995 -1.687 1.00 0.00 H new ATOM 0 HD11 LEU A 73 10.717 3.746 -0.684 1.00 0.00 H new ATOM 0 HD12 LEU A 73 12.374 4.337 -0.418 1.00 0.00 H new ATOM 0 HD13 LEU A 73 11.187 4.391 0.907 1.00 0.00 H new ATOM 0 HD21 LEU A 73 8.813 5.353 -0.779 1.00 0.00 H new ATOM 0 HD22 LEU A 73 9.278 5.999 0.812 1.00 0.00 H new ATOM 0 HD23 LEU A 73 9.107 7.097 -0.578 1.00 0.00 H new ATOM 1019 N GLY A 74 13.456 9.261 -0.037 1.00 0.00 N ATOM 1020 CA GLY A 74 14.457 10.285 0.374 1.00 0.00 C ATOM 1021 C GLY A 74 14.094 11.625 -0.267 1.00 0.00 C ATOM 1022 O GLY A 74 14.396 12.678 0.258 1.00 0.00 O ATOM 0 H GLY A 74 13.834 8.464 -0.549 1.00 0.00 H new ATOM 0 HA2 GLY A 74 14.474 10.380 1.460 1.00 0.00 H new ATOM 0 HA3 GLY A 74 15.457 9.979 0.065 1.00 0.00 H new ATOM 1026 N ASP A 75 13.446 11.593 -1.399 1.00 0.00 N ATOM 1027 CA ASP A 75 13.061 12.864 -2.074 1.00 0.00 C ATOM 1028 C ASP A 75 11.640 13.253 -1.662 1.00 0.00 C ATOM 1029 O ASP A 75 10.768 12.416 -1.538 1.00 0.00 O ATOM 1030 CB ASP A 75 13.128 12.562 -3.572 1.00 0.00 C ATOM 1031 CG ASP A 75 13.577 13.808 -4.339 1.00 0.00 C ATOM 1032 OD1 ASP A 75 12.903 14.819 -4.233 1.00 0.00 O ATOM 1033 OD2 ASP A 75 14.587 13.729 -5.018 1.00 0.00 O ATOM 0 H ASP A 75 13.167 10.741 -1.886 1.00 0.00 H new ATOM 0 HA ASP A 75 13.714 13.694 -1.806 1.00 0.00 H new ATOM 0 HB2 ASP A 75 13.823 11.742 -3.755 1.00 0.00 H new ATOM 0 HB3 ASP A 75 12.151 12.237 -3.930 1.00 0.00 H new ATOM 1038 N GLU A 76 11.399 14.517 -1.447 1.00 0.00 N ATOM 1039 CA GLU A 76 10.033 14.957 -1.043 1.00 0.00 C ATOM 1040 C GLU A 76 9.609 16.160 -1.889 1.00 0.00 C ATOM 1041 O GLU A 76 9.307 17.218 -1.373 1.00 0.00 O ATOM 1042 CB GLU A 76 10.156 15.348 0.431 1.00 0.00 C ATOM 1043 CG GLU A 76 8.910 14.884 1.188 1.00 0.00 C ATOM 1044 CD GLU A 76 9.241 14.684 2.668 1.00 0.00 C ATOM 1045 OE1 GLU A 76 10.085 15.409 3.169 1.00 0.00 O ATOM 1046 OE2 GLU A 76 8.644 13.811 3.275 1.00 0.00 O ATOM 0 H GLU A 76 12.088 15.264 -1.533 1.00 0.00 H new ATOM 0 HA GLU A 76 9.283 14.179 -1.189 1.00 0.00 H new ATOM 0 HB2 GLU A 76 11.048 14.896 0.865 1.00 0.00 H new ATOM 0 HB3 GLU A 76 10.269 16.428 0.523 1.00 0.00 H new ATOM 0 HG2 GLU A 76 8.114 15.621 1.081 1.00 0.00 H new ATOM 0 HG3 GLU A 76 8.541 13.952 0.760 1.00 0.00 H new ATOM 1053 N GLY A 77 9.584 16.007 -3.184 1.00 0.00 N ATOM 1054 CA GLY A 77 9.180 17.143 -4.059 1.00 0.00 C ATOM 1055 C GLY A 77 8.266 16.628 -5.174 1.00 0.00 C ATOM 1056 O GLY A 77 8.055 17.291 -6.170 1.00 0.00 O ATOM 0 H GLY A 77 9.826 15.145 -3.674 1.00 0.00 H new ATOM 0 HA2 GLY A 77 8.663 17.902 -3.472 1.00 0.00 H new ATOM 0 HA3 GLY A 77 10.063 17.618 -4.488 1.00 0.00 H new ATOM 1060 N LYS A 78 7.718 15.452 -5.017 1.00 0.00 N ATOM 1061 CA LYS A 78 6.819 14.907 -6.073 1.00 0.00 C ATOM 1062 C LYS A 78 6.083 13.673 -5.545 1.00 0.00 C ATOM 1063 O LYS A 78 4.901 13.502 -5.770 1.00 0.00 O ATOM 1064 CB LYS A 78 7.738 14.530 -7.235 1.00 0.00 C ATOM 1065 CG LYS A 78 6.928 13.794 -8.303 1.00 0.00 C ATOM 1066 CD LYS A 78 7.635 13.914 -9.655 1.00 0.00 C ATOM 1067 CE LYS A 78 8.760 12.880 -9.736 1.00 0.00 C ATOM 1068 NZ LYS A 78 9.730 13.454 -10.708 1.00 0.00 N ATOM 0 H LYS A 78 7.854 14.848 -4.206 1.00 0.00 H new ATOM 0 HA LYS A 78 6.061 15.627 -6.381 1.00 0.00 H new ATOM 0 HB2 LYS A 78 8.192 15.425 -7.660 1.00 0.00 H new ATOM 0 HB3 LYS A 78 8.552 13.898 -6.880 1.00 0.00 H new ATOM 0 HG2 LYS A 78 6.817 12.744 -8.031 1.00 0.00 H new ATOM 0 HG3 LYS A 78 5.924 14.215 -8.367 1.00 0.00 H new ATOM 0 HD2 LYS A 78 6.923 13.757 -10.465 1.00 0.00 H new ATOM 0 HD3 LYS A 78 8.040 14.918 -9.778 1.00 0.00 H new ATOM 0 HE2 LYS A 78 9.222 12.721 -8.762 1.00 0.00 H new ATOM 0 HE3 LYS A 78 8.386 11.913 -10.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 10.534 12.804 -10.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 9.262 13.589 -11.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 10.073 14.371 -10.356 1.00 0.00 H new ATOM 1082 N MET A 79 6.770 12.808 -4.845 1.00 0.00 N ATOM 1083 CA MET A 79 6.103 11.586 -4.306 1.00 0.00 C ATOM 1084 C MET A 79 4.793 11.978 -3.619 1.00 0.00 C ATOM 1085 O MET A 79 3.796 11.291 -3.722 1.00 0.00 O ATOM 1086 CB MET A 79 7.089 10.993 -3.298 1.00 0.00 C ATOM 1087 CG MET A 79 6.412 9.857 -2.529 1.00 0.00 C ATOM 1088 SD MET A 79 7.636 9.015 -1.495 1.00 0.00 S ATOM 1089 CE MET A 79 7.343 9.961 0.019 1.00 0.00 C ATOM 0 H MET A 79 7.762 12.895 -4.624 1.00 0.00 H new ATOM 0 HA MET A 79 5.857 10.867 -5.087 1.00 0.00 H new ATOM 0 HB2 MET A 79 7.973 10.620 -3.815 1.00 0.00 H new ATOM 0 HB3 MET A 79 7.426 11.765 -2.606 1.00 0.00 H new ATOM 0 HG2 MET A 79 5.607 10.252 -1.909 1.00 0.00 H new ATOM 0 HG3 MET A 79 5.961 9.150 -3.226 1.00 0.00 H new ATOM 0 HE1 MET A 79 8.005 9.602 0.807 1.00 0.00 H new ATOM 0 HE2 MET A 79 7.540 11.017 -0.168 1.00 0.00 H new ATOM 0 HE3 MET A 79 6.306 9.835 0.332 1.00 0.00 H new ATOM 1099 N VAL A 80 4.787 13.082 -2.924 1.00 0.00 N ATOM 1100 CA VAL A 80 3.540 13.521 -2.237 1.00 0.00 C ATOM 1101 C VAL A 80 2.576 14.112 -3.267 1.00 0.00 C ATOM 1102 O VAL A 80 1.376 14.118 -3.076 1.00 0.00 O ATOM 1103 CB VAL A 80 3.984 14.586 -1.234 1.00 0.00 C ATOM 1104 CG1 VAL A 80 2.789 15.011 -0.379 1.00 0.00 C ATOM 1105 CG2 VAL A 80 5.077 14.009 -0.330 1.00 0.00 C ATOM 0 H VAL A 80 5.591 13.698 -2.802 1.00 0.00 H new ATOM 0 HA VAL A 80 3.023 12.701 -1.739 1.00 0.00 H new ATOM 0 HB VAL A 80 4.373 15.451 -1.771 1.00 0.00 H new ATOM 0 HG11 VAL A 80 3.105 15.770 0.336 1.00 0.00 H new ATOM 0 HG12 VAL A 80 2.009 15.420 -1.021 1.00 0.00 H new ATOM 0 HG13 VAL A 80 2.400 14.146 0.158 1.00 0.00 H new ATOM 0 HG21 VAL A 80 5.395 14.767 0.386 1.00 0.00 H new ATOM 0 HG22 VAL A 80 4.686 13.144 0.207 1.00 0.00 H new ATOM 0 HG23 VAL A 80 5.929 13.704 -0.938 1.00 0.00 H new ATOM 1115 N ALA A 81 3.090 14.606 -4.360 1.00 0.00 N ATOM 1116 CA ALA A 81 2.199 15.192 -5.401 1.00 0.00 C ATOM 1117 C ALA A 81 1.182 14.140 -5.849 1.00 0.00 C ATOM 1118 O ALA A 81 0.006 14.415 -5.978 1.00 0.00 O ATOM 1119 CB ALA A 81 3.125 15.581 -6.555 1.00 0.00 C ATOM 0 H ALA A 81 4.086 14.629 -4.577 1.00 0.00 H new ATOM 0 HA ALA A 81 1.638 16.053 -5.038 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.537 16.021 -7.361 1.00 0.00 H new ATOM 0 HB2 ALA A 81 3.859 16.306 -6.204 1.00 0.00 H new ATOM 0 HB3 ALA A 81 3.639 14.694 -6.924 1.00 0.00 H new ATOM 1125 N GLU A 82 1.627 12.936 -6.080 1.00 0.00 N ATOM 1126 CA GLU A 82 0.686 11.864 -6.513 1.00 0.00 C ATOM 1127 C GLU A 82 0.018 11.250 -5.282 1.00 0.00 C ATOM 1128 O GLU A 82 -1.177 11.032 -5.255 1.00 0.00 O ATOM 1129 CB GLU A 82 1.553 10.831 -7.233 1.00 0.00 C ATOM 1130 CG GLU A 82 1.903 11.343 -8.632 1.00 0.00 C ATOM 1131 CD GLU A 82 3.203 10.699 -9.116 1.00 0.00 C ATOM 1132 OE1 GLU A 82 4.228 10.946 -8.502 1.00 0.00 O ATOM 1133 OE2 GLU A 82 3.152 9.969 -10.092 1.00 0.00 O ATOM 0 H GLU A 82 2.601 12.648 -5.988 1.00 0.00 H new ATOM 0 HA GLU A 82 -0.106 12.236 -7.163 1.00 0.00 H new ATOM 0 HB2 GLU A 82 2.464 10.645 -6.664 1.00 0.00 H new ATOM 0 HB3 GLU A 82 1.022 9.882 -7.304 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.094 11.113 -9.325 1.00 0.00 H new ATOM 0 HG3 GLU A 82 2.009 12.428 -8.615 1.00 0.00 H new ATOM 1140 N MET A 83 0.780 10.974 -4.259 1.00 0.00 N ATOM 1141 CA MET A 83 0.188 10.379 -3.028 1.00 0.00 C ATOM 1142 C MET A 83 -0.893 11.314 -2.484 1.00 0.00 C ATOM 1143 O MET A 83 -2.042 10.939 -2.354 1.00 0.00 O ATOM 1144 CB MET A 83 1.350 10.254 -2.043 1.00 0.00 C ATOM 1145 CG MET A 83 2.217 9.055 -2.431 1.00 0.00 C ATOM 1146 SD MET A 83 2.180 7.827 -1.103 1.00 0.00 S ATOM 1147 CE MET A 83 0.449 7.333 -1.289 1.00 0.00 C ATOM 0 H MET A 83 1.787 11.135 -4.223 1.00 0.00 H new ATOM 0 HA MET A 83 -0.281 9.412 -3.209 1.00 0.00 H new ATOM 0 HB2 MET A 83 1.947 11.166 -2.050 1.00 0.00 H new ATOM 0 HB3 MET A 83 0.970 10.129 -1.029 1.00 0.00 H new ATOM 0 HG2 MET A 83 1.852 8.614 -3.359 1.00 0.00 H new ATOM 0 HG3 MET A 83 3.242 9.378 -2.613 1.00 0.00 H new ATOM 0 HE1 MET A 83 0.188 6.620 -0.507 1.00 0.00 H new ATOM 0 HE2 MET A 83 -0.191 8.212 -1.207 1.00 0.00 H new ATOM 0 HE3 MET A 83 0.306 6.870 -2.265 1.00 0.00 H new ATOM 1157 N LYS A 84 -0.540 12.532 -2.172 1.00 0.00 N ATOM 1158 CA LYS A 84 -1.558 13.485 -1.647 1.00 0.00 C ATOM 1159 C LYS A 84 -2.752 13.512 -2.601 1.00 0.00 C ATOM 1160 O LYS A 84 -3.881 13.704 -2.195 1.00 0.00 O ATOM 1161 CB LYS A 84 -0.859 14.846 -1.606 1.00 0.00 C ATOM 1162 CG LYS A 84 -1.503 15.717 -0.526 1.00 0.00 C ATOM 1163 CD LYS A 84 -2.542 16.640 -1.164 1.00 0.00 C ATOM 1164 CE LYS A 84 -2.587 17.965 -0.400 1.00 0.00 C ATOM 1165 NZ LYS A 84 -2.958 18.978 -1.426 1.00 0.00 N ATOM 0 H LYS A 84 0.405 12.906 -2.258 1.00 0.00 H new ATOM 0 HA LYS A 84 -1.931 13.207 -0.661 1.00 0.00 H new ATOM 0 HB2 LYS A 84 0.203 14.715 -1.398 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -0.936 15.336 -2.577 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -1.975 15.088 0.229 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -0.740 16.307 -0.018 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -2.291 16.819 -2.209 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -3.523 16.166 -1.149 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -3.319 17.932 0.407 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -1.622 18.194 0.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -3.011 19.918 -0.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -2.240 18.989 -2.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -3.883 18.736 -1.835 1.00 0.00 H new ATOM 1179 N ALA A 85 -2.511 13.308 -3.868 1.00 0.00 N ATOM 1180 CA ALA A 85 -3.632 13.307 -4.848 1.00 0.00 C ATOM 1181 C ALA A 85 -4.532 12.103 -4.574 1.00 0.00 C ATOM 1182 O ALA A 85 -5.741 12.214 -4.539 1.00 0.00 O ATOM 1183 CB ALA A 85 -2.968 13.190 -6.222 1.00 0.00 C ATOM 0 H ALA A 85 -1.586 13.142 -4.266 1.00 0.00 H new ATOM 0 HA ALA A 85 -4.251 14.202 -4.786 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -3.734 13.183 -6.997 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -2.302 14.039 -6.378 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -2.394 12.265 -6.271 1.00 0.00 H new ATOM 1189 N VAL A 86 -3.950 10.952 -4.369 1.00 0.00 N ATOM 1190 CA VAL A 86 -4.772 9.742 -4.087 1.00 0.00 C ATOM 1191 C VAL A 86 -5.755 10.054 -2.958 1.00 0.00 C ATOM 1192 O VAL A 86 -6.933 9.772 -3.051 1.00 0.00 O ATOM 1193 CB VAL A 86 -3.775 8.665 -3.659 1.00 0.00 C ATOM 1194 CG1 VAL A 86 -4.505 7.331 -3.490 1.00 0.00 C ATOM 1195 CG2 VAL A 86 -2.691 8.520 -4.730 1.00 0.00 C ATOM 0 H VAL A 86 -2.942 10.798 -4.385 1.00 0.00 H new ATOM 0 HA VAL A 86 -5.355 9.418 -4.949 1.00 0.00 H new ATOM 0 HB VAL A 86 -3.316 8.950 -2.712 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -3.794 6.563 -3.185 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -5.278 7.433 -2.728 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -4.964 7.045 -4.436 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -1.979 7.752 -4.426 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -3.150 8.235 -5.676 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -2.170 9.470 -4.851 1.00 0.00 H new ATOM 1205 N GLY A 87 -5.281 10.644 -1.894 1.00 0.00 N ATOM 1206 CA GLY A 87 -6.193 10.983 -0.766 1.00 0.00 C ATOM 1207 C GLY A 87 -7.362 11.799 -1.315 1.00 0.00 C ATOM 1208 O GLY A 87 -8.514 11.486 -1.085 1.00 0.00 O ATOM 0 H GLY A 87 -4.304 10.905 -1.758 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.557 10.074 -0.288 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -5.659 11.552 -0.005 1.00 0.00 H new ATOM 1212 N VAL A 88 -7.075 12.840 -2.050 1.00 0.00 N ATOM 1213 CA VAL A 88 -8.171 13.669 -2.624 1.00 0.00 C ATOM 1214 C VAL A 88 -9.121 12.764 -3.409 1.00 0.00 C ATOM 1215 O VAL A 88 -10.319 12.967 -3.427 1.00 0.00 O ATOM 1216 CB VAL A 88 -7.478 14.668 -3.552 1.00 0.00 C ATOM 1217 CG1 VAL A 88 -8.529 15.537 -4.244 1.00 0.00 C ATOM 1218 CG2 VAL A 88 -6.541 15.559 -2.733 1.00 0.00 C ATOM 0 H VAL A 88 -6.130 13.151 -2.277 1.00 0.00 H new ATOM 0 HA VAL A 88 -8.759 14.182 -1.863 1.00 0.00 H new ATOM 0 HB VAL A 88 -6.903 14.126 -4.303 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -8.035 16.249 -4.905 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -9.198 14.904 -4.827 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -9.105 16.079 -3.493 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -6.047 16.271 -3.394 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -7.117 16.100 -1.982 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -5.791 14.941 -2.239 1.00 0.00 H new ATOM 1228 N ARG A 89 -8.592 11.758 -4.052 1.00 0.00 N ATOM 1229 CA ARG A 89 -9.459 10.829 -4.828 1.00 0.00 C ATOM 1230 C ARG A 89 -10.286 9.986 -3.855 1.00 0.00 C ATOM 1231 O ARG A 89 -11.499 9.956 -3.920 1.00 0.00 O ATOM 1232 CB ARG A 89 -8.494 9.955 -5.631 1.00 0.00 C ATOM 1233 CG ARG A 89 -7.597 10.846 -6.492 1.00 0.00 C ATOM 1234 CD ARG A 89 -8.358 11.277 -7.748 1.00 0.00 C ATOM 1235 NE ARG A 89 -7.895 10.362 -8.827 1.00 0.00 N ATOM 1236 CZ ARG A 89 -8.189 10.620 -10.072 1.00 0.00 C ATOM 1237 NH1 ARG A 89 -8.081 11.838 -10.529 1.00 0.00 N ATOM 1238 NH2 ARG A 89 -8.592 9.661 -10.860 1.00 0.00 N ATOM 0 H ARG A 89 -7.596 11.540 -4.073 1.00 0.00 H new ATOM 0 HA ARG A 89 -10.158 11.347 -5.485 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -7.886 9.351 -4.957 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -9.052 9.264 -6.262 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -7.285 11.723 -5.924 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -6.691 10.307 -6.770 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -9.435 11.197 -7.601 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -8.147 12.317 -7.998 1.00 0.00 H new ATOM 0 HE ARG A 89 -7.348 9.533 -8.593 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -7.767 12.588 -9.913 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -8.311 12.040 -11.502 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -8.677 8.709 -10.503 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -8.822 9.863 -11.833 1.00 0.00 H new ATOM 1252 N HIS A 90 -9.639 9.310 -2.944 1.00 0.00 N ATOM 1253 CA HIS A 90 -10.390 8.482 -1.959 1.00 0.00 C ATOM 1254 C HIS A 90 -11.463 9.348 -1.297 1.00 0.00 C ATOM 1255 O HIS A 90 -12.504 8.870 -0.892 1.00 0.00 O ATOM 1256 CB HIS A 90 -9.351 8.036 -0.927 1.00 0.00 C ATOM 1257 CG HIS A 90 -8.631 6.810 -1.419 1.00 0.00 C ATOM 1258 ND1 HIS A 90 -7.940 6.787 -2.617 1.00 0.00 N ATOM 1259 CD2 HIS A 90 -8.482 5.558 -0.877 1.00 0.00 C ATOM 1260 CE1 HIS A 90 -7.411 5.558 -2.756 1.00 0.00 C ATOM 1261 NE2 HIS A 90 -7.709 4.763 -1.721 1.00 0.00 N ATOM 0 H HIS A 90 -8.624 9.296 -2.840 1.00 0.00 H new ATOM 0 HA HIS A 90 -10.886 7.627 -2.418 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -8.637 8.840 -0.747 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -9.839 7.824 0.024 1.00 0.00 H new ATOM 0 HD1 HIS A 90 -7.848 7.561 -3.275 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -8.902 5.236 0.065 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -6.816 5.249 -3.603 1.00 0.00 H new ATOM 1269 N LYS A 91 -11.209 10.623 -1.184 1.00 0.00 N ATOM 1270 CA LYS A 91 -12.200 11.536 -0.548 1.00 0.00 C ATOM 1271 C LYS A 91 -13.446 11.660 -1.432 1.00 0.00 C ATOM 1272 O LYS A 91 -14.448 12.215 -1.027 1.00 0.00 O ATOM 1273 CB LYS A 91 -11.482 12.881 -0.435 1.00 0.00 C ATOM 1274 CG LYS A 91 -12.422 13.916 0.184 1.00 0.00 C ATOM 1275 CD LYS A 91 -12.605 15.086 -0.786 1.00 0.00 C ATOM 1276 CE LYS A 91 -11.671 16.231 -0.386 1.00 0.00 C ATOM 1277 NZ LYS A 91 -12.171 17.409 -1.147 1.00 0.00 N ATOM 0 H LYS A 91 -10.353 11.074 -1.507 1.00 0.00 H new ATOM 0 HA LYS A 91 -12.536 11.173 0.423 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -10.587 12.776 0.178 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -11.156 13.214 -1.420 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -13.387 13.460 0.406 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -12.014 14.274 1.129 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -12.389 14.765 -1.805 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -13.641 15.425 -0.772 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -11.703 16.411 0.689 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -10.636 16.005 -0.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -11.583 18.239 -0.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -12.123 17.210 -2.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -13.157 17.603 -0.878 1.00 0.00 H new ATOM 1291 N GLY A 92 -13.396 11.157 -2.638 1.00 0.00 N ATOM 1292 CA GLY A 92 -14.584 11.263 -3.533 1.00 0.00 C ATOM 1293 C GLY A 92 -14.739 9.972 -4.342 1.00 0.00 C ATOM 1294 O GLY A 92 -14.865 9.998 -5.550 1.00 0.00 O ATOM 0 H GLY A 92 -12.588 10.680 -3.039 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -15.482 11.443 -2.942 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -14.470 12.113 -4.205 1.00 0.00 H new ATOM 1298 N TYR A 93 -14.737 8.843 -3.687 1.00 0.00 N ATOM 1299 CA TYR A 93 -14.893 7.554 -4.423 1.00 0.00 C ATOM 1300 C TYR A 93 -16.294 6.988 -4.179 1.00 0.00 C ATOM 1301 O TYR A 93 -17.168 7.665 -3.676 1.00 0.00 O ATOM 1302 CB TYR A 93 -13.819 6.625 -3.846 1.00 0.00 C ATOM 1303 CG TYR A 93 -12.532 6.751 -4.639 1.00 0.00 C ATOM 1304 CD1 TYR A 93 -12.267 7.903 -5.395 1.00 0.00 C ATOM 1305 CD2 TYR A 93 -11.600 5.705 -4.616 1.00 0.00 C ATOM 1306 CE1 TYR A 93 -11.076 8.006 -6.124 1.00 0.00 C ATOM 1307 CE2 TYR A 93 -10.409 5.809 -5.345 1.00 0.00 C ATOM 1308 CZ TYR A 93 -10.148 6.959 -6.098 1.00 0.00 C ATOM 1309 OH TYR A 93 -8.974 7.061 -6.817 1.00 0.00 O ATOM 0 H TYR A 93 -14.634 8.756 -2.676 1.00 0.00 H new ATOM 0 HA TYR A 93 -14.778 7.672 -5.500 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -13.636 6.875 -2.801 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -14.170 5.593 -3.871 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -12.983 8.711 -5.415 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -11.801 4.817 -4.035 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -10.874 8.893 -6.706 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -9.692 5.002 -5.326 1.00 0.00 H new ATOM 0 HH TYR A 93 -9.077 6.604 -7.678 1.00 0.00 H new ATOM 1319 N GLY A 94 -16.515 5.750 -4.530 1.00 0.00 N ATOM 1320 CA GLY A 94 -17.861 5.146 -4.314 1.00 0.00 C ATOM 1321 C GLY A 94 -18.120 5.046 -2.811 1.00 0.00 C ATOM 1322 O GLY A 94 -19.220 5.260 -2.342 1.00 0.00 O ATOM 0 H GLY A 94 -15.824 5.132 -4.956 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -18.629 5.756 -4.790 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -17.909 4.158 -4.772 1.00 0.00 H new ATOM 1326 N ASN A 95 -17.108 4.724 -2.054 1.00 0.00 N ATOM 1327 CA ASN A 95 -17.279 4.610 -0.580 1.00 0.00 C ATOM 1328 C ASN A 95 -17.276 6.011 0.043 1.00 0.00 C ATOM 1329 O ASN A 95 -18.094 6.327 0.884 1.00 0.00 O ATOM 1330 CB ASN A 95 -16.073 3.790 -0.118 1.00 0.00 C ATOM 1331 CG ASN A 95 -15.902 3.889 1.397 1.00 0.00 C ATOM 1332 OD1 ASN A 95 -16.856 4.101 2.119 1.00 0.00 O ATOM 1333 ND2 ASN A 95 -14.713 3.744 1.908 1.00 0.00 N ATOM 0 H ASN A 95 -16.166 4.534 -2.395 1.00 0.00 H new ATOM 0 HA ASN A 95 -18.217 4.139 -0.288 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -16.204 2.747 -0.407 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -15.171 4.148 -0.615 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -14.580 3.808 2.917 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -13.914 3.566 1.299 1.00 0.00 H new ATOM 1340 N LYS A 96 -16.362 6.854 -0.373 1.00 0.00 N ATOM 1341 CA LYS A 96 -16.285 8.251 0.172 1.00 0.00 C ATOM 1342 C LYS A 96 -15.763 8.237 1.612 1.00 0.00 C ATOM 1343 O LYS A 96 -14.800 8.904 1.937 1.00 0.00 O ATOM 1344 CB LYS A 96 -17.712 8.810 0.117 1.00 0.00 C ATOM 1345 CG LYS A 96 -17.710 10.146 -0.628 1.00 0.00 C ATOM 1346 CD LYS A 96 -19.126 10.458 -1.117 1.00 0.00 C ATOM 1347 CE LYS A 96 -19.588 9.358 -2.076 1.00 0.00 C ATOM 1348 NZ LYS A 96 -20.143 10.090 -3.248 1.00 0.00 N ATOM 0 H LYS A 96 -15.656 6.633 -1.076 1.00 0.00 H new ATOM 0 HA LYS A 96 -15.598 8.867 -0.408 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -18.372 8.103 -0.386 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -18.100 8.945 1.127 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -17.357 10.941 0.029 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -17.023 10.103 -1.473 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -19.808 10.527 -0.270 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -19.144 11.425 -1.620 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -18.759 8.713 -2.368 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -20.341 8.720 -1.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -20.483 9.407 -3.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -20.934 10.691 -2.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -19.401 10.684 -3.670 1.00 0.00 H new ATOM 1362 N HIS A 97 -16.390 7.493 2.479 1.00 0.00 N ATOM 1363 CA HIS A 97 -15.929 7.450 3.898 1.00 0.00 C ATOM 1364 C HIS A 97 -14.414 7.218 3.949 1.00 0.00 C ATOM 1365 O HIS A 97 -13.637 8.150 4.000 1.00 0.00 O ATOM 1366 CB HIS A 97 -16.687 6.281 4.532 1.00 0.00 C ATOM 1367 CG HIS A 97 -18.024 6.760 5.029 1.00 0.00 C ATOM 1368 ND1 HIS A 97 -18.731 6.085 6.013 1.00 0.00 N ATOM 1369 CD2 HIS A 97 -18.795 7.843 4.689 1.00 0.00 C ATOM 1370 CE1 HIS A 97 -19.873 6.763 6.228 1.00 0.00 C ATOM 1371 NE2 HIS A 97 -19.962 7.844 5.448 1.00 0.00 N ATOM 0 H HIS A 97 -17.202 6.912 2.268 1.00 0.00 H new ATOM 0 HA HIS A 97 -16.123 8.383 4.428 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -16.823 5.483 3.802 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -16.109 5.863 5.356 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -18.536 8.582 3.946 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -20.626 6.469 6.944 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -20.722 8.524 5.416 1.00 0.00 H new ATOM 1380 N ILE A 98 -13.998 5.982 3.945 1.00 0.00 N ATOM 1381 CA ILE A 98 -12.540 5.665 3.997 1.00 0.00 C ATOM 1382 C ILE A 98 -11.925 6.247 5.270 1.00 0.00 C ATOM 1383 O ILE A 98 -12.435 7.186 5.847 1.00 0.00 O ATOM 1384 CB ILE A 98 -11.919 6.308 2.754 1.00 0.00 C ATOM 1385 CG1 ILE A 98 -12.531 5.691 1.495 1.00 0.00 C ATOM 1386 CG2 ILE A 98 -10.413 6.053 2.756 1.00 0.00 C ATOM 1387 CD1 ILE A 98 -11.863 6.295 0.258 1.00 0.00 C ATOM 0 H ILE A 98 -14.612 5.168 3.908 1.00 0.00 H new ATOM 0 HA ILE A 98 -12.361 4.590 4.012 1.00 0.00 H new ATOM 0 HB ILE A 98 -12.114 7.380 2.765 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -12.396 4.609 1.504 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -13.605 5.878 1.470 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -9.966 6.509 1.873 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -9.971 6.489 3.652 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -10.226 4.979 2.744 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -12.297 5.857 -0.641 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -12.021 7.373 0.249 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -10.794 6.086 0.283 1.00 0.00 H new ATOM 1399 N LYS A 99 -10.831 5.691 5.710 1.00 0.00 N ATOM 1400 CA LYS A 99 -10.176 6.199 6.944 1.00 0.00 C ATOM 1401 C LYS A 99 -8.665 5.958 6.875 1.00 0.00 C ATOM 1402 O LYS A 99 -8.201 4.958 6.363 1.00 0.00 O ATOM 1403 CB LYS A 99 -10.796 5.396 8.087 1.00 0.00 C ATOM 1404 CG LYS A 99 -12.179 5.961 8.417 1.00 0.00 C ATOM 1405 CD LYS A 99 -13.258 5.042 7.842 1.00 0.00 C ATOM 1406 CE LYS A 99 -14.573 5.814 7.718 1.00 0.00 C ATOM 1407 NZ LYS A 99 -14.980 6.093 9.123 1.00 0.00 N ATOM 0 H LYS A 99 -10.361 4.903 5.265 1.00 0.00 H new ATOM 0 HA LYS A 99 -10.323 7.271 7.077 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -10.878 4.346 7.805 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -10.154 5.440 8.967 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -12.299 6.049 9.497 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -12.282 6.964 8.002 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -12.950 4.668 6.865 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -13.393 4.174 8.487 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -14.439 6.737 7.154 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -15.329 5.228 7.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -15.998 6.305 9.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -14.781 5.261 9.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -14.446 6.909 9.484 1.00 0.00 H new ATOM 1421 N ALA A 100 -7.901 6.876 7.405 1.00 0.00 N ATOM 1422 CA ALA A 100 -6.421 6.721 7.398 1.00 0.00 C ATOM 1423 C ALA A 100 -6.000 5.766 8.521 1.00 0.00 C ATOM 1424 O ALA A 100 -4.857 5.363 8.606 1.00 0.00 O ATOM 1425 CB ALA A 100 -5.867 8.126 7.643 1.00 0.00 C ATOM 0 H ALA A 100 -8.243 7.731 7.844 1.00 0.00 H new ATOM 0 HA ALA A 100 -6.048 6.304 6.462 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -4.778 8.091 7.651 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -6.203 8.793 6.849 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -6.225 8.496 8.604 1.00 0.00 H new ATOM 1431 N GLU A 101 -6.913 5.394 9.380 1.00 0.00 N ATOM 1432 CA GLU A 101 -6.556 4.460 10.484 1.00 0.00 C ATOM 1433 C GLU A 101 -6.423 3.042 9.926 1.00 0.00 C ATOM 1434 O GLU A 101 -5.781 2.191 10.510 1.00 0.00 O ATOM 1435 CB GLU A 101 -7.718 4.546 11.476 1.00 0.00 C ATOM 1436 CG GLU A 101 -7.921 6.002 11.902 1.00 0.00 C ATOM 1437 CD GLU A 101 -6.900 6.381 12.976 1.00 0.00 C ATOM 1438 OE1 GLU A 101 -6.853 5.699 13.987 1.00 0.00 O ATOM 1439 OE2 GLU A 101 -6.183 7.346 12.770 1.00 0.00 O ATOM 0 H GLU A 101 -7.887 5.696 9.364 1.00 0.00 H new ATOM 0 HA GLU A 101 -5.608 4.713 10.960 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -8.629 4.160 11.019 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -7.511 3.926 12.349 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -7.815 6.660 11.039 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -8.932 6.140 12.285 1.00 0.00 H new ATOM 1446 N TYR A 102 -7.025 2.782 8.797 1.00 0.00 N ATOM 1447 CA TYR A 102 -6.934 1.421 8.196 1.00 0.00 C ATOM 1448 C TYR A 102 -5.652 1.304 7.364 1.00 0.00 C ATOM 1449 O TYR A 102 -5.229 0.222 7.007 1.00 0.00 O ATOM 1450 CB TYR A 102 -8.169 1.295 7.303 1.00 0.00 C ATOM 1451 CG TYR A 102 -9.407 1.219 8.163 1.00 0.00 C ATOM 1452 CD1 TYR A 102 -9.925 2.381 8.749 1.00 0.00 C ATOM 1453 CD2 TYR A 102 -10.038 -0.012 8.376 1.00 0.00 C ATOM 1454 CE1 TYR A 102 -11.073 2.311 9.547 1.00 0.00 C ATOM 1455 CE2 TYR A 102 -11.186 -0.082 9.173 1.00 0.00 C ATOM 1456 CZ TYR A 102 -11.704 1.080 9.759 1.00 0.00 C ATOM 1457 OH TYR A 102 -12.836 1.011 10.546 1.00 0.00 O ATOM 0 H TYR A 102 -7.577 3.455 8.264 1.00 0.00 H new ATOM 0 HA TYR A 102 -6.900 0.635 8.950 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -8.233 2.150 6.630 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -8.091 0.404 6.680 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -9.439 3.331 8.585 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -9.639 -0.908 7.925 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -11.472 3.207 9.999 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -11.673 -1.032 9.336 1.00 0.00 H new ATOM 0 HH TYR A 102 -13.537 0.520 10.069 1.00 0.00 H new ATOM 1467 N PHE A 103 -5.033 2.410 7.049 1.00 0.00 N ATOM 1468 CA PHE A 103 -3.783 2.368 6.236 1.00 0.00 C ATOM 1469 C PHE A 103 -2.680 1.624 6.997 1.00 0.00 C ATOM 1470 O PHE A 103 -2.232 0.570 6.591 1.00 0.00 O ATOM 1471 CB PHE A 103 -3.392 3.834 6.033 1.00 0.00 C ATOM 1472 CG PHE A 103 -4.100 4.392 4.821 1.00 0.00 C ATOM 1473 CD1 PHE A 103 -5.464 4.147 4.627 1.00 0.00 C ATOM 1474 CD2 PHE A 103 -3.388 5.160 3.893 1.00 0.00 C ATOM 1475 CE1 PHE A 103 -6.116 4.670 3.502 1.00 0.00 C ATOM 1476 CE2 PHE A 103 -4.039 5.683 2.769 1.00 0.00 C ATOM 1477 CZ PHE A 103 -5.403 5.438 2.574 1.00 0.00 C ATOM 0 H PHE A 103 -5.340 3.344 7.321 1.00 0.00 H new ATOM 0 HA PHE A 103 -3.926 1.847 5.289 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -3.654 4.415 6.917 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -2.313 3.917 5.905 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -6.014 3.555 5.344 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -2.336 5.350 4.044 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -7.168 4.480 3.351 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -3.489 6.275 2.053 1.00 0.00 H new ATOM 0 HZ PHE A 103 -5.906 5.842 1.707 1.00 0.00 H new ATOM 1487 N GLU A 104 -2.235 2.178 8.092 1.00 0.00 N ATOM 1488 CA GLU A 104 -1.150 1.530 8.889 1.00 0.00 C ATOM 1489 C GLU A 104 -1.389 0.022 9.022 1.00 0.00 C ATOM 1490 O GLU A 104 -0.559 -0.770 8.622 1.00 0.00 O ATOM 1491 CB GLU A 104 -1.208 2.206 10.260 1.00 0.00 C ATOM 1492 CG GLU A 104 0.109 2.936 10.528 1.00 0.00 C ATOM 1493 CD GLU A 104 0.300 3.138 12.032 1.00 0.00 C ATOM 1494 OE1 GLU A 104 0.164 2.169 12.761 1.00 0.00 O ATOM 1495 OE2 GLU A 104 0.578 4.257 12.429 1.00 0.00 O ATOM 0 H GLU A 104 -2.579 3.059 8.473 1.00 0.00 H new ATOM 0 HA GLU A 104 -0.176 1.645 8.413 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -2.039 2.910 10.295 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -1.388 1.462 11.036 1.00 0.00 H new ATOM 0 HG2 GLU A 104 0.942 2.362 10.121 1.00 0.00 H new ATOM 0 HG3 GLU A 104 0.109 3.901 10.020 1.00 0.00 H new ATOM 1502 N PRO A 105 -2.511 -0.330 9.590 1.00 0.00 N ATOM 1503 CA PRO A 105 -2.814 -1.775 9.770 1.00 0.00 C ATOM 1504 C PRO A 105 -2.671 -2.511 8.437 1.00 0.00 C ATOM 1505 O PRO A 105 -1.929 -3.465 8.322 1.00 0.00 O ATOM 1506 CB PRO A 105 -4.259 -1.802 10.275 1.00 0.00 C ATOM 1507 CG PRO A 105 -4.770 -0.401 10.184 1.00 0.00 C ATOM 1508 CD PRO A 105 -3.583 0.517 10.118 1.00 0.00 C ATOM 0 HA PRO A 105 -2.136 -2.271 10.465 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -4.867 -2.476 9.672 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -4.304 -2.165 11.302 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -5.397 -0.280 9.300 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -5.389 -0.163 11.049 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -3.774 1.371 9.468 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -3.330 0.915 11.101 1.00 0.00 H new ATOM 1516 N LEU A 106 -3.372 -2.075 7.428 1.00 0.00 N ATOM 1517 CA LEU A 106 -3.267 -2.754 6.107 1.00 0.00 C ATOM 1518 C LEU A 106 -1.812 -2.715 5.631 1.00 0.00 C ATOM 1519 O LEU A 106 -1.397 -3.505 4.806 1.00 0.00 O ATOM 1520 CB LEU A 106 -4.182 -1.954 5.170 1.00 0.00 C ATOM 1521 CG LEU A 106 -4.251 -2.615 3.784 1.00 0.00 C ATOM 1522 CD1 LEU A 106 -2.954 -2.346 3.018 1.00 0.00 C ATOM 1523 CD2 LEU A 106 -4.454 -4.128 3.928 1.00 0.00 C ATOM 0 H LEU A 106 -4.011 -1.281 7.461 1.00 0.00 H new ATOM 0 HA LEU A 106 -3.563 -3.802 6.143 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -5.182 -1.890 5.598 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.810 -0.934 5.074 1.00 0.00 H new ATOM 0 HG LEU A 106 -5.093 -2.193 3.236 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -3.007 -2.816 2.036 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.818 -1.271 2.899 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.111 -2.759 3.573 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.501 -4.584 2.939 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -3.621 -4.555 4.486 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -5.385 -4.321 4.462 1.00 0.00 H new ATOM 1535 N GLY A 107 -1.031 -1.804 6.147 1.00 0.00 N ATOM 1536 CA GLY A 107 0.395 -1.719 5.723 1.00 0.00 C ATOM 1537 C GLY A 107 1.180 -2.876 6.346 1.00 0.00 C ATOM 1538 O GLY A 107 1.926 -3.562 5.676 1.00 0.00 O ATOM 0 H GLY A 107 -1.319 -1.116 6.843 1.00 0.00 H new ATOM 0 HA2 GLY A 107 0.466 -1.760 4.636 1.00 0.00 H new ATOM 0 HA3 GLY A 107 0.822 -0.766 6.034 1.00 0.00 H new ATOM 1542 N ALA A 108 1.020 -3.100 7.622 1.00 0.00 N ATOM 1543 CA ALA A 108 1.762 -4.214 8.279 1.00 0.00 C ATOM 1544 C ALA A 108 1.406 -5.538 7.599 1.00 0.00 C ATOM 1545 O ALA A 108 2.268 -6.275 7.163 1.00 0.00 O ATOM 1546 CB ALA A 108 1.295 -4.209 9.735 1.00 0.00 C ATOM 0 H ALA A 108 0.409 -2.562 8.237 1.00 0.00 H new ATOM 0 HA ALA A 108 2.843 -4.094 8.209 1.00 0.00 H new ATOM 0 HB1 ALA A 108 1.800 -5.005 10.282 1.00 0.00 H new ATOM 0 HB2 ALA A 108 1.533 -3.248 10.190 1.00 0.00 H new ATOM 0 HB3 ALA A 108 0.218 -4.371 9.772 1.00 0.00 H new ATOM 1552 N SER A 109 0.142 -5.846 7.504 1.00 0.00 N ATOM 1553 CA SER A 109 -0.267 -7.121 6.851 1.00 0.00 C ATOM 1554 C SER A 109 0.331 -7.191 5.444 1.00 0.00 C ATOM 1555 O SER A 109 0.533 -8.257 4.898 1.00 0.00 O ATOM 1556 CB SER A 109 -1.793 -7.072 6.791 1.00 0.00 C ATOM 1557 OG SER A 109 -2.328 -7.593 8.000 1.00 0.00 O ATOM 0 H SER A 109 -0.625 -5.270 7.850 1.00 0.00 H new ATOM 0 HA SER A 109 0.081 -8.000 7.394 1.00 0.00 H new ATOM 0 HB2 SER A 109 -2.130 -6.046 6.643 1.00 0.00 H new ATOM 0 HB3 SER A 109 -2.154 -7.651 5.941 1.00 0.00 H new ATOM 0 HG SER A 109 -3.307 -7.561 7.965 1.00 0.00 H new ATOM 1563 N LEU A 110 0.615 -6.063 4.852 1.00 0.00 N ATOM 1564 CA LEU A 110 1.199 -6.069 3.482 1.00 0.00 C ATOM 1565 C LEU A 110 2.583 -6.721 3.515 1.00 0.00 C ATOM 1566 O LEU A 110 2.969 -7.426 2.604 1.00 0.00 O ATOM 1567 CB LEU A 110 1.299 -4.598 3.077 1.00 0.00 C ATOM 1568 CG LEU A 110 1.229 -4.481 1.554 1.00 0.00 C ATOM 1569 CD1 LEU A 110 0.375 -3.270 1.173 1.00 0.00 C ATOM 1570 CD2 LEU A 110 2.641 -4.304 0.992 1.00 0.00 C ATOM 0 H LEU A 110 0.468 -5.139 5.258 1.00 0.00 H new ATOM 0 HA LEU A 110 0.594 -6.635 2.773 1.00 0.00 H new ATOM 0 HB2 LEU A 110 0.489 -4.029 3.533 1.00 0.00 H new ATOM 0 HB3 LEU A 110 2.234 -4.172 3.442 1.00 0.00 H new ATOM 0 HG LEU A 110 0.782 -5.385 1.141 1.00 0.00 H new ATOM 0 HD11 LEU A 110 0.325 -3.187 0.087 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -0.631 -3.394 1.574 1.00 0.00 H new ATOM 0 HD13 LEU A 110 0.821 -2.365 1.586 1.00 0.00 H new ATOM 0 HD21 LEU A 110 2.593 -4.220 -0.094 1.00 0.00 H new ATOM 0 HD22 LEU A 110 3.087 -3.400 1.406 1.00 0.00 H new ATOM 0 HD23 LEU A 110 3.251 -5.166 1.263 1.00 0.00 H new ATOM 1582 N LEU A 111 3.334 -6.493 4.559 1.00 0.00 N ATOM 1583 CA LEU A 111 4.692 -7.104 4.645 1.00 0.00 C ATOM 1584 C LEU A 111 4.564 -8.627 4.720 1.00 0.00 C ATOM 1585 O LEU A 111 5.303 -9.354 4.085 1.00 0.00 O ATOM 1586 CB LEU A 111 5.308 -6.550 5.933 1.00 0.00 C ATOM 1587 CG LEU A 111 6.054 -5.247 5.636 1.00 0.00 C ATOM 1588 CD1 LEU A 111 6.724 -4.740 6.914 1.00 0.00 C ATOM 1589 CD2 LEU A 111 7.125 -5.498 4.573 1.00 0.00 C ATOM 0 H LEU A 111 3.067 -5.912 5.354 1.00 0.00 H new ATOM 0 HA LEU A 111 5.309 -6.871 3.777 1.00 0.00 H new ATOM 0 HB2 LEU A 111 4.527 -6.372 6.672 1.00 0.00 H new ATOM 0 HB3 LEU A 111 5.993 -7.281 6.363 1.00 0.00 H new ATOM 0 HG LEU A 111 5.346 -4.503 5.272 1.00 0.00 H new ATOM 0 HD11 LEU A 111 7.255 -3.812 6.703 1.00 0.00 H new ATOM 0 HD12 LEU A 111 5.965 -4.558 7.675 1.00 0.00 H new ATOM 0 HD13 LEU A 111 7.430 -5.488 7.276 1.00 0.00 H new ATOM 0 HD21 LEU A 111 7.655 -4.569 4.363 1.00 0.00 H new ATOM 0 HD22 LEU A 111 7.831 -6.244 4.937 1.00 0.00 H new ATOM 0 HD23 LEU A 111 6.653 -5.861 3.660 1.00 0.00 H new ATOM 1601 N SER A 112 3.634 -9.116 5.493 1.00 0.00 N ATOM 1602 CA SER A 112 3.461 -10.592 5.611 1.00 0.00 C ATOM 1603 C SER A 112 3.019 -11.170 4.265 1.00 0.00 C ATOM 1604 O SER A 112 3.208 -12.338 3.988 1.00 0.00 O ATOM 1605 CB SER A 112 2.375 -10.786 6.668 1.00 0.00 C ATOM 1606 OG SER A 112 2.217 -12.174 6.930 1.00 0.00 O ATOM 0 H SER A 112 2.986 -8.557 6.048 1.00 0.00 H new ATOM 0 HA SER A 112 4.385 -11.099 5.890 1.00 0.00 H new ATOM 0 HB2 SER A 112 2.645 -10.260 7.584 1.00 0.00 H new ATOM 0 HB3 SER A 112 1.434 -10.360 6.321 1.00 0.00 H new ATOM 0 HG SER A 112 1.522 -12.302 7.609 1.00 0.00 H new ATOM 1612 N ALA A 113 2.430 -10.363 3.425 1.00 0.00 N ATOM 1613 CA ALA A 113 1.975 -10.869 2.099 1.00 0.00 C ATOM 1614 C ALA A 113 3.134 -10.813 1.100 1.00 0.00 C ATOM 1615 O ALA A 113 3.304 -11.692 0.279 1.00 0.00 O ATOM 1616 CB ALA A 113 0.849 -9.926 1.673 1.00 0.00 C ATOM 0 H ALA A 113 2.244 -9.375 3.600 1.00 0.00 H new ATOM 0 HA ALA A 113 1.635 -11.904 2.142 1.00 0.00 H new ATOM 0 HB1 ALA A 113 0.462 -10.236 0.702 1.00 0.00 H new ATOM 0 HB2 ALA A 113 0.047 -9.960 2.411 1.00 0.00 H new ATOM 0 HB3 ALA A 113 1.234 -8.909 1.602 1.00 0.00 H new ATOM 1622 N MET A 114 3.932 -9.782 1.163 1.00 0.00 N ATOM 1623 CA MET A 114 5.078 -9.665 0.217 1.00 0.00 C ATOM 1624 C MET A 114 5.924 -10.939 0.267 1.00 0.00 C ATOM 1625 O MET A 114 6.320 -11.471 -0.751 1.00 0.00 O ATOM 1626 CB MET A 114 5.882 -8.461 0.706 1.00 0.00 C ATOM 1627 CG MET A 114 5.341 -7.188 0.052 1.00 0.00 C ATOM 1628 SD MET A 114 5.308 -5.850 1.272 1.00 0.00 S ATOM 1629 CE MET A 114 5.721 -4.500 0.140 1.00 0.00 C ATOM 0 H MET A 114 3.840 -9.015 1.829 1.00 0.00 H new ATOM 0 HA MET A 114 4.754 -9.536 -0.816 1.00 0.00 H new ATOM 0 HB2 MET A 114 5.815 -8.382 1.791 1.00 0.00 H new ATOM 0 HB3 MET A 114 6.936 -8.590 0.460 1.00 0.00 H new ATOM 0 HG2 MET A 114 5.967 -6.907 -0.795 1.00 0.00 H new ATOM 0 HG3 MET A 114 4.338 -7.364 -0.338 1.00 0.00 H new ATOM 0 HE1 MET A 114 6.230 -3.708 0.689 1.00 0.00 H new ATOM 0 HE2 MET A 114 6.375 -4.873 -0.648 1.00 0.00 H new ATOM 0 HE3 MET A 114 4.807 -4.104 -0.303 1.00 0.00 H new ATOM 1639 N GLU A 115 6.205 -11.433 1.443 1.00 0.00 N ATOM 1640 CA GLU A 115 7.026 -12.673 1.558 1.00 0.00 C ATOM 1641 C GLU A 115 6.494 -13.736 0.589 1.00 0.00 C ATOM 1642 O GLU A 115 7.223 -14.587 0.121 1.00 0.00 O ATOM 1643 CB GLU A 115 6.855 -13.133 3.008 1.00 0.00 C ATOM 1644 CG GLU A 115 7.909 -12.460 3.888 1.00 0.00 C ATOM 1645 CD GLU A 115 8.107 -13.262 5.175 1.00 0.00 C ATOM 1646 OE1 GLU A 115 8.002 -14.476 5.116 1.00 0.00 O ATOM 1647 OE2 GLU A 115 8.360 -12.648 6.199 1.00 0.00 O ATOM 0 H GLU A 115 5.901 -11.031 2.330 1.00 0.00 H new ATOM 0 HA GLU A 115 8.074 -12.504 1.311 1.00 0.00 H new ATOM 0 HB2 GLU A 115 5.856 -12.882 3.364 1.00 0.00 H new ATOM 0 HB3 GLU A 115 6.953 -14.217 3.070 1.00 0.00 H new ATOM 0 HG2 GLU A 115 8.853 -12.386 3.347 1.00 0.00 H new ATOM 0 HG3 GLU A 115 7.599 -11.443 4.128 1.00 0.00 H new ATOM 1654 N HIS A 116 5.226 -13.694 0.286 1.00 0.00 N ATOM 1655 CA HIS A 116 4.650 -14.702 -0.649 1.00 0.00 C ATOM 1656 C HIS A 116 5.389 -14.649 -1.989 1.00 0.00 C ATOM 1657 O HIS A 116 5.458 -15.625 -2.709 1.00 0.00 O ATOM 1658 CB HIS A 116 3.184 -14.299 -0.820 1.00 0.00 C ATOM 1659 CG HIS A 116 2.479 -14.397 0.505 1.00 0.00 C ATOM 1660 ND1 HIS A 116 1.103 -14.529 0.602 1.00 0.00 N ATOM 1661 CD2 HIS A 116 2.947 -14.383 1.796 1.00 0.00 C ATOM 1662 CE1 HIS A 116 0.793 -14.590 1.910 1.00 0.00 C ATOM 1663 NE2 HIS A 116 1.880 -14.506 2.681 1.00 0.00 N ATOM 0 H HIS A 116 4.564 -13.006 0.645 1.00 0.00 H new ATOM 0 HA HIS A 116 4.743 -15.721 -0.273 1.00 0.00 H new ATOM 0 HB2 HIS A 116 3.118 -13.281 -1.205 1.00 0.00 H new ATOM 0 HB3 HIS A 116 2.700 -14.948 -1.550 1.00 0.00 H new ATOM 0 HD2 HIS A 116 3.985 -14.291 2.081 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -0.213 -14.694 2.290 1.00 0.00 H new ATOM 0 HE2 HIS A 116 1.920 -14.527 3.700 1.00 0.00 H new ATOM 1671 N ARG A 117 5.939 -13.516 -2.330 1.00 0.00 N ATOM 1672 CA ARG A 117 6.671 -13.401 -3.625 1.00 0.00 C ATOM 1673 C ARG A 117 8.147 -13.750 -3.421 1.00 0.00 C ATOM 1674 O ARG A 117 8.642 -14.730 -3.942 1.00 0.00 O ATOM 1675 CB ARG A 117 6.512 -11.939 -4.047 1.00 0.00 C ATOM 1676 CG ARG A 117 6.548 -11.839 -5.573 1.00 0.00 C ATOM 1677 CD ARG A 117 7.944 -12.212 -6.077 1.00 0.00 C ATOM 1678 NE ARG A 117 8.087 -11.531 -7.393 1.00 0.00 N ATOM 1679 CZ ARG A 117 8.622 -12.164 -8.401 1.00 0.00 C ATOM 1680 NH1 ARG A 117 9.500 -13.106 -8.188 1.00 0.00 N ATOM 1681 NH2 ARG A 117 8.279 -11.857 -9.621 1.00 0.00 N ATOM 0 H ARG A 117 5.914 -12.665 -1.769 1.00 0.00 H new ATOM 0 HA ARG A 117 6.284 -14.081 -4.384 1.00 0.00 H new ATOM 0 HB2 ARG A 117 5.571 -11.541 -3.668 1.00 0.00 H new ATOM 0 HB3 ARG A 117 7.310 -11.336 -3.614 1.00 0.00 H new ATOM 0 HG2 ARG A 117 5.803 -12.504 -6.009 1.00 0.00 H new ATOM 0 HG3 ARG A 117 6.295 -10.827 -5.888 1.00 0.00 H new ATOM 0 HD2 ARG A 117 8.714 -11.883 -5.379 1.00 0.00 H new ATOM 0 HD3 ARG A 117 8.048 -13.292 -6.181 1.00 0.00 H new ATOM 0 HE ARG A 117 7.767 -10.569 -7.507 1.00 0.00 H new ATOM 0 HH11 ARG A 117 9.768 -13.347 -7.234 1.00 0.00 H new ATOM 0 HH12 ARG A 117 9.918 -13.601 -8.976 1.00 0.00 H new ATOM 0 HH21 ARG A 117 7.592 -11.122 -9.788 1.00 0.00 H new ATOM 0 HH22 ARG A 117 8.698 -12.352 -10.408 1.00 0.00 H new ATOM 1695 N ILE A 118 8.856 -12.954 -2.667 1.00 0.00 N ATOM 1696 CA ILE A 118 10.301 -13.243 -2.432 1.00 0.00 C ATOM 1697 C ILE A 118 10.446 -14.183 -1.228 1.00 0.00 C ATOM 1698 O ILE A 118 11.275 -15.070 -1.222 1.00 0.00 O ATOM 1699 CB ILE A 118 10.958 -11.878 -2.175 1.00 0.00 C ATOM 1700 CG1 ILE A 118 10.300 -11.183 -0.978 1.00 0.00 C ATOM 1701 CG2 ILE A 118 10.797 -10.998 -3.415 1.00 0.00 C ATOM 1702 CD1 ILE A 118 11.143 -9.974 -0.566 1.00 0.00 C ATOM 0 H ILE A 118 8.499 -12.118 -2.204 1.00 0.00 H new ATOM 0 HA ILE A 118 10.776 -13.742 -3.277 1.00 0.00 H new ATOM 0 HB ILE A 118 12.015 -12.033 -1.958 1.00 0.00 H new ATOM 0 HG12 ILE A 118 9.290 -10.865 -1.238 1.00 0.00 H new ATOM 0 HG13 ILE A 118 10.210 -11.879 -0.144 1.00 0.00 H new ATOM 0 HG21 ILE A 118 11.262 -10.029 -3.236 1.00 0.00 H new ATOM 0 HG22 ILE A 118 11.277 -11.479 -4.267 1.00 0.00 H new ATOM 0 HG23 ILE A 118 9.737 -10.858 -3.627 1.00 0.00 H new ATOM 0 HD11 ILE A 118 10.677 -9.478 0.285 1.00 0.00 H new ATOM 0 HD12 ILE A 118 12.144 -10.306 -0.289 1.00 0.00 H new ATOM 0 HD13 ILE A 118 11.210 -9.276 -1.400 1.00 0.00 H new ATOM 1714 N GLY A 119 9.628 -14.003 -0.223 1.00 0.00 N ATOM 1715 CA GLY A 119 9.679 -14.885 0.986 1.00 0.00 C ATOM 1716 C GLY A 119 11.127 -15.187 1.386 1.00 0.00 C ATOM 1717 O GLY A 119 11.743 -14.449 2.130 1.00 0.00 O ATOM 0 H GLY A 119 8.917 -13.273 -0.187 1.00 0.00 H new ATOM 0 HA2 GLY A 119 9.162 -14.401 1.815 1.00 0.00 H new ATOM 0 HA3 GLY A 119 9.152 -15.817 0.783 1.00 0.00 H new ATOM 1721 N GLY A 120 11.662 -16.283 0.911 1.00 0.00 N ATOM 1722 CA GLY A 120 13.061 -16.671 1.265 1.00 0.00 C ATOM 1723 C GLY A 120 13.981 -15.449 1.213 1.00 0.00 C ATOM 1724 O GLY A 120 14.833 -15.269 2.061 1.00 0.00 O ATOM 0 H GLY A 120 11.184 -16.932 0.286 1.00 0.00 H new ATOM 0 HA2 GLY A 120 13.083 -17.109 2.263 1.00 0.00 H new ATOM 0 HA3 GLY A 120 13.420 -17.434 0.574 1.00 0.00 H new ATOM 1728 N LYS A 121 13.823 -14.611 0.229 1.00 0.00 N ATOM 1729 CA LYS A 121 14.696 -13.409 0.133 1.00 0.00 C ATOM 1730 C LYS A 121 14.245 -12.359 1.153 1.00 0.00 C ATOM 1731 O LYS A 121 15.033 -11.565 1.627 1.00 0.00 O ATOM 1732 CB LYS A 121 14.518 -12.899 -1.296 1.00 0.00 C ATOM 1733 CG LYS A 121 15.502 -13.619 -2.220 1.00 0.00 C ATOM 1734 CD LYS A 121 16.926 -13.159 -1.906 1.00 0.00 C ATOM 1735 CE LYS A 121 17.894 -13.754 -2.932 1.00 0.00 C ATOM 1736 NZ LYS A 121 19.227 -13.699 -2.269 1.00 0.00 N ATOM 0 H LYS A 121 13.129 -14.705 -0.512 1.00 0.00 H new ATOM 0 HA LYS A 121 15.741 -13.631 0.348 1.00 0.00 H new ATOM 0 HB2 LYS A 121 13.495 -13.072 -1.631 1.00 0.00 H new ATOM 0 HB3 LYS A 121 14.688 -11.823 -1.333 1.00 0.00 H new ATOM 0 HG2 LYS A 121 15.419 -14.698 -2.087 1.00 0.00 H new ATOM 0 HG3 LYS A 121 15.261 -13.407 -3.262 1.00 0.00 H new ATOM 0 HD2 LYS A 121 16.981 -12.071 -1.927 1.00 0.00 H new ATOM 0 HD3 LYS A 121 17.207 -13.473 -0.901 1.00 0.00 H new ATOM 0 HE2 LYS A 121 17.621 -14.778 -3.187 1.00 0.00 H new ATOM 0 HE3 LYS A 121 17.889 -13.182 -3.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 19.949 -14.090 -2.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 19.462 -12.711 -2.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 19.202 -14.258 -1.392 1.00 0.00 H new ATOM 1750 N MET A 122 12.985 -12.350 1.499 1.00 0.00 N ATOM 1751 CA MET A 122 12.499 -11.351 2.493 1.00 0.00 C ATOM 1752 C MET A 122 13.264 -11.530 3.806 1.00 0.00 C ATOM 1753 O MET A 122 12.991 -12.428 4.578 1.00 0.00 O ATOM 1754 CB MET A 122 11.011 -11.647 2.685 1.00 0.00 C ATOM 1755 CG MET A 122 10.384 -10.556 3.557 1.00 0.00 C ATOM 1756 SD MET A 122 9.041 -9.749 2.648 1.00 0.00 S ATOM 1757 CE MET A 122 9.131 -8.141 3.479 1.00 0.00 C ATOM 0 H MET A 122 12.275 -12.988 1.138 1.00 0.00 H new ATOM 0 HA MET A 122 12.653 -10.324 2.161 1.00 0.00 H new ATOM 0 HB2 MET A 122 10.509 -11.688 1.718 1.00 0.00 H new ATOM 0 HB3 MET A 122 10.880 -12.622 3.154 1.00 0.00 H new ATOM 0 HG2 MET A 122 10.002 -10.990 4.481 1.00 0.00 H new ATOM 0 HG3 MET A 122 11.139 -9.822 3.838 1.00 0.00 H new ATOM 0 HE1 MET A 122 8.436 -7.447 3.006 1.00 0.00 H new ATOM 0 HE2 MET A 122 8.867 -8.259 4.530 1.00 0.00 H new ATOM 0 HE3 MET A 122 10.145 -7.748 3.402 1.00 0.00 H new ATOM 1767 N ASN A 123 14.223 -10.684 4.064 1.00 0.00 N ATOM 1768 CA ASN A 123 15.008 -10.810 5.327 1.00 0.00 C ATOM 1769 C ASN A 123 14.469 -9.831 6.371 1.00 0.00 C ATOM 1770 O ASN A 123 13.517 -9.115 6.134 1.00 0.00 O ATOM 1771 CB ASN A 123 16.452 -10.465 4.949 1.00 0.00 C ATOM 1772 CG ASN A 123 16.501 -9.121 4.219 1.00 0.00 C ATOM 1773 OD1 ASN A 123 16.027 -9.003 3.106 1.00 0.00 O ATOM 1774 ND2 ASN A 123 17.061 -8.096 4.801 1.00 0.00 N ATOM 0 H ASN A 123 14.498 -9.912 3.457 1.00 0.00 H new ATOM 0 HA ASN A 123 14.941 -11.809 5.759 1.00 0.00 H new ATOM 0 HB2 ASN A 123 17.070 -10.423 5.846 1.00 0.00 H new ATOM 0 HB3 ASN A 123 16.866 -11.248 4.313 1.00 0.00 H new ATOM 0 HD21 ASN A 123 17.101 -7.196 4.322 1.00 0.00 H new ATOM 0 HD22 ASN A 123 17.459 -8.194 5.735 1.00 0.00 H new ATOM 1781 N ALA A 124 15.066 -9.796 7.531 1.00 0.00 N ATOM 1782 CA ALA A 124 14.580 -8.864 8.589 1.00 0.00 C ATOM 1783 C ALA A 124 14.716 -7.418 8.107 1.00 0.00 C ATOM 1784 O ALA A 124 13.829 -6.608 8.288 1.00 0.00 O ATOM 1785 CB ALA A 124 15.480 -9.120 9.799 1.00 0.00 C ATOM 0 H ALA A 124 15.867 -10.371 7.792 1.00 0.00 H new ATOM 0 HA ALA A 124 13.530 -9.024 8.833 1.00 0.00 H new ATOM 0 HB1 ALA A 124 15.181 -8.468 10.619 1.00 0.00 H new ATOM 0 HB2 ALA A 124 15.385 -10.161 10.109 1.00 0.00 H new ATOM 0 HB3 ALA A 124 16.516 -8.914 9.532 1.00 0.00 H new ATOM 1791 N ALA A 125 15.817 -7.085 7.493 1.00 0.00 N ATOM 1792 CA ALA A 125 15.997 -5.690 7.005 1.00 0.00 C ATOM 1793 C ALA A 125 14.970 -5.401 5.911 1.00 0.00 C ATOM 1794 O ALA A 125 14.613 -4.266 5.665 1.00 0.00 O ATOM 1795 CB ALA A 125 17.418 -5.633 6.447 1.00 0.00 C ATOM 0 H ALA A 125 16.597 -7.716 7.309 1.00 0.00 H new ATOM 0 HA ALA A 125 15.854 -4.949 7.791 1.00 0.00 H new ATOM 0 HB1 ALA A 125 17.620 -4.631 6.069 1.00 0.00 H new ATOM 0 HB2 ALA A 125 18.129 -5.873 7.237 1.00 0.00 H new ATOM 0 HB3 ALA A 125 17.520 -6.354 5.636 1.00 0.00 H new ATOM 1801 N ALA A 126 14.491 -6.421 5.252 1.00 0.00 N ATOM 1802 CA ALA A 126 13.484 -6.204 4.177 1.00 0.00 C ATOM 1803 C ALA A 126 12.141 -5.828 4.806 1.00 0.00 C ATOM 1804 O ALA A 126 11.506 -4.871 4.409 1.00 0.00 O ATOM 1805 CB ALA A 126 13.382 -7.540 3.442 1.00 0.00 C ATOM 0 H ALA A 126 14.754 -7.394 5.412 1.00 0.00 H new ATOM 0 HA ALA A 126 13.763 -5.398 3.498 1.00 0.00 H new ATOM 0 HB1 ALA A 126 12.656 -7.456 2.633 1.00 0.00 H new ATOM 0 HB2 ALA A 126 14.356 -7.803 3.029 1.00 0.00 H new ATOM 0 HB3 ALA A 126 13.061 -8.315 4.138 1.00 0.00 H new ATOM 1811 N LYS A 127 11.703 -6.573 5.786 1.00 0.00 N ATOM 1812 CA LYS A 127 10.402 -6.253 6.435 1.00 0.00 C ATOM 1813 C LYS A 127 10.557 -5.009 7.315 1.00 0.00 C ATOM 1814 O LYS A 127 9.624 -4.254 7.506 1.00 0.00 O ATOM 1815 CB LYS A 127 10.055 -7.481 7.280 1.00 0.00 C ATOM 1816 CG LYS A 127 11.171 -7.743 8.293 1.00 0.00 C ATOM 1817 CD LYS A 127 10.651 -8.667 9.395 1.00 0.00 C ATOM 1818 CE LYS A 127 10.935 -10.123 9.018 1.00 0.00 C ATOM 1819 NZ LYS A 127 10.753 -10.883 10.286 1.00 0.00 N ATOM 0 H LYS A 127 12.189 -7.386 6.163 1.00 0.00 H new ATOM 0 HA LYS A 127 9.617 -6.038 5.710 1.00 0.00 H new ATOM 0 HB2 LYS A 127 9.110 -7.322 7.799 1.00 0.00 H new ATOM 0 HB3 LYS A 127 9.923 -8.351 6.637 1.00 0.00 H new ATOM 0 HG2 LYS A 127 12.028 -8.198 7.797 1.00 0.00 H new ATOM 0 HG3 LYS A 127 11.514 -6.802 8.724 1.00 0.00 H new ATOM 0 HD2 LYS A 127 11.131 -8.426 10.343 1.00 0.00 H new ATOM 0 HD3 LYS A 127 9.580 -8.518 9.533 1.00 0.00 H new ATOM 0 HE2 LYS A 127 10.251 -10.473 8.245 1.00 0.00 H new ATOM 0 HE3 LYS A 127 11.945 -10.241 8.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 10.930 -11.893 10.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 11.422 -10.531 11.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 9.780 -10.756 10.630 1.00 0.00 H new ATOM 1833 N ASP A 128 11.728 -4.787 7.851 1.00 0.00 N ATOM 1834 CA ASP A 128 11.936 -3.591 8.715 1.00 0.00 C ATOM 1835 C ASP A 128 12.025 -2.344 7.837 1.00 0.00 C ATOM 1836 O ASP A 128 11.521 -1.292 8.179 1.00 0.00 O ATOM 1837 CB ASP A 128 13.257 -3.839 9.447 1.00 0.00 C ATOM 1838 CG ASP A 128 13.673 -2.585 10.218 1.00 0.00 C ATOM 1839 OD1 ASP A 128 12.792 -1.864 10.659 1.00 0.00 O ATOM 1840 OD2 ASP A 128 14.865 -2.366 10.356 1.00 0.00 O ATOM 0 H ASP A 128 12.547 -5.382 7.727 1.00 0.00 H new ATOM 0 HA ASP A 128 11.120 -3.436 9.421 1.00 0.00 H new ATOM 0 HB2 ASP A 128 13.149 -4.679 10.134 1.00 0.00 H new ATOM 0 HB3 ASP A 128 14.033 -4.110 8.731 1.00 0.00 H new ATOM 1845 N ALA A 129 12.655 -2.457 6.703 1.00 0.00 N ATOM 1846 CA ALA A 129 12.770 -1.283 5.795 1.00 0.00 C ATOM 1847 C ALA A 129 11.382 -0.919 5.270 1.00 0.00 C ATOM 1848 O ALA A 129 11.006 0.236 5.224 1.00 0.00 O ATOM 1849 CB ALA A 129 13.680 -1.740 4.653 1.00 0.00 C ATOM 0 H ALA A 129 13.096 -3.312 6.365 1.00 0.00 H new ATOM 0 HA ALA A 129 13.175 -0.402 6.293 1.00 0.00 H new ATOM 0 HB1 ALA A 129 13.810 -0.924 3.943 1.00 0.00 H new ATOM 0 HB2 ALA A 129 14.651 -2.030 5.055 1.00 0.00 H new ATOM 0 HB3 ALA A 129 13.228 -2.593 4.147 1.00 0.00 H new ATOM 1855 N TRP A 130 10.613 -1.899 4.879 1.00 0.00 N ATOM 1856 CA TRP A 130 9.247 -1.610 4.365 1.00 0.00 C ATOM 1857 C TRP A 130 8.341 -1.228 5.534 1.00 0.00 C ATOM 1858 O TRP A 130 7.455 -0.411 5.397 1.00 0.00 O ATOM 1859 CB TRP A 130 8.786 -2.908 3.688 1.00 0.00 C ATOM 1860 CG TRP A 130 9.246 -2.928 2.255 1.00 0.00 C ATOM 1861 CD1 TRP A 130 9.989 -1.964 1.653 1.00 0.00 C ATOM 1862 CD2 TRP A 130 9.006 -3.944 1.236 1.00 0.00 C ATOM 1863 NE1 TRP A 130 10.211 -2.323 0.338 1.00 0.00 N ATOM 1864 CE2 TRP A 130 9.627 -3.532 0.033 1.00 0.00 C ATOM 1865 CE3 TRP A 130 8.317 -5.171 1.235 1.00 0.00 C ATOM 1866 CZ2 TRP A 130 9.565 -4.304 -1.124 1.00 0.00 C ATOM 1867 CZ3 TRP A 130 8.255 -5.951 0.070 1.00 0.00 C ATOM 1868 CH2 TRP A 130 8.878 -5.517 -1.108 1.00 0.00 C ATOM 0 H TRP A 130 10.873 -2.885 4.894 1.00 0.00 H new ATOM 0 HA TRP A 130 9.221 -0.779 3.660 1.00 0.00 H new ATOM 0 HB2 TRP A 130 9.189 -3.769 4.221 1.00 0.00 H new ATOM 0 HB3 TRP A 130 7.700 -2.986 3.732 1.00 0.00 H new ATOM 0 HD1 TRP A 130 10.348 -1.062 2.126 1.00 0.00 H new ATOM 0 HE1 TRP A 130 10.743 -1.761 -0.326 1.00 0.00 H new ATOM 0 HE3 TRP A 130 7.833 -5.515 2.137 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 10.047 -3.965 -2.029 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 7.724 -6.891 0.081 1.00 0.00 H new ATOM 0 HH2 TRP A 130 8.826 -6.121 -2.002 1.00 0.00 H new ATOM 1879 N ALA A 131 8.570 -1.793 6.690 1.00 0.00 N ATOM 1880 CA ALA A 131 7.728 -1.442 7.871 1.00 0.00 C ATOM 1881 C ALA A 131 7.605 0.082 7.974 1.00 0.00 C ATOM 1882 O ALA A 131 6.633 0.605 8.482 1.00 0.00 O ATOM 1883 CB ALA A 131 8.472 -2.009 9.081 1.00 0.00 C ATOM 0 H ALA A 131 9.302 -2.481 6.867 1.00 0.00 H new ATOM 0 HA ALA A 131 6.718 -1.846 7.801 1.00 0.00 H new ATOM 0 HB1 ALA A 131 7.911 -1.789 9.989 1.00 0.00 H new ATOM 0 HB2 ALA A 131 8.576 -3.088 8.971 1.00 0.00 H new ATOM 0 HB3 ALA A 131 9.460 -1.554 9.146 1.00 0.00 H new ATOM 1889 N ALA A 132 8.584 0.795 7.486 1.00 0.00 N ATOM 1890 CA ALA A 132 8.528 2.282 7.542 1.00 0.00 C ATOM 1891 C ALA A 132 8.297 2.843 6.134 1.00 0.00 C ATOM 1892 O ALA A 132 7.962 3.999 5.964 1.00 0.00 O ATOM 1893 CB ALA A 132 9.894 2.710 8.078 1.00 0.00 C ATOM 0 H ALA A 132 9.422 0.410 7.050 1.00 0.00 H new ATOM 0 HA ALA A 132 7.717 2.648 8.171 1.00 0.00 H new ATOM 0 HB1 ALA A 132 9.933 3.797 8.149 1.00 0.00 H new ATOM 0 HB2 ALA A 132 10.049 2.276 9.066 1.00 0.00 H new ATOM 0 HB3 ALA A 132 10.675 2.362 7.402 1.00 0.00 H new ATOM 1899 N ALA A 133 8.481 2.036 5.122 1.00 0.00 N ATOM 1900 CA ALA A 133 8.280 2.526 3.729 1.00 0.00 C ATOM 1901 C ALA A 133 6.786 2.693 3.439 1.00 0.00 C ATOM 1902 O ALA A 133 6.297 3.796 3.295 1.00 0.00 O ATOM 1903 CB ALA A 133 8.895 1.451 2.832 1.00 0.00 C ATOM 0 H ALA A 133 8.762 1.059 5.201 1.00 0.00 H new ATOM 0 HA ALA A 133 8.743 3.499 3.562 1.00 0.00 H new ATOM 0 HB1 ALA A 133 8.785 1.742 1.787 1.00 0.00 H new ATOM 0 HB2 ALA A 133 9.953 1.341 3.069 1.00 0.00 H new ATOM 0 HB3 ALA A 133 8.386 0.502 3.000 1.00 0.00 H new ATOM 1909 N TYR A 134 6.049 1.616 3.351 1.00 0.00 N ATOM 1910 CA TYR A 134 4.592 1.751 3.069 1.00 0.00 C ATOM 1911 C TYR A 134 3.948 2.609 4.159 1.00 0.00 C ATOM 1912 O TYR A 134 2.886 3.170 3.976 1.00 0.00 O ATOM 1913 CB TYR A 134 4.027 0.326 3.070 1.00 0.00 C ATOM 1914 CG TYR A 134 4.167 -0.289 4.442 1.00 0.00 C ATOM 1915 CD1 TYR A 134 3.346 0.141 5.491 1.00 0.00 C ATOM 1916 CD2 TYR A 134 5.115 -1.293 4.664 1.00 0.00 C ATOM 1917 CE1 TYR A 134 3.473 -0.431 6.762 1.00 0.00 C ATOM 1918 CE2 TYR A 134 5.242 -1.865 5.935 1.00 0.00 C ATOM 1919 CZ TYR A 134 4.422 -1.434 6.984 1.00 0.00 C ATOM 1920 OH TYR A 134 4.549 -2.000 8.236 1.00 0.00 O ATOM 0 H TYR A 134 6.389 0.661 3.461 1.00 0.00 H new ATOM 0 HA TYR A 134 4.393 2.237 2.114 1.00 0.00 H new ATOM 0 HB2 TYR A 134 2.977 0.343 2.776 1.00 0.00 H new ATOM 0 HB3 TYR A 134 4.554 -0.283 2.335 1.00 0.00 H new ATOM 0 HD1 TYR A 134 2.613 0.916 5.319 1.00 0.00 H new ATOM 0 HD2 TYR A 134 5.748 -1.627 3.855 1.00 0.00 H new ATOM 0 HE1 TYR A 134 2.839 -0.098 7.570 1.00 0.00 H new ATOM 0 HE2 TYR A 134 5.974 -2.640 6.107 1.00 0.00 H new ATOM 0 HH TYR A 134 3.682 -1.981 8.693 1.00 0.00 H new ATOM 1930 N ALA A 135 4.590 2.726 5.291 1.00 0.00 N ATOM 1931 CA ALA A 135 4.022 3.560 6.385 1.00 0.00 C ATOM 1932 C ALA A 135 4.184 5.035 6.018 1.00 0.00 C ATOM 1933 O ALA A 135 3.298 5.840 6.226 1.00 0.00 O ATOM 1934 CB ALA A 135 4.843 3.214 7.628 1.00 0.00 C ATOM 0 H ALA A 135 5.482 2.280 5.503 1.00 0.00 H new ATOM 0 HA ALA A 135 2.961 3.375 6.553 1.00 0.00 H new ATOM 0 HB1 ALA A 135 4.480 3.793 8.477 1.00 0.00 H new ATOM 0 HB2 ALA A 135 4.744 2.150 7.845 1.00 0.00 H new ATOM 0 HB3 ALA A 135 5.892 3.452 7.449 1.00 0.00 H new ATOM 1940 N ASP A 136 5.311 5.393 5.463 1.00 0.00 N ATOM 1941 CA ASP A 136 5.530 6.813 5.071 1.00 0.00 C ATOM 1942 C ASP A 136 4.758 7.100 3.782 1.00 0.00 C ATOM 1943 O ASP A 136 4.309 8.204 3.546 1.00 0.00 O ATOM 1944 CB ASP A 136 7.038 6.942 4.844 1.00 0.00 C ATOM 1945 CG ASP A 136 7.560 8.220 5.504 1.00 0.00 C ATOM 1946 OD1 ASP A 136 6.936 8.672 6.449 1.00 0.00 O ATOM 1947 OD2 ASP A 136 8.575 8.723 5.053 1.00 0.00 O ATOM 0 H ASP A 136 6.088 4.763 5.265 1.00 0.00 H new ATOM 0 HA ASP A 136 5.184 7.520 5.825 1.00 0.00 H new ATOM 0 HB2 ASP A 136 7.552 6.074 5.257 1.00 0.00 H new ATOM 0 HB3 ASP A 136 7.253 6.961 3.776 1.00 0.00 H new ATOM 1952 N ILE A 137 4.597 6.108 2.949 1.00 0.00 N ATOM 1953 CA ILE A 137 3.849 6.312 1.678 1.00 0.00 C ATOM 1954 C ILE A 137 2.374 6.559 1.998 1.00 0.00 C ATOM 1955 O ILE A 137 1.818 7.589 1.673 1.00 0.00 O ATOM 1956 CB ILE A 137 4.026 5.007 0.898 1.00 0.00 C ATOM 1957 CG1 ILE A 137 5.486 4.873 0.460 1.00 0.00 C ATOM 1958 CG2 ILE A 137 3.121 5.014 -0.339 1.00 0.00 C ATOM 1959 CD1 ILE A 137 5.796 3.407 0.153 1.00 0.00 C ATOM 0 H ILE A 137 4.953 5.163 3.095 1.00 0.00 H new ATOM 0 HA ILE A 137 4.207 7.168 1.106 1.00 0.00 H new ATOM 0 HB ILE A 137 3.755 4.166 1.536 1.00 0.00 H new ATOM 0 HG12 ILE A 137 5.670 5.487 -0.422 1.00 0.00 H new ATOM 0 HG13 ILE A 137 6.147 5.238 1.246 1.00 0.00 H new ATOM 0 HG21 ILE A 137 3.251 4.083 -0.890 1.00 0.00 H new ATOM 0 HG22 ILE A 137 2.081 5.109 -0.028 1.00 0.00 H new ATOM 0 HG23 ILE A 137 3.387 5.855 -0.979 1.00 0.00 H new ATOM 0 HD11 ILE A 137 6.836 3.313 -0.159 1.00 0.00 H new ATOM 0 HD12 ILE A 137 5.629 2.805 1.046 1.00 0.00 H new ATOM 0 HD13 ILE A 137 5.144 3.057 -0.647 1.00 0.00 H new ATOM 1971 N SER A 138 1.737 5.616 2.635 1.00 0.00 N ATOM 1972 CA SER A 138 0.298 5.785 2.979 1.00 0.00 C ATOM 1973 C SER A 138 0.114 7.049 3.828 1.00 0.00 C ATOM 1974 O SER A 138 -0.974 7.576 3.945 1.00 0.00 O ATOM 1975 CB SER A 138 -0.073 4.522 3.766 1.00 0.00 C ATOM 1976 OG SER A 138 -0.198 4.834 5.149 1.00 0.00 O ATOM 0 H SER A 138 2.152 4.733 2.933 1.00 0.00 H new ATOM 0 HA SER A 138 -0.337 5.904 2.101 1.00 0.00 H new ATOM 0 HB2 SER A 138 -1.010 4.111 3.391 1.00 0.00 H new ATOM 0 HB3 SER A 138 0.690 3.757 3.624 1.00 0.00 H new ATOM 0 HG SER A 138 -0.118 4.013 5.678 1.00 0.00 H new ATOM 1982 N GLY A 139 1.170 7.537 4.420 1.00 0.00 N ATOM 1983 CA GLY A 139 1.053 8.764 5.260 1.00 0.00 C ATOM 1984 C GLY A 139 0.778 9.969 4.358 1.00 0.00 C ATOM 1985 O GLY A 139 -0.154 10.718 4.575 1.00 0.00 O ATOM 0 H GLY A 139 2.108 7.140 4.359 1.00 0.00 H new ATOM 0 HA2 GLY A 139 0.248 8.647 5.985 1.00 0.00 H new ATOM 0 HA3 GLY A 139 1.971 8.921 5.826 1.00 0.00 H new ATOM 1989 N ALA A 140 1.583 10.164 3.350 1.00 0.00 N ATOM 1990 CA ALA A 140 1.368 11.323 2.437 1.00 0.00 C ATOM 1991 C ALA A 140 -0.070 11.308 1.912 1.00 0.00 C ATOM 1992 O ALA A 140 -0.621 12.330 1.554 1.00 0.00 O ATOM 1993 CB ALA A 140 2.364 11.124 1.293 1.00 0.00 C ATOM 0 H ALA A 140 2.380 9.571 3.119 1.00 0.00 H new ATOM 0 HA ALA A 140 1.518 12.280 2.936 1.00 0.00 H new ATOM 0 HB1 ALA A 140 2.265 11.941 0.578 1.00 0.00 H new ATOM 0 HB2 ALA A 140 3.378 11.112 1.692 1.00 0.00 H new ATOM 0 HB3 ALA A 140 2.159 10.177 0.793 1.00 0.00 H new ATOM 1999 N LEU A 141 -0.682 10.156 1.863 1.00 0.00 N ATOM 2000 CA LEU A 141 -2.084 10.078 1.360 1.00 0.00 C ATOM 2001 C LEU A 141 -3.050 10.638 2.410 1.00 0.00 C ATOM 2002 O LEU A 141 -4.212 10.864 2.136 1.00 0.00 O ATOM 2003 CB LEU A 141 -2.344 8.590 1.124 1.00 0.00 C ATOM 2004 CG LEU A 141 -3.597 8.420 0.264 1.00 0.00 C ATOM 2005 CD1 LEU A 141 -3.505 7.110 -0.520 1.00 0.00 C ATOM 2006 CD2 LEU A 141 -4.832 8.388 1.166 1.00 0.00 C ATOM 0 H LEU A 141 -0.273 9.267 2.149 1.00 0.00 H new ATOM 0 HA LEU A 141 -2.230 10.660 0.450 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -1.486 8.134 0.629 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -2.472 8.077 2.077 1.00 0.00 H new ATOM 0 HG LEU A 141 -3.676 9.255 -0.433 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -4.398 6.989 -1.133 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -2.625 7.131 -1.162 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -3.427 6.274 0.176 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -5.726 8.267 0.554 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -4.753 7.553 1.862 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -4.899 9.321 1.725 1.00 0.00 H new ATOM 2018 N ILE A 142 -2.584 10.863 3.609 1.00 0.00 N ATOM 2019 CA ILE A 142 -3.484 11.405 4.667 1.00 0.00 C ATOM 2020 C ILE A 142 -3.415 12.934 4.670 1.00 0.00 C ATOM 2021 O ILE A 142 -3.734 13.576 5.651 1.00 0.00 O ATOM 2022 CB ILE A 142 -2.946 10.839 5.982 1.00 0.00 C ATOM 2023 CG1 ILE A 142 -3.044 9.311 5.957 1.00 0.00 C ATOM 2024 CG2 ILE A 142 -3.774 11.382 7.148 1.00 0.00 C ATOM 2025 CD1 ILE A 142 -2.342 8.735 7.188 1.00 0.00 C ATOM 0 H ILE A 142 -1.621 10.695 3.901 1.00 0.00 H new ATOM 0 HA ILE A 142 -4.526 11.129 4.508 1.00 0.00 H new ATOM 0 HB ILE A 142 -1.905 11.136 6.106 1.00 0.00 H new ATOM 0 HG12 ILE A 142 -4.090 9.003 5.944 1.00 0.00 H new ATOM 0 HG13 ILE A 142 -2.586 8.921 5.048 1.00 0.00 H new ATOM 0 HG21 ILE A 142 -3.391 10.979 8.085 1.00 0.00 H new ATOM 0 HG22 ILE A 142 -3.707 12.470 7.167 1.00 0.00 H new ATOM 0 HG23 ILE A 142 -4.815 11.085 7.024 1.00 0.00 H new ATOM 0 HD11 ILE A 142 -2.411 7.647 7.171 1.00 0.00 H new ATOM 0 HD12 ILE A 142 -1.293 9.032 7.181 1.00 0.00 H new ATOM 0 HD13 ILE A 142 -2.820 9.115 8.091 1.00 0.00 H new ATOM 2037 N SER A 143 -2.999 13.524 3.583 1.00 0.00 N ATOM 2038 CA SER A 143 -2.908 15.011 3.532 1.00 0.00 C ATOM 2039 C SER A 143 -3.992 15.566 2.605 1.00 0.00 C ATOM 2040 O SER A 143 -4.349 16.725 2.679 1.00 0.00 O ATOM 2041 CB SER A 143 -1.516 15.309 2.976 1.00 0.00 C ATOM 2042 OG SER A 143 -0.668 15.728 4.037 1.00 0.00 O ATOM 0 H SER A 143 -2.719 13.042 2.729 1.00 0.00 H new ATOM 0 HA SER A 143 -3.056 15.471 4.509 1.00 0.00 H new ATOM 0 HB2 SER A 143 -1.106 14.421 2.496 1.00 0.00 H new ATOM 0 HB3 SER A 143 -1.575 16.085 2.213 1.00 0.00 H new ATOM 0 HG SER A 143 0.227 15.919 3.685 1.00 0.00 H new ATOM 2048 N GLY A 144 -4.516 14.753 1.729 1.00 0.00 N ATOM 2049 CA GLY A 144 -5.571 15.243 0.797 1.00 0.00 C ATOM 2050 C GLY A 144 -6.868 14.466 1.034 1.00 0.00 C ATOM 2051 O GLY A 144 -7.945 14.926 0.709 1.00 0.00 O ATOM 0 H GLY A 144 -4.260 13.772 1.618 1.00 0.00 H new ATOM 0 HA2 GLY A 144 -5.740 16.309 0.952 1.00 0.00 H new ATOM 0 HA3 GLY A 144 -5.244 15.119 -0.235 1.00 0.00 H new ATOM 2055 N LEU A 145 -6.778 13.290 1.594 1.00 0.00 N ATOM 2056 CA LEU A 145 -8.010 12.489 1.843 1.00 0.00 C ATOM 2057 C LEU A 145 -8.926 13.236 2.825 1.00 0.00 C ATOM 2058 O LEU A 145 -9.657 14.127 2.439 1.00 0.00 O ATOM 2059 CB LEU A 145 -7.514 11.165 2.431 1.00 0.00 C ATOM 2060 CG LEU A 145 -8.711 10.295 2.813 1.00 0.00 C ATOM 2061 CD1 LEU A 145 -9.023 9.326 1.673 1.00 0.00 C ATOM 2062 CD2 LEU A 145 -8.379 9.501 4.079 1.00 0.00 C ATOM 0 H LEU A 145 -5.906 12.850 1.889 1.00 0.00 H new ATOM 0 HA LEU A 145 -8.596 12.321 0.939 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -6.890 10.644 1.705 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -6.894 11.354 3.307 1.00 0.00 H new ATOM 0 HG LEU A 145 -9.578 10.930 2.997 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -9.877 8.706 1.946 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -9.258 9.890 0.770 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -8.157 8.690 1.489 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -9.232 8.880 4.353 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -7.512 8.866 3.894 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -8.156 10.191 4.893 1.00 0.00 H new ATOM 2074 N GLN A 146 -8.894 12.891 4.087 1.00 0.00 N ATOM 2075 CA GLN A 146 -9.764 13.593 5.076 1.00 0.00 C ATOM 2076 C GLN A 146 -11.196 13.696 4.539 1.00 0.00 C ATOM 2077 O GLN A 146 -11.897 14.654 4.800 1.00 0.00 O ATOM 2078 CB GLN A 146 -9.146 14.983 5.239 1.00 0.00 C ATOM 2079 CG GLN A 146 -8.047 14.931 6.302 1.00 0.00 C ATOM 2080 CD GLN A 146 -6.848 14.141 5.776 1.00 0.00 C ATOM 2081 OE1 GLN A 146 -5.940 14.705 5.198 1.00 0.00 O ATOM 2082 NE2 GLN A 146 -6.805 12.849 5.954 1.00 0.00 N ATOM 0 H GLN A 146 -8.304 12.155 4.474 1.00 0.00 H new ATOM 0 HA GLN A 146 -9.819 13.063 6.027 1.00 0.00 H new ATOM 0 HB2 GLN A 146 -8.732 15.322 4.289 1.00 0.00 H new ATOM 0 HB3 GLN A 146 -9.913 15.702 5.528 1.00 0.00 H new ATOM 0 HG2 GLN A 146 -7.739 15.942 6.568 1.00 0.00 H new ATOM 0 HG3 GLN A 146 -8.430 14.465 7.210 1.00 0.00 H new ATOM 0 HE21 GLN A 146 -7.567 12.375 6.439 1.00 0.00 H new ATOM 0 HE22 GLN A 146 -6.009 12.313 5.608 1.00 0.00 H new ATOM 2091 N SER A 147 -11.640 12.719 3.795 1.00 0.00 N ATOM 2092 CA SER A 147 -13.027 12.769 3.250 1.00 0.00 C ATOM 2093 C SER A 147 -14.012 13.096 4.376 1.00 0.00 C ATOM 2094 O SER A 147 -13.683 12.828 5.520 1.00 0.00 O ATOM 2095 CB SER A 147 -13.289 11.370 2.689 1.00 0.00 C ATOM 2096 OG SER A 147 -13.849 10.551 3.707 1.00 0.00 O ATOM 2097 OXT SER A 147 -15.076 13.609 4.075 1.00 0.00 O ATOM 0 H SER A 147 -11.103 11.890 3.541 1.00 0.00 H new ATOM 0 HA SER A 147 -13.148 13.535 2.484 1.00 0.00 H new ATOM 0 HB2 SER A 147 -13.969 11.428 1.839 1.00 0.00 H new ATOM 0 HB3 SER A 147 -12.360 10.932 2.325 1.00 0.00 H new ATOM 0 HG SER A 147 -13.992 9.647 3.358 1.00 0.00 H new TER 2103 SER A 147 HETATM 2104 FE HEM A 148 -7.399 2.586 -1.801 1.00 0.00 FE HETATM 2105 CHA HEM A 148 -8.787 2.500 -4.883 1.00 0.00 C HETATM 2106 CHB HEM A 148 -10.451 2.140 -0.412 1.00 0.00 C HETATM 2107 CHC HEM A 148 -5.999 2.623 1.279 1.00 0.00 C HETATM 2108 CHD HEM A 148 -4.351 3.076 -3.188 1.00 0.00 C HETATM 2109 NA HEM A 148 -9.216 2.366 -2.495 1.00 0.00 N HETATM 2110 C1A HEM A 148 -9.626 2.353 -3.807 1.00 0.00 C HETATM 2111 C2A HEM A 148 -11.054 2.176 -3.915 1.00 0.00 C HETATM 2112 C3A HEM A 148 -11.524 2.083 -2.658 1.00 0.00 C HETATM 2113 C4A HEM A 148 -10.381 2.198 -1.782 1.00 0.00 C HETATM 2114 CMA HEM A 148 -12.947 1.907 -2.251 1.00 0.00 C HETATM 2115 CAA HEM A 148 -11.851 2.108 -5.172 1.00 0.00 C HETATM 2116 CBA HEM A 148 -12.707 0.843 -5.252 1.00 0.00 C HETATM 2117 CGA HEM A 148 -14.142 1.222 -5.494 1.00 0.00 C HETATM 2118 O1A HEM A 148 -15.018 0.741 -4.727 1.00 0.00 O HETATM 2119 O2A HEM A 148 -14.394 2.002 -6.451 1.00 0.00 O HETATM 2120 NB HEM A 148 -8.075 2.419 0.028 1.00 0.00 N HETATM 2121 C1B HEM A 148 -9.377 2.240 0.438 1.00 0.00 C HETATM 2122 C2B HEM A 148 -9.472 2.154 1.876 1.00 0.00 C HETATM 2123 C3B HEM A 148 -8.218 2.271 2.351 1.00 0.00 C HETATM 2124 C4B HEM A 148 -7.359 2.443 1.204 1.00 0.00 C HETATM 2125 CMB HEM A 148 -10.716 1.987 2.679 1.00 0.00 C HETATM 2126 CAB HEM A 148 -7.829 2.198 3.674 1.00 0.00 C HETATM 2127 CBB HEM A 148 -7.258 1.048 4.182 1.00 0.00 C HETATM 2128 NC HEM A 148 -5.580 2.810 -1.108 1.00 0.00 N HETATM 2129 C1C HEM A 148 -5.164 2.798 0.203 1.00 0.00 C HETATM 2130 C2C HEM A 148 -3.737 2.998 0.308 1.00 0.00 C HETATM 2131 C3C HEM A 148 -3.277 3.136 -0.951 1.00 0.00 C HETATM 2132 C4C HEM A 148 -4.420 3.013 -1.820 1.00 0.00 C HETATM 2133 CMC HEM A 148 -2.933 3.042 1.562 1.00 0.00 C HETATM 2134 CAC HEM A 148 -1.974 3.381 -1.341 1.00 0.00 C HETATM 2135 CBC HEM A 148 -0.912 2.739 -0.741 1.00 0.00 C HETATM 2136 ND HEM A 148 -6.719 2.749 -3.631 1.00 0.00 N HETATM 2137 C1D HEM A 148 -5.420 2.952 -4.039 1.00 0.00 C HETATM 2138 C2D HEM A 148 -5.321 3.015 -5.477 1.00 0.00 C HETATM 2139 C3D HEM A 148 -6.569 2.849 -5.954 1.00 0.00 C HETATM 2140 C4D HEM A 148 -7.430 2.686 -4.807 1.00 0.00 C HETATM 2141 CMD HEM A 148 -4.081 3.221 -6.276 1.00 0.00 C HETATM 2142 CAD HEM A 148 -6.980 2.836 -7.386 1.00 0.00 C HETATM 2143 CBD HEM A 148 -8.165 3.764 -7.660 1.00 0.00 C HETATM 2144 CGD HEM A 148 -7.925 4.520 -8.938 1.00 0.00 C HETATM 2145 O1D HEM A 148 -8.275 5.729 -8.985 1.00 0.00 O HETATM 2146 O2D HEM A 148 -7.385 3.905 -9.896 1.00 0.00 O HETATM 0 HMA1 HEM A 148 -13.598 2.364 -2.996 1.00 0.00 H new HETATM 0 HMA2 HEM A 148 -13.111 2.384 -1.285 1.00 0.00 H new HETATM 0 HMA3 HEM A 148 -13.175 0.844 -2.174 1.00 0.00 H new HETATM 0 HMB1 HEM A 148 -11.553 2.448 2.154 1.00 0.00 H new HETATM 0 HMB2 HEM A 148 -10.589 2.465 3.650 1.00 0.00 H new HETATM 0 HMB3 HEM A 148 -10.918 0.925 2.821 1.00 0.00 H new HETATM 0 HMC1 HEM A 148 -3.548 3.426 2.375 1.00 0.00 H new HETATM 0 HMC2 HEM A 148 -2.072 3.695 1.419 1.00 0.00 H new HETATM 0 HMC3 HEM A 148 -2.590 2.037 1.810 1.00 0.00 H new HETATM 0 HMD1 HEM A 148 -3.375 3.823 -5.704 1.00 0.00 H new HETATM 0 HMD2 HEM A 148 -4.328 3.736 -7.204 1.00 0.00 H new HETATM 0 HMD3 HEM A 148 -3.631 2.255 -6.506 1.00 0.00 H new HETATM 0 HBB1 HEM A 148 -6.956 1.006 5.229 1.00 0.00 H new HETATM 0 HBB2 HEM A 148 -7.109 0.182 3.536 1.00 0.00 H new HETATM 0 HBC1 HEM A 148 0.107 2.950 -1.067 1.00 0.00 H new HETATM 0 HBC2 HEM A 148 -1.091 2.021 0.059 1.00 0.00 H new HETATM 0 HBA1 HEM A 148 -12.621 0.274 -4.326 1.00 0.00 H new HETATM 0 HBA2 HEM A 148 -12.349 0.200 -6.056 1.00 0.00 H new HETATM 0 HAA1 HEM A 148 -11.178 2.142 -6.028 1.00 0.00 H new HETATM 0 HAA2 HEM A 148 -12.496 2.984 -5.238 1.00 0.00 H new HETATM 0 HBD1 HEM A 148 -8.294 4.461 -6.832 1.00 0.00 H new HETATM 0 HBD2 HEM A 148 -9.085 3.184 -7.735 1.00 0.00 H new HETATM 0 HAD1 HEM A 148 -7.243 1.819 -7.677 1.00 0.00 H new HETATM 0 HAD2 HEM A 148 -6.136 3.136 -8.006 1.00 0.00 H new HETATM 0 HHA HEM A 148 -9.230 2.467 -5.867 1.00 0.00 H new HETATM 0 HHB HEM A 148 -11.426 2.005 0.032 1.00 0.00 H new HETATM 0 HHC HEM A 148 -5.551 2.627 2.262 1.00 0.00 H new HETATM 0 HHD HEM A 148 -3.379 3.236 -3.630 1.00 0.00 H new HETATM 0 HAB HEM A 148 -7.975 3.059 4.326 1.00 0.00 H new HETATM 0 HAC HEM A 148 -1.782 4.097 -2.140 1.00 0.00 H new HETATM 2177 C CMO A 149 -7.137 0.705 -1.874 1.00 0.00 C HETATM 2178 O CMO A 149 -6.982 -0.411 -1.917 1.00 0.00 O