USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 949 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 18 ASN :FLIP amide:sc= 0.753 F(o=0.83,f=1.6) USER MOD Set 1.2: A 124 THR OG1 : rot -96:sc= 0.884 USER MOD Single : A 6 SER OG : rot 180:sc= -0.958 USER MOD Single : A 8 MET CE :methyl 174:sc= -0.0557 (180deg=-0.0903) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 31:sc= -0.117 USER MOD Single : A 21 LYS NZ :NH3+ 144:sc= -0.625 (180deg=-1.16) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 147:sc= 0.156 (180deg=0.00321) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ -162:sc= 0.945 (180deg=0.659) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00149) USER MOD Single : A 42 THR OG1 : rot 140:sc= 2.05 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ -140:sc= 1.43 (180deg=-0.721) USER MOD Single : A 47 ASN : amide:sc= -1.37! C(o=-1.4!,f=-1.1!) USER MOD Single : A 50 ASN : amide:sc= -0.232 X(o=-0.23,f=-0.19) USER MOD Single : A 54 ASN :FLIP amide:sc= 0.978 F(o=-0.027,f=0.98) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 110:sc= -3.1! USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot -49:sc= 0.45 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ -128:sc= 0 (180deg=-1.47!) USER MOD Single : A 99 THR OG1 : rot -55:sc= 0.27 USER MOD Single : A 102 GLN : amide:sc= -0.133 K(o=-0.13,f=-1.9!) USER MOD Single : A 103 SER OG : rot 43:sc= 0.0353 USER MOD Single : A 105 SER OG : rot 47:sc= 0.3 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 170:sc= 0.62 (180deg=0.567) USER MOD Single : A 112 SER OG : rot 180:sc= 0.0423 USER MOD Single : A 115 ASN : amide:sc= -2.91 K(o=-2.9,f=-11!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 GLN : amide:sc= -0.0649 K(o=-0.065,f=-0.84) USER MOD Single : A 121 THR OG1 : rot -52:sc= 1.27 USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 6 -8.264 -22.131 2.486 1.00 0.00 N ATOM 49 CA SER A 6 -7.938 -22.326 1.078 1.00 0.00 C ATOM 50 C SER A 6 -6.945 -21.270 0.600 1.00 0.00 C ATOM 51 O SER A 6 -7.122 -20.671 -0.460 1.00 0.00 O ATOM 52 CB SER A 6 -9.207 -22.272 0.226 1.00 0.00 C ATOM 53 OG SER A 6 -9.071 -23.061 -0.943 1.00 0.00 O ATOM 0 HA SER A 6 -7.478 -23.308 0.969 1.00 0.00 H new ATOM 0 HB2 SER A 6 -10.056 -22.626 0.810 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.419 -21.239 -0.051 1.00 0.00 H new ATOM 0 HG SER A 6 -9.896 -23.011 -1.469 1.00 0.00 H new ATOM 59 N GLY A 7 -5.899 -21.049 1.390 1.00 0.00 N ATOM 60 CA GLY A 7 -4.893 -20.066 1.032 1.00 0.00 C ATOM 61 C GLY A 7 -5.468 -18.670 0.898 1.00 0.00 C ATOM 62 O GLY A 7 -6.331 -18.426 0.055 1.00 0.00 O ATOM 0 H GLY A 7 -5.730 -21.533 2.272 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.109 -20.061 1.789 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -4.426 -20.355 0.091 1.00 0.00 H new ATOM 66 N MET A 8 -4.991 -17.753 1.733 1.00 0.00 N ATOM 67 CA MET A 8 -5.464 -16.374 1.704 1.00 0.00 C ATOM 68 C MET A 8 -4.299 -15.396 1.822 1.00 0.00 C ATOM 69 O MET A 8 -3.348 -15.636 2.567 1.00 0.00 O ATOM 70 CB MET A 8 -6.465 -16.132 2.835 1.00 0.00 C ATOM 71 CG MET A 8 -6.756 -14.661 3.084 1.00 0.00 C ATOM 72 SD MET A 8 -8.412 -14.382 3.743 1.00 0.00 S ATOM 73 CE MET A 8 -9.345 -14.163 2.230 1.00 0.00 C ATOM 0 H MET A 8 -4.278 -17.940 2.438 1.00 0.00 H new ATOM 0 HA MET A 8 -5.960 -16.207 0.748 1.00 0.00 H new ATOM 0 HB2 MET A 8 -7.398 -16.644 2.599 1.00 0.00 H new ATOM 0 HB3 MET A 8 -6.080 -16.578 3.752 1.00 0.00 H new ATOM 0 HG2 MET A 8 -6.020 -14.262 3.782 1.00 0.00 H new ATOM 0 HG3 MET A 8 -6.643 -14.109 2.151 1.00 0.00 H new ATOM 0 HE1 MET A 8 -10.407 -14.087 2.465 1.00 0.00 H new ATOM 0 HE2 MET A 8 -9.018 -13.251 1.730 1.00 0.00 H new ATOM 0 HE3 MET A 8 -9.179 -15.017 1.573 1.00 0.00 H new ATOM 83 N LEU A 9 -4.379 -14.295 1.084 1.00 0.00 N ATOM 84 CA LEU A 9 -3.331 -13.281 1.106 1.00 0.00 C ATOM 85 C LEU A 9 -3.858 -11.965 1.668 1.00 0.00 C ATOM 86 O LEU A 9 -4.632 -11.265 1.016 1.00 0.00 O ATOM 87 CB LEU A 9 -2.777 -13.061 -0.303 1.00 0.00 C ATOM 88 CG LEU A 9 -1.594 -12.099 -0.416 1.00 0.00 C ATOM 89 CD1 LEU A 9 -0.308 -12.779 0.027 1.00 0.00 C ATOM 90 CD2 LEU A 9 -1.462 -11.581 -1.841 1.00 0.00 C ATOM 0 H LEU A 9 -5.159 -14.081 0.463 1.00 0.00 H new ATOM 0 HA LEU A 9 -2.530 -13.637 1.754 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -2.474 -14.027 -0.708 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -3.584 -12.689 -0.935 1.00 0.00 H new ATOM 0 HG LEU A 9 -1.777 -11.250 0.243 1.00 0.00 H new ATOM 0 HD11 LEU A 9 0.523 -12.079 -0.061 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.405 -13.100 1.064 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -0.119 -13.647 -0.605 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -0.615 -10.898 -1.903 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -1.302 -12.419 -2.519 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -2.374 -11.055 -2.123 1.00 0.00 H new ATOM 102 N ARG A 10 -3.431 -11.633 2.883 1.00 0.00 N ATOM 103 CA ARG A 10 -3.860 -10.401 3.533 1.00 0.00 C ATOM 104 C ARG A 10 -2.855 -9.279 3.286 1.00 0.00 C ATOM 105 O ARG A 10 -1.664 -9.427 3.557 1.00 0.00 O ATOM 106 CB ARG A 10 -4.031 -10.625 5.036 1.00 0.00 C ATOM 107 CG ARG A 10 -5.414 -11.123 5.424 1.00 0.00 C ATOM 108 CD ARG A 10 -5.642 -11.023 6.924 1.00 0.00 C ATOM 109 NE ARG A 10 -6.687 -11.935 7.381 1.00 0.00 N ATOM 110 CZ ARG A 10 -6.771 -12.391 8.626 1.00 0.00 C ATOM 111 NH1 ARG A 10 -5.877 -12.022 9.533 1.00 0.00 N ATOM 112 NH2 ARG A 10 -7.751 -13.218 8.966 1.00 0.00 N ATOM 0 H ARG A 10 -2.789 -12.200 3.436 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.819 -10.108 3.105 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -3.286 -11.346 5.374 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -3.831 -9.690 5.559 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -6.172 -10.540 4.900 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.532 -12.159 5.105 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -4.712 -11.246 7.448 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -5.916 -10.000 7.182 1.00 0.00 H new ATOM 0 HE ARG A 10 -7.391 -12.238 6.708 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -5.122 -11.386 9.276 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -5.944 -12.374 10.488 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -8.441 -13.504 8.271 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -7.815 -13.568 9.922 1.00 0.00 H new ATOM 126 N VAL A 11 -3.345 -8.156 2.770 1.00 0.00 N ATOM 127 CA VAL A 11 -2.491 -7.008 2.487 1.00 0.00 C ATOM 128 C VAL A 11 -2.950 -5.778 3.261 1.00 0.00 C ATOM 129 O VAL A 11 -3.879 -5.083 2.848 1.00 0.00 O ATOM 130 CB VAL A 11 -2.474 -6.678 0.983 1.00 0.00 C ATOM 131 CG1 VAL A 11 -1.483 -5.562 0.692 1.00 0.00 C ATOM 132 CG2 VAL A 11 -2.144 -7.921 0.169 1.00 0.00 C ATOM 0 H VAL A 11 -4.329 -8.017 2.539 1.00 0.00 H new ATOM 0 HA VAL A 11 -1.483 -7.278 2.803 1.00 0.00 H new ATOM 0 HB VAL A 11 -3.467 -6.334 0.693 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -1.485 -5.343 -0.376 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -1.769 -4.668 1.246 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -0.484 -5.874 0.996 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -2.136 -7.670 -0.892 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -1.163 -8.297 0.460 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -2.896 -8.688 0.355 1.00 0.00 H new ATOM 142 N ILE A 12 -2.294 -5.514 4.386 1.00 0.00 N ATOM 143 CA ILE A 12 -2.634 -4.366 5.217 1.00 0.00 C ATOM 144 C ILE A 12 -1.968 -3.095 4.699 1.00 0.00 C ATOM 145 O ILE A 12 -0.790 -3.101 4.338 1.00 0.00 O ATOM 146 CB ILE A 12 -2.217 -4.589 6.683 1.00 0.00 C ATOM 147 CG1 ILE A 12 -2.726 -5.943 7.180 1.00 0.00 C ATOM 148 CG2 ILE A 12 -2.745 -3.464 7.560 1.00 0.00 C ATOM 149 CD1 ILE A 12 -1.844 -6.569 8.237 1.00 0.00 C ATOM 0 H ILE A 12 -1.524 -6.080 4.743 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.717 -4.252 5.169 1.00 0.00 H new ATOM 0 HB ILE A 12 -1.129 -4.588 6.740 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -3.731 -5.818 7.584 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -2.805 -6.625 6.334 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -2.442 -3.635 8.593 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -2.339 -2.513 7.216 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -3.833 -3.436 7.500 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.266 -7.526 8.543 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -0.845 -6.726 7.831 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.785 -5.906 9.101 1.00 0.00 H new ATOM 161 N VAL A 13 -2.728 -2.006 4.665 1.00 0.00 N ATOM 162 CA VAL A 13 -2.212 -0.727 4.194 1.00 0.00 C ATOM 163 C VAL A 13 -2.104 0.277 5.337 1.00 0.00 C ATOM 164 O VAL A 13 -3.062 0.983 5.647 1.00 0.00 O ATOM 165 CB VAL A 13 -3.105 -0.134 3.088 1.00 0.00 C ATOM 166 CG1 VAL A 13 -2.538 1.190 2.596 1.00 0.00 C ATOM 167 CG2 VAL A 13 -3.253 -1.119 1.938 1.00 0.00 C ATOM 0 H VAL A 13 -3.705 -1.984 4.958 1.00 0.00 H new ATOM 0 HA VAL A 13 -1.219 -0.918 3.786 1.00 0.00 H new ATOM 0 HB VAL A 13 -4.094 0.054 3.506 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.182 1.594 1.815 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -2.488 1.895 3.426 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -1.537 1.031 2.195 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -3.887 -0.684 1.165 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -2.271 -1.340 1.520 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -3.707 -2.040 2.304 1.00 0.00 H new ATOM 177 N GLU A 14 -0.930 0.333 5.958 1.00 0.00 N ATOM 178 CA GLU A 14 -0.697 1.251 7.067 1.00 0.00 C ATOM 179 C GLU A 14 -0.966 2.693 6.646 1.00 0.00 C ATOM 180 O GLU A 14 -1.972 3.286 7.035 1.00 0.00 O ATOM 181 CB GLU A 14 0.740 1.117 7.576 1.00 0.00 C ATOM 182 CG GLU A 14 0.965 -0.109 8.446 1.00 0.00 C ATOM 183 CD GLU A 14 -0.139 -0.312 9.465 1.00 0.00 C ATOM 184 OE1 GLU A 14 -0.101 0.355 10.521 1.00 0.00 O ATOM 185 OE2 GLU A 14 -1.040 -1.137 9.208 1.00 0.00 O ATOM 0 H GLU A 14 -0.127 -0.245 5.713 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.386 0.991 7.871 1.00 0.00 H new ATOM 0 HB2 GLU A 14 1.417 1.076 6.722 1.00 0.00 H new ATOM 0 HB3 GLU A 14 1.000 2.009 8.146 1.00 0.00 H new ATOM 0 HG2 GLU A 14 1.035 -0.992 7.811 1.00 0.00 H new ATOM 0 HG3 GLU A 14 1.919 -0.012 8.964 1.00 0.00 H new ATOM 192 N SER A 15 -0.059 3.250 5.850 1.00 0.00 N ATOM 193 CA SER A 15 -0.196 4.623 5.380 1.00 0.00 C ATOM 194 C SER A 15 0.908 4.969 4.385 1.00 0.00 C ATOM 195 O SER A 15 1.826 4.180 4.161 1.00 0.00 O ATOM 196 CB SER A 15 -0.157 5.596 6.560 1.00 0.00 C ATOM 197 OG SER A 15 0.958 5.339 7.396 1.00 0.00 O ATOM 0 H SER A 15 0.778 2.772 5.517 1.00 0.00 H new ATOM 0 HA SER A 15 -1.158 4.713 4.876 1.00 0.00 H new ATOM 0 HB2 SER A 15 -0.109 6.620 6.190 1.00 0.00 H new ATOM 0 HB3 SER A 15 -1.077 5.509 7.138 1.00 0.00 H new ATOM 0 HG SER A 15 0.961 5.975 8.142 1.00 0.00 H new ATOM 203 N ALA A 16 0.811 6.154 3.792 1.00 0.00 N ATOM 204 CA ALA A 16 1.802 6.607 2.823 1.00 0.00 C ATOM 205 C ALA A 16 2.327 7.993 3.180 1.00 0.00 C ATOM 206 O ALA A 16 1.741 8.695 4.004 1.00 0.00 O ATOM 207 CB ALA A 16 1.207 6.610 1.422 1.00 0.00 C ATOM 0 H ALA A 16 0.056 6.818 3.965 1.00 0.00 H new ATOM 0 HA ALA A 16 2.642 5.913 2.848 1.00 0.00 H new ATOM 0 HB1 ALA A 16 1.958 6.950 0.709 1.00 0.00 H new ATOM 0 HB2 ALA A 16 0.888 5.601 1.160 1.00 0.00 H new ATOM 0 HB3 ALA A 16 0.348 7.281 1.393 1.00 0.00 H new ATOM 213 N SER A 17 3.434 8.381 2.556 1.00 0.00 N ATOM 214 CA SER A 17 4.040 9.682 2.812 1.00 0.00 C ATOM 215 C SER A 17 4.937 10.101 1.651 1.00 0.00 C ATOM 216 O SER A 17 5.287 9.288 0.797 1.00 0.00 O ATOM 217 CB SER A 17 4.851 9.644 4.109 1.00 0.00 C ATOM 218 OG SER A 17 4.009 9.786 5.240 1.00 0.00 O ATOM 0 H SER A 17 3.930 7.813 1.869 1.00 0.00 H new ATOM 0 HA SER A 17 3.239 10.415 2.913 1.00 0.00 H new ATOM 0 HB2 SER A 17 5.396 8.702 4.173 1.00 0.00 H new ATOM 0 HB3 SER A 17 5.593 10.442 4.101 1.00 0.00 H new ATOM 0 HG SER A 17 3.132 9.393 5.046 1.00 0.00 H new ATOM 224 N ASN A 18 5.305 11.378 1.627 1.00 0.00 N ATOM 225 CA ASN A 18 6.160 11.908 0.571 1.00 0.00 C ATOM 226 C ASN A 18 5.427 11.921 -0.767 1.00 0.00 C ATOM 227 O ASN A 18 6.043 11.783 -1.824 1.00 0.00 O ATOM 228 CB ASN A 18 7.439 11.076 0.457 1.00 0.00 C ATOM 229 CG ASN A 18 8.131 10.893 1.794 1.00 0.00 C ATOM 230 OD1 ASN A 18 8.160 9.658 2.281 1.00 0.00 O flip ATOM 231 ND2 ASN A 18 8.635 11.851 2.381 1.00 0.00 N flip ATOM 0 H ASN A 18 5.024 12.065 2.327 1.00 0.00 H new ATOM 0 HA ASN A 18 6.423 12.933 0.831 1.00 0.00 H new ATOM 0 HB2 ASN A 18 7.197 10.099 0.039 1.00 0.00 H new ATOM 0 HB3 ASN A 18 8.123 11.560 -0.240 1.00 0.00 H new ATOM 0 HD21 ASN A 18 8.589 12.783 1.969 1.00 0.00 H new ATOM 0 HD22 ASN A 18 9.099 11.712 3.279 1.00 0.00 H new ATOM 238 N ILE A 19 4.110 12.088 -0.712 1.00 0.00 N ATOM 239 CA ILE A 19 3.294 12.122 -1.920 1.00 0.00 C ATOM 240 C ILE A 19 3.478 13.436 -2.671 1.00 0.00 C ATOM 241 O ILE A 19 3.398 14.523 -2.099 1.00 0.00 O ATOM 242 CB ILE A 19 1.801 11.933 -1.595 1.00 0.00 C ATOM 243 CG1 ILE A 19 1.500 10.459 -1.314 1.00 0.00 C ATOM 244 CG2 ILE A 19 0.941 12.445 -2.741 1.00 0.00 C ATOM 245 CD1 ILE A 19 0.023 10.157 -1.185 1.00 0.00 C ATOM 0 H ILE A 19 3.585 12.202 0.155 1.00 0.00 H new ATOM 0 HA ILE A 19 3.627 11.297 -2.550 1.00 0.00 H new ATOM 0 HB ILE A 19 1.563 12.510 -0.701 1.00 0.00 H new ATOM 0 HG12 ILE A 19 1.918 9.852 -2.117 1.00 0.00 H new ATOM 0 HG13 ILE A 19 2.005 10.162 -0.395 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -0.112 12.305 -2.497 1.00 0.00 H new ATOM 0 HG22 ILE A 19 1.139 13.505 -2.899 1.00 0.00 H new ATOM 0 HG23 ILE A 19 1.179 11.892 -3.650 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -0.115 9.094 -0.986 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -0.397 10.737 -0.363 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -0.485 10.422 -2.112 1.00 0.00 H new ATOM 257 N PRO A 20 3.727 13.336 -3.985 1.00 0.00 N ATOM 258 CA PRO A 20 3.924 14.508 -4.844 1.00 0.00 C ATOM 259 C PRO A 20 2.637 15.300 -5.049 1.00 0.00 C ATOM 260 O PRO A 20 1.773 14.908 -5.834 1.00 0.00 O ATOM 261 CB PRO A 20 4.395 13.901 -6.168 1.00 0.00 C ATOM 262 CG PRO A 20 3.841 12.518 -6.170 1.00 0.00 C ATOM 263 CD PRO A 20 3.836 12.073 -4.733 1.00 0.00 C ATOM 0 HA PRO A 20 4.628 15.218 -4.410 1.00 0.00 H new ATOM 0 HB2 PRO A 20 4.029 14.475 -7.019 1.00 0.00 H new ATOM 0 HB3 PRO A 20 5.483 13.892 -6.234 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.834 12.501 -6.587 1.00 0.00 H new ATOM 0 HG3 PRO A 20 4.451 11.854 -6.782 1.00 0.00 H new ATOM 0 HD2 PRO A 20 2.999 11.407 -4.521 1.00 0.00 H new ATOM 0 HD3 PRO A 20 4.747 11.532 -4.477 1.00 0.00 H new ATOM 271 N LYS A 21 2.515 16.416 -4.338 1.00 0.00 N ATOM 272 CA LYS A 21 1.335 17.265 -4.443 1.00 0.00 C ATOM 273 C LYS A 21 1.092 17.684 -5.889 1.00 0.00 C ATOM 274 O LYS A 21 1.793 17.243 -6.801 1.00 0.00 O ATOM 275 CB LYS A 21 1.493 18.505 -3.561 1.00 0.00 C ATOM 276 CG LYS A 21 2.538 19.483 -4.069 1.00 0.00 C ATOM 277 CD LYS A 21 2.524 20.777 -3.273 1.00 0.00 C ATOM 278 CE LYS A 21 3.185 20.603 -1.914 1.00 0.00 C ATOM 279 NZ LYS A 21 2.207 20.182 -0.872 1.00 0.00 N ATOM 0 H LYS A 21 3.220 16.753 -3.682 1.00 0.00 H new ATOM 0 HA LYS A 21 0.474 16.691 -4.101 1.00 0.00 H new ATOM 0 HB2 LYS A 21 0.533 19.016 -3.491 1.00 0.00 H new ATOM 0 HB3 LYS A 21 1.761 18.191 -2.552 1.00 0.00 H new ATOM 0 HG2 LYS A 21 3.526 19.027 -4.006 1.00 0.00 H new ATOM 0 HG3 LYS A 21 2.354 19.700 -5.121 1.00 0.00 H new ATOM 0 HD2 LYS A 21 3.041 21.556 -3.833 1.00 0.00 H new ATOM 0 HD3 LYS A 21 1.495 21.111 -3.138 1.00 0.00 H new ATOM 0 HE2 LYS A 21 3.979 19.860 -1.989 1.00 0.00 H new ATOM 0 HE3 LYS A 21 3.653 21.541 -1.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 2.666 19.523 -0.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 1.873 21.018 -0.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 1.398 19.710 -1.325 1.00 0.00 H new ATOM 293 N THR A 22 0.097 18.541 -6.093 1.00 0.00 N ATOM 294 CA THR A 22 -0.237 19.021 -7.429 1.00 0.00 C ATOM 295 C THR A 22 -0.181 20.542 -7.496 1.00 0.00 C ATOM 296 O THR A 22 0.054 21.211 -6.490 1.00 0.00 O ATOM 297 CB THR A 22 -1.639 18.550 -7.860 1.00 0.00 C ATOM 298 OG1 THR A 22 -2.617 18.992 -6.912 1.00 0.00 O ATOM 299 CG2 THR A 22 -1.689 17.034 -7.978 1.00 0.00 C ATOM 0 H THR A 22 -0.492 18.917 -5.350 1.00 0.00 H new ATOM 0 HA THR A 22 0.504 18.603 -8.110 1.00 0.00 H new ATOM 0 HB THR A 22 -1.858 18.982 -8.837 1.00 0.00 H new ATOM 0 HG1 THR A 22 -3.506 18.690 -7.194 1.00 0.00 H new ATOM 0 HG21 THR A 22 -2.689 16.726 -8.283 1.00 0.00 H new ATOM 0 HG22 THR A 22 -0.964 16.703 -8.722 1.00 0.00 H new ATOM 0 HG23 THR A 22 -1.450 16.586 -7.014 1.00 0.00 H new ATOM 356 N LYS A 26 -3.478 19.463 -2.671 1.00 0.00 N ATOM 357 CA LYS A 26 -3.174 18.076 -2.342 1.00 0.00 C ATOM 358 C LYS A 26 -4.235 17.138 -2.908 1.00 0.00 C ATOM 359 O LYS A 26 -5.416 17.220 -2.567 1.00 0.00 O ATOM 360 CB LYS A 26 -3.077 17.899 -0.825 1.00 0.00 C ATOM 361 CG LYS A 26 -2.091 18.846 -0.164 1.00 0.00 C ATOM 362 CD LYS A 26 -2.069 18.664 1.345 1.00 0.00 C ATOM 363 CE LYS A 26 -0.707 19.008 1.927 1.00 0.00 C ATOM 364 NZ LYS A 26 -0.450 18.282 3.202 1.00 0.00 N ATOM 0 HA LYS A 26 -2.214 17.824 -2.792 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -4.063 18.050 -0.386 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -2.785 16.872 -0.605 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.093 18.673 -0.567 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.357 19.875 -0.403 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -2.831 19.297 1.800 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -2.322 17.633 1.592 1.00 0.00 H new ATOM 0 HE2 LYS A 26 0.070 18.759 1.204 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -0.648 20.082 2.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 0.565 18.071 3.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -0.745 18.874 4.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -0.990 17.393 3.210 1.00 0.00 H new ATOM 378 N PRO A 27 -3.808 16.223 -3.791 1.00 0.00 N ATOM 379 CA PRO A 27 -4.707 15.250 -4.420 1.00 0.00 C ATOM 380 C PRO A 27 -5.212 14.204 -3.433 1.00 0.00 C ATOM 381 O PRO A 27 -4.764 14.151 -2.287 1.00 0.00 O ATOM 382 CB PRO A 27 -3.828 14.596 -5.490 1.00 0.00 C ATOM 383 CG PRO A 27 -2.435 14.762 -4.989 1.00 0.00 C ATOM 384 CD PRO A 27 -2.415 16.068 -4.243 1.00 0.00 C ATOM 0 HA PRO A 27 -5.606 15.722 -4.817 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -4.079 13.543 -5.620 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -3.960 15.077 -6.459 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -2.154 13.936 -4.336 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.723 14.773 -5.814 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -1.721 16.041 -3.403 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.107 16.893 -4.885 1.00 0.00 H new ATOM 392 N ASP A 28 -6.145 13.373 -3.884 1.00 0.00 N ATOM 393 CA ASP A 28 -6.710 12.327 -3.040 1.00 0.00 C ATOM 394 C ASP A 28 -6.073 10.976 -3.350 1.00 0.00 C ATOM 395 O ASP A 28 -6.428 10.302 -4.318 1.00 0.00 O ATOM 396 CB ASP A 28 -8.225 12.247 -3.234 1.00 0.00 C ATOM 397 CG ASP A 28 -8.833 13.587 -3.601 1.00 0.00 C ATOM 398 OD1 ASP A 28 -8.620 14.041 -4.744 1.00 0.00 O ATOM 399 OD2 ASP A 28 -9.520 14.181 -2.744 1.00 0.00 O ATOM 0 H ASP A 28 -6.526 13.403 -4.830 1.00 0.00 H new ATOM 0 HA ASP A 28 -6.498 12.579 -2.001 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -8.450 11.522 -4.016 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -8.687 11.880 -2.317 1.00 0.00 H new ATOM 404 N PRO A 29 -5.109 10.569 -2.511 1.00 0.00 N ATOM 405 CA PRO A 29 -4.402 9.295 -2.675 1.00 0.00 C ATOM 406 C PRO A 29 -5.296 8.094 -2.387 1.00 0.00 C ATOM 407 O PRO A 29 -6.245 8.189 -1.608 1.00 0.00 O ATOM 408 CB PRO A 29 -3.272 9.381 -1.646 1.00 0.00 C ATOM 409 CG PRO A 29 -3.776 10.324 -0.608 1.00 0.00 C ATOM 410 CD PRO A 29 -4.635 11.321 -1.337 1.00 0.00 C ATOM 0 HA PRO A 29 -4.055 9.151 -3.698 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -3.051 8.403 -1.218 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -2.351 9.747 -2.099 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -4.351 9.796 0.153 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -2.951 10.820 -0.097 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -5.464 11.665 -0.719 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -4.067 12.204 -1.628 1.00 0.00 H new ATOM 418 N ILE A 30 -4.986 6.967 -3.018 1.00 0.00 N ATOM 419 CA ILE A 30 -5.761 5.747 -2.827 1.00 0.00 C ATOM 420 C ILE A 30 -4.971 4.519 -3.264 1.00 0.00 C ATOM 421 O ILE A 30 -4.489 4.448 -4.395 1.00 0.00 O ATOM 422 CB ILE A 30 -7.088 5.795 -3.607 1.00 0.00 C ATOM 423 CG1 ILE A 30 -7.884 4.508 -3.382 1.00 0.00 C ATOM 424 CG2 ILE A 30 -6.822 6.007 -5.090 1.00 0.00 C ATOM 425 CD1 ILE A 30 -9.381 4.696 -3.496 1.00 0.00 C ATOM 0 H ILE A 30 -4.204 6.873 -3.666 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.978 5.675 -1.761 1.00 0.00 H new ATOM 0 HB ILE A 30 -7.679 6.634 -3.239 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.563 3.760 -4.108 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -7.650 4.113 -2.393 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -7.769 6.039 -5.629 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.291 6.948 -5.234 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -6.215 5.186 -5.472 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -9.881 3.743 -3.325 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -9.715 5.420 -2.752 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -9.627 5.061 -4.493 1.00 0.00 H new ATOM 437 N VAL A 31 -4.842 3.552 -2.361 1.00 0.00 N ATOM 438 CA VAL A 31 -4.112 2.324 -2.654 1.00 0.00 C ATOM 439 C VAL A 31 -4.965 1.360 -3.471 1.00 0.00 C ATOM 440 O VAL A 31 -6.163 1.213 -3.225 1.00 0.00 O ATOM 441 CB VAL A 31 -3.656 1.621 -1.363 1.00 0.00 C ATOM 442 CG1 VAL A 31 -2.873 0.358 -1.690 1.00 0.00 C ATOM 443 CG2 VAL A 31 -2.825 2.566 -0.507 1.00 0.00 C ATOM 0 H VAL A 31 -5.234 3.595 -1.420 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.234 2.608 -3.233 1.00 0.00 H new ATOM 0 HB VAL A 31 -4.541 1.334 -0.794 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.559 -0.125 -0.765 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.504 -0.324 -2.260 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -1.994 0.617 -2.280 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.511 2.053 0.402 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.945 2.885 -1.066 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.423 3.438 -0.243 1.00 0.00 H new ATOM 453 N SER A 32 -4.341 0.704 -4.444 1.00 0.00 N ATOM 454 CA SER A 32 -5.043 -0.245 -5.300 1.00 0.00 C ATOM 455 C SER A 32 -4.230 -1.524 -5.474 1.00 0.00 C ATOM 456 O SER A 32 -3.306 -1.580 -6.286 1.00 0.00 O ATOM 457 CB SER A 32 -5.328 0.383 -6.665 1.00 0.00 C ATOM 458 OG SER A 32 -5.977 1.635 -6.526 1.00 0.00 O ATOM 0 H SER A 32 -3.350 0.812 -4.659 1.00 0.00 H new ATOM 0 HA SER A 32 -5.988 -0.500 -4.821 1.00 0.00 H new ATOM 0 HB2 SER A 32 -4.394 0.513 -7.211 1.00 0.00 H new ATOM 0 HB3 SER A 32 -5.951 -0.289 -7.255 1.00 0.00 H new ATOM 0 HG SER A 32 -6.146 2.016 -7.413 1.00 0.00 H new ATOM 464 N VAL A 33 -4.581 -2.550 -4.706 1.00 0.00 N ATOM 465 CA VAL A 33 -3.886 -3.830 -4.775 1.00 0.00 C ATOM 466 C VAL A 33 -4.573 -4.777 -5.752 1.00 0.00 C ATOM 467 O VAL A 33 -5.790 -4.958 -5.704 1.00 0.00 O ATOM 468 CB VAL A 33 -3.810 -4.503 -3.392 1.00 0.00 C ATOM 469 CG1 VAL A 33 -3.159 -5.874 -3.500 1.00 0.00 C ATOM 470 CG2 VAL A 33 -3.053 -3.620 -2.411 1.00 0.00 C ATOM 0 H VAL A 33 -5.343 -2.520 -4.028 1.00 0.00 H new ATOM 0 HA VAL A 33 -2.875 -3.622 -5.126 1.00 0.00 H new ATOM 0 HB VAL A 33 -4.824 -4.638 -3.016 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -3.114 -6.334 -2.513 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -3.746 -6.504 -4.168 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -2.149 -5.767 -3.897 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -3.009 -4.111 -1.439 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -2.041 -3.452 -2.779 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -3.566 -2.664 -2.311 1.00 0.00 H new ATOM 480 N ILE A 34 -3.786 -5.378 -6.638 1.00 0.00 N ATOM 481 CA ILE A 34 -4.319 -6.308 -7.626 1.00 0.00 C ATOM 482 C ILE A 34 -3.641 -7.670 -7.521 1.00 0.00 C ATOM 483 O ILE A 34 -2.414 -7.766 -7.530 1.00 0.00 O ATOM 484 CB ILE A 34 -4.145 -5.769 -9.058 1.00 0.00 C ATOM 485 CG1 ILE A 34 -5.047 -4.553 -9.282 1.00 0.00 C ATOM 486 CG2 ILE A 34 -4.453 -6.858 -10.075 1.00 0.00 C ATOM 487 CD1 ILE A 34 -4.411 -3.245 -8.868 1.00 0.00 C ATOM 0 H ILE A 34 -2.777 -5.238 -6.692 1.00 0.00 H new ATOM 0 HA ILE A 34 -5.383 -6.417 -7.415 1.00 0.00 H new ATOM 0 HB ILE A 34 -3.109 -5.458 -9.190 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -5.315 -4.499 -10.337 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -5.973 -4.690 -8.724 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -4.326 -6.462 -11.082 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -3.773 -7.697 -9.927 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.481 -7.196 -9.946 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -5.107 -2.427 -9.055 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -4.168 -3.279 -7.806 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -3.500 -3.085 -9.444 1.00 0.00 H new ATOM 499 N PHE A 35 -4.448 -8.721 -7.423 1.00 0.00 N ATOM 500 CA PHE A 35 -3.926 -10.078 -7.318 1.00 0.00 C ATOM 501 C PHE A 35 -4.976 -11.099 -7.748 1.00 0.00 C ATOM 502 O PHE A 35 -6.144 -11.004 -7.371 1.00 0.00 O ATOM 503 CB PHE A 35 -3.478 -10.365 -5.883 1.00 0.00 C ATOM 504 CG PHE A 35 -2.680 -11.630 -5.746 1.00 0.00 C ATOM 505 CD1 PHE A 35 -1.325 -11.645 -6.033 1.00 0.00 C ATOM 506 CD2 PHE A 35 -3.285 -12.805 -5.330 1.00 0.00 C ATOM 507 CE1 PHE A 35 -0.588 -12.807 -5.909 1.00 0.00 C ATOM 508 CE2 PHE A 35 -2.554 -13.971 -5.203 1.00 0.00 C ATOM 509 CZ PHE A 35 -1.204 -13.972 -5.492 1.00 0.00 C ATOM 0 H PHE A 35 -5.466 -8.659 -7.414 1.00 0.00 H new ATOM 0 HA PHE A 35 -3.067 -10.163 -7.984 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -2.881 -9.527 -5.523 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -4.357 -10.428 -5.242 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -0.839 -10.737 -6.358 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -4.341 -12.810 -5.102 1.00 0.00 H new ATOM 0 HE1 PHE A 35 0.468 -12.805 -6.137 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -3.038 -14.880 -4.878 1.00 0.00 H new ATOM 0 HZ PHE A 35 -0.630 -14.882 -5.392 1.00 0.00 H new ATOM 519 N LYS A 36 -4.551 -12.076 -8.543 1.00 0.00 N ATOM 520 CA LYS A 36 -5.451 -13.116 -9.026 1.00 0.00 C ATOM 521 C LYS A 36 -6.680 -12.506 -9.692 1.00 0.00 C ATOM 522 O LYS A 36 -7.814 -12.817 -9.328 1.00 0.00 O ATOM 523 CB LYS A 36 -5.882 -14.024 -7.871 1.00 0.00 C ATOM 524 CG LYS A 36 -4.732 -14.787 -7.236 1.00 0.00 C ATOM 525 CD LYS A 36 -4.497 -16.119 -7.928 1.00 0.00 C ATOM 526 CE LYS A 36 -3.541 -16.997 -7.136 1.00 0.00 C ATOM 527 NZ LYS A 36 -2.122 -16.587 -7.328 1.00 0.00 N ATOM 0 H LYS A 36 -3.588 -12.169 -8.866 1.00 0.00 H new ATOM 0 HA LYS A 36 -4.915 -13.710 -9.766 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -6.371 -13.419 -7.108 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -6.622 -14.736 -8.236 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -3.824 -14.186 -7.285 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -4.946 -14.957 -6.181 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -5.448 -16.637 -8.055 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -4.092 -15.946 -8.925 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -3.794 -16.945 -6.077 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -3.663 -18.036 -7.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -1.494 -17.363 -7.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -1.957 -16.365 -8.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -1.923 -15.746 -6.750 1.00 0.00 H new ATOM 541 N ASP A 37 -6.447 -11.637 -10.669 1.00 0.00 N ATOM 542 CA ASP A 37 -7.536 -10.985 -11.388 1.00 0.00 C ATOM 543 C ASP A 37 -8.536 -10.367 -10.415 1.00 0.00 C ATOM 544 O ASP A 37 -9.735 -10.322 -10.690 1.00 0.00 O ATOM 545 CB ASP A 37 -8.245 -11.987 -12.300 1.00 0.00 C ATOM 546 CG ASP A 37 -9.082 -11.307 -13.366 1.00 0.00 C ATOM 547 OD1 ASP A 37 -9.581 -10.192 -13.108 1.00 0.00 O ATOM 548 OD2 ASP A 37 -9.237 -11.890 -14.460 1.00 0.00 O ATOM 0 H ASP A 37 -5.514 -11.367 -10.982 1.00 0.00 H new ATOM 0 HA ASP A 37 -7.110 -10.188 -11.998 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -7.503 -12.627 -12.778 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -8.884 -12.633 -11.698 1.00 0.00 H new ATOM 553 N GLU A 38 -8.034 -9.895 -9.279 1.00 0.00 N ATOM 554 CA GLU A 38 -8.885 -9.282 -8.265 1.00 0.00 C ATOM 555 C GLU A 38 -8.426 -7.860 -7.957 1.00 0.00 C ATOM 556 O GLU A 38 -7.270 -7.631 -7.602 1.00 0.00 O ATOM 557 CB GLU A 38 -8.877 -10.121 -6.985 1.00 0.00 C ATOM 558 CG GLU A 38 -10.147 -9.988 -6.162 1.00 0.00 C ATOM 559 CD GLU A 38 -10.334 -11.135 -5.189 1.00 0.00 C ATOM 560 OE1 GLU A 38 -9.318 -11.665 -4.692 1.00 0.00 O ATOM 561 OE2 GLU A 38 -11.497 -11.503 -4.923 1.00 0.00 O ATOM 0 H GLU A 38 -7.044 -9.925 -9.037 1.00 0.00 H new ATOM 0 HA GLU A 38 -9.901 -9.240 -8.657 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -8.733 -11.169 -7.248 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -8.025 -9.826 -6.373 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -10.121 -9.049 -5.610 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -11.006 -9.941 -6.831 1.00 0.00 H new ATOM 568 N LYS A 39 -9.341 -6.906 -8.097 1.00 0.00 N ATOM 569 CA LYS A 39 -9.032 -5.506 -7.834 1.00 0.00 C ATOM 570 C LYS A 39 -9.577 -5.075 -6.475 1.00 0.00 C ATOM 571 O LYS A 39 -10.766 -5.227 -6.195 1.00 0.00 O ATOM 572 CB LYS A 39 -9.617 -4.618 -8.934 1.00 0.00 C ATOM 573 CG LYS A 39 -8.888 -3.296 -9.101 1.00 0.00 C ATOM 574 CD LYS A 39 -7.760 -3.405 -10.113 1.00 0.00 C ATOM 575 CE LYS A 39 -8.238 -3.074 -11.519 1.00 0.00 C ATOM 576 NZ LYS A 39 -7.471 -3.820 -12.555 1.00 0.00 N ATOM 0 H LYS A 39 -10.302 -7.078 -8.391 1.00 0.00 H new ATOM 0 HA LYS A 39 -7.948 -5.395 -7.824 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -9.590 -5.160 -9.879 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -10.665 -4.420 -8.710 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -9.593 -2.529 -9.422 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -8.486 -2.977 -8.139 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -6.952 -2.728 -9.833 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -7.350 -4.415 -10.095 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -9.297 -3.314 -11.608 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -8.138 -2.003 -11.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -7.826 -3.567 -13.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -6.463 -3.572 -12.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -7.587 -4.842 -12.404 1.00 0.00 H new ATOM 590 N LYS A 40 -8.700 -4.534 -5.636 1.00 0.00 N ATOM 591 CA LYS A 40 -9.092 -4.078 -4.308 1.00 0.00 C ATOM 592 C LYS A 40 -8.316 -2.827 -3.911 1.00 0.00 C ATOM 593 O LYS A 40 -7.086 -2.803 -3.966 1.00 0.00 O ATOM 594 CB LYS A 40 -8.859 -5.185 -3.277 1.00 0.00 C ATOM 595 CG LYS A 40 -9.759 -6.393 -3.467 1.00 0.00 C ATOM 596 CD LYS A 40 -9.539 -7.429 -2.377 1.00 0.00 C ATOM 597 CE LYS A 40 -10.636 -8.483 -2.381 1.00 0.00 C ATOM 598 NZ LYS A 40 -11.856 -8.018 -1.665 1.00 0.00 N ATOM 0 H LYS A 40 -7.712 -4.401 -5.853 1.00 0.00 H new ATOM 0 HA LYS A 40 -10.154 -3.832 -4.334 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -7.819 -5.506 -3.330 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.017 -4.778 -2.278 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -10.802 -6.075 -3.463 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -9.566 -6.842 -4.441 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -8.571 -7.909 -2.520 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -9.510 -6.936 -1.405 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -10.893 -8.735 -3.410 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -10.265 -9.395 -1.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -12.579 -8.765 -1.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -11.617 -7.801 -0.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -12.225 -7.163 -2.127 1.00 0.00 H new ATOM 612 N LYS A 41 -9.041 -1.788 -3.510 1.00 0.00 N ATOM 613 CA LYS A 41 -8.422 -0.534 -3.101 1.00 0.00 C ATOM 614 C LYS A 41 -8.904 -0.115 -1.716 1.00 0.00 C ATOM 615 O LYS A 41 -9.953 -0.561 -1.250 1.00 0.00 O ATOM 616 CB LYS A 41 -8.733 0.568 -4.116 1.00 0.00 C ATOM 617 CG LYS A 41 -10.197 0.630 -4.516 1.00 0.00 C ATOM 618 CD LYS A 41 -11.017 1.423 -3.511 1.00 0.00 C ATOM 619 CE LYS A 41 -12.448 1.615 -3.987 1.00 0.00 C ATOM 620 NZ LYS A 41 -12.546 2.657 -5.047 1.00 0.00 N ATOM 0 H LYS A 41 -10.060 -1.791 -3.460 1.00 0.00 H new ATOM 0 HA LYS A 41 -7.344 -0.687 -3.060 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -8.438 1.530 -3.697 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -8.127 0.410 -5.008 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -10.287 1.087 -5.502 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -10.596 -0.381 -4.596 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -11.018 0.906 -2.552 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -10.553 2.396 -3.348 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -12.833 0.670 -4.370 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -13.077 1.896 -3.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -13.540 2.770 -5.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -12.187 3.561 -4.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -11.980 2.369 -5.871 1.00 0.00 H new ATOM 634 N THR A 42 -8.132 0.747 -1.061 1.00 0.00 N ATOM 635 CA THR A 42 -8.481 1.227 0.271 1.00 0.00 C ATOM 636 C THR A 42 -9.332 2.489 0.195 1.00 0.00 C ATOM 637 O THR A 42 -9.536 3.050 -0.882 1.00 0.00 O ATOM 638 CB THR A 42 -7.223 1.519 1.110 1.00 0.00 C ATOM 639 OG1 THR A 42 -6.489 2.604 0.532 1.00 0.00 O ATOM 640 CG2 THR A 42 -6.334 0.288 1.198 1.00 0.00 C ATOM 0 H THR A 42 -7.261 1.127 -1.431 1.00 0.00 H new ATOM 0 HA THR A 42 -9.054 0.435 0.753 1.00 0.00 H new ATOM 0 HB THR A 42 -7.540 1.792 2.117 1.00 0.00 H new ATOM 0 HG1 THR A 42 -6.150 3.185 1.244 1.00 0.00 H new ATOM 0 HG21 THR A 42 -5.452 0.518 1.795 1.00 0.00 H new ATOM 0 HG22 THR A 42 -6.886 -0.527 1.666 1.00 0.00 H new ATOM 0 HG23 THR A 42 -6.026 -0.011 0.196 1.00 0.00 H new ATOM 648 N LYS A 43 -9.827 2.934 1.345 1.00 0.00 N ATOM 649 CA LYS A 43 -10.654 4.133 1.410 1.00 0.00 C ATOM 650 C LYS A 43 -9.854 5.369 1.012 1.00 0.00 C ATOM 651 O LYS A 43 -8.764 5.609 1.530 1.00 0.00 O ATOM 652 CB LYS A 43 -11.219 4.311 2.822 1.00 0.00 C ATOM 653 CG LYS A 43 -10.164 4.651 3.860 1.00 0.00 C ATOM 654 CD LYS A 43 -10.785 4.902 5.224 1.00 0.00 C ATOM 655 CE LYS A 43 -11.271 6.337 5.361 1.00 0.00 C ATOM 656 NZ LYS A 43 -10.152 7.275 5.652 1.00 0.00 N ATOM 0 H LYS A 43 -9.670 2.482 2.246 1.00 0.00 H new ATOM 0 HA LYS A 43 -11.478 4.014 0.707 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -11.970 5.101 2.807 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -11.727 3.394 3.119 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.445 3.834 3.931 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -9.611 5.535 3.542 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -11.620 4.218 5.376 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -10.053 4.689 6.003 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -11.770 6.641 4.441 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -12.011 6.395 6.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -10.524 8.243 5.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -9.692 7.000 6.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -9.458 7.238 4.878 1.00 0.00 H new ATOM 670 N LYS A 44 -10.403 6.151 0.088 1.00 0.00 N ATOM 671 CA LYS A 44 -9.743 7.364 -0.379 1.00 0.00 C ATOM 672 C LYS A 44 -9.635 8.391 0.744 1.00 0.00 C ATOM 673 O LYS A 44 -10.550 8.539 1.554 1.00 0.00 O ATOM 674 CB LYS A 44 -10.508 7.963 -1.561 1.00 0.00 C ATOM 675 CG LYS A 44 -11.789 8.674 -1.159 1.00 0.00 C ATOM 676 CD LYS A 44 -12.527 9.221 -2.369 1.00 0.00 C ATOM 677 CE LYS A 44 -13.611 10.208 -1.963 1.00 0.00 C ATOM 678 NZ LYS A 44 -14.478 10.584 -3.113 1.00 0.00 N ATOM 0 H LYS A 44 -11.304 5.966 -0.352 1.00 0.00 H new ATOM 0 HA LYS A 44 -8.737 7.099 -0.703 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -9.860 8.667 -2.083 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -10.750 7.168 -2.267 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -12.436 7.982 -0.619 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -11.554 9.490 -0.476 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -11.819 9.711 -3.037 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -12.974 8.398 -2.927 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -14.223 9.771 -1.174 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -13.149 11.104 -1.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -14.695 11.600 -3.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -13.983 10.376 -4.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -15.363 10.039 -3.073 1.00 0.00 H new ATOM 692 N VAL A 45 -8.512 9.100 0.785 1.00 0.00 N ATOM 693 CA VAL A 45 -8.286 10.116 1.807 1.00 0.00 C ATOM 694 C VAL A 45 -8.340 11.518 1.210 1.00 0.00 C ATOM 695 O VAL A 45 -7.695 11.799 0.199 1.00 0.00 O ATOM 696 CB VAL A 45 -6.926 9.919 2.503 1.00 0.00 C ATOM 697 CG1 VAL A 45 -6.677 11.029 3.512 1.00 0.00 C ATOM 698 CG2 VAL A 45 -6.864 8.554 3.172 1.00 0.00 C ATOM 0 H VAL A 45 -7.744 8.990 0.123 1.00 0.00 H new ATOM 0 HA VAL A 45 -9.082 10.007 2.543 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.140 9.965 1.749 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -5.712 10.873 3.994 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -6.676 11.992 3.001 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -7.464 11.019 4.266 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -5.897 8.431 3.659 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.657 8.477 3.916 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.994 7.775 2.421 1.00 0.00 H new ATOM 708 N ASP A 46 -9.113 12.394 1.841 1.00 0.00 N ATOM 709 CA ASP A 46 -9.251 13.768 1.373 1.00 0.00 C ATOM 710 C ASP A 46 -7.884 14.392 1.109 1.00 0.00 C ATOM 711 O ASP A 46 -6.853 13.826 1.468 1.00 0.00 O ATOM 712 CB ASP A 46 -10.017 14.604 2.400 1.00 0.00 C ATOM 713 CG ASP A 46 -9.190 14.906 3.634 1.00 0.00 C ATOM 714 OD1 ASP A 46 -8.409 15.879 3.601 1.00 0.00 O ATOM 715 OD2 ASP A 46 -9.323 14.168 4.633 1.00 0.00 O ATOM 0 H ASP A 46 -9.654 12.177 2.678 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.810 13.753 0.438 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -10.332 15.540 1.939 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -10.922 14.073 2.694 1.00 0.00 H new ATOM 720 N ASN A 47 -7.885 15.561 0.477 1.00 0.00 N ATOM 721 CA ASN A 47 -6.645 16.261 0.163 1.00 0.00 C ATOM 722 C ASN A 47 -5.605 16.043 1.257 1.00 0.00 C ATOM 723 O ASN A 47 -5.666 16.665 2.317 1.00 0.00 O ATOM 724 CB ASN A 47 -6.910 17.758 -0.014 1.00 0.00 C ATOM 725 CG ASN A 47 -7.189 18.455 1.304 1.00 0.00 C ATOM 726 OD1 ASN A 47 -8.278 18.334 1.865 1.00 0.00 O ATOM 727 ND2 ASN A 47 -6.202 19.190 1.804 1.00 0.00 N ATOM 0 H ASN A 47 -8.730 16.043 0.172 1.00 0.00 H new ATOM 0 HA ASN A 47 -6.255 15.855 -0.770 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -6.048 18.223 -0.492 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -7.759 17.897 -0.683 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -6.330 19.683 2.688 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -5.316 19.262 1.304 1.00 0.00 H new ATOM 734 N GLU A 48 -4.651 15.156 0.991 1.00 0.00 N ATOM 735 CA GLU A 48 -3.598 14.857 1.954 1.00 0.00 C ATOM 736 C GLU A 48 -2.436 14.130 1.282 1.00 0.00 C ATOM 737 O GLU A 48 -2.640 13.272 0.422 1.00 0.00 O ATOM 738 CB GLU A 48 -4.150 14.006 3.100 1.00 0.00 C ATOM 739 CG GLU A 48 -3.094 13.580 4.106 1.00 0.00 C ATOM 740 CD GLU A 48 -2.414 14.760 4.772 1.00 0.00 C ATOM 741 OE1 GLU A 48 -1.721 15.521 4.065 1.00 0.00 O ATOM 742 OE2 GLU A 48 -2.573 14.922 6.000 1.00 0.00 O ATOM 0 H GLU A 48 -4.586 14.633 0.118 1.00 0.00 H new ATOM 0 HA GLU A 48 -3.231 15.801 2.356 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -4.927 14.569 3.618 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -4.624 13.117 2.685 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -3.556 12.954 4.869 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -2.344 12.969 3.603 1.00 0.00 H new ATOM 749 N LEU A 49 -1.218 14.480 1.679 1.00 0.00 N ATOM 750 CA LEU A 49 -0.023 13.863 1.115 1.00 0.00 C ATOM 751 C LEU A 49 0.252 12.512 1.768 1.00 0.00 C ATOM 752 O LEU A 49 0.511 11.523 1.084 1.00 0.00 O ATOM 753 CB LEU A 49 1.185 14.784 1.296 1.00 0.00 C ATOM 754 CG LEU A 49 1.454 15.769 0.158 1.00 0.00 C ATOM 755 CD1 LEU A 49 0.161 16.430 -0.294 1.00 0.00 C ATOM 756 CD2 LEU A 49 2.469 16.818 0.589 1.00 0.00 C ATOM 0 H LEU A 49 -1.032 15.188 2.389 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.195 13.704 0.050 1.00 0.00 H new ATOM 0 HB2 LEU A 49 1.049 15.352 2.217 1.00 0.00 H new ATOM 0 HB3 LEU A 49 2.072 14.165 1.431 1.00 0.00 H new ATOM 0 HG LEU A 49 1.868 15.216 -0.685 1.00 0.00 H new ATOM 0 HD11 LEU A 49 0.373 17.128 -1.104 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -0.534 15.667 -0.644 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.283 16.970 0.542 1.00 0.00 H new ATOM 0 HD21 LEU A 49 2.648 17.510 -0.233 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.083 17.367 1.448 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.404 16.329 0.862 1.00 0.00 H new ATOM 768 N ASN A 50 0.192 12.479 3.095 1.00 0.00 N ATOM 769 CA ASN A 50 0.432 11.248 3.841 1.00 0.00 C ATOM 770 C ASN A 50 -0.869 10.697 4.415 1.00 0.00 C ATOM 771 O ASN A 50 -1.204 10.914 5.580 1.00 0.00 O ATOM 772 CB ASN A 50 1.435 11.499 4.969 1.00 0.00 C ATOM 773 CG ASN A 50 1.359 12.915 5.506 1.00 0.00 C ATOM 774 OD1 ASN A 50 0.560 13.211 6.396 1.00 0.00 O ATOM 775 ND2 ASN A 50 2.191 13.798 4.968 1.00 0.00 N ATOM 0 H ASN A 50 -0.021 13.290 3.676 1.00 0.00 H new ATOM 0 HA ASN A 50 0.845 10.510 3.153 1.00 0.00 H new ATOM 0 HB2 ASN A 50 1.249 10.795 5.780 1.00 0.00 H new ATOM 0 HB3 ASN A 50 2.444 11.305 4.604 1.00 0.00 H new ATOM 0 HD21 ASN A 50 2.185 14.766 5.290 1.00 0.00 H new ATOM 0 HD22 ASN A 50 2.836 13.509 4.233 1.00 0.00 H new ATOM 782 N PRO A 51 -1.622 9.966 3.579 1.00 0.00 N ATOM 783 CA PRO A 51 -2.898 9.367 3.982 1.00 0.00 C ATOM 784 C PRO A 51 -2.714 8.223 4.973 1.00 0.00 C ATOM 785 O PRO A 51 -1.672 7.568 4.994 1.00 0.00 O ATOM 786 CB PRO A 51 -3.475 8.845 2.664 1.00 0.00 C ATOM 787 CG PRO A 51 -2.288 8.615 1.794 1.00 0.00 C ATOM 788 CD PRO A 51 -1.284 9.667 2.177 1.00 0.00 C ATOM 0 HA PRO A 51 -3.542 10.083 4.492 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -4.039 7.924 2.816 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -4.159 9.567 2.218 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -1.882 7.615 1.944 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -2.555 8.696 0.740 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -0.262 9.302 2.079 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -1.368 10.552 1.546 1.00 0.00 H new ATOM 796 N VAL A 52 -3.733 7.989 5.794 1.00 0.00 N ATOM 797 CA VAL A 52 -3.685 6.923 6.788 1.00 0.00 C ATOM 798 C VAL A 52 -4.895 6.003 6.667 1.00 0.00 C ATOM 799 O VAL A 52 -5.993 6.346 7.104 1.00 0.00 O ATOM 800 CB VAL A 52 -3.626 7.491 8.218 1.00 0.00 C ATOM 801 CG1 VAL A 52 -3.657 6.366 9.241 1.00 0.00 C ATOM 802 CG2 VAL A 52 -2.385 8.353 8.398 1.00 0.00 C ATOM 0 H VAL A 52 -4.602 8.523 5.790 1.00 0.00 H new ATOM 0 HA VAL A 52 -2.777 6.351 6.595 1.00 0.00 H new ATOM 0 HB VAL A 52 -4.503 8.119 8.378 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -3.614 6.787 10.246 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -4.578 5.794 9.126 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -2.801 5.710 9.086 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.359 8.746 9.414 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.494 7.750 8.220 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -2.411 9.181 7.689 1.00 0.00 H new ATOM 812 N TRP A 53 -4.685 4.835 6.072 1.00 0.00 N ATOM 813 CA TRP A 53 -5.760 3.865 5.894 1.00 0.00 C ATOM 814 C TRP A 53 -5.831 2.908 7.079 1.00 0.00 C ATOM 815 O TRP A 53 -6.899 2.692 7.650 1.00 0.00 O ATOM 816 CB TRP A 53 -5.555 3.078 4.599 1.00 0.00 C ATOM 817 CG TRP A 53 -5.562 3.939 3.372 1.00 0.00 C ATOM 818 CD1 TRP A 53 -6.659 4.411 2.709 1.00 0.00 C ATOM 819 CD2 TRP A 53 -4.420 4.430 2.663 1.00 0.00 C ATOM 820 NE1 TRP A 53 -6.267 5.166 1.630 1.00 0.00 N ATOM 821 CE2 TRP A 53 -4.898 5.193 1.580 1.00 0.00 C ATOM 822 CE3 TRP A 53 -3.039 4.300 2.838 1.00 0.00 C ATOM 823 CZ2 TRP A 53 -4.044 5.822 0.677 1.00 0.00 C ATOM 824 CZ3 TRP A 53 -2.193 4.924 1.941 1.00 0.00 C ATOM 825 CH2 TRP A 53 -2.697 5.678 0.873 1.00 0.00 C ATOM 0 H TRP A 53 -3.782 4.536 5.705 1.00 0.00 H new ATOM 0 HA TRP A 53 -6.702 4.410 5.834 1.00 0.00 H new ATOM 0 HB2 TRP A 53 -4.607 2.544 4.654 1.00 0.00 H new ATOM 0 HB3 TRP A 53 -6.340 2.327 4.511 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -7.684 4.219 2.991 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -6.893 5.631 0.973 1.00 0.00 H new ATOM 0 HE3 TRP A 53 -2.641 3.723 3.659 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 -4.431 6.402 -0.148 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 -1.124 4.829 2.065 1.00 0.00 H new ATOM 0 HH2 TRP A 53 -2.009 6.155 0.191 1.00 0.00 H new ATOM 836 N ASN A 54 -4.687 2.337 7.443 1.00 0.00 N ATOM 837 CA ASN A 54 -4.621 1.402 8.560 1.00 0.00 C ATOM 838 C ASN A 54 -5.680 0.312 8.421 1.00 0.00 C ATOM 839 O ASN A 54 -6.115 -0.274 9.412 1.00 0.00 O ATOM 840 CB ASN A 54 -4.809 2.145 9.885 1.00 0.00 C ATOM 841 CG ASN A 54 -4.050 1.494 11.025 1.00 0.00 C ATOM 842 OD1 ASN A 54 -3.088 2.219 11.586 1.00 0.00 O flip ATOM 843 ND2 ASN A 54 -4.324 0.353 11.397 1.00 0.00 N flip ATOM 0 H ASN A 54 -3.794 2.506 6.981 1.00 0.00 H new ATOM 0 HA ASN A 54 -3.638 0.932 8.550 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -4.474 3.176 9.771 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -5.870 2.180 10.132 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -5.071 -0.168 10.937 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -3.804 -0.072 12.165 1.00 0.00 H new ATOM 850 N GLU A 55 -6.089 0.046 7.185 1.00 0.00 N ATOM 851 CA GLU A 55 -7.096 -0.973 6.917 1.00 0.00 C ATOM 852 C GLU A 55 -6.444 -2.328 6.658 1.00 0.00 C ATOM 853 O GLU A 55 -5.219 -2.442 6.624 1.00 0.00 O ATOM 854 CB GLU A 55 -7.954 -0.570 5.715 1.00 0.00 C ATOM 855 CG GLU A 55 -7.404 -1.055 4.385 1.00 0.00 C ATOM 856 CD GLU A 55 -8.330 -0.747 3.224 1.00 0.00 C ATOM 857 OE1 GLU A 55 -8.998 0.308 3.262 1.00 0.00 O ATOM 858 OE2 GLU A 55 -8.387 -1.560 2.278 1.00 0.00 O ATOM 0 H GLU A 55 -5.739 0.522 6.354 1.00 0.00 H new ATOM 0 HA GLU A 55 -7.733 -1.058 7.797 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -8.961 -0.966 5.849 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -8.040 0.516 5.689 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -6.435 -0.590 4.205 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -7.236 -2.131 4.436 1.00 0.00 H new ATOM 865 N ILE A 56 -7.272 -3.352 6.478 1.00 0.00 N ATOM 866 CA ILE A 56 -6.776 -4.698 6.222 1.00 0.00 C ATOM 867 C ILE A 56 -7.472 -5.320 5.016 1.00 0.00 C ATOM 868 O ILE A 56 -8.694 -5.475 5.002 1.00 0.00 O ATOM 869 CB ILE A 56 -6.977 -5.613 7.444 1.00 0.00 C ATOM 870 CG1 ILE A 56 -6.403 -4.955 8.701 1.00 0.00 C ATOM 871 CG2 ILE A 56 -6.325 -6.967 7.205 1.00 0.00 C ATOM 872 CD1 ILE A 56 -6.807 -5.648 9.984 1.00 0.00 C ATOM 0 H ILE A 56 -8.289 -3.275 6.505 1.00 0.00 H new ATOM 0 HA ILE A 56 -5.709 -4.608 6.017 1.00 0.00 H new ATOM 0 HB ILE A 56 -8.046 -5.767 7.592 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.315 -4.943 8.631 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -6.731 -3.916 8.740 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.476 -7.602 8.078 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -6.775 -7.438 6.331 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -5.257 -6.832 7.035 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -6.364 -5.128 10.833 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -7.893 -5.637 10.077 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -6.455 -6.680 9.967 1.00 0.00 H new ATOM 884 N LEU A 57 -6.686 -5.677 4.006 1.00 0.00 N ATOM 885 CA LEU A 57 -7.226 -6.285 2.794 1.00 0.00 C ATOM 886 C LEU A 57 -6.925 -7.780 2.755 1.00 0.00 C ATOM 887 O LEU A 57 -5.935 -8.238 3.323 1.00 0.00 O ATOM 888 CB LEU A 57 -6.644 -5.603 1.555 1.00 0.00 C ATOM 889 CG LEU A 57 -6.906 -4.102 1.429 1.00 0.00 C ATOM 890 CD1 LEU A 57 -5.815 -3.437 0.605 1.00 0.00 C ATOM 891 CD2 LEU A 57 -8.273 -3.850 0.810 1.00 0.00 C ATOM 0 H LEU A 57 -5.673 -5.556 4.002 1.00 0.00 H new ATOM 0 HA LEU A 57 -8.308 -6.151 2.800 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -5.566 -5.765 1.548 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -7.046 -6.097 0.670 1.00 0.00 H new ATOM 0 HG LEU A 57 -6.895 -3.665 2.428 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -6.018 -2.369 0.526 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.850 -3.588 1.089 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -5.793 -3.877 -0.392 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -8.443 -2.776 0.728 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -8.312 -4.301 -0.182 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -9.045 -4.292 1.440 1.00 0.00 H new ATOM 903 N GLU A 58 -7.786 -8.534 2.079 1.00 0.00 N ATOM 904 CA GLU A 58 -7.611 -9.977 1.964 1.00 0.00 C ATOM 905 C GLU A 58 -7.947 -10.456 0.555 1.00 0.00 C ATOM 906 O GLU A 58 -8.597 -9.748 -0.215 1.00 0.00 O ATOM 907 CB GLU A 58 -8.491 -10.702 2.984 1.00 0.00 C ATOM 908 CG GLU A 58 -8.669 -9.939 4.286 1.00 0.00 C ATOM 909 CD GLU A 58 -9.859 -8.999 4.253 1.00 0.00 C ATOM 910 OE1 GLU A 58 -10.706 -9.145 3.348 1.00 0.00 O ATOM 911 OE2 GLU A 58 -9.941 -8.116 5.133 1.00 0.00 O ATOM 0 H GLU A 58 -8.611 -8.170 1.603 1.00 0.00 H new ATOM 0 HA GLU A 58 -6.565 -10.207 2.167 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -9.471 -10.883 2.542 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -8.054 -11.677 3.201 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -8.793 -10.648 5.104 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -7.765 -9.367 4.494 1.00 0.00 H new ATOM 918 N PHE A 59 -7.500 -11.663 0.224 1.00 0.00 N ATOM 919 CA PHE A 59 -7.751 -12.236 -1.093 1.00 0.00 C ATOM 920 C PHE A 59 -7.946 -13.747 -1.000 1.00 0.00 C ATOM 921 O PHE A 59 -7.391 -14.402 -0.117 1.00 0.00 O ATOM 922 CB PHE A 59 -6.594 -11.917 -2.041 1.00 0.00 C ATOM 923 CG PHE A 59 -6.487 -10.460 -2.388 1.00 0.00 C ATOM 924 CD1 PHE A 59 -6.068 -9.538 -1.442 1.00 0.00 C ATOM 925 CD2 PHE A 59 -6.807 -10.011 -3.659 1.00 0.00 C ATOM 926 CE1 PHE A 59 -5.968 -8.196 -1.757 1.00 0.00 C ATOM 927 CE2 PHE A 59 -6.709 -8.670 -3.980 1.00 0.00 C ATOM 928 CZ PHE A 59 -6.290 -7.761 -3.028 1.00 0.00 C ATOM 0 H PHE A 59 -6.962 -12.263 0.850 1.00 0.00 H new ATOM 0 HA PHE A 59 -8.666 -11.792 -1.486 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -5.660 -12.243 -1.584 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -6.717 -12.493 -2.958 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -5.817 -9.872 -0.446 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -7.137 -10.717 -4.407 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -5.639 -7.488 -1.011 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -6.960 -8.333 -4.975 1.00 0.00 H new ATOM 0 HZ PHE A 59 -6.214 -6.713 -3.277 1.00 0.00 H new ATOM 938 N ASP A 60 -8.737 -14.293 -1.916 1.00 0.00 N ATOM 939 CA ASP A 60 -9.005 -15.726 -1.939 1.00 0.00 C ATOM 940 C ASP A 60 -8.153 -16.422 -2.996 1.00 0.00 C ATOM 941 O ASP A 60 -8.183 -16.056 -4.172 1.00 0.00 O ATOM 942 CB ASP A 60 -10.488 -15.986 -2.210 1.00 0.00 C ATOM 943 CG ASP A 60 -11.298 -16.100 -0.933 1.00 0.00 C ATOM 944 OD1 ASP A 60 -10.977 -16.976 -0.104 1.00 0.00 O ATOM 945 OD2 ASP A 60 -12.255 -15.314 -0.765 1.00 0.00 O ATOM 0 H ASP A 60 -9.204 -13.765 -2.653 1.00 0.00 H new ATOM 0 HA ASP A 60 -8.745 -16.134 -0.962 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -10.890 -15.178 -2.821 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -10.593 -16.905 -2.787 1.00 0.00 H new ATOM 950 N LEU A 61 -7.394 -17.425 -2.570 1.00 0.00 N ATOM 951 CA LEU A 61 -6.532 -18.172 -3.480 1.00 0.00 C ATOM 952 C LEU A 61 -7.236 -19.424 -3.992 1.00 0.00 C ATOM 953 O LEU A 61 -6.894 -19.951 -5.051 1.00 0.00 O ATOM 954 CB LEU A 61 -5.229 -18.557 -2.778 1.00 0.00 C ATOM 955 CG LEU A 61 -4.512 -17.434 -2.028 1.00 0.00 C ATOM 956 CD1 LEU A 61 -3.314 -17.979 -1.267 1.00 0.00 C ATOM 957 CD2 LEU A 61 -4.081 -16.339 -2.993 1.00 0.00 C ATOM 0 H LEU A 61 -7.358 -17.740 -1.601 1.00 0.00 H new ATOM 0 HA LEU A 61 -6.303 -17.532 -4.332 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.444 -19.359 -2.072 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -4.545 -18.963 -3.523 1.00 0.00 H new ATOM 0 HG LEU A 61 -5.207 -17.003 -1.308 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.817 -17.165 -0.740 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.649 -18.726 -0.548 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -2.616 -18.437 -1.967 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.572 -15.548 -2.442 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -3.403 -16.756 -3.738 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.959 -15.927 -3.492 1.00 0.00 H new ATOM 969 N ARG A 62 -8.222 -19.894 -3.235 1.00 0.00 N ATOM 970 CA ARG A 62 -8.975 -21.084 -3.613 1.00 0.00 C ATOM 971 C ARG A 62 -8.090 -22.326 -3.567 1.00 0.00 C ATOM 972 O ARG A 62 -8.285 -23.268 -4.333 1.00 0.00 O ATOM 973 CB ARG A 62 -9.565 -20.916 -5.015 1.00 0.00 C ATOM 974 CG ARG A 62 -10.333 -19.618 -5.201 1.00 0.00 C ATOM 975 CD ARG A 62 -10.382 -19.205 -6.664 1.00 0.00 C ATOM 976 NE ARG A 62 -11.486 -18.288 -6.937 1.00 0.00 N ATOM 977 CZ ARG A 62 -11.504 -17.445 -7.963 1.00 0.00 C ATOM 978 NH1 ARG A 62 -10.484 -17.403 -8.809 1.00 0.00 N ATOM 979 NH2 ARG A 62 -12.545 -16.642 -8.145 1.00 0.00 N ATOM 0 H ARG A 62 -8.518 -19.469 -2.356 1.00 0.00 H new ATOM 0 HA ARG A 62 -9.787 -21.212 -2.897 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.758 -20.959 -5.747 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -10.230 -21.755 -5.223 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -11.348 -19.737 -4.821 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -9.863 -18.829 -4.614 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -9.440 -18.730 -6.938 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -10.485 -20.093 -7.288 1.00 0.00 H new ATOM 0 HE ARG A 62 -12.287 -18.296 -6.305 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -9.683 -18.019 -8.673 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -10.501 -16.755 -9.596 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -13.332 -16.672 -7.497 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -12.558 -15.995 -8.933 1.00 0.00 H new ATOM 993 N GLY A 63 -7.115 -22.318 -2.663 1.00 0.00 N ATOM 994 CA GLY A 63 -6.214 -23.448 -2.534 1.00 0.00 C ATOM 995 C GLY A 63 -4.958 -23.286 -3.367 1.00 0.00 C ATOM 996 O GLY A 63 -4.051 -24.117 -3.304 1.00 0.00 O ATOM 0 H GLY A 63 -6.933 -21.549 -2.018 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -5.938 -23.571 -1.487 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.732 -24.358 -2.836 1.00 0.00 H new ATOM 1000 N ILE A 64 -4.904 -22.215 -4.152 1.00 0.00 N ATOM 1001 CA ILE A 64 -3.751 -21.948 -5.002 1.00 0.00 C ATOM 1002 C ILE A 64 -2.626 -21.290 -4.210 1.00 0.00 C ATOM 1003 O ILE A 64 -2.732 -20.146 -3.765 1.00 0.00 O ATOM 1004 CB ILE A 64 -4.124 -21.042 -6.190 1.00 0.00 C ATOM 1005 CG1 ILE A 64 -5.144 -21.742 -7.092 1.00 0.00 C ATOM 1006 CG2 ILE A 64 -2.880 -20.666 -6.981 1.00 0.00 C ATOM 1007 CD1 ILE A 64 -4.611 -22.998 -7.744 1.00 0.00 C ATOM 0 H ILE A 64 -5.646 -21.518 -4.217 1.00 0.00 H new ATOM 0 HA ILE A 64 -3.411 -22.911 -5.383 1.00 0.00 H new ATOM 0 HB ILE A 64 -4.575 -20.128 -5.803 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -6.026 -21.994 -6.503 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -5.467 -21.048 -7.868 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -3.160 -20.026 -7.817 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.184 -20.133 -6.333 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -2.403 -21.570 -7.360 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -5.387 -23.441 -8.368 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -3.747 -22.749 -8.360 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -4.314 -23.710 -6.974 1.00 0.00 H new ATOM 1019 N PRO A 65 -1.520 -22.026 -4.029 1.00 0.00 N ATOM 1020 CA PRO A 65 -0.352 -21.534 -3.293 1.00 0.00 C ATOM 1021 C PRO A 65 0.387 -20.433 -4.046 1.00 0.00 C ATOM 1022 O PRO A 65 0.059 -20.123 -5.192 1.00 0.00 O ATOM 1023 CB PRO A 65 0.533 -22.776 -3.159 1.00 0.00 C ATOM 1024 CG PRO A 65 0.142 -23.644 -4.305 1.00 0.00 C ATOM 1025 CD PRO A 65 -1.324 -23.397 -4.531 1.00 0.00 C ATOM 0 HA PRO A 65 -0.631 -21.088 -2.339 1.00 0.00 H new ATOM 0 HB2 PRO A 65 1.590 -22.515 -3.202 1.00 0.00 H new ATOM 0 HB3 PRO A 65 0.368 -23.279 -2.206 1.00 0.00 H new ATOM 0 HG2 PRO A 65 0.721 -23.399 -5.195 1.00 0.00 H new ATOM 0 HG3 PRO A 65 0.331 -24.694 -4.081 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -1.588 -23.481 -5.585 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -1.941 -24.115 -3.990 1.00 0.00 H new ATOM 1033 N LEU A 66 1.384 -19.844 -3.395 1.00 0.00 N ATOM 1034 CA LEU A 66 2.170 -18.777 -4.004 1.00 0.00 C ATOM 1035 C LEU A 66 3.469 -19.323 -4.589 1.00 0.00 C ATOM 1036 O LEU A 66 4.023 -20.302 -4.090 1.00 0.00 O ATOM 1037 CB LEU A 66 2.479 -17.692 -2.971 1.00 0.00 C ATOM 1038 CG LEU A 66 1.320 -16.764 -2.605 1.00 0.00 C ATOM 1039 CD1 LEU A 66 1.768 -15.726 -1.587 1.00 0.00 C ATOM 1040 CD2 LEU A 66 0.765 -16.087 -3.850 1.00 0.00 C ATOM 0 H LEU A 66 1.667 -20.087 -2.446 1.00 0.00 H new ATOM 0 HA LEU A 66 1.583 -18.343 -4.814 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.832 -18.176 -2.060 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.301 -17.083 -3.348 1.00 0.00 H new ATOM 0 HG LEU A 66 0.527 -17.364 -2.158 1.00 0.00 H new ATOM 0 HD11 LEU A 66 0.930 -15.075 -1.339 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.117 -16.228 -0.685 1.00 0.00 H new ATOM 0 HD13 LEU A 66 2.578 -15.130 -2.007 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.059 -15.430 -3.570 1.00 0.00 H new ATOM 0 HD22 LEU A 66 1.551 -15.501 -4.326 1.00 0.00 H new ATOM 0 HD23 LEU A 66 0.405 -16.844 -4.546 1.00 0.00 H new ATOM 1052 N ASP A 67 3.950 -18.681 -5.648 1.00 0.00 N ATOM 1053 CA ASP A 67 5.186 -19.100 -6.300 1.00 0.00 C ATOM 1054 C ASP A 67 6.187 -17.950 -6.357 1.00 0.00 C ATOM 1055 O ASP A 67 5.862 -16.812 -6.015 1.00 0.00 O ATOM 1056 CB ASP A 67 4.895 -19.610 -7.712 1.00 0.00 C ATOM 1057 CG ASP A 67 6.110 -20.244 -8.360 1.00 0.00 C ATOM 1058 OD1 ASP A 67 6.856 -20.954 -7.653 1.00 0.00 O ATOM 1059 OD2 ASP A 67 6.314 -20.032 -9.573 1.00 0.00 O ATOM 0 H ASP A 67 3.503 -17.869 -6.073 1.00 0.00 H new ATOM 0 HA ASP A 67 5.622 -19.908 -5.713 1.00 0.00 H new ATOM 0 HB2 ASP A 67 4.086 -20.339 -7.672 1.00 0.00 H new ATOM 0 HB3 ASP A 67 4.548 -18.782 -8.330 1.00 0.00 H new ATOM 1064 N PHE A 68 7.406 -18.254 -6.789 1.00 0.00 N ATOM 1065 CA PHE A 68 8.455 -17.247 -6.889 1.00 0.00 C ATOM 1066 C PHE A 68 8.049 -16.131 -7.847 1.00 0.00 C ATOM 1067 O PHE A 68 8.360 -14.961 -7.623 1.00 0.00 O ATOM 1068 CB PHE A 68 9.763 -17.887 -7.359 1.00 0.00 C ATOM 1069 CG PHE A 68 10.244 -18.993 -6.464 1.00 0.00 C ATOM 1070 CD1 PHE A 68 10.406 -18.782 -5.104 1.00 0.00 C ATOM 1071 CD2 PHE A 68 10.535 -20.245 -6.983 1.00 0.00 C ATOM 1072 CE1 PHE A 68 10.848 -19.798 -4.278 1.00 0.00 C ATOM 1073 CE2 PHE A 68 10.977 -21.265 -6.162 1.00 0.00 C ATOM 1074 CZ PHE A 68 11.135 -21.041 -4.808 1.00 0.00 C ATOM 0 H PHE A 68 7.692 -19.190 -7.076 1.00 0.00 H new ATOM 0 HA PHE A 68 8.605 -16.816 -5.899 1.00 0.00 H new ATOM 0 HB2 PHE A 68 9.625 -18.280 -8.366 1.00 0.00 H new ATOM 0 HB3 PHE A 68 10.533 -17.118 -7.419 1.00 0.00 H new ATOM 0 HD1 PHE A 68 10.184 -17.812 -4.685 1.00 0.00 H new ATOM 0 HD2 PHE A 68 10.415 -20.425 -8.041 1.00 0.00 H new ATOM 0 HE1 PHE A 68 10.969 -19.620 -3.220 1.00 0.00 H new ATOM 0 HE2 PHE A 68 11.199 -22.236 -6.579 1.00 0.00 H new ATOM 0 HZ PHE A 68 11.482 -21.836 -4.165 1.00 0.00 H new ATOM 1084 N SER A 69 7.352 -16.502 -8.917 1.00 0.00 N ATOM 1085 CA SER A 69 6.907 -15.535 -9.912 1.00 0.00 C ATOM 1086 C SER A 69 5.858 -14.595 -9.325 1.00 0.00 C ATOM 1087 O SER A 69 5.809 -13.412 -9.664 1.00 0.00 O ATOM 1088 CB SER A 69 6.335 -16.255 -11.135 1.00 0.00 C ATOM 1089 OG SER A 69 5.784 -15.333 -12.059 1.00 0.00 O ATOM 0 H SER A 69 7.084 -17.466 -9.116 1.00 0.00 H new ATOM 0 HA SER A 69 7.770 -14.943 -10.218 1.00 0.00 H new ATOM 0 HB2 SER A 69 7.120 -16.835 -11.620 1.00 0.00 H new ATOM 0 HB3 SER A 69 5.567 -16.961 -10.819 1.00 0.00 H new ATOM 0 HG SER A 69 5.427 -15.818 -12.832 1.00 0.00 H new ATOM 1095 N SER A 70 5.021 -15.130 -8.442 1.00 0.00 N ATOM 1096 CA SER A 70 3.970 -14.341 -7.810 1.00 0.00 C ATOM 1097 C SER A 70 4.479 -12.949 -7.449 1.00 0.00 C ATOM 1098 O SER A 70 5.670 -12.754 -7.209 1.00 0.00 O ATOM 1099 CB SER A 70 3.457 -15.050 -6.555 1.00 0.00 C ATOM 1100 OG SER A 70 2.099 -14.728 -6.307 1.00 0.00 O ATOM 0 H SER A 70 5.050 -16.106 -8.148 1.00 0.00 H new ATOM 0 HA SER A 70 3.150 -14.236 -8.521 1.00 0.00 H new ATOM 0 HB2 SER A 70 3.563 -16.128 -6.674 1.00 0.00 H new ATOM 0 HB3 SER A 70 4.065 -14.763 -5.697 1.00 0.00 H new ATOM 0 HG SER A 70 1.540 -15.514 -6.478 1.00 0.00 H new ATOM 1106 N SER A 71 3.566 -11.983 -7.414 1.00 0.00 N ATOM 1107 CA SER A 71 3.921 -10.607 -7.086 1.00 0.00 C ATOM 1108 C SER A 71 2.672 -9.742 -6.947 1.00 0.00 C ATOM 1109 O SER A 71 1.664 -9.973 -7.616 1.00 0.00 O ATOM 1110 CB SER A 71 4.840 -10.026 -8.162 1.00 0.00 C ATOM 1111 OG SER A 71 4.286 -10.200 -9.455 1.00 0.00 O ATOM 0 H SER A 71 2.575 -12.128 -7.609 1.00 0.00 H new ATOM 0 HA SER A 71 4.447 -10.611 -6.131 1.00 0.00 H new ATOM 0 HB2 SER A 71 5.002 -8.965 -7.972 1.00 0.00 H new ATOM 0 HB3 SER A 71 5.815 -10.511 -8.112 1.00 0.00 H new ATOM 0 HG SER A 71 4.892 -9.819 -10.124 1.00 0.00 H new ATOM 1117 N LEU A 72 2.745 -8.745 -6.072 1.00 0.00 N ATOM 1118 CA LEU A 72 1.621 -7.844 -5.843 1.00 0.00 C ATOM 1119 C LEU A 72 1.839 -6.511 -6.552 1.00 0.00 C ATOM 1120 O LEU A 72 2.954 -5.993 -6.593 1.00 0.00 O ATOM 1121 CB LEU A 72 1.426 -7.611 -4.344 1.00 0.00 C ATOM 1122 CG LEU A 72 0.059 -7.073 -3.921 1.00 0.00 C ATOM 1123 CD1 LEU A 72 -0.946 -8.208 -3.795 1.00 0.00 C ATOM 1124 CD2 LEU A 72 0.169 -6.308 -2.610 1.00 0.00 C ATOM 0 H LEU A 72 3.571 -8.540 -5.509 1.00 0.00 H new ATOM 0 HA LEU A 72 0.724 -8.310 -6.252 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.600 -8.553 -3.825 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.190 -6.913 -4.003 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.294 -6.387 -4.691 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -1.913 -7.806 -3.493 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.047 -8.713 -4.756 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.599 -8.920 -3.046 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -0.814 -5.932 -2.324 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.544 -6.972 -1.831 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.856 -5.471 -2.734 1.00 0.00 H new ATOM 1136 N GLY A 73 0.764 -5.960 -7.108 1.00 0.00 N ATOM 1137 CA GLY A 73 0.858 -4.691 -7.806 1.00 0.00 C ATOM 1138 C GLY A 73 0.259 -3.547 -7.012 1.00 0.00 C ATOM 1139 O GLY A 73 -0.950 -3.510 -6.780 1.00 0.00 O ATOM 0 H GLY A 73 -0.170 -6.370 -7.087 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.905 -4.473 -8.018 1.00 0.00 H new ATOM 0 HA3 GLY A 73 0.348 -4.769 -8.766 1.00 0.00 H new ATOM 1143 N ILE A 74 1.105 -2.612 -6.593 1.00 0.00 N ATOM 1144 CA ILE A 74 0.651 -1.462 -5.821 1.00 0.00 C ATOM 1145 C ILE A 74 0.594 -0.207 -6.685 1.00 0.00 C ATOM 1146 O ILE A 74 1.627 0.346 -7.063 1.00 0.00 O ATOM 1147 CB ILE A 74 1.569 -1.199 -4.612 1.00 0.00 C ATOM 1148 CG1 ILE A 74 1.490 -2.361 -3.621 1.00 0.00 C ATOM 1149 CG2 ILE A 74 1.189 0.109 -3.934 1.00 0.00 C ATOM 1150 CD1 ILE A 74 0.089 -2.633 -3.118 1.00 0.00 C ATOM 0 H ILE A 74 2.108 -2.628 -6.775 1.00 0.00 H new ATOM 0 HA ILE A 74 -0.351 -1.698 -5.462 1.00 0.00 H new ATOM 0 HB ILE A 74 2.597 -1.118 -4.966 1.00 0.00 H new ATOM 0 HG12 ILE A 74 1.877 -3.261 -4.098 1.00 0.00 H new ATOM 0 HG13 ILE A 74 2.137 -2.147 -2.771 1.00 0.00 H new ATOM 0 HG21 ILE A 74 1.846 0.281 -3.082 1.00 0.00 H new ATOM 0 HG22 ILE A 74 1.292 0.930 -4.644 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.156 0.054 -3.590 1.00 0.00 H new ATOM 0 HD11 ILE A 74 0.109 -3.470 -2.420 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.294 -1.747 -2.612 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -0.559 -2.879 -3.960 1.00 0.00 H new ATOM 1162 N ILE A 75 -0.619 0.239 -6.991 1.00 0.00 N ATOM 1163 CA ILE A 75 -0.811 1.431 -7.808 1.00 0.00 C ATOM 1164 C ILE A 75 -1.538 2.521 -7.028 1.00 0.00 C ATOM 1165 O ILE A 75 -2.657 2.320 -6.555 1.00 0.00 O ATOM 1166 CB ILE A 75 -1.607 1.114 -9.088 1.00 0.00 C ATOM 1167 CG1 ILE A 75 -1.028 -0.120 -9.782 1.00 0.00 C ATOM 1168 CG2 ILE A 75 -1.596 2.311 -10.028 1.00 0.00 C ATOM 1169 CD1 ILE A 75 -2.007 -0.808 -10.708 1.00 0.00 C ATOM 0 H ILE A 75 -1.484 -0.207 -6.686 1.00 0.00 H new ATOM 0 HA ILE A 75 0.181 1.786 -8.085 1.00 0.00 H new ATOM 0 HB ILE A 75 -2.640 0.902 -8.813 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -0.146 0.174 -10.352 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -0.696 -0.830 -9.025 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -2.162 2.072 -10.928 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -2.050 3.168 -9.531 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -0.568 2.551 -10.299 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.528 -1.674 -11.165 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.878 -1.133 -10.140 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -2.320 -0.113 -11.487 1.00 0.00 H new ATOM 1181 N VAL A 76 -0.895 3.677 -6.898 1.00 0.00 N ATOM 1182 CA VAL A 76 -1.481 4.801 -6.177 1.00 0.00 C ATOM 1183 C VAL A 76 -1.807 5.951 -7.124 1.00 0.00 C ATOM 1184 O VAL A 76 -0.914 6.542 -7.732 1.00 0.00 O ATOM 1185 CB VAL A 76 -0.538 5.312 -5.072 1.00 0.00 C ATOM 1186 CG1 VAL A 76 -1.154 6.503 -4.353 1.00 0.00 C ATOM 1187 CG2 VAL A 76 -0.213 4.196 -4.091 1.00 0.00 C ATOM 0 H VAL A 76 0.032 3.860 -7.283 1.00 0.00 H new ATOM 0 HA VAL A 76 -2.402 4.439 -5.719 1.00 0.00 H new ATOM 0 HB VAL A 76 0.393 5.640 -5.535 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -0.473 6.850 -3.576 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.331 7.308 -5.067 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.100 6.205 -3.901 1.00 0.00 H new ATOM 0 HG21 VAL A 76 0.454 4.575 -3.317 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -1.134 3.836 -3.632 1.00 0.00 H new ATOM 0 HG23 VAL A 76 0.273 3.377 -4.620 1.00 0.00 H new ATOM 1197 N LYS A 77 -3.092 6.264 -7.245 1.00 0.00 N ATOM 1198 CA LYS A 77 -3.538 7.345 -8.116 1.00 0.00 C ATOM 1199 C LYS A 77 -4.393 8.347 -7.347 1.00 0.00 C ATOM 1200 O LYS A 77 -4.639 8.178 -6.152 1.00 0.00 O ATOM 1201 CB LYS A 77 -4.333 6.781 -9.296 1.00 0.00 C ATOM 1202 CG LYS A 77 -3.499 5.932 -10.241 1.00 0.00 C ATOM 1203 CD LYS A 77 -4.374 5.064 -11.130 1.00 0.00 C ATOM 1204 CE LYS A 77 -3.539 4.230 -12.089 1.00 0.00 C ATOM 1205 NZ LYS A 77 -3.290 4.943 -13.372 1.00 0.00 N ATOM 0 H LYS A 77 -3.844 5.784 -6.750 1.00 0.00 H new ATOM 0 HA LYS A 77 -2.655 7.861 -8.493 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -5.158 6.180 -8.913 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -4.773 7.607 -9.855 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -2.878 6.579 -10.860 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.824 5.300 -9.664 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -4.985 4.407 -10.511 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -5.059 5.695 -11.696 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -2.587 3.983 -11.620 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -4.049 3.288 -12.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -2.718 4.341 -13.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -4.198 5.157 -13.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -2.780 5.830 -13.183 1.00 0.00 H new ATOM 1219 N ASP A 78 -4.843 9.387 -8.038 1.00 0.00 N ATOM 1220 CA ASP A 78 -5.673 10.415 -7.420 1.00 0.00 C ATOM 1221 C ASP A 78 -7.144 10.205 -7.764 1.00 0.00 C ATOM 1222 O ASP A 78 -7.565 10.421 -8.901 1.00 0.00 O ATOM 1223 CB ASP A 78 -5.224 11.805 -7.875 1.00 0.00 C ATOM 1224 CG ASP A 78 -6.351 12.818 -7.837 1.00 0.00 C ATOM 1225 OD1 ASP A 78 -6.990 12.956 -6.773 1.00 0.00 O ATOM 1226 OD2 ASP A 78 -6.593 13.475 -8.871 1.00 0.00 O ATOM 0 H ASP A 78 -4.647 9.541 -9.027 1.00 0.00 H new ATOM 0 HA ASP A 78 -5.557 10.340 -6.339 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -4.410 12.148 -7.237 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -4.829 11.742 -8.889 1.00 0.00 H new ATOM 1231 N PHE A 79 -7.923 9.781 -6.774 1.00 0.00 N ATOM 1232 CA PHE A 79 -9.347 9.539 -6.971 1.00 0.00 C ATOM 1233 C PHE A 79 -9.935 10.533 -7.969 1.00 0.00 C ATOM 1234 O PHE A 79 -10.554 10.142 -8.958 1.00 0.00 O ATOM 1235 CB PHE A 79 -10.093 9.636 -5.639 1.00 0.00 C ATOM 1236 CG PHE A 79 -11.511 9.148 -5.708 1.00 0.00 C ATOM 1237 CD1 PHE A 79 -11.791 7.790 -5.713 1.00 0.00 C ATOM 1238 CD2 PHE A 79 -12.565 10.045 -5.767 1.00 0.00 C ATOM 1239 CE1 PHE A 79 -13.095 7.338 -5.777 1.00 0.00 C ATOM 1240 CE2 PHE A 79 -13.872 9.598 -5.831 1.00 0.00 C ATOM 1241 CZ PHE A 79 -14.137 8.243 -5.835 1.00 0.00 C ATOM 0 H PHE A 79 -7.591 9.598 -5.827 1.00 0.00 H new ATOM 0 HA PHE A 79 -9.466 8.533 -7.373 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -9.555 9.058 -4.888 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -10.090 10.674 -5.305 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -10.981 7.078 -5.666 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -12.364 11.106 -5.763 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -13.300 6.278 -5.782 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -14.685 10.308 -5.878 1.00 0.00 H new ATOM 0 HZ PHE A 79 -15.157 7.891 -5.883 1.00 0.00 H new ATOM 1378 N ILE A 88 0.497 8.842 -9.686 1.00 0.00 N ATOM 1379 CA ILE A 88 1.369 9.277 -8.601 1.00 0.00 C ATOM 1380 C ILE A 88 2.595 8.378 -8.487 1.00 0.00 C ATOM 1381 O ILE A 88 3.727 8.857 -8.443 1.00 0.00 O ATOM 1382 CB ILE A 88 0.626 9.287 -7.252 1.00 0.00 C ATOM 1383 CG1 ILE A 88 -0.536 10.282 -7.293 1.00 0.00 C ATOM 1384 CG2 ILE A 88 1.585 9.631 -6.123 1.00 0.00 C ATOM 1385 CD1 ILE A 88 -1.532 10.093 -6.170 1.00 0.00 C ATOM 0 HA ILE A 88 1.687 10.292 -8.839 1.00 0.00 H new ATOM 0 HB ILE A 88 0.221 8.292 -7.069 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -0.138 11.296 -7.248 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -1.054 10.185 -8.247 1.00 0.00 H new ATOM 0 HG21 ILE A 88 1.046 9.634 -5.176 1.00 0.00 H new ATOM 0 HG22 ILE A 88 2.382 8.889 -6.084 1.00 0.00 H new ATOM 0 HG23 ILE A 88 2.015 10.617 -6.299 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -2.328 10.832 -6.262 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -1.958 9.091 -6.226 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -1.028 10.219 -5.212 1.00 0.00 H new ATOM 1397 N GLY A 89 2.361 7.070 -8.441 1.00 0.00 N ATOM 1398 CA GLY A 89 3.455 6.123 -8.335 1.00 0.00 C ATOM 1399 C GLY A 89 2.979 4.684 -8.326 1.00 0.00 C ATOM 1400 O GLY A 89 1.816 4.408 -8.031 1.00 0.00 O ATOM 0 H GLY A 89 1.432 6.649 -8.475 1.00 0.00 H new ATOM 0 HA2 GLY A 89 4.141 6.270 -9.169 1.00 0.00 H new ATOM 0 HA3 GLY A 89 4.016 6.322 -7.422 1.00 0.00 H new ATOM 1404 N THR A 90 3.880 3.762 -8.654 1.00 0.00 N ATOM 1405 CA THR A 90 3.545 2.344 -8.686 1.00 0.00 C ATOM 1406 C THR A 90 4.711 1.493 -8.197 1.00 0.00 C ATOM 1407 O THR A 90 5.852 1.689 -8.613 1.00 0.00 O ATOM 1408 CB THR A 90 3.154 1.891 -10.106 1.00 0.00 C ATOM 1409 OG1 THR A 90 4.293 1.954 -10.971 1.00 0.00 O ATOM 1410 CG2 THR A 90 2.039 2.763 -10.664 1.00 0.00 C ATOM 0 H THR A 90 4.847 3.973 -8.901 1.00 0.00 H new ATOM 0 HA THR A 90 2.693 2.205 -8.021 1.00 0.00 H new ATOM 0 HB THR A 90 2.797 0.863 -10.050 1.00 0.00 H new ATOM 0 HG1 THR A 90 4.731 2.825 -10.872 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.780 2.424 -11.667 1.00 0.00 H new ATOM 0 HG22 THR A 90 1.163 2.691 -10.019 1.00 0.00 H new ATOM 0 HG23 THR A 90 2.374 3.799 -10.706 1.00 0.00 H new ATOM 1418 N ALA A 91 4.415 0.547 -7.311 1.00 0.00 N ATOM 1419 CA ALA A 91 5.439 -0.336 -6.767 1.00 0.00 C ATOM 1420 C ALA A 91 4.999 -1.794 -6.835 1.00 0.00 C ATOM 1421 O ALA A 91 3.891 -2.140 -6.422 1.00 0.00 O ATOM 1422 CB ALA A 91 5.764 0.053 -5.332 1.00 0.00 C ATOM 0 H ALA A 91 3.475 0.373 -6.955 1.00 0.00 H new ATOM 0 HA ALA A 91 6.338 -0.226 -7.374 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.530 -0.615 -4.939 1.00 0.00 H new ATOM 0 HB2 ALA A 91 6.130 1.079 -5.307 1.00 0.00 H new ATOM 0 HB3 ALA A 91 4.865 -0.026 -4.721 1.00 0.00 H new ATOM 1428 N THR A 92 5.873 -2.648 -7.359 1.00 0.00 N ATOM 1429 CA THR A 92 5.573 -4.069 -7.483 1.00 0.00 C ATOM 1430 C THR A 92 6.311 -4.881 -6.424 1.00 0.00 C ATOM 1431 O THR A 92 7.535 -4.812 -6.316 1.00 0.00 O ATOM 1432 CB THR A 92 5.951 -4.603 -8.878 1.00 0.00 C ATOM 1433 OG1 THR A 92 5.279 -3.846 -9.890 1.00 0.00 O ATOM 1434 CG2 THR A 92 5.585 -6.074 -9.011 1.00 0.00 C ATOM 0 H THR A 92 6.795 -2.380 -7.704 1.00 0.00 H new ATOM 0 HA THR A 92 4.498 -4.179 -7.338 1.00 0.00 H new ATOM 0 HB THR A 92 7.029 -4.500 -9.003 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.526 -4.190 -10.774 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.861 -6.429 -10.004 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.120 -6.652 -8.257 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.511 -6.196 -8.867 1.00 0.00 H new ATOM 1442 N VAL A 93 5.558 -5.650 -5.644 1.00 0.00 N ATOM 1443 CA VAL A 93 6.140 -6.477 -4.594 1.00 0.00 C ATOM 1444 C VAL A 93 6.277 -7.926 -5.048 1.00 0.00 C ATOM 1445 O VAL A 93 5.381 -8.473 -5.690 1.00 0.00 O ATOM 1446 CB VAL A 93 5.293 -6.431 -3.309 1.00 0.00 C ATOM 1447 CG1 VAL A 93 5.884 -7.347 -2.247 1.00 0.00 C ATOM 1448 CG2 VAL A 93 5.186 -5.004 -2.793 1.00 0.00 C ATOM 0 H VAL A 93 4.543 -5.717 -5.720 1.00 0.00 H new ATOM 0 HA VAL A 93 7.129 -6.071 -4.383 1.00 0.00 H new ATOM 0 HB VAL A 93 4.289 -6.785 -3.543 1.00 0.00 H new ATOM 0 HG11 VAL A 93 5.272 -7.302 -1.346 1.00 0.00 H new ATOM 0 HG12 VAL A 93 5.905 -8.371 -2.620 1.00 0.00 H new ATOM 0 HG13 VAL A 93 6.899 -7.025 -2.013 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.584 -4.990 -1.884 1.00 0.00 H new ATOM 0 HG22 VAL A 93 6.183 -4.621 -2.574 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.715 -4.378 -3.550 1.00 0.00 H new ATOM 1458 N ALA A 94 7.405 -8.542 -4.710 1.00 0.00 N ATOM 1459 CA ALA A 94 7.658 -9.929 -5.080 1.00 0.00 C ATOM 1460 C ALA A 94 7.383 -10.869 -3.911 1.00 0.00 C ATOM 1461 O ALA A 94 8.139 -10.906 -2.939 1.00 0.00 O ATOM 1462 CB ALA A 94 9.091 -10.092 -5.565 1.00 0.00 C ATOM 0 H ALA A 94 8.158 -8.102 -4.181 1.00 0.00 H new ATOM 0 HA ALA A 94 6.979 -10.193 -5.891 1.00 0.00 H new ATOM 0 HB1 ALA A 94 9.267 -11.133 -5.838 1.00 0.00 H new ATOM 0 HB2 ALA A 94 9.255 -9.456 -6.435 1.00 0.00 H new ATOM 0 HB3 ALA A 94 9.779 -9.804 -4.770 1.00 0.00 H new ATOM 1468 N LEU A 95 6.296 -11.626 -4.010 1.00 0.00 N ATOM 1469 CA LEU A 95 5.920 -12.566 -2.960 1.00 0.00 C ATOM 1470 C LEU A 95 6.895 -13.738 -2.904 1.00 0.00 C ATOM 1471 O LEU A 95 6.776 -14.618 -2.051 1.00 0.00 O ATOM 1472 CB LEU A 95 4.499 -13.081 -3.195 1.00 0.00 C ATOM 1473 CG LEU A 95 3.437 -12.018 -3.475 1.00 0.00 C ATOM 1474 CD1 LEU A 95 2.147 -12.665 -3.955 1.00 0.00 C ATOM 1475 CD2 LEU A 95 3.184 -11.176 -2.233 1.00 0.00 C ATOM 0 H LEU A 95 5.659 -11.607 -4.807 1.00 0.00 H new ATOM 0 HA LEU A 95 5.957 -12.041 -2.006 1.00 0.00 H new ATOM 0 HB2 LEU A 95 4.520 -13.775 -4.035 1.00 0.00 H new ATOM 0 HB3 LEU A 95 4.191 -13.651 -2.318 1.00 0.00 H new ATOM 0 HG LEU A 95 3.806 -11.363 -4.264 1.00 0.00 H new ATOM 0 HD11 LEU A 95 1.403 -11.893 -4.149 1.00 0.00 H new ATOM 0 HD12 LEU A 95 2.339 -13.223 -4.872 1.00 0.00 H new ATOM 0 HD13 LEU A 95 1.773 -13.344 -3.189 1.00 0.00 H new ATOM 0 HD21 LEU A 95 2.425 -10.425 -2.451 1.00 0.00 H new ATOM 0 HD22 LEU A 95 2.837 -11.818 -1.423 1.00 0.00 H new ATOM 0 HD23 LEU A 95 4.108 -10.682 -1.934 1.00 0.00 H new ATOM 1487 N LYS A 96 7.861 -13.741 -3.816 1.00 0.00 N ATOM 1488 CA LYS A 96 8.860 -14.802 -3.869 1.00 0.00 C ATOM 1489 C LYS A 96 9.488 -15.027 -2.497 1.00 0.00 C ATOM 1490 O LYS A 96 10.022 -16.101 -2.217 1.00 0.00 O ATOM 1491 CB LYS A 96 9.948 -14.456 -4.888 1.00 0.00 C ATOM 1492 CG LYS A 96 10.883 -13.351 -4.428 1.00 0.00 C ATOM 1493 CD LYS A 96 12.078 -13.909 -3.674 1.00 0.00 C ATOM 1494 CE LYS A 96 13.298 -13.013 -3.822 1.00 0.00 C ATOM 1495 NZ LYS A 96 13.110 -11.702 -3.143 1.00 0.00 N ATOM 0 H LYS A 96 7.973 -13.020 -4.529 1.00 0.00 H new ATOM 0 HA LYS A 96 8.361 -15.721 -4.177 1.00 0.00 H new ATOM 0 HB2 LYS A 96 10.533 -15.351 -5.100 1.00 0.00 H new ATOM 0 HB3 LYS A 96 9.476 -14.155 -5.823 1.00 0.00 H new ATOM 0 HG2 LYS A 96 11.229 -12.783 -5.292 1.00 0.00 H new ATOM 0 HG3 LYS A 96 10.339 -12.657 -3.787 1.00 0.00 H new ATOM 0 HD2 LYS A 96 11.827 -14.013 -2.618 1.00 0.00 H new ATOM 0 HD3 LYS A 96 12.311 -14.907 -4.046 1.00 0.00 H new ATOM 0 HE2 LYS A 96 14.170 -13.516 -3.405 1.00 0.00 H new ATOM 0 HE3 LYS A 96 13.501 -12.848 -4.880 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 13.323 -10.932 -3.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.125 -11.617 -2.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 13.750 -11.640 -2.325 1.00 0.00 H new ATOM 1509 N ASP A 97 9.418 -14.010 -1.645 1.00 0.00 N ATOM 1510 CA ASP A 97 9.977 -14.099 -0.301 1.00 0.00 C ATOM 1511 C ASP A 97 8.948 -14.651 0.680 1.00 0.00 C ATOM 1512 O ASP A 97 9.301 -15.298 1.668 1.00 0.00 O ATOM 1513 CB ASP A 97 10.459 -12.724 0.166 1.00 0.00 C ATOM 1514 CG ASP A 97 11.899 -12.452 -0.222 1.00 0.00 C ATOM 1515 OD1 ASP A 97 12.606 -13.415 -0.587 1.00 0.00 O ATOM 1516 OD2 ASP A 97 12.319 -11.278 -0.160 1.00 0.00 O ATOM 0 H ASP A 97 8.980 -13.115 -1.861 1.00 0.00 H new ATOM 0 HA ASP A 97 10.826 -14.782 -0.332 1.00 0.00 H new ATOM 0 HB2 ASP A 97 9.819 -11.953 -0.263 1.00 0.00 H new ATOM 0 HB3 ASP A 97 10.359 -12.656 1.249 1.00 0.00 H new ATOM 1521 N LEU A 98 7.675 -14.391 0.403 1.00 0.00 N ATOM 1522 CA LEU A 98 6.594 -14.862 1.262 1.00 0.00 C ATOM 1523 C LEU A 98 6.221 -16.302 0.929 1.00 0.00 C ATOM 1524 O LEU A 98 5.621 -17.005 1.743 1.00 0.00 O ATOM 1525 CB LEU A 98 5.368 -13.958 1.114 1.00 0.00 C ATOM 1526 CG LEU A 98 5.595 -12.470 1.381 1.00 0.00 C ATOM 1527 CD1 LEU A 98 4.508 -11.637 0.720 1.00 0.00 C ATOM 1528 CD2 LEU A 98 5.642 -12.198 2.878 1.00 0.00 C ATOM 0 H LEU A 98 7.366 -13.857 -0.409 1.00 0.00 H new ATOM 0 HA LEU A 98 6.942 -14.826 2.294 1.00 0.00 H new ATOM 0 HB2 LEU A 98 4.979 -14.070 0.102 1.00 0.00 H new ATOM 0 HB3 LEU A 98 4.594 -14.315 1.794 1.00 0.00 H new ATOM 0 HG LEU A 98 6.555 -12.185 0.950 1.00 0.00 H new ATOM 0 HD11 LEU A 98 4.686 -10.581 0.921 1.00 0.00 H new ATOM 0 HD12 LEU A 98 4.522 -11.809 -0.356 1.00 0.00 H new ATOM 0 HD13 LEU A 98 3.536 -11.924 1.121 1.00 0.00 H new ATOM 0 HD21 LEU A 98 5.804 -11.134 3.050 1.00 0.00 H new ATOM 0 HD22 LEU A 98 4.698 -12.499 3.332 1.00 0.00 H new ATOM 0 HD23 LEU A 98 6.457 -12.766 3.326 1.00 0.00 H new ATOM 1540 N THR A 99 6.582 -16.739 -0.274 1.00 0.00 N ATOM 1541 CA THR A 99 6.287 -18.096 -0.715 1.00 0.00 C ATOM 1542 C THR A 99 6.921 -19.126 0.213 1.00 0.00 C ATOM 1543 O THR A 99 7.822 -18.807 0.987 1.00 0.00 O ATOM 1544 CB THR A 99 6.785 -18.340 -2.152 1.00 0.00 C ATOM 1545 OG1 THR A 99 8.192 -18.083 -2.233 1.00 0.00 O ATOM 1546 CG2 THR A 99 6.044 -17.453 -3.141 1.00 0.00 C ATOM 0 H THR A 99 7.080 -16.172 -0.960 1.00 0.00 H new ATOM 0 HA THR A 99 5.203 -18.208 -0.690 1.00 0.00 H new ATOM 0 HB THR A 99 6.591 -19.382 -2.408 1.00 0.00 H new ATOM 0 HG1 THR A 99 8.378 -17.177 -1.909 1.00 0.00 H new ATOM 0 HG21 THR A 99 6.413 -17.644 -4.149 1.00 0.00 H new ATOM 0 HG22 THR A 99 4.977 -17.672 -3.098 1.00 0.00 H new ATOM 0 HG23 THR A 99 6.210 -16.406 -2.886 1.00 0.00 H new ATOM 1554 N GLY A 100 6.444 -20.364 0.129 1.00 0.00 N ATOM 1555 CA GLY A 100 6.976 -21.423 0.967 1.00 0.00 C ATOM 1556 C GLY A 100 5.893 -22.333 1.509 1.00 0.00 C ATOM 1557 O GLY A 100 4.807 -22.427 0.937 1.00 0.00 O ATOM 0 H GLY A 100 5.699 -20.653 -0.504 1.00 0.00 H new ATOM 0 HA2 GLY A 100 7.688 -22.014 0.392 1.00 0.00 H new ATOM 0 HA3 GLY A 100 7.526 -20.982 1.799 1.00 0.00 H new ATOM 1561 N ASP A 101 6.188 -23.007 2.616 1.00 0.00 N ATOM 1562 CA ASP A 101 5.230 -23.916 3.236 1.00 0.00 C ATOM 1563 C ASP A 101 4.991 -23.540 4.695 1.00 0.00 C ATOM 1564 O ASP A 101 4.998 -24.399 5.575 1.00 0.00 O ATOM 1565 CB ASP A 101 5.730 -25.358 3.143 1.00 0.00 C ATOM 1566 CG ASP A 101 7.242 -25.452 3.209 1.00 0.00 C ATOM 1567 OD1 ASP A 101 7.803 -25.230 4.303 1.00 0.00 O ATOM 1568 OD2 ASP A 101 7.864 -25.749 2.168 1.00 0.00 O ATOM 0 H ASP A 101 7.082 -22.941 3.102 1.00 0.00 H new ATOM 0 HA ASP A 101 4.285 -23.832 2.698 1.00 0.00 H new ATOM 0 HB2 ASP A 101 5.297 -25.943 3.954 1.00 0.00 H new ATOM 0 HB3 ASP A 101 5.382 -25.801 2.210 1.00 0.00 H new ATOM 1573 N GLN A 102 4.781 -22.251 4.942 1.00 0.00 N ATOM 1574 CA GLN A 102 4.541 -21.762 6.294 1.00 0.00 C ATOM 1575 C GLN A 102 4.166 -20.284 6.280 1.00 0.00 C ATOM 1576 O GLN A 102 4.868 -19.461 5.693 1.00 0.00 O ATOM 1577 CB GLN A 102 5.780 -21.978 7.164 1.00 0.00 C ATOM 1578 CG GLN A 102 6.922 -21.026 6.844 1.00 0.00 C ATOM 1579 CD GLN A 102 8.279 -21.604 7.193 1.00 0.00 C ATOM 1580 OE1 GLN A 102 8.383 -22.745 7.645 1.00 0.00 O ATOM 1581 NE2 GLN A 102 9.329 -20.818 6.984 1.00 0.00 N ATOM 0 H GLN A 102 4.772 -21.527 4.224 1.00 0.00 H new ATOM 0 HA GLN A 102 3.708 -22.325 6.714 1.00 0.00 H new ATOM 0 HB2 GLN A 102 5.503 -21.861 8.212 1.00 0.00 H new ATOM 0 HB3 GLN A 102 6.127 -23.004 7.039 1.00 0.00 H new ATOM 0 HG2 GLN A 102 6.898 -20.780 5.782 1.00 0.00 H new ATOM 0 HG3 GLN A 102 6.777 -20.094 7.390 1.00 0.00 H new ATOM 0 HE21 GLN A 102 9.196 -19.879 6.608 1.00 0.00 H new ATOM 0 HE22 GLN A 102 10.268 -21.153 7.200 1.00 0.00 H new ATOM 1590 N SER A 103 3.055 -19.954 6.931 1.00 0.00 N ATOM 1591 CA SER A 103 2.584 -18.575 6.990 1.00 0.00 C ATOM 1592 C SER A 103 3.738 -17.619 7.276 1.00 0.00 C ATOM 1593 O SER A 103 4.388 -17.707 8.317 1.00 0.00 O ATOM 1594 CB SER A 103 1.506 -18.428 8.066 1.00 0.00 C ATOM 1595 OG SER A 103 1.116 -17.074 8.214 1.00 0.00 O ATOM 0 H SER A 103 2.464 -20.623 7.425 1.00 0.00 H new ATOM 0 HA SER A 103 2.156 -18.321 6.020 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.639 -19.033 7.802 1.00 0.00 H new ATOM 0 HB3 SER A 103 1.882 -18.808 9.016 1.00 0.00 H new ATOM 0 HG SER A 103 1.026 -16.661 7.330 1.00 0.00 H new ATOM 1601 N ARG A 104 3.985 -16.705 6.343 1.00 0.00 N ATOM 1602 CA ARG A 104 5.061 -15.733 6.493 1.00 0.00 C ATOM 1603 C ARG A 104 4.572 -14.326 6.161 1.00 0.00 C ATOM 1604 O ARG A 104 4.116 -14.063 5.048 1.00 0.00 O ATOM 1605 CB ARG A 104 6.240 -16.101 5.590 1.00 0.00 C ATOM 1606 CG ARG A 104 7.551 -15.453 6.004 1.00 0.00 C ATOM 1607 CD ARG A 104 8.528 -15.380 4.842 1.00 0.00 C ATOM 1608 NE ARG A 104 9.788 -14.747 5.225 1.00 0.00 N ATOM 1609 CZ ARG A 104 10.683 -15.316 6.025 1.00 0.00 C ATOM 1610 NH1 ARG A 104 10.458 -16.524 6.524 1.00 0.00 N ATOM 1611 NH2 ARG A 104 11.805 -14.677 6.327 1.00 0.00 N ATOM 0 H ARG A 104 3.455 -16.617 5.476 1.00 0.00 H new ATOM 0 HA ARG A 104 5.390 -15.750 7.532 1.00 0.00 H new ATOM 0 HB2 ARG A 104 6.364 -17.184 5.592 1.00 0.00 H new ATOM 0 HB3 ARG A 104 6.007 -15.808 4.566 1.00 0.00 H new ATOM 0 HG2 ARG A 104 7.358 -14.449 6.382 1.00 0.00 H new ATOM 0 HG3 ARG A 104 7.997 -16.021 6.820 1.00 0.00 H new ATOM 0 HD2 ARG A 104 8.726 -16.386 4.471 1.00 0.00 H new ATOM 0 HD3 ARG A 104 8.076 -14.821 4.023 1.00 0.00 H new ATOM 0 HE ARG A 104 9.992 -13.817 4.858 1.00 0.00 H new ATOM 0 HH11 ARG A 104 9.596 -17.018 6.294 1.00 0.00 H new ATOM 0 HH12 ARG A 104 11.147 -16.959 7.138 1.00 0.00 H new ATOM 0 HH21 ARG A 104 11.981 -13.748 5.945 1.00 0.00 H new ATOM 0 HH22 ARG A 104 12.492 -15.115 6.941 1.00 0.00 H new ATOM 1625 N SER A 105 4.671 -13.426 7.134 1.00 0.00 N ATOM 1626 CA SER A 105 4.235 -12.047 6.947 1.00 0.00 C ATOM 1627 C SER A 105 5.389 -11.076 7.177 1.00 0.00 C ATOM 1628 O SER A 105 5.800 -10.841 8.314 1.00 0.00 O ATOM 1629 CB SER A 105 3.081 -11.721 7.898 1.00 0.00 C ATOM 1630 OG SER A 105 3.400 -12.085 9.230 1.00 0.00 O ATOM 0 H SER A 105 5.049 -13.627 8.060 1.00 0.00 H new ATOM 0 HA SER A 105 3.891 -11.937 5.919 1.00 0.00 H new ATOM 0 HB2 SER A 105 2.858 -10.655 7.852 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.182 -12.249 7.579 1.00 0.00 H new ATOM 0 HG SER A 105 4.296 -11.756 9.454 1.00 0.00 H new ATOM 1636 N LEU A 106 5.907 -10.515 6.091 1.00 0.00 N ATOM 1637 CA LEU A 106 7.015 -9.569 6.172 1.00 0.00 C ATOM 1638 C LEU A 106 6.529 -8.141 5.943 1.00 0.00 C ATOM 1639 O LEU A 106 5.926 -7.822 4.918 1.00 0.00 O ATOM 1640 CB LEU A 106 8.092 -9.925 5.146 1.00 0.00 C ATOM 1641 CG LEU A 106 8.761 -11.289 5.321 1.00 0.00 C ATOM 1642 CD1 LEU A 106 9.423 -11.728 4.024 1.00 0.00 C ATOM 1643 CD2 LEU A 106 9.778 -11.243 6.452 1.00 0.00 C ATOM 0 H LEU A 106 5.578 -10.698 5.143 1.00 0.00 H new ATOM 0 HA LEU A 106 7.442 -9.632 7.173 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.646 -9.886 4.152 1.00 0.00 H new ATOM 0 HB3 LEU A 106 8.865 -9.157 5.179 1.00 0.00 H new ATOM 0 HG LEU A 106 7.994 -12.019 5.579 1.00 0.00 H new ATOM 0 HD11 LEU A 106 9.894 -12.701 4.167 1.00 0.00 H new ATOM 0 HD12 LEU A 106 8.671 -11.801 3.238 1.00 0.00 H new ATOM 0 HD13 LEU A 106 10.179 -10.998 3.736 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.244 -12.222 6.562 1.00 0.00 H new ATOM 0 HD22 LEU A 106 10.543 -10.501 6.224 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.277 -10.973 7.381 1.00 0.00 H new ATOM 1655 N PRO A 107 6.799 -7.260 6.917 1.00 0.00 N ATOM 1656 CA PRO A 107 6.401 -5.851 6.843 1.00 0.00 C ATOM 1657 C PRO A 107 7.192 -5.080 5.792 1.00 0.00 C ATOM 1658 O PRO A 107 8.354 -4.733 6.006 1.00 0.00 O ATOM 1659 CB PRO A 107 6.715 -5.320 8.244 1.00 0.00 C ATOM 1660 CG PRO A 107 7.788 -6.217 8.758 1.00 0.00 C ATOM 1661 CD PRO A 107 7.515 -7.572 8.166 1.00 0.00 C ATOM 0 HA PRO A 107 5.356 -5.737 6.553 1.00 0.00 H new ATOM 0 HB2 PRO A 107 7.049 -4.283 8.209 1.00 0.00 H new ATOM 0 HB3 PRO A 107 5.834 -5.349 8.885 1.00 0.00 H new ATOM 0 HG2 PRO A 107 8.773 -5.854 8.465 1.00 0.00 H new ATOM 0 HG3 PRO A 107 7.774 -6.257 9.847 1.00 0.00 H new ATOM 0 HD2 PRO A 107 8.437 -8.120 7.974 1.00 0.00 H new ATOM 0 HD3 PRO A 107 6.911 -8.188 8.833 1.00 0.00 H new ATOM 1669 N TYR A 108 6.556 -4.814 4.657 1.00 0.00 N ATOM 1670 CA TYR A 108 7.201 -4.085 3.572 1.00 0.00 C ATOM 1671 C TYR A 108 6.971 -2.584 3.712 1.00 0.00 C ATOM 1672 O TYR A 108 5.906 -2.072 3.367 1.00 0.00 O ATOM 1673 CB TYR A 108 6.674 -4.570 2.220 1.00 0.00 C ATOM 1674 CG TYR A 108 7.221 -5.916 1.803 1.00 0.00 C ATOM 1675 CD1 TYR A 108 8.449 -6.020 1.161 1.00 0.00 C ATOM 1676 CD2 TYR A 108 6.511 -7.084 2.052 1.00 0.00 C ATOM 1677 CE1 TYR A 108 8.952 -7.249 0.778 1.00 0.00 C ATOM 1678 CE2 TYR A 108 7.007 -8.316 1.674 1.00 0.00 C ATOM 1679 CZ TYR A 108 8.228 -8.393 1.037 1.00 0.00 C ATOM 1680 OH TYR A 108 8.726 -9.619 0.658 1.00 0.00 O ATOM 0 H TYR A 108 5.594 -5.092 4.464 1.00 0.00 H new ATOM 0 HA TYR A 108 8.273 -4.276 3.626 1.00 0.00 H new ATOM 0 HB2 TYR A 108 5.586 -4.627 2.263 1.00 0.00 H new ATOM 0 HB3 TYR A 108 6.925 -3.833 1.457 1.00 0.00 H new ATOM 0 HD1 TYR A 108 9.020 -5.126 0.958 1.00 0.00 H new ATOM 0 HD2 TYR A 108 5.554 -7.027 2.550 1.00 0.00 H new ATOM 0 HE1 TYR A 108 9.907 -7.313 0.278 1.00 0.00 H new ATOM 0 HE2 TYR A 108 6.442 -9.214 1.876 1.00 0.00 H new ATOM 0 HH TYR A 108 8.094 -10.322 0.915 1.00 0.00 H new ATOM 1690 N LYS A 109 7.979 -1.882 4.219 1.00 0.00 N ATOM 1691 CA LYS A 109 7.891 -0.439 4.404 1.00 0.00 C ATOM 1692 C LYS A 109 8.997 0.277 3.636 1.00 0.00 C ATOM 1693 O LYS A 109 9.986 -0.338 3.234 1.00 0.00 O ATOM 1694 CB LYS A 109 7.979 -0.088 5.891 1.00 0.00 C ATOM 1695 CG LYS A 109 7.154 -1.001 6.782 1.00 0.00 C ATOM 1696 CD LYS A 109 6.678 -0.279 8.031 1.00 0.00 C ATOM 1697 CE LYS A 109 6.150 -1.255 9.071 1.00 0.00 C ATOM 1698 NZ LYS A 109 5.168 -0.612 9.987 1.00 0.00 N ATOM 0 H LYS A 109 8.867 -2.290 4.509 1.00 0.00 H new ATOM 0 HA LYS A 109 6.929 -0.107 4.015 1.00 0.00 H new ATOM 0 HB2 LYS A 109 9.022 -0.133 6.205 1.00 0.00 H new ATOM 0 HB3 LYS A 109 7.648 0.941 6.033 1.00 0.00 H new ATOM 0 HG2 LYS A 109 6.294 -1.374 6.226 1.00 0.00 H new ATOM 0 HG3 LYS A 109 7.750 -1.868 7.067 1.00 0.00 H new ATOM 0 HD2 LYS A 109 7.500 0.297 8.455 1.00 0.00 H new ATOM 0 HD3 LYS A 109 5.895 0.431 7.766 1.00 0.00 H new ATOM 0 HE2 LYS A 109 5.679 -2.101 8.569 1.00 0.00 H new ATOM 0 HE3 LYS A 109 6.982 -1.652 9.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 4.707 -1.341 10.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 5.661 0.064 10.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 4.449 -0.109 9.428 1.00 0.00 H new ATOM 1712 N LEU A 110 8.824 1.579 3.435 1.00 0.00 N ATOM 1713 CA LEU A 110 9.809 2.379 2.715 1.00 0.00 C ATOM 1714 C LEU A 110 9.908 1.939 1.258 1.00 0.00 C ATOM 1715 O LEU A 110 10.999 1.889 0.688 1.00 0.00 O ATOM 1716 CB LEU A 110 11.177 2.266 3.389 1.00 0.00 C ATOM 1717 CG LEU A 110 11.211 2.548 4.891 1.00 0.00 C ATOM 1718 CD1 LEU A 110 12.406 1.862 5.536 1.00 0.00 C ATOM 1719 CD2 LEU A 110 11.250 4.047 5.152 1.00 0.00 C ATOM 0 H LEU A 110 8.011 2.103 3.760 1.00 0.00 H new ATOM 0 HA LEU A 110 9.484 3.419 2.739 1.00 0.00 H new ATOM 0 HB2 LEU A 110 11.561 1.260 3.220 1.00 0.00 H new ATOM 0 HB3 LEU A 110 11.861 2.956 2.895 1.00 0.00 H new ATOM 0 HG LEU A 110 10.302 2.145 5.337 1.00 0.00 H new ATOM 0 HD11 LEU A 110 12.414 2.074 6.605 1.00 0.00 H new ATOM 0 HD12 LEU A 110 12.335 0.786 5.380 1.00 0.00 H new ATOM 0 HD13 LEU A 110 13.326 2.234 5.086 1.00 0.00 H new ATOM 0 HD21 LEU A 110 11.274 4.229 6.226 1.00 0.00 H new ATOM 0 HD22 LEU A 110 12.141 4.473 4.692 1.00 0.00 H new ATOM 0 HD23 LEU A 110 10.363 4.514 4.725 1.00 0.00 H new ATOM 1731 N ILE A 111 8.764 1.623 0.661 1.00 0.00 N ATOM 1732 CA ILE A 111 8.723 1.191 -0.730 1.00 0.00 C ATOM 1733 C ILE A 111 8.779 2.384 -1.679 1.00 0.00 C ATOM 1734 O ILE A 111 7.947 3.288 -1.605 1.00 0.00 O ATOM 1735 CB ILE A 111 7.453 0.372 -1.028 1.00 0.00 C ATOM 1736 CG1 ILE A 111 7.352 -0.819 -0.072 1.00 0.00 C ATOM 1737 CG2 ILE A 111 7.455 -0.101 -2.474 1.00 0.00 C ATOM 1738 CD1 ILE A 111 6.035 -1.556 -0.163 1.00 0.00 C ATOM 0 H ILE A 111 7.853 1.658 1.119 1.00 0.00 H new ATOM 0 HA ILE A 111 9.598 0.561 -0.890 1.00 0.00 H new ATOM 0 HB ILE A 111 6.583 1.010 -0.876 1.00 0.00 H new ATOM 0 HG12 ILE A 111 8.164 -1.515 -0.284 1.00 0.00 H new ATOM 0 HG13 ILE A 111 7.492 -0.467 0.950 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.551 -0.678 -2.669 1.00 0.00 H new ATOM 0 HG22 ILE A 111 7.485 0.762 -3.139 1.00 0.00 H new ATOM 0 HG23 ILE A 111 8.330 -0.726 -2.651 1.00 0.00 H new ATOM 0 HD11 ILE A 111 6.034 -2.387 0.542 1.00 0.00 H new ATOM 0 HD12 ILE A 111 5.219 -0.874 0.078 1.00 0.00 H new ATOM 0 HD13 ILE A 111 5.901 -1.938 -1.175 1.00 0.00 H new ATOM 1750 N SER A 112 9.764 2.378 -2.571 1.00 0.00 N ATOM 1751 CA SER A 112 9.930 3.461 -3.533 1.00 0.00 C ATOM 1752 C SER A 112 8.952 3.310 -4.695 1.00 0.00 C ATOM 1753 O SER A 112 8.973 2.311 -5.414 1.00 0.00 O ATOM 1754 CB SER A 112 11.365 3.487 -4.061 1.00 0.00 C ATOM 1755 OG SER A 112 11.857 2.174 -4.267 1.00 0.00 O ATOM 0 H SER A 112 10.459 1.635 -2.648 1.00 0.00 H new ATOM 0 HA SER A 112 9.720 4.402 -3.023 1.00 0.00 H new ATOM 0 HB2 SER A 112 11.401 4.043 -4.998 1.00 0.00 H new ATOM 0 HB3 SER A 112 12.007 4.012 -3.353 1.00 0.00 H new ATOM 0 HG SER A 112 12.775 2.218 -4.606 1.00 0.00 H new ATOM 1761 N LEU A 113 8.094 4.310 -4.871 1.00 0.00 N ATOM 1762 CA LEU A 113 7.107 4.290 -5.945 1.00 0.00 C ATOM 1763 C LEU A 113 7.657 4.955 -7.203 1.00 0.00 C ATOM 1764 O LEU A 113 8.432 5.910 -7.125 1.00 0.00 O ATOM 1765 CB LEU A 113 5.826 4.997 -5.499 1.00 0.00 C ATOM 1766 CG LEU A 113 5.015 4.294 -4.410 1.00 0.00 C ATOM 1767 CD1 LEU A 113 3.930 5.214 -3.874 1.00 0.00 C ATOM 1768 CD2 LEU A 113 4.408 3.005 -4.946 1.00 0.00 C ATOM 0 H LEU A 113 8.062 5.144 -4.284 1.00 0.00 H new ATOM 0 HA LEU A 113 6.879 3.250 -6.177 1.00 0.00 H new ATOM 0 HB2 LEU A 113 6.090 5.992 -5.142 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.186 5.131 -6.371 1.00 0.00 H new ATOM 0 HG LEU A 113 5.686 4.042 -3.589 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.363 4.696 -3.100 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.387 6.109 -3.452 1.00 0.00 H new ATOM 0 HD13 LEU A 113 3.260 5.498 -4.686 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.834 2.518 -4.158 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.751 3.234 -5.785 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.204 2.339 -5.280 1.00 0.00 H new ATOM 1780 N LEU A 114 7.250 4.447 -8.360 1.00 0.00 N ATOM 1781 CA LEU A 114 7.700 4.992 -9.636 1.00 0.00 C ATOM 1782 C LEU A 114 6.516 5.285 -10.551 1.00 0.00 C ATOM 1783 O LEU A 114 5.457 4.671 -10.428 1.00 0.00 O ATOM 1784 CB LEU A 114 8.659 4.017 -10.321 1.00 0.00 C ATOM 1785 CG LEU A 114 9.694 3.346 -9.416 1.00 0.00 C ATOM 1786 CD1 LEU A 114 10.235 2.084 -10.069 1.00 0.00 C ATOM 1787 CD2 LEU A 114 10.827 4.310 -9.095 1.00 0.00 C ATOM 0 H LEU A 114 6.609 3.658 -8.441 1.00 0.00 H new ATOM 0 HA LEU A 114 8.223 5.928 -9.438 1.00 0.00 H new ATOM 0 HB2 LEU A 114 8.069 3.238 -10.805 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.188 4.552 -11.109 1.00 0.00 H new ATOM 0 HG LEU A 114 9.206 3.067 -8.482 1.00 0.00 H new ATOM 0 HD11 LEU A 114 10.970 1.620 -9.411 1.00 0.00 H new ATOM 0 HD12 LEU A 114 9.416 1.387 -10.247 1.00 0.00 H new ATOM 0 HD13 LEU A 114 10.707 2.339 -11.018 1.00 0.00 H new ATOM 0 HD21 LEU A 114 11.554 3.816 -8.450 1.00 0.00 H new ATOM 0 HD22 LEU A 114 11.314 4.620 -10.020 1.00 0.00 H new ATOM 0 HD23 LEU A 114 10.426 5.186 -8.585 1.00 0.00 H new ATOM 1799 N ASN A 115 6.704 6.227 -11.470 1.00 0.00 N ATOM 1800 CA ASN A 115 5.651 6.601 -12.408 1.00 0.00 C ATOM 1801 C ASN A 115 5.571 5.605 -13.561 1.00 0.00 C ATOM 1802 O ASN A 115 6.277 4.597 -13.573 1.00 0.00 O ATOM 1803 CB ASN A 115 5.899 8.009 -12.952 1.00 0.00 C ATOM 1804 CG ASN A 115 7.375 8.354 -13.011 1.00 0.00 C ATOM 1805 OD1 ASN A 115 8.088 7.925 -13.918 1.00 0.00 O ATOM 1806 ND2 ASN A 115 7.840 9.132 -12.041 1.00 0.00 N ATOM 0 H ASN A 115 7.575 6.745 -11.585 1.00 0.00 H new ATOM 0 HA ASN A 115 4.701 6.588 -11.873 1.00 0.00 H new ATOM 0 HB2 ASN A 115 5.469 8.091 -13.950 1.00 0.00 H new ATOM 0 HB3 ASN A 115 5.384 8.735 -12.323 1.00 0.00 H new ATOM 0 HD21 ASN A 115 8.825 9.397 -12.028 1.00 0.00 H new ATOM 0 HD22 ASN A 115 7.212 9.465 -11.309 1.00 0.00 H new ATOM 1813 N GLU A 116 4.707 5.896 -14.529 1.00 0.00 N ATOM 1814 CA GLU A 116 4.535 5.025 -15.686 1.00 0.00 C ATOM 1815 C GLU A 116 5.855 4.844 -16.430 1.00 0.00 C ATOM 1816 O GLU A 116 6.071 3.831 -17.096 1.00 0.00 O ATOM 1817 CB GLU A 116 3.478 5.600 -16.631 1.00 0.00 C ATOM 1818 CG GLU A 116 3.935 6.847 -17.369 1.00 0.00 C ATOM 1819 CD GLU A 116 2.805 7.532 -18.113 1.00 0.00 C ATOM 1820 OE1 GLU A 116 2.341 6.973 -19.129 1.00 0.00 O ATOM 1821 OE2 GLU A 116 2.384 8.625 -17.680 1.00 0.00 O ATOM 0 H GLU A 116 4.116 6.727 -14.535 1.00 0.00 H new ATOM 0 HA GLU A 116 4.202 4.050 -15.330 1.00 0.00 H new ATOM 0 HB2 GLU A 116 3.201 4.838 -17.359 1.00 0.00 H new ATOM 0 HB3 GLU A 116 2.581 5.835 -16.059 1.00 0.00 H new ATOM 0 HG2 GLU A 116 4.372 7.546 -16.657 1.00 0.00 H new ATOM 0 HG3 GLU A 116 4.720 6.579 -18.076 1.00 0.00 H new ATOM 1828 N LYS A 117 6.734 5.833 -16.314 1.00 0.00 N ATOM 1829 CA LYS A 117 8.033 5.784 -16.974 1.00 0.00 C ATOM 1830 C LYS A 117 9.040 5.000 -16.137 1.00 0.00 C ATOM 1831 O LYS A 117 10.009 4.456 -16.664 1.00 0.00 O ATOM 1832 CB LYS A 117 8.555 7.201 -17.223 1.00 0.00 C ATOM 1833 CG LYS A 117 7.679 8.016 -18.159 1.00 0.00 C ATOM 1834 CD LYS A 117 7.759 7.501 -19.587 1.00 0.00 C ATOM 1835 CE LYS A 117 9.076 7.884 -20.245 1.00 0.00 C ATOM 1836 NZ LYS A 117 9.325 7.099 -21.485 1.00 0.00 N ATOM 0 H LYS A 117 6.570 6.679 -15.768 1.00 0.00 H new ATOM 0 HA LYS A 117 7.908 5.276 -17.930 1.00 0.00 H new ATOM 0 HB2 LYS A 117 8.636 7.722 -16.269 1.00 0.00 H new ATOM 0 HB3 LYS A 117 9.560 7.141 -17.640 1.00 0.00 H new ATOM 0 HG2 LYS A 117 6.645 7.979 -17.815 1.00 0.00 H new ATOM 0 HG3 LYS A 117 7.988 9.061 -18.130 1.00 0.00 H new ATOM 0 HD2 LYS A 117 7.651 6.416 -19.590 1.00 0.00 H new ATOM 0 HD3 LYS A 117 6.930 7.905 -20.168 1.00 0.00 H new ATOM 0 HE2 LYS A 117 9.067 8.947 -20.484 1.00 0.00 H new ATOM 0 HE3 LYS A 117 9.894 7.722 -19.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 10.232 7.389 -21.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 9.359 6.086 -21.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 8.558 7.273 -22.166 1.00 0.00 H new ATOM 1850 N GLY A 118 8.802 4.946 -14.830 1.00 0.00 N ATOM 1851 CA GLY A 118 9.695 4.226 -13.943 1.00 0.00 C ATOM 1852 C GLY A 118 10.662 5.144 -13.223 1.00 0.00 C ATOM 1853 O GLY A 118 11.711 4.705 -12.752 1.00 0.00 O ATOM 0 H GLY A 118 8.006 5.388 -14.370 1.00 0.00 H new ATOM 0 HA2 GLY A 118 9.107 3.675 -13.209 1.00 0.00 H new ATOM 0 HA3 GLY A 118 10.257 3.490 -14.518 1.00 0.00 H new ATOM 1857 N GLN A 119 10.310 6.423 -13.138 1.00 0.00 N ATOM 1858 CA GLN A 119 11.156 7.406 -12.472 1.00 0.00 C ATOM 1859 C GLN A 119 10.768 7.553 -11.005 1.00 0.00 C ATOM 1860 O GLN A 119 9.587 7.535 -10.660 1.00 0.00 O ATOM 1861 CB GLN A 119 11.054 8.760 -13.177 1.00 0.00 C ATOM 1862 CG GLN A 119 11.899 8.855 -14.437 1.00 0.00 C ATOM 1863 CD GLN A 119 13.383 8.935 -14.140 1.00 0.00 C ATOM 1864 OE1 GLN A 119 13.798 9.534 -13.147 1.00 0.00 O ATOM 1865 NE2 GLN A 119 14.193 8.330 -15.001 1.00 0.00 N ATOM 0 H GLN A 119 9.445 6.803 -13.522 1.00 0.00 H new ATOM 0 HA GLN A 119 12.187 7.055 -12.523 1.00 0.00 H new ATOM 0 HB2 GLN A 119 10.012 8.949 -13.433 1.00 0.00 H new ATOM 0 HB3 GLN A 119 11.359 9.545 -12.485 1.00 0.00 H new ATOM 0 HG2 GLN A 119 11.705 7.987 -15.066 1.00 0.00 H new ATOM 0 HG3 GLN A 119 11.598 9.735 -15.006 1.00 0.00 H new ATOM 0 HE21 GLN A 119 13.806 7.845 -15.811 1.00 0.00 H new ATOM 0 HE22 GLN A 119 15.202 8.350 -14.853 1.00 0.00 H new ATOM 1874 N ASP A 120 11.771 7.697 -10.145 1.00 0.00 N ATOM 1875 CA ASP A 120 11.534 7.848 -8.713 1.00 0.00 C ATOM 1876 C ASP A 120 10.513 8.949 -8.444 1.00 0.00 C ATOM 1877 O ASP A 120 10.828 10.137 -8.525 1.00 0.00 O ATOM 1878 CB ASP A 120 12.844 8.162 -7.989 1.00 0.00 C ATOM 1879 CG ASP A 120 13.743 9.082 -8.791 1.00 0.00 C ATOM 1880 OD1 ASP A 120 13.500 10.307 -8.779 1.00 0.00 O ATOM 1881 OD2 ASP A 120 14.690 8.578 -9.431 1.00 0.00 O ATOM 0 H ASP A 120 12.755 7.712 -10.414 1.00 0.00 H new ATOM 0 HA ASP A 120 11.135 6.907 -8.334 1.00 0.00 H new ATOM 0 HB2 ASP A 120 12.622 8.624 -7.027 1.00 0.00 H new ATOM 0 HB3 ASP A 120 13.373 7.232 -7.782 1.00 0.00 H new ATOM 1886 N THR A 121 9.287 8.547 -8.125 1.00 0.00 N ATOM 1887 CA THR A 121 8.219 9.498 -7.846 1.00 0.00 C ATOM 1888 C THR A 121 8.495 10.274 -6.564 1.00 0.00 C ATOM 1889 O THR A 121 8.121 11.440 -6.439 1.00 0.00 O ATOM 1890 CB THR A 121 6.856 8.792 -7.722 1.00 0.00 C ATOM 1891 OG1 THR A 121 6.852 7.930 -6.579 1.00 0.00 O ATOM 1892 CG2 THR A 121 6.549 7.984 -8.974 1.00 0.00 C ATOM 0 H THR A 121 9.009 7.568 -8.053 1.00 0.00 H new ATOM 0 HA THR A 121 8.186 10.191 -8.687 1.00 0.00 H new ATOM 0 HB THR A 121 6.087 9.555 -7.603 1.00 0.00 H new ATOM 0 HG1 THR A 121 7.635 7.342 -6.610 1.00 0.00 H new ATOM 0 HG21 THR A 121 5.581 7.494 -8.863 1.00 0.00 H new ATOM 0 HG22 THR A 121 6.523 8.648 -9.838 1.00 0.00 H new ATOM 0 HG23 THR A 121 7.323 7.230 -9.119 1.00 0.00 H new ATOM 1900 N GLY A 122 9.152 9.620 -5.611 1.00 0.00 N ATOM 1901 CA GLY A 122 9.468 10.265 -4.350 1.00 0.00 C ATOM 1902 C GLY A 122 8.395 10.044 -3.302 1.00 0.00 C ATOM 1903 O GLY A 122 8.302 10.796 -2.332 1.00 0.00 O ATOM 0 H GLY A 122 9.471 8.654 -5.690 1.00 0.00 H new ATOM 0 HA2 GLY A 122 10.419 9.883 -3.978 1.00 0.00 H new ATOM 0 HA3 GLY A 122 9.596 11.335 -4.515 1.00 0.00 H new ATOM 1907 N ALA A 123 7.583 9.010 -3.497 1.00 0.00 N ATOM 1908 CA ALA A 123 6.512 8.693 -2.560 1.00 0.00 C ATOM 1909 C ALA A 123 6.704 7.305 -1.958 1.00 0.00 C ATOM 1910 O ALA A 123 6.952 6.334 -2.673 1.00 0.00 O ATOM 1911 CB ALA A 123 5.160 8.787 -3.252 1.00 0.00 C ATOM 0 H ALA A 123 7.646 8.378 -4.295 1.00 0.00 H new ATOM 0 HA ALA A 123 6.544 9.421 -1.749 1.00 0.00 H new ATOM 0 HB1 ALA A 123 4.370 8.548 -2.540 1.00 0.00 H new ATOM 0 HB2 ALA A 123 5.014 9.799 -3.630 1.00 0.00 H new ATOM 0 HB3 ALA A 123 5.126 8.082 -4.082 1.00 0.00 H new ATOM 1917 N THR A 124 6.588 7.218 -0.636 1.00 0.00 N ATOM 1918 CA THR A 124 6.751 5.950 0.063 1.00 0.00 C ATOM 1919 C THR A 124 5.443 5.506 0.708 1.00 0.00 C ATOM 1920 O THR A 124 4.670 6.330 1.197 1.00 0.00 O ATOM 1921 CB THR A 124 7.840 6.042 1.149 1.00 0.00 C ATOM 1922 OG1 THR A 124 7.423 6.938 2.185 1.00 0.00 O ATOM 1923 CG2 THR A 124 9.156 6.522 0.556 1.00 0.00 C ATOM 0 H THR A 124 6.382 8.011 -0.029 1.00 0.00 H new ATOM 0 HA THR A 124 7.054 5.215 -0.683 1.00 0.00 H new ATOM 0 HB THR A 124 7.990 5.047 1.568 1.00 0.00 H new ATOM 0 HG1 THR A 124 7.796 7.828 2.017 1.00 0.00 H new ATOM 0 HG21 THR A 124 9.910 6.579 1.341 1.00 0.00 H new ATOM 0 HG22 THR A 124 9.485 5.823 -0.213 1.00 0.00 H new ATOM 0 HG23 THR A 124 9.017 7.509 0.114 1.00 0.00 H new ATOM 1931 N ILE A 125 5.201 4.199 0.706 1.00 0.00 N ATOM 1932 CA ILE A 125 3.987 3.647 1.293 1.00 0.00 C ATOM 1933 C ILE A 125 4.281 2.359 2.055 1.00 0.00 C ATOM 1934 O ILE A 125 4.967 1.470 1.550 1.00 0.00 O ATOM 1935 CB ILE A 125 2.921 3.361 0.218 1.00 0.00 C ATOM 1936 CG1 ILE A 125 1.617 2.898 0.871 1.00 0.00 C ATOM 1937 CG2 ILE A 125 3.428 2.316 -0.765 1.00 0.00 C ATOM 1938 CD1 ILE A 125 0.390 3.172 0.030 1.00 0.00 C ATOM 0 H ILE A 125 5.830 3.503 0.304 1.00 0.00 H new ATOM 0 HA ILE A 125 3.603 4.397 1.985 1.00 0.00 H new ATOM 0 HB ILE A 125 2.723 4.282 -0.330 1.00 0.00 H new ATOM 0 HG12 ILE A 125 1.680 1.828 1.070 1.00 0.00 H new ATOM 0 HG13 ILE A 125 1.506 3.396 1.834 1.00 0.00 H new ATOM 0 HG21 ILE A 125 2.664 2.124 -1.518 1.00 0.00 H new ATOM 0 HG22 ILE A 125 4.333 2.682 -1.250 1.00 0.00 H new ATOM 0 HG23 ILE A 125 3.651 1.392 -0.231 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -0.497 2.818 0.555 1.00 0.00 H new ATOM 0 HD12 ILE A 125 0.303 4.244 -0.148 1.00 0.00 H new ATOM 0 HD13 ILE A 125 0.479 2.652 -0.924 1.00 0.00 H new ATOM 1950 N ASP A 126 3.757 2.266 3.272 1.00 0.00 N ATOM 1951 CA ASP A 126 3.960 1.085 4.104 1.00 0.00 C ATOM 1952 C ASP A 126 2.883 0.039 3.836 1.00 0.00 C ATOM 1953 O ASP A 126 1.692 0.353 3.807 1.00 0.00 O ATOM 1954 CB ASP A 126 3.958 1.471 5.584 1.00 0.00 C ATOM 1955 CG ASP A 126 3.897 0.263 6.497 1.00 0.00 C ATOM 1956 OD1 ASP A 126 4.075 -0.868 5.998 1.00 0.00 O ATOM 1957 OD2 ASP A 126 3.671 0.448 7.711 1.00 0.00 O ATOM 0 H ASP A 126 3.188 2.994 3.705 1.00 0.00 H new ATOM 0 HA ASP A 126 4.929 0.655 3.850 1.00 0.00 H new ATOM 0 HB2 ASP A 126 4.856 2.047 5.808 1.00 0.00 H new ATOM 0 HB3 ASP A 126 3.105 2.119 5.786 1.00 0.00 H new ATOM 1962 N LEU A 127 3.308 -1.204 3.640 1.00 0.00 N ATOM 1963 CA LEU A 127 2.379 -2.297 3.373 1.00 0.00 C ATOM 1964 C LEU A 127 2.851 -3.586 4.038 1.00 0.00 C ATOM 1965 O LEU A 127 4.035 -3.922 3.996 1.00 0.00 O ATOM 1966 CB LEU A 127 2.232 -2.511 1.866 1.00 0.00 C ATOM 1967 CG LEU A 127 1.831 -1.282 1.050 1.00 0.00 C ATOM 1968 CD1 LEU A 127 2.012 -1.545 -0.437 1.00 0.00 C ATOM 1969 CD2 LEU A 127 0.392 -0.887 1.351 1.00 0.00 C ATOM 0 H LEU A 127 4.290 -1.480 3.661 1.00 0.00 H new ATOM 0 HA LEU A 127 1.409 -2.028 3.791 1.00 0.00 H new ATOM 0 HB2 LEU A 127 3.179 -2.887 1.478 1.00 0.00 H new ATOM 0 HB3 LEU A 127 1.488 -3.291 1.701 1.00 0.00 H new ATOM 0 HG LEU A 127 2.481 -0.455 1.334 1.00 0.00 H new ATOM 0 HD11 LEU A 127 1.721 -0.659 -1.001 1.00 0.00 H new ATOM 0 HD12 LEU A 127 3.057 -1.778 -0.641 1.00 0.00 H new ATOM 0 HD13 LEU A 127 1.387 -2.387 -0.736 1.00 0.00 H new ATOM 0 HD21 LEU A 127 0.124 -0.010 0.761 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.273 -1.712 1.096 1.00 0.00 H new ATOM 0 HD23 LEU A 127 0.293 -0.655 2.411 1.00 0.00 H new ATOM 1981 N VAL A 128 1.917 -4.307 4.649 1.00 0.00 N ATOM 1982 CA VAL A 128 2.236 -5.562 5.319 1.00 0.00 C ATOM 1983 C VAL A 128 1.493 -6.730 4.682 1.00 0.00 C ATOM 1984 O VAL A 128 0.301 -6.927 4.922 1.00 0.00 O ATOM 1985 CB VAL A 128 1.887 -5.502 6.818 1.00 0.00 C ATOM 1986 CG1 VAL A 128 2.337 -6.773 7.523 1.00 0.00 C ATOM 1987 CG2 VAL A 128 2.513 -4.275 7.463 1.00 0.00 C ATOM 0 H VAL A 128 0.933 -4.043 4.694 1.00 0.00 H new ATOM 0 HA VAL A 128 3.310 -5.715 5.209 1.00 0.00 H new ATOM 0 HB VAL A 128 0.804 -5.424 6.917 1.00 0.00 H new ATOM 0 HG11 VAL A 128 2.082 -6.712 8.581 1.00 0.00 H new ATOM 0 HG12 VAL A 128 1.836 -7.633 7.078 1.00 0.00 H new ATOM 0 HG13 VAL A 128 3.416 -6.886 7.416 1.00 0.00 H new ATOM 0 HG21 VAL A 128 2.256 -4.249 8.522 1.00 0.00 H new ATOM 0 HG22 VAL A 128 3.597 -4.319 7.354 1.00 0.00 H new ATOM 0 HG23 VAL A 128 2.136 -3.376 6.976 1.00 0.00 H new ATOM 1997 N ILE A 129 2.204 -7.504 3.868 1.00 0.00 N ATOM 1998 CA ILE A 129 1.612 -8.654 3.197 1.00 0.00 C ATOM 1999 C ILE A 129 1.920 -9.946 3.946 1.00 0.00 C ATOM 2000 O ILE A 129 3.042 -10.157 4.406 1.00 0.00 O ATOM 2001 CB ILE A 129 2.117 -8.781 1.748 1.00 0.00 C ATOM 2002 CG1 ILE A 129 2.127 -7.412 1.066 1.00 0.00 C ATOM 2003 CG2 ILE A 129 1.250 -9.760 0.969 1.00 0.00 C ATOM 2004 CD1 ILE A 129 3.123 -7.308 -0.068 1.00 0.00 C ATOM 0 H ILE A 129 3.191 -7.355 3.658 1.00 0.00 H new ATOM 0 HA ILE A 129 0.534 -8.492 3.185 1.00 0.00 H new ATOM 0 HB ILE A 129 3.137 -9.164 1.767 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.129 -7.199 0.683 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.353 -6.647 1.809 1.00 0.00 H new ATOM 0 HG21 ILE A 129 1.619 -9.839 -0.053 1.00 0.00 H new ATOM 0 HG22 ILE A 129 1.289 -10.739 1.446 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.220 -9.403 0.956 1.00 0.00 H new ATOM 0 HD11 ILE A 129 3.075 -6.310 -0.504 1.00 0.00 H new ATOM 0 HD12 ILE A 129 4.128 -7.489 0.313 1.00 0.00 H new ATOM 0 HD13 ILE A 129 2.885 -8.050 -0.831 1.00 0.00 H new ATOM 2016 N GLY A 130 0.916 -10.810 4.064 1.00 0.00 N ATOM 2017 CA GLY A 130 1.100 -12.072 4.756 1.00 0.00 C ATOM 2018 C GLY A 130 0.614 -13.255 3.944 1.00 0.00 C ATOM 2019 O GLY A 130 -0.533 -13.282 3.498 1.00 0.00 O ATOM 0 H GLY A 130 -0.022 -10.658 3.692 1.00 0.00 H new ATOM 0 HA2 GLY A 130 2.157 -12.205 4.988 1.00 0.00 H new ATOM 0 HA3 GLY A 130 0.566 -12.043 5.706 1.00 0.00 H new ATOM 2023 N TYR A 131 1.489 -14.236 3.749 1.00 0.00 N ATOM 2024 CA TYR A 131 1.144 -15.426 2.980 1.00 0.00 C ATOM 2025 C TYR A 131 0.637 -16.537 3.894 1.00 0.00 C ATOM 2026 O TYR A 131 1.099 -16.685 5.025 1.00 0.00 O ATOM 2027 CB TYR A 131 2.357 -15.916 2.188 1.00 0.00 C ATOM 2028 CG TYR A 131 2.189 -17.309 1.624 1.00 0.00 C ATOM 2029 CD1 TYR A 131 1.160 -17.601 0.738 1.00 0.00 C ATOM 2030 CD2 TYR A 131 3.060 -18.333 1.977 1.00 0.00 C ATOM 2031 CE1 TYR A 131 1.002 -18.872 0.220 1.00 0.00 C ATOM 2032 CE2 TYR A 131 2.910 -19.606 1.463 1.00 0.00 C ATOM 2033 CZ TYR A 131 1.880 -19.871 0.585 1.00 0.00 C ATOM 2034 OH TYR A 131 1.727 -21.139 0.072 1.00 0.00 O ATOM 0 H TYR A 131 2.442 -14.230 4.113 1.00 0.00 H new ATOM 0 HA TYR A 131 0.348 -15.160 2.285 1.00 0.00 H new ATOM 0 HB2 TYR A 131 2.550 -15.223 1.370 1.00 0.00 H new ATOM 0 HB3 TYR A 131 3.234 -15.898 2.835 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.471 -16.821 0.449 1.00 0.00 H new ATOM 0 HD2 TYR A 131 3.868 -18.130 2.665 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.195 -19.082 -0.467 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.596 -20.390 1.747 1.00 0.00 H new ATOM 0 HH TYR A 131 2.428 -21.723 0.429 1.00 0.00 H new ATOM 2044 N ASP A 132 -0.317 -17.315 3.395 1.00 0.00 N ATOM 2045 CA ASP A 132 -0.888 -18.414 4.165 1.00 0.00 C ATOM 2046 C ASP A 132 -1.215 -19.598 3.261 1.00 0.00 C ATOM 2047 O ASP A 132 -2.078 -19.523 2.386 1.00 0.00 O ATOM 2048 CB ASP A 132 -2.148 -17.952 4.897 1.00 0.00 C ATOM 2049 CG ASP A 132 -2.437 -18.782 6.133 1.00 0.00 C ATOM 2050 OD1 ASP A 132 -1.472 -19.195 6.809 1.00 0.00 O ATOM 2051 OD2 ASP A 132 -3.628 -19.019 6.424 1.00 0.00 O ATOM 0 H ASP A 132 -0.711 -17.205 2.461 1.00 0.00 H new ATOM 0 HA ASP A 132 -0.148 -18.734 4.899 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -2.036 -16.906 5.183 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -2.999 -18.007 4.219 1.00 0.00 H new ATOM 2056 N PRO A 133 -0.510 -20.719 3.474 1.00 0.00 N ATOM 2057 CA PRO A 133 -0.708 -21.941 2.687 1.00 0.00 C ATOM 2058 C PRO A 133 -2.046 -22.610 2.983 1.00 0.00 C ATOM 2059 O PRO A 133 -2.491 -22.684 4.128 1.00 0.00 O ATOM 2060 CB PRO A 133 0.449 -22.840 3.131 1.00 0.00 C ATOM 2061 CG PRO A 133 0.797 -22.361 4.499 1.00 0.00 C ATOM 2062 CD PRO A 133 0.534 -20.881 4.499 1.00 0.00 C ATOM 0 HA PRO A 133 -0.722 -21.739 1.616 1.00 0.00 H new ATOM 0 HB2 PRO A 133 0.154 -23.889 3.142 1.00 0.00 H new ATOM 0 HB3 PRO A 133 1.299 -22.755 2.454 1.00 0.00 H new ATOM 0 HG2 PRO A 133 0.193 -22.865 5.254 1.00 0.00 H new ATOM 0 HG3 PRO A 133 1.841 -22.572 4.733 1.00 0.00 H new ATOM 0 HD2 PRO A 133 0.196 -20.533 5.475 1.00 0.00 H new ATOM 0 HD3 PRO A 133 1.431 -20.314 4.252 1.00 0.00 H new ATOM 2070 N PRO A 134 -2.704 -23.109 1.926 1.00 0.00 N ATOM 2071 CA PRO A 134 -4.001 -23.782 2.047 1.00 0.00 C ATOM 2072 C PRO A 134 -3.889 -25.135 2.742 1.00 0.00 C ATOM 2073 O PRO A 134 -3.064 -25.969 2.368 1.00 0.00 O ATOM 2074 CB PRO A 134 -4.445 -23.962 0.594 1.00 0.00 C ATOM 2075 CG PRO A 134 -3.178 -23.977 -0.190 1.00 0.00 C ATOM 2076 CD PRO A 134 -2.233 -23.056 0.532 1.00 0.00 C ATOM 0 HA PRO A 134 -4.703 -23.209 2.653 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -5.003 -24.889 0.462 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -5.098 -23.149 0.276 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -2.769 -24.986 -0.252 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -3.348 -23.639 -1.212 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -1.200 -23.391 0.444 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -2.275 -22.043 0.132 1.00 0.00 H new