USER MOD reduce.3.24.130724 H: found=0, std=0, add=1535, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1535 hydrogens (26 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 21 THR OG1 : rot 113:sc= 0.109 USER MOD Set 1.2: A 153 TYR OH : rot -146:sc= 1.38 USER MOD Set 2.1: A 6 ASN :FLIP amide:sc= -1.7! C(o=-18!,f=-15!) USER MOD Set 2.2: A 10 GLN :FLIP amide:sc= -7.95! C(o=-18!,f=-15!) USER MOD Set 2.3: A 163 SER OG : rot 115:sc= -1.73! USER MOD Set 2.4: A 164 GLN :FLIP amide:sc= -3.16! C(o=-17!,f=-15!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -173:sc= -0.77 (180deg=-1.33) USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=0.13) USER MOD Single : A 9 SER OG : rot -84:sc= 0.764 USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 91:sc= 1.14 USER MOD Single : A 33 GLN : amide:sc= -3.09! C(o=-3.1!,f=-6.2!) USER MOD Single : A 34 HIS : no HD1:sc= -0.103 X(o=-0.1,f=0.014) USER MOD Single : A 36 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 155:sc= -0.841 (180deg=-1.57) USER MOD Single : A 44 SER OG : rot 180:sc=-0.00391 USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 156:sc= -0.0638 (180deg=-0.496) USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.554 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 TYR OH : rot 165:sc= -1.18 USER MOD Single : A 80 SER OG : rot 24:sc= -0.865 USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=0.0091) USER MOD Single : A 88 THR OG1 : rot -13:sc= 0.273 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 HIS : no HD1:sc= -1.62 K(o=-1.6,f=-3.8!) USER MOD Single : A 92 THR OG1 : rot -27:sc=0.000342 USER MOD Single : A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -0.821 K(o=-0.82,f=-2.7!) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= -1.71 USER MOD Single : A 103 THR OG1 : rot 58:sc= 0.561 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 MET CE :methyl -160:sc= -0.103 (180deg=-0.845) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 GLN : amide:sc= -3.28! C(o=-3.3!,f=-3.2!) USER MOD Single : A 127 SER OG : rot 50:sc= 0.887 USER MOD Single : A 134 GLN : amide:sc= -1.08 K(o=-1.1,f=-3.2!) USER MOD Single : A 142 MET CE :methyl -162:sc= -4.32 (180deg=-6.08!) USER MOD Single : A 144 GLN : amide:sc= -2.74 K(o=-2.7,f=-7.8!) USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 169 LYS NZ :NH3+ -153:sc= -4.79! (180deg=-4.94!) USER MOD Single : A 170 LYS NZ :NH3+ -162:sc=-0.00974 (180deg=-0.187) USER MOD Single : A 178 HIS : no HD1:sc= -0.107 X(o=-0.11,f=0) USER MOD Single : A 179 HIS :FLIP no HD1:sc= 0.402 F(o=-2.1!,f=0.4) USER MOD Single : A 180 HIS : no HD1:sc= 0 X(o=0,f=-0.0016) USER MOD Single : A 181 HIS : no HE2:sc= -1.32! C(o=-1.3!,f=-3.2!) USER MOD Single : A 182 HIS : no HD1:sc= -0.0817 X(o=-0.082,f=-0.12) USER MOD Single : A 183 HIS : no HD1:sc= -0.0128 X(o=-0.013,f=-0.013) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 15.552 -23.736 -2.703 1.00 0.00 N ATOM 2 CA MET A 1 14.254 -23.614 -1.979 1.00 0.00 C ATOM 3 C MET A 1 13.238 -22.917 -2.877 1.00 0.00 C ATOM 4 O MET A 1 12.125 -22.609 -2.452 1.00 0.00 O ATOM 5 CB MET A 1 14.462 -22.805 -0.697 1.00 0.00 C ATOM 6 CG MET A 1 15.610 -23.414 0.111 1.00 0.00 C ATOM 7 SD MET A 1 15.676 -22.640 1.746 1.00 0.00 S ATOM 8 CE MET A 1 14.570 -23.796 2.589 1.00 0.00 C ATOM 0 H1 MET A 1 16.210 -24.314 -2.142 1.00 0.00 H new ATOM 0 H2 MET A 1 15.394 -24.189 -3.626 1.00 0.00 H new ATOM 0 H3 MET A 1 15.959 -22.790 -2.847 1.00 0.00 H new ATOM 0 HA MET A 1 13.881 -24.605 -1.720 1.00 0.00 H new ATOM 0 HB2 MET A 1 14.686 -21.767 -0.942 1.00 0.00 H new ATOM 0 HB3 MET A 1 13.547 -22.802 -0.104 1.00 0.00 H new ATOM 0 HG2 MET A 1 15.467 -24.490 0.212 1.00 0.00 H new ATOM 0 HG3 MET A 1 16.555 -23.266 -0.411 1.00 0.00 H new ATOM 0 HE1 MET A 1 14.465 -23.503 3.634 1.00 0.00 H new ATOM 0 HE2 MET A 1 13.592 -23.781 2.107 1.00 0.00 H new ATOM 0 HE3 MET A 1 14.986 -24.802 2.535 1.00 0.00 H new ATOM 20 N LEU A 2 13.629 -22.672 -4.125 1.00 0.00 N ATOM 21 CA LEU A 2 12.744 -22.011 -5.076 1.00 0.00 C ATOM 22 C LEU A 2 11.701 -22.992 -5.606 1.00 0.00 C ATOM 23 O LEU A 2 10.512 -22.676 -5.667 1.00 0.00 O ATOM 24 CB LEU A 2 13.559 -21.437 -6.243 1.00 0.00 C ATOM 25 CG LEU A 2 14.758 -22.351 -6.541 1.00 0.00 C ATOM 26 CD1 LEU A 2 15.093 -22.287 -8.034 1.00 0.00 C ATOM 27 CD2 LEU A 2 15.977 -21.890 -5.731 1.00 0.00 C ATOM 0 H LEU A 2 14.546 -22.919 -4.498 1.00 0.00 H new ATOM 0 HA LEU A 2 12.231 -21.197 -4.563 1.00 0.00 H new ATOM 0 HB2 LEU A 2 12.930 -21.347 -7.128 1.00 0.00 H new ATOM 0 HB3 LEU A 2 13.907 -20.434 -5.997 1.00 0.00 H new ATOM 0 HG LEU A 2 14.504 -23.374 -6.265 1.00 0.00 H new ATOM 0 HD11 LEU A 2 15.943 -22.936 -8.244 1.00 0.00 H new ATOM 0 HD12 LEU A 2 14.232 -22.618 -8.615 1.00 0.00 H new ATOM 0 HD13 LEU A 2 15.342 -21.262 -8.307 1.00 0.00 H new ATOM 0 HD21 LEU A 2 16.824 -22.541 -5.946 1.00 0.00 H new ATOM 0 HD22 LEU A 2 16.229 -20.865 -6.004 1.00 0.00 H new ATOM 0 HD23 LEU A 2 15.745 -21.936 -4.667 1.00 0.00 H new ATOM 39 N ARG A 3 12.153 -24.184 -5.985 1.00 0.00 N ATOM 40 CA ARG A 3 11.247 -25.201 -6.504 1.00 0.00 C ATOM 41 C ARG A 3 10.086 -25.415 -5.541 1.00 0.00 C ATOM 42 O ARG A 3 8.970 -25.727 -5.957 1.00 0.00 O ATOM 43 CB ARG A 3 12.000 -26.518 -6.707 1.00 0.00 C ATOM 44 CG ARG A 3 12.917 -26.400 -7.927 1.00 0.00 C ATOM 45 CD ARG A 3 13.939 -27.537 -7.909 1.00 0.00 C ATOM 46 NE ARG A 3 14.792 -27.429 -6.731 1.00 0.00 N ATOM 47 CZ ARG A 3 15.831 -28.239 -6.557 1.00 0.00 C ATOM 48 NH1 ARG A 3 16.103 -29.151 -7.450 1.00 0.00 N ATOM 49 NH2 ARG A 3 16.579 -28.122 -5.494 1.00 0.00 N ATOM 0 H ARG A 3 13.132 -24.467 -5.943 1.00 0.00 H new ATOM 0 HA ARG A 3 10.853 -24.861 -7.462 1.00 0.00 H new ATOM 0 HB2 ARG A 3 12.587 -26.754 -5.819 1.00 0.00 H new ATOM 0 HB3 ARG A 3 11.293 -27.335 -6.848 1.00 0.00 H new ATOM 0 HG2 ARG A 3 12.328 -26.441 -8.843 1.00 0.00 H new ATOM 0 HG3 ARG A 3 13.428 -25.437 -7.919 1.00 0.00 H new ATOM 0 HD2 ARG A 3 13.425 -28.498 -7.908 1.00 0.00 H new ATOM 0 HD3 ARG A 3 14.548 -27.503 -8.812 1.00 0.00 H new ATOM 0 HE ARG A 3 14.587 -26.719 -6.028 1.00 0.00 H new ATOM 0 HH11 ARG A 3 15.518 -29.242 -8.281 1.00 0.00 H new ATOM 0 HH12 ARG A 3 16.900 -29.773 -7.317 1.00 0.00 H new ATOM 0 HH21 ARG A 3 16.366 -27.409 -4.797 1.00 0.00 H new ATOM 0 HH22 ARG A 3 17.376 -28.744 -5.361 1.00 0.00 H new ATOM 63 N PHE A 4 10.356 -25.243 -4.251 1.00 0.00 N ATOM 64 CA PHE A 4 9.324 -25.416 -3.236 1.00 0.00 C ATOM 65 C PHE A 4 8.389 -24.210 -3.218 1.00 0.00 C ATOM 66 O PHE A 4 7.173 -24.357 -3.111 1.00 0.00 O ATOM 67 CB PHE A 4 9.967 -25.593 -1.857 1.00 0.00 C ATOM 68 CG PHE A 4 8.974 -26.233 -0.916 1.00 0.00 C ATOM 69 CD1 PHE A 4 7.933 -25.470 -0.374 1.00 0.00 C ATOM 70 CD2 PHE A 4 9.094 -27.588 -0.586 1.00 0.00 C ATOM 71 CE1 PHE A 4 7.011 -26.063 0.497 1.00 0.00 C ATOM 72 CE2 PHE A 4 8.173 -28.181 0.285 1.00 0.00 C ATOM 73 CZ PHE A 4 7.132 -27.418 0.827 1.00 0.00 C ATOM 0 H PHE A 4 11.273 -24.986 -3.886 1.00 0.00 H new ATOM 0 HA PHE A 4 8.745 -26.307 -3.478 1.00 0.00 H new ATOM 0 HB2 PHE A 4 10.860 -26.213 -1.937 1.00 0.00 H new ATOM 0 HB3 PHE A 4 10.284 -24.627 -1.465 1.00 0.00 H new ATOM 0 HD1 PHE A 4 7.841 -24.424 -0.628 1.00 0.00 H new ATOM 0 HD2 PHE A 4 9.898 -28.176 -1.004 1.00 0.00 H new ATOM 0 HE1 PHE A 4 6.207 -25.475 0.914 1.00 0.00 H new ATOM 0 HE2 PHE A 4 8.265 -29.227 0.539 1.00 0.00 H new ATOM 0 HZ PHE A 4 6.422 -27.875 1.500 1.00 0.00 H new ATOM 83 N LEU A 5 8.967 -23.017 -3.326 1.00 0.00 N ATOM 84 CA LEU A 5 8.174 -21.794 -3.323 1.00 0.00 C ATOM 85 C LEU A 5 6.979 -21.939 -4.259 1.00 0.00 C ATOM 86 O LEU A 5 5.875 -21.487 -3.949 1.00 0.00 O ATOM 87 CB LEU A 5 9.039 -20.610 -3.770 1.00 0.00 C ATOM 88 CG LEU A 5 8.272 -19.296 -3.572 1.00 0.00 C ATOM 89 CD1 LEU A 5 8.279 -18.902 -2.091 1.00 0.00 C ATOM 90 CD2 LEU A 5 8.943 -18.191 -4.392 1.00 0.00 C ATOM 0 H LEU A 5 9.973 -22.872 -3.416 1.00 0.00 H new ATOM 0 HA LEU A 5 7.812 -21.614 -2.311 1.00 0.00 H new ATOM 0 HB2 LEU A 5 9.966 -20.589 -3.197 1.00 0.00 H new ATOM 0 HB3 LEU A 5 9.315 -20.726 -4.818 1.00 0.00 H new ATOM 0 HG LEU A 5 7.242 -19.430 -3.902 1.00 0.00 H new ATOM 0 HD11 LEU A 5 7.732 -17.968 -1.960 1.00 0.00 H new ATOM 0 HD12 LEU A 5 7.802 -19.687 -1.503 1.00 0.00 H new ATOM 0 HD13 LEU A 5 9.307 -18.770 -1.754 1.00 0.00 H new ATOM 0 HD21 LEU A 5 8.401 -17.255 -4.254 1.00 0.00 H new ATOM 0 HD22 LEU A 5 9.973 -18.066 -4.059 1.00 0.00 H new ATOM 0 HD23 LEU A 5 8.933 -18.464 -5.447 1.00 0.00 H new ATOM 102 N ASN A 6 7.206 -22.575 -5.402 1.00 0.00 N ATOM 103 CA ASN A 6 6.142 -22.779 -6.379 1.00 0.00 C ATOM 104 C ASN A 6 5.084 -23.722 -5.818 1.00 0.00 C ATOM 105 O ASN A 6 3.931 -23.706 -6.246 1.00 0.00 O ATOM 106 CB ASN A 6 6.724 -23.365 -7.668 1.00 0.00 C ATOM 107 CG ASN A 6 5.737 -23.180 -8.817 1.00 0.00 C ATOM 108 OD1 ASN A 6 5.363 -21.977 -9.154 1.00 0.00 O flip ATOM 109 ND2 ASN A 6 5.296 -24.158 -9.422 1.00 0.00 N flip ATOM 0 H ASN A 6 8.112 -22.957 -5.675 1.00 0.00 H new ATOM 0 HA ASN A 6 5.678 -21.817 -6.598 1.00 0.00 H new ATOM 0 HB2 ASN A 6 7.668 -22.875 -7.906 1.00 0.00 H new ATOM 0 HB3 ASN A 6 6.940 -24.424 -7.530 1.00 0.00 H new ATOM 0 HD21 ASN A 6 5.591 -25.098 -9.156 1.00 0.00 H new ATOM 0 HD22 ASN A 6 4.636 -24.028 -10.189 1.00 0.00 H new ATOM 116 N GLN A 7 5.492 -24.548 -4.861 1.00 0.00 N ATOM 117 CA GLN A 7 4.579 -25.505 -4.247 1.00 0.00 C ATOM 118 C GLN A 7 3.726 -24.833 -3.175 1.00 0.00 C ATOM 119 O GLN A 7 2.511 -25.031 -3.120 1.00 0.00 O ATOM 120 CB GLN A 7 5.370 -26.655 -3.620 1.00 0.00 C ATOM 121 CG GLN A 7 4.405 -27.758 -3.183 1.00 0.00 C ATOM 122 CD GLN A 7 5.187 -28.977 -2.704 1.00 0.00 C ATOM 123 OE1 GLN A 7 5.729 -28.973 -1.599 1.00 0.00 O ATOM 124 NE2 GLN A 7 5.277 -30.027 -3.474 1.00 0.00 N ATOM 0 H GLN A 7 6.444 -24.575 -4.495 1.00 0.00 H new ATOM 0 HA GLN A 7 3.922 -25.893 -5.025 1.00 0.00 H new ATOM 0 HB2 GLN A 7 6.089 -27.050 -4.338 1.00 0.00 H new ATOM 0 HB3 GLN A 7 5.939 -26.294 -2.763 1.00 0.00 H new ATOM 0 HG2 GLN A 7 3.760 -27.393 -2.384 1.00 0.00 H new ATOM 0 HG3 GLN A 7 3.757 -28.035 -4.014 1.00 0.00 H new ATOM 0 HE21 GLN A 7 4.827 -30.028 -4.389 1.00 0.00 H new ATOM 0 HE22 GLN A 7 5.797 -30.846 -3.160 1.00 0.00 H new ATOM 133 N ALA A 8 4.369 -24.040 -2.326 1.00 0.00 N ATOM 134 CA ALA A 8 3.661 -23.346 -1.255 1.00 0.00 C ATOM 135 C ALA A 8 2.627 -22.377 -1.827 1.00 0.00 C ATOM 136 O ALA A 8 1.533 -22.231 -1.282 1.00 0.00 O ATOM 137 CB ALA A 8 4.659 -22.578 -0.384 1.00 0.00 C ATOM 0 H ALA A 8 5.373 -23.862 -2.357 1.00 0.00 H new ATOM 0 HA ALA A 8 3.143 -24.089 -0.648 1.00 0.00 H new ATOM 0 HB1 ALA A 8 4.124 -22.062 0.414 1.00 0.00 H new ATOM 0 HB2 ALA A 8 5.374 -23.276 0.051 1.00 0.00 H new ATOM 0 HB3 ALA A 8 5.190 -21.849 -0.996 1.00 0.00 H new ATOM 143 N SER A 9 2.981 -21.714 -2.922 1.00 0.00 N ATOM 144 CA SER A 9 2.075 -20.758 -3.548 1.00 0.00 C ATOM 145 C SER A 9 0.982 -21.483 -4.325 1.00 0.00 C ATOM 146 O SER A 9 -0.170 -21.050 -4.344 1.00 0.00 O ATOM 147 CB SER A 9 2.854 -19.842 -4.492 1.00 0.00 C ATOM 148 OG SER A 9 3.562 -20.635 -5.438 1.00 0.00 O ATOM 0 H SER A 9 3.880 -21.819 -3.391 1.00 0.00 H new ATOM 0 HA SER A 9 1.610 -20.160 -2.764 1.00 0.00 H new ATOM 0 HB2 SER A 9 2.172 -19.165 -5.006 1.00 0.00 H new ATOM 0 HB3 SER A 9 3.550 -19.223 -3.925 1.00 0.00 H new ATOM 0 HG SER A 9 4.413 -20.927 -5.049 1.00 0.00 H new ATOM 154 N GLN A 10 1.350 -22.588 -4.963 1.00 0.00 N ATOM 155 CA GLN A 10 0.389 -23.365 -5.737 1.00 0.00 C ATOM 156 C GLN A 10 -0.651 -24.000 -4.818 1.00 0.00 C ATOM 157 O GLN A 10 -1.509 -24.760 -5.266 1.00 0.00 O ATOM 158 CB GLN A 10 1.116 -24.458 -6.529 1.00 0.00 C ATOM 159 CG GLN A 10 1.706 -23.858 -7.809 1.00 0.00 C ATOM 160 CD GLN A 10 2.744 -24.807 -8.399 1.00 0.00 C ATOM 161 OE1 GLN A 10 2.927 -24.836 -9.691 1.00 0.00 O flip ATOM 162 NE2 GLN A 10 3.406 -25.539 -7.664 1.00 0.00 N flip ATOM 0 H GLN A 10 2.298 -22.964 -4.960 1.00 0.00 H new ATOM 0 HA GLN A 10 -0.119 -22.695 -6.430 1.00 0.00 H new ATOM 0 HB2 GLN A 10 1.908 -24.896 -5.922 1.00 0.00 H new ATOM 0 HB3 GLN A 10 0.424 -25.262 -6.778 1.00 0.00 H new ATOM 0 HG2 GLN A 10 0.913 -23.676 -8.535 1.00 0.00 H new ATOM 0 HG3 GLN A 10 2.165 -22.894 -7.591 1.00 0.00 H new ATOM 0 HE21 GLN A 10 3.261 -25.514 -6.655 1.00 0.00 H new ATOM 0 HE22 GLN A 10 4.100 -26.171 -8.064 1.00 0.00 H new ATOM 171 N GLY A 11 -0.580 -23.662 -3.532 1.00 0.00 N ATOM 172 CA GLY A 11 -1.533 -24.181 -2.556 1.00 0.00 C ATOM 173 C GLY A 11 -2.621 -23.144 -2.300 1.00 0.00 C ATOM 174 O GLY A 11 -2.362 -21.939 -2.318 1.00 0.00 O ATOM 0 H GLY A 11 0.124 -23.034 -3.144 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -1.978 -25.106 -2.924 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -1.020 -24.422 -1.625 1.00 0.00 H new ATOM 178 N ARG A 12 -3.840 -23.617 -2.061 1.00 0.00 N ATOM 179 CA ARG A 12 -4.961 -22.723 -1.805 1.00 0.00 C ATOM 180 C ARG A 12 -4.805 -22.032 -0.456 1.00 0.00 C ATOM 181 O ARG A 12 -4.951 -20.814 -0.352 1.00 0.00 O ATOM 182 CB ARG A 12 -6.272 -23.510 -1.830 1.00 0.00 C ATOM 183 CG ARG A 12 -6.320 -24.382 -3.087 1.00 0.00 C ATOM 184 CD ARG A 12 -7.734 -24.936 -3.271 1.00 0.00 C ATOM 185 NE ARG A 12 -8.270 -25.384 -1.991 1.00 0.00 N ATOM 186 CZ ARG A 12 -9.506 -25.861 -1.893 1.00 0.00 C ATOM 187 NH1 ARG A 12 -10.263 -25.936 -2.954 1.00 0.00 N ATOM 188 NH2 ARG A 12 -9.965 -26.256 -0.737 1.00 0.00 N ATOM 0 H ARG A 12 -4.075 -24.609 -2.039 1.00 0.00 H new ATOM 0 HA ARG A 12 -4.978 -21.963 -2.586 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -6.352 -24.133 -0.939 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -7.120 -22.825 -1.817 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -6.031 -23.796 -3.960 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -5.606 -25.201 -3.002 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -8.381 -24.168 -3.696 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -7.718 -25.766 -3.977 1.00 0.00 H new ATOM 0 HE ARG A 12 -7.686 -25.330 -1.157 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -9.905 -25.628 -3.858 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -11.212 -26.302 -2.879 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -9.375 -26.199 0.093 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -10.914 -26.622 -0.663 1.00 0.00 H new ATOM 202 N GLY A 13 -4.506 -22.813 0.578 1.00 0.00 N ATOM 203 CA GLY A 13 -4.331 -22.264 1.916 1.00 0.00 C ATOM 204 C GLY A 13 -3.518 -20.980 1.864 1.00 0.00 C ATOM 205 O GLY A 13 -3.866 -19.981 2.493 1.00 0.00 O ATOM 0 H GLY A 13 -4.381 -23.823 0.514 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -5.305 -22.067 2.364 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -3.829 -22.993 2.552 1.00 0.00 H new ATOM 209 N ALA A 14 -2.433 -21.020 1.098 1.00 0.00 N ATOM 210 CA ALA A 14 -1.570 -19.858 0.953 1.00 0.00 C ATOM 211 C ALA A 14 -2.340 -18.709 0.314 1.00 0.00 C ATOM 212 O ALA A 14 -2.297 -17.577 0.795 1.00 0.00 O ATOM 213 CB ALA A 14 -0.359 -20.213 0.088 1.00 0.00 C ATOM 0 H ALA A 14 -2.133 -21.841 0.571 1.00 0.00 H new ATOM 0 HA ALA A 14 -1.227 -19.549 1.941 1.00 0.00 H new ATOM 0 HB1 ALA A 14 0.283 -19.338 -0.016 1.00 0.00 H new ATOM 0 HB2 ALA A 14 0.201 -21.020 0.560 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -0.697 -20.534 -0.897 1.00 0.00 H new ATOM 219 N TRP A 15 -3.045 -19.008 -0.774 1.00 0.00 N ATOM 220 CA TRP A 15 -3.820 -17.984 -1.466 1.00 0.00 C ATOM 221 C TRP A 15 -4.840 -17.359 -0.517 1.00 0.00 C ATOM 222 O TRP A 15 -4.959 -16.136 -0.438 1.00 0.00 O ATOM 223 CB TRP A 15 -4.536 -18.593 -2.675 1.00 0.00 C ATOM 224 CG TRP A 15 -3.567 -18.743 -3.808 1.00 0.00 C ATOM 225 CD1 TRP A 15 -3.177 -19.920 -4.346 1.00 0.00 C ATOM 226 CD2 TRP A 15 -2.864 -17.702 -4.547 1.00 0.00 C ATOM 227 NE1 TRP A 15 -2.276 -19.670 -5.367 1.00 0.00 N ATOM 228 CE2 TRP A 15 -2.053 -18.317 -5.529 1.00 0.00 C ATOM 229 CE3 TRP A 15 -2.851 -16.297 -4.460 1.00 0.00 C ATOM 230 CZ2 TRP A 15 -1.257 -17.565 -6.395 1.00 0.00 C ATOM 231 CZ3 TRP A 15 -2.052 -15.538 -5.331 1.00 0.00 C ATOM 232 CH2 TRP A 15 -1.257 -16.172 -6.296 1.00 0.00 C ATOM 0 H TRP A 15 -3.096 -19.938 -1.190 1.00 0.00 H new ATOM 0 HA TRP A 15 -3.139 -17.206 -1.811 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -4.956 -19.564 -2.411 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -5.368 -17.957 -2.976 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -3.513 -20.897 -4.031 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -1.832 -20.395 -5.930 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -3.459 -15.800 -3.719 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -0.645 -18.057 -7.137 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -2.050 -14.461 -5.257 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -0.645 -15.583 -6.963 1.00 0.00 H new ATOM 243 N LEU A 16 -5.567 -18.204 0.210 1.00 0.00 N ATOM 244 CA LEU A 16 -6.563 -17.714 1.156 1.00 0.00 C ATOM 245 C LEU A 16 -5.889 -16.844 2.211 1.00 0.00 C ATOM 246 O LEU A 16 -6.505 -15.940 2.774 1.00 0.00 O ATOM 247 CB LEU A 16 -7.272 -18.896 1.828 1.00 0.00 C ATOM 248 CG LEU A 16 -8.294 -18.385 2.853 1.00 0.00 C ATOM 249 CD1 LEU A 16 -9.333 -17.498 2.157 1.00 0.00 C ATOM 250 CD2 LEU A 16 -8.998 -19.582 3.500 1.00 0.00 C ATOM 0 H LEU A 16 -5.486 -19.220 0.163 1.00 0.00 H new ATOM 0 HA LEU A 16 -7.301 -17.117 0.620 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -7.773 -19.505 1.076 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -6.540 -19.537 2.321 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.780 -17.801 3.616 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -10.055 -17.139 2.891 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -8.833 -16.647 1.693 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -9.851 -18.076 1.391 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -9.725 -19.226 4.229 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.509 -20.162 2.732 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -8.261 -20.211 4.000 1.00 0.00 H new ATOM 262 N LEU A 17 -4.619 -17.132 2.472 1.00 0.00 N ATOM 263 CA LEU A 17 -3.858 -16.379 3.462 1.00 0.00 C ATOM 264 C LEU A 17 -3.590 -14.961 2.963 1.00 0.00 C ATOM 265 O LEU A 17 -3.471 -14.028 3.757 1.00 0.00 O ATOM 266 CB LEU A 17 -2.526 -17.095 3.744 1.00 0.00 C ATOM 267 CG LEU A 17 -2.424 -17.461 5.231 1.00 0.00 C ATOM 268 CD1 LEU A 17 -3.392 -18.605 5.554 1.00 0.00 C ATOM 269 CD2 LEU A 17 -0.993 -17.905 5.544 1.00 0.00 C ATOM 0 H LEU A 17 -4.096 -17.878 2.014 1.00 0.00 H new ATOM 0 HA LEU A 17 -4.439 -16.319 4.382 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -2.453 -17.996 3.135 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -1.692 -16.452 3.463 1.00 0.00 H new ATOM 0 HG LEU A 17 -2.682 -16.591 5.835 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -3.314 -18.860 6.611 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -4.412 -18.293 5.330 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -3.139 -19.477 4.951 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -0.916 -18.166 6.599 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.740 -18.774 4.936 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -0.303 -17.092 5.320 1.00 0.00 H new ATOM 281 N MET A 18 -3.496 -14.804 1.646 1.00 0.00 N ATOM 282 CA MET A 18 -3.241 -13.494 1.060 1.00 0.00 C ATOM 283 C MET A 18 -4.500 -12.638 1.121 1.00 0.00 C ATOM 284 O MET A 18 -4.424 -11.417 1.263 1.00 0.00 O ATOM 285 CB MET A 18 -2.788 -13.653 -0.400 1.00 0.00 C ATOM 286 CG MET A 18 -1.275 -13.439 -0.503 1.00 0.00 C ATOM 287 SD MET A 18 -0.419 -14.678 0.502 1.00 0.00 S ATOM 288 CE MET A 18 1.199 -13.869 0.526 1.00 0.00 C ATOM 0 H MET A 18 -3.592 -15.561 0.970 1.00 0.00 H new ATOM 0 HA MET A 18 -2.451 -13.002 1.628 1.00 0.00 H new ATOM 0 HB2 MET A 18 -3.049 -14.646 -0.765 1.00 0.00 H new ATOM 0 HB3 MET A 18 -3.310 -12.934 -1.032 1.00 0.00 H new ATOM 0 HG2 MET A 18 -0.956 -13.515 -1.543 1.00 0.00 H new ATOM 0 HG3 MET A 18 -1.015 -12.437 -0.163 1.00 0.00 H new ATOM 0 HE1 MET A 18 1.899 -14.472 1.104 1.00 0.00 H new ATOM 0 HE2 MET A 18 1.568 -13.763 -0.494 1.00 0.00 H new ATOM 0 HE3 MET A 18 1.106 -12.884 0.983 1.00 0.00 H new ATOM 298 N ALA A 19 -5.658 -13.278 1.007 1.00 0.00 N ATOM 299 CA ALA A 19 -6.924 -12.558 1.044 1.00 0.00 C ATOM 300 C ALA A 19 -7.197 -12.024 2.445 1.00 0.00 C ATOM 301 O ALA A 19 -7.454 -10.833 2.624 1.00 0.00 O ATOM 302 CB ALA A 19 -8.064 -13.485 0.614 1.00 0.00 C ATOM 0 H ALA A 19 -5.746 -14.287 0.889 1.00 0.00 H new ATOM 0 HA ALA A 19 -6.862 -11.716 0.355 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -9.007 -12.940 0.644 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -7.882 -13.839 -0.401 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -8.116 -14.337 1.292 1.00 0.00 H new ATOM 308 N PHE A 20 -7.147 -12.909 3.436 1.00 0.00 N ATOM 309 CA PHE A 20 -7.397 -12.520 4.819 1.00 0.00 C ATOM 310 C PHE A 20 -6.542 -11.316 5.203 1.00 0.00 C ATOM 311 O PHE A 20 -7.052 -10.311 5.694 1.00 0.00 O ATOM 312 CB PHE A 20 -7.084 -13.700 5.752 1.00 0.00 C ATOM 313 CG PHE A 20 -8.139 -13.801 6.832 1.00 0.00 C ATOM 314 CD1 PHE A 20 -8.353 -12.726 7.702 1.00 0.00 C ATOM 315 CD2 PHE A 20 -8.901 -14.970 6.963 1.00 0.00 C ATOM 316 CE1 PHE A 20 -9.329 -12.819 8.704 1.00 0.00 C ATOM 317 CE2 PHE A 20 -9.876 -15.063 7.964 1.00 0.00 C ATOM 318 CZ PHE A 20 -10.090 -13.987 8.833 1.00 0.00 C ATOM 0 H PHE A 20 -6.936 -13.899 3.307 1.00 0.00 H new ATOM 0 HA PHE A 20 -8.447 -12.244 4.919 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -7.048 -14.627 5.180 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -6.101 -13.566 6.204 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -7.766 -11.825 7.602 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -8.736 -15.800 6.292 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -9.494 -11.990 9.376 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -10.462 -15.964 8.065 1.00 0.00 H new ATOM 0 HZ PHE A 20 -10.843 -14.058 9.604 1.00 0.00 H new ATOM 328 N THR A 21 -5.237 -11.430 4.977 1.00 0.00 N ATOM 329 CA THR A 21 -4.320 -10.345 5.306 1.00 0.00 C ATOM 330 C THR A 21 -4.842 -9.015 4.771 1.00 0.00 C ATOM 331 O THR A 21 -5.042 -8.066 5.529 1.00 0.00 O ATOM 332 CB THR A 21 -2.940 -10.632 4.707 1.00 0.00 C ATOM 333 OG1 THR A 21 -3.078 -10.900 3.319 1.00 0.00 O ATOM 334 CG2 THR A 21 -2.314 -11.842 5.403 1.00 0.00 C ATOM 0 H THR A 21 -4.794 -12.254 4.571 1.00 0.00 H new ATOM 0 HA THR A 21 -4.242 -10.278 6.391 1.00 0.00 H new ATOM 0 HB THR A 21 -2.295 -9.765 4.851 1.00 0.00 H new ATOM 0 HG1 THR A 21 -2.652 -10.183 2.804 1.00 0.00 H new ATOM 0 HG21 THR A 21 -1.333 -12.042 4.973 1.00 0.00 H new ATOM 0 HG22 THR A 21 -2.208 -11.635 6.468 1.00 0.00 H new ATOM 0 HG23 THR A 21 -2.955 -12.713 5.265 1.00 0.00 H new ATOM 342 N ALA A 22 -5.057 -8.951 3.462 1.00 0.00 N ATOM 343 CA ALA A 22 -5.550 -7.730 2.834 1.00 0.00 C ATOM 344 C ALA A 22 -6.811 -7.222 3.531 1.00 0.00 C ATOM 345 O ALA A 22 -7.068 -6.019 3.561 1.00 0.00 O ATOM 346 CB ALA A 22 -5.856 -7.991 1.357 1.00 0.00 C ATOM 0 H ALA A 22 -4.899 -9.726 2.817 1.00 0.00 H new ATOM 0 HA ALA A 22 -4.775 -6.969 2.922 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.224 -7.075 0.894 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -4.948 -8.315 0.849 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -6.615 -8.769 1.275 1.00 0.00 H new ATOM 352 N LEU A 23 -7.595 -8.142 4.085 1.00 0.00 N ATOM 353 CA LEU A 23 -8.829 -7.766 4.769 1.00 0.00 C ATOM 354 C LEU A 23 -8.539 -7.297 6.193 1.00 0.00 C ATOM 355 O LEU A 23 -9.160 -6.354 6.684 1.00 0.00 O ATOM 356 CB LEU A 23 -9.789 -8.962 4.806 1.00 0.00 C ATOM 357 CG LEU A 23 -11.196 -8.504 5.236 1.00 0.00 C ATOM 358 CD1 LEU A 23 -12.255 -9.288 4.458 1.00 0.00 C ATOM 359 CD2 LEU A 23 -11.391 -8.756 6.737 1.00 0.00 C ATOM 0 H LEU A 23 -7.401 -9.143 4.075 1.00 0.00 H new ATOM 0 HA LEU A 23 -9.289 -6.945 4.220 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.836 -9.430 3.823 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -9.416 -9.715 5.500 1.00 0.00 H new ATOM 0 HG LEU A 23 -11.299 -7.439 5.027 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -13.248 -8.961 4.765 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -12.128 -9.110 3.390 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -12.144 -10.353 4.664 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.388 -8.430 7.034 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.280 -9.820 6.945 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -10.644 -8.197 7.300 1.00 0.00 H new ATOM 371 N ALA A 24 -7.599 -7.963 6.854 1.00 0.00 N ATOM 372 CA ALA A 24 -7.240 -7.608 8.223 1.00 0.00 C ATOM 373 C ALA A 24 -6.951 -6.114 8.341 1.00 0.00 C ATOM 374 O ALA A 24 -7.356 -5.470 9.308 1.00 0.00 O ATOM 375 CB ALA A 24 -6.010 -8.403 8.664 1.00 0.00 C ATOM 0 H ALA A 24 -7.074 -8.747 6.467 1.00 0.00 H new ATOM 0 HA ALA A 24 -8.083 -7.851 8.869 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -5.749 -8.132 9.687 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -6.230 -9.470 8.616 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -5.173 -8.175 8.004 1.00 0.00 H new ATOM 381 N LEU A 25 -6.247 -5.570 7.355 1.00 0.00 N ATOM 382 CA LEU A 25 -5.906 -4.151 7.362 1.00 0.00 C ATOM 383 C LEU A 25 -7.153 -3.295 7.156 1.00 0.00 C ATOM 384 O LEU A 25 -7.255 -2.191 7.691 1.00 0.00 O ATOM 385 CB LEU A 25 -4.887 -3.854 6.257 1.00 0.00 C ATOM 386 CG LEU A 25 -3.479 -4.204 6.747 1.00 0.00 C ATOM 387 CD1 LEU A 25 -3.457 -5.644 7.259 1.00 0.00 C ATOM 388 CD2 LEU A 25 -2.489 -4.063 5.589 1.00 0.00 C ATOM 0 H LEU A 25 -5.903 -6.086 6.545 1.00 0.00 H new ATOM 0 HA LEU A 25 -5.472 -3.906 8.331 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -5.126 -4.431 5.364 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.935 -2.801 5.978 1.00 0.00 H new ATOM 0 HG LEU A 25 -3.198 -3.528 7.554 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -2.454 -5.891 7.607 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.163 -5.748 8.083 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.738 -6.321 6.453 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -1.486 -4.312 5.936 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.773 -4.740 4.783 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -2.502 -3.037 5.222 1.00 0.00 H new ATOM 400 N GLU A 26 -8.097 -3.811 6.376 1.00 0.00 N ATOM 401 CA GLU A 26 -9.330 -3.082 6.106 1.00 0.00 C ATOM 402 C GLU A 26 -10.128 -2.872 7.390 1.00 0.00 C ATOM 403 O GLU A 26 -10.686 -1.798 7.614 1.00 0.00 O ATOM 404 CB GLU A 26 -10.179 -3.856 5.093 1.00 0.00 C ATOM 405 CG GLU A 26 -11.402 -3.022 4.696 1.00 0.00 C ATOM 406 CD GLU A 26 -12.473 -3.104 5.782 1.00 0.00 C ATOM 407 OE1 GLU A 26 -12.375 -3.985 6.621 1.00 0.00 O ATOM 408 OE2 GLU A 26 -13.375 -2.284 5.758 1.00 0.00 O ATOM 0 H GLU A 26 -8.033 -4.723 5.923 1.00 0.00 H new ATOM 0 HA GLU A 26 -9.070 -2.106 5.696 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.585 -4.090 4.210 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.499 -4.805 5.523 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -11.109 -1.984 4.542 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.805 -3.383 3.750 1.00 0.00 H new ATOM 415 N LEU A 27 -10.180 -3.903 8.225 1.00 0.00 N ATOM 416 CA LEU A 27 -10.919 -3.822 9.480 1.00 0.00 C ATOM 417 C LEU A 27 -10.170 -2.967 10.500 1.00 0.00 C ATOM 418 O LEU A 27 -10.746 -2.064 11.108 1.00 0.00 O ATOM 419 CB LEU A 27 -11.134 -5.229 10.048 1.00 0.00 C ATOM 420 CG LEU A 27 -12.084 -5.171 11.251 1.00 0.00 C ATOM 421 CD1 LEU A 27 -13.531 -5.003 10.770 1.00 0.00 C ATOM 422 CD2 LEU A 27 -11.965 -6.469 12.053 1.00 0.00 C ATOM 0 H LEU A 27 -9.723 -4.799 8.058 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.884 -3.356 9.279 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -11.548 -5.881 9.279 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -10.178 -5.658 10.349 1.00 0.00 H new ATOM 0 HG LEU A 27 -11.815 -4.322 11.879 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -14.198 -4.963 11.631 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -13.620 -4.079 10.199 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -13.805 -5.848 10.138 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -12.639 -6.431 12.909 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -12.231 -7.314 11.419 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -10.940 -6.587 12.404 1.00 0.00 H new ATOM 434 N THR A 28 -8.888 -3.260 10.690 1.00 0.00 N ATOM 435 CA THR A 28 -8.078 -2.514 11.646 1.00 0.00 C ATOM 436 C THR A 28 -8.270 -1.012 11.458 1.00 0.00 C ATOM 437 O THR A 28 -8.475 -0.279 12.425 1.00 0.00 O ATOM 438 CB THR A 28 -6.599 -2.866 11.469 1.00 0.00 C ATOM 439 OG1 THR A 28 -6.472 -4.261 11.248 1.00 0.00 O ATOM 440 CG2 THR A 28 -5.823 -2.470 12.728 1.00 0.00 C ATOM 0 H THR A 28 -8.390 -4.003 10.199 1.00 0.00 H new ATOM 0 HA THR A 28 -8.398 -2.787 12.651 1.00 0.00 H new ATOM 0 HB THR A 28 -6.195 -2.325 10.614 1.00 0.00 H new ATOM 0 HG1 THR A 28 -6.500 -4.444 10.286 1.00 0.00 H new ATOM 0 HG21 THR A 28 -4.770 -2.721 12.600 1.00 0.00 H new ATOM 0 HG22 THR A 28 -5.923 -1.397 12.894 1.00 0.00 H new ATOM 0 HG23 THR A 28 -6.223 -3.009 13.587 1.00 0.00 H new ATOM 448 N ALA A 29 -8.201 -0.563 10.210 1.00 0.00 N ATOM 449 CA ALA A 29 -8.365 0.854 9.911 1.00 0.00 C ATOM 450 C ALA A 29 -9.815 1.286 10.109 1.00 0.00 C ATOM 451 O ALA A 29 -10.088 2.444 10.427 1.00 0.00 O ATOM 452 CB ALA A 29 -7.945 1.133 8.468 1.00 0.00 C ATOM 0 H ALA A 29 -8.034 -1.154 9.396 1.00 0.00 H new ATOM 0 HA ALA A 29 -7.734 1.422 10.594 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -8.070 2.194 8.251 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -6.899 0.856 8.333 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.566 0.548 7.789 1.00 0.00 H new ATOM 458 N LEU A 30 -10.740 0.350 9.915 1.00 0.00 N ATOM 459 CA LEU A 30 -12.161 0.642 10.065 1.00 0.00 C ATOM 460 C LEU A 30 -12.502 0.966 11.516 1.00 0.00 C ATOM 461 O LEU A 30 -13.528 1.587 11.795 1.00 0.00 O ATOM 462 CB LEU A 30 -12.993 -0.559 9.600 1.00 0.00 C ATOM 463 CG LEU A 30 -14.434 -0.116 9.304 1.00 0.00 C ATOM 464 CD1 LEU A 30 -14.539 0.366 7.854 1.00 0.00 C ATOM 465 CD2 LEU A 30 -15.386 -1.297 9.513 1.00 0.00 C ATOM 0 H LEU A 30 -10.531 -0.614 9.654 1.00 0.00 H new ATOM 0 HA LEU A 30 -12.396 1.511 9.451 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -12.547 -0.997 8.707 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -12.992 -1.332 10.368 1.00 0.00 H new ATOM 0 HG LEU A 30 -14.704 0.697 9.978 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -15.562 0.679 7.648 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -13.864 1.208 7.701 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -14.265 -0.446 7.180 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -16.408 -0.982 9.303 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -15.111 -2.109 8.840 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -15.317 -1.641 10.545 1.00 0.00 H new ATOM 477 N TRP A 31 -11.644 0.543 12.440 1.00 0.00 N ATOM 478 CA TRP A 31 -11.876 0.795 13.860 1.00 0.00 C ATOM 479 C TRP A 31 -11.282 2.138 14.269 1.00 0.00 C ATOM 480 O TRP A 31 -11.904 2.902 15.006 1.00 0.00 O ATOM 481 CB TRP A 31 -11.245 -0.324 14.696 1.00 0.00 C ATOM 482 CG TRP A 31 -11.246 0.065 16.142 1.00 0.00 C ATOM 483 CD1 TRP A 31 -12.322 0.013 16.960 1.00 0.00 C ATOM 484 CD2 TRP A 31 -10.141 0.563 16.951 1.00 0.00 C ATOM 485 NE1 TRP A 31 -11.948 0.447 18.220 1.00 0.00 N ATOM 486 CE2 TRP A 31 -10.613 0.798 18.264 1.00 0.00 C ATOM 487 CE3 TRP A 31 -8.788 0.833 16.675 1.00 0.00 C ATOM 488 CZ2 TRP A 31 -9.772 1.282 19.268 1.00 0.00 C ATOM 489 CZ3 TRP A 31 -7.939 1.320 17.683 1.00 0.00 C ATOM 490 CH2 TRP A 31 -8.430 1.544 18.977 1.00 0.00 C ATOM 0 H TRP A 31 -10.788 0.028 12.234 1.00 0.00 H new ATOM 0 HA TRP A 31 -12.951 0.819 14.037 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -11.801 -1.251 14.559 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -10.225 -0.511 14.360 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -13.311 -0.314 16.676 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -12.581 0.501 19.018 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -8.399 0.665 15.681 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -10.156 1.453 20.263 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -6.902 1.523 17.460 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -7.773 1.918 19.748 1.00 0.00 H new ATOM 501 N PHE A 32 -10.077 2.420 13.786 1.00 0.00 N ATOM 502 CA PHE A 32 -9.418 3.677 14.114 1.00 0.00 C ATOM 503 C PHE A 32 -10.351 4.849 13.831 1.00 0.00 C ATOM 504 O PHE A 32 -10.501 5.747 14.657 1.00 0.00 O ATOM 505 CB PHE A 32 -8.130 3.825 13.292 1.00 0.00 C ATOM 506 CG PHE A 32 -6.976 3.185 14.031 1.00 0.00 C ATOM 507 CD1 PHE A 32 -6.422 3.822 15.148 1.00 0.00 C ATOM 508 CD2 PHE A 32 -6.463 1.955 13.601 1.00 0.00 C ATOM 509 CE1 PHE A 32 -5.354 3.230 15.833 1.00 0.00 C ATOM 510 CE2 PHE A 32 -5.395 1.364 14.286 1.00 0.00 C ATOM 511 CZ PHE A 32 -4.840 2.001 15.402 1.00 0.00 C ATOM 0 H PHE A 32 -9.543 1.803 13.174 1.00 0.00 H new ATOM 0 HA PHE A 32 -9.165 3.674 15.174 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -8.254 3.356 12.316 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -7.920 4.880 13.114 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -6.818 4.770 15.481 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -6.891 1.462 12.741 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -4.926 3.722 16.694 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -4.999 0.416 13.953 1.00 0.00 H new ATOM 0 HZ PHE A 32 -4.016 1.545 15.930 1.00 0.00 H new ATOM 521 N GLN A 33 -10.981 4.830 12.663 1.00 0.00 N ATOM 522 CA GLN A 33 -11.901 5.898 12.287 1.00 0.00 C ATOM 523 C GLN A 33 -13.170 5.835 13.131 1.00 0.00 C ATOM 524 O GLN A 33 -13.811 6.855 13.380 1.00 0.00 O ATOM 525 CB GLN A 33 -12.262 5.779 10.803 1.00 0.00 C ATOM 526 CG GLN A 33 -13.372 6.782 10.453 1.00 0.00 C ATOM 527 CD GLN A 33 -14.739 6.104 10.522 1.00 0.00 C ATOM 528 OE1 GLN A 33 -15.280 5.905 11.609 1.00 0.00 O ATOM 529 NE2 GLN A 33 -15.330 5.738 9.418 1.00 0.00 N ATOM 0 H GLN A 33 -10.874 4.094 11.965 1.00 0.00 H new ATOM 0 HA GLN A 33 -11.410 6.855 12.464 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -11.381 5.969 10.189 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -12.593 4.765 10.580 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -13.341 7.625 11.143 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -13.207 7.183 9.453 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -14.879 5.904 8.519 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -16.243 5.285 9.454 1.00 0.00 H new ATOM 538 N HIS A 34 -13.527 4.633 13.568 1.00 0.00 N ATOM 539 CA HIS A 34 -14.722 4.454 14.382 1.00 0.00 C ATOM 540 C HIS A 34 -14.535 5.100 15.754 1.00 0.00 C ATOM 541 O HIS A 34 -15.503 5.501 16.400 1.00 0.00 O ATOM 542 CB HIS A 34 -15.019 2.957 14.550 1.00 0.00 C ATOM 543 CG HIS A 34 -16.506 2.732 14.619 1.00 0.00 C ATOM 544 ND1 HIS A 34 -17.119 1.665 13.980 1.00 0.00 N ATOM 545 CD2 HIS A 34 -17.515 3.424 15.241 1.00 0.00 C ATOM 546 CE1 HIS A 34 -18.439 1.746 14.230 1.00 0.00 C ATOM 547 NE2 HIS A 34 -18.734 2.801 14.996 1.00 0.00 N ATOM 0 H HIS A 34 -13.011 3.775 13.374 1.00 0.00 H new ATOM 0 HA HIS A 34 -15.561 4.935 13.879 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -14.597 2.398 13.715 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -14.544 2.583 15.457 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -17.382 4.318 15.832 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -19.171 1.044 13.857 1.00 0.00 H new ATOM 0 HE2 HIS A 34 -19.655 3.087 15.329 1.00 0.00 H new ATOM 556 N VAL A 35 -13.284 5.193 16.196 1.00 0.00 N ATOM 557 CA VAL A 35 -12.981 5.785 17.497 1.00 0.00 C ATOM 558 C VAL A 35 -12.396 7.186 17.342 1.00 0.00 C ATOM 559 O VAL A 35 -12.885 8.141 17.943 1.00 0.00 O ATOM 560 CB VAL A 35 -11.988 4.898 18.251 1.00 0.00 C ATOM 561 CG1 VAL A 35 -11.710 5.496 19.631 1.00 0.00 C ATOM 562 CG2 VAL A 35 -12.584 3.497 18.415 1.00 0.00 C ATOM 0 H VAL A 35 -12.468 4.869 15.677 1.00 0.00 H new ATOM 0 HA VAL A 35 -13.911 5.860 18.060 1.00 0.00 H new ATOM 0 HB VAL A 35 -11.056 4.837 17.689 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -11.003 4.863 20.166 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -11.288 6.495 19.517 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -12.641 5.558 20.195 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -11.879 2.862 18.952 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -13.515 3.561 18.977 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -12.782 3.069 17.433 1.00 0.00 H new ATOM 572 N MET A 36 -11.342 7.303 16.540 1.00 0.00 N ATOM 573 CA MET A 36 -10.698 8.596 16.330 1.00 0.00 C ATOM 574 C MET A 36 -11.530 9.483 15.406 1.00 0.00 C ATOM 575 O MET A 36 -11.121 10.593 15.068 1.00 0.00 O ATOM 576 CB MET A 36 -9.302 8.397 15.737 1.00 0.00 C ATOM 577 CG MET A 36 -8.361 7.858 16.815 1.00 0.00 C ATOM 578 SD MET A 36 -6.738 7.525 16.085 1.00 0.00 S ATOM 579 CE MET A 36 -5.745 7.926 17.542 1.00 0.00 C ATOM 0 H MET A 36 -10.919 6.528 16.030 1.00 0.00 H new ATOM 0 HA MET A 36 -10.614 9.092 17.297 1.00 0.00 H new ATOM 0 HB2 MET A 36 -9.347 7.702 14.899 1.00 0.00 H new ATOM 0 HB3 MET A 36 -8.923 9.342 15.348 1.00 0.00 H new ATOM 0 HG2 MET A 36 -8.266 8.581 17.625 1.00 0.00 H new ATOM 0 HG3 MET A 36 -8.771 6.946 17.248 1.00 0.00 H new ATOM 0 HE1 MET A 36 -4.689 7.787 17.312 1.00 0.00 H new ATOM 0 HE2 MET A 36 -5.921 8.963 17.828 1.00 0.00 H new ATOM 0 HE3 MET A 36 -6.026 7.270 18.366 1.00 0.00 H new ATOM 589 N LEU A 37 -12.701 8.995 15.009 1.00 0.00 N ATOM 590 CA LEU A 37 -13.581 9.762 14.133 1.00 0.00 C ATOM 591 C LEU A 37 -12.784 10.397 12.994 1.00 0.00 C ATOM 592 O LEU A 37 -12.940 11.582 12.698 1.00 0.00 O ATOM 593 CB LEU A 37 -14.298 10.851 14.945 1.00 0.00 C ATOM 594 CG LEU A 37 -15.715 11.071 14.400 1.00 0.00 C ATOM 595 CD1 LEU A 37 -16.469 12.030 15.323 1.00 0.00 C ATOM 596 CD2 LEU A 37 -15.639 11.676 12.996 1.00 0.00 C ATOM 0 H LEU A 37 -13.061 8.079 15.277 1.00 0.00 H new ATOM 0 HA LEU A 37 -14.321 9.088 13.701 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -14.345 10.561 15.995 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -13.733 11.782 14.897 1.00 0.00 H new ATOM 0 HG LEU A 37 -16.237 10.115 14.355 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -17.476 12.188 14.938 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -16.526 11.602 16.324 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -15.943 12.984 15.365 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -16.647 11.831 12.612 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -15.116 12.631 13.039 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -15.099 10.997 12.336 1.00 0.00 H new ATOM 608 N LEU A 38 -11.932 9.600 12.360 1.00 0.00 N ATOM 609 CA LEU A 38 -11.123 10.102 11.254 1.00 0.00 C ATOM 610 C LEU A 38 -11.959 10.205 9.982 1.00 0.00 C ATOM 611 O LEU A 38 -12.955 9.499 9.824 1.00 0.00 O ATOM 612 CB LEU A 38 -9.929 9.178 11.006 1.00 0.00 C ATOM 613 CG LEU A 38 -8.957 9.261 12.188 1.00 0.00 C ATOM 614 CD1 LEU A 38 -7.855 8.213 12.010 1.00 0.00 C ATOM 615 CD2 LEU A 38 -8.326 10.660 12.254 1.00 0.00 C ATOM 0 H LEU A 38 -11.784 8.617 12.588 1.00 0.00 H new ATOM 0 HA LEU A 38 -10.760 11.094 11.522 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -10.272 8.152 10.876 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -9.421 9.463 10.085 1.00 0.00 H new ATOM 0 HG LEU A 38 -9.501 9.072 13.114 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -7.161 8.269 12.849 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -8.301 7.219 11.973 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -7.317 8.404 11.081 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -7.637 10.709 13.097 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.783 10.858 11.330 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -9.110 11.407 12.382 1.00 0.00 H new ATOM 627 N LYS A 39 -11.547 11.093 9.081 1.00 0.00 N ATOM 628 CA LYS A 39 -12.263 11.290 7.823 1.00 0.00 C ATOM 629 C LYS A 39 -11.377 10.900 6.636 1.00 0.00 C ATOM 630 O LYS A 39 -10.259 11.399 6.506 1.00 0.00 O ATOM 631 CB LYS A 39 -12.668 12.760 7.687 1.00 0.00 C ATOM 632 CG LYS A 39 -13.668 13.119 8.790 1.00 0.00 C ATOM 633 CD LYS A 39 -13.798 14.641 8.888 1.00 0.00 C ATOM 634 CE LYS A 39 -14.253 15.205 7.541 1.00 0.00 C ATOM 635 NZ LYS A 39 -15.317 14.332 6.969 1.00 0.00 N ATOM 0 H LYS A 39 -10.725 11.685 9.197 1.00 0.00 H new ATOM 0 HA LYS A 39 -13.152 10.659 7.826 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -11.788 13.399 7.758 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -13.112 12.937 6.707 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -14.639 12.674 8.574 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -13.335 12.710 9.744 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -14.515 14.906 9.665 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -12.842 15.080 9.173 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -14.630 16.220 7.669 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -13.408 15.263 6.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -15.909 14.887 6.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -14.878 13.544 6.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -15.907 13.955 7.738 1.00 0.00 H new ATOM 649 N PRO A 40 -11.845 10.032 5.768 1.00 0.00 N ATOM 650 CA PRO A 40 -11.060 9.595 4.577 1.00 0.00 C ATOM 651 C PRO A 40 -11.077 10.647 3.471 1.00 0.00 C ATOM 652 O PRO A 40 -11.767 11.662 3.580 1.00 0.00 O ATOM 653 CB PRO A 40 -11.771 8.316 4.134 1.00 0.00 C ATOM 654 CG PRO A 40 -13.191 8.499 4.557 1.00 0.00 C ATOM 655 CD PRO A 40 -13.162 9.367 5.819 1.00 0.00 C ATOM 0 HA PRO A 40 -10.005 9.442 4.804 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -11.695 8.175 3.056 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -11.330 7.436 4.602 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -13.771 8.979 3.769 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -13.662 7.537 4.759 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -13.975 10.093 5.822 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -13.269 8.764 6.720 1.00 0.00 H new ATOM 663 N CYS A 41 -10.316 10.400 2.408 1.00 0.00 N ATOM 664 CA CYS A 41 -10.255 11.337 1.288 1.00 0.00 C ATOM 665 C CYS A 41 -10.433 10.606 -0.039 1.00 0.00 C ATOM 666 O CYS A 41 -10.677 9.399 -0.068 1.00 0.00 O ATOM 667 CB CYS A 41 -8.912 12.070 1.289 1.00 0.00 C ATOM 668 SG CYS A 41 -9.045 13.567 0.281 1.00 0.00 S ATOM 0 H CYS A 41 -9.738 9.567 2.298 1.00 0.00 H new ATOM 0 HA CYS A 41 -11.064 12.058 1.404 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -8.627 12.329 2.309 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -8.130 11.421 0.895 1.00 0.00 H new ATOM 673 N VAL A 42 -10.309 11.348 -1.133 1.00 0.00 N ATOM 674 CA VAL A 42 -10.458 10.770 -2.463 1.00 0.00 C ATOM 675 C VAL A 42 -9.358 9.749 -2.734 1.00 0.00 C ATOM 676 O VAL A 42 -9.615 8.670 -3.269 1.00 0.00 O ATOM 677 CB VAL A 42 -10.396 11.874 -3.519 1.00 0.00 C ATOM 678 CG1 VAL A 42 -10.672 11.275 -4.900 1.00 0.00 C ATOM 679 CG2 VAL A 42 -11.446 12.943 -3.206 1.00 0.00 C ATOM 0 H VAL A 42 -10.106 12.348 -1.126 1.00 0.00 H new ATOM 0 HA VAL A 42 -11.424 10.268 -2.512 1.00 0.00 H new ATOM 0 HB VAL A 42 -9.405 12.328 -3.511 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -10.628 12.062 -5.653 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -9.922 10.516 -5.124 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -11.663 10.820 -4.908 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -11.401 13.729 -3.960 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -12.438 12.491 -3.212 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -11.248 13.371 -2.223 1.00 0.00 H new ATOM 689 N LEU A 43 -8.129 10.109 -2.380 1.00 0.00 N ATOM 690 CA LEU A 43 -6.985 9.234 -2.606 1.00 0.00 C ATOM 691 C LEU A 43 -7.046 7.992 -1.721 1.00 0.00 C ATOM 692 O LEU A 43 -6.899 6.866 -2.198 1.00 0.00 O ATOM 693 CB LEU A 43 -5.683 10.003 -2.333 1.00 0.00 C ATOM 694 CG LEU A 43 -5.112 10.554 -3.649 1.00 0.00 C ATOM 695 CD1 LEU A 43 -4.173 11.725 -3.350 1.00 0.00 C ATOM 696 CD2 LEU A 43 -4.330 9.455 -4.378 1.00 0.00 C ATOM 0 H LEU A 43 -7.900 10.999 -1.936 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.011 8.907 -3.646 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.873 10.821 -1.639 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.955 9.345 -1.858 1.00 0.00 H new ATOM 0 HG LEU A 43 -5.934 10.893 -4.279 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.769 12.115 -4.284 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -4.725 12.512 -2.837 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -3.355 11.383 -2.716 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.928 9.852 -5.310 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.511 9.111 -3.746 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.995 8.619 -4.596 1.00 0.00 H new ATOM 708 N SER A 44 -7.264 8.209 -0.425 1.00 0.00 N ATOM 709 CA SER A 44 -7.343 7.104 0.526 1.00 0.00 C ATOM 710 C SER A 44 -8.288 6.024 0.013 1.00 0.00 C ATOM 711 O SER A 44 -7.937 4.845 -0.017 1.00 0.00 O ATOM 712 CB SER A 44 -7.834 7.616 1.880 1.00 0.00 C ATOM 713 OG SER A 44 -8.268 6.517 2.669 1.00 0.00 O ATOM 0 H SER A 44 -7.388 9.134 -0.012 1.00 0.00 H new ATOM 0 HA SER A 44 -6.348 6.674 0.641 1.00 0.00 H new ATOM 0 HB2 SER A 44 -7.034 8.152 2.391 1.00 0.00 H new ATOM 0 HB3 SER A 44 -8.652 8.323 1.740 1.00 0.00 H new ATOM 0 HG SER A 44 -8.582 6.842 3.538 1.00 0.00 H new ATOM 719 N ILE A 45 -9.486 6.431 -0.391 1.00 0.00 N ATOM 720 CA ILE A 45 -10.465 5.482 -0.904 1.00 0.00 C ATOM 721 C ILE A 45 -9.928 4.797 -2.155 1.00 0.00 C ATOM 722 O ILE A 45 -10.088 3.590 -2.333 1.00 0.00 O ATOM 723 CB ILE A 45 -11.773 6.204 -1.229 1.00 0.00 C ATOM 724 CG1 ILE A 45 -12.422 6.684 0.069 1.00 0.00 C ATOM 725 CG2 ILE A 45 -12.726 5.246 -1.950 1.00 0.00 C ATOM 726 CD1 ILE A 45 -13.553 7.658 -0.258 1.00 0.00 C ATOM 0 H ILE A 45 -9.800 7.401 -0.374 1.00 0.00 H new ATOM 0 HA ILE A 45 -10.654 4.727 -0.141 1.00 0.00 H new ATOM 0 HB ILE A 45 -11.564 7.058 -1.873 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -12.810 5.834 0.630 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -11.679 7.171 0.701 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -13.657 5.764 -2.180 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -12.264 4.901 -2.875 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -12.936 4.390 -1.308 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -14.017 8.001 0.667 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -13.151 8.513 -0.801 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -14.299 7.156 -0.873 1.00 0.00 H new ATOM 738 N TYR A 46 -9.282 5.578 -3.013 1.00 0.00 N ATOM 739 CA TYR A 46 -8.715 5.031 -4.239 1.00 0.00 C ATOM 740 C TYR A 46 -7.773 3.879 -3.902 1.00 0.00 C ATOM 741 O TYR A 46 -7.817 2.820 -4.531 1.00 0.00 O ATOM 742 CB TYR A 46 -7.959 6.129 -5.002 1.00 0.00 C ATOM 743 CG TYR A 46 -8.328 6.082 -6.468 1.00 0.00 C ATOM 744 CD1 TYR A 46 -7.967 4.974 -7.246 1.00 0.00 C ATOM 745 CD2 TYR A 46 -9.031 7.144 -7.050 1.00 0.00 C ATOM 746 CE1 TYR A 46 -8.308 4.929 -8.602 1.00 0.00 C ATOM 747 CE2 TYR A 46 -9.372 7.099 -8.408 1.00 0.00 C ATOM 748 CZ TYR A 46 -9.011 5.992 -9.184 1.00 0.00 C ATOM 749 OH TYR A 46 -9.346 5.947 -10.522 1.00 0.00 O ATOM 0 H TYR A 46 -9.139 6.580 -2.885 1.00 0.00 H new ATOM 0 HA TYR A 46 -9.520 4.656 -4.871 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -8.204 7.107 -4.587 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -6.884 5.992 -4.884 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -7.425 4.154 -6.798 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -9.311 7.998 -6.451 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -8.029 4.074 -9.201 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -9.914 7.919 -8.856 1.00 0.00 H new ATOM 0 HH TYR A 46 -9.832 6.762 -10.765 1.00 0.00 H new ATOM 759 N GLU A 47 -6.926 4.092 -2.898 1.00 0.00 N ATOM 760 CA GLU A 47 -5.983 3.065 -2.477 1.00 0.00 C ATOM 761 C GLU A 47 -6.735 1.854 -1.941 1.00 0.00 C ATOM 762 O GLU A 47 -6.319 0.713 -2.140 1.00 0.00 O ATOM 763 CB GLU A 47 -5.056 3.616 -1.392 1.00 0.00 C ATOM 764 CG GLU A 47 -4.095 4.633 -2.009 1.00 0.00 C ATOM 765 CD GLU A 47 -3.259 5.290 -0.916 1.00 0.00 C ATOM 766 OE1 GLU A 47 -3.844 5.782 0.035 1.00 0.00 O ATOM 767 OE2 GLU A 47 -2.045 5.292 -1.046 1.00 0.00 O ATOM 0 H GLU A 47 -6.875 4.961 -2.366 1.00 0.00 H new ATOM 0 HA GLU A 47 -5.386 2.764 -3.338 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -5.642 4.086 -0.603 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -4.495 2.803 -0.931 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -3.443 4.139 -2.730 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -4.656 5.392 -2.555 1.00 0.00 H new ATOM 774 N ARG A 48 -7.851 2.112 -1.264 1.00 0.00 N ATOM 775 CA ARG A 48 -8.660 1.037 -0.710 1.00 0.00 C ATOM 776 C ARG A 48 -9.250 0.190 -1.831 1.00 0.00 C ATOM 777 O ARG A 48 -9.282 -1.035 -1.743 1.00 0.00 O ATOM 778 CB ARG A 48 -9.790 1.620 0.143 1.00 0.00 C ATOM 779 CG ARG A 48 -10.461 0.499 0.940 1.00 0.00 C ATOM 780 CD ARG A 48 -11.678 1.056 1.679 1.00 0.00 C ATOM 781 NE ARG A 48 -11.253 1.896 2.793 1.00 0.00 N ATOM 782 CZ ARG A 48 -12.115 2.288 3.726 1.00 0.00 C ATOM 783 NH1 ARG A 48 -13.364 1.918 3.657 1.00 0.00 N ATOM 784 NH2 ARG A 48 -11.712 3.042 4.712 1.00 0.00 N ATOM 0 H ARG A 48 -8.211 3.050 -1.088 1.00 0.00 H new ATOM 0 HA ARG A 48 -8.025 0.408 -0.086 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -9.395 2.376 0.821 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -10.522 2.116 -0.495 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -10.766 -0.305 0.271 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -9.755 0.071 1.651 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -12.295 1.636 0.992 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -12.295 0.236 2.047 1.00 0.00 H new ATOM 0 HE ARG A 48 -10.278 2.188 2.857 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -13.679 1.328 2.887 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -14.025 2.219 4.373 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -10.735 3.331 4.767 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -12.374 3.343 5.428 1.00 0.00 H new ATOM 798 N ALA A 49 -9.711 0.856 -2.886 1.00 0.00 N ATOM 799 CA ALA A 49 -10.299 0.158 -4.025 1.00 0.00 C ATOM 800 C ALA A 49 -9.233 -0.628 -4.782 1.00 0.00 C ATOM 801 O ALA A 49 -9.495 -1.724 -5.277 1.00 0.00 O ATOM 802 CB ALA A 49 -10.963 1.163 -4.969 1.00 0.00 C ATOM 0 H ALA A 49 -9.689 1.872 -2.976 1.00 0.00 H new ATOM 0 HA ALA A 49 -11.049 -0.538 -3.651 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -11.399 0.633 -5.816 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -11.746 1.701 -4.435 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -10.217 1.872 -5.329 1.00 0.00 H new ATOM 808 N ALA A 50 -8.033 -0.064 -4.867 1.00 0.00 N ATOM 809 CA ALA A 50 -6.941 -0.729 -5.565 1.00 0.00 C ATOM 810 C ALA A 50 -6.729 -2.127 -4.993 1.00 0.00 C ATOM 811 O ALA A 50 -6.604 -3.102 -5.736 1.00 0.00 O ATOM 812 CB ALA A 50 -5.653 0.087 -5.424 1.00 0.00 C ATOM 0 H ALA A 50 -7.794 0.843 -4.466 1.00 0.00 H new ATOM 0 HA ALA A 50 -7.198 -0.810 -6.621 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -4.843 -0.419 -5.949 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -5.801 1.078 -5.853 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -5.397 0.183 -4.369 1.00 0.00 H new ATOM 818 N LEU A 51 -6.701 -2.217 -3.668 1.00 0.00 N ATOM 819 CA LEU A 51 -6.515 -3.503 -3.005 1.00 0.00 C ATOM 820 C LEU A 51 -7.818 -4.296 -3.030 1.00 0.00 C ATOM 821 O LEU A 51 -7.815 -5.482 -3.358 1.00 0.00 O ATOM 822 CB LEU A 51 -6.064 -3.290 -1.555 1.00 0.00 C ATOM 823 CG LEU A 51 -5.383 -4.560 -1.029 1.00 0.00 C ATOM 824 CD1 LEU A 51 -3.910 -4.578 -1.454 1.00 0.00 C ATOM 825 CD2 LEU A 51 -5.464 -4.587 0.499 1.00 0.00 C ATOM 0 H LEU A 51 -6.804 -1.423 -3.036 1.00 0.00 H new ATOM 0 HA LEU A 51 -5.746 -4.063 -3.536 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -5.375 -2.447 -1.499 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -6.922 -3.042 -0.931 1.00 0.00 H new ATOM 0 HG LEU A 51 -5.890 -5.432 -1.442 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -3.433 -5.483 -1.077 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -3.845 -4.560 -2.542 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -3.403 -3.704 -1.046 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -4.980 -5.489 0.873 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -4.960 -3.710 0.906 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -6.509 -4.581 0.808 1.00 0.00 H new ATOM 837 N PHE A 52 -8.931 -3.649 -2.703 1.00 0.00 N ATOM 838 CA PHE A 52 -10.214 -4.343 -2.724 1.00 0.00 C ATOM 839 C PHE A 52 -10.344 -5.120 -4.032 1.00 0.00 C ATOM 840 O PHE A 52 -10.847 -6.244 -4.057 1.00 0.00 O ATOM 841 CB PHE A 52 -11.370 -3.338 -2.592 1.00 0.00 C ATOM 842 CG PHE A 52 -12.435 -3.899 -1.674 1.00 0.00 C ATOM 843 CD1 PHE A 52 -13.066 -5.108 -1.992 1.00 0.00 C ATOM 844 CD2 PHE A 52 -12.791 -3.210 -0.508 1.00 0.00 C ATOM 845 CE1 PHE A 52 -14.051 -5.628 -1.143 1.00 0.00 C ATOM 846 CE2 PHE A 52 -13.776 -3.730 0.340 1.00 0.00 C ATOM 847 CZ PHE A 52 -14.406 -4.938 0.022 1.00 0.00 C ATOM 0 H PHE A 52 -8.973 -2.668 -2.426 1.00 0.00 H new ATOM 0 HA PHE A 52 -10.261 -5.034 -1.882 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -10.998 -2.392 -2.198 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -11.796 -3.129 -3.573 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -12.793 -5.639 -2.892 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -12.305 -2.277 -0.263 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -14.537 -6.561 -1.387 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -14.050 -3.199 1.240 1.00 0.00 H new ATOM 0 HZ PHE A 52 -15.167 -5.338 0.676 1.00 0.00 H new ATOM 857 N GLY A 53 -9.866 -4.511 -5.115 1.00 0.00 N ATOM 858 CA GLY A 53 -9.912 -5.145 -6.426 1.00 0.00 C ATOM 859 C GLY A 53 -8.990 -6.357 -6.462 1.00 0.00 C ATOM 860 O GLY A 53 -9.372 -7.425 -6.938 1.00 0.00 O ATOM 0 H GLY A 53 -9.444 -3.582 -5.109 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -10.933 -5.450 -6.654 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -9.614 -4.430 -7.193 1.00 0.00 H new ATOM 864 N VAL A 54 -7.776 -6.189 -5.941 1.00 0.00 N ATOM 865 CA VAL A 54 -6.818 -7.285 -5.908 1.00 0.00 C ATOM 866 C VAL A 54 -7.360 -8.415 -5.043 1.00 0.00 C ATOM 867 O VAL A 54 -7.352 -9.580 -5.437 1.00 0.00 O ATOM 868 CB VAL A 54 -5.478 -6.794 -5.348 1.00 0.00 C ATOM 869 CG1 VAL A 54 -4.595 -7.992 -4.983 1.00 0.00 C ATOM 870 CG2 VAL A 54 -4.764 -5.944 -6.403 1.00 0.00 C ATOM 0 H VAL A 54 -7.438 -5.314 -5.541 1.00 0.00 H new ATOM 0 HA VAL A 54 -6.662 -7.653 -6.922 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.662 -6.196 -4.456 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -3.645 -7.636 -4.586 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -5.098 -8.599 -4.230 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -4.413 -8.595 -5.873 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -3.811 -5.595 -6.005 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -4.586 -6.545 -7.295 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -5.386 -5.087 -6.661 1.00 0.00 H new ATOM 880 N LEU A 55 -7.850 -8.048 -3.862 1.00 0.00 N ATOM 881 CA LEU A 55 -8.415 -9.031 -2.948 1.00 0.00 C ATOM 882 C LEU A 55 -9.285 -10.010 -3.726 1.00 0.00 C ATOM 883 O LEU A 55 -9.172 -11.226 -3.567 1.00 0.00 O ATOM 884 CB LEU A 55 -9.252 -8.325 -1.876 1.00 0.00 C ATOM 885 CG LEU A 55 -9.997 -9.356 -1.022 1.00 0.00 C ATOM 886 CD1 LEU A 55 -9.001 -10.364 -0.440 1.00 0.00 C ATOM 887 CD2 LEU A 55 -10.717 -8.637 0.120 1.00 0.00 C ATOM 0 H LEU A 55 -7.867 -7.087 -3.520 1.00 0.00 H new ATOM 0 HA LEU A 55 -7.607 -9.577 -2.462 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -8.607 -7.716 -1.243 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -9.965 -7.649 -2.348 1.00 0.00 H new ATOM 0 HG LEU A 55 -10.722 -9.884 -1.642 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -9.536 -11.095 0.167 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -8.484 -10.875 -1.252 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -8.274 -9.840 0.180 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -11.249 -9.366 0.731 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -9.988 -8.111 0.736 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -11.428 -7.921 -0.292 1.00 0.00 H new ATOM 899 N GLY A 56 -10.143 -9.466 -4.584 1.00 0.00 N ATOM 900 CA GLY A 56 -11.015 -10.299 -5.400 1.00 0.00 C ATOM 901 C GLY A 56 -10.183 -11.199 -6.305 1.00 0.00 C ATOM 902 O GLY A 56 -10.537 -12.351 -6.554 1.00 0.00 O ATOM 0 H GLY A 56 -10.252 -8.462 -4.730 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -11.655 -10.906 -4.759 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -11.671 -9.671 -6.003 1.00 0.00 H new ATOM 906 N ALA A 57 -9.068 -10.656 -6.784 1.00 0.00 N ATOM 907 CA ALA A 57 -8.178 -11.413 -7.657 1.00 0.00 C ATOM 908 C ALA A 57 -7.752 -12.709 -6.977 1.00 0.00 C ATOM 909 O ALA A 57 -7.736 -13.773 -7.598 1.00 0.00 O ATOM 910 CB ALA A 57 -6.941 -10.581 -8.000 1.00 0.00 C ATOM 0 H ALA A 57 -8.761 -9.704 -6.585 1.00 0.00 H new ATOM 0 HA ALA A 57 -8.713 -11.651 -8.576 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -6.284 -11.157 -8.652 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -7.247 -9.667 -8.509 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -6.409 -10.325 -7.084 1.00 0.00 H new ATOM 916 N ALA A 58 -7.413 -12.614 -5.696 1.00 0.00 N ATOM 917 CA ALA A 58 -6.994 -13.787 -4.940 1.00 0.00 C ATOM 918 C ALA A 58 -8.125 -14.806 -4.879 1.00 0.00 C ATOM 919 O ALA A 58 -7.891 -16.013 -4.933 1.00 0.00 O ATOM 920 CB ALA A 58 -6.596 -13.379 -3.521 1.00 0.00 C ATOM 0 H ALA A 58 -7.420 -11.744 -5.163 1.00 0.00 H new ATOM 0 HA ALA A 58 -6.136 -14.236 -5.441 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -6.284 -14.262 -2.963 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -5.772 -12.667 -3.565 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -7.448 -12.917 -3.023 1.00 0.00 H new ATOM 926 N LEU A 59 -9.354 -14.310 -4.769 1.00 0.00 N ATOM 927 CA LEU A 59 -10.516 -15.189 -4.706 1.00 0.00 C ATOM 928 C LEU A 59 -10.602 -16.049 -5.966 1.00 0.00 C ATOM 929 O LEU A 59 -10.872 -17.248 -5.892 1.00 0.00 O ATOM 930 CB LEU A 59 -11.794 -14.353 -4.559 1.00 0.00 C ATOM 931 CG LEU A 59 -12.894 -15.189 -3.886 1.00 0.00 C ATOM 932 CD1 LEU A 59 -12.750 -15.108 -2.363 1.00 0.00 C ATOM 933 CD2 LEU A 59 -14.267 -14.644 -4.290 1.00 0.00 C ATOM 0 H LEU A 59 -9.570 -13.314 -4.722 1.00 0.00 H new ATOM 0 HA LEU A 59 -10.412 -15.844 -3.841 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -11.589 -13.462 -3.966 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -12.131 -14.014 -5.538 1.00 0.00 H new ATOM 0 HG LEU A 59 -12.799 -16.227 -4.205 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -13.532 -15.703 -1.891 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -11.774 -15.494 -2.069 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -12.841 -14.070 -2.044 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -15.048 -15.236 -3.813 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -14.354 -13.605 -3.972 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -14.377 -14.702 -5.373 1.00 0.00 H new ATOM 945 N ILE A 60 -10.369 -15.428 -7.117 1.00 0.00 N ATOM 946 CA ILE A 60 -10.421 -16.147 -8.386 1.00 0.00 C ATOM 947 C ILE A 60 -9.188 -17.031 -8.554 1.00 0.00 C ATOM 948 O ILE A 60 -9.291 -18.180 -8.980 1.00 0.00 O ATOM 949 CB ILE A 60 -10.498 -15.156 -9.551 1.00 0.00 C ATOM 950 CG1 ILE A 60 -11.560 -14.092 -9.257 1.00 0.00 C ATOM 951 CG2 ILE A 60 -10.863 -15.902 -10.835 1.00 0.00 C ATOM 952 CD1 ILE A 60 -12.881 -14.765 -8.874 1.00 0.00 C ATOM 0 H ILE A 60 -10.144 -14.436 -7.199 1.00 0.00 H new ATOM 0 HA ILE A 60 -11.311 -16.776 -8.385 1.00 0.00 H new ATOM 0 HB ILE A 60 -9.529 -14.672 -9.675 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -11.224 -13.444 -8.447 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -11.705 -13.459 -10.132 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -10.917 -15.196 -11.663 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -10.102 -16.653 -11.048 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -11.830 -16.390 -10.710 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -13.631 -14.002 -8.666 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -13.221 -15.394 -9.697 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -12.732 -15.379 -7.986 1.00 0.00 H new ATOM 964 N GLY A 61 -8.024 -16.483 -8.219 1.00 0.00 N ATOM 965 CA GLY A 61 -6.776 -17.229 -8.341 1.00 0.00 C ATOM 966 C GLY A 61 -6.772 -18.452 -7.430 1.00 0.00 C ATOM 967 O GLY A 61 -6.084 -19.437 -7.701 1.00 0.00 O ATOM 0 H GLY A 61 -7.919 -15.533 -7.864 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -6.637 -17.543 -9.376 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -5.936 -16.582 -8.088 1.00 0.00 H new ATOM 971 N ALA A 62 -7.541 -18.383 -6.349 1.00 0.00 N ATOM 972 CA ALA A 62 -7.615 -19.491 -5.403 1.00 0.00 C ATOM 973 C ALA A 62 -8.521 -20.598 -5.936 1.00 0.00 C ATOM 974 O ALA A 62 -8.775 -21.586 -5.249 1.00 0.00 O ATOM 975 CB ALA A 62 -8.153 -18.995 -4.060 1.00 0.00 C ATOM 0 H ALA A 62 -8.118 -17.578 -6.107 1.00 0.00 H new ATOM 0 HA ALA A 62 -6.611 -19.894 -5.269 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -8.205 -19.828 -3.359 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -7.488 -18.228 -3.663 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -9.149 -18.575 -4.200 1.00 0.00 H new ATOM 981 N ILE A 63 -9.003 -20.427 -7.163 1.00 0.00 N ATOM 982 CA ILE A 63 -9.878 -21.425 -7.769 1.00 0.00 C ATOM 983 C ILE A 63 -9.061 -22.598 -8.307 1.00 0.00 C ATOM 984 O ILE A 63 -9.422 -23.758 -8.103 1.00 0.00 O ATOM 985 CB ILE A 63 -10.686 -20.796 -8.907 1.00 0.00 C ATOM 986 CG1 ILE A 63 -11.636 -19.743 -8.332 1.00 0.00 C ATOM 987 CG2 ILE A 63 -11.499 -21.881 -9.618 1.00 0.00 C ATOM 988 CD1 ILE A 63 -12.292 -18.967 -9.476 1.00 0.00 C ATOM 0 H ILE A 63 -8.806 -19.617 -7.751 1.00 0.00 H new ATOM 0 HA ILE A 63 -10.561 -21.793 -7.003 1.00 0.00 H new ATOM 0 HB ILE A 63 -10.007 -20.327 -9.619 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -12.399 -20.223 -7.719 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -11.088 -19.060 -7.682 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -12.074 -21.433 -10.428 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -10.824 -22.633 -10.026 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -12.179 -22.351 -8.907 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -12.969 -18.217 -9.066 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -11.522 -18.475 -10.070 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -12.853 -19.655 -10.108 1.00 0.00 H new ATOM 1000 N ALA A 64 -7.963 -22.291 -8.992 1.00 0.00 N ATOM 1001 CA ALA A 64 -7.106 -23.328 -9.555 1.00 0.00 C ATOM 1002 C ALA A 64 -5.848 -22.705 -10.158 1.00 0.00 C ATOM 1003 O ALA A 64 -5.723 -22.597 -11.378 1.00 0.00 O ATOM 1004 CB ALA A 64 -7.862 -24.100 -10.639 1.00 0.00 C ATOM 0 H ALA A 64 -7.647 -21.337 -9.170 1.00 0.00 H new ATOM 0 HA ALA A 64 -6.818 -24.012 -8.757 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -7.215 -24.872 -11.054 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -8.748 -24.564 -10.205 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -8.163 -23.414 -11.431 1.00 0.00 H new ATOM 1010 N PRO A 65 -4.927 -22.284 -9.328 1.00 0.00 N ATOM 1011 CA PRO A 65 -3.659 -21.647 -9.788 1.00 0.00 C ATOM 1012 C PRO A 65 -2.662 -22.665 -10.337 1.00 0.00 C ATOM 1013 O PRO A 65 -1.469 -22.384 -10.449 1.00 0.00 O ATOM 1014 CB PRO A 65 -3.122 -20.970 -8.524 1.00 0.00 C ATOM 1015 CG PRO A 65 -3.661 -21.779 -7.388 1.00 0.00 C ATOM 1016 CD PRO A 65 -4.992 -22.374 -7.859 1.00 0.00 C ATOM 0 HA PRO A 65 -3.823 -20.953 -10.613 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -2.032 -20.958 -8.517 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -3.453 -19.933 -8.461 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -2.962 -22.568 -7.110 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -3.807 -21.156 -6.505 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -5.107 -23.406 -7.528 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -5.840 -21.816 -7.463 1.00 0.00 H new ATOM 1024 N LYS A 66 -3.163 -23.848 -10.681 1.00 0.00 N ATOM 1025 CA LYS A 66 -2.312 -24.904 -11.223 1.00 0.00 C ATOM 1026 C LYS A 66 -2.531 -25.034 -12.726 1.00 0.00 C ATOM 1027 O LYS A 66 -1.810 -25.759 -13.412 1.00 0.00 O ATOM 1028 CB LYS A 66 -2.621 -26.235 -10.530 1.00 0.00 C ATOM 1029 CG LYS A 66 -4.069 -26.652 -10.821 1.00 0.00 C ATOM 1030 CD LYS A 66 -4.610 -27.484 -9.656 1.00 0.00 C ATOM 1031 CE LYS A 66 -5.926 -28.146 -10.068 1.00 0.00 C ATOM 1032 NZ LYS A 66 -5.651 -29.217 -11.067 1.00 0.00 N ATOM 0 H LYS A 66 -4.148 -24.099 -10.595 1.00 0.00 H new ATOM 0 HA LYS A 66 -1.269 -24.644 -11.040 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -1.934 -27.005 -10.880 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -2.470 -26.139 -9.455 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -4.690 -25.768 -10.968 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -4.113 -27.230 -11.744 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -3.883 -28.244 -9.370 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -4.768 -26.849 -8.784 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -6.423 -28.568 -9.194 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -6.602 -27.403 -10.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -6.422 -29.915 -11.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -5.587 -28.798 -12.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -4.753 -29.687 -10.834 1.00 0.00 H new ATOM 1046 N THR A 67 -3.529 -24.313 -13.229 1.00 0.00 N ATOM 1047 CA THR A 67 -3.846 -24.329 -14.655 1.00 0.00 C ATOM 1048 C THR A 67 -3.569 -22.951 -15.253 1.00 0.00 C ATOM 1049 O THR A 67 -3.202 -22.023 -14.533 1.00 0.00 O ATOM 1050 CB THR A 67 -5.324 -24.701 -14.867 1.00 0.00 C ATOM 1051 OG1 THR A 67 -6.051 -23.550 -15.271 1.00 0.00 O ATOM 1052 CG2 THR A 67 -5.919 -25.243 -13.564 1.00 0.00 C ATOM 0 H THR A 67 -4.133 -23.710 -12.670 1.00 0.00 H new ATOM 0 HA THR A 67 -3.223 -25.073 -15.150 1.00 0.00 H new ATOM 0 HB THR A 67 -5.390 -25.467 -15.639 1.00 0.00 H new ATOM 0 HG1 THR A 67 -6.992 -23.788 -15.407 1.00 0.00 H new ATOM 0 HG21 THR A 67 -6.965 -25.504 -13.723 1.00 0.00 H new ATOM 0 HG22 THR A 67 -5.367 -26.130 -13.253 1.00 0.00 H new ATOM 0 HG23 THR A 67 -5.849 -24.481 -12.787 1.00 0.00 H new ATOM 1060 N PRO A 68 -3.737 -22.794 -16.541 1.00 0.00 N ATOM 1061 CA PRO A 68 -3.496 -21.486 -17.221 1.00 0.00 C ATOM 1062 C PRO A 68 -4.259 -20.345 -16.548 1.00 0.00 C ATOM 1063 O PRO A 68 -4.195 -19.197 -16.989 1.00 0.00 O ATOM 1064 CB PRO A 68 -3.995 -21.720 -18.652 1.00 0.00 C ATOM 1065 CG PRO A 68 -3.912 -23.196 -18.858 1.00 0.00 C ATOM 1066 CD PRO A 68 -4.168 -23.832 -17.493 1.00 0.00 C ATOM 0 HA PRO A 68 -2.449 -21.187 -17.181 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -5.017 -21.362 -18.776 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -3.380 -21.186 -19.376 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -4.650 -23.529 -19.587 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -2.933 -23.481 -19.243 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -5.220 -24.086 -17.360 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -3.599 -24.753 -17.367 1.00 0.00 H new ATOM 1074 N LEU A 69 -4.978 -20.671 -15.477 1.00 0.00 N ATOM 1075 CA LEU A 69 -5.751 -19.673 -14.747 1.00 0.00 C ATOM 1076 C LEU A 69 -4.859 -18.507 -14.320 1.00 0.00 C ATOM 1077 O LEU A 69 -5.301 -17.360 -14.290 1.00 0.00 O ATOM 1078 CB LEU A 69 -6.394 -20.321 -13.510 1.00 0.00 C ATOM 1079 CG LEU A 69 -7.811 -19.771 -13.302 1.00 0.00 C ATOM 1080 CD1 LEU A 69 -8.797 -20.527 -14.198 1.00 0.00 C ATOM 1081 CD2 LEU A 69 -8.220 -19.955 -11.836 1.00 0.00 C ATOM 0 H LEU A 69 -5.041 -21.616 -15.097 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.532 -19.287 -15.402 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.430 -21.403 -13.635 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -5.785 -20.122 -12.628 1.00 0.00 H new ATOM 0 HG LEU A 69 -7.825 -18.712 -13.559 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -9.802 -20.133 -14.047 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -8.511 -20.400 -15.242 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -8.781 -21.587 -13.944 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.227 -19.564 -11.687 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.201 -21.015 -11.583 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -7.523 -19.416 -11.194 1.00 0.00 H new ATOM 1093 N ARG A 70 -3.607 -18.806 -13.989 1.00 0.00 N ATOM 1094 CA ARG A 70 -2.669 -17.766 -13.565 1.00 0.00 C ATOM 1095 C ARG A 70 -2.871 -16.485 -14.379 1.00 0.00 C ATOM 1096 O ARG A 70 -3.286 -15.468 -13.827 1.00 0.00 O ATOM 1097 CB ARG A 70 -1.231 -18.262 -13.736 1.00 0.00 C ATOM 1098 CG ARG A 70 -0.890 -19.242 -12.611 1.00 0.00 C ATOM 1099 CD ARG A 70 0.455 -19.913 -12.902 1.00 0.00 C ATOM 1100 NE ARG A 70 0.296 -20.941 -13.929 1.00 0.00 N ATOM 1101 CZ ARG A 70 0.545 -20.688 -15.213 1.00 0.00 C ATOM 1102 NH1 ARG A 70 0.940 -19.502 -15.586 1.00 0.00 N ATOM 1103 NH2 ARG A 70 0.393 -21.632 -16.101 1.00 0.00 N ATOM 0 H ARG A 70 -3.219 -19.749 -14.005 1.00 0.00 H new ATOM 0 HA ARG A 70 -2.856 -17.543 -12.515 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -1.116 -18.749 -14.704 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -0.540 -17.419 -13.720 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -0.846 -18.715 -11.658 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -1.672 -19.996 -12.523 1.00 0.00 H new ATOM 0 HD2 ARG A 70 1.177 -19.167 -13.233 1.00 0.00 H new ATOM 0 HD3 ARG A 70 0.852 -20.359 -11.990 1.00 0.00 H new ATOM 0 HE ARG A 70 -0.013 -21.874 -13.656 1.00 0.00 H new ATOM 0 HH11 ARG A 70 1.060 -18.763 -14.893 1.00 0.00 H new ATOM 0 HH12 ARG A 70 1.129 -19.314 -16.570 1.00 0.00 H new ATOM 0 HH21 ARG A 70 0.084 -22.560 -15.811 1.00 0.00 H new ATOM 0 HH22 ARG A 70 0.583 -21.442 -17.085 1.00 0.00 H new ATOM 1117 N TYR A 71 -2.575 -16.516 -15.674 1.00 0.00 N ATOM 1118 CA TYR A 71 -2.737 -15.320 -16.503 1.00 0.00 C ATOM 1119 C TYR A 71 -4.147 -14.752 -16.381 1.00 0.00 C ATOM 1120 O TYR A 71 -4.371 -13.576 -16.670 1.00 0.00 O ATOM 1121 CB TYR A 71 -2.449 -15.660 -17.964 1.00 0.00 C ATOM 1122 CG TYR A 71 -1.104 -16.337 -18.066 1.00 0.00 C ATOM 1123 CD1 TYR A 71 0.064 -15.567 -18.120 1.00 0.00 C ATOM 1124 CD2 TYR A 71 -1.026 -17.734 -18.102 1.00 0.00 C ATOM 1125 CE1 TYR A 71 1.312 -16.196 -18.211 1.00 0.00 C ATOM 1126 CE2 TYR A 71 0.222 -18.361 -18.194 1.00 0.00 C ATOM 1127 CZ TYR A 71 1.390 -17.593 -18.248 1.00 0.00 C ATOM 1128 OH TYR A 71 2.620 -18.212 -18.338 1.00 0.00 O ATOM 0 H TYR A 71 -2.228 -17.338 -16.168 1.00 0.00 H new ATOM 0 HA TYR A 71 -2.031 -14.567 -16.153 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -3.228 -16.313 -18.357 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -2.459 -14.753 -18.569 1.00 0.00 H new ATOM 0 HD1 TYR A 71 0.003 -14.489 -18.092 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -1.927 -18.327 -18.059 1.00 0.00 H new ATOM 0 HE1 TYR A 71 2.214 -15.603 -18.253 1.00 0.00 H new ATOM 0 HE2 TYR A 71 0.283 -19.439 -18.223 1.00 0.00 H new ATOM 0 HH TYR A 71 2.497 -19.184 -18.352 1.00 0.00 H new ATOM 1138 N VAL A 72 -5.102 -15.578 -15.975 1.00 0.00 N ATOM 1139 CA VAL A 72 -6.481 -15.111 -15.855 1.00 0.00 C ATOM 1140 C VAL A 72 -6.688 -14.314 -14.568 1.00 0.00 C ATOM 1141 O VAL A 72 -7.247 -13.219 -14.607 1.00 0.00 O ATOM 1142 CB VAL A 72 -7.447 -16.297 -15.890 1.00 0.00 C ATOM 1143 CG1 VAL A 72 -8.869 -15.790 -16.132 1.00 0.00 C ATOM 1144 CG2 VAL A 72 -7.048 -17.244 -17.024 1.00 0.00 C ATOM 0 H VAL A 72 -4.955 -16.556 -15.727 1.00 0.00 H new ATOM 0 HA VAL A 72 -6.684 -14.454 -16.700 1.00 0.00 H new ATOM 0 HB VAL A 72 -7.406 -16.827 -14.938 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -9.557 -16.635 -16.157 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -9.155 -15.112 -15.328 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -8.910 -15.261 -17.084 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -7.735 -18.090 -17.051 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -7.091 -16.712 -17.974 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -6.034 -17.606 -16.856 1.00 0.00 H new ATOM 1154 N ALA A 73 -6.233 -14.840 -13.437 1.00 0.00 N ATOM 1155 CA ALA A 73 -6.381 -14.125 -12.171 1.00 0.00 C ATOM 1156 C ALA A 73 -5.345 -13.005 -12.074 1.00 0.00 C ATOM 1157 O ALA A 73 -5.611 -11.931 -11.523 1.00 0.00 O ATOM 1158 CB ALA A 73 -6.203 -15.093 -10.999 1.00 0.00 C ATOM 0 H ALA A 73 -5.766 -15.744 -13.368 1.00 0.00 H new ATOM 0 HA ALA A 73 -7.380 -13.691 -12.130 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -6.315 -14.552 -10.060 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -6.957 -15.878 -11.058 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -5.210 -15.540 -11.044 1.00 0.00 H new ATOM 1164 N MET A 74 -4.164 -13.261 -12.620 1.00 0.00 N ATOM 1165 CA MET A 74 -3.094 -12.274 -12.599 1.00 0.00 C ATOM 1166 C MET A 74 -3.489 -11.053 -13.422 1.00 0.00 C ATOM 1167 O MET A 74 -2.810 -10.026 -13.394 1.00 0.00 O ATOM 1168 CB MET A 74 -1.807 -12.883 -13.161 1.00 0.00 C ATOM 1169 CG MET A 74 -1.138 -13.751 -12.092 1.00 0.00 C ATOM 1170 SD MET A 74 -2.362 -14.868 -11.364 1.00 0.00 S ATOM 1171 CE MET A 74 -1.272 -15.630 -10.137 1.00 0.00 C ATOM 0 H MET A 74 -3.924 -14.139 -13.080 1.00 0.00 H new ATOM 0 HA MET A 74 -2.922 -11.966 -11.568 1.00 0.00 H new ATOM 0 HB2 MET A 74 -2.032 -13.483 -14.042 1.00 0.00 H new ATOM 0 HB3 MET A 74 -1.128 -12.092 -13.479 1.00 0.00 H new ATOM 0 HG2 MET A 74 -0.323 -14.325 -12.533 1.00 0.00 H new ATOM 0 HG3 MET A 74 -0.701 -13.120 -11.318 1.00 0.00 H new ATOM 0 HE1 MET A 74 -1.831 -16.368 -9.562 1.00 0.00 H new ATOM 0 HE2 MET A 74 -0.440 -16.119 -10.643 1.00 0.00 H new ATOM 0 HE3 MET A 74 -0.887 -14.862 -9.466 1.00 0.00 H new ATOM 1181 N VAL A 75 -4.593 -11.170 -14.155 1.00 0.00 N ATOM 1182 CA VAL A 75 -5.064 -10.065 -14.978 1.00 0.00 C ATOM 1183 C VAL A 75 -5.420 -8.867 -14.102 1.00 0.00 C ATOM 1184 O VAL A 75 -5.202 -7.714 -14.474 1.00 0.00 O ATOM 1185 CB VAL A 75 -6.281 -10.501 -15.802 1.00 0.00 C ATOM 1186 CG1 VAL A 75 -7.515 -10.593 -14.904 1.00 0.00 C ATOM 1187 CG2 VAL A 75 -6.534 -9.479 -16.914 1.00 0.00 C ATOM 0 H VAL A 75 -5.171 -12.009 -14.195 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.266 -9.772 -15.660 1.00 0.00 H new ATOM 0 HB VAL A 75 -6.085 -11.480 -16.240 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -8.375 -10.903 -15.498 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.337 -11.323 -14.114 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -7.714 -9.618 -14.459 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.399 -9.787 -17.501 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.725 -8.501 -16.473 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.659 -9.421 -17.561 1.00 0.00 H new ATOM 1197 N ILE A 76 -5.953 -9.170 -12.917 1.00 0.00 N ATOM 1198 CA ILE A 76 -6.327 -8.131 -11.962 1.00 0.00 C ATOM 1199 C ILE A 76 -5.134 -7.784 -11.083 1.00 0.00 C ATOM 1200 O ILE A 76 -4.957 -6.635 -10.679 1.00 0.00 O ATOM 1201 CB ILE A 76 -7.481 -8.607 -11.071 1.00 0.00 C ATOM 1202 CG1 ILE A 76 -8.727 -8.906 -11.917 1.00 0.00 C ATOM 1203 CG2 ILE A 76 -7.813 -7.523 -10.044 1.00 0.00 C ATOM 1204 CD1 ILE A 76 -9.119 -7.678 -12.748 1.00 0.00 C ATOM 0 H ILE A 76 -6.134 -10.122 -12.599 1.00 0.00 H new ATOM 0 HA ILE A 76 -6.646 -7.251 -12.521 1.00 0.00 H new ATOM 0 HB ILE A 76 -7.175 -9.520 -10.561 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -8.532 -9.752 -12.577 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -9.554 -9.192 -11.268 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -8.633 -7.861 -9.411 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -6.936 -7.325 -9.428 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -8.107 -6.610 -10.561 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -10.004 -7.908 -13.341 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -9.335 -6.842 -12.083 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -8.297 -7.410 -13.411 1.00 0.00 H new ATOM 1216 N TRP A 77 -4.313 -8.790 -10.798 1.00 0.00 N ATOM 1217 CA TRP A 77 -3.130 -8.583 -9.972 1.00 0.00 C ATOM 1218 C TRP A 77 -2.195 -7.581 -10.640 1.00 0.00 C ATOM 1219 O TRP A 77 -1.757 -6.614 -10.016 1.00 0.00 O ATOM 1220 CB TRP A 77 -2.397 -9.911 -9.756 1.00 0.00 C ATOM 1221 CG TRP A 77 -1.547 -9.835 -8.523 1.00 0.00 C ATOM 1222 CD1 TRP A 77 -0.268 -9.395 -8.484 1.00 0.00 C ATOM 1223 CD2 TRP A 77 -1.895 -10.203 -7.157 1.00 0.00 C ATOM 1224 NE1 TRP A 77 0.196 -9.477 -7.180 1.00 0.00 N ATOM 1225 CE2 TRP A 77 -0.773 -9.967 -6.325 1.00 0.00 C ATOM 1226 CE3 TRP A 77 -3.062 -10.718 -6.565 1.00 0.00 C ATOM 1227 CZ2 TRP A 77 -0.811 -10.231 -4.954 1.00 0.00 C ATOM 1228 CZ3 TRP A 77 -3.104 -10.983 -5.186 1.00 0.00 C ATOM 1229 CH2 TRP A 77 -1.981 -10.741 -4.383 1.00 0.00 C ATOM 0 H TRP A 77 -4.443 -9.748 -11.124 1.00 0.00 H new ATOM 0 HA TRP A 77 -3.443 -8.189 -9.005 1.00 0.00 H new ATOM 0 HB2 TRP A 77 -3.119 -10.722 -9.660 1.00 0.00 H new ATOM 0 HB3 TRP A 77 -1.776 -10.138 -10.622 1.00 0.00 H new ATOM 0 HD1 TRP A 77 0.299 -9.038 -9.331 1.00 0.00 H new ATOM 0 HE1 TRP A 77 1.136 -9.209 -6.888 1.00 0.00 H new ATOM 0 HE3 TRP A 77 -3.932 -10.911 -7.175 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 0.057 -10.043 -4.339 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 -4.007 -11.375 -4.742 1.00 0.00 H new ATOM 0 HH2 TRP A 77 -2.019 -10.948 -3.324 1.00 0.00 H new ATOM 1240 N LEU A 78 -1.894 -7.814 -11.916 1.00 0.00 N ATOM 1241 CA LEU A 78 -1.016 -6.924 -12.665 1.00 0.00 C ATOM 1242 C LEU A 78 -1.679 -5.562 -12.861 1.00 0.00 C ATOM 1243 O LEU A 78 -1.047 -4.522 -12.676 1.00 0.00 O ATOM 1244 CB LEU A 78 -0.688 -7.543 -14.034 1.00 0.00 C ATOM 1245 CG LEU A 78 0.733 -8.118 -14.026 1.00 0.00 C ATOM 1246 CD1 LEU A 78 0.805 -9.301 -13.059 1.00 0.00 C ATOM 1247 CD2 LEU A 78 1.095 -8.592 -15.435 1.00 0.00 C ATOM 0 H LEU A 78 -2.245 -8.609 -12.449 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.094 -6.788 -12.100 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.406 -8.330 -14.267 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -0.778 -6.787 -14.814 1.00 0.00 H new ATOM 0 HG LEU A 78 1.434 -7.347 -13.706 1.00 0.00 H new ATOM 0 HD11 LEU A 78 1.816 -9.707 -13.056 1.00 0.00 H new ATOM 0 HD12 LEU A 78 0.545 -8.966 -12.055 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.105 -10.074 -13.376 1.00 0.00 H new ATOM 0 HD21 LEU A 78 2.105 -9.002 -15.433 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.392 -9.362 -15.752 1.00 0.00 H new ATOM 0 HD23 LEU A 78 1.046 -7.750 -16.126 1.00 0.00 H new ATOM 1259 N TYR A 79 -2.955 -5.571 -13.237 1.00 0.00 N ATOM 1260 CA TYR A 79 -3.677 -4.323 -13.453 1.00 0.00 C ATOM 1261 C TYR A 79 -3.400 -3.344 -12.317 1.00 0.00 C ATOM 1262 O TYR A 79 -3.147 -2.161 -12.550 1.00 0.00 O ATOM 1263 CB TYR A 79 -5.180 -4.594 -13.540 1.00 0.00 C ATOM 1264 CG TYR A 79 -5.882 -3.371 -14.085 1.00 0.00 C ATOM 1265 CD1 TYR A 79 -5.816 -3.081 -15.453 1.00 0.00 C ATOM 1266 CD2 TYR A 79 -6.594 -2.528 -13.224 1.00 0.00 C ATOM 1267 CE1 TYR A 79 -6.464 -1.948 -15.959 1.00 0.00 C ATOM 1268 CE2 TYR A 79 -7.241 -1.395 -13.730 1.00 0.00 C ATOM 1269 CZ TYR A 79 -7.176 -1.105 -15.098 1.00 0.00 C ATOM 1270 OH TYR A 79 -7.814 0.012 -15.597 1.00 0.00 O ATOM 0 H TYR A 79 -3.503 -6.416 -13.396 1.00 0.00 H new ATOM 0 HA TYR A 79 -3.334 -3.884 -14.390 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -5.369 -5.452 -14.185 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -5.573 -4.843 -12.554 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -5.266 -3.731 -16.117 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -6.644 -2.752 -12.169 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -6.414 -1.724 -17.014 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -7.790 -0.745 -13.065 1.00 0.00 H new ATOM 0 HH TYR A 79 -8.449 0.350 -14.932 1.00 0.00 H new ATOM 1280 N SER A 80 -3.448 -3.847 -11.087 1.00 0.00 N ATOM 1281 CA SER A 80 -3.202 -3.004 -9.920 1.00 0.00 C ATOM 1282 C SER A 80 -1.704 -2.797 -9.708 1.00 0.00 C ATOM 1283 O SER A 80 -1.288 -1.828 -9.078 1.00 0.00 O ATOM 1284 CB SER A 80 -3.813 -3.646 -8.674 1.00 0.00 C ATOM 1285 OG SER A 80 -3.503 -5.033 -8.661 1.00 0.00 O ATOM 0 H SER A 80 -3.653 -4.823 -10.873 1.00 0.00 H new ATOM 0 HA SER A 80 -3.667 -2.034 -10.094 1.00 0.00 H new ATOM 0 HB2 SER A 80 -3.424 -3.166 -7.776 1.00 0.00 H new ATOM 0 HB3 SER A 80 -4.894 -3.503 -8.670 1.00 0.00 H new ATOM 0 HG SER A 80 -2.695 -5.193 -9.193 1.00 0.00 H new ATOM 1291 N ALA A 81 -0.896 -3.713 -10.224 1.00 0.00 N ATOM 1292 CA ALA A 81 0.550 -3.604 -10.063 1.00 0.00 C ATOM 1293 C ALA A 81 1.064 -2.314 -10.689 1.00 0.00 C ATOM 1294 O ALA A 81 1.646 -1.469 -10.008 1.00 0.00 O ATOM 1295 CB ALA A 81 1.244 -4.800 -10.716 1.00 0.00 C ATOM 0 H ALA A 81 -1.209 -4.529 -10.750 1.00 0.00 H new ATOM 0 HA ALA A 81 0.775 -3.593 -8.996 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.323 -4.708 -10.590 1.00 0.00 H new ATOM 0 HB2 ALA A 81 0.901 -5.721 -10.245 1.00 0.00 H new ATOM 0 HB3 ALA A 81 1.004 -4.824 -11.779 1.00 0.00 H new ATOM 1301 N PHE A 82 0.851 -2.171 -11.991 1.00 0.00 N ATOM 1302 CA PHE A 82 1.301 -0.983 -12.704 1.00 0.00 C ATOM 1303 C PHE A 82 0.456 0.235 -12.335 1.00 0.00 C ATOM 1304 O PHE A 82 0.989 1.262 -11.913 1.00 0.00 O ATOM 1305 CB PHE A 82 1.217 -1.228 -14.213 1.00 0.00 C ATOM 1306 CG PHE A 82 1.580 0.037 -14.954 1.00 0.00 C ATOM 1307 CD1 PHE A 82 2.924 0.354 -15.183 1.00 0.00 C ATOM 1308 CD2 PHE A 82 0.571 0.892 -15.414 1.00 0.00 C ATOM 1309 CE1 PHE A 82 3.260 1.525 -15.872 1.00 0.00 C ATOM 1310 CE2 PHE A 82 0.907 2.064 -16.103 1.00 0.00 C ATOM 1311 CZ PHE A 82 2.251 2.381 -16.332 1.00 0.00 C ATOM 0 H PHE A 82 0.372 -2.859 -12.572 1.00 0.00 H new ATOM 0 HA PHE A 82 2.333 -0.782 -12.417 1.00 0.00 H new ATOM 0 HB2 PHE A 82 1.892 -2.035 -14.498 1.00 0.00 H new ATOM 0 HB3 PHE A 82 0.210 -1.544 -14.485 1.00 0.00 H new ATOM 0 HD1 PHE A 82 3.702 -0.305 -14.828 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -0.466 0.648 -15.237 1.00 0.00 H new ATOM 0 HE1 PHE A 82 4.297 1.769 -16.049 1.00 0.00 H new ATOM 0 HE2 PHE A 82 0.129 2.724 -16.458 1.00 0.00 H new ATOM 0 HZ PHE A 82 2.510 3.285 -16.863 1.00 0.00 H new ATOM 1321 N ARG A 83 -0.855 0.129 -12.523 1.00 0.00 N ATOM 1322 CA ARG A 83 -1.754 1.246 -12.234 1.00 0.00 C ATOM 1323 C ARG A 83 -1.804 1.572 -10.742 1.00 0.00 C ATOM 1324 O ARG A 83 -1.625 2.726 -10.357 1.00 0.00 O ATOM 1325 CB ARG A 83 -3.165 0.911 -12.729 1.00 0.00 C ATOM 1326 CG ARG A 83 -4.044 2.172 -12.697 1.00 0.00 C ATOM 1327 CD ARG A 83 -3.866 2.970 -13.994 1.00 0.00 C ATOM 1328 NE ARG A 83 -4.883 2.586 -14.967 1.00 0.00 N ATOM 1329 CZ ARG A 83 -6.166 2.866 -14.765 1.00 0.00 C ATOM 1330 NH1 ARG A 83 -6.535 3.489 -13.681 1.00 0.00 N ATOM 1331 NH2 ARG A 83 -7.057 2.515 -15.652 1.00 0.00 N ATOM 0 H ARG A 83 -1.318 -0.710 -12.871 1.00 0.00 H new ATOM 0 HA ARG A 83 -1.368 2.123 -12.754 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -3.119 0.515 -13.743 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -3.605 0.135 -12.103 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -5.090 1.893 -12.573 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -3.776 2.790 -11.840 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -3.937 4.037 -13.785 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -2.873 2.791 -14.406 1.00 0.00 H new ATOM 0 HE ARG A 83 -4.604 2.095 -15.816 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -5.839 3.762 -12.987 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -7.520 3.704 -13.526 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -6.768 2.026 -16.499 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -8.042 2.730 -15.498 1.00 0.00 H new ATOM 1345 N GLY A 84 -2.038 0.571 -9.902 1.00 0.00 N ATOM 1346 CA GLY A 84 -2.094 0.813 -8.463 1.00 0.00 C ATOM 1347 C GLY A 84 -0.851 1.563 -8.000 1.00 0.00 C ATOM 1348 O GLY A 84 -0.949 2.552 -7.274 1.00 0.00 O ATOM 0 H GLY A 84 -2.189 -0.398 -10.183 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -2.986 1.390 -8.220 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -2.173 -0.135 -7.931 1.00 0.00 H new ATOM 1352 N VAL A 85 0.317 1.094 -8.426 1.00 0.00 N ATOM 1353 CA VAL A 85 1.568 1.740 -8.046 1.00 0.00 C ATOM 1354 C VAL A 85 1.640 3.145 -8.641 1.00 0.00 C ATOM 1355 O VAL A 85 2.222 4.052 -8.047 1.00 0.00 O ATOM 1356 CB VAL A 85 2.756 0.909 -8.535 1.00 0.00 C ATOM 1357 CG1 VAL A 85 4.058 1.669 -8.274 1.00 0.00 C ATOM 1358 CG2 VAL A 85 2.784 -0.424 -7.784 1.00 0.00 C ATOM 0 H VAL A 85 0.424 0.278 -9.028 1.00 0.00 H new ATOM 0 HA VAL A 85 1.606 1.814 -6.959 1.00 0.00 H new ATOM 0 HB VAL A 85 2.655 0.725 -9.605 1.00 0.00 H new ATOM 0 HG11 VAL A 85 4.902 1.075 -8.623 1.00 0.00 H new ATOM 0 HG12 VAL A 85 4.038 2.619 -8.807 1.00 0.00 H new ATOM 0 HG13 VAL A 85 4.163 1.855 -7.205 1.00 0.00 H new ATOM 0 HG21 VAL A 85 3.629 -1.019 -8.130 1.00 0.00 H new ATOM 0 HG22 VAL A 85 2.885 -0.237 -6.715 1.00 0.00 H new ATOM 0 HG23 VAL A 85 1.858 -0.967 -7.972 1.00 0.00 H new ATOM 1368 N GLN A 86 1.039 3.315 -9.813 1.00 0.00 N ATOM 1369 CA GLN A 86 1.037 4.614 -10.477 1.00 0.00 C ATOM 1370 C GLN A 86 0.307 5.646 -9.625 1.00 0.00 C ATOM 1371 O GLN A 86 0.664 6.825 -9.620 1.00 0.00 O ATOM 1372 CB GLN A 86 0.353 4.502 -11.841 1.00 0.00 C ATOM 1373 CG GLN A 86 0.679 5.739 -12.682 1.00 0.00 C ATOM 1374 CD GLN A 86 -0.294 5.845 -13.852 1.00 0.00 C ATOM 1375 OE1 GLN A 86 -0.156 5.127 -14.843 1.00 0.00 O ATOM 1376 NE2 GLN A 86 -1.275 6.704 -13.798 1.00 0.00 N ATOM 0 H GLN A 86 0.551 2.577 -10.320 1.00 0.00 H new ATOM 0 HA GLN A 86 2.070 4.934 -10.614 1.00 0.00 H new ATOM 0 HB2 GLN A 86 0.689 3.601 -12.355 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -0.726 4.411 -11.712 1.00 0.00 H new ATOM 0 HG2 GLN A 86 0.617 6.635 -12.065 1.00 0.00 H new ATOM 0 HG3 GLN A 86 1.702 5.677 -13.053 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -1.388 7.298 -12.977 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -1.929 6.781 -14.577 1.00 0.00 H new ATOM 1385 N LEU A 87 -0.714 5.197 -8.901 1.00 0.00 N ATOM 1386 CA LEU A 87 -1.486 6.094 -8.048 1.00 0.00 C ATOM 1387 C LEU A 87 -0.728 6.389 -6.756 1.00 0.00 C ATOM 1388 O LEU A 87 -0.720 7.523 -6.276 1.00 0.00 O ATOM 1389 CB LEU A 87 -2.840 5.464 -7.709 1.00 0.00 C ATOM 1390 CG LEU A 87 -3.576 5.092 -8.999 1.00 0.00 C ATOM 1391 CD1 LEU A 87 -4.844 4.307 -8.652 1.00 0.00 C ATOM 1392 CD2 LEU A 87 -3.960 6.364 -9.765 1.00 0.00 C ATOM 0 H LEU A 87 -1.024 4.225 -8.888 1.00 0.00 H new ATOM 0 HA LEU A 87 -1.644 7.027 -8.589 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -2.695 4.576 -7.093 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.440 6.162 -7.125 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.923 4.480 -9.622 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -5.370 4.041 -9.569 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -4.574 3.399 -8.112 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -5.492 4.921 -8.027 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.483 6.093 -10.682 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.611 6.980 -9.144 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -3.059 6.925 -10.014 1.00 0.00 H new ATOM 1404 N THR A 88 -0.094 5.364 -6.197 1.00 0.00 N ATOM 1405 CA THR A 88 0.660 5.529 -4.960 1.00 0.00 C ATOM 1406 C THR A 88 1.658 6.674 -5.085 1.00 0.00 C ATOM 1407 O THR A 88 1.914 7.395 -4.122 1.00 0.00 O ATOM 1408 CB THR A 88 1.404 4.238 -4.616 1.00 0.00 C ATOM 1409 OG1 THR A 88 2.222 3.857 -5.713 1.00 0.00 O ATOM 1410 CG2 THR A 88 0.395 3.128 -4.318 1.00 0.00 C ATOM 0 H THR A 88 -0.087 4.417 -6.577 1.00 0.00 H new ATOM 0 HA THR A 88 -0.046 5.762 -4.163 1.00 0.00 H new ATOM 0 HB THR A 88 2.028 4.402 -3.738 1.00 0.00 H new ATOM 0 HG1 THR A 88 1.972 4.379 -6.504 1.00 0.00 H new ATOM 0 HG21 THR A 88 0.927 2.209 -4.073 1.00 0.00 H new ATOM 0 HG22 THR A 88 -0.230 3.421 -3.474 1.00 0.00 H new ATOM 0 HG23 THR A 88 -0.232 2.962 -5.194 1.00 0.00 H new ATOM 1418 N TYR A 89 2.222 6.835 -6.278 1.00 0.00 N ATOM 1419 CA TYR A 89 3.195 7.896 -6.514 1.00 0.00 C ATOM 1420 C TYR A 89 2.514 9.263 -6.504 1.00 0.00 C ATOM 1421 O TYR A 89 2.940 10.170 -5.790 1.00 0.00 O ATOM 1422 CB TYR A 89 3.899 7.675 -7.859 1.00 0.00 C ATOM 1423 CG TYR A 89 5.101 6.778 -7.662 1.00 0.00 C ATOM 1424 CD1 TYR A 89 6.221 7.256 -6.972 1.00 0.00 C ATOM 1425 CD2 TYR A 89 5.094 5.473 -8.169 1.00 0.00 C ATOM 1426 CE1 TYR A 89 7.336 6.429 -6.789 1.00 0.00 C ATOM 1427 CE2 TYR A 89 6.210 4.646 -7.986 1.00 0.00 C ATOM 1428 CZ TYR A 89 7.330 5.124 -7.296 1.00 0.00 C ATOM 1429 OH TYR A 89 8.429 4.309 -7.116 1.00 0.00 O ATOM 0 H TYR A 89 2.024 6.250 -7.090 1.00 0.00 H new ATOM 0 HA TYR A 89 3.934 7.869 -5.713 1.00 0.00 H new ATOM 0 HB2 TYR A 89 3.209 7.224 -8.572 1.00 0.00 H new ATOM 0 HB3 TYR A 89 4.211 8.631 -8.279 1.00 0.00 H new ATOM 0 HD1 TYR A 89 6.225 8.263 -6.581 1.00 0.00 H new ATOM 0 HD2 TYR A 89 4.229 5.104 -8.701 1.00 0.00 H new ATOM 0 HE1 TYR A 89 8.200 6.798 -6.257 1.00 0.00 H new ATOM 0 HE2 TYR A 89 6.206 3.639 -8.377 1.00 0.00 H new ATOM 0 HH TYR A 89 8.260 3.436 -7.528 1.00 0.00 H new ATOM 1439 N GLU A 90 1.457 9.405 -7.296 1.00 0.00 N ATOM 1440 CA GLU A 90 0.734 10.670 -7.361 1.00 0.00 C ATOM 1441 C GLU A 90 0.481 11.209 -5.957 1.00 0.00 C ATOM 1442 O GLU A 90 0.428 12.420 -5.745 1.00 0.00 O ATOM 1443 CB GLU A 90 -0.603 10.477 -8.083 1.00 0.00 C ATOM 1444 CG GLU A 90 -0.356 10.297 -9.583 1.00 0.00 C ATOM 1445 CD GLU A 90 0.126 11.609 -10.195 1.00 0.00 C ATOM 1446 OE1 GLU A 90 -0.097 12.642 -9.585 1.00 0.00 O ATOM 1447 OE2 GLU A 90 0.709 11.561 -11.265 1.00 0.00 O ATOM 0 H GLU A 90 1.085 8.669 -7.896 1.00 0.00 H new ATOM 0 HA GLU A 90 1.342 11.386 -7.914 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -1.121 9.606 -7.683 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -1.248 11.339 -7.911 1.00 0.00 H new ATOM 0 HG2 GLU A 90 0.387 9.516 -9.746 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -1.273 9.973 -10.074 1.00 0.00 H new ATOM 1454 N HIS A 91 0.327 10.300 -5.000 1.00 0.00 N ATOM 1455 CA HIS A 91 0.080 10.693 -3.617 1.00 0.00 C ATOM 1456 C HIS A 91 1.364 11.192 -2.962 1.00 0.00 C ATOM 1457 O HIS A 91 1.366 12.222 -2.289 1.00 0.00 O ATOM 1458 CB HIS A 91 -0.470 9.503 -2.826 1.00 0.00 C ATOM 1459 CG HIS A 91 -1.085 9.991 -1.542 1.00 0.00 C ATOM 1460 ND1 HIS A 91 -2.413 9.757 -1.223 1.00 0.00 N ATOM 1461 CD2 HIS A 91 -0.566 10.703 -0.488 1.00 0.00 C ATOM 1462 CE1 HIS A 91 -2.647 10.317 -0.022 1.00 0.00 C ATOM 1463 NE2 HIS A 91 -1.555 10.906 0.470 1.00 0.00 N ATOM 0 H HIS A 91 0.368 9.293 -5.155 1.00 0.00 H new ATOM 0 HA HIS A 91 -0.652 11.501 -3.615 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -1.215 8.972 -3.419 1.00 0.00 H new ATOM 0 HB3 HIS A 91 0.330 8.795 -2.612 1.00 0.00 H new ATOM 0 HD2 HIS A 91 0.453 11.052 -0.414 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -3.602 10.293 0.482 1.00 0.00 H new ATOM 0 HE2 HIS A 91 -1.465 11.399 1.358 1.00 0.00 H new ATOM 1472 N THR A 92 2.454 10.456 -3.162 1.00 0.00 N ATOM 1473 CA THR A 92 3.738 10.836 -2.582 1.00 0.00 C ATOM 1474 C THR A 92 4.258 12.120 -3.219 1.00 0.00 C ATOM 1475 O THR A 92 4.645 13.057 -2.522 1.00 0.00 O ATOM 1476 CB THR A 92 4.761 9.715 -2.785 1.00 0.00 C ATOM 1477 OG1 THR A 92 4.845 9.398 -4.167 1.00 0.00 O ATOM 1478 CG2 THR A 92 4.329 8.476 -1.999 1.00 0.00 C ATOM 0 H THR A 92 2.474 9.600 -3.717 1.00 0.00 H new ATOM 0 HA THR A 92 3.592 11.005 -1.515 1.00 0.00 H new ATOM 0 HB THR A 92 5.737 10.045 -2.428 1.00 0.00 H new ATOM 0 HG1 THR A 92 3.994 9.610 -4.604 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.059 7.680 -2.145 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.267 8.721 -0.939 1.00 0.00 H new ATOM 0 HG23 THR A 92 3.353 8.143 -2.352 1.00 0.00 H new ATOM 1486 N MET A 93 4.264 12.156 -4.548 1.00 0.00 N ATOM 1487 CA MET A 93 4.739 13.333 -5.263 1.00 0.00 C ATOM 1488 C MET A 93 4.070 14.587 -4.709 1.00 0.00 C ATOM 1489 O MET A 93 4.743 15.546 -4.333 1.00 0.00 O ATOM 1490 CB MET A 93 4.431 13.196 -6.763 1.00 0.00 C ATOM 1491 CG MET A 93 5.721 12.890 -7.532 1.00 0.00 C ATOM 1492 SD MET A 93 6.522 11.431 -6.820 1.00 0.00 S ATOM 1493 CE MET A 93 8.167 11.704 -7.524 1.00 0.00 C ATOM 0 H MET A 93 3.949 11.392 -5.145 1.00 0.00 H new ATOM 0 HA MET A 93 5.817 13.417 -5.127 1.00 0.00 H new ATOM 0 HB2 MET A 93 3.704 12.400 -6.923 1.00 0.00 H new ATOM 0 HB3 MET A 93 3.983 14.117 -7.137 1.00 0.00 H new ATOM 0 HG2 MET A 93 5.496 12.717 -8.584 1.00 0.00 H new ATOM 0 HG3 MET A 93 6.395 13.746 -7.487 1.00 0.00 H new ATOM 0 HE1 MET A 93 8.836 10.904 -7.207 1.00 0.00 H new ATOM 0 HE2 MET A 93 8.101 11.711 -8.612 1.00 0.00 H new ATOM 0 HE3 MET A 93 8.557 12.661 -7.178 1.00 0.00 H new ATOM 1503 N LEU A 94 2.743 14.570 -4.659 1.00 0.00 N ATOM 1504 CA LEU A 94 1.996 15.713 -4.145 1.00 0.00 C ATOM 1505 C LEU A 94 2.316 15.940 -2.672 1.00 0.00 C ATOM 1506 O LEU A 94 2.623 17.057 -2.258 1.00 0.00 O ATOM 1507 CB LEU A 94 0.491 15.478 -4.311 1.00 0.00 C ATOM 1508 CG LEU A 94 -0.270 16.786 -4.049 1.00 0.00 C ATOM 1509 CD1 LEU A 94 -0.347 17.608 -5.338 1.00 0.00 C ATOM 1510 CD2 LEU A 94 -1.690 16.466 -3.571 1.00 0.00 C ATOM 0 H LEU A 94 2.166 13.786 -4.965 1.00 0.00 H new ATOM 0 HA LEU A 94 2.288 16.597 -4.712 1.00 0.00 H new ATOM 0 HB2 LEU A 94 0.278 15.118 -5.318 1.00 0.00 H new ATOM 0 HB3 LEU A 94 0.155 14.706 -3.619 1.00 0.00 H new ATOM 0 HG LEU A 94 0.256 17.358 -3.284 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -0.888 18.535 -5.147 1.00 0.00 H new ATOM 0 HD12 LEU A 94 0.661 17.840 -5.682 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.869 17.035 -6.104 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -2.229 17.395 -3.385 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -2.211 15.891 -4.337 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -1.642 15.884 -2.650 1.00 0.00 H new ATOM 1522 N GLN A 95 2.238 14.872 -1.887 1.00 0.00 N ATOM 1523 CA GLN A 95 2.518 14.965 -0.460 1.00 0.00 C ATOM 1524 C GLN A 95 3.843 15.682 -0.226 1.00 0.00 C ATOM 1525 O GLN A 95 3.992 16.434 0.737 1.00 0.00 O ATOM 1526 CB GLN A 95 2.577 13.563 0.151 1.00 0.00 C ATOM 1527 CG GLN A 95 2.639 13.668 1.676 1.00 0.00 C ATOM 1528 CD GLN A 95 1.310 14.185 2.217 1.00 0.00 C ATOM 1529 OE1 GLN A 95 0.314 13.464 2.214 1.00 0.00 O ATOM 1530 NE2 GLN A 95 1.237 15.402 2.686 1.00 0.00 N ATOM 0 H GLN A 95 1.985 13.939 -2.211 1.00 0.00 H new ATOM 0 HA GLN A 95 1.719 15.534 0.016 1.00 0.00 H new ATOM 0 HB2 GLN A 95 1.701 12.988 -0.148 1.00 0.00 H new ATOM 0 HB3 GLN A 95 3.451 13.029 -0.222 1.00 0.00 H new ATOM 0 HG2 GLN A 95 2.862 12.692 2.107 1.00 0.00 H new ATOM 0 HG3 GLN A 95 3.447 14.338 1.970 1.00 0.00 H new ATOM 0 HE21 GLN A 95 2.064 15.998 2.688 1.00 0.00 H new ATOM 0 HE22 GLN A 95 0.353 15.756 3.051 1.00 0.00 H new ATOM 1539 N LEU A 96 4.801 15.449 -1.118 1.00 0.00 N ATOM 1540 CA LEU A 96 6.111 16.080 -1.008 1.00 0.00 C ATOM 1541 C LEU A 96 6.205 17.275 -1.952 1.00 0.00 C ATOM 1542 O LEU A 96 7.163 18.046 -1.903 1.00 0.00 O ATOM 1543 CB LEU A 96 7.206 15.063 -1.352 1.00 0.00 C ATOM 1544 CG LEU A 96 8.556 15.533 -0.788 1.00 0.00 C ATOM 1545 CD1 LEU A 96 8.697 15.086 0.670 1.00 0.00 C ATOM 1546 CD2 LEU A 96 9.692 14.923 -1.614 1.00 0.00 C ATOM 0 H LEU A 96 4.695 14.830 -1.922 1.00 0.00 H new ATOM 0 HA LEU A 96 6.248 16.429 0.016 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.950 14.087 -0.939 1.00 0.00 H new ATOM 0 HB3 LEU A 96 7.276 14.943 -2.433 1.00 0.00 H new ATOM 0 HG LEU A 96 8.605 16.621 -0.838 1.00 0.00 H new ATOM 0 HD11 LEU A 96 9.656 15.423 1.063 1.00 0.00 H new ATOM 0 HD12 LEU A 96 7.891 15.518 1.263 1.00 0.00 H new ATOM 0 HD13 LEU A 96 8.645 13.999 0.724 1.00 0.00 H new ATOM 0 HD21 LEU A 96 10.651 15.255 -1.216 1.00 0.00 H new ATOM 0 HD22 LEU A 96 9.635 13.836 -1.564 1.00 0.00 H new ATOM 0 HD23 LEU A 96 9.600 15.243 -2.652 1.00 0.00 H new ATOM 1558 N TYR A 97 5.200 17.422 -2.813 1.00 0.00 N ATOM 1559 CA TYR A 97 5.173 18.526 -3.770 1.00 0.00 C ATOM 1560 C TYR A 97 3.844 19.271 -3.693 1.00 0.00 C ATOM 1561 O TYR A 97 2.985 19.118 -4.562 1.00 0.00 O ATOM 1562 CB TYR A 97 5.374 17.987 -5.188 1.00 0.00 C ATOM 1563 CG TYR A 97 5.728 19.126 -6.114 1.00 0.00 C ATOM 1564 CD1 TYR A 97 7.033 19.634 -6.133 1.00 0.00 C ATOM 1565 CD2 TYR A 97 4.752 19.675 -6.953 1.00 0.00 C ATOM 1566 CE1 TYR A 97 7.361 20.690 -6.992 1.00 0.00 C ATOM 1567 CE2 TYR A 97 5.079 20.731 -7.811 1.00 0.00 C ATOM 1568 CZ TYR A 97 6.383 21.238 -7.830 1.00 0.00 C ATOM 1569 OH TYR A 97 6.706 22.279 -8.677 1.00 0.00 O ATOM 0 H TYR A 97 4.398 16.794 -2.868 1.00 0.00 H new ATOM 0 HA TYR A 97 5.978 19.218 -3.523 1.00 0.00 H new ATOM 0 HB2 TYR A 97 6.167 17.239 -5.195 1.00 0.00 H new ATOM 0 HB3 TYR A 97 4.466 17.493 -5.533 1.00 0.00 H new ATOM 0 HD1 TYR A 97 7.786 19.211 -5.485 1.00 0.00 H new ATOM 0 HD2 TYR A 97 3.746 19.283 -6.938 1.00 0.00 H new ATOM 0 HE1 TYR A 97 8.368 21.081 -7.008 1.00 0.00 H new ATOM 0 HE2 TYR A 97 4.325 21.154 -8.458 1.00 0.00 H new ATOM 0 HH TYR A 97 5.913 22.541 -9.190 1.00 0.00 H new ATOM 1579 N PRO A 98 3.662 20.071 -2.675 1.00 0.00 N ATOM 1580 CA PRO A 98 2.410 20.858 -2.482 1.00 0.00 C ATOM 1581 C PRO A 98 1.985 21.580 -3.759 1.00 0.00 C ATOM 1582 O PRO A 98 2.715 22.425 -4.278 1.00 0.00 O ATOM 1583 CB PRO A 98 2.776 21.854 -1.379 1.00 0.00 C ATOM 1584 CG PRO A 98 3.868 21.194 -0.603 1.00 0.00 C ATOM 1585 CD PRO A 98 4.632 20.312 -1.594 1.00 0.00 C ATOM 0 HA PRO A 98 1.561 20.226 -2.222 1.00 0.00 H new ATOM 0 HB2 PRO A 98 3.110 22.803 -1.800 1.00 0.00 H new ATOM 0 HB3 PRO A 98 1.917 22.071 -0.744 1.00 0.00 H new ATOM 0 HG2 PRO A 98 4.529 21.936 -0.155 1.00 0.00 H new ATOM 0 HG3 PRO A 98 3.459 20.597 0.212 1.00 0.00 H new ATOM 0 HD2 PRO A 98 5.527 20.811 -1.965 1.00 0.00 H new ATOM 0 HD3 PRO A 98 4.955 19.379 -1.132 1.00 0.00 H new ATOM 1593 N SER A 99 0.800 21.240 -4.258 1.00 0.00 N ATOM 1594 CA SER A 99 0.285 21.858 -5.476 1.00 0.00 C ATOM 1595 C SER A 99 -1.204 22.173 -5.320 1.00 0.00 C ATOM 1596 O SER A 99 -1.900 21.531 -4.533 1.00 0.00 O ATOM 1597 CB SER A 99 0.497 20.911 -6.664 1.00 0.00 C ATOM 1598 OG SER A 99 1.465 19.930 -6.311 1.00 0.00 O ATOM 0 H SER A 99 0.182 20.544 -3.841 1.00 0.00 H new ATOM 0 HA SER A 99 0.823 22.789 -5.657 1.00 0.00 H new ATOM 0 HB2 SER A 99 -0.443 20.431 -6.934 1.00 0.00 H new ATOM 0 HB3 SER A 99 0.831 21.472 -7.537 1.00 0.00 H new ATOM 0 HG SER A 99 1.604 19.321 -7.066 1.00 0.00 H new ATOM 1604 N PRO A 100 -1.700 23.143 -6.045 1.00 0.00 N ATOM 1605 CA PRO A 100 -3.138 23.541 -5.977 1.00 0.00 C ATOM 1606 C PRO A 100 -4.054 22.484 -6.591 1.00 0.00 C ATOM 1607 O PRO A 100 -4.369 22.537 -7.780 1.00 0.00 O ATOM 1608 CB PRO A 100 -3.192 24.850 -6.773 1.00 0.00 C ATOM 1609 CG PRO A 100 -2.035 24.784 -7.714 1.00 0.00 C ATOM 1610 CD PRO A 100 -0.951 23.967 -7.009 1.00 0.00 C ATOM 0 HA PRO A 100 -3.486 23.652 -4.950 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -4.134 24.944 -7.313 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -3.115 25.715 -6.114 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -2.325 24.315 -8.654 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -1.673 25.783 -7.955 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -0.394 23.350 -7.714 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -0.228 24.611 -6.508 1.00 0.00 H new ATOM 1618 N PHE A 101 -4.479 21.528 -5.772 1.00 0.00 N ATOM 1619 CA PHE A 101 -5.358 20.464 -6.244 1.00 0.00 C ATOM 1620 C PHE A 101 -6.490 21.044 -7.088 1.00 0.00 C ATOM 1621 O PHE A 101 -6.755 22.246 -7.050 1.00 0.00 O ATOM 1622 CB PHE A 101 -5.940 19.694 -5.050 1.00 0.00 C ATOM 1623 CG PHE A 101 -5.997 20.601 -3.841 1.00 0.00 C ATOM 1624 CD1 PHE A 101 -6.761 21.773 -3.882 1.00 0.00 C ATOM 1625 CD2 PHE A 101 -5.285 20.269 -2.681 1.00 0.00 C ATOM 1626 CE1 PHE A 101 -6.814 22.614 -2.764 1.00 0.00 C ATOM 1627 CE2 PHE A 101 -5.339 21.111 -1.563 1.00 0.00 C ATOM 1628 CZ PHE A 101 -6.103 22.283 -1.605 1.00 0.00 C ATOM 0 H PHE A 101 -4.231 21.468 -4.784 1.00 0.00 H new ATOM 0 HA PHE A 101 -4.775 19.780 -6.861 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -6.939 19.329 -5.291 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -5.325 18.820 -4.833 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -7.310 22.029 -4.776 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -4.695 19.365 -2.649 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -7.404 23.518 -2.796 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -4.791 20.856 -0.668 1.00 0.00 H new ATOM 0 HZ PHE A 101 -6.144 22.932 -0.743 1.00 0.00 H new ATOM 1638 N ALA A 102 -7.153 20.181 -7.851 1.00 0.00 N ATOM 1639 CA ALA A 102 -8.254 20.614 -8.702 1.00 0.00 C ATOM 1640 C ALA A 102 -9.534 20.769 -7.887 1.00 0.00 C ATOM 1641 O ALA A 102 -9.647 20.234 -6.784 1.00 0.00 O ATOM 1642 CB ALA A 102 -8.480 19.597 -9.822 1.00 0.00 C ATOM 0 H ALA A 102 -6.948 19.183 -7.897 1.00 0.00 H new ATOM 0 HA ALA A 102 -7.994 21.580 -9.135 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -9.305 19.928 -10.453 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -7.575 19.511 -10.423 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -8.722 18.626 -9.389 1.00 0.00 H new ATOM 1648 N THR A 103 -10.497 21.502 -8.438 1.00 0.00 N ATOM 1649 CA THR A 103 -11.766 21.719 -7.752 1.00 0.00 C ATOM 1650 C THR A 103 -12.671 20.501 -7.902 1.00 0.00 C ATOM 1651 O THR A 103 -13.884 20.633 -8.065 1.00 0.00 O ATOM 1652 CB THR A 103 -12.468 22.952 -8.328 1.00 0.00 C ATOM 1653 OG1 THR A 103 -13.090 22.607 -9.559 1.00 0.00 O ATOM 1654 CG2 THR A 103 -11.444 24.062 -8.564 1.00 0.00 C ATOM 0 H THR A 103 -10.424 21.952 -9.350 1.00 0.00 H new ATOM 0 HA THR A 103 -11.562 21.879 -6.693 1.00 0.00 H new ATOM 0 HB THR A 103 -13.223 23.303 -7.624 1.00 0.00 H new ATOM 0 HG1 THR A 103 -13.729 21.879 -9.410 1.00 0.00 H new ATOM 0 HG21 THR A 103 -11.946 24.939 -8.974 1.00 0.00 H new ATOM 0 HG22 THR A 103 -10.968 24.325 -7.619 1.00 0.00 H new ATOM 0 HG23 THR A 103 -10.687 23.715 -9.267 1.00 0.00 H new ATOM 1662 N SER A 104 -12.072 19.313 -7.845 1.00 0.00 N ATOM 1663 CA SER A 104 -12.829 18.069 -7.975 1.00 0.00 C ATOM 1664 C SER A 104 -12.688 17.222 -6.713 1.00 0.00 C ATOM 1665 O SER A 104 -13.419 16.250 -6.522 1.00 0.00 O ATOM 1666 CB SER A 104 -12.326 17.277 -9.181 1.00 0.00 C ATOM 1667 OG SER A 104 -10.923 17.078 -9.059 1.00 0.00 O ATOM 0 H SER A 104 -11.069 19.185 -7.710 1.00 0.00 H new ATOM 0 HA SER A 104 -13.881 18.318 -8.117 1.00 0.00 H new ATOM 0 HB2 SER A 104 -12.838 16.316 -9.239 1.00 0.00 H new ATOM 0 HB3 SER A 104 -12.550 17.814 -10.103 1.00 0.00 H new ATOM 0 HG SER A 104 -10.597 16.569 -9.830 1.00 0.00 H new ATOM 1673 N ASP A 105 -11.744 17.599 -5.857 1.00 0.00 N ATOM 1674 CA ASP A 105 -11.515 16.866 -4.616 1.00 0.00 C ATOM 1675 C ASP A 105 -12.813 16.729 -3.826 1.00 0.00 C ATOM 1676 O ASP A 105 -13.211 15.624 -3.455 1.00 0.00 O ATOM 1677 CB ASP A 105 -10.474 17.596 -3.766 1.00 0.00 C ATOM 1678 CG ASP A 105 -10.931 19.026 -3.496 1.00 0.00 C ATOM 1679 OD1 ASP A 105 -11.621 19.231 -2.511 1.00 0.00 O ATOM 1680 OD2 ASP A 105 -10.585 19.895 -4.279 1.00 0.00 O ATOM 0 H ASP A 105 -11.129 18.401 -5.997 1.00 0.00 H new ATOM 0 HA ASP A 105 -11.149 15.870 -4.866 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -10.327 17.068 -2.824 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -9.513 17.604 -4.280 1.00 0.00 H new ATOM 1685 N PHE A 106 -13.467 17.858 -3.571 1.00 0.00 N ATOM 1686 CA PHE A 106 -14.719 17.857 -2.822 1.00 0.00 C ATOM 1687 C PHE A 106 -15.607 16.693 -3.255 1.00 0.00 C ATOM 1688 O PHE A 106 -15.592 15.626 -2.642 1.00 0.00 O ATOM 1689 CB PHE A 106 -15.462 19.176 -3.045 1.00 0.00 C ATOM 1690 CG PHE A 106 -14.780 20.279 -2.270 1.00 0.00 C ATOM 1691 CD1 PHE A 106 -15.078 20.472 -0.915 1.00 0.00 C ATOM 1692 CD2 PHE A 106 -13.850 21.110 -2.906 1.00 0.00 C ATOM 1693 CE1 PHE A 106 -14.448 21.496 -0.198 1.00 0.00 C ATOM 1694 CE2 PHE A 106 -13.219 22.133 -2.189 1.00 0.00 C ATOM 1695 CZ PHE A 106 -13.518 22.326 -0.835 1.00 0.00 C ATOM 0 H PHE A 106 -13.153 18.781 -3.870 1.00 0.00 H new ATOM 0 HA PHE A 106 -14.484 17.744 -1.764 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -15.479 19.421 -4.107 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -16.499 19.080 -2.724 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -15.794 19.830 -0.423 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -13.619 20.962 -3.951 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -14.679 21.646 0.846 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -12.501 22.773 -2.680 1.00 0.00 H new ATOM 0 HZ PHE A 106 -13.031 23.115 -0.282 1.00 0.00 H new ATOM 1705 N MET A 107 -16.382 16.911 -4.315 1.00 0.00 N ATOM 1706 CA MET A 107 -17.279 15.877 -4.824 1.00 0.00 C ATOM 1707 C MET A 107 -16.615 15.103 -5.957 1.00 0.00 C ATOM 1708 O MET A 107 -16.369 15.646 -7.033 1.00 0.00 O ATOM 1709 CB MET A 107 -18.573 16.515 -5.332 1.00 0.00 C ATOM 1710 CG MET A 107 -19.055 17.564 -4.327 1.00 0.00 C ATOM 1711 SD MET A 107 -20.773 18.002 -4.691 1.00 0.00 S ATOM 1712 CE MET A 107 -20.485 18.713 -6.329 1.00 0.00 C ATOM 0 H MET A 107 -16.407 17.788 -4.835 1.00 0.00 H new ATOM 0 HA MET A 107 -17.507 15.187 -4.012 1.00 0.00 H new ATOM 0 HB2 MET A 107 -18.405 16.978 -6.304 1.00 0.00 H new ATOM 0 HB3 MET A 107 -19.338 15.751 -5.471 1.00 0.00 H new ATOM 0 HG2 MET A 107 -18.975 17.175 -3.312 1.00 0.00 H new ATOM 0 HG3 MET A 107 -18.423 18.451 -4.379 1.00 0.00 H new ATOM 0 HE1 MET A 107 -21.321 19.359 -6.597 1.00 0.00 H new ATOM 0 HE2 MET A 107 -19.565 19.297 -6.316 1.00 0.00 H new ATOM 0 HE3 MET A 107 -20.396 17.912 -7.063 1.00 0.00 H new ATOM 1722 N VAL A 108 -16.327 13.830 -5.708 1.00 0.00 N ATOM 1723 CA VAL A 108 -15.691 12.990 -6.717 1.00 0.00 C ATOM 1724 C VAL A 108 -16.680 12.634 -7.821 1.00 0.00 C ATOM 1725 O VAL A 108 -17.725 12.039 -7.562 1.00 0.00 O ATOM 1726 CB VAL A 108 -15.155 11.707 -6.077 1.00 0.00 C ATOM 1727 CG1 VAL A 108 -14.122 12.063 -5.006 1.00 0.00 C ATOM 1728 CG2 VAL A 108 -16.308 10.928 -5.436 1.00 0.00 C ATOM 0 H VAL A 108 -16.522 13.360 -4.824 1.00 0.00 H new ATOM 0 HA VAL A 108 -14.863 13.549 -7.152 1.00 0.00 H new ATOM 0 HB VAL A 108 -14.686 11.091 -6.844 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -13.741 11.149 -4.550 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -13.299 12.612 -5.463 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -14.590 12.682 -4.241 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -15.922 10.015 -4.982 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -16.781 11.543 -4.670 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -17.042 10.671 -6.200 1.00 0.00 H new ATOM 1738 N ARG A 109 -16.340 12.998 -9.053 1.00 0.00 N ATOM 1739 CA ARG A 109 -17.205 12.704 -10.188 1.00 0.00 C ATOM 1740 C ARG A 109 -17.057 11.244 -10.600 1.00 0.00 C ATOM 1741 O ARG A 109 -16.105 10.877 -11.288 1.00 0.00 O ATOM 1742 CB ARG A 109 -16.845 13.610 -11.367 1.00 0.00 C ATOM 1743 CG ARG A 109 -17.701 13.236 -12.580 1.00 0.00 C ATOM 1744 CD ARG A 109 -17.629 14.356 -13.620 1.00 0.00 C ATOM 1745 NE ARG A 109 -18.361 13.974 -14.823 1.00 0.00 N ATOM 1746 CZ ARG A 109 -18.884 14.890 -15.632 1.00 0.00 C ATOM 1747 NH1 ARG A 109 -18.748 16.159 -15.357 1.00 0.00 N ATOM 1748 NH2 ARG A 109 -19.533 14.522 -16.703 1.00 0.00 N ATOM 0 H ARG A 109 -15.480 13.492 -9.289 1.00 0.00 H new ATOM 0 HA ARG A 109 -18.239 12.887 -9.896 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -17.010 14.654 -11.100 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -15.787 13.506 -11.609 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -17.348 12.300 -13.013 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -18.735 13.076 -12.274 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -18.048 15.274 -13.207 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -16.589 14.564 -13.869 1.00 0.00 H new ATOM 0 HE ARG A 109 -18.474 12.985 -15.047 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -18.240 16.448 -14.521 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -19.150 16.861 -15.978 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -19.639 13.531 -16.920 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -19.934 15.225 -17.323 1.00 0.00 H new ATOM 1762 N PHE A 110 -18.002 10.414 -10.170 1.00 0.00 N ATOM 1763 CA PHE A 110 -17.963 8.992 -10.495 1.00 0.00 C ATOM 1764 C PHE A 110 -18.714 8.719 -11.797 1.00 0.00 C ATOM 1765 O PHE A 110 -19.664 9.425 -12.135 1.00 0.00 O ATOM 1766 CB PHE A 110 -18.594 8.185 -9.358 1.00 0.00 C ATOM 1767 CG PHE A 110 -19.852 8.874 -8.888 1.00 0.00 C ATOM 1768 CD1 PHE A 110 -21.031 8.764 -9.634 1.00 0.00 C ATOM 1769 CD2 PHE A 110 -19.841 9.623 -7.704 1.00 0.00 C ATOM 1770 CE1 PHE A 110 -22.198 9.401 -9.198 1.00 0.00 C ATOM 1771 CE2 PHE A 110 -21.009 10.260 -7.268 1.00 0.00 C ATOM 1772 CZ PHE A 110 -22.188 10.150 -8.016 1.00 0.00 C ATOM 0 H PHE A 110 -18.799 10.698 -9.600 1.00 0.00 H new ATOM 0 HA PHE A 110 -16.923 8.692 -10.622 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -18.825 7.176 -9.699 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -17.889 8.089 -8.532 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -21.040 8.187 -10.547 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -18.932 9.709 -7.128 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -23.107 9.315 -9.774 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -21.001 10.836 -6.355 1.00 0.00 H new ATOM 0 HZ PHE A 110 -23.089 10.643 -7.681 1.00 0.00 H new ATOM 1782 N PRO A 111 -18.311 7.709 -12.527 1.00 0.00 N ATOM 1783 CA PRO A 111 -18.966 7.337 -13.818 1.00 0.00 C ATOM 1784 C PRO A 111 -20.406 6.870 -13.612 1.00 0.00 C ATOM 1785 O PRO A 111 -20.746 6.319 -12.566 1.00 0.00 O ATOM 1786 CB PRO A 111 -18.088 6.203 -14.367 1.00 0.00 C ATOM 1787 CG PRO A 111 -17.362 5.653 -13.183 1.00 0.00 C ATOM 1788 CD PRO A 111 -17.190 6.812 -12.205 1.00 0.00 C ATOM 0 HA PRO A 111 -19.038 8.184 -14.501 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -18.694 5.435 -14.848 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -17.390 6.575 -15.117 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -17.925 4.840 -12.726 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -16.394 5.245 -13.476 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -17.233 6.473 -11.170 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -16.229 7.309 -12.338 1.00 0.00 H new ATOM 1796 N GLU A 112 -21.248 7.097 -14.618 1.00 0.00 N ATOM 1797 CA GLU A 112 -22.652 6.699 -14.539 1.00 0.00 C ATOM 1798 C GLU A 112 -22.883 5.383 -15.278 1.00 0.00 C ATOM 1799 O GLU A 112 -23.916 4.737 -15.105 1.00 0.00 O ATOM 1800 CB GLU A 112 -23.538 7.792 -15.149 1.00 0.00 C ATOM 1801 CG GLU A 112 -25.020 7.491 -14.863 1.00 0.00 C ATOM 1802 CD GLU A 112 -25.647 8.633 -14.066 1.00 0.00 C ATOM 1803 OE1 GLU A 112 -25.939 9.655 -14.663 1.00 0.00 O ATOM 1804 OE2 GLU A 112 -25.825 8.467 -12.871 1.00 0.00 O ATOM 0 H GLU A 112 -20.985 7.552 -15.492 1.00 0.00 H new ATOM 0 HA GLU A 112 -22.912 6.561 -13.489 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -23.269 8.763 -14.733 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -23.371 7.848 -16.225 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -25.558 7.354 -15.801 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -25.108 6.558 -14.306 1.00 0.00 H new ATOM 1811 N TRP A 113 -21.916 4.993 -16.103 1.00 0.00 N ATOM 1812 CA TRP A 113 -22.029 3.751 -16.865 1.00 0.00 C ATOM 1813 C TRP A 113 -21.563 2.566 -16.023 1.00 0.00 C ATOM 1814 O TRP A 113 -21.655 1.416 -16.452 1.00 0.00 O ATOM 1815 CB TRP A 113 -21.195 3.842 -18.152 1.00 0.00 C ATOM 1816 CG TRP A 113 -20.156 4.908 -18.007 1.00 0.00 C ATOM 1817 CD1 TRP A 113 -18.957 4.747 -17.403 1.00 0.00 C ATOM 1818 CD2 TRP A 113 -20.205 6.290 -18.462 1.00 0.00 C ATOM 1819 NE1 TRP A 113 -18.266 5.945 -17.458 1.00 0.00 N ATOM 1820 CE2 TRP A 113 -18.993 6.926 -18.101 1.00 0.00 C ATOM 1821 CE3 TRP A 113 -21.173 7.047 -19.145 1.00 0.00 C ATOM 1822 CZ2 TRP A 113 -18.751 8.266 -18.409 1.00 0.00 C ATOM 1823 CZ3 TRP A 113 -20.933 8.395 -19.457 1.00 0.00 C ATOM 1824 CH2 TRP A 113 -19.724 9.003 -19.088 1.00 0.00 C ATOM 0 H TRP A 113 -21.053 5.512 -16.261 1.00 0.00 H new ATOM 0 HA TRP A 113 -23.075 3.601 -17.131 1.00 0.00 H new ATOM 0 HB2 TRP A 113 -20.719 2.883 -18.357 1.00 0.00 H new ATOM 0 HB3 TRP A 113 -21.842 4.065 -19.001 1.00 0.00 H new ATOM 0 HD1 TRP A 113 -18.598 3.834 -16.952 1.00 0.00 H new ATOM 0 HE1 TRP A 113 -17.333 6.086 -17.070 1.00 0.00 H new ATOM 0 HE3 TRP A 113 -22.108 6.589 -19.432 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 -17.818 8.730 -18.124 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 -21.683 8.966 -19.984 1.00 0.00 H new ATOM 0 HH2 TRP A 113 -19.546 10.041 -19.329 1.00 0.00 H new ATOM 1835 N LEU A 114 -21.069 2.854 -14.822 1.00 0.00 N ATOM 1836 CA LEU A 114 -20.597 1.806 -13.925 1.00 0.00 C ATOM 1837 C LEU A 114 -21.244 1.963 -12.554 1.00 0.00 C ATOM 1838 O LEU A 114 -20.640 2.511 -11.632 1.00 0.00 O ATOM 1839 CB LEU A 114 -19.074 1.885 -13.785 1.00 0.00 C ATOM 1840 CG LEU A 114 -18.406 1.436 -15.092 1.00 0.00 C ATOM 1841 CD1 LEU A 114 -17.011 2.057 -15.192 1.00 0.00 C ATOM 1842 CD2 LEU A 114 -18.280 -0.090 -15.117 1.00 0.00 C ATOM 0 H LEU A 114 -20.986 3.800 -14.450 1.00 0.00 H new ATOM 0 HA LEU A 114 -20.870 0.837 -14.342 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -18.774 2.905 -13.545 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -18.742 1.253 -12.961 1.00 0.00 H new ATOM 0 HG LEU A 114 -19.017 1.762 -15.934 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -16.537 1.738 -16.120 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -17.095 3.144 -15.182 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -16.406 1.732 -14.345 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -17.805 -0.401 -16.048 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -17.674 -0.419 -14.273 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -19.271 -0.538 -15.048 1.00 0.00 H new ATOM 1854 N PRO A 115 -22.458 1.500 -12.408 1.00 0.00 N ATOM 1855 CA PRO A 115 -23.210 1.593 -11.122 1.00 0.00 C ATOM 1856 C PRO A 115 -22.397 1.074 -9.937 1.00 0.00 C ATOM 1857 O PRO A 115 -22.889 1.022 -8.813 1.00 0.00 O ATOM 1858 CB PRO A 115 -24.452 0.727 -11.360 1.00 0.00 C ATOM 1859 CG PRO A 115 -24.644 0.716 -12.841 1.00 0.00 C ATOM 1860 CD PRO A 115 -23.250 0.837 -13.458 1.00 0.00 C ATOM 0 HA PRO A 115 -23.451 2.624 -10.865 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -24.308 -0.282 -10.974 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -25.324 1.141 -10.853 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -25.132 -0.204 -13.162 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -25.281 1.542 -13.156 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -22.839 -0.140 -13.713 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -23.268 1.424 -14.376 1.00 0.00 H new ATOM 1868 N LEU A 116 -21.153 0.698 -10.192 1.00 0.00 N ATOM 1869 CA LEU A 116 -20.286 0.195 -9.138 1.00 0.00 C ATOM 1870 C LEU A 116 -20.154 1.234 -8.033 1.00 0.00 C ATOM 1871 O LEU A 116 -20.027 0.900 -6.856 1.00 0.00 O ATOM 1872 CB LEU A 116 -18.898 -0.133 -9.711 1.00 0.00 C ATOM 1873 CG LEU A 116 -18.843 -1.598 -10.168 1.00 0.00 C ATOM 1874 CD1 LEU A 116 -18.978 -2.537 -8.958 1.00 0.00 C ATOM 1875 CD2 LEU A 116 -19.981 -1.867 -11.161 1.00 0.00 C ATOM 0 H LEU A 116 -20.723 0.731 -11.116 1.00 0.00 H new ATOM 0 HA LEU A 116 -20.725 -0.713 -8.724 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -18.679 0.526 -10.551 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -18.133 0.049 -8.956 1.00 0.00 H new ATOM 0 HG LEU A 116 -17.884 -1.784 -10.652 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -18.938 -3.573 -9.295 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -18.162 -2.350 -8.260 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -19.930 -2.354 -8.460 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -19.942 -2.907 -11.486 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -20.939 -1.673 -10.678 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -19.872 -1.213 -12.026 1.00 0.00 H new ATOM 1887 N ASP A 117 -20.188 2.504 -8.436 1.00 0.00 N ATOM 1888 CA ASP A 117 -20.079 3.613 -7.495 1.00 0.00 C ATOM 1889 C ASP A 117 -21.463 4.139 -7.125 1.00 0.00 C ATOM 1890 O ASP A 117 -21.751 4.379 -5.954 1.00 0.00 O ATOM 1891 CB ASP A 117 -19.249 4.741 -8.117 1.00 0.00 C ATOM 1892 CG ASP A 117 -18.208 4.161 -9.068 1.00 0.00 C ATOM 1893 OD1 ASP A 117 -17.414 3.350 -8.621 1.00 0.00 O ATOM 1894 OD2 ASP A 117 -18.220 4.535 -10.229 1.00 0.00 O ATOM 0 H ASP A 117 -20.290 2.788 -9.410 1.00 0.00 H new ATOM 0 HA ASP A 117 -19.587 3.255 -6.591 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -19.901 5.429 -8.655 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -18.756 5.316 -7.333 1.00 0.00 H new ATOM 1899 N LYS A 118 -22.317 4.317 -8.133 1.00 0.00 N ATOM 1900 CA LYS A 118 -23.666 4.819 -7.892 1.00 0.00 C ATOM 1901 C LYS A 118 -24.470 3.809 -7.082 1.00 0.00 C ATOM 1902 O LYS A 118 -25.145 4.168 -6.118 1.00 0.00 O ATOM 1903 CB LYS A 118 -24.371 5.091 -9.223 1.00 0.00 C ATOM 1904 CG LYS A 118 -25.585 5.992 -8.984 1.00 0.00 C ATOM 1905 CD LYS A 118 -26.331 6.203 -10.303 1.00 0.00 C ATOM 1906 CE LYS A 118 -27.613 7.000 -10.048 1.00 0.00 C ATOM 1907 NZ LYS A 118 -28.549 6.812 -11.193 1.00 0.00 N ATOM 0 H LYS A 118 -22.101 4.124 -9.111 1.00 0.00 H new ATOM 0 HA LYS A 118 -23.594 5.749 -7.328 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -23.682 5.568 -9.920 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -24.686 4.152 -9.678 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -26.248 5.539 -8.247 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -25.265 6.951 -8.577 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -25.695 6.735 -11.011 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -26.573 5.240 -10.753 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -28.082 6.668 -9.122 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -27.379 8.057 -9.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -29.421 7.353 -11.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -28.099 7.149 -12.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -28.781 5.803 -11.289 1.00 0.00 H new ATOM 1921 N TRP A 119 -24.382 2.543 -7.474 1.00 0.00 N ATOM 1922 CA TRP A 119 -25.096 1.485 -6.772 1.00 0.00 C ATOM 1923 C TRP A 119 -24.416 1.199 -5.439 1.00 0.00 C ATOM 1924 O TRP A 119 -24.985 0.544 -4.566 1.00 0.00 O ATOM 1925 CB TRP A 119 -25.121 0.208 -7.620 1.00 0.00 C ATOM 1926 CG TRP A 119 -26.243 -0.673 -7.171 1.00 0.00 C ATOM 1927 CD1 TRP A 119 -26.102 -1.776 -6.401 1.00 0.00 C ATOM 1928 CD2 TRP A 119 -27.669 -0.548 -7.449 1.00 0.00 C ATOM 1929 NE1 TRP A 119 -27.349 -2.336 -6.189 1.00 0.00 N ATOM 1930 CE2 TRP A 119 -28.346 -1.615 -6.815 1.00 0.00 C ATOM 1931 CE3 TRP A 119 -28.430 0.379 -8.184 1.00 0.00 C ATOM 1932 CZ2 TRP A 119 -29.732 -1.757 -6.905 1.00 0.00 C ATOM 1933 CZ3 TRP A 119 -29.825 0.239 -8.276 1.00 0.00 C ATOM 1934 CH2 TRP A 119 -30.474 -0.828 -7.639 1.00 0.00 C ATOM 0 H TRP A 119 -23.827 2.226 -8.269 1.00 0.00 H new ATOM 0 HA TRP A 119 -26.120 1.813 -6.594 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -25.244 0.461 -8.673 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -24.172 -0.320 -7.528 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -25.168 -2.157 -6.015 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -27.512 -3.179 -5.638 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -27.939 1.203 -8.680 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -30.227 -2.580 -6.411 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -30.401 0.957 -8.841 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -31.546 -0.932 -7.716 1.00 0.00 H new ATOM 1945 N VAL A 120 -23.192 1.704 -5.289 1.00 0.00 N ATOM 1946 CA VAL A 120 -22.441 1.505 -4.052 1.00 0.00 C ATOM 1947 C VAL A 120 -21.647 2.760 -3.689 1.00 0.00 C ATOM 1948 O VAL A 120 -20.426 2.803 -3.848 1.00 0.00 O ATOM 1949 CB VAL A 120 -21.489 0.313 -4.204 1.00 0.00 C ATOM 1950 CG1 VAL A 120 -21.202 -0.296 -2.829 1.00 0.00 C ATOM 1951 CG2 VAL A 120 -22.137 -0.745 -5.100 1.00 0.00 C ATOM 0 H VAL A 120 -22.704 2.248 -6.001 1.00 0.00 H new ATOM 0 HA VAL A 120 -23.150 1.302 -3.250 1.00 0.00 H new ATOM 0 HB VAL A 120 -20.555 0.652 -4.653 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -20.525 -1.143 -2.940 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -20.741 0.455 -2.187 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -22.135 -0.634 -2.379 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -21.461 -1.593 -5.209 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -23.071 -1.081 -4.649 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -22.341 -0.316 -6.081 1.00 0.00 H new ATOM 1961 N PRO A 121 -22.316 3.774 -3.202 1.00 0.00 N ATOM 1962 CA PRO A 121 -21.666 5.055 -2.803 1.00 0.00 C ATOM 1963 C PRO A 121 -21.030 4.958 -1.417 1.00 0.00 C ATOM 1964 O PRO A 121 -20.202 5.786 -1.039 1.00 0.00 O ATOM 1965 CB PRO A 121 -22.825 6.051 -2.813 1.00 0.00 C ATOM 1966 CG PRO A 121 -24.041 5.241 -2.490 1.00 0.00 C ATOM 1967 CD PRO A 121 -23.770 3.812 -2.980 1.00 0.00 C ATOM 0 HA PRO A 121 -20.850 5.339 -3.467 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -22.672 6.841 -2.078 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -22.921 6.534 -3.785 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -24.237 5.251 -1.418 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -24.922 5.656 -2.979 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -24.079 3.073 -2.241 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -24.318 3.595 -3.897 1.00 0.00 H new ATOM 1975 N GLN A 122 -21.440 3.943 -0.667 1.00 0.00 N ATOM 1976 CA GLN A 122 -20.927 3.737 0.684 1.00 0.00 C ATOM 1977 C GLN A 122 -19.405 3.664 0.678 1.00 0.00 C ATOM 1978 O GLN A 122 -18.737 4.393 1.412 1.00 0.00 O ATOM 1979 CB GLN A 122 -21.501 2.443 1.267 1.00 0.00 C ATOM 1980 CG GLN A 122 -21.045 2.281 2.721 1.00 0.00 C ATOM 1981 CD GLN A 122 -19.624 1.728 2.765 1.00 0.00 C ATOM 1982 OE1 GLN A 122 -18.712 2.393 3.257 1.00 0.00 O ATOM 1983 NE2 GLN A 122 -19.381 0.542 2.277 1.00 0.00 N ATOM 0 H GLN A 122 -22.125 3.250 -0.969 1.00 0.00 H new ATOM 0 HA GLN A 122 -21.233 4.582 1.301 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -22.590 2.463 1.218 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -21.171 1.589 0.675 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -21.086 3.243 3.232 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -21.722 1.610 3.250 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -20.138 -0.007 1.870 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -18.434 0.164 2.303 1.00 0.00 H new ATOM 1992 N VAL A 123 -18.862 2.778 -0.150 1.00 0.00 N ATOM 1993 CA VAL A 123 -17.414 2.614 -0.239 1.00 0.00 C ATOM 1994 C VAL A 123 -16.882 3.234 -1.528 1.00 0.00 C ATOM 1995 O VAL A 123 -16.291 2.555 -2.367 1.00 0.00 O ATOM 1996 CB VAL A 123 -17.057 1.123 -0.181 1.00 0.00 C ATOM 1997 CG1 VAL A 123 -17.874 0.354 -1.226 1.00 0.00 C ATOM 1998 CG2 VAL A 123 -15.556 0.932 -0.455 1.00 0.00 C ATOM 0 H VAL A 123 -19.398 2.166 -0.766 1.00 0.00 H new ATOM 0 HA VAL A 123 -16.950 3.126 0.604 1.00 0.00 H new ATOM 0 HB VAL A 123 -17.290 0.740 0.812 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -17.617 -0.704 -1.182 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -18.937 0.479 -1.020 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -17.649 0.740 -2.220 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -15.310 -0.129 -0.412 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -15.314 1.321 -1.444 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -14.978 1.469 0.297 1.00 0.00 H new ATOM 2008 N PHE A 124 -17.103 4.537 -1.674 1.00 0.00 N ATOM 2009 CA PHE A 124 -16.652 5.257 -2.858 1.00 0.00 C ATOM 2010 C PHE A 124 -16.691 6.766 -2.611 1.00 0.00 C ATOM 2011 O PHE A 124 -15.770 7.489 -2.991 1.00 0.00 O ATOM 2012 CB PHE A 124 -17.545 4.898 -4.055 1.00 0.00 C ATOM 2013 CG PHE A 124 -16.690 4.644 -5.276 1.00 0.00 C ATOM 2014 CD1 PHE A 124 -16.197 5.720 -6.024 1.00 0.00 C ATOM 2015 CD2 PHE A 124 -16.392 3.331 -5.659 1.00 0.00 C ATOM 2016 CE1 PHE A 124 -15.405 5.483 -7.153 1.00 0.00 C ATOM 2017 CE2 PHE A 124 -15.600 3.093 -6.789 1.00 0.00 C ATOM 2018 CZ PHE A 124 -15.107 4.169 -7.536 1.00 0.00 C ATOM 0 H PHE A 124 -17.591 5.114 -0.988 1.00 0.00 H new ATOM 0 HA PHE A 124 -15.624 4.967 -3.076 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -18.138 4.013 -3.825 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -18.246 5.709 -4.253 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -16.428 6.733 -5.730 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -16.773 2.501 -5.083 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -15.024 6.313 -7.729 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -15.370 2.080 -7.084 1.00 0.00 H new ATOM 0 HZ PHE A 124 -14.497 3.986 -8.408 1.00 0.00 H new ATOM 2028 N VAL A 125 -17.763 7.230 -1.973 1.00 0.00 N ATOM 2029 CA VAL A 125 -17.912 8.656 -1.682 1.00 0.00 C ATOM 2030 C VAL A 125 -16.797 9.140 -0.757 1.00 0.00 C ATOM 2031 O VAL A 125 -16.525 8.531 0.277 1.00 0.00 O ATOM 2032 CB VAL A 125 -19.269 8.914 -1.026 1.00 0.00 C ATOM 2033 CG1 VAL A 125 -19.321 8.222 0.339 1.00 0.00 C ATOM 2034 CG2 VAL A 125 -19.466 10.420 -0.841 1.00 0.00 C ATOM 0 H VAL A 125 -18.535 6.647 -1.650 1.00 0.00 H new ATOM 0 HA VAL A 125 -17.850 9.206 -2.621 1.00 0.00 H new ATOM 0 HB VAL A 125 -20.060 8.517 -1.663 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -20.289 8.407 0.804 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -19.181 7.149 0.209 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -18.530 8.616 0.977 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -20.433 10.606 -0.373 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -18.674 10.815 -0.205 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -19.432 10.913 -1.812 1.00 0.00 H new ATOM 2044 N ALA A 126 -16.151 10.241 -1.141 1.00 0.00 N ATOM 2045 CA ALA A 126 -15.061 10.803 -0.345 1.00 0.00 C ATOM 2046 C ALA A 126 -15.549 11.968 0.511 1.00 0.00 C ATOM 2047 O ALA A 126 -16.565 12.593 0.206 1.00 0.00 O ATOM 2048 CB ALA A 126 -13.942 11.285 -1.269 1.00 0.00 C ATOM 0 H ALA A 126 -16.362 10.759 -1.994 1.00 0.00 H new ATOM 0 HA ALA A 126 -14.686 10.022 0.316 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -13.132 11.703 -0.672 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -13.566 10.445 -1.854 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -14.330 12.051 -1.941 1.00 0.00 H new ATOM 2054 N SER A 127 -14.809 12.259 1.578 1.00 0.00 N ATOM 2055 CA SER A 127 -15.162 13.356 2.472 1.00 0.00 C ATOM 2056 C SER A 127 -13.965 13.747 3.338 1.00 0.00 C ATOM 2057 O SER A 127 -13.674 13.094 4.340 1.00 0.00 O ATOM 2058 CB SER A 127 -16.330 12.943 3.370 1.00 0.00 C ATOM 2059 OG SER A 127 -15.978 11.766 4.085 1.00 0.00 O ATOM 0 H SER A 127 -13.965 11.752 1.843 1.00 0.00 H new ATOM 0 HA SER A 127 -15.455 14.214 1.867 1.00 0.00 H new ATOM 0 HB2 SER A 127 -16.571 13.747 4.066 1.00 0.00 H new ATOM 0 HB3 SER A 127 -17.221 12.764 2.768 1.00 0.00 H new ATOM 0 HG SER A 127 -15.099 11.887 4.502 1.00 0.00 H new ATOM 2065 N GLY A 128 -13.273 14.816 2.944 1.00 0.00 N ATOM 2066 CA GLY A 128 -12.108 15.284 3.693 1.00 0.00 C ATOM 2067 C GLY A 128 -11.020 15.800 2.754 1.00 0.00 C ATOM 2068 O GLY A 128 -11.228 15.898 1.545 1.00 0.00 O ATOM 0 H GLY A 128 -13.497 15.370 2.117 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -12.407 16.077 4.378 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -11.712 14.470 4.301 1.00 0.00 H new ATOM 2072 N ASP A 129 -9.858 16.127 3.319 1.00 0.00 N ATOM 2073 CA ASP A 129 -8.741 16.630 2.523 1.00 0.00 C ATOM 2074 C ASP A 129 -7.826 15.480 2.115 1.00 0.00 C ATOM 2075 O ASP A 129 -7.754 14.458 2.796 1.00 0.00 O ATOM 2076 CB ASP A 129 -7.944 17.657 3.330 1.00 0.00 C ATOM 2077 CG ASP A 129 -6.691 18.066 2.563 1.00 0.00 C ATOM 2078 OD1 ASP A 129 -6.813 18.875 1.658 1.00 0.00 O ATOM 2079 OD2 ASP A 129 -5.629 17.563 2.891 1.00 0.00 O ATOM 0 H ASP A 129 -9.667 16.053 4.318 1.00 0.00 H new ATOM 0 HA ASP A 129 -9.138 17.106 1.626 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -8.561 18.533 3.529 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -7.667 17.236 4.297 1.00 0.00 H new ATOM 2084 N CYS A 130 -7.133 15.655 0.991 1.00 0.00 N ATOM 2085 CA CYS A 130 -6.227 14.625 0.488 1.00 0.00 C ATOM 2086 C CYS A 130 -4.772 15.009 0.744 1.00 0.00 C ATOM 2087 O CYS A 130 -4.345 16.111 0.401 1.00 0.00 O ATOM 2088 CB CYS A 130 -6.451 14.426 -1.014 1.00 0.00 C ATOM 2089 SG CYS A 130 -7.793 13.240 -1.270 1.00 0.00 S ATOM 0 H CYS A 130 -7.181 16.495 0.415 1.00 0.00 H new ATOM 0 HA CYS A 130 -6.437 13.695 1.016 1.00 0.00 H new ATOM 0 HB2 CYS A 130 -6.697 15.378 -1.485 1.00 0.00 H new ATOM 0 HB3 CYS A 130 -5.537 14.064 -1.484 1.00 0.00 H new ATOM 2094 N ALA A 131 -4.029 14.080 1.350 1.00 0.00 N ATOM 2095 CA ALA A 131 -2.611 14.281 1.666 1.00 0.00 C ATOM 2096 C ALA A 131 -2.431 14.672 3.129 1.00 0.00 C ATOM 2097 O ALA A 131 -1.310 14.693 3.640 1.00 0.00 O ATOM 2098 CB ALA A 131 -1.985 15.352 0.767 1.00 0.00 C ATOM 0 H ALA A 131 -4.391 13.170 1.635 1.00 0.00 H new ATOM 0 HA ALA A 131 -2.102 13.334 1.484 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -0.934 15.476 1.027 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -2.067 15.045 -0.276 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -2.508 16.298 0.909 1.00 0.00 H new ATOM 2104 N GLU A 132 -3.535 14.971 3.805 1.00 0.00 N ATOM 2105 CA GLU A 132 -3.470 15.346 5.212 1.00 0.00 C ATOM 2106 C GLU A 132 -3.044 14.142 6.048 1.00 0.00 C ATOM 2107 O GLU A 132 -3.362 13.001 5.709 1.00 0.00 O ATOM 2108 CB GLU A 132 -4.843 15.851 5.681 1.00 0.00 C ATOM 2109 CG GLU A 132 -4.667 16.994 6.685 1.00 0.00 C ATOM 2110 CD GLU A 132 -3.753 16.556 7.824 1.00 0.00 C ATOM 2111 OE1 GLU A 132 -4.243 15.910 8.735 1.00 0.00 O ATOM 2112 OE2 GLU A 132 -2.576 16.874 7.769 1.00 0.00 O ATOM 0 H GLU A 132 -4.474 14.961 3.407 1.00 0.00 H new ATOM 0 HA GLU A 132 -2.737 16.143 5.337 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -5.425 16.194 4.826 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -5.402 15.036 6.140 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -4.245 17.866 6.185 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -5.637 17.293 7.082 1.00 0.00 H new ATOM 2119 N ARG A 133 -2.325 14.395 7.138 1.00 0.00 N ATOM 2120 CA ARG A 133 -1.868 13.314 8.005 1.00 0.00 C ATOM 2121 C ARG A 133 -2.907 13.022 9.080 1.00 0.00 C ATOM 2122 O ARG A 133 -3.425 13.937 9.720 1.00 0.00 O ATOM 2123 CB ARG A 133 -0.541 13.695 8.663 1.00 0.00 C ATOM 2124 CG ARG A 133 0.081 12.457 9.314 1.00 0.00 C ATOM 2125 CD ARG A 133 1.483 12.794 9.822 1.00 0.00 C ATOM 2126 NE ARG A 133 1.417 13.864 10.810 1.00 0.00 N ATOM 2127 CZ ARG A 133 2.458 14.147 11.587 1.00 0.00 C ATOM 2128 NH1 ARG A 133 3.567 13.471 11.466 1.00 0.00 N ATOM 2129 NH2 ARG A 133 2.371 15.105 12.469 1.00 0.00 N ATOM 0 H ARG A 133 -2.049 15.329 7.440 1.00 0.00 H new ATOM 0 HA ARG A 133 -1.725 12.420 7.398 1.00 0.00 H new ATOM 0 HB2 ARG A 133 0.140 14.109 7.919 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -0.704 14.470 9.412 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -0.543 12.115 10.140 1.00 0.00 H new ATOM 0 HG3 ARG A 133 0.131 11.641 8.593 1.00 0.00 H new ATOM 0 HD2 ARG A 133 1.940 11.909 10.264 1.00 0.00 H new ATOM 0 HD3 ARG A 133 2.117 13.097 8.989 1.00 0.00 H new ATOM 0 HE ARG A 133 0.558 14.405 10.907 1.00 0.00 H new ATOM 0 HH11 ARG A 133 3.636 12.724 10.775 1.00 0.00 H new ATOM 0 HH12 ARG A 133 4.365 13.689 12.063 1.00 0.00 H new ATOM 0 HH21 ARG A 133 1.505 15.636 12.562 1.00 0.00 H new ATOM 0 HH22 ARG A 133 3.169 15.323 13.066 1.00 0.00 H new ATOM 2143 N GLN A 134 -3.214 11.742 9.269 1.00 0.00 N ATOM 2144 CA GLN A 134 -4.203 11.340 10.267 1.00 0.00 C ATOM 2145 C GLN A 134 -3.657 10.234 11.166 1.00 0.00 C ATOM 2146 O GLN A 134 -4.147 10.031 12.276 1.00 0.00 O ATOM 2147 CB GLN A 134 -5.474 10.852 9.567 1.00 0.00 C ATOM 2148 CG GLN A 134 -6.146 12.026 8.848 1.00 0.00 C ATOM 2149 CD GLN A 134 -6.944 12.863 9.845 1.00 0.00 C ATOM 2150 OE1 GLN A 134 -6.366 13.500 10.725 1.00 0.00 O ATOM 2151 NE2 GLN A 134 -8.245 12.900 9.757 1.00 0.00 N ATOM 0 H GLN A 134 -2.797 10.970 8.749 1.00 0.00 H new ATOM 0 HA GLN A 134 -4.433 12.206 10.888 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -5.229 10.066 8.852 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -6.159 10.418 10.295 1.00 0.00 H new ATOM 0 HG2 GLN A 134 -5.392 12.645 8.363 1.00 0.00 H new ATOM 0 HG3 GLN A 134 -6.805 11.653 8.064 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -8.722 12.371 9.027 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -8.785 13.458 10.418 1.00 0.00 H new ATOM 2160 N TRP A 135 -2.644 9.520 10.683 1.00 0.00 N ATOM 2161 CA TRP A 135 -2.055 8.439 11.466 1.00 0.00 C ATOM 2162 C TRP A 135 -0.823 7.868 10.769 1.00 0.00 C ATOM 2163 O TRP A 135 -0.839 7.634 9.560 1.00 0.00 O ATOM 2164 CB TRP A 135 -3.091 7.332 11.677 1.00 0.00 C ATOM 2165 CG TRP A 135 -2.447 6.157 12.343 1.00 0.00 C ATOM 2166 CD1 TRP A 135 -1.664 6.220 13.443 1.00 0.00 C ATOM 2167 CD2 TRP A 135 -2.522 4.751 11.971 1.00 0.00 C ATOM 2168 NE1 TRP A 135 -1.251 4.940 13.771 1.00 0.00 N ATOM 2169 CE2 TRP A 135 -1.755 4.000 12.892 1.00 0.00 C ATOM 2170 CE3 TRP A 135 -3.174 4.061 10.933 1.00 0.00 C ATOM 2171 CZ2 TRP A 135 -1.639 2.613 12.788 1.00 0.00 C ATOM 2172 CZ3 TRP A 135 -3.060 2.666 10.825 1.00 0.00 C ATOM 2173 CH2 TRP A 135 -2.293 1.944 11.751 1.00 0.00 C ATOM 0 H TRP A 135 -2.219 9.667 9.767 1.00 0.00 H new ATOM 0 HA TRP A 135 -1.747 8.841 12.431 1.00 0.00 H new ATOM 0 HB2 TRP A 135 -3.914 7.703 12.288 1.00 0.00 H new ATOM 0 HB3 TRP A 135 -3.516 7.031 10.719 1.00 0.00 H new ATOM 0 HD1 TRP A 135 -1.403 7.121 13.978 1.00 0.00 H new ATOM 0 HE1 TRP A 135 -0.649 4.718 14.564 1.00 0.00 H new ATOM 0 HE3 TRP A 135 -3.766 4.608 10.214 1.00 0.00 H new ATOM 0 HZ2 TRP A 135 -1.048 2.061 13.504 1.00 0.00 H new ATOM 0 HZ3 TRP A 135 -3.566 2.146 10.025 1.00 0.00 H new ATOM 0 HH2 TRP A 135 -2.208 0.871 11.662 1.00 0.00 H new ATOM 2184 N ASP A 136 0.251 7.673 11.528 1.00 0.00 N ATOM 2185 CA ASP A 136 1.493 7.162 10.954 1.00 0.00 C ATOM 2186 C ASP A 136 2.185 6.170 11.885 1.00 0.00 C ATOM 2187 O ASP A 136 1.935 6.145 13.091 1.00 0.00 O ATOM 2188 CB ASP A 136 2.439 8.333 10.674 1.00 0.00 C ATOM 2189 CG ASP A 136 2.434 9.298 11.855 1.00 0.00 C ATOM 2190 OD1 ASP A 136 1.445 9.992 12.023 1.00 0.00 O ATOM 2191 OD2 ASP A 136 3.420 9.329 12.573 1.00 0.00 O ATOM 0 H ASP A 136 0.288 7.858 12.530 1.00 0.00 H new ATOM 0 HA ASP A 136 1.244 6.639 10.031 1.00 0.00 H new ATOM 0 HB2 ASP A 136 3.449 7.962 10.500 1.00 0.00 H new ATOM 0 HB3 ASP A 136 2.130 8.853 9.767 1.00 0.00 H new ATOM 2196 N PHE A 137 3.076 5.369 11.304 1.00 0.00 N ATOM 2197 CA PHE A 137 3.842 4.381 12.059 1.00 0.00 C ATOM 2198 C PHE A 137 5.329 4.689 11.918 1.00 0.00 C ATOM 2199 O PHE A 137 5.790 5.056 10.839 1.00 0.00 O ATOM 2200 CB PHE A 137 3.548 2.972 11.534 1.00 0.00 C ATOM 2201 CG PHE A 137 3.849 1.956 12.610 1.00 0.00 C ATOM 2202 CD1 PHE A 137 2.926 1.734 13.640 1.00 0.00 C ATOM 2203 CD2 PHE A 137 5.050 1.240 12.581 1.00 0.00 C ATOM 2204 CE1 PHE A 137 3.204 0.794 14.638 1.00 0.00 C ATOM 2205 CE2 PHE A 137 5.329 0.300 13.581 1.00 0.00 C ATOM 2206 CZ PHE A 137 4.406 0.077 14.609 1.00 0.00 C ATOM 0 H PHE A 137 3.286 5.386 10.306 1.00 0.00 H new ATOM 0 HA PHE A 137 3.557 4.426 13.110 1.00 0.00 H new ATOM 0 HB2 PHE A 137 2.504 2.897 11.231 1.00 0.00 H new ATOM 0 HB3 PHE A 137 4.152 2.769 10.650 1.00 0.00 H new ATOM 0 HD1 PHE A 137 2.000 2.289 13.664 1.00 0.00 H new ATOM 0 HD2 PHE A 137 5.762 1.412 11.788 1.00 0.00 H new ATOM 0 HE1 PHE A 137 2.491 0.621 15.431 1.00 0.00 H new ATOM 0 HE2 PHE A 137 6.257 -0.253 13.559 1.00 0.00 H new ATOM 0 HZ PHE A 137 4.621 -0.648 15.380 1.00 0.00 H new ATOM 2216 N LEU A 138 6.080 4.534 13.000 1.00 0.00 N ATOM 2217 CA LEU A 138 7.513 4.806 12.953 1.00 0.00 C ATOM 2218 C LEU A 138 7.770 6.185 12.341 1.00 0.00 C ATOM 2219 O LEU A 138 8.885 6.486 11.918 1.00 0.00 O ATOM 2220 CB LEU A 138 8.221 3.724 12.125 1.00 0.00 C ATOM 2221 CG LEU A 138 9.533 3.312 12.804 1.00 0.00 C ATOM 2222 CD1 LEU A 138 10.161 2.153 12.030 1.00 0.00 C ATOM 2223 CD2 LEU A 138 10.501 4.499 12.815 1.00 0.00 C ATOM 0 H LEU A 138 5.730 4.227 13.907 1.00 0.00 H new ATOM 0 HA LEU A 138 7.908 4.795 13.969 1.00 0.00 H new ATOM 0 HB2 LEU A 138 7.571 2.856 12.016 1.00 0.00 H new ATOM 0 HB3 LEU A 138 8.424 4.098 11.122 1.00 0.00 H new ATOM 0 HG LEU A 138 9.329 3.001 13.829 1.00 0.00 H new ATOM 0 HD11 LEU A 138 11.094 1.858 12.510 1.00 0.00 H new ATOM 0 HD12 LEU A 138 9.474 1.307 12.021 1.00 0.00 H new ATOM 0 HD13 LEU A 138 10.364 2.467 11.006 1.00 0.00 H new ATOM 0 HD21 LEU A 138 11.433 4.204 13.298 1.00 0.00 H new ATOM 0 HD22 LEU A 138 10.706 4.811 11.791 1.00 0.00 H new ATOM 0 HD23 LEU A 138 10.054 5.328 13.364 1.00 0.00 H new ATOM 2235 N GLY A 139 6.734 7.018 12.300 1.00 0.00 N ATOM 2236 CA GLY A 139 6.870 8.362 11.741 1.00 0.00 C ATOM 2237 C GLY A 139 6.632 8.368 10.230 1.00 0.00 C ATOM 2238 O GLY A 139 7.074 9.278 9.530 1.00 0.00 O ATOM 0 H GLY A 139 5.800 6.791 12.643 1.00 0.00 H new ATOM 0 HA2 GLY A 139 6.159 9.032 12.225 1.00 0.00 H new ATOM 0 HA3 GLY A 139 7.867 8.747 11.955 1.00 0.00 H new ATOM 2242 N LEU A 140 5.930 7.351 9.738 1.00 0.00 N ATOM 2243 CA LEU A 140 5.632 7.239 8.310 1.00 0.00 C ATOM 2244 C LEU A 140 4.121 7.135 8.109 1.00 0.00 C ATOM 2245 O LEU A 140 3.433 6.430 8.846 1.00 0.00 O ATOM 2246 CB LEU A 140 6.320 5.990 7.734 1.00 0.00 C ATOM 2247 CG LEU A 140 7.625 6.373 7.018 1.00 0.00 C ATOM 2248 CD1 LEU A 140 7.317 7.210 5.768 1.00 0.00 C ATOM 2249 CD2 LEU A 140 8.525 7.173 7.972 1.00 0.00 C ATOM 0 H LEU A 140 5.556 6.591 10.306 1.00 0.00 H new ATOM 0 HA LEU A 140 6.004 8.123 7.793 1.00 0.00 H new ATOM 0 HB2 LEU A 140 6.533 5.283 8.536 1.00 0.00 H new ATOM 0 HB3 LEU A 140 5.650 5.488 7.036 1.00 0.00 H new ATOM 0 HG LEU A 140 8.142 5.463 6.714 1.00 0.00 H new ATOM 0 HD11 LEU A 140 8.249 7.475 5.269 1.00 0.00 H new ATOM 0 HD12 LEU A 140 6.693 6.631 5.087 1.00 0.00 H new ATOM 0 HD13 LEU A 140 6.790 8.119 6.059 1.00 0.00 H new ATOM 0 HD21 LEU A 140 9.449 7.442 7.460 1.00 0.00 H new ATOM 0 HD22 LEU A 140 8.007 8.079 8.287 1.00 0.00 H new ATOM 0 HD23 LEU A 140 8.758 6.566 8.847 1.00 0.00 H new ATOM 2261 N GLU A 141 3.612 7.841 7.103 1.00 0.00 N ATOM 2262 CA GLU A 141 2.183 7.822 6.817 1.00 0.00 C ATOM 2263 C GLU A 141 1.774 6.479 6.218 1.00 0.00 C ATOM 2264 O GLU A 141 2.546 5.848 5.498 1.00 0.00 O ATOM 2265 CB GLU A 141 1.833 8.953 5.847 1.00 0.00 C ATOM 2266 CG GLU A 141 2.353 8.613 4.449 1.00 0.00 C ATOM 2267 CD GLU A 141 2.356 9.863 3.573 1.00 0.00 C ATOM 2268 OE1 GLU A 141 2.175 10.941 4.113 1.00 0.00 O ATOM 2269 OE2 GLU A 141 2.540 9.721 2.376 1.00 0.00 O ATOM 0 H GLU A 141 4.164 8.428 6.478 1.00 0.00 H new ATOM 0 HA GLU A 141 1.639 7.966 7.750 1.00 0.00 H new ATOM 0 HB2 GLU A 141 0.753 9.099 5.818 1.00 0.00 H new ATOM 0 HB3 GLU A 141 2.272 9.889 6.191 1.00 0.00 H new ATOM 0 HG2 GLU A 141 3.361 8.204 4.517 1.00 0.00 H new ATOM 0 HG3 GLU A 141 1.727 7.844 3.997 1.00 0.00 H new ATOM 2276 N MET A 142 0.554 6.051 6.524 1.00 0.00 N ATOM 2277 CA MET A 142 0.054 4.783 6.011 1.00 0.00 C ATOM 2278 C MET A 142 0.323 4.668 4.506 1.00 0.00 C ATOM 2279 O MET A 142 0.978 3.726 4.061 1.00 0.00 O ATOM 2280 CB MET A 142 -1.451 4.653 6.300 1.00 0.00 C ATOM 2281 CG MET A 142 -1.678 3.652 7.436 1.00 0.00 C ATOM 2282 SD MET A 142 -0.877 4.256 8.944 1.00 0.00 S ATOM 2283 CE MET A 142 -0.282 2.657 9.549 1.00 0.00 C ATOM 0 H MET A 142 -0.101 6.559 7.119 1.00 0.00 H new ATOM 0 HA MET A 142 0.579 3.971 6.515 1.00 0.00 H new ATOM 0 HB2 MET A 142 -1.863 5.625 6.572 1.00 0.00 H new ATOM 0 HB3 MET A 142 -1.975 4.324 5.403 1.00 0.00 H new ATOM 0 HG2 MET A 142 -2.746 3.517 7.608 1.00 0.00 H new ATOM 0 HG3 MET A 142 -1.274 2.677 7.162 1.00 0.00 H new ATOM 0 HE1 MET A 142 -0.040 2.736 10.609 1.00 0.00 H new ATOM 0 HE2 MET A 142 -1.057 1.904 9.409 1.00 0.00 H new ATOM 0 HE3 MET A 142 0.610 2.367 8.994 1.00 0.00 H new ATOM 2293 N PRO A 143 -0.165 5.598 3.720 1.00 0.00 N ATOM 2294 CA PRO A 143 0.038 5.589 2.245 1.00 0.00 C ATOM 2295 C PRO A 143 1.437 5.116 1.848 1.00 0.00 C ATOM 2296 O PRO A 143 1.602 4.396 0.862 1.00 0.00 O ATOM 2297 CB PRO A 143 -0.178 7.049 1.852 1.00 0.00 C ATOM 2298 CG PRO A 143 -1.137 7.592 2.863 1.00 0.00 C ATOM 2299 CD PRO A 143 -0.962 6.763 4.144 1.00 0.00 C ATOM 0 HA PRO A 143 -0.638 4.897 1.743 1.00 0.00 H new ATOM 0 HB2 PRO A 143 0.761 7.602 1.864 1.00 0.00 H new ATOM 0 HB3 PRO A 143 -0.583 7.129 0.843 1.00 0.00 H new ATOM 0 HG2 PRO A 143 -0.937 8.646 3.056 1.00 0.00 H new ATOM 0 HG3 PRO A 143 -2.162 7.524 2.497 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -0.451 7.333 4.920 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -1.925 6.458 4.555 1.00 0.00 H new ATOM 2307 N GLN A 144 2.441 5.516 2.623 1.00 0.00 N ATOM 2308 CA GLN A 144 3.811 5.114 2.329 1.00 0.00 C ATOM 2309 C GLN A 144 4.013 3.643 2.677 1.00 0.00 C ATOM 2310 O GLN A 144 4.476 2.855 1.848 1.00 0.00 O ATOM 2311 CB GLN A 144 4.799 5.982 3.116 1.00 0.00 C ATOM 2312 CG GLN A 144 4.987 7.320 2.394 1.00 0.00 C ATOM 2313 CD GLN A 144 5.960 8.203 3.168 1.00 0.00 C ATOM 2314 OE1 GLN A 144 5.577 8.840 4.148 1.00 0.00 O ATOM 2315 NE2 GLN A 144 7.204 8.279 2.785 1.00 0.00 N ATOM 0 H GLN A 144 2.334 6.109 3.446 1.00 0.00 H new ATOM 0 HA GLN A 144 3.995 5.252 1.264 1.00 0.00 H new ATOM 0 HB2 GLN A 144 4.427 6.151 4.127 1.00 0.00 H new ATOM 0 HB3 GLN A 144 5.756 5.469 3.210 1.00 0.00 H new ATOM 0 HG2 GLN A 144 5.364 7.148 1.386 1.00 0.00 H new ATOM 0 HG3 GLN A 144 4.027 7.826 2.293 1.00 0.00 H new ATOM 0 HE21 GLN A 144 7.521 7.750 1.972 1.00 0.00 H new ATOM 0 HE22 GLN A 144 7.861 8.867 3.298 1.00 0.00 H new ATOM 2324 N TRP A 145 3.655 3.271 3.901 1.00 0.00 N ATOM 2325 CA TRP A 145 3.799 1.886 4.323 1.00 0.00 C ATOM 2326 C TRP A 145 3.059 0.970 3.353 1.00 0.00 C ATOM 2327 O TRP A 145 3.653 0.078 2.750 1.00 0.00 O ATOM 2328 CB TRP A 145 3.228 1.703 5.734 1.00 0.00 C ATOM 2329 CG TRP A 145 4.223 2.165 6.750 1.00 0.00 C ATOM 2330 CD1 TRP A 145 4.083 3.259 7.532 1.00 0.00 C ATOM 2331 CD2 TRP A 145 5.500 1.564 7.111 1.00 0.00 C ATOM 2332 NE1 TRP A 145 5.194 3.369 8.350 1.00 0.00 N ATOM 2333 CE2 TRP A 145 6.096 2.348 8.126 1.00 0.00 C ATOM 2334 CE3 TRP A 145 6.193 0.427 6.659 1.00 0.00 C ATOM 2335 CZ2 TRP A 145 7.335 2.014 8.676 1.00 0.00 C ATOM 2336 CZ3 TRP A 145 7.442 0.088 7.209 1.00 0.00 C ATOM 2337 CH2 TRP A 145 8.011 0.881 8.215 1.00 0.00 C ATOM 0 H TRP A 145 3.269 3.898 4.607 1.00 0.00 H new ATOM 0 HA TRP A 145 4.858 1.629 4.329 1.00 0.00 H new ATOM 0 HB2 TRP A 145 2.301 2.268 5.837 1.00 0.00 H new ATOM 0 HB3 TRP A 145 2.983 0.655 5.903 1.00 0.00 H new ATOM 0 HD1 TRP A 145 3.242 3.936 7.520 1.00 0.00 H new ATOM 0 HE1 TRP A 145 5.330 4.113 9.034 1.00 0.00 H new ATOM 0 HE3 TRP A 145 5.763 -0.190 5.884 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 7.768 2.627 9.452 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 7.965 -0.788 6.855 1.00 0.00 H new ATOM 0 HH2 TRP A 145 8.971 0.617 8.633 1.00 0.00 H new ATOM 2348 N LEU A 146 1.758 1.205 3.201 1.00 0.00 N ATOM 2349 CA LEU A 146 0.955 0.400 2.288 1.00 0.00 C ATOM 2350 C LEU A 146 1.712 0.202 0.976 1.00 0.00 C ATOM 2351 O LEU A 146 1.700 -0.885 0.402 1.00 0.00 O ATOM 2352 CB LEU A 146 -0.385 1.096 2.017 1.00 0.00 C ATOM 2353 CG LEU A 146 -1.170 0.327 0.947 1.00 0.00 C ATOM 2354 CD1 LEU A 146 -1.352 -1.130 1.382 1.00 0.00 C ATOM 2355 CD2 LEU A 146 -2.543 0.978 0.764 1.00 0.00 C ATOM 0 H LEU A 146 1.244 1.937 3.692 1.00 0.00 H new ATOM 0 HA LEU A 146 0.763 -0.572 2.742 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -0.967 1.152 2.937 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -0.212 2.120 1.687 1.00 0.00 H new ATOM 0 HG LEU A 146 -0.620 0.354 0.006 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -1.910 -1.671 0.618 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -0.375 -1.595 1.515 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -1.900 -1.163 2.323 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -3.105 0.435 0.004 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -3.088 0.950 1.708 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -2.416 2.014 0.450 1.00 0.00 H new ATOM 2367 N LEU A 147 2.392 1.254 0.522 1.00 0.00 N ATOM 2368 CA LEU A 147 3.176 1.166 -0.708 1.00 0.00 C ATOM 2369 C LEU A 147 4.156 0.003 -0.582 1.00 0.00 C ATOM 2370 O LEU A 147 4.423 -0.719 -1.542 1.00 0.00 O ATOM 2371 CB LEU A 147 3.938 2.479 -0.937 1.00 0.00 C ATOM 2372 CG LEU A 147 4.165 2.702 -2.436 1.00 0.00 C ATOM 2373 CD1 LEU A 147 4.787 4.083 -2.655 1.00 0.00 C ATOM 2374 CD2 LEU A 147 5.107 1.625 -2.989 1.00 0.00 C ATOM 0 H LEU A 147 2.416 2.165 0.980 1.00 0.00 H new ATOM 0 HA LEU A 147 2.515 0.998 -1.559 1.00 0.00 H new ATOM 0 HB2 LEU A 147 3.375 3.313 -0.519 1.00 0.00 H new ATOM 0 HB3 LEU A 147 4.895 2.448 -0.417 1.00 0.00 H new ATOM 0 HG LEU A 147 3.209 2.642 -2.956 1.00 0.00 H new ATOM 0 HD11 LEU A 147 4.949 4.244 -3.721 1.00 0.00 H new ATOM 0 HD12 LEU A 147 4.115 4.850 -2.270 1.00 0.00 H new ATOM 0 HD13 LEU A 147 5.741 4.140 -2.130 1.00 0.00 H new ATOM 0 HD21 LEU A 147 5.263 1.791 -4.055 1.00 0.00 H new ATOM 0 HD22 LEU A 147 6.064 1.677 -2.470 1.00 0.00 H new ATOM 0 HD23 LEU A 147 4.664 0.641 -2.836 1.00 0.00 H new ATOM 2386 N GLY A 148 4.670 -0.163 0.628 1.00 0.00 N ATOM 2387 CA GLY A 148 5.614 -1.243 0.899 1.00 0.00 C ATOM 2388 C GLY A 148 4.960 -2.603 0.659 1.00 0.00 C ATOM 2389 O GLY A 148 5.558 -3.501 0.061 1.00 0.00 O ATOM 0 H GLY A 148 4.454 0.428 1.431 1.00 0.00 H new ATOM 0 HA2 GLY A 148 6.490 -1.137 0.259 1.00 0.00 H new ATOM 0 HA3 GLY A 148 5.963 -1.178 1.930 1.00 0.00 H new ATOM 2393 N ILE A 149 3.727 -2.747 1.124 1.00 0.00 N ATOM 2394 CA ILE A 149 3.001 -3.999 0.951 1.00 0.00 C ATOM 2395 C ILE A 149 2.502 -4.127 -0.485 1.00 0.00 C ATOM 2396 O ILE A 149 2.290 -5.233 -0.982 1.00 0.00 O ATOM 2397 CB ILE A 149 1.815 -4.063 1.922 1.00 0.00 C ATOM 2398 CG1 ILE A 149 2.330 -4.123 3.374 1.00 0.00 C ATOM 2399 CG2 ILE A 149 0.984 -5.315 1.623 1.00 0.00 C ATOM 2400 CD1 ILE A 149 2.324 -2.720 3.990 1.00 0.00 C ATOM 0 H ILE A 149 3.211 -2.020 1.620 1.00 0.00 H new ATOM 0 HA ILE A 149 3.679 -4.825 1.165 1.00 0.00 H new ATOM 0 HB ILE A 149 1.198 -3.173 1.798 1.00 0.00 H new ATOM 0 HG12 ILE A 149 1.702 -4.791 3.964 1.00 0.00 H new ATOM 0 HG13 ILE A 149 3.339 -4.534 3.394 1.00 0.00 H new ATOM 0 HG21 ILE A 149 0.140 -5.364 2.311 1.00 0.00 H new ATOM 0 HG22 ILE A 149 0.615 -5.271 0.598 1.00 0.00 H new ATOM 0 HG23 ILE A 149 1.605 -6.202 1.747 1.00 0.00 H new ATOM 0 HD11 ILE A 149 2.689 -2.771 5.016 1.00 0.00 H new ATOM 0 HD12 ILE A 149 2.970 -2.064 3.407 1.00 0.00 H new ATOM 0 HD13 ILE A 149 1.308 -2.325 3.986 1.00 0.00 H new ATOM 2412 N PHE A 150 2.314 -2.988 -1.147 1.00 0.00 N ATOM 2413 CA PHE A 150 1.841 -2.989 -2.526 1.00 0.00 C ATOM 2414 C PHE A 150 2.877 -3.626 -3.448 1.00 0.00 C ATOM 2415 O PHE A 150 2.536 -4.419 -4.324 1.00 0.00 O ATOM 2416 CB PHE A 150 1.545 -1.554 -2.982 1.00 0.00 C ATOM 2417 CG PHE A 150 0.335 -1.550 -3.889 1.00 0.00 C ATOM 2418 CD1 PHE A 150 0.367 -2.250 -5.102 1.00 0.00 C ATOM 2419 CD2 PHE A 150 -0.821 -0.855 -3.515 1.00 0.00 C ATOM 2420 CE1 PHE A 150 -0.754 -2.253 -5.939 1.00 0.00 C ATOM 2421 CE2 PHE A 150 -1.942 -0.857 -4.354 1.00 0.00 C ATOM 2422 CZ PHE A 150 -1.909 -1.556 -5.565 1.00 0.00 C ATOM 0 H PHE A 150 2.480 -2.061 -0.754 1.00 0.00 H new ATOM 0 HA PHE A 150 0.924 -3.576 -2.576 1.00 0.00 H new ATOM 0 HB2 PHE A 150 1.365 -0.916 -2.116 1.00 0.00 H new ATOM 0 HB3 PHE A 150 2.407 -1.143 -3.507 1.00 0.00 H new ATOM 0 HD1 PHE A 150 1.258 -2.788 -5.391 1.00 0.00 H new ATOM 0 HD2 PHE A 150 -0.848 -0.317 -2.579 1.00 0.00 H new ATOM 0 HE1 PHE A 150 -0.728 -2.793 -6.874 1.00 0.00 H new ATOM 0 HE2 PHE A 150 -2.833 -0.318 -4.066 1.00 0.00 H new ATOM 0 HZ PHE A 150 -2.774 -1.558 -6.211 1.00 0.00 H new ATOM 2432 N ILE A 151 4.143 -3.271 -3.246 1.00 0.00 N ATOM 2433 CA ILE A 151 5.212 -3.818 -4.073 1.00 0.00 C ATOM 2434 C ILE A 151 5.378 -5.307 -3.804 1.00 0.00 C ATOM 2435 O ILE A 151 5.632 -6.086 -4.720 1.00 0.00 O ATOM 2436 CB ILE A 151 6.531 -3.089 -3.804 1.00 0.00 C ATOM 2437 CG1 ILE A 151 6.783 -3.012 -2.297 1.00 0.00 C ATOM 2438 CG2 ILE A 151 6.456 -1.674 -4.378 1.00 0.00 C ATOM 2439 CD1 ILE A 151 8.188 -2.464 -2.040 1.00 0.00 C ATOM 0 H ILE A 151 4.450 -2.616 -2.527 1.00 0.00 H new ATOM 0 HA ILE A 151 4.942 -3.674 -5.119 1.00 0.00 H new ATOM 0 HB ILE A 151 7.346 -3.635 -4.278 1.00 0.00 H new ATOM 0 HG12 ILE A 151 6.039 -2.370 -1.826 1.00 0.00 H new ATOM 0 HG13 ILE A 151 6.680 -4.001 -1.850 1.00 0.00 H new ATOM 0 HG21 ILE A 151 7.395 -1.154 -4.187 1.00 0.00 H new ATOM 0 HG22 ILE A 151 6.282 -1.726 -5.453 1.00 0.00 H new ATOM 0 HG23 ILE A 151 5.638 -1.132 -3.904 1.00 0.00 H new ATOM 0 HD11 ILE A 151 8.366 -2.410 -0.966 1.00 0.00 H new ATOM 0 HD12 ILE A 151 8.925 -3.124 -2.497 1.00 0.00 H new ATOM 0 HD13 ILE A 151 8.275 -1.468 -2.473 1.00 0.00 H new ATOM 2451 N ALA A 152 5.229 -5.702 -2.546 1.00 0.00 N ATOM 2452 CA ALA A 152 5.360 -7.110 -2.192 1.00 0.00 C ATOM 2453 C ALA A 152 4.310 -7.942 -2.927 1.00 0.00 C ATOM 2454 O ALA A 152 4.632 -8.958 -3.539 1.00 0.00 O ATOM 2455 CB ALA A 152 5.194 -7.290 -0.682 1.00 0.00 C ATOM 0 H ALA A 152 5.021 -5.080 -1.765 1.00 0.00 H new ATOM 0 HA ALA A 152 6.353 -7.450 -2.487 1.00 0.00 H new ATOM 0 HB1 ALA A 152 5.294 -8.345 -0.428 1.00 0.00 H new ATOM 0 HB2 ALA A 152 5.961 -6.717 -0.161 1.00 0.00 H new ATOM 0 HB3 ALA A 152 4.209 -6.936 -0.379 1.00 0.00 H new ATOM 2461 N TYR A 153 3.055 -7.511 -2.845 1.00 0.00 N ATOM 2462 CA TYR A 153 1.956 -8.232 -3.490 1.00 0.00 C ATOM 2463 C TYR A 153 2.217 -8.452 -4.984 1.00 0.00 C ATOM 2464 O TYR A 153 1.992 -9.545 -5.504 1.00 0.00 O ATOM 2465 CB TYR A 153 0.647 -7.450 -3.305 1.00 0.00 C ATOM 2466 CG TYR A 153 -0.116 -7.995 -2.116 1.00 0.00 C ATOM 2467 CD1 TYR A 153 0.536 -8.184 -0.893 1.00 0.00 C ATOM 2468 CD2 TYR A 153 -1.476 -8.310 -2.240 1.00 0.00 C ATOM 2469 CE1 TYR A 153 -0.171 -8.688 0.207 1.00 0.00 C ATOM 2470 CE2 TYR A 153 -2.182 -8.812 -1.140 1.00 0.00 C ATOM 2471 CZ TYR A 153 -1.530 -9.002 0.083 1.00 0.00 C ATOM 2472 OH TYR A 153 -2.226 -9.497 1.168 1.00 0.00 O ATOM 0 H TYR A 153 2.772 -6.670 -2.341 1.00 0.00 H new ATOM 0 HA TYR A 153 1.878 -9.211 -3.018 1.00 0.00 H new ATOM 0 HB2 TYR A 153 0.863 -6.392 -3.155 1.00 0.00 H new ATOM 0 HB3 TYR A 153 0.037 -7.526 -4.205 1.00 0.00 H new ATOM 0 HD1 TYR A 153 1.584 -7.942 -0.796 1.00 0.00 H new ATOM 0 HD2 TYR A 153 -1.980 -8.165 -3.184 1.00 0.00 H new ATOM 0 HE1 TYR A 153 0.333 -8.834 1.151 1.00 0.00 H new ATOM 0 HE2 TYR A 153 -3.230 -9.053 -1.236 1.00 0.00 H new ATOM 0 HH TYR A 153 -2.898 -10.141 0.860 1.00 0.00 H new ATOM 2482 N LEU A 154 2.675 -7.414 -5.676 1.00 0.00 N ATOM 2483 CA LEU A 154 2.935 -7.527 -7.110 1.00 0.00 C ATOM 2484 C LEU A 154 4.229 -8.298 -7.370 1.00 0.00 C ATOM 2485 O LEU A 154 4.373 -8.955 -8.400 1.00 0.00 O ATOM 2486 CB LEU A 154 2.995 -6.127 -7.751 1.00 0.00 C ATOM 2487 CG LEU A 154 4.438 -5.592 -7.768 1.00 0.00 C ATOM 2488 CD1 LEU A 154 5.216 -6.182 -8.959 1.00 0.00 C ATOM 2489 CD2 LEU A 154 4.408 -4.063 -7.887 1.00 0.00 C ATOM 0 H LEU A 154 2.872 -6.497 -5.276 1.00 0.00 H new ATOM 0 HA LEU A 154 2.117 -8.084 -7.567 1.00 0.00 H new ATOM 0 HB2 LEU A 154 2.608 -6.172 -8.769 1.00 0.00 H new ATOM 0 HB3 LEU A 154 2.355 -5.441 -7.196 1.00 0.00 H new ATOM 0 HG LEU A 154 4.936 -5.885 -6.843 1.00 0.00 H new ATOM 0 HD11 LEU A 154 6.234 -5.794 -8.957 1.00 0.00 H new ATOM 0 HD12 LEU A 154 5.242 -7.268 -8.875 1.00 0.00 H new ATOM 0 HD13 LEU A 154 4.723 -5.902 -9.890 1.00 0.00 H new ATOM 0 HD21 LEU A 154 5.428 -3.679 -7.899 1.00 0.00 H new ATOM 0 HD22 LEU A 154 3.902 -3.780 -8.810 1.00 0.00 H new ATOM 0 HD23 LEU A 154 3.872 -3.642 -7.036 1.00 0.00 H new ATOM 2501 N ILE A 155 5.166 -8.202 -6.437 1.00 0.00 N ATOM 2502 CA ILE A 155 6.450 -8.883 -6.580 1.00 0.00 C ATOM 2503 C ILE A 155 6.295 -10.396 -6.421 1.00 0.00 C ATOM 2504 O ILE A 155 6.987 -11.168 -7.086 1.00 0.00 O ATOM 2505 CB ILE A 155 7.444 -8.345 -5.543 1.00 0.00 C ATOM 2506 CG1 ILE A 155 7.980 -6.984 -6.008 1.00 0.00 C ATOM 2507 CG2 ILE A 155 8.614 -9.321 -5.382 1.00 0.00 C ATOM 2508 CD1 ILE A 155 8.590 -6.239 -4.819 1.00 0.00 C ATOM 0 H ILE A 155 5.065 -7.663 -5.577 1.00 0.00 H new ATOM 0 HA ILE A 155 6.830 -8.686 -7.583 1.00 0.00 H new ATOM 0 HB ILE A 155 6.935 -8.234 -4.586 1.00 0.00 H new ATOM 0 HG12 ILE A 155 8.730 -7.124 -6.786 1.00 0.00 H new ATOM 0 HG13 ILE A 155 7.174 -6.394 -6.445 1.00 0.00 H new ATOM 0 HG21 ILE A 155 9.315 -8.931 -4.644 1.00 0.00 H new ATOM 0 HG22 ILE A 155 8.238 -10.288 -5.049 1.00 0.00 H new ATOM 0 HG23 ILE A 155 9.123 -9.439 -6.338 1.00 0.00 H new ATOM 0 HD11 ILE A 155 8.970 -5.273 -5.151 1.00 0.00 H new ATOM 0 HD12 ILE A 155 7.827 -6.086 -4.055 1.00 0.00 H new ATOM 0 HD13 ILE A 155 9.408 -6.827 -4.402 1.00 0.00 H new ATOM 2520 N VAL A 156 5.395 -10.820 -5.538 1.00 0.00 N ATOM 2521 CA VAL A 156 5.189 -12.249 -5.318 1.00 0.00 C ATOM 2522 C VAL A 156 4.405 -12.866 -6.472 1.00 0.00 C ATOM 2523 O VAL A 156 4.654 -14.008 -6.859 1.00 0.00 O ATOM 2524 CB VAL A 156 4.451 -12.493 -3.997 1.00 0.00 C ATOM 2525 CG1 VAL A 156 5.303 -11.980 -2.835 1.00 0.00 C ATOM 2526 CG2 VAL A 156 3.109 -11.758 -4.006 1.00 0.00 C ATOM 0 H VAL A 156 4.807 -10.208 -4.973 1.00 0.00 H new ATOM 0 HA VAL A 156 6.168 -12.725 -5.266 1.00 0.00 H new ATOM 0 HB VAL A 156 4.274 -13.562 -3.879 1.00 0.00 H new ATOM 0 HG11 VAL A 156 4.779 -12.153 -1.895 1.00 0.00 H new ATOM 0 HG12 VAL A 156 6.256 -12.509 -2.822 1.00 0.00 H new ATOM 0 HG13 VAL A 156 5.482 -10.912 -2.959 1.00 0.00 H new ATOM 0 HG21 VAL A 156 2.590 -11.936 -3.064 1.00 0.00 H new ATOM 0 HG22 VAL A 156 3.281 -10.689 -4.129 1.00 0.00 H new ATOM 0 HG23 VAL A 156 2.499 -12.125 -4.831 1.00 0.00 H new ATOM 2536 N ALA A 157 3.460 -12.111 -7.023 1.00 0.00 N ATOM 2537 CA ALA A 157 2.658 -12.611 -8.133 1.00 0.00 C ATOM 2538 C ALA A 157 3.535 -12.874 -9.355 1.00 0.00 C ATOM 2539 O ALA A 157 3.475 -13.948 -9.954 1.00 0.00 O ATOM 2540 CB ALA A 157 1.574 -11.597 -8.490 1.00 0.00 C ATOM 0 H ALA A 157 3.233 -11.163 -6.724 1.00 0.00 H new ATOM 0 HA ALA A 157 2.193 -13.548 -7.827 1.00 0.00 H new ATOM 0 HB1 ALA A 157 0.979 -11.978 -9.320 1.00 0.00 H new ATOM 0 HB2 ALA A 157 0.929 -11.434 -7.626 1.00 0.00 H new ATOM 0 HB3 ALA A 157 2.039 -10.654 -8.779 1.00 0.00 H new ATOM 2546 N VAL A 158 4.344 -11.887 -9.723 1.00 0.00 N ATOM 2547 CA VAL A 158 5.223 -12.025 -10.881 1.00 0.00 C ATOM 2548 C VAL A 158 6.118 -13.252 -10.737 1.00 0.00 C ATOM 2549 O VAL A 158 6.242 -14.052 -11.663 1.00 0.00 O ATOM 2550 CB VAL A 158 6.087 -10.771 -11.036 1.00 0.00 C ATOM 2551 CG1 VAL A 158 7.154 -11.011 -12.108 1.00 0.00 C ATOM 2552 CG2 VAL A 158 5.202 -9.595 -11.456 1.00 0.00 C ATOM 0 H VAL A 158 4.411 -10.990 -9.242 1.00 0.00 H new ATOM 0 HA VAL A 158 4.603 -12.149 -11.769 1.00 0.00 H new ATOM 0 HB VAL A 158 6.572 -10.545 -10.086 1.00 0.00 H new ATOM 0 HG11 VAL A 158 7.768 -10.117 -12.217 1.00 0.00 H new ATOM 0 HG12 VAL A 158 7.784 -11.850 -11.813 1.00 0.00 H new ATOM 0 HG13 VAL A 158 6.671 -11.237 -13.058 1.00 0.00 H new ATOM 0 HG21 VAL A 158 5.814 -8.700 -11.567 1.00 0.00 H new ATOM 0 HG22 VAL A 158 4.719 -9.824 -12.406 1.00 0.00 H new ATOM 0 HG23 VAL A 158 4.442 -9.422 -10.695 1.00 0.00 H new ATOM 2562 N LEU A 159 6.741 -13.395 -9.572 1.00 0.00 N ATOM 2563 CA LEU A 159 7.623 -14.530 -9.325 1.00 0.00 C ATOM 2564 C LEU A 159 6.832 -15.836 -9.346 1.00 0.00 C ATOM 2565 O LEU A 159 7.355 -16.882 -9.730 1.00 0.00 O ATOM 2566 CB LEU A 159 8.320 -14.365 -7.965 1.00 0.00 C ATOM 2567 CG LEU A 159 9.737 -13.797 -8.154 1.00 0.00 C ATOM 2568 CD1 LEU A 159 10.630 -14.828 -8.863 1.00 0.00 C ATOM 2569 CD2 LEU A 159 9.673 -12.506 -8.984 1.00 0.00 C ATOM 0 H LEU A 159 6.653 -12.746 -8.790 1.00 0.00 H new ATOM 0 HA LEU A 159 8.375 -14.564 -10.113 1.00 0.00 H new ATOM 0 HB2 LEU A 159 7.737 -13.700 -7.329 1.00 0.00 H new ATOM 0 HB3 LEU A 159 8.372 -15.328 -7.457 1.00 0.00 H new ATOM 0 HG LEU A 159 10.162 -13.575 -7.175 1.00 0.00 H new ATOM 0 HD11 LEU A 159 11.631 -14.415 -8.992 1.00 0.00 H new ATOM 0 HD12 LEU A 159 10.686 -15.735 -8.262 1.00 0.00 H new ATOM 0 HD13 LEU A 159 10.207 -15.065 -9.839 1.00 0.00 H new ATOM 0 HD21 LEU A 159 10.679 -12.107 -9.115 1.00 0.00 H new ATOM 0 HD22 LEU A 159 9.238 -12.722 -9.960 1.00 0.00 H new ATOM 0 HD23 LEU A 159 9.056 -11.771 -8.467 1.00 0.00 H new ATOM 2581 N VAL A 160 5.573 -15.770 -8.929 1.00 0.00 N ATOM 2582 CA VAL A 160 4.725 -16.956 -8.903 1.00 0.00 C ATOM 2583 C VAL A 160 4.394 -17.415 -10.322 1.00 0.00 C ATOM 2584 O VAL A 160 4.143 -18.596 -10.559 1.00 0.00 O ATOM 2585 CB VAL A 160 3.431 -16.653 -8.135 1.00 0.00 C ATOM 2586 CG1 VAL A 160 2.365 -17.701 -8.473 1.00 0.00 C ATOM 2587 CG2 VAL A 160 3.712 -16.683 -6.626 1.00 0.00 C ATOM 0 H VAL A 160 5.119 -14.915 -8.607 1.00 0.00 H new ATOM 0 HA VAL A 160 5.265 -17.758 -8.399 1.00 0.00 H new ATOM 0 HB VAL A 160 3.069 -15.666 -8.422 1.00 0.00 H new ATOM 0 HG11 VAL A 160 1.450 -17.479 -7.924 1.00 0.00 H new ATOM 0 HG12 VAL A 160 2.160 -17.680 -9.543 1.00 0.00 H new ATOM 0 HG13 VAL A 160 2.726 -18.691 -8.192 1.00 0.00 H new ATOM 0 HG21 VAL A 160 2.793 -16.468 -6.080 1.00 0.00 H new ATOM 0 HG22 VAL A 160 4.079 -17.670 -6.344 1.00 0.00 H new ATOM 0 HG23 VAL A 160 4.464 -15.933 -6.381 1.00 0.00 H new ATOM 2597 N VAL A 161 4.397 -16.475 -11.261 1.00 0.00 N ATOM 2598 CA VAL A 161 4.099 -16.799 -12.652 1.00 0.00 C ATOM 2599 C VAL A 161 5.333 -17.374 -13.341 1.00 0.00 C ATOM 2600 O VAL A 161 5.252 -18.386 -14.040 1.00 0.00 O ATOM 2601 CB VAL A 161 3.634 -15.545 -13.393 1.00 0.00 C ATOM 2602 CG1 VAL A 161 3.403 -15.879 -14.868 1.00 0.00 C ATOM 2603 CG2 VAL A 161 2.326 -15.044 -12.776 1.00 0.00 C ATOM 0 H VAL A 161 4.601 -15.491 -11.087 1.00 0.00 H new ATOM 0 HA VAL A 161 3.304 -17.545 -12.671 1.00 0.00 H new ATOM 0 HB VAL A 161 4.397 -14.771 -13.310 1.00 0.00 H new ATOM 0 HG11 VAL A 161 3.072 -14.985 -15.396 1.00 0.00 H new ATOM 0 HG12 VAL A 161 4.333 -16.238 -15.310 1.00 0.00 H new ATOM 0 HG13 VAL A 161 2.640 -16.653 -14.951 1.00 0.00 H new ATOM 0 HG21 VAL A 161 1.994 -14.150 -13.304 1.00 0.00 H new ATOM 0 HG22 VAL A 161 1.564 -15.819 -12.860 1.00 0.00 H new ATOM 0 HG23 VAL A 161 2.487 -14.806 -11.725 1.00 0.00 H new ATOM 2613 N ILE A 162 6.473 -16.723 -13.139 1.00 0.00 N ATOM 2614 CA ILE A 162 7.722 -17.174 -13.746 1.00 0.00 C ATOM 2615 C ILE A 162 8.268 -18.398 -13.015 1.00 0.00 C ATOM 2616 O ILE A 162 9.162 -19.081 -13.514 1.00 0.00 O ATOM 2617 CB ILE A 162 8.761 -16.051 -13.705 1.00 0.00 C ATOM 2618 CG1 ILE A 162 8.166 -14.769 -14.301 1.00 0.00 C ATOM 2619 CG2 ILE A 162 9.997 -16.464 -14.509 1.00 0.00 C ATOM 2620 CD1 ILE A 162 7.596 -15.050 -15.695 1.00 0.00 C ATOM 0 H ILE A 162 6.559 -15.886 -12.563 1.00 0.00 H new ATOM 0 HA ILE A 162 7.518 -17.445 -14.782 1.00 0.00 H new ATOM 0 HB ILE A 162 9.047 -15.866 -12.669 1.00 0.00 H new ATOM 0 HG12 ILE A 162 7.381 -14.386 -13.649 1.00 0.00 H new ATOM 0 HG13 ILE A 162 8.933 -13.997 -14.362 1.00 0.00 H new ATOM 0 HG21 ILE A 162 10.735 -15.663 -14.478 1.00 0.00 H new ATOM 0 HG22 ILE A 162 10.425 -17.369 -14.078 1.00 0.00 H new ATOM 0 HG23 ILE A 162 9.711 -16.655 -15.543 1.00 0.00 H new ATOM 0 HD11 ILE A 162 7.176 -14.133 -16.108 1.00 0.00 H new ATOM 0 HD12 ILE A 162 8.391 -15.411 -16.347 1.00 0.00 H new ATOM 0 HD13 ILE A 162 6.814 -15.806 -15.623 1.00 0.00 H new ATOM 2632 N SER A 163 7.728 -18.670 -11.832 1.00 0.00 N ATOM 2633 CA SER A 163 8.177 -19.815 -11.047 1.00 0.00 C ATOM 2634 C SER A 163 7.794 -21.122 -11.736 1.00 0.00 C ATOM 2635 O SER A 163 8.300 -22.188 -11.388 1.00 0.00 O ATOM 2636 CB SER A 163 7.556 -19.771 -9.650 1.00 0.00 C ATOM 2637 OG SER A 163 6.169 -19.482 -9.761 1.00 0.00 O ATOM 0 H SER A 163 6.986 -18.120 -11.399 1.00 0.00 H new ATOM 0 HA SER A 163 9.263 -19.767 -10.961 1.00 0.00 H new ATOM 0 HB2 SER A 163 7.701 -20.726 -9.145 1.00 0.00 H new ATOM 0 HB3 SER A 163 8.050 -19.012 -9.044 1.00 0.00 H new ATOM 0 HG SER A 163 5.649 -20.252 -9.449 1.00 0.00 H new ATOM 2643 N GLN A 164 6.897 -21.031 -12.714 1.00 0.00 N ATOM 2644 CA GLN A 164 6.457 -22.216 -13.442 1.00 0.00 C ATOM 2645 C GLN A 164 7.604 -22.794 -14.274 1.00 0.00 C ATOM 2646 O GLN A 164 8.064 -23.907 -14.016 1.00 0.00 O ATOM 2647 CB GLN A 164 5.262 -21.867 -14.343 1.00 0.00 C ATOM 2648 CG GLN A 164 3.955 -22.264 -13.648 1.00 0.00 C ATOM 2649 CD GLN A 164 3.888 -21.627 -12.264 1.00 0.00 C ATOM 2650 OE1 GLN A 164 4.567 -20.539 -12.023 1.00 0.00 O flip ATOM 2651 NE2 GLN A 164 3.198 -22.134 -11.380 1.00 0.00 N flip ATOM 0 H GLN A 164 6.465 -20.159 -13.018 1.00 0.00 H new ATOM 0 HA GLN A 164 6.145 -22.972 -12.721 1.00 0.00 H new ATOM 0 HB2 GLN A 164 5.259 -20.799 -14.561 1.00 0.00 H new ATOM 0 HB3 GLN A 164 5.350 -22.387 -15.297 1.00 0.00 H new ATOM 0 HG2 GLN A 164 3.103 -21.943 -14.247 1.00 0.00 H new ATOM 0 HG3 GLN A 164 3.894 -23.349 -13.562 1.00 0.00 H new ATOM 0 HE21 GLN A 164 2.668 -22.984 -11.571 1.00 0.00 H new ATOM 0 HE22 GLN A 164 3.156 -21.704 -10.456 1.00 0.00 H new ATOM 2660 N PRO A 165 8.080 -22.066 -15.255 1.00 0.00 N ATOM 2661 CA PRO A 165 9.203 -22.529 -16.126 1.00 0.00 C ATOM 2662 C PRO A 165 10.484 -22.759 -15.327 1.00 0.00 C ATOM 2663 O PRO A 165 11.254 -23.672 -15.622 1.00 0.00 O ATOM 2664 CB PRO A 165 9.384 -21.387 -17.140 1.00 0.00 C ATOM 2665 CG PRO A 165 8.748 -20.194 -16.507 1.00 0.00 C ATOM 2666 CD PRO A 165 7.607 -20.730 -15.648 1.00 0.00 C ATOM 0 HA PRO A 165 8.985 -23.486 -16.600 1.00 0.00 H new ATOM 0 HB2 PRO A 165 10.439 -21.207 -17.346 1.00 0.00 H new ATOM 0 HB3 PRO A 165 8.910 -21.627 -18.092 1.00 0.00 H new ATOM 0 HG2 PRO A 165 9.468 -19.644 -15.900 1.00 0.00 H new ATOM 0 HG3 PRO A 165 8.375 -19.503 -17.263 1.00 0.00 H new ATOM 0 HD2 PRO A 165 7.425 -20.096 -14.780 1.00 0.00 H new ATOM 0 HD3 PRO A 165 6.673 -20.782 -16.207 1.00 0.00 H new ATOM 2674 N PHE A 166 10.700 -21.923 -14.315 1.00 0.00 N ATOM 2675 CA PHE A 166 11.888 -22.035 -13.474 1.00 0.00 C ATOM 2676 C PHE A 166 13.158 -21.981 -14.322 1.00 0.00 C ATOM 2677 O PHE A 166 13.159 -22.388 -15.484 1.00 0.00 O ATOM 2678 CB PHE A 166 11.832 -23.340 -12.655 1.00 0.00 C ATOM 2679 CG PHE A 166 12.743 -24.391 -13.256 1.00 0.00 C ATOM 2680 CD1 PHE A 166 14.128 -24.315 -13.056 1.00 0.00 C ATOM 2681 CD2 PHE A 166 12.202 -25.442 -14.008 1.00 0.00 C ATOM 2682 CE1 PHE A 166 14.969 -25.289 -13.610 1.00 0.00 C ATOM 2683 CE2 PHE A 166 13.044 -26.415 -14.560 1.00 0.00 C ATOM 2684 CZ PHE A 166 14.427 -26.338 -14.361 1.00 0.00 C ATOM 0 H PHE A 166 10.070 -21.163 -14.058 1.00 0.00 H new ATOM 0 HA PHE A 166 11.910 -21.191 -12.785 1.00 0.00 H new ATOM 0 HB2 PHE A 166 12.128 -23.141 -11.625 1.00 0.00 H new ATOM 0 HB3 PHE A 166 10.808 -23.713 -12.626 1.00 0.00 H new ATOM 0 HD1 PHE A 166 14.547 -23.506 -12.475 1.00 0.00 H new ATOM 0 HD2 PHE A 166 11.135 -25.502 -14.162 1.00 0.00 H new ATOM 0 HE1 PHE A 166 16.037 -25.230 -13.457 1.00 0.00 H new ATOM 0 HE2 PHE A 166 12.626 -27.225 -15.139 1.00 0.00 H new ATOM 0 HZ PHE A 166 15.076 -27.088 -14.787 1.00 0.00 H new ATOM 2694 N LYS A 167 14.236 -21.474 -13.732 1.00 0.00 N ATOM 2695 CA LYS A 167 15.506 -21.370 -14.443 1.00 0.00 C ATOM 2696 C LYS A 167 16.599 -20.853 -13.515 1.00 0.00 C ATOM 2697 O LYS A 167 17.760 -20.740 -13.910 1.00 0.00 O ATOM 2698 CB LYS A 167 15.360 -20.425 -15.638 1.00 0.00 C ATOM 2699 CG LYS A 167 14.731 -19.110 -15.175 1.00 0.00 C ATOM 2700 CD LYS A 167 14.525 -18.190 -16.381 1.00 0.00 C ATOM 2701 CE LYS A 167 13.796 -16.921 -15.936 1.00 0.00 C ATOM 2702 NZ LYS A 167 13.295 -16.190 -17.135 1.00 0.00 N ATOM 0 H LYS A 167 14.257 -21.131 -12.772 1.00 0.00 H new ATOM 0 HA LYS A 167 15.785 -22.363 -14.797 1.00 0.00 H new ATOM 0 HB2 LYS A 167 16.335 -20.236 -16.087 1.00 0.00 H new ATOM 0 HB3 LYS A 167 14.740 -20.886 -16.406 1.00 0.00 H new ATOM 0 HG2 LYS A 167 13.777 -19.304 -14.685 1.00 0.00 H new ATOM 0 HG3 LYS A 167 15.374 -18.626 -14.440 1.00 0.00 H new ATOM 0 HD2 LYS A 167 15.487 -17.933 -16.824 1.00 0.00 H new ATOM 0 HD3 LYS A 167 13.947 -18.704 -17.149 1.00 0.00 H new ATOM 0 HE2 LYS A 167 12.965 -17.178 -15.279 1.00 0.00 H new ATOM 0 HE3 LYS A 167 14.470 -16.284 -15.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 167 12.799 -15.327 -16.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 167 14.097 -15.933 -17.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 167 12.639 -16.799 -17.664 1.00 0.00 H new ATOM 2716 N ALA A 168 16.222 -20.538 -12.280 1.00 0.00 N ATOM 2717 CA ALA A 168 17.182 -20.032 -11.305 1.00 0.00 C ATOM 2718 C ALA A 168 17.808 -18.730 -11.794 1.00 0.00 C ATOM 2719 O ALA A 168 18.455 -18.695 -12.841 1.00 0.00 O ATOM 2720 CB ALA A 168 18.278 -21.072 -11.064 1.00 0.00 C ATOM 0 H ALA A 168 15.267 -20.623 -11.932 1.00 0.00 H new ATOM 0 HA ALA A 168 16.655 -19.838 -10.371 1.00 0.00 H new ATOM 0 HB1 ALA A 168 18.991 -20.687 -10.335 1.00 0.00 H new ATOM 0 HB2 ALA A 168 17.831 -21.991 -10.684 1.00 0.00 H new ATOM 0 HB3 ALA A 168 18.794 -21.280 -12.001 1.00 0.00 H new ATOM 2726 N LYS A 169 17.609 -17.660 -11.030 1.00 0.00 N ATOM 2727 CA LYS A 169 18.158 -16.359 -11.396 1.00 0.00 C ATOM 2728 C LYS A 169 19.657 -16.461 -11.661 1.00 0.00 C ATOM 2729 O LYS A 169 20.231 -17.549 -11.632 1.00 0.00 O ATOM 2730 CB LYS A 169 17.908 -15.352 -10.271 1.00 0.00 C ATOM 2731 CG LYS A 169 16.409 -15.071 -10.158 1.00 0.00 C ATOM 2732 CD LYS A 169 16.171 -14.007 -9.083 1.00 0.00 C ATOM 2733 CE LYS A 169 14.746 -13.464 -9.208 1.00 0.00 C ATOM 2734 NZ LYS A 169 13.810 -14.584 -9.511 1.00 0.00 N ATOM 0 H LYS A 169 17.076 -17.667 -10.160 1.00 0.00 H new ATOM 0 HA LYS A 169 17.662 -16.022 -12.306 1.00 0.00 H new ATOM 0 HB2 LYS A 169 18.287 -15.744 -9.327 1.00 0.00 H new ATOM 0 HB3 LYS A 169 18.448 -14.426 -10.471 1.00 0.00 H new ATOM 0 HG2 LYS A 169 16.019 -14.729 -11.117 1.00 0.00 H new ATOM 0 HG3 LYS A 169 15.874 -15.986 -9.904 1.00 0.00 H new ATOM 0 HD2 LYS A 169 16.322 -14.436 -8.092 1.00 0.00 H new ATOM 0 HD3 LYS A 169 16.891 -13.196 -9.193 1.00 0.00 H new ATOM 0 HE2 LYS A 169 14.451 -12.971 -8.282 1.00 0.00 H new ATOM 0 HE3 LYS A 169 14.700 -12.714 -9.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 12.987 -14.218 -10.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 14.297 -15.296 -10.092 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 13.492 -15.021 -8.622 1.00 0.00 H new ATOM 2748 N LYS A 170 20.284 -15.317 -11.918 1.00 0.00 N ATOM 2749 CA LYS A 170 21.718 -15.281 -12.186 1.00 0.00 C ATOM 2750 C LYS A 170 22.279 -13.894 -11.874 1.00 0.00 C ATOM 2751 O LYS A 170 21.527 -12.930 -11.734 1.00 0.00 O ATOM 2752 CB LYS A 170 21.986 -15.637 -13.658 1.00 0.00 C ATOM 2753 CG LYS A 170 22.531 -17.065 -13.758 1.00 0.00 C ATOM 2754 CD LYS A 170 22.807 -17.405 -15.225 1.00 0.00 C ATOM 2755 CE LYS A 170 23.680 -18.659 -15.306 1.00 0.00 C ATOM 2756 NZ LYS A 170 25.087 -18.307 -14.961 1.00 0.00 N ATOM 0 H LYS A 170 19.825 -14.407 -11.946 1.00 0.00 H new ATOM 0 HA LYS A 170 22.213 -16.012 -11.547 1.00 0.00 H new ATOM 0 HB2 LYS A 170 21.066 -15.548 -14.236 1.00 0.00 H new ATOM 0 HB3 LYS A 170 22.701 -14.935 -14.087 1.00 0.00 H new ATOM 0 HG2 LYS A 170 23.446 -17.158 -13.174 1.00 0.00 H new ATOM 0 HG3 LYS A 170 21.813 -17.770 -13.339 1.00 0.00 H new ATOM 0 HD2 LYS A 170 21.868 -17.569 -15.754 1.00 0.00 H new ATOM 0 HD3 LYS A 170 23.307 -16.569 -15.715 1.00 0.00 H new ATOM 0 HE2 LYS A 170 23.306 -19.421 -14.622 1.00 0.00 H new ATOM 0 HE3 LYS A 170 23.635 -19.082 -16.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 170 25.725 -19.054 -15.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 170 25.340 -17.405 -15.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 170 25.179 -18.216 -13.929 1.00 0.00 H new ATOM 2770 N ARG A 171 23.600 -13.806 -11.765 1.00 0.00 N ATOM 2771 CA ARG A 171 24.250 -12.534 -11.468 1.00 0.00 C ATOM 2772 C ARG A 171 23.974 -12.118 -10.024 1.00 0.00 C ATOM 2773 O ARG A 171 22.820 -12.009 -9.611 1.00 0.00 O ATOM 2774 CB ARG A 171 23.740 -11.448 -12.425 1.00 0.00 C ATOM 2775 CG ARG A 171 24.799 -10.346 -12.583 1.00 0.00 C ATOM 2776 CD ARG A 171 25.678 -10.640 -13.802 1.00 0.00 C ATOM 2777 NE ARG A 171 26.189 -12.007 -13.742 1.00 0.00 N ATOM 2778 CZ ARG A 171 27.354 -12.285 -13.161 1.00 0.00 C ATOM 2779 NH1 ARG A 171 28.062 -11.331 -12.622 1.00 0.00 N ATOM 2780 NH2 ARG A 171 27.786 -13.515 -13.127 1.00 0.00 N ATOM 0 H ARG A 171 24.238 -14.594 -11.877 1.00 0.00 H new ATOM 0 HA ARG A 171 25.325 -12.655 -11.600 1.00 0.00 H new ATOM 0 HB2 ARG A 171 23.512 -11.886 -13.397 1.00 0.00 H new ATOM 0 HB3 ARG A 171 22.813 -11.021 -12.042 1.00 0.00 H new ATOM 0 HG2 ARG A 171 24.314 -9.377 -12.699 1.00 0.00 H new ATOM 0 HG3 ARG A 171 25.414 -10.289 -11.685 1.00 0.00 H new ATOM 0 HD2 ARG A 171 25.102 -10.500 -14.716 1.00 0.00 H new ATOM 0 HD3 ARG A 171 26.509 -9.935 -13.838 1.00 0.00 H new ATOM 0 HE ARG A 171 25.642 -12.764 -14.153 1.00 0.00 H new ATOM 0 HH11 ARG A 171 27.723 -10.369 -12.645 1.00 0.00 H new ATOM 0 HH12 ARG A 171 28.954 -11.547 -12.177 1.00 0.00 H new ATOM 0 HH21 ARG A 171 27.231 -14.262 -13.545 1.00 0.00 H new ATOM 0 HH22 ARG A 171 28.678 -13.730 -12.682 1.00 0.00 H new ATOM 2794 N ASP A 172 25.040 -11.886 -9.265 1.00 0.00 N ATOM 2795 CA ASP A 172 24.900 -11.482 -7.872 1.00 0.00 C ATOM 2796 C ASP A 172 24.594 -9.991 -7.773 1.00 0.00 C ATOM 2797 O ASP A 172 23.833 -9.450 -8.575 1.00 0.00 O ATOM 2798 CB ASP A 172 26.186 -11.794 -7.103 1.00 0.00 C ATOM 2799 CG ASP A 172 26.709 -13.171 -7.496 1.00 0.00 C ATOM 2800 OD1 ASP A 172 26.920 -13.389 -8.678 1.00 0.00 O ATOM 2801 OD2 ASP A 172 26.890 -13.990 -6.609 1.00 0.00 O ATOM 0 H ASP A 172 26.004 -11.970 -9.589 1.00 0.00 H new ATOM 0 HA ASP A 172 24.072 -12.040 -7.435 1.00 0.00 H new ATOM 0 HB2 ASP A 172 26.939 -11.036 -7.316 1.00 0.00 H new ATOM 0 HB3 ASP A 172 25.995 -11.761 -6.030 1.00 0.00 H new ATOM 2806 N LEU A 173 25.191 -9.332 -6.784 1.00 0.00 N ATOM 2807 CA LEU A 173 24.978 -7.901 -6.587 1.00 0.00 C ATOM 2808 C LEU A 173 26.174 -7.106 -7.102 1.00 0.00 C ATOM 2809 O LEU A 173 26.031 -6.240 -7.964 1.00 0.00 O ATOM 2810 CB LEU A 173 24.767 -7.601 -5.099 1.00 0.00 C ATOM 2811 CG LEU A 173 23.670 -8.516 -4.531 1.00 0.00 C ATOM 2812 CD1 LEU A 173 24.305 -9.760 -3.902 1.00 0.00 C ATOM 2813 CD2 LEU A 173 22.878 -7.760 -3.458 1.00 0.00 C ATOM 0 H LEU A 173 25.823 -9.763 -6.109 1.00 0.00 H new ATOM 0 HA LEU A 173 24.090 -7.606 -7.146 1.00 0.00 H new ATOM 0 HB2 LEU A 173 25.698 -7.753 -4.553 1.00 0.00 H new ATOM 0 HB3 LEU A 173 24.486 -6.556 -4.966 1.00 0.00 H new ATOM 0 HG LEU A 173 23.003 -8.817 -5.339 1.00 0.00 H new ATOM 0 HD11 LEU A 173 23.523 -10.405 -3.501 1.00 0.00 H new ATOM 0 HD12 LEU A 173 24.870 -10.303 -4.660 1.00 0.00 H new ATOM 0 HD13 LEU A 173 24.975 -9.459 -3.097 1.00 0.00 H new ATOM 0 HD21 LEU A 173 22.100 -8.409 -3.055 1.00 0.00 H new ATOM 0 HD22 LEU A 173 23.550 -7.458 -2.655 1.00 0.00 H new ATOM 0 HD23 LEU A 173 22.420 -6.875 -3.900 1.00 0.00 H new ATOM 2825 N PHE A 174 27.352 -7.408 -6.566 1.00 0.00 N ATOM 2826 CA PHE A 174 28.568 -6.714 -6.977 1.00 0.00 C ATOM 2827 C PHE A 174 28.394 -5.205 -6.835 1.00 0.00 C ATOM 2828 O PHE A 174 27.671 -4.578 -7.610 1.00 0.00 O ATOM 2829 CB PHE A 174 28.900 -7.058 -8.431 1.00 0.00 C ATOM 2830 CG PHE A 174 29.401 -8.480 -8.513 1.00 0.00 C ATOM 2831 CD1 PHE A 174 30.731 -8.774 -8.184 1.00 0.00 C ATOM 2832 CD2 PHE A 174 28.538 -9.504 -8.919 1.00 0.00 C ATOM 2833 CE1 PHE A 174 31.195 -10.092 -8.259 1.00 0.00 C ATOM 2834 CE2 PHE A 174 29.003 -10.823 -8.994 1.00 0.00 C ATOM 2835 CZ PHE A 174 30.332 -11.117 -8.665 1.00 0.00 C ATOM 0 H PHE A 174 27.491 -8.123 -5.852 1.00 0.00 H new ATOM 0 HA PHE A 174 29.386 -7.037 -6.333 1.00 0.00 H new ATOM 0 HB2 PHE A 174 28.015 -6.937 -9.055 1.00 0.00 H new ATOM 0 HB3 PHE A 174 29.656 -6.373 -8.814 1.00 0.00 H new ATOM 0 HD1 PHE A 174 31.398 -7.984 -7.873 1.00 0.00 H new ATOM 0 HD2 PHE A 174 27.513 -9.277 -9.174 1.00 0.00 H new ATOM 0 HE1 PHE A 174 32.220 -10.319 -8.004 1.00 0.00 H new ATOM 0 HE2 PHE A 174 28.336 -11.614 -9.306 1.00 0.00 H new ATOM 0 HZ PHE A 174 30.691 -12.134 -8.724 1.00 0.00 H new ATOM 2845 N GLY A 175 29.060 -4.628 -5.840 1.00 0.00 N ATOM 2846 CA GLY A 175 28.973 -3.189 -5.603 1.00 0.00 C ATOM 2847 C GLY A 175 30.324 -2.626 -5.176 1.00 0.00 C ATOM 2848 O GLY A 175 31.058 -3.257 -4.416 1.00 0.00 O ATOM 0 H GLY A 175 29.663 -5.130 -5.188 1.00 0.00 H new ATOM 0 HA2 GLY A 175 28.635 -2.687 -6.509 1.00 0.00 H new ATOM 0 HA3 GLY A 175 28.230 -2.988 -4.831 1.00 0.00 H new ATOM 2852 N ARG A 176 30.647 -1.435 -5.672 1.00 0.00 N ATOM 2853 CA ARG A 176 31.914 -0.797 -5.338 1.00 0.00 C ATOM 2854 C ARG A 176 31.813 -0.076 -3.993 1.00 0.00 C ATOM 2855 O ARG A 176 32.608 -0.320 -3.086 1.00 0.00 O ATOM 2856 CB ARG A 176 32.298 0.202 -6.438 1.00 0.00 C ATOM 2857 CG ARG A 176 33.824 0.261 -6.590 1.00 0.00 C ATOM 2858 CD ARG A 176 34.457 0.809 -5.306 1.00 0.00 C ATOM 2859 NE ARG A 176 34.662 -0.269 -4.343 1.00 0.00 N ATOM 2860 CZ ARG A 176 35.579 -0.170 -3.385 1.00 0.00 C ATOM 2861 NH1 ARG A 176 36.312 0.905 -3.291 1.00 0.00 N ATOM 2862 NH2 ARG A 176 35.744 -1.149 -2.538 1.00 0.00 N ATOM 0 H ARG A 176 30.053 -0.896 -6.302 1.00 0.00 H new ATOM 0 HA ARG A 176 32.683 -1.566 -5.263 1.00 0.00 H new ATOM 0 HB2 ARG A 176 31.842 -0.093 -7.383 1.00 0.00 H new ATOM 0 HB3 ARG A 176 31.911 1.191 -6.193 1.00 0.00 H new ATOM 0 HG2 ARG A 176 34.215 -0.734 -6.803 1.00 0.00 H new ATOM 0 HG3 ARG A 176 34.089 0.895 -7.436 1.00 0.00 H new ATOM 0 HD2 ARG A 176 35.410 1.286 -5.537 1.00 0.00 H new ATOM 0 HD3 ARG A 176 33.814 1.575 -4.873 1.00 0.00 H new ATOM 0 HE ARG A 176 34.092 -1.113 -4.406 1.00 0.00 H new ATOM 0 HH11 ARG A 176 36.182 1.670 -3.953 1.00 0.00 H new ATOM 0 HH12 ARG A 176 37.015 0.980 -2.556 1.00 0.00 H new ATOM 0 HH21 ARG A 176 35.170 -1.989 -2.611 1.00 0.00 H new ATOM 0 HH22 ARG A 176 36.447 -1.074 -1.803 1.00 0.00 H new ATOM 2876 N GLY A 177 30.831 0.813 -3.874 1.00 0.00 N ATOM 2877 CA GLY A 177 30.640 1.562 -2.636 1.00 0.00 C ATOM 2878 C GLY A 177 31.864 2.415 -2.323 1.00 0.00 C ATOM 2879 O GLY A 177 32.658 2.079 -1.444 1.00 0.00 O ATOM 0 H GLY A 177 30.161 1.031 -4.612 1.00 0.00 H new ATOM 0 HA2 GLY A 177 29.760 2.199 -2.724 1.00 0.00 H new ATOM 0 HA3 GLY A 177 30.453 0.872 -1.814 1.00 0.00 H new ATOM 2883 N HIS A 178 32.012 3.517 -3.050 1.00 0.00 N ATOM 2884 CA HIS A 178 33.147 4.411 -2.845 1.00 0.00 C ATOM 2885 C HIS A 178 32.885 5.360 -1.679 1.00 0.00 C ATOM 2886 O HIS A 178 31.812 5.955 -1.580 1.00 0.00 O ATOM 2887 CB HIS A 178 33.406 5.223 -4.115 1.00 0.00 C ATOM 2888 CG HIS A 178 34.591 6.124 -3.901 1.00 0.00 C ATOM 2889 ND1 HIS A 178 34.625 7.425 -4.375 1.00 0.00 N ATOM 2890 CD2 HIS A 178 35.792 5.923 -3.267 1.00 0.00 C ATOM 2891 CE1 HIS A 178 35.810 7.954 -4.023 1.00 0.00 C ATOM 2892 NE2 HIS A 178 36.560 7.082 -3.344 1.00 0.00 N ATOM 0 H HIS A 178 31.366 3.812 -3.782 1.00 0.00 H new ATOM 0 HA HIS A 178 34.023 3.805 -2.613 1.00 0.00 H new ATOM 0 HB2 HIS A 178 33.591 4.554 -4.956 1.00 0.00 H new ATOM 0 HB3 HIS A 178 32.526 5.815 -4.367 1.00 0.00 H new ATOM 0 HD2 HIS A 178 36.095 5.006 -2.783 1.00 0.00 H new ATOM 0 HE1 HIS A 178 36.118 8.962 -4.260 1.00 0.00 H new ATOM 0 HE2 HIS A 178 37.494 7.233 -2.964 1.00 0.00 H new ATOM 2901 N HIS A 179 33.874 5.497 -0.801 1.00 0.00 N ATOM 2902 CA HIS A 179 33.744 6.379 0.353 1.00 0.00 C ATOM 2903 C HIS A 179 34.095 7.814 -0.031 1.00 0.00 C ATOM 2904 O HIS A 179 34.322 8.113 -1.203 1.00 0.00 O ATOM 2905 CB HIS A 179 34.668 5.906 1.477 1.00 0.00 C ATOM 2906 CG HIS A 179 36.004 5.524 0.901 1.00 0.00 C ATOM 2907 ND1 HIS A 179 36.429 4.396 0.242 1.00 0.00 N flip ATOM 2908 CD2 HIS A 179 37.107 6.361 0.968 1.00 0.00 C flip ATOM 2909 CE1 HIS A 179 37.773 4.529 -0.094 1.00 0.00 C flip ATOM 2910 NE2 HIS A 179 38.132 5.730 0.367 1.00 0.00 N flip ATOM 0 H HIS A 179 34.769 5.012 -0.866 1.00 0.00 H new ATOM 0 HA HIS A 179 32.711 6.350 0.698 1.00 0.00 H new ATOM 0 HB2 HIS A 179 34.792 6.696 2.217 1.00 0.00 H new ATOM 0 HB3 HIS A 179 34.225 5.054 1.992 1.00 0.00 H new ATOM 0 HD2 HIS A 179 37.138 7.341 1.420 1.00 0.00 H new ATOM 0 HE1 HIS A 179 38.393 3.814 -0.616 1.00 0.00 H new ATOM 0 HE2 HIS A 179 39.069 6.121 0.275 1.00 0.00 H new ATOM 2919 N HIS A 180 34.136 8.697 0.964 1.00 0.00 N ATOM 2920 CA HIS A 180 34.461 10.101 0.722 1.00 0.00 C ATOM 2921 C HIS A 180 35.703 10.507 1.510 1.00 0.00 C ATOM 2922 O HIS A 180 36.200 9.746 2.341 1.00 0.00 O ATOM 2923 CB HIS A 180 33.282 10.985 1.136 1.00 0.00 C ATOM 2924 CG HIS A 180 32.145 10.788 0.172 1.00 0.00 C ATOM 2925 ND1 HIS A 180 30.910 10.308 0.576 1.00 0.00 N ATOM 2926 CD2 HIS A 180 32.040 11.001 -1.180 1.00 0.00 C ATOM 2927 CE1 HIS A 180 30.121 10.248 -0.514 1.00 0.00 C ATOM 2928 NE2 HIS A 180 30.762 10.660 -1.611 1.00 0.00 N ATOM 0 H HIS A 180 33.949 8.467 1.940 1.00 0.00 H new ATOM 0 HA HIS A 180 34.661 10.232 -0.342 1.00 0.00 H new ATOM 0 HB2 HIS A 180 32.963 10.734 2.148 1.00 0.00 H new ATOM 0 HB3 HIS A 180 33.585 12.032 1.148 1.00 0.00 H new ATOM 0 HD2 HIS A 180 32.830 11.377 -1.813 1.00 0.00 H new ATOM 0 HE1 HIS A 180 29.096 9.908 -0.502 1.00 0.00 H new ATOM 0 HE2 HIS A 180 30.394 10.713 -2.561 1.00 0.00 H new ATOM 2937 N HIS A 181 36.198 11.711 1.243 1.00 0.00 N ATOM 2938 CA HIS A 181 37.382 12.209 1.934 1.00 0.00 C ATOM 2939 C HIS A 181 37.134 12.282 3.437 1.00 0.00 C ATOM 2940 O HIS A 181 36.038 11.977 3.910 1.00 0.00 O ATOM 2941 CB HIS A 181 37.750 13.597 1.405 1.00 0.00 C ATOM 2942 CG HIS A 181 36.500 14.416 1.234 1.00 0.00 C ATOM 2943 ND1 HIS A 181 36.014 15.242 2.235 1.00 0.00 N ATOM 2944 CD2 HIS A 181 35.626 14.546 0.182 1.00 0.00 C ATOM 2945 CE1 HIS A 181 34.895 15.828 1.769 1.00 0.00 C ATOM 2946 NE2 HIS A 181 34.614 15.438 0.523 1.00 0.00 N ATOM 0 H HIS A 181 35.802 12.355 0.559 1.00 0.00 H new ATOM 0 HA HIS A 181 38.206 11.520 1.748 1.00 0.00 H new ATOM 0 HB2 HIS A 181 38.431 14.093 2.097 1.00 0.00 H new ATOM 0 HB3 HIS A 181 38.273 13.508 0.453 1.00 0.00 H new ATOM 0 HD1 HIS A 181 36.428 15.381 3.157 1.00 0.00 H new ATOM 0 HD2 HIS A 181 35.711 14.034 -0.765 1.00 0.00 H new ATOM 0 HE1 HIS A 181 34.297 16.528 2.334 1.00 0.00 H new ATOM 2955 N HIS A 182 38.157 12.686 4.182 1.00 0.00 N ATOM 2956 CA HIS A 182 38.037 12.795 5.632 1.00 0.00 C ATOM 2957 C HIS A 182 37.226 14.028 6.013 1.00 0.00 C ATOM 2958 O HIS A 182 36.067 13.920 6.417 1.00 0.00 O ATOM 2959 CB HIS A 182 39.428 12.879 6.265 1.00 0.00 C ATOM 2960 CG HIS A 182 40.338 11.876 5.610 1.00 0.00 C ATOM 2961 ND1 HIS A 182 40.009 10.534 5.508 1.00 0.00 N ATOM 2962 CD2 HIS A 182 41.572 12.005 5.019 1.00 0.00 C ATOM 2963 CE1 HIS A 182 41.024 9.914 4.878 1.00 0.00 C ATOM 2964 NE2 HIS A 182 42.003 10.766 4.558 1.00 0.00 N ATOM 0 H HIS A 182 39.072 12.942 3.810 1.00 0.00 H new ATOM 0 HA HIS A 182 37.522 11.909 6.003 1.00 0.00 H new ATOM 0 HB2 HIS A 182 39.833 13.884 6.148 1.00 0.00 H new ATOM 0 HB3 HIS A 182 39.365 12.684 7.336 1.00 0.00 H new ATOM 0 HD2 HIS A 182 42.124 12.929 4.927 1.00 0.00 H new ATOM 0 HE1 HIS A 182 41.045 8.857 4.658 1.00 0.00 H new ATOM 0 HE2 HIS A 182 42.878 10.553 4.079 1.00 0.00 H new ATOM 2973 N HIS A 183 37.840 15.200 5.883 1.00 0.00 N ATOM 2974 CA HIS A 183 37.163 16.448 6.219 1.00 0.00 C ATOM 2975 C HIS A 183 35.951 16.659 5.317 1.00 0.00 C ATOM 2976 O HIS A 183 34.843 16.497 5.800 1.00 0.00 O ATOM 2977 CB HIS A 183 38.128 17.623 6.062 1.00 0.00 C ATOM 2978 CG HIS A 183 39.299 17.438 6.989 1.00 0.00 C ATOM 2979 ND1 HIS A 183 40.597 17.305 6.522 1.00 0.00 N ATOM 2980 CD2 HIS A 183 39.383 17.361 8.357 1.00 0.00 C ATOM 2981 CE1 HIS A 183 41.399 17.157 7.592 1.00 0.00 C ATOM 2982 NE2 HIS A 183 40.709 17.183 8.736 1.00 0.00 N ATOM 2983 OXT HIS A 183 36.150 16.979 4.156 1.00 0.00 O ATOM 0 H HIS A 183 38.798 15.312 5.550 1.00 0.00 H new ATOM 0 HA HIS A 183 36.826 16.390 7.254 1.00 0.00 H new ATOM 0 HB2 HIS A 183 38.474 17.688 5.030 1.00 0.00 H new ATOM 0 HB3 HIS A 183 37.617 18.559 6.286 1.00 0.00 H new ATOM 0 HD2 HIS A 183 38.546 17.428 9.036 1.00 0.00 H new ATOM 0 HE1 HIS A 183 42.470 17.032 7.533 1.00 0.00 H new ATOM 0 HE2 HIS A 183 41.076 17.092 9.683 1.00 0.00 H new TER 2992 HIS A 183 HETATM 2993 C1 UQ2 A 201 -8.439 4.954 6.219 1.00 20.00 C HETATM 2994 C2 UQ2 A 201 -8.181 5.988 7.240 1.00 20.00 C HETATM 2995 C3 UQ2 A 201 -7.090 6.768 7.146 1.00 20.00 C HETATM 2996 C4 UQ2 A 201 -6.149 6.592 6.023 1.00 20.00 C HETATM 2997 C5 UQ2 A 201 -6.402 5.560 4.997 1.00 20.00 C HETATM 2998 C6 UQ2 A 201 -7.502 4.772 5.089 1.00 20.00 C HETATM 2999 CM2 UQ2 A 201 -8.404 5.638 9.457 1.00 20.00 C HETATM 3000 CM3 UQ2 A 201 -7.820 8.766 7.898 1.00 20.00 C HETATM 3001 CM5 UQ2 A 201 -5.423 5.397 3.858 1.00 20.00 C HETATM 3002 C7 UQ2 A 201 -7.789 3.703 4.059 1.00 20.00 C HETATM 3003 C8 UQ2 A 201 -7.537 2.345 4.672 1.00 20.00 C HETATM 3004 C9 UQ2 A 201 -6.956 1.386 3.983 1.00 20.00 C HETATM 3005 C10 UQ2 A 201 -6.523 1.620 2.554 1.00 20.00 C HETATM 3006 C11 UQ2 A 201 -6.722 0.039 4.630 1.00 20.00 C HETATM 3007 C12 UQ2 A 201 -5.756 0.182 5.813 1.00 20.00 C HETATM 3008 C13 UQ2 A 201 -4.347 -0.081 5.348 1.00 20.00 C HETATM 3009 C14 UQ2 A 201 -3.338 0.097 6.169 1.00 20.00 C HETATM 3010 C15 UQ2 A 201 -1.928 -0.166 5.701 1.00 20.00 C HETATM 3011 C16 UQ2 A 201 -3.585 0.559 7.582 1.00 20.00 C HETATM 3012 O1 UQ2 A 201 -9.427 4.250 6.305 1.00 20.00 O HETATM 3013 O2 UQ2 A 201 -9.046 6.150 8.278 1.00 20.00 O HETATM 3014 O3 UQ2 A 201 -6.854 7.720 8.089 1.00 20.00 O HETATM 3015 O4 UQ2 A 201 -5.165 7.300 5.941 1.00 20.00 O HETATM 0 H5M3 UQ2 A 201 -5.361 6.329 3.296 1.00 20.00 H new HETATM 0 H5M2 UQ2 A 201 -4.440 5.147 4.256 1.00 20.00 H new HETATM 0 H5M1 UQ2 A 201 -5.761 4.597 3.199 1.00 20.00 H new HETATM 0 H3M3 UQ2 A 201 -7.709 9.185 6.898 1.00 20.00 H new HETATM 0 H3M2 UQ2 A 201 -8.825 8.359 8.012 1.00 20.00 H new HETATM 0 H3M1 UQ2 A 201 -7.660 9.549 8.639 1.00 20.00 H new HETATM 0 H2M3 UQ2 A 201 -8.172 4.582 9.316 1.00 20.00 H new HETATM 0 H2M2 UQ2 A 201 -7.483 6.191 9.639 1.00 20.00 H new HETATM 0 H2M1 UQ2 A 201 -9.070 5.751 10.312 1.00 20.00 H new HETATM 0 H163 UQ2 A 201 -4.084 1.528 7.566 1.00 20.00 H new HETATM 0 H162 UQ2 A 201 -4.216 -0.165 8.097 1.00 20.00 H new HETATM 0 H161 UQ2 A 201 -2.634 0.649 8.107 1.00 20.00 H new HETATM 0 H153 UQ2 A 201 -1.835 -1.207 5.393 1.00 20.00 H new HETATM 0 H152 UQ2 A 201 -1.698 0.484 4.857 1.00 20.00 H new HETATM 0 H151 UQ2 A 201 -1.231 0.035 6.515 1.00 20.00 H new HETATM 0 H122 UQ2 A 201 -5.829 1.184 6.237 1.00 20.00 H new HETATM 0 H121 UQ2 A 201 -6.026 -0.519 6.603 1.00 20.00 H new HETATM 0 H112 UQ2 A 201 -7.669 -0.378 4.972 1.00 20.00 H new HETATM 0 H111 UQ2 A 201 -6.313 -0.658 3.899 1.00 20.00 H new HETATM 0 H103 UQ2 A 201 -7.391 1.882 1.949 1.00 20.00 H new HETATM 0 H102 UQ2 A 201 -5.799 2.435 2.522 1.00 20.00 H new HETATM 0 H101 UQ2 A 201 -6.066 0.713 2.159 1.00 20.00 H new HETATM 0 H8 UQ2 A 201 -7.841 2.157 5.702 1.00 20.00 H new HETATM 0 H72 UQ2 A 201 -8.822 3.776 3.719 1.00 20.00 H new HETATM 0 H71 UQ2 A 201 -7.155 3.844 3.184 1.00 20.00 H new HETATM 0 H13 UQ2 A 201 -4.165 -0.420 4.328 1.00 20.00 H new