USER MOD reduce.3.24.130724 H: found=0, std=0, add=751, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 755 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 74 SER OG : rot 50:sc= 0.985 USER MOD Set 1.2: A 75 GLN : amide:sc= 0.145 X(o=1.1,f=0.81) USER MOD Set 2.1: A 32 GLN : amide:sc= 0.00907 X(o=0.018,f=-0.45) USER MOD Set 2.2: A 123 THR OG1 : rot -81:sc= 0.00869 USER MOD Set 3.1: A 18 LYS NZ :NH3+ 175:sc= 0.556 (180deg=0) USER MOD Set 3.2: A 118 ASN : amide:sc= 0.176 K(o=0.73,f=-8.4!) USER MOD Single : A 2 GLN : amide:sc= 0.154 X(o=0.15,f=0) USER MOD Single : A 3 GLN : amide:sc= 0 K(o=0,f=-1.8) USER MOD Single : A 9 GLN : amide:sc= -0.0425 X(o=-0.043,f=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 MET CE :methyl 179:sc= 0 (180deg=-0.00891) USER MOD Single : A 30 GLN :FLIP amide:sc= -0.0417 F(o=-3.9!,f=-0.042) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 TYR OH : rot 180:sc= -0.0109 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 ASN : amide:sc= -0.617 X(o=-0.62,f=-0.19) USER MOD Single : A 64 SER OG : rot 48:sc= 0.271 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 71 GLN :FLIP amide:sc= -0.202 F(o=-0.95,f=-0.2) USER MOD Single : A 72 SER OG : rot 81:sc= 0.911 USER MOD Single : A 76 THR OG1 : rot 86:sc= 0.826 USER MOD Single : A 77 MET CE :methyl 164:sc= -0.436 (180deg=-1.02) USER MOD Single : A 81 GLN : amide:sc= -0.269 X(o=-0.27,f=0) USER MOD Single : A 83 GLN : amide:sc= 0.0966 X(o=0.097,f=0) USER MOD Single : A 89 MET CE :methyl -128:sc= -0.505 (180deg=-5.9!) USER MOD Single : A 101 MET CE :methyl -140:sc= 0 (180deg=-0.441) USER MOD Single : A 104 ASN : amide:sc= -0.386 X(o=-0.39,f=0) USER MOD Single : A 109 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 LYS NZ :NH3+ -131:sc= -0.253 (180deg=-1.82) USER MOD Single : A 111 THR OG1 : rot -53:sc= -1.8! USER MOD Single : A 112 MET CE :methyl -145:sc= -0.0542 (180deg=-0.29) USER MOD Single : A 116 SER OG : rot -78:sc= -0.0274 USER MOD Single : A 120 ASN : amide:sc= 0.163 X(o=0.16,f=-0.15) USER MOD Single : A 128 THR OG1 : rot -54:sc= 1.44 USER MOD ----------------------------------------------------------------- ATOM 15 N GLN A 2 2.055 -2.171 -0.531 1.00 0.00 N ATOM 16 CA GLN A 2 2.015 -3.427 -1.311 1.00 0.00 C ATOM 17 C GLN A 2 0.656 -3.621 -2.002 1.00 0.00 C ATOM 18 O GLN A 2 0.610 -4.149 -3.100 1.00 0.00 O ATOM 19 CB GLN A 2 2.339 -4.663 -0.426 1.00 0.00 C ATOM 20 CG GLN A 2 1.331 -4.950 0.707 1.00 0.00 C ATOM 21 CD GLN A 2 1.642 -6.227 1.489 1.00 0.00 C ATOM 22 OE1 GLN A 2 2.379 -6.205 2.476 1.00 0.00 O ATOM 23 NE2 GLN A 2 1.085 -7.346 1.060 1.00 0.00 N ATOM 0 HA GLN A 2 2.784 -3.341 -2.078 1.00 0.00 H new ATOM 0 HB2 GLN A 2 2.398 -5.542 -1.068 1.00 0.00 H new ATOM 0 HB3 GLN A 2 3.326 -4.524 0.016 1.00 0.00 H new ATOM 0 HG2 GLN A 2 1.320 -4.105 1.396 1.00 0.00 H new ATOM 0 HG3 GLN A 2 0.330 -5.028 0.282 1.00 0.00 H new ATOM 0 HE21 GLN A 2 0.479 -7.332 0.240 1.00 0.00 H new ATOM 0 HE22 GLN A 2 1.261 -8.223 1.549 1.00 0.00 H new ATOM 32 N GLN A 3 -0.421 -3.134 -1.355 1.00 0.00 N ATOM 33 CA GLN A 3 -1.832 -3.353 -1.770 1.00 0.00 C ATOM 34 C GLN A 3 -2.101 -2.929 -3.232 1.00 0.00 C ATOM 35 O GLN A 3 -2.863 -3.584 -3.953 1.00 0.00 O ATOM 36 CB GLN A 3 -2.787 -2.601 -0.783 1.00 0.00 C ATOM 37 CG GLN A 3 -2.576 -1.062 -0.682 1.00 0.00 C ATOM 38 CD GLN A 3 -3.534 -0.206 -1.527 1.00 0.00 C ATOM 39 OE1 GLN A 3 -4.077 -0.651 -2.536 1.00 0.00 O ATOM 40 NE2 GLN A 3 -3.699 1.047 -1.145 1.00 0.00 N ATOM 0 H GLN A 3 -0.339 -2.565 -0.512 1.00 0.00 H new ATOM 0 HA GLN A 3 -2.028 -4.424 -1.727 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -3.816 -2.789 -1.088 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -2.665 -3.032 0.211 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -2.678 -0.767 0.362 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -1.553 -0.833 -0.980 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -3.236 1.389 -0.303 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -4.290 1.673 -1.692 1.00 0.00 H new ATOM 49 N LEU A 4 -1.441 -1.840 -3.643 1.00 0.00 N ATOM 50 CA LEU A 4 -1.630 -1.209 -4.957 1.00 0.00 C ATOM 51 C LEU A 4 -1.175 -2.151 -6.094 1.00 0.00 C ATOM 52 O LEU A 4 -1.905 -2.369 -7.070 1.00 0.00 O ATOM 53 CB LEU A 4 -0.855 0.140 -4.965 1.00 0.00 C ATOM 54 CG LEU A 4 -1.050 1.064 -6.202 1.00 0.00 C ATOM 55 CD1 LEU A 4 -2.542 1.373 -6.455 1.00 0.00 C ATOM 56 CD2 LEU A 4 -0.220 2.364 -6.046 1.00 0.00 C ATOM 0 H LEU A 4 -0.749 -1.364 -3.064 1.00 0.00 H new ATOM 0 HA LEU A 4 -2.688 -1.012 -5.133 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -1.143 0.701 -4.076 1.00 0.00 H new ATOM 0 HB3 LEU A 4 0.208 -0.081 -4.872 1.00 0.00 H new ATOM 0 HG LEU A 4 -0.684 0.531 -7.079 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -2.637 2.021 -7.327 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -3.081 0.443 -6.634 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -2.963 1.874 -5.583 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -0.369 2.998 -6.920 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -0.544 2.897 -5.152 1.00 0.00 H new ATOM 0 HD23 LEU A 4 0.837 2.112 -5.956 1.00 0.00 H new ATOM 68 N VAL A 5 0.026 -2.727 -5.928 1.00 0.00 N ATOM 69 CA VAL A 5 0.601 -3.695 -6.877 1.00 0.00 C ATOM 70 C VAL A 5 0.073 -5.130 -6.611 1.00 0.00 C ATOM 71 O VAL A 5 0.065 -5.970 -7.503 1.00 0.00 O ATOM 72 CB VAL A 5 2.178 -3.643 -6.862 1.00 0.00 C ATOM 73 CG1 VAL A 5 2.764 -4.050 -5.486 1.00 0.00 C ATOM 74 CG2 VAL A 5 2.785 -4.491 -8.009 1.00 0.00 C ATOM 0 H VAL A 5 0.629 -2.534 -5.128 1.00 0.00 H new ATOM 0 HA VAL A 5 0.275 -3.411 -7.878 1.00 0.00 H new ATOM 0 HB VAL A 5 2.461 -2.604 -7.033 1.00 0.00 H new ATOM 0 HG11 VAL A 5 3.852 -3.999 -5.524 1.00 0.00 H new ATOM 0 HG12 VAL A 5 2.396 -3.370 -4.718 1.00 0.00 H new ATOM 0 HG13 VAL A 5 2.457 -5.068 -5.246 1.00 0.00 H new ATOM 0 HG21 VAL A 5 3.873 -4.432 -7.968 1.00 0.00 H new ATOM 0 HG22 VAL A 5 2.473 -5.530 -7.898 1.00 0.00 H new ATOM 0 HG23 VAL A 5 2.437 -4.108 -8.968 1.00 0.00 H new ATOM 84 N GLU A 6 -0.377 -5.392 -5.374 1.00 0.00 N ATOM 85 CA GLU A 6 -0.830 -6.730 -4.925 1.00 0.00 C ATOM 86 C GLU A 6 -2.143 -7.114 -5.612 1.00 0.00 C ATOM 87 O GLU A 6 -2.267 -8.223 -6.145 1.00 0.00 O ATOM 88 CB GLU A 6 -1.020 -6.758 -3.384 1.00 0.00 C ATOM 89 CG GLU A 6 -1.468 -8.124 -2.805 1.00 0.00 C ATOM 90 CD GLU A 6 -1.701 -8.109 -1.278 1.00 0.00 C ATOM 91 OE1 GLU A 6 -2.653 -7.437 -0.829 1.00 0.00 O ATOM 92 OE2 GLU A 6 -0.962 -8.784 -0.527 1.00 0.00 O ATOM 0 H GLU A 6 -0.440 -4.679 -4.647 1.00 0.00 H new ATOM 0 HA GLU A 6 -0.061 -7.452 -5.199 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -0.081 -6.470 -2.912 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -1.758 -6.004 -3.110 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -2.388 -8.434 -3.300 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -0.712 -8.873 -3.040 1.00 0.00 H new ATOM 99 N ARG A 7 -3.116 -6.176 -5.599 1.00 0.00 N ATOM 100 CA ARG A 7 -4.431 -6.374 -6.243 1.00 0.00 C ATOM 101 C ARG A 7 -4.246 -6.552 -7.748 1.00 0.00 C ATOM 102 O ARG A 7 -4.949 -7.344 -8.381 1.00 0.00 O ATOM 103 CB ARG A 7 -5.416 -5.208 -5.911 1.00 0.00 C ATOM 104 CG ARG A 7 -5.223 -3.837 -6.662 1.00 0.00 C ATOM 105 CD ARG A 7 -6.136 -3.687 -7.917 1.00 0.00 C ATOM 106 NE ARG A 7 -6.473 -2.279 -8.267 1.00 0.00 N ATOM 107 CZ ARG A 7 -7.159 -1.907 -9.374 1.00 0.00 C ATOM 108 NH1 ARG A 7 -7.535 -2.794 -10.287 1.00 0.00 N ATOM 109 NH2 ARG A 7 -7.486 -0.640 -9.551 1.00 0.00 N ATOM 0 H ARG A 7 -3.012 -5.268 -5.146 1.00 0.00 H new ATOM 0 HA ARG A 7 -4.883 -7.281 -5.842 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -6.428 -5.559 -6.113 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -5.353 -5.013 -4.840 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -5.430 -3.020 -5.971 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -4.181 -3.741 -6.966 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -5.641 -4.152 -8.769 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -7.061 -4.238 -7.746 1.00 0.00 H new ATOM 0 HE ARG A 7 -6.166 -1.545 -7.629 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -7.308 -3.781 -10.163 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -8.051 -2.489 -11.112 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -7.222 0.057 -8.855 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -8.003 -0.358 -10.384 1.00 0.00 H new ATOM 123 N LEU A 8 -3.240 -5.828 -8.278 1.00 0.00 N ATOM 124 CA LEU A 8 -2.850 -5.873 -9.686 1.00 0.00 C ATOM 125 C LEU A 8 -2.428 -7.322 -10.038 1.00 0.00 C ATOM 126 O LEU A 8 -2.964 -7.914 -10.963 1.00 0.00 O ATOM 127 CB LEU A 8 -1.686 -4.855 -9.920 1.00 0.00 C ATOM 128 CG LEU A 8 -1.352 -4.394 -11.387 1.00 0.00 C ATOM 129 CD1 LEU A 8 -0.169 -3.394 -11.397 1.00 0.00 C ATOM 130 CD2 LEU A 8 -1.055 -5.563 -12.343 1.00 0.00 C ATOM 0 H LEU A 8 -2.672 -5.188 -7.724 1.00 0.00 H new ATOM 0 HA LEU A 8 -3.680 -5.593 -10.335 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -1.910 -3.961 -9.338 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -0.780 -5.290 -9.499 1.00 0.00 H new ATOM 0 HG LEU A 8 -2.252 -3.902 -11.755 1.00 0.00 H new ATOM 0 HD11 LEU A 8 0.042 -3.091 -12.422 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -0.429 -2.516 -10.805 1.00 0.00 H new ATOM 0 HD13 LEU A 8 0.714 -3.870 -10.970 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.833 -5.173 -13.336 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -0.198 -6.126 -11.974 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -1.924 -6.219 -12.396 1.00 0.00 H new ATOM 142 N GLN A 9 -1.478 -7.867 -9.258 1.00 0.00 N ATOM 143 CA GLN A 9 -0.915 -9.225 -9.459 1.00 0.00 C ATOM 144 C GLN A 9 -1.999 -10.315 -9.347 1.00 0.00 C ATOM 145 O GLN A 9 -2.097 -11.222 -10.197 1.00 0.00 O ATOM 146 CB GLN A 9 0.208 -9.474 -8.423 1.00 0.00 C ATOM 147 CG GLN A 9 1.456 -8.593 -8.628 1.00 0.00 C ATOM 148 CD GLN A 9 2.474 -8.725 -7.496 1.00 0.00 C ATOM 149 OE1 GLN A 9 3.358 -9.575 -7.537 1.00 0.00 O ATOM 150 NE2 GLN A 9 2.349 -7.890 -6.470 1.00 0.00 N ATOM 0 H GLN A 9 -1.072 -7.377 -8.461 1.00 0.00 H new ATOM 0 HA GLN A 9 -0.504 -9.279 -10.467 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -0.188 -9.298 -7.423 1.00 0.00 H new ATOM 0 HB3 GLN A 9 0.504 -10.522 -8.468 1.00 0.00 H new ATOM 0 HG2 GLN A 9 1.933 -8.862 -9.571 1.00 0.00 H new ATOM 0 HG3 GLN A 9 1.148 -7.551 -8.712 1.00 0.00 H new ATOM 0 HE21 GLN A 9 1.603 -7.194 -6.467 1.00 0.00 H new ATOM 0 HE22 GLN A 9 2.999 -7.945 -5.686 1.00 0.00 H new ATOM 159 N GLU A 10 -2.844 -10.146 -8.321 1.00 0.00 N ATOM 160 CA GLU A 10 -3.887 -11.111 -7.932 1.00 0.00 C ATOM 161 C GLU A 10 -4.914 -11.296 -9.067 1.00 0.00 C ATOM 162 O GLU A 10 -5.376 -12.405 -9.316 1.00 0.00 O ATOM 163 CB GLU A 10 -4.539 -10.628 -6.588 1.00 0.00 C ATOM 164 CG GLU A 10 -5.458 -11.635 -5.839 1.00 0.00 C ATOM 165 CD GLU A 10 -6.879 -11.768 -6.422 1.00 0.00 C ATOM 166 OE1 GLU A 10 -7.656 -10.796 -6.318 1.00 0.00 O ATOM 167 OE2 GLU A 10 -7.225 -12.833 -6.976 1.00 0.00 O ATOM 0 H GLU A 10 -2.823 -9.319 -7.725 1.00 0.00 H new ATOM 0 HA GLU A 10 -3.451 -12.096 -7.764 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.737 -10.335 -5.910 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -5.122 -9.732 -6.799 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -4.983 -12.616 -5.849 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -5.535 -11.329 -4.796 1.00 0.00 H new ATOM 174 N GLU A 11 -5.248 -10.203 -9.770 1.00 0.00 N ATOM 175 CA GLU A 11 -6.218 -10.244 -10.882 1.00 0.00 C ATOM 176 C GLU A 11 -5.525 -10.551 -12.227 1.00 0.00 C ATOM 177 O GLU A 11 -6.101 -11.244 -13.068 1.00 0.00 O ATOM 178 CB GLU A 11 -7.004 -8.908 -10.958 1.00 0.00 C ATOM 179 CG GLU A 11 -6.162 -7.678 -11.309 1.00 0.00 C ATOM 180 CD GLU A 11 -6.909 -6.346 -11.236 1.00 0.00 C ATOM 181 OE1 GLU A 11 -7.947 -6.186 -11.913 1.00 0.00 O ATOM 182 OE2 GLU A 11 -6.423 -5.416 -10.568 1.00 0.00 O ATOM 0 H GLU A 11 -4.861 -9.277 -9.590 1.00 0.00 H new ATOM 0 HA GLU A 11 -6.921 -11.053 -10.686 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -7.795 -9.012 -11.701 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -7.489 -8.735 -9.998 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -5.307 -7.636 -10.634 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -5.767 -7.802 -12.317 1.00 0.00 H new ATOM 189 N LYS A 12 -4.269 -10.056 -12.404 1.00 0.00 N ATOM 190 CA LYS A 12 -3.560 -10.108 -13.707 1.00 0.00 C ATOM 191 C LYS A 12 -3.159 -11.522 -14.100 1.00 0.00 C ATOM 192 O LYS A 12 -2.880 -11.752 -15.266 1.00 0.00 O ATOM 193 CB LYS A 12 -2.303 -9.188 -13.759 1.00 0.00 C ATOM 194 CG LYS A 12 -1.039 -9.747 -13.062 1.00 0.00 C ATOM 195 CD LYS A 12 0.206 -8.858 -13.273 1.00 0.00 C ATOM 196 CE LYS A 12 1.462 -9.410 -12.583 1.00 0.00 C ATOM 197 NZ LYS A 12 2.640 -8.544 -12.826 1.00 0.00 N ATOM 0 H LYS A 12 -3.729 -9.617 -11.658 1.00 0.00 H new ATOM 0 HA LYS A 12 -4.288 -9.734 -14.427 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -2.063 -8.989 -14.803 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -2.555 -8.231 -13.302 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -1.233 -9.845 -11.994 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -0.833 -10.748 -13.442 1.00 0.00 H new ATOM 0 HD2 LYS A 12 0.399 -8.760 -14.341 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -0.000 -7.857 -12.893 1.00 0.00 H new ATOM 0 HE2 LYS A 12 1.284 -9.491 -11.511 1.00 0.00 H new ATOM 0 HE3 LYS A 12 1.667 -10.416 -12.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 3.471 -8.945 -12.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 2.824 -8.487 -13.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 2.453 -7.591 -12.455 1.00 0.00 H new ATOM 211 N ARG A 13 -3.124 -12.453 -13.125 1.00 0.00 N ATOM 212 CA ARG A 13 -2.765 -13.876 -13.356 1.00 0.00 C ATOM 213 C ARG A 13 -3.510 -14.549 -14.555 1.00 0.00 C ATOM 214 O ARG A 13 -3.021 -15.556 -15.088 1.00 0.00 O ATOM 215 CB ARG A 13 -2.989 -14.687 -12.051 1.00 0.00 C ATOM 216 CG ARG A 13 -4.432 -14.643 -11.493 1.00 0.00 C ATOM 217 CD ARG A 13 -4.593 -15.466 -10.195 1.00 0.00 C ATOM 218 NE ARG A 13 -3.586 -15.083 -9.173 1.00 0.00 N ATOM 219 CZ ARG A 13 -3.825 -14.843 -7.875 1.00 0.00 C ATOM 220 NH1 ARG A 13 -5.058 -14.865 -7.386 1.00 0.00 N ATOM 221 NH2 ARG A 13 -2.814 -14.547 -7.067 1.00 0.00 N ATOM 0 H ARG A 13 -3.344 -12.243 -12.151 1.00 0.00 H new ATOM 0 HA ARG A 13 -1.712 -13.882 -13.636 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -2.719 -15.727 -12.236 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -2.308 -14.312 -11.287 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -4.711 -13.607 -11.299 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -5.121 -15.023 -12.247 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -5.595 -15.318 -9.792 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -4.495 -16.527 -10.423 1.00 0.00 H new ATOM 0 HE ARG A 13 -2.620 -14.994 -9.488 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -5.847 -15.067 -8.000 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -5.217 -14.680 -6.396 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -1.863 -14.503 -7.434 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -2.988 -14.363 -6.079 1.00 0.00 H new ATOM 235 N ILE A 14 -4.661 -13.977 -14.990 1.00 0.00 N ATOM 236 CA ILE A 14 -5.447 -14.501 -16.145 1.00 0.00 C ATOM 237 C ILE A 14 -4.690 -14.334 -17.493 1.00 0.00 C ATOM 238 O ILE A 14 -5.055 -14.962 -18.492 1.00 0.00 O ATOM 239 CB ILE A 14 -6.902 -13.860 -16.265 1.00 0.00 C ATOM 240 CG1 ILE A 14 -6.918 -12.457 -16.977 1.00 0.00 C ATOM 241 CG2 ILE A 14 -7.580 -13.785 -14.876 1.00 0.00 C ATOM 242 CD1 ILE A 14 -6.165 -11.346 -16.280 1.00 0.00 C ATOM 0 H ILE A 14 -5.070 -13.148 -14.558 1.00 0.00 H new ATOM 0 HA ILE A 14 -5.572 -15.564 -15.937 1.00 0.00 H new ATOM 0 HB ILE A 14 -7.476 -14.526 -16.909 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -6.504 -12.576 -17.978 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -7.956 -12.145 -17.096 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -8.572 -13.345 -14.979 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -7.670 -14.789 -14.460 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -6.977 -13.169 -14.209 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -6.247 -10.429 -16.863 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -6.589 -11.185 -15.289 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -5.115 -11.622 -16.184 1.00 0.00 H new ATOM 254 N GLU A 15 -3.638 -13.480 -17.497 1.00 0.00 N ATOM 255 CA GLU A 15 -2.800 -13.193 -18.684 1.00 0.00 C ATOM 256 C GLU A 15 -2.081 -14.455 -19.199 1.00 0.00 C ATOM 257 O GLU A 15 -1.720 -14.527 -20.377 1.00 0.00 O ATOM 258 CB GLU A 15 -1.751 -12.085 -18.370 1.00 0.00 C ATOM 259 CG GLU A 15 -0.679 -12.478 -17.317 1.00 0.00 C ATOM 260 CD GLU A 15 0.377 -11.388 -17.075 1.00 0.00 C ATOM 261 OE1 GLU A 15 0.117 -10.457 -16.292 1.00 0.00 O ATOM 262 OE2 GLU A 15 1.478 -11.460 -17.671 1.00 0.00 O ATOM 0 H GLU A 15 -3.345 -12.966 -16.666 1.00 0.00 H new ATOM 0 HA GLU A 15 -3.472 -12.840 -19.467 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -1.246 -11.811 -19.296 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -2.276 -11.197 -18.018 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -1.175 -12.707 -16.374 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -0.179 -13.390 -17.643 1.00 0.00 H new ATOM 269 N ALA A 16 -1.911 -15.456 -18.301 1.00 0.00 N ATOM 270 CA ALA A 16 -1.300 -16.770 -18.617 1.00 0.00 C ATOM 271 C ALA A 16 -1.990 -17.470 -19.811 1.00 0.00 C ATOM 272 O ALA A 16 -1.404 -18.352 -20.451 1.00 0.00 O ATOM 273 CB ALA A 16 -1.328 -17.658 -17.357 1.00 0.00 C ATOM 0 H ALA A 16 -2.198 -15.372 -17.326 1.00 0.00 H new ATOM 0 HA ALA A 16 -0.267 -16.602 -18.921 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -0.880 -18.625 -17.584 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -0.764 -17.175 -16.559 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -2.360 -17.802 -17.036 1.00 0.00 H new ATOM 279 N GLN A 17 -3.237 -17.059 -20.096 1.00 0.00 N ATOM 280 CA GLN A 17 -4.014 -17.545 -21.243 1.00 0.00 C ATOM 281 C GLN A 17 -4.521 -16.373 -22.122 1.00 0.00 C ATOM 282 O GLN A 17 -4.558 -16.489 -23.347 1.00 0.00 O ATOM 283 CB GLN A 17 -5.199 -18.412 -20.725 1.00 0.00 C ATOM 284 CG GLN A 17 -6.118 -17.703 -19.705 1.00 0.00 C ATOM 285 CD GLN A 17 -7.281 -18.561 -19.218 1.00 0.00 C ATOM 286 OE1 GLN A 17 -7.168 -19.282 -18.227 1.00 0.00 O ATOM 287 NE2 GLN A 17 -8.409 -18.484 -19.906 1.00 0.00 N ATOM 0 H GLN A 17 -3.737 -16.373 -19.530 1.00 0.00 H new ATOM 0 HA GLN A 17 -3.369 -18.157 -21.874 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -5.800 -18.728 -21.577 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -4.797 -19.315 -20.266 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -5.522 -17.396 -18.846 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -6.515 -16.795 -20.159 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -8.468 -17.876 -20.723 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -9.220 -19.033 -19.619 1.00 0.00 H new ATOM 296 N LYS A 18 -4.892 -15.236 -21.490 1.00 0.00 N ATOM 297 CA LYS A 18 -5.623 -14.130 -22.166 1.00 0.00 C ATOM 298 C LYS A 18 -4.681 -13.120 -22.878 1.00 0.00 C ATOM 299 O LYS A 18 -5.111 -12.398 -23.785 1.00 0.00 O ATOM 300 CB LYS A 18 -6.561 -13.427 -21.138 1.00 0.00 C ATOM 301 CG LYS A 18 -7.573 -12.406 -21.721 1.00 0.00 C ATOM 302 CD LYS A 18 -8.460 -12.965 -22.866 1.00 0.00 C ATOM 303 CE LYS A 18 -9.223 -14.254 -22.504 1.00 0.00 C ATOM 304 NZ LYS A 18 -10.084 -14.097 -21.310 1.00 0.00 N ATOM 0 H LYS A 18 -4.697 -15.056 -20.505 1.00 0.00 H new ATOM 0 HA LYS A 18 -6.226 -14.565 -22.963 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -7.119 -14.195 -20.602 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -5.941 -12.913 -20.404 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -8.219 -12.053 -20.917 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -7.024 -11.540 -22.092 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -9.180 -12.201 -23.159 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -7.831 -13.160 -23.735 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -9.838 -14.557 -23.352 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -8.507 -15.057 -22.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -10.636 -14.966 -21.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -9.490 -13.919 -20.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -10.731 -13.296 -21.452 1.00 0.00 H new ATOM 445 N HIS A 26 -10.326 -10.396 -33.459 1.00 0.00 N ATOM 446 CA HIS A 26 -11.756 -10.354 -33.036 1.00 0.00 C ATOM 447 C HIS A 26 -11.943 -9.844 -31.578 1.00 0.00 C ATOM 448 O HIS A 26 -13.072 -9.764 -31.088 1.00 0.00 O ATOM 449 CB HIS A 26 -12.415 -11.754 -33.197 1.00 0.00 C ATOM 450 CG HIS A 26 -12.045 -12.777 -32.131 1.00 0.00 C ATOM 451 ND1 HIS A 26 -10.919 -13.571 -32.196 1.00 0.00 N ATOM 452 CD2 HIS A 26 -12.664 -13.116 -30.970 1.00 0.00 C ATOM 453 CE1 HIS A 26 -10.868 -14.351 -31.132 1.00 0.00 C ATOM 454 NE2 HIS A 26 -11.914 -14.096 -30.370 1.00 0.00 N ATOM 0 HA HIS A 26 -12.251 -9.638 -33.692 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -13.498 -11.629 -33.196 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -12.141 -12.156 -34.173 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -13.581 -12.691 -30.588 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -10.097 -15.078 -30.921 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -12.129 -14.551 -29.483 1.00 0.00 H new ATOM 463 N LEU A 27 -10.831 -9.480 -30.908 1.00 0.00 N ATOM 464 CA LEU A 27 -10.813 -9.055 -29.494 1.00 0.00 C ATOM 465 C LEU A 27 -11.168 -7.549 -29.342 1.00 0.00 C ATOM 466 O LEU A 27 -10.871 -6.964 -28.316 1.00 0.00 O ATOM 467 CB LEU A 27 -9.407 -9.354 -28.863 1.00 0.00 C ATOM 468 CG LEU A 27 -8.951 -10.853 -28.774 1.00 0.00 C ATOM 469 CD1 LEU A 27 -9.967 -11.722 -28.020 1.00 0.00 C ATOM 470 CD2 LEU A 27 -8.610 -11.442 -30.158 1.00 0.00 C ATOM 0 H LEU A 27 -9.907 -9.473 -31.340 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.575 -9.625 -28.962 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.658 -8.809 -29.439 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.397 -8.940 -27.855 1.00 0.00 H new ATOM 0 HG LEU A 27 -8.030 -10.862 -28.191 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -9.609 -12.751 -27.983 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.087 -11.343 -27.005 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -10.927 -11.690 -28.535 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.300 -12.481 -30.045 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -9.489 -11.394 -30.801 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.800 -10.868 -30.608 1.00 0.00 H new ATOM 482 N TYR A 28 -11.861 -6.988 -30.349 1.00 0.00 N ATOM 483 CA TYR A 28 -12.308 -5.565 -30.461 1.00 0.00 C ATOM 484 C TYR A 28 -13.389 -5.120 -29.430 1.00 0.00 C ATOM 485 O TYR A 28 -14.156 -4.211 -29.729 1.00 0.00 O ATOM 486 CB TYR A 28 -12.705 -5.212 -31.934 1.00 0.00 C ATOM 487 CG TYR A 28 -11.554 -4.618 -32.774 1.00 0.00 C ATOM 488 CD1 TYR A 28 -10.271 -5.171 -32.742 1.00 0.00 C ATOM 489 CD2 TYR A 28 -11.752 -3.499 -33.594 1.00 0.00 C ATOM 490 CE1 TYR A 28 -9.235 -4.639 -33.490 1.00 0.00 C ATOM 491 CE2 TYR A 28 -10.722 -2.968 -34.342 1.00 0.00 C ATOM 492 CZ TYR A 28 -9.464 -3.540 -34.290 1.00 0.00 C ATOM 493 OH TYR A 28 -8.432 -2.996 -35.036 1.00 0.00 O ATOM 0 H TYR A 28 -12.147 -7.537 -31.160 1.00 0.00 H new ATOM 0 HA TYR A 28 -11.436 -4.972 -30.186 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -13.071 -6.113 -32.426 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -13.531 -4.501 -31.915 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -10.084 -6.033 -32.119 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -12.730 -3.044 -33.641 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -8.251 -5.083 -33.447 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -10.898 -2.106 -34.968 1.00 0.00 H new ATOM 0 HH TYR A 28 -8.766 -2.227 -35.544 1.00 0.00 H new ATOM 503 N MET A 29 -13.443 -5.793 -28.261 1.00 0.00 N ATOM 504 CA MET A 29 -14.439 -5.588 -27.168 1.00 0.00 C ATOM 505 C MET A 29 -14.856 -4.111 -26.981 1.00 0.00 C ATOM 506 O MET A 29 -14.015 -3.206 -26.929 1.00 0.00 O ATOM 507 CB MET A 29 -13.850 -6.190 -25.846 1.00 0.00 C ATOM 508 CG MET A 29 -14.353 -5.598 -24.509 1.00 0.00 C ATOM 509 SD MET A 29 -13.502 -4.060 -24.061 1.00 0.00 S ATOM 510 CE MET A 29 -14.306 -3.612 -22.523 1.00 0.00 C ATOM 0 H MET A 29 -12.770 -6.526 -28.036 1.00 0.00 H new ATOM 0 HA MET A 29 -15.359 -6.104 -27.444 1.00 0.00 H new ATOM 0 HB2 MET A 29 -14.059 -7.260 -25.841 1.00 0.00 H new ATOM 0 HB3 MET A 29 -12.766 -6.077 -25.878 1.00 0.00 H new ATOM 0 HG2 MET A 29 -15.424 -5.408 -24.580 1.00 0.00 H new ATOM 0 HG3 MET A 29 -14.211 -6.331 -23.715 1.00 0.00 H new ATOM 0 HE1 MET A 29 -13.863 -2.695 -22.135 1.00 0.00 H new ATOM 0 HE2 MET A 29 -15.370 -3.454 -22.701 1.00 0.00 H new ATOM 0 HE3 MET A 29 -14.175 -4.414 -21.797 1.00 0.00 H new ATOM 520 N GLN A 30 -16.181 -3.906 -26.912 1.00 0.00 N ATOM 521 CA GLN A 30 -16.795 -2.584 -26.862 1.00 0.00 C ATOM 522 C GLN A 30 -16.885 -2.116 -25.402 1.00 0.00 C ATOM 523 O GLN A 30 -17.240 -2.891 -24.504 1.00 0.00 O ATOM 524 CB GLN A 30 -18.207 -2.597 -27.542 1.00 0.00 C ATOM 525 CG GLN A 30 -18.247 -2.394 -29.096 1.00 0.00 C ATOM 526 CD GLN A 30 -17.938 -3.626 -29.978 1.00 0.00 C ATOM 527 OE1 GLN A 30 -16.929 -4.410 -29.653 1.00 0.00 O flip ATOM 528 NE2 GLN A 30 -18.565 -3.812 -31.022 1.00 0.00 N flip ATOM 0 H GLN A 30 -16.858 -4.668 -26.889 1.00 0.00 H new ATOM 0 HA GLN A 30 -16.174 -1.881 -27.418 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -18.686 -3.549 -27.312 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -18.812 -1.816 -27.082 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -19.238 -2.027 -29.363 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -17.536 -1.608 -29.352 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -19.344 -3.200 -31.265 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -18.305 -4.578 -31.643 1.00 0.00 H new ATOM 537 N VAL A 31 -16.535 -0.849 -25.182 1.00 0.00 N ATOM 538 CA VAL A 31 -16.568 -0.206 -23.868 1.00 0.00 C ATOM 539 C VAL A 31 -17.477 1.040 -23.949 1.00 0.00 C ATOM 540 O VAL A 31 -17.235 1.954 -24.745 1.00 0.00 O ATOM 541 CB VAL A 31 -15.103 0.130 -23.389 1.00 0.00 C ATOM 542 CG1 VAL A 31 -14.321 0.978 -24.423 1.00 0.00 C ATOM 543 CG2 VAL A 31 -15.090 0.772 -21.980 1.00 0.00 C ATOM 0 H VAL A 31 -16.215 -0.229 -25.926 1.00 0.00 H new ATOM 0 HA VAL A 31 -16.988 -0.878 -23.119 1.00 0.00 H new ATOM 0 HB VAL A 31 -14.576 -0.821 -23.311 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -13.319 1.181 -24.044 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -14.249 0.431 -25.363 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -14.843 1.920 -24.591 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -14.062 0.988 -21.688 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -15.664 1.698 -21.997 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -15.534 0.083 -21.262 1.00 0.00 H new ATOM 553 N GLN A 32 -18.564 1.019 -23.162 1.00 0.00 N ATOM 554 CA GLN A 32 -19.598 2.057 -23.166 1.00 0.00 C ATOM 555 C GLN A 32 -19.195 3.227 -22.261 1.00 0.00 C ATOM 556 O GLN A 32 -19.409 3.208 -21.055 1.00 0.00 O ATOM 557 CB GLN A 32 -20.977 1.457 -22.740 1.00 0.00 C ATOM 558 CG GLN A 32 -21.968 1.268 -23.902 1.00 0.00 C ATOM 559 CD GLN A 32 -23.328 0.727 -23.459 1.00 0.00 C ATOM 560 OE1 GLN A 32 -23.783 0.974 -22.337 1.00 0.00 O ATOM 561 NE2 GLN A 32 -23.992 -0.003 -24.339 1.00 0.00 N ATOM 0 H GLN A 32 -18.749 0.268 -22.497 1.00 0.00 H new ATOM 0 HA GLN A 32 -19.699 2.443 -24.180 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -20.809 0.493 -22.260 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -21.430 2.110 -21.994 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -22.112 2.224 -24.406 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -21.534 0.585 -24.632 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -23.588 -0.188 -25.257 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -24.909 -0.381 -24.100 1.00 0.00 H new ATOM 570 N ILE A 33 -18.609 4.231 -22.881 1.00 0.00 N ATOM 571 CA ILE A 33 -18.155 5.446 -22.225 1.00 0.00 C ATOM 572 C ILE A 33 -19.274 6.504 -22.209 1.00 0.00 C ATOM 573 O ILE A 33 -20.033 6.645 -23.178 1.00 0.00 O ATOM 574 CB ILE A 33 -16.876 6.001 -22.955 1.00 0.00 C ATOM 575 CG1 ILE A 33 -15.781 4.894 -23.045 1.00 0.00 C ATOM 576 CG2 ILE A 33 -16.323 7.270 -22.255 1.00 0.00 C ATOM 577 CD1 ILE A 33 -15.313 4.391 -21.705 1.00 0.00 C ATOM 0 H ILE A 33 -18.429 4.226 -23.885 1.00 0.00 H new ATOM 0 HA ILE A 33 -17.897 5.213 -21.192 1.00 0.00 H new ATOM 0 HB ILE A 33 -17.166 6.289 -23.966 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -16.172 4.055 -23.621 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -14.925 5.286 -23.594 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -15.440 7.624 -22.788 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -17.085 8.049 -22.259 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -16.054 7.030 -21.226 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -14.552 3.624 -21.850 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -14.891 5.217 -21.133 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -16.157 3.967 -21.161 1.00 0.00 H new ATOM 589 N VAL A 34 -19.389 7.216 -21.081 1.00 0.00 N ATOM 590 CA VAL A 34 -20.263 8.392 -20.930 1.00 0.00 C ATOM 591 C VAL A 34 -19.485 9.504 -20.214 1.00 0.00 C ATOM 592 O VAL A 34 -18.851 9.264 -19.183 1.00 0.00 O ATOM 593 CB VAL A 34 -21.617 8.090 -20.169 1.00 0.00 C ATOM 594 CG1 VAL A 34 -22.652 7.482 -21.129 1.00 0.00 C ATOM 595 CG2 VAL A 34 -21.392 7.175 -18.933 1.00 0.00 C ATOM 0 H VAL A 34 -18.870 6.990 -20.233 1.00 0.00 H new ATOM 0 HA VAL A 34 -20.553 8.706 -21.933 1.00 0.00 H new ATOM 0 HB VAL A 34 -22.008 9.038 -19.798 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -23.576 7.281 -20.588 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -22.851 8.182 -21.940 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -22.263 6.551 -21.541 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -22.346 6.991 -18.438 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -20.962 6.227 -19.256 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -20.710 7.664 -18.237 1.00 0.00 H new ATOM 605 N ALA A 35 -19.534 10.714 -20.788 1.00 0.00 N ATOM 606 CA ALA A 35 -18.824 11.896 -20.279 1.00 0.00 C ATOM 607 C ALA A 35 -19.406 13.151 -20.925 1.00 0.00 C ATOM 608 O ALA A 35 -19.702 13.141 -22.131 1.00 0.00 O ATOM 609 CB ALA A 35 -17.311 11.793 -20.572 1.00 0.00 C ATOM 0 H ALA A 35 -20.076 10.902 -21.631 1.00 0.00 H new ATOM 0 HA ALA A 35 -18.954 11.951 -19.198 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -16.805 12.678 -20.187 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -16.906 10.904 -20.088 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -17.153 11.724 -21.648 1.00 0.00 H new ATOM 883 N LYS A 54 -25.173 10.911 -27.144 1.00 0.00 N ATOM 884 CA LYS A 54 -25.589 9.637 -26.532 1.00 0.00 C ATOM 885 C LYS A 54 -24.381 8.718 -26.186 1.00 0.00 C ATOM 886 O LYS A 54 -23.216 9.141 -26.281 1.00 0.00 O ATOM 887 CB LYS A 54 -26.588 8.897 -27.477 1.00 0.00 C ATOM 888 CG LYS A 54 -26.062 8.543 -28.901 1.00 0.00 C ATOM 889 CD LYS A 54 -26.280 9.679 -29.936 1.00 0.00 C ATOM 890 CE LYS A 54 -25.736 9.346 -31.334 1.00 0.00 C ATOM 891 NZ LYS A 54 -26.117 10.376 -32.340 1.00 0.00 N ATOM 0 HA LYS A 54 -26.083 9.873 -25.589 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -26.900 7.974 -26.989 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -27.478 9.517 -27.586 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -24.998 8.315 -28.841 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -26.563 7.640 -29.252 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -27.346 9.892 -30.011 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -25.798 10.587 -29.574 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -24.650 9.266 -31.291 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -26.115 8.374 -31.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -25.730 10.114 -33.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -27.154 10.435 -32.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -25.733 11.299 -32.054 1.00 0.00 H new ATOM 905 N TYR A 55 -24.688 7.462 -25.785 1.00 0.00 N ATOM 906 CA TYR A 55 -23.692 6.469 -25.339 1.00 0.00 C ATOM 907 C TYR A 55 -22.533 6.327 -26.336 1.00 0.00 C ATOM 908 O TYR A 55 -22.682 5.775 -27.431 1.00 0.00 O ATOM 909 CB TYR A 55 -24.358 5.078 -25.072 1.00 0.00 C ATOM 910 CG TYR A 55 -24.421 4.707 -23.587 1.00 0.00 C ATOM 911 CD1 TYR A 55 -23.243 4.488 -22.866 1.00 0.00 C ATOM 912 CD2 TYR A 55 -25.636 4.603 -22.903 1.00 0.00 C ATOM 913 CE1 TYR A 55 -23.279 4.177 -21.521 1.00 0.00 C ATOM 914 CE2 TYR A 55 -25.672 4.291 -21.559 1.00 0.00 C ATOM 915 CZ TYR A 55 -24.497 4.080 -20.876 1.00 0.00 C ATOM 916 OH TYR A 55 -24.543 3.773 -19.537 1.00 0.00 O ATOM 0 H TYR A 55 -25.645 7.110 -25.763 1.00 0.00 H new ATOM 0 HA TYR A 55 -23.277 6.839 -24.401 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -25.369 5.083 -25.480 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -23.802 4.309 -25.608 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -22.290 4.563 -23.369 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -26.561 4.769 -23.435 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -22.361 4.011 -20.977 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -26.619 4.213 -21.046 1.00 0.00 H new ATOM 0 HH TYR A 55 -25.476 3.745 -19.240 1.00 0.00 H new ATOM 926 N THR A 56 -21.402 6.871 -25.908 1.00 0.00 N ATOM 927 CA THR A 56 -20.136 6.800 -26.599 1.00 0.00 C ATOM 928 C THR A 56 -19.561 5.380 -26.416 1.00 0.00 C ATOM 929 O THR A 56 -19.650 4.815 -25.330 1.00 0.00 O ATOM 930 CB THR A 56 -19.196 7.907 -26.015 1.00 0.00 C ATOM 931 OG1 THR A 56 -19.565 9.200 -26.534 1.00 0.00 O ATOM 932 CG2 THR A 56 -17.718 7.624 -26.271 1.00 0.00 C ATOM 0 H THR A 56 -21.347 7.393 -25.034 1.00 0.00 H new ATOM 0 HA THR A 56 -20.242 6.981 -27.669 1.00 0.00 H new ATOM 0 HB THR A 56 -19.330 7.902 -24.933 1.00 0.00 H new ATOM 0 HG1 THR A 56 -18.971 9.884 -26.160 1.00 0.00 H new ATOM 0 HG21 THR A 56 -17.115 8.425 -25.844 1.00 0.00 H new ATOM 0 HG22 THR A 56 -17.443 6.676 -25.808 1.00 0.00 H new ATOM 0 HG23 THR A 56 -17.539 7.568 -27.345 1.00 0.00 H new ATOM 940 N VAL A 57 -19.044 4.795 -27.497 1.00 0.00 N ATOM 941 CA VAL A 57 -18.504 3.426 -27.485 1.00 0.00 C ATOM 942 C VAL A 57 -17.208 3.351 -28.310 1.00 0.00 C ATOM 943 O VAL A 57 -17.109 3.953 -29.384 1.00 0.00 O ATOM 944 CB VAL A 57 -19.577 2.397 -28.003 1.00 0.00 C ATOM 945 CG1 VAL A 57 -20.144 2.797 -29.392 1.00 0.00 C ATOM 946 CG2 VAL A 57 -19.033 0.949 -27.995 1.00 0.00 C ATOM 0 H VAL A 57 -18.986 5.252 -28.407 1.00 0.00 H new ATOM 0 HA VAL A 57 -18.262 3.158 -26.457 1.00 0.00 H new ATOM 0 HB VAL A 57 -20.412 2.428 -27.303 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -20.881 2.059 -29.711 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -20.618 3.776 -29.323 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -19.332 2.837 -30.119 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -19.803 0.269 -28.359 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -18.158 0.886 -28.641 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -18.754 0.671 -26.979 1.00 0.00 H new ATOM 956 N PHE A 58 -16.200 2.639 -27.771 1.00 0.00 N ATOM 957 CA PHE A 58 -14.926 2.367 -28.469 1.00 0.00 C ATOM 958 C PHE A 58 -14.740 0.850 -28.578 1.00 0.00 C ATOM 959 O PHE A 58 -15.029 0.115 -27.627 1.00 0.00 O ATOM 960 CB PHE A 58 -13.723 3.013 -27.710 1.00 0.00 C ATOM 961 CG PHE A 58 -13.891 4.508 -27.442 1.00 0.00 C ATOM 962 CD1 PHE A 58 -14.205 5.386 -28.476 1.00 0.00 C ATOM 963 CD2 PHE A 58 -13.761 5.031 -26.155 1.00 0.00 C ATOM 964 CE1 PHE A 58 -14.394 6.731 -28.232 1.00 0.00 C ATOM 965 CE2 PHE A 58 -13.958 6.375 -25.917 1.00 0.00 C ATOM 966 CZ PHE A 58 -14.265 7.223 -26.951 1.00 0.00 C ATOM 0 H PHE A 58 -16.245 2.234 -26.836 1.00 0.00 H new ATOM 0 HA PHE A 58 -14.959 2.808 -29.465 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -13.586 2.497 -26.760 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -12.814 2.858 -28.291 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -14.302 5.009 -29.483 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -13.503 4.376 -25.336 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -14.643 7.398 -29.044 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -13.870 6.762 -24.912 1.00 0.00 H new ATOM 0 HZ PHE A 58 -14.406 8.277 -26.761 1.00 0.00 H new ATOM 976 N LYS A 59 -14.273 0.393 -29.745 1.00 0.00 N ATOM 977 CA LYS A 59 -13.984 -1.024 -30.007 1.00 0.00 C ATOM 978 C LYS A 59 -12.463 -1.214 -29.946 1.00 0.00 C ATOM 979 O LYS A 59 -11.732 -0.761 -30.834 1.00 0.00 O ATOM 980 CB LYS A 59 -14.582 -1.503 -31.375 1.00 0.00 C ATOM 981 CG LYS A 59 -14.312 -0.584 -32.593 1.00 0.00 C ATOM 982 CD LYS A 59 -15.287 0.619 -32.664 1.00 0.00 C ATOM 983 CE LYS A 59 -14.744 1.772 -33.508 1.00 0.00 C ATOM 984 NZ LYS A 59 -15.733 2.864 -33.674 1.00 0.00 N ATOM 0 H LYS A 59 -14.083 1.000 -30.542 1.00 0.00 H new ATOM 0 HA LYS A 59 -14.463 -1.644 -29.249 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -14.183 -2.493 -31.596 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -15.660 -1.612 -31.259 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -13.288 -0.214 -32.543 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -14.396 -1.168 -33.509 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -16.238 0.286 -33.080 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -15.489 0.977 -31.655 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -13.843 2.169 -33.040 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -14.454 1.396 -34.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -15.319 3.622 -34.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -16.583 2.494 -34.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -15.992 3.243 -32.741 1.00 0.00 H new ATOM 998 N VAL A 60 -11.989 -1.862 -28.872 1.00 0.00 N ATOM 999 CA VAL A 60 -10.549 -1.999 -28.567 1.00 0.00 C ATOM 1000 C VAL A 60 -10.235 -3.434 -28.118 1.00 0.00 C ATOM 1001 O VAL A 60 -11.140 -4.190 -27.712 1.00 0.00 O ATOM 1002 CB VAL A 60 -10.089 -0.979 -27.446 1.00 0.00 C ATOM 1003 CG1 VAL A 60 -10.107 0.486 -27.962 1.00 0.00 C ATOM 1004 CG2 VAL A 60 -10.953 -1.128 -26.164 1.00 0.00 C ATOM 0 H VAL A 60 -12.594 -2.310 -28.184 1.00 0.00 H new ATOM 0 HA VAL A 60 -9.998 -1.772 -29.480 1.00 0.00 H new ATOM 0 HB VAL A 60 -9.058 -1.223 -27.188 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -9.785 1.156 -27.165 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -9.430 0.581 -28.811 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -11.118 0.750 -28.272 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -10.614 -0.415 -25.412 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -11.998 -0.932 -26.405 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -10.854 -2.141 -25.774 1.00 0.00 H new ATOM 1014 N LEU A 61 -8.936 -3.800 -28.185 1.00 0.00 N ATOM 1015 CA LEU A 61 -8.456 -5.111 -27.740 1.00 0.00 C ATOM 1016 C LEU A 61 -8.675 -5.247 -26.220 1.00 0.00 C ATOM 1017 O LEU A 61 -8.146 -4.464 -25.430 1.00 0.00 O ATOM 1018 CB LEU A 61 -6.963 -5.353 -28.136 1.00 0.00 C ATOM 1019 CG LEU A 61 -6.637 -5.499 -29.662 1.00 0.00 C ATOM 1020 CD1 LEU A 61 -7.495 -6.594 -30.319 1.00 0.00 C ATOM 1021 CD2 LEU A 61 -6.747 -4.156 -30.419 1.00 0.00 C ATOM 0 H LEU A 61 -8.201 -3.193 -28.548 1.00 0.00 H new ATOM 0 HA LEU A 61 -9.032 -5.884 -28.249 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -6.372 -4.526 -27.743 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -6.623 -6.257 -27.631 1.00 0.00 H new ATOM 0 HG LEU A 61 -5.595 -5.811 -29.733 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -7.243 -6.668 -31.377 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -7.301 -7.550 -29.832 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -8.550 -6.341 -30.214 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -6.512 -4.311 -31.472 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -7.762 -3.769 -30.327 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -6.045 -3.439 -29.992 1.00 0.00 H new ATOM 1033 N LYS A 62 -9.510 -6.228 -25.842 1.00 0.00 N ATOM 1034 CA LYS A 62 -9.855 -6.525 -24.443 1.00 0.00 C ATOM 1035 C LYS A 62 -8.605 -6.877 -23.616 1.00 0.00 C ATOM 1036 O LYS A 62 -8.534 -6.594 -22.421 1.00 0.00 O ATOM 1037 CB LYS A 62 -10.880 -7.688 -24.395 1.00 0.00 C ATOM 1038 CG LYS A 62 -10.414 -9.010 -25.063 1.00 0.00 C ATOM 1039 CD LYS A 62 -11.431 -10.168 -24.911 1.00 0.00 C ATOM 1040 CE LYS A 62 -12.788 -9.874 -25.581 1.00 0.00 C ATOM 1041 NZ LYS A 62 -13.755 -10.980 -25.383 1.00 0.00 N ATOM 0 H LYS A 62 -9.971 -6.846 -26.510 1.00 0.00 H new ATOM 0 HA LYS A 62 -10.298 -5.632 -24.003 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -11.124 -7.893 -23.353 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -11.800 -7.360 -24.879 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -10.236 -8.830 -26.123 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -9.462 -9.313 -24.627 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -11.008 -11.074 -25.344 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -11.591 -10.366 -23.851 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -13.202 -8.952 -25.172 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -12.638 -9.710 -26.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -14.654 -10.743 -25.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -13.372 -11.854 -25.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -13.919 -11.120 -24.366 1.00 0.00 H new ATOM 1055 N ASN A 63 -7.624 -7.482 -24.287 1.00 0.00 N ATOM 1056 CA ASN A 63 -6.358 -7.898 -23.669 1.00 0.00 C ATOM 1057 C ASN A 63 -5.270 -6.813 -23.826 1.00 0.00 C ATOM 1058 O ASN A 63 -4.154 -7.012 -23.358 1.00 0.00 O ATOM 1059 CB ASN A 63 -5.887 -9.236 -24.288 1.00 0.00 C ATOM 1060 CG ASN A 63 -5.664 -9.132 -25.794 1.00 0.00 C ATOM 1061 OD1 ASN A 63 -4.605 -8.713 -26.241 1.00 0.00 O ATOM 1062 ND2 ASN A 63 -6.667 -9.509 -26.577 1.00 0.00 N ATOM 0 H ASN A 63 -7.683 -7.700 -25.282 1.00 0.00 H new ATOM 0 HA ASN A 63 -6.528 -8.038 -22.602 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -4.961 -9.550 -23.807 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -6.629 -10.008 -24.086 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -6.571 -9.455 -27.591 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -7.534 -9.853 -26.165 1.00 0.00 H new ATOM 1069 N SER A 64 -5.584 -5.694 -24.507 1.00 0.00 N ATOM 1070 CA SER A 64 -4.669 -4.532 -24.593 1.00 0.00 C ATOM 1071 C SER A 64 -4.571 -3.852 -23.227 1.00 0.00 C ATOM 1072 O SER A 64 -5.491 -3.956 -22.401 1.00 0.00 O ATOM 1073 CB SER A 64 -5.156 -3.509 -25.646 1.00 0.00 C ATOM 1074 OG SER A 64 -4.352 -2.356 -25.683 1.00 0.00 O ATOM 0 H SER A 64 -6.464 -5.567 -25.007 1.00 0.00 H new ATOM 0 HA SER A 64 -3.688 -4.896 -24.899 1.00 0.00 H new ATOM 0 HB2 SER A 64 -5.160 -3.978 -26.630 1.00 0.00 H new ATOM 0 HB3 SER A 64 -6.185 -3.225 -25.424 1.00 0.00 H new ATOM 0 HG SER A 64 -3.408 -2.617 -25.719 1.00 0.00 H new ATOM 1080 N SER A 65 -3.456 -3.144 -23.007 1.00 0.00 N ATOM 1081 CA SER A 65 -3.209 -2.425 -21.762 1.00 0.00 C ATOM 1082 C SER A 65 -4.158 -1.226 -21.637 1.00 0.00 C ATOM 1083 O SER A 65 -4.478 -0.566 -22.637 1.00 0.00 O ATOM 1084 CB SER A 65 -1.732 -1.984 -21.698 1.00 0.00 C ATOM 1085 OG SER A 65 -0.873 -3.111 -21.814 1.00 0.00 O ATOM 0 H SER A 65 -2.703 -3.057 -23.690 1.00 0.00 H new ATOM 0 HA SER A 65 -3.405 -3.088 -20.919 1.00 0.00 H new ATOM 0 HB2 SER A 65 -1.522 -1.275 -22.499 1.00 0.00 H new ATOM 0 HB3 SER A 65 -1.540 -1.468 -20.757 1.00 0.00 H new ATOM 0 HG SER A 65 0.061 -2.816 -21.774 1.00 0.00 H new ATOM 1091 N LEU A 66 -4.602 -0.962 -20.400 1.00 0.00 N ATOM 1092 CA LEU A 66 -5.524 0.140 -20.085 1.00 0.00 C ATOM 1093 C LEU A 66 -4.855 1.494 -20.447 1.00 0.00 C ATOM 1094 O LEU A 66 -5.541 2.442 -20.792 1.00 0.00 O ATOM 1095 CB LEU A 66 -5.945 0.070 -18.576 1.00 0.00 C ATOM 1096 CG LEU A 66 -7.303 0.757 -18.150 1.00 0.00 C ATOM 1097 CD1 LEU A 66 -7.221 2.288 -18.092 1.00 0.00 C ATOM 1098 CD2 LEU A 66 -8.472 0.311 -19.045 1.00 0.00 C ATOM 0 H LEU A 66 -4.330 -1.510 -19.584 1.00 0.00 H new ATOM 0 HA LEU A 66 -6.434 0.050 -20.679 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -6.000 -0.981 -18.294 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -5.145 0.517 -17.986 1.00 0.00 H new ATOM 0 HG LEU A 66 -7.494 0.415 -17.133 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -8.188 2.693 -17.793 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -6.463 2.585 -17.367 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -6.953 2.676 -19.075 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -9.388 0.805 -18.720 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -8.261 0.581 -20.080 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -8.596 -0.769 -18.970 1.00 0.00 H new ATOM 1110 N ALA A 67 -3.501 1.539 -20.389 1.00 0.00 N ATOM 1111 CA ALA A 67 -2.697 2.709 -20.826 1.00 0.00 C ATOM 1112 C ALA A 67 -2.965 3.081 -22.306 1.00 0.00 C ATOM 1113 O ALA A 67 -3.036 4.272 -22.650 1.00 0.00 O ATOM 1114 CB ALA A 67 -1.204 2.427 -20.595 1.00 0.00 C ATOM 0 H ALA A 67 -2.935 0.766 -20.038 1.00 0.00 H new ATOM 0 HA ALA A 67 -2.999 3.568 -20.226 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.617 3.287 -20.917 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -1.028 2.244 -19.535 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -0.906 1.550 -21.169 1.00 0.00 H new ATOM 1120 N GLU A 68 -3.140 2.053 -23.167 1.00 0.00 N ATOM 1121 CA GLU A 68 -3.484 2.254 -24.593 1.00 0.00 C ATOM 1122 C GLU A 68 -4.898 2.836 -24.725 1.00 0.00 C ATOM 1123 O GLU A 68 -5.156 3.695 -25.580 1.00 0.00 O ATOM 1124 CB GLU A 68 -3.381 0.944 -25.418 1.00 0.00 C ATOM 1125 CG GLU A 68 -1.996 0.268 -25.384 1.00 0.00 C ATOM 1126 CD GLU A 68 -1.807 -0.804 -26.472 1.00 0.00 C ATOM 1127 OE1 GLU A 68 -1.979 -0.485 -27.675 1.00 0.00 O ATOM 1128 OE2 GLU A 68 -1.504 -1.969 -26.138 1.00 0.00 O ATOM 0 H GLU A 68 -3.048 1.073 -22.898 1.00 0.00 H new ATOM 0 HA GLU A 68 -2.756 2.957 -24.997 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -4.124 0.238 -25.047 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -3.638 1.162 -26.454 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -1.226 1.031 -25.499 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -1.848 -0.189 -24.406 1.00 0.00 H new ATOM 1135 N PHE A 69 -5.800 2.372 -23.855 1.00 0.00 N ATOM 1136 CA PHE A 69 -7.175 2.864 -23.807 1.00 0.00 C ATOM 1137 C PHE A 69 -7.230 4.343 -23.324 1.00 0.00 C ATOM 1138 O PHE A 69 -8.019 5.142 -23.848 1.00 0.00 O ATOM 1139 CB PHE A 69 -8.020 1.944 -22.895 1.00 0.00 C ATOM 1140 CG PHE A 69 -9.468 2.378 -22.767 1.00 0.00 C ATOM 1141 CD1 PHE A 69 -10.244 2.562 -23.908 1.00 0.00 C ATOM 1142 CD2 PHE A 69 -10.046 2.627 -21.522 1.00 0.00 C ATOM 1143 CE1 PHE A 69 -11.541 2.982 -23.810 1.00 0.00 C ATOM 1144 CE2 PHE A 69 -11.353 3.050 -21.428 1.00 0.00 C ATOM 1145 CZ PHE A 69 -12.098 3.223 -22.575 1.00 0.00 C ATOM 0 H PHE A 69 -5.596 1.647 -23.167 1.00 0.00 H new ATOM 0 HA PHE A 69 -7.592 2.843 -24.814 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -7.988 0.928 -23.288 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -7.569 1.916 -21.903 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -9.817 2.371 -24.881 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -9.463 2.487 -20.624 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -12.130 3.125 -24.704 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -11.792 3.245 -20.461 1.00 0.00 H new ATOM 0 HZ PHE A 69 -13.125 3.550 -22.504 1.00 0.00 H new ATOM 1155 N VAL A 70 -6.372 4.688 -22.343 1.00 0.00 N ATOM 1156 CA VAL A 70 -6.299 6.048 -21.762 1.00 0.00 C ATOM 1157 C VAL A 70 -5.836 7.066 -22.817 1.00 0.00 C ATOM 1158 O VAL A 70 -6.510 8.071 -23.040 1.00 0.00 O ATOM 1159 CB VAL A 70 -5.332 6.093 -20.515 1.00 0.00 C ATOM 1160 CG1 VAL A 70 -5.029 7.537 -20.070 1.00 0.00 C ATOM 1161 CG2 VAL A 70 -5.890 5.282 -19.330 1.00 0.00 C ATOM 0 H VAL A 70 -5.709 4.033 -21.929 1.00 0.00 H new ATOM 0 HA VAL A 70 -7.302 6.312 -21.427 1.00 0.00 H new ATOM 0 HB VAL A 70 -4.397 5.634 -20.837 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -4.360 7.520 -19.209 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -4.553 8.078 -20.888 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -5.959 8.036 -19.797 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -5.196 5.338 -18.492 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -6.854 5.692 -19.030 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -6.015 4.241 -19.628 1.00 0.00 H new ATOM 1171 N GLN A 71 -4.699 6.763 -23.480 1.00 0.00 N ATOM 1172 CA GLN A 71 -4.084 7.661 -24.488 1.00 0.00 C ATOM 1173 C GLN A 71 -5.070 7.934 -25.651 1.00 0.00 C ATOM 1174 O GLN A 71 -5.153 9.061 -26.149 1.00 0.00 O ATOM 1175 CB GLN A 71 -2.739 7.077 -25.014 1.00 0.00 C ATOM 1176 CG GLN A 71 -2.891 5.780 -25.822 1.00 0.00 C ATOM 1177 CD GLN A 71 -1.588 5.231 -26.393 1.00 0.00 C ATOM 1178 OE1 GLN A 71 -0.906 4.387 -25.635 1.00 0.00 O flip ATOM 1179 NE2 GLN A 71 -1.198 5.563 -27.511 1.00 0.00 N flip ATOM 0 H GLN A 71 -4.183 5.895 -23.335 1.00 0.00 H new ATOM 0 HA GLN A 71 -3.862 8.612 -24.004 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -2.250 7.825 -25.637 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -2.081 6.889 -24.166 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -3.341 5.020 -25.183 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -3.585 5.958 -26.643 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -1.748 6.216 -28.070 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -0.325 5.186 -27.880 1.00 0.00 H new ATOM 1188 N SER A 72 -5.853 6.895 -26.030 1.00 0.00 N ATOM 1189 CA SER A 72 -6.911 7.024 -27.048 1.00 0.00 C ATOM 1190 C SER A 72 -7.989 8.002 -26.559 1.00 0.00 C ATOM 1191 O SER A 72 -8.190 9.046 -27.159 1.00 0.00 O ATOM 1192 CB SER A 72 -7.541 5.645 -27.348 1.00 0.00 C ATOM 1193 OG SER A 72 -6.575 4.727 -27.825 1.00 0.00 O ATOM 0 H SER A 72 -5.767 5.956 -25.641 1.00 0.00 H new ATOM 0 HA SER A 72 -6.469 7.410 -27.967 1.00 0.00 H new ATOM 0 HB2 SER A 72 -8.004 5.251 -26.443 1.00 0.00 H new ATOM 0 HB3 SER A 72 -8.333 5.759 -28.088 1.00 0.00 H new ATOM 0 HG SER A 72 -6.072 4.359 -27.069 1.00 0.00 H new ATOM 1199 N LEU A 73 -8.587 7.686 -25.394 1.00 0.00 N ATOM 1200 CA LEU A 73 -9.725 8.438 -24.801 1.00 0.00 C ATOM 1201 C LEU A 73 -9.338 9.920 -24.504 1.00 0.00 C ATOM 1202 O LEU A 73 -10.178 10.831 -24.527 1.00 0.00 O ATOM 1203 CB LEU A 73 -10.203 7.703 -23.496 1.00 0.00 C ATOM 1204 CG LEU A 73 -11.744 7.533 -23.305 1.00 0.00 C ATOM 1205 CD1 LEU A 73 -12.077 6.728 -22.028 1.00 0.00 C ATOM 1206 CD2 LEU A 73 -12.474 8.879 -23.314 1.00 0.00 C ATOM 0 H LEU A 73 -8.294 6.891 -24.826 1.00 0.00 H new ATOM 0 HA LEU A 73 -10.544 8.465 -25.519 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -9.748 6.713 -23.478 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -9.813 8.249 -22.637 1.00 0.00 H new ATOM 0 HG LEU A 73 -12.105 6.961 -24.160 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.158 6.631 -21.930 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -11.629 5.737 -22.096 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -11.679 7.247 -21.156 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -13.543 8.714 -23.178 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.097 9.503 -22.503 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -12.302 9.380 -24.267 1.00 0.00 H new ATOM 1218 N SER A 74 -8.044 10.121 -24.283 1.00 0.00 N ATOM 1219 CA SER A 74 -7.440 11.420 -23.941 1.00 0.00 C ATOM 1220 C SER A 74 -7.405 12.346 -25.150 1.00 0.00 C ATOM 1221 O SER A 74 -7.750 13.519 -25.057 1.00 0.00 O ATOM 1222 CB SER A 74 -6.009 11.192 -23.416 1.00 0.00 C ATOM 1223 OG SER A 74 -5.250 12.389 -23.318 1.00 0.00 O ATOM 0 H SER A 74 -7.359 9.367 -24.336 1.00 0.00 H new ATOM 0 HA SER A 74 -8.048 11.894 -23.171 1.00 0.00 H new ATOM 0 HB2 SER A 74 -6.060 10.721 -22.434 1.00 0.00 H new ATOM 0 HB3 SER A 74 -5.493 10.496 -24.077 1.00 0.00 H new ATOM 0 HG SER A 74 -5.768 13.066 -22.834 1.00 0.00 H new ATOM 1229 N GLN A 75 -6.979 11.795 -26.286 1.00 0.00 N ATOM 1230 CA GLN A 75 -6.811 12.565 -27.531 1.00 0.00 C ATOM 1231 C GLN A 75 -8.162 12.654 -28.261 1.00 0.00 C ATOM 1232 O GLN A 75 -8.401 13.555 -29.069 1.00 0.00 O ATOM 1233 CB GLN A 75 -5.732 11.891 -28.412 1.00 0.00 C ATOM 1234 CG GLN A 75 -4.355 11.715 -27.736 1.00 0.00 C ATOM 1235 CD GLN A 75 -3.747 13.014 -27.200 1.00 0.00 C ATOM 1236 OE1 GLN A 75 -3.040 13.721 -27.914 1.00 0.00 O ATOM 1237 NE2 GLN A 75 -4.018 13.337 -25.940 1.00 0.00 N ATOM 0 H GLN A 75 -6.740 10.807 -26.376 1.00 0.00 H new ATOM 0 HA GLN A 75 -6.479 13.579 -27.307 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -6.096 10.911 -28.721 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -5.602 12.483 -29.318 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -4.455 11.007 -26.913 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -3.664 11.273 -28.454 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -4.609 12.728 -25.373 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -3.635 14.194 -25.539 1.00 0.00 H new ATOM 1246 N THR A 76 -9.034 11.704 -27.920 1.00 0.00 N ATOM 1247 CA THR A 76 -10.405 11.603 -28.401 1.00 0.00 C ATOM 1248 C THR A 76 -11.282 12.769 -27.881 1.00 0.00 C ATOM 1249 O THR A 76 -11.927 13.459 -28.673 1.00 0.00 O ATOM 1250 CB THR A 76 -10.964 10.211 -27.954 1.00 0.00 C ATOM 1251 OG1 THR A 76 -10.434 9.175 -28.800 1.00 0.00 O ATOM 1252 CG2 THR A 76 -12.479 10.121 -27.922 1.00 0.00 C ATOM 0 H THR A 76 -8.790 10.954 -27.273 1.00 0.00 H new ATOM 0 HA THR A 76 -10.426 11.680 -29.488 1.00 0.00 H new ATOM 0 HB THR A 76 -10.635 10.078 -26.923 1.00 0.00 H new ATOM 0 HG1 THR A 76 -9.562 8.887 -28.457 1.00 0.00 H new ATOM 0 HG21 THR A 76 -12.778 9.123 -27.602 1.00 0.00 H new ATOM 0 HG22 THR A 76 -12.873 10.859 -27.223 1.00 0.00 H new ATOM 0 HG23 THR A 76 -12.876 10.316 -28.918 1.00 0.00 H new ATOM 1260 N MET A 77 -11.286 12.982 -26.548 1.00 0.00 N ATOM 1261 CA MET A 77 -12.166 13.990 -25.897 1.00 0.00 C ATOM 1262 C MET A 77 -11.390 15.261 -25.518 1.00 0.00 C ATOM 1263 O MET A 77 -11.992 16.309 -25.286 1.00 0.00 O ATOM 1264 CB MET A 77 -12.834 13.400 -24.628 1.00 0.00 C ATOM 1265 CG MET A 77 -13.720 12.175 -24.859 1.00 0.00 C ATOM 1266 SD MET A 77 -14.707 11.775 -23.403 1.00 0.00 S ATOM 1267 CE MET A 77 -15.652 10.368 -23.977 1.00 0.00 C ATOM 0 H MET A 77 -10.691 12.471 -25.896 1.00 0.00 H new ATOM 0 HA MET A 77 -12.935 14.257 -26.622 1.00 0.00 H new ATOM 0 HB2 MET A 77 -12.052 13.132 -23.918 1.00 0.00 H new ATOM 0 HB3 MET A 77 -13.436 14.179 -24.160 1.00 0.00 H new ATOM 0 HG2 MET A 77 -14.381 12.359 -25.706 1.00 0.00 H new ATOM 0 HG3 MET A 77 -13.097 11.320 -25.121 1.00 0.00 H new ATOM 0 HE1 MET A 77 -16.083 9.846 -23.123 1.00 0.00 H new ATOM 0 HE2 MET A 77 -16.451 10.710 -24.634 1.00 0.00 H new ATOM 0 HE3 MET A 77 -14.998 9.689 -24.524 1.00 0.00 H new ATOM 1277 N GLY A 78 -10.056 15.158 -25.453 1.00 0.00 N ATOM 1278 CA GLY A 78 -9.207 16.270 -24.995 1.00 0.00 C ATOM 1279 C GLY A 78 -8.920 16.227 -23.493 1.00 0.00 C ATOM 1280 O GLY A 78 -8.232 17.105 -22.970 1.00 0.00 O ATOM 0 H GLY A 78 -9.540 14.317 -25.711 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -8.263 16.247 -25.540 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -9.693 17.215 -25.239 1.00 0.00 H new ATOM 1284 N PHE A 79 -9.439 15.187 -22.806 1.00 0.00 N ATOM 1285 CA PHE A 79 -9.226 14.970 -21.352 1.00 0.00 C ATOM 1286 C PHE A 79 -7.748 14.605 -21.082 1.00 0.00 C ATOM 1287 O PHE A 79 -7.116 13.983 -21.936 1.00 0.00 O ATOM 1288 CB PHE A 79 -10.184 13.850 -20.829 1.00 0.00 C ATOM 1289 CG PHE A 79 -11.622 14.302 -20.563 1.00 0.00 C ATOM 1290 CD1 PHE A 79 -12.386 14.909 -21.554 1.00 0.00 C ATOM 1291 CD2 PHE A 79 -12.212 14.112 -19.310 1.00 0.00 C ATOM 1292 CE1 PHE A 79 -13.685 15.311 -21.308 1.00 0.00 C ATOM 1293 CE2 PHE A 79 -13.512 14.510 -19.069 1.00 0.00 C ATOM 1294 CZ PHE A 79 -14.249 15.109 -20.063 1.00 0.00 C ATOM 0 H PHE A 79 -10.019 14.470 -23.242 1.00 0.00 H new ATOM 0 HA PHE A 79 -9.454 15.891 -20.815 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -10.203 13.039 -21.557 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -9.771 13.441 -19.907 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -11.957 15.069 -22.532 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -11.643 13.647 -18.519 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -14.260 15.784 -22.090 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -13.952 14.350 -18.096 1.00 0.00 H new ATOM 0 HZ PHE A 79 -15.265 15.421 -19.871 1.00 0.00 H new ATOM 1304 N PRO A 80 -7.168 14.998 -19.909 1.00 0.00 N ATOM 1305 CA PRO A 80 -5.743 14.712 -19.611 1.00 0.00 C ATOM 1306 C PRO A 80 -5.490 13.205 -19.353 1.00 0.00 C ATOM 1307 O PRO A 80 -6.088 12.623 -18.453 1.00 0.00 O ATOM 1308 CB PRO A 80 -5.474 15.573 -18.350 1.00 0.00 C ATOM 1309 CG PRO A 80 -6.813 15.719 -17.683 1.00 0.00 C ATOM 1310 CD PRO A 80 -7.832 15.755 -18.799 1.00 0.00 C ATOM 0 HA PRO A 80 -5.078 14.951 -20.441 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -4.755 15.090 -17.689 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -5.059 16.545 -18.617 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -7.005 14.886 -17.006 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -6.855 16.631 -17.087 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -8.770 15.287 -18.500 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -8.066 16.778 -19.095 1.00 0.00 H new ATOM 1318 N GLN A 81 -4.566 12.603 -20.139 1.00 0.00 N ATOM 1319 CA GLN A 81 -4.205 11.167 -20.026 1.00 0.00 C ATOM 1320 C GLN A 81 -3.549 10.854 -18.672 1.00 0.00 C ATOM 1321 O GLN A 81 -3.665 9.744 -18.143 1.00 0.00 O ATOM 1322 CB GLN A 81 -3.256 10.746 -21.182 1.00 0.00 C ATOM 1323 CG GLN A 81 -1.954 11.567 -21.301 1.00 0.00 C ATOM 1324 CD GLN A 81 -0.996 11.079 -22.400 1.00 0.00 C ATOM 1325 OE1 GLN A 81 0.227 11.155 -22.247 1.00 0.00 O ATOM 1326 NE2 GLN A 81 -1.532 10.607 -23.529 1.00 0.00 N ATOM 0 H GLN A 81 -4.050 13.096 -20.868 1.00 0.00 H new ATOM 0 HA GLN A 81 -5.130 10.594 -20.097 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -2.993 9.696 -21.050 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -3.801 10.822 -22.123 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -2.211 12.608 -21.496 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -1.433 11.541 -20.344 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -2.546 10.555 -23.629 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -0.928 10.299 -24.291 1.00 0.00 H new ATOM 1335 N ASP A 82 -2.858 11.860 -18.136 1.00 0.00 N ATOM 1336 CA ASP A 82 -2.171 11.777 -16.845 1.00 0.00 C ATOM 1337 C ASP A 82 -3.179 11.669 -15.676 1.00 0.00 C ATOM 1338 O ASP A 82 -2.862 11.091 -14.631 1.00 0.00 O ATOM 1339 CB ASP A 82 -1.255 13.016 -16.675 1.00 0.00 C ATOM 1340 CG ASP A 82 -0.408 12.999 -15.387 1.00 0.00 C ATOM 1341 OD1 ASP A 82 0.486 12.134 -15.263 1.00 0.00 O ATOM 1342 OD2 ASP A 82 -0.629 13.852 -14.498 1.00 0.00 O ATOM 0 H ASP A 82 -2.758 12.767 -18.591 1.00 0.00 H new ATOM 0 HA ASP A 82 -1.562 10.873 -16.826 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -0.588 13.083 -17.535 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -1.872 13.914 -16.680 1.00 0.00 H new ATOM 1347 N GLN A 83 -4.410 12.184 -15.883 1.00 0.00 N ATOM 1348 CA GLN A 83 -5.421 12.308 -14.813 1.00 0.00 C ATOM 1349 C GLN A 83 -6.759 11.598 -15.174 1.00 0.00 C ATOM 1350 O GLN A 83 -7.708 11.693 -14.397 1.00 0.00 O ATOM 1351 CB GLN A 83 -5.656 13.825 -14.503 1.00 0.00 C ATOM 1352 CG GLN A 83 -6.346 14.111 -13.151 1.00 0.00 C ATOM 1353 CD GLN A 83 -6.647 15.590 -12.931 1.00 0.00 C ATOM 1354 OE1 GLN A 83 -5.827 16.332 -12.394 1.00 0.00 O ATOM 1355 NE2 GLN A 83 -7.824 16.032 -13.348 1.00 0.00 N ATOM 0 H GLN A 83 -4.729 12.523 -16.791 1.00 0.00 H new ATOM 0 HA GLN A 83 -5.040 11.805 -13.924 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -4.694 14.338 -14.520 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -6.261 14.255 -15.302 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -7.277 13.546 -13.099 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -5.709 13.752 -12.342 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -8.482 15.390 -13.790 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -8.072 17.014 -13.227 1.00 0.00 H new ATOM 1364 N ILE A 84 -6.829 10.863 -16.327 1.00 0.00 N ATOM 1365 CA ILE A 84 -8.077 10.148 -16.749 1.00 0.00 C ATOM 1366 C ILE A 84 -8.607 9.239 -15.610 1.00 0.00 C ATOM 1367 O ILE A 84 -7.935 8.295 -15.178 1.00 0.00 O ATOM 1368 CB ILE A 84 -7.905 9.336 -18.120 1.00 0.00 C ATOM 1369 CG1 ILE A 84 -8.081 10.299 -19.353 1.00 0.00 C ATOM 1370 CG2 ILE A 84 -8.860 8.113 -18.230 1.00 0.00 C ATOM 1371 CD1 ILE A 84 -8.320 9.632 -20.706 1.00 0.00 C ATOM 0 H ILE A 84 -6.047 10.751 -16.973 1.00 0.00 H new ATOM 0 HA ILE A 84 -8.823 10.917 -16.949 1.00 0.00 H new ATOM 0 HB ILE A 84 -6.893 8.932 -18.122 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -8.918 10.967 -19.148 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -7.189 10.921 -19.431 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -8.694 7.606 -19.181 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -8.662 7.422 -17.411 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -9.894 8.453 -18.176 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -8.425 10.397 -21.475 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -7.475 8.988 -20.948 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -9.231 9.035 -20.661 1.00 0.00 H new ATOM 1383 N ARG A 85 -9.808 9.587 -15.107 1.00 0.00 N ATOM 1384 CA ARG A 85 -10.454 8.908 -13.975 1.00 0.00 C ATOM 1385 C ARG A 85 -11.584 8.026 -14.497 1.00 0.00 C ATOM 1386 O ARG A 85 -12.569 8.520 -15.057 1.00 0.00 O ATOM 1387 CB ARG A 85 -10.994 9.952 -12.948 1.00 0.00 C ATOM 1388 CG ARG A 85 -9.905 10.616 -12.080 1.00 0.00 C ATOM 1389 CD ARG A 85 -10.453 11.770 -11.214 1.00 0.00 C ATOM 1390 NE ARG A 85 -9.457 12.246 -10.230 1.00 0.00 N ATOM 1391 CZ ARG A 85 -8.933 13.486 -10.165 1.00 0.00 C ATOM 1392 NH1 ARG A 85 -9.172 14.390 -11.115 1.00 0.00 N ATOM 1393 NH2 ARG A 85 -8.136 13.796 -9.151 1.00 0.00 N ATOM 0 H ARG A 85 -10.360 10.358 -15.483 1.00 0.00 H new ATOM 0 HA ARG A 85 -9.723 8.284 -13.462 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -11.534 10.729 -13.489 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -11.713 9.460 -12.293 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -9.454 9.864 -11.432 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -9.114 10.996 -12.726 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -10.750 12.597 -11.858 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -11.349 11.436 -10.690 1.00 0.00 H new ATOM 0 HE ARG A 85 -9.136 11.572 -9.535 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -9.762 14.149 -11.911 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -8.765 15.323 -11.045 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -7.928 13.100 -8.435 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -7.731 14.730 -9.087 1.00 0.00 H new ATOM 1407 N LEU A 86 -11.407 6.718 -14.350 1.00 0.00 N ATOM 1408 CA LEU A 86 -12.395 5.727 -14.756 1.00 0.00 C ATOM 1409 C LEU A 86 -13.300 5.384 -13.556 1.00 0.00 C ATOM 1410 O LEU A 86 -12.818 5.289 -12.414 1.00 0.00 O ATOM 1411 CB LEU A 86 -11.688 4.453 -15.307 1.00 0.00 C ATOM 1412 CG LEU A 86 -10.724 4.651 -16.535 1.00 0.00 C ATOM 1413 CD1 LEU A 86 -9.299 5.071 -16.091 1.00 0.00 C ATOM 1414 CD2 LEU A 86 -10.685 3.387 -17.428 1.00 0.00 C ATOM 0 H LEU A 86 -10.565 6.312 -13.942 1.00 0.00 H new ATOM 0 HA LEU A 86 -13.014 6.136 -15.555 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -11.116 4.004 -14.495 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -12.456 3.734 -15.591 1.00 0.00 H new ATOM 0 HG LEU A 86 -11.128 5.469 -17.132 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -8.666 5.197 -16.970 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -9.351 6.012 -15.544 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -8.876 4.300 -15.447 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -10.010 3.555 -18.268 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -10.331 2.539 -16.842 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -11.686 3.176 -17.804 1.00 0.00 H new ATOM 1426 N TRP A 87 -14.613 5.242 -13.810 1.00 0.00 N ATOM 1427 CA TRP A 87 -15.617 4.843 -12.799 1.00 0.00 C ATOM 1428 C TRP A 87 -16.579 3.825 -13.439 1.00 0.00 C ATOM 1429 O TRP A 87 -17.337 4.210 -14.320 1.00 0.00 O ATOM 1430 CB TRP A 87 -16.449 6.073 -12.318 1.00 0.00 C ATOM 1431 CG TRP A 87 -15.680 7.139 -11.577 1.00 0.00 C ATOM 1432 CD1 TRP A 87 -14.939 8.162 -12.110 1.00 0.00 C ATOM 1433 CD2 TRP A 87 -15.618 7.302 -10.158 1.00 0.00 C ATOM 1434 NE1 TRP A 87 -14.412 8.933 -11.106 1.00 0.00 N ATOM 1435 CE2 TRP A 87 -14.820 8.429 -9.900 1.00 0.00 C ATOM 1436 CE3 TRP A 87 -16.159 6.592 -9.083 1.00 0.00 C ATOM 1437 CZ2 TRP A 87 -14.542 8.855 -8.603 1.00 0.00 C ATOM 1438 CZ3 TRP A 87 -15.897 7.027 -7.803 1.00 0.00 C ATOM 1439 CH2 TRP A 87 -15.098 8.149 -7.569 1.00 0.00 C ATOM 0 H TRP A 87 -15.015 5.402 -14.734 1.00 0.00 H new ATOM 0 HA TRP A 87 -15.098 4.413 -11.942 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -16.921 6.531 -13.188 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -17.251 5.715 -11.672 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -14.792 8.335 -13.166 1.00 0.00 H new ATOM 0 HE1 TRP A 87 -13.814 9.749 -11.236 1.00 0.00 H new ATOM 0 HE3 TRP A 87 -16.771 5.719 -9.253 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 -13.910 9.712 -8.419 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 -16.317 6.491 -6.965 1.00 0.00 H new ATOM 0 HH2 TRP A 87 -14.915 8.466 -6.553 1.00 0.00 H new ATOM 1450 N PRO A 88 -16.597 2.523 -13.020 1.00 0.00 N ATOM 1451 CA PRO A 88 -17.439 1.488 -13.685 1.00 0.00 C ATOM 1452 C PRO A 88 -18.933 1.670 -13.369 1.00 0.00 C ATOM 1453 O PRO A 88 -19.284 2.485 -12.500 1.00 0.00 O ATOM 1454 CB PRO A 88 -16.867 0.165 -13.126 1.00 0.00 C ATOM 1455 CG PRO A 88 -16.320 0.515 -11.773 1.00 0.00 C ATOM 1456 CD PRO A 88 -15.848 1.959 -11.864 1.00 0.00 C ATOM 0 HA PRO A 88 -17.400 1.534 -14.773 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -17.641 -0.599 -13.053 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -16.087 -0.233 -13.775 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -17.084 0.403 -11.004 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -15.497 -0.147 -11.503 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -16.064 2.506 -10.946 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -14.771 2.015 -12.023 1.00 0.00 H new ATOM 1464 N MET A 89 -19.815 0.964 -14.118 1.00 0.00 N ATOM 1465 CA MET A 89 -21.257 0.910 -13.804 1.00 0.00 C ATOM 1466 C MET A 89 -21.464 0.233 -12.421 1.00 0.00 C ATOM 1467 O MET A 89 -21.682 -0.976 -12.286 1.00 0.00 O ATOM 1468 CB MET A 89 -22.113 0.262 -14.951 1.00 0.00 C ATOM 1469 CG MET A 89 -21.918 -1.248 -15.275 1.00 0.00 C ATOM 1470 SD MET A 89 -20.402 -1.650 -16.189 1.00 0.00 S ATOM 1471 CE MET A 89 -19.241 -2.051 -14.887 1.00 0.00 C ATOM 0 H MET A 89 -19.549 0.426 -14.943 1.00 0.00 H new ATOM 0 HA MET A 89 -21.632 1.931 -13.738 1.00 0.00 H new ATOM 0 HB2 MET A 89 -23.164 0.413 -14.703 1.00 0.00 H new ATOM 0 HB3 MET A 89 -21.918 0.823 -15.865 1.00 0.00 H new ATOM 0 HG2 MET A 89 -21.919 -1.807 -14.340 1.00 0.00 H new ATOM 0 HG3 MET A 89 -22.775 -1.593 -15.854 1.00 0.00 H new ATOM 0 HE1 MET A 89 -18.330 -1.467 -15.019 1.00 0.00 H new ATOM 0 HE2 MET A 89 -19.685 -1.817 -13.919 1.00 0.00 H new ATOM 0 HE3 MET A 89 -19.000 -3.113 -14.928 1.00 0.00 H new ATOM 1638 N ALA A 100 -15.404 3.458 -5.433 1.00 0.00 N ATOM 1639 CA ALA A 100 -14.062 4.039 -5.637 1.00 0.00 C ATOM 1640 C ALA A 100 -13.723 4.104 -7.128 1.00 0.00 C ATOM 1641 O ALA A 100 -14.269 3.339 -7.934 1.00 0.00 O ATOM 1642 CB ALA A 100 -13.013 3.223 -4.867 1.00 0.00 C ATOM 0 HA ALA A 100 -14.057 5.058 -5.250 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -12.026 3.659 -5.023 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -13.251 3.236 -3.803 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -13.016 2.194 -5.227 1.00 0.00 H new ATOM 1648 N MET A 101 -12.822 5.035 -7.485 1.00 0.00 N ATOM 1649 CA MET A 101 -12.289 5.151 -8.851 1.00 0.00 C ATOM 1650 C MET A 101 -11.238 4.056 -9.099 1.00 0.00 C ATOM 1651 O MET A 101 -10.833 3.336 -8.171 1.00 0.00 O ATOM 1652 CB MET A 101 -11.669 6.561 -9.102 1.00 0.00 C ATOM 1653 CG MET A 101 -10.360 6.859 -8.340 1.00 0.00 C ATOM 1654 SD MET A 101 -10.551 6.861 -6.538 1.00 0.00 S ATOM 1655 CE MET A 101 -11.522 8.344 -6.251 1.00 0.00 C ATOM 0 H MET A 101 -12.444 5.726 -6.836 1.00 0.00 H new ATOM 0 HA MET A 101 -13.116 5.021 -9.549 1.00 0.00 H new ATOM 0 HB2 MET A 101 -11.480 6.670 -10.170 1.00 0.00 H new ATOM 0 HB3 MET A 101 -12.407 7.316 -8.830 1.00 0.00 H new ATOM 0 HG2 MET A 101 -9.612 6.116 -8.616 1.00 0.00 H new ATOM 0 HG3 MET A 101 -9.978 7.829 -8.657 1.00 0.00 H new ATOM 0 HE1 MET A 101 -11.154 8.853 -5.361 1.00 0.00 H new ATOM 0 HE2 MET A 101 -11.435 9.008 -7.111 1.00 0.00 H new ATOM 0 HE3 MET A 101 -12.568 8.072 -6.107 1.00 0.00 H new ATOM 1665 N LEU A 102 -10.812 3.937 -10.354 1.00 0.00 N ATOM 1666 CA LEU A 102 -9.751 2.997 -10.751 1.00 0.00 C ATOM 1667 C LEU A 102 -8.356 3.552 -10.369 1.00 0.00 C ATOM 1668 O LEU A 102 -8.143 4.774 -10.325 1.00 0.00 O ATOM 1669 CB LEU A 102 -9.850 2.663 -12.274 1.00 0.00 C ATOM 1670 CG LEU A 102 -10.914 1.593 -12.693 1.00 0.00 C ATOM 1671 CD1 LEU A 102 -10.682 0.260 -11.974 1.00 0.00 C ATOM 1672 CD2 LEU A 102 -12.342 2.093 -12.463 1.00 0.00 C ATOM 0 H LEU A 102 -11.188 4.485 -11.128 1.00 0.00 H new ATOM 0 HA LEU A 102 -9.890 2.064 -10.205 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -10.067 3.586 -12.811 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.872 2.320 -12.611 1.00 0.00 H new ATOM 0 HG LEU A 102 -10.791 1.424 -13.763 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -11.438 -0.459 -12.288 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -9.692 -0.121 -12.225 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -10.750 0.411 -10.897 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -13.051 1.322 -12.766 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -12.482 2.320 -11.406 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -12.512 2.994 -13.053 1.00 0.00 H new ATOM 1684 N ASP A 103 -7.428 2.625 -10.070 1.00 0.00 N ATOM 1685 CA ASP A 103 -6.061 2.943 -9.612 1.00 0.00 C ATOM 1686 C ASP A 103 -5.137 3.030 -10.819 1.00 0.00 C ATOM 1687 O ASP A 103 -4.677 2.005 -11.306 1.00 0.00 O ATOM 1688 CB ASP A 103 -5.549 1.863 -8.616 1.00 0.00 C ATOM 1689 CG ASP A 103 -6.326 1.873 -7.293 1.00 0.00 C ATOM 1690 OD1 ASP A 103 -6.105 2.792 -6.479 1.00 0.00 O ATOM 1691 OD2 ASP A 103 -7.178 0.979 -7.071 1.00 0.00 O ATOM 0 H ASP A 103 -7.607 1.623 -10.140 1.00 0.00 H new ATOM 0 HA ASP A 103 -6.072 3.901 -9.092 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -5.633 0.879 -9.076 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -4.491 2.031 -8.414 1.00 0.00 H new ATOM 1696 N ASN A 104 -4.854 4.256 -11.280 1.00 0.00 N ATOM 1697 CA ASN A 104 -4.123 4.514 -12.546 1.00 0.00 C ATOM 1698 C ASN A 104 -2.690 3.891 -12.551 1.00 0.00 C ATOM 1699 O ASN A 104 -2.037 3.810 -13.596 1.00 0.00 O ATOM 1700 CB ASN A 104 -4.077 6.046 -12.806 1.00 0.00 C ATOM 1701 CG ASN A 104 -3.518 6.451 -14.182 1.00 0.00 C ATOM 1702 OD1 ASN A 104 -2.859 7.482 -14.304 1.00 0.00 O ATOM 1703 ND2 ASN A 104 -3.796 5.668 -15.229 1.00 0.00 N ATOM 0 H ASN A 104 -5.124 5.108 -10.788 1.00 0.00 H new ATOM 0 HA ASN A 104 -4.662 4.024 -13.356 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -5.085 6.448 -12.707 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -3.470 6.514 -12.031 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -3.459 5.920 -16.158 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -4.345 4.818 -15.099 1.00 0.00 H new ATOM 1710 N GLU A 105 -2.203 3.458 -11.372 1.00 0.00 N ATOM 1711 CA GLU A 105 -0.986 2.635 -11.276 1.00 0.00 C ATOM 1712 C GLU A 105 -1.276 1.204 -11.751 1.00 0.00 C ATOM 1713 O GLU A 105 -0.599 0.698 -12.661 1.00 0.00 O ATOM 1714 CB GLU A 105 -0.439 2.614 -9.835 1.00 0.00 C ATOM 1715 CG GLU A 105 0.870 1.810 -9.655 1.00 0.00 C ATOM 1716 CD GLU A 105 2.004 2.264 -10.604 1.00 0.00 C ATOM 1717 OE1 GLU A 105 2.553 3.370 -10.405 1.00 0.00 O ATOM 1718 OE2 GLU A 105 2.347 1.522 -11.548 1.00 0.00 O ATOM 0 H GLU A 105 -2.636 3.666 -10.472 1.00 0.00 H new ATOM 0 HA GLU A 105 -0.227 3.079 -11.920 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -0.267 3.640 -9.511 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -1.201 2.195 -9.177 1.00 0.00 H new ATOM 0 HG2 GLU A 105 1.209 1.907 -8.623 1.00 0.00 H new ATOM 0 HG3 GLU A 105 0.665 0.753 -9.825 1.00 0.00 H new ATOM 1725 N ALA A 106 -2.291 0.571 -11.120 1.00 0.00 N ATOM 1726 CA ALA A 106 -2.723 -0.788 -11.467 1.00 0.00 C ATOM 1727 C ALA A 106 -3.135 -0.837 -12.944 1.00 0.00 C ATOM 1728 O ALA A 106 -2.472 -1.444 -13.786 1.00 0.00 O ATOM 1729 CB ALA A 106 -3.879 -1.246 -10.557 1.00 0.00 C ATOM 0 H ALA A 106 -2.827 0.992 -10.361 1.00 0.00 H new ATOM 0 HA ALA A 106 -1.890 -1.474 -11.311 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -4.182 -2.256 -10.834 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -3.549 -1.238 -9.518 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.725 -0.569 -10.675 1.00 0.00 H new ATOM 1735 N ASP A 107 -4.177 -0.061 -13.256 1.00 0.00 N ATOM 1736 CA ASP A 107 -4.770 0.048 -14.595 1.00 0.00 C ATOM 1737 C ASP A 107 -4.122 1.179 -15.410 1.00 0.00 C ATOM 1738 O ASP A 107 -4.781 1.905 -16.145 1.00 0.00 O ATOM 1739 CB ASP A 107 -6.311 0.184 -14.491 1.00 0.00 C ATOM 1740 CG ASP A 107 -6.800 1.101 -13.372 1.00 0.00 C ATOM 1741 OD1 ASP A 107 -6.826 2.335 -13.570 1.00 0.00 O ATOM 1742 OD2 ASP A 107 -7.135 0.576 -12.272 1.00 0.00 O ATOM 0 H ASP A 107 -4.646 0.526 -12.566 1.00 0.00 H new ATOM 0 HA ASP A 107 -4.563 -0.870 -15.145 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -6.693 0.558 -15.441 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -6.740 -0.807 -14.343 1.00 0.00 H new ATOM 1747 N GLY A 108 -2.813 1.321 -15.251 1.00 0.00 N ATOM 1748 CA GLY A 108 -1.978 2.030 -16.223 1.00 0.00 C ATOM 1749 C GLY A 108 -0.827 1.153 -16.683 1.00 0.00 C ATOM 1750 O GLY A 108 0.005 1.580 -17.482 1.00 0.00 O ATOM 0 H GLY A 108 -2.298 0.952 -14.451 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -2.582 2.326 -17.081 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -1.589 2.945 -15.776 1.00 0.00 H new ATOM 1754 N ASN A 109 -0.790 -0.098 -16.177 1.00 0.00 N ATOM 1755 CA ASN A 109 0.336 -1.030 -16.384 1.00 0.00 C ATOM 1756 C ASN A 109 -0.130 -2.342 -17.043 1.00 0.00 C ATOM 1757 O ASN A 109 0.607 -2.932 -17.842 1.00 0.00 O ATOM 1758 CB ASN A 109 1.024 -1.315 -15.020 1.00 0.00 C ATOM 1759 CG ASN A 109 2.280 -2.193 -15.135 1.00 0.00 C ATOM 1760 OD1 ASN A 109 3.377 -1.707 -15.406 1.00 0.00 O ATOM 1761 ND2 ASN A 109 2.128 -3.488 -14.908 1.00 0.00 N ATOM 0 H ASN A 109 -1.543 -0.490 -15.612 1.00 0.00 H new ATOM 0 HA ASN A 109 1.052 -0.566 -17.062 1.00 0.00 H new ATOM 0 HB2 ASN A 109 1.295 -0.367 -14.554 1.00 0.00 H new ATOM 0 HB3 ASN A 109 0.309 -1.803 -14.357 1.00 0.00 H new ATOM 0 HD21 ASN A 109 2.933 -4.112 -14.956 1.00 0.00 H new ATOM 0 HD22 ASN A 109 1.205 -3.862 -14.685 1.00 0.00 H new ATOM 1768 N LYS A 110 -1.363 -2.791 -16.724 1.00 0.00 N ATOM 1769 CA LYS A 110 -1.867 -4.118 -17.150 1.00 0.00 C ATOM 1770 C LYS A 110 -3.017 -4.000 -18.163 1.00 0.00 C ATOM 1771 O LYS A 110 -3.368 -2.898 -18.580 1.00 0.00 O ATOM 1772 CB LYS A 110 -2.268 -4.962 -15.904 1.00 0.00 C ATOM 1773 CG LYS A 110 -3.166 -4.276 -14.848 1.00 0.00 C ATOM 1774 CD LYS A 110 -4.569 -3.856 -15.333 1.00 0.00 C ATOM 1775 CE LYS A 110 -5.494 -3.487 -14.187 1.00 0.00 C ATOM 1776 NZ LYS A 110 -5.675 -4.611 -13.256 1.00 0.00 N ATOM 0 H LYS A 110 -2.031 -2.253 -16.171 1.00 0.00 H new ATOM 0 HA LYS A 110 -1.062 -4.639 -17.668 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -2.781 -5.858 -16.253 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -1.354 -5.290 -15.409 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -3.282 -4.953 -14.002 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -2.649 -3.390 -14.479 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -4.477 -3.006 -16.009 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -5.012 -4.672 -15.905 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -5.086 -2.631 -13.650 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -6.462 -3.182 -14.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -6.689 -4.747 -13.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -5.281 -5.477 -13.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -5.183 -4.405 -12.363 1.00 0.00 H new ATOM 1790 N THR A 111 -3.619 -5.159 -18.493 1.00 0.00 N ATOM 1791 CA THR A 111 -4.668 -5.285 -19.517 1.00 0.00 C ATOM 1792 C THR A 111 -6.045 -4.844 -18.973 1.00 0.00 C ATOM 1793 O THR A 111 -6.288 -4.885 -17.762 1.00 0.00 O ATOM 1794 CB THR A 111 -4.748 -6.768 -20.028 1.00 0.00 C ATOM 1795 OG1 THR A 111 -5.329 -7.603 -19.028 1.00 0.00 O ATOM 1796 CG2 THR A 111 -3.365 -7.337 -20.380 1.00 0.00 C ATOM 0 H THR A 111 -3.385 -6.046 -18.047 1.00 0.00 H new ATOM 0 HA THR A 111 -4.405 -4.628 -20.346 1.00 0.00 H new ATOM 0 HB THR A 111 -5.362 -6.755 -20.928 1.00 0.00 H new ATOM 0 HG1 THR A 111 -4.840 -7.493 -18.186 1.00 0.00 H new ATOM 0 HG21 THR A 111 -3.472 -8.364 -20.728 1.00 0.00 H new ATOM 0 HG22 THR A 111 -2.912 -6.733 -21.166 1.00 0.00 H new ATOM 0 HG23 THR A 111 -2.728 -7.318 -19.496 1.00 0.00 H new ATOM 1804 N MET A 112 -6.950 -4.440 -19.879 1.00 0.00 N ATOM 1805 CA MET A 112 -8.293 -3.941 -19.506 1.00 0.00 C ATOM 1806 C MET A 112 -9.316 -5.086 -19.322 1.00 0.00 C ATOM 1807 O MET A 112 -10.466 -4.834 -18.933 1.00 0.00 O ATOM 1808 CB MET A 112 -8.783 -2.894 -20.552 1.00 0.00 C ATOM 1809 CG MET A 112 -8.986 -3.408 -21.988 1.00 0.00 C ATOM 1810 SD MET A 112 -9.307 -2.078 -23.173 1.00 0.00 S ATOM 1811 CE MET A 112 -10.745 -1.268 -22.471 1.00 0.00 C ATOM 0 H MET A 112 -6.778 -4.448 -20.884 1.00 0.00 H new ATOM 0 HA MET A 112 -8.210 -3.451 -18.536 1.00 0.00 H new ATOM 0 HB2 MET A 112 -9.727 -2.476 -20.202 1.00 0.00 H new ATOM 0 HB3 MET A 112 -8.063 -2.076 -20.580 1.00 0.00 H new ATOM 0 HG2 MET A 112 -8.099 -3.960 -22.300 1.00 0.00 H new ATOM 0 HG3 MET A 112 -9.820 -4.110 -22.003 1.00 0.00 H new ATOM 0 HE1 MET A 112 -11.391 -0.914 -23.274 1.00 0.00 H new ATOM 0 HE2 MET A 112 -11.294 -1.975 -21.849 1.00 0.00 H new ATOM 0 HE3 MET A 112 -10.425 -0.422 -21.863 1.00 0.00 H new ATOM 1821 N ILE A 113 -8.883 -6.345 -19.568 1.00 0.00 N ATOM 1822 CA ILE A 113 -9.737 -7.552 -19.432 1.00 0.00 C ATOM 1823 C ILE A 113 -10.065 -7.833 -17.955 1.00 0.00 C ATOM 1824 O ILE A 113 -11.135 -8.364 -17.624 1.00 0.00 O ATOM 1825 CB ILE A 113 -9.057 -8.827 -20.087 1.00 0.00 C ATOM 1826 CG1 ILE A 113 -10.108 -9.945 -20.342 1.00 0.00 C ATOM 1827 CG2 ILE A 113 -7.870 -9.381 -19.255 1.00 0.00 C ATOM 1828 CD1 ILE A 113 -11.233 -9.555 -21.276 1.00 0.00 C ATOM 0 H ILE A 113 -7.930 -6.554 -19.867 1.00 0.00 H new ATOM 0 HA ILE A 113 -10.665 -7.349 -19.966 1.00 0.00 H new ATOM 0 HB ILE A 113 -8.645 -8.497 -21.040 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -9.599 -10.817 -20.753 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -10.536 -10.247 -19.386 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -7.449 -10.252 -19.757 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -7.103 -8.612 -19.158 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -8.223 -9.668 -18.264 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -11.916 -10.396 -21.394 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -11.773 -8.705 -20.860 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -10.821 -9.283 -22.248 1.00 0.00 H new ATOM 1840 N GLU A 114 -9.128 -7.423 -17.101 1.00 0.00 N ATOM 1841 CA GLU A 114 -9.132 -7.682 -15.651 1.00 0.00 C ATOM 1842 C GLU A 114 -10.215 -6.837 -14.958 1.00 0.00 C ATOM 1843 O GLU A 114 -10.860 -7.263 -13.992 1.00 0.00 O ATOM 1844 CB GLU A 114 -7.723 -7.344 -15.080 1.00 0.00 C ATOM 1845 CG GLU A 114 -6.565 -7.728 -16.027 1.00 0.00 C ATOM 1846 CD GLU A 114 -5.154 -7.451 -15.508 1.00 0.00 C ATOM 1847 OE1 GLU A 114 -4.996 -7.054 -14.341 1.00 0.00 O ATOM 1848 OE2 GLU A 114 -4.192 -7.617 -16.289 1.00 0.00 O ATOM 0 H GLU A 114 -8.317 -6.884 -17.403 1.00 0.00 H new ATOM 0 HA GLU A 114 -9.359 -8.732 -15.465 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -7.671 -6.275 -14.871 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -7.591 -7.861 -14.130 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -6.645 -8.791 -16.254 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -6.697 -7.191 -16.966 1.00 0.00 H new ATOM 1855 N LEU A 115 -10.404 -5.638 -15.513 1.00 0.00 N ATOM 1856 CA LEU A 115 -11.318 -4.614 -15.000 1.00 0.00 C ATOM 1857 C LEU A 115 -12.735 -4.843 -15.546 1.00 0.00 C ATOM 1858 O LEU A 115 -13.721 -4.700 -14.821 1.00 0.00 O ATOM 1859 CB LEU A 115 -10.797 -3.239 -15.450 1.00 0.00 C ATOM 1860 CG LEU A 115 -9.297 -2.959 -15.143 1.00 0.00 C ATOM 1861 CD1 LEU A 115 -8.809 -1.735 -15.927 1.00 0.00 C ATOM 1862 CD2 LEU A 115 -9.047 -2.813 -13.622 1.00 0.00 C ATOM 0 H LEU A 115 -9.911 -5.344 -16.356 1.00 0.00 H new ATOM 0 HA LEU A 115 -11.361 -4.664 -13.912 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -10.954 -3.144 -16.524 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -11.399 -2.467 -14.970 1.00 0.00 H new ATOM 0 HG LEU A 115 -8.713 -3.818 -15.473 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -7.758 -1.553 -15.701 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -8.924 -1.918 -16.995 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -9.398 -0.863 -15.643 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -7.989 -2.618 -13.444 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -9.639 -1.984 -13.234 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -9.336 -3.734 -13.116 1.00 0.00 H new ATOM 1874 N SER A 116 -12.806 -5.179 -16.849 1.00 0.00 N ATOM 1875 CA SER A 116 -14.079 -5.452 -17.543 1.00 0.00 C ATOM 1876 C SER A 116 -14.696 -6.772 -17.046 1.00 0.00 C ATOM 1877 O SER A 116 -15.918 -6.922 -17.044 1.00 0.00 O ATOM 1878 CB SER A 116 -13.856 -5.503 -19.075 1.00 0.00 C ATOM 1879 OG SER A 116 -12.893 -6.483 -19.427 1.00 0.00 O ATOM 0 H SER A 116 -11.985 -5.268 -17.448 1.00 0.00 H new ATOM 0 HA SER A 116 -14.774 -4.643 -17.318 1.00 0.00 H new ATOM 0 HB2 SER A 116 -14.800 -5.723 -19.574 1.00 0.00 H new ATOM 0 HB3 SER A 116 -13.528 -4.526 -19.429 1.00 0.00 H new ATOM 0 HG SER A 116 -11.994 -6.137 -19.249 1.00 0.00 H new ATOM 1885 N ASP A 117 -13.810 -7.705 -16.618 1.00 0.00 N ATOM 1886 CA ASP A 117 -14.166 -9.073 -16.189 1.00 0.00 C ATOM 1887 C ASP A 117 -14.736 -9.859 -17.395 1.00 0.00 C ATOM 1888 O ASP A 117 -15.729 -10.595 -17.277 1.00 0.00 O ATOM 1889 CB ASP A 117 -15.144 -9.061 -14.966 1.00 0.00 C ATOM 1890 CG ASP A 117 -15.221 -10.419 -14.232 1.00 0.00 C ATOM 1891 OD1 ASP A 117 -14.298 -10.729 -13.449 1.00 0.00 O ATOM 1892 OD2 ASP A 117 -16.203 -11.174 -14.426 1.00 0.00 O ATOM 0 H ASP A 117 -12.809 -7.520 -16.562 1.00 0.00 H new ATOM 0 HA ASP A 117 -13.267 -9.583 -15.844 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -14.825 -8.293 -14.262 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -16.141 -8.784 -15.309 1.00 0.00 H new ATOM 1897 N ASN A 118 -14.082 -9.660 -18.566 1.00 0.00 N ATOM 1898 CA ASN A 118 -14.431 -10.333 -19.845 1.00 0.00 C ATOM 1899 C ASN A 118 -15.849 -9.956 -20.320 1.00 0.00 C ATOM 1900 O ASN A 118 -16.501 -10.716 -21.049 1.00 0.00 O ATOM 1901 CB ASN A 118 -14.264 -11.874 -19.714 1.00 0.00 C ATOM 1902 CG ASN A 118 -12.832 -12.285 -19.392 1.00 0.00 C ATOM 1903 OD1 ASN A 118 -12.056 -12.626 -20.272 1.00 0.00 O ATOM 1904 ND2 ASN A 118 -12.454 -12.217 -18.128 1.00 0.00 N ATOM 0 H ASN A 118 -13.290 -9.023 -18.651 1.00 0.00 H new ATOM 0 HA ASN A 118 -13.738 -9.981 -20.609 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -14.928 -12.242 -18.932 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -14.574 -12.349 -20.645 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -11.496 -12.452 -17.869 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -13.120 -11.930 -17.411 1.00 0.00 H new ATOM 1911 N GLU A 119 -16.290 -8.749 -19.945 1.00 0.00 N ATOM 1912 CA GLU A 119 -17.662 -8.272 -20.192 1.00 0.00 C ATOM 1913 C GLU A 119 -17.670 -7.105 -21.191 1.00 0.00 C ATOM 1914 O GLU A 119 -16.796 -6.225 -21.137 1.00 0.00 O ATOM 1915 CB GLU A 119 -18.298 -7.836 -18.842 1.00 0.00 C ATOM 1916 CG GLU A 119 -19.784 -7.431 -18.900 1.00 0.00 C ATOM 1917 CD GLU A 119 -20.713 -8.575 -19.362 1.00 0.00 C ATOM 1918 OE1 GLU A 119 -20.955 -8.717 -20.584 1.00 0.00 O ATOM 1919 OE2 GLU A 119 -21.194 -9.348 -18.504 1.00 0.00 O ATOM 0 H GLU A 119 -15.704 -8.070 -19.459 1.00 0.00 H new ATOM 0 HA GLU A 119 -18.247 -9.082 -20.628 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -18.192 -8.655 -18.131 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -17.727 -6.995 -18.448 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -20.100 -7.092 -17.913 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -19.896 -6.585 -19.578 1.00 0.00 H new ATOM 1926 N ASN A 120 -18.671 -7.113 -22.094 1.00 0.00 N ATOM 1927 CA ASN A 120 -18.945 -6.007 -23.018 1.00 0.00 C ATOM 1928 C ASN A 120 -20.462 -5.917 -23.332 1.00 0.00 C ATOM 1929 O ASN A 120 -21.136 -6.949 -23.376 1.00 0.00 O ATOM 1930 CB ASN A 120 -18.077 -6.076 -24.322 1.00 0.00 C ATOM 1931 CG ASN A 120 -18.078 -7.396 -25.121 1.00 0.00 C ATOM 1932 OD1 ASN A 120 -17.071 -7.721 -25.753 1.00 0.00 O ATOM 1933 ND2 ASN A 120 -19.171 -8.153 -25.147 1.00 0.00 N ATOM 0 H ASN A 120 -19.315 -7.897 -22.199 1.00 0.00 H new ATOM 0 HA ASN A 120 -18.650 -5.086 -22.515 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -18.411 -5.281 -24.989 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -17.046 -5.851 -24.050 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -19.182 -9.014 -25.694 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -19.998 -7.873 -24.620 1.00 0.00 H new ATOM 1940 N PRO A 121 -21.039 -4.687 -23.552 1.00 0.00 N ATOM 1941 CA PRO A 121 -20.307 -3.402 -23.481 1.00 0.00 C ATOM 1942 C PRO A 121 -20.065 -2.968 -22.016 1.00 0.00 C ATOM 1943 O PRO A 121 -21.004 -2.864 -21.215 1.00 0.00 O ATOM 1944 CB PRO A 121 -21.234 -2.436 -24.247 1.00 0.00 C ATOM 1945 CG PRO A 121 -22.616 -2.976 -24.012 1.00 0.00 C ATOM 1946 CD PRO A 121 -22.470 -4.480 -23.899 1.00 0.00 C ATOM 0 HA PRO A 121 -19.306 -3.443 -23.910 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -21.138 -1.416 -23.876 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -20.992 -2.413 -25.310 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -23.048 -2.558 -23.103 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -23.282 -2.710 -24.833 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -23.128 -4.887 -23.131 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -22.728 -4.976 -24.835 1.00 0.00 H new ATOM 1954 N TRP A 122 -18.786 -2.729 -21.681 1.00 0.00 N ATOM 1955 CA TRP A 122 -18.372 -2.376 -20.317 1.00 0.00 C ATOM 1956 C TRP A 122 -18.634 -0.884 -20.087 1.00 0.00 C ATOM 1957 O TRP A 122 -17.908 -0.037 -20.611 1.00 0.00 O ATOM 1958 CB TRP A 122 -16.874 -2.737 -20.101 1.00 0.00 C ATOM 1959 CG TRP A 122 -16.347 -2.447 -18.711 1.00 0.00 C ATOM 1960 CD1 TRP A 122 -16.992 -2.681 -17.530 1.00 0.00 C ATOM 1961 CD2 TRP A 122 -15.063 -1.903 -18.358 1.00 0.00 C ATOM 1962 NE1 TRP A 122 -16.211 -2.293 -16.477 1.00 0.00 N ATOM 1963 CE2 TRP A 122 -15.024 -1.825 -16.951 1.00 0.00 C ATOM 1964 CE3 TRP A 122 -13.938 -1.488 -19.088 1.00 0.00 C ATOM 1965 CZ2 TRP A 122 -13.927 -1.334 -16.262 1.00 0.00 C ATOM 1966 CZ3 TRP A 122 -12.839 -1.003 -18.399 1.00 0.00 C ATOM 1967 CH2 TRP A 122 -12.841 -0.930 -16.997 1.00 0.00 C ATOM 0 H TRP A 122 -18.015 -2.775 -22.347 1.00 0.00 H new ATOM 0 HA TRP A 122 -18.951 -2.946 -19.590 1.00 0.00 H new ATOM 0 HB2 TRP A 122 -16.736 -3.797 -20.313 1.00 0.00 H new ATOM 0 HB3 TRP A 122 -16.274 -2.186 -20.825 1.00 0.00 H new ATOM 0 HD1 TRP A 122 -17.979 -3.111 -17.441 1.00 0.00 H new ATOM 0 HE1 TRP A 122 -16.476 -2.346 -15.493 1.00 0.00 H new ATOM 0 HE3 TRP A 122 -13.930 -1.546 -20.166 1.00 0.00 H new ATOM 0 HZ2 TRP A 122 -13.927 -1.271 -15.184 1.00 0.00 H new ATOM 0 HZ3 TRP A 122 -11.968 -0.676 -18.948 1.00 0.00 H new ATOM 0 HH2 TRP A 122 -11.970 -0.548 -16.486 1.00 0.00 H new ATOM 1978 N THR A 123 -19.694 -0.572 -19.327 1.00 0.00 N ATOM 1979 CA THR A 123 -20.078 0.811 -19.056 1.00 0.00 C ATOM 1980 C THR A 123 -19.152 1.424 -17.993 1.00 0.00 C ATOM 1981 O THR A 123 -18.860 0.801 -16.968 1.00 0.00 O ATOM 1982 CB THR A 123 -21.568 0.940 -18.612 1.00 0.00 C ATOM 1983 OG1 THR A 123 -22.426 0.404 -19.634 1.00 0.00 O ATOM 1984 CG2 THR A 123 -21.963 2.409 -18.320 1.00 0.00 C ATOM 0 H THR A 123 -20.300 -1.266 -18.890 1.00 0.00 H new ATOM 0 HA THR A 123 -19.972 1.361 -19.991 1.00 0.00 H new ATOM 0 HB THR A 123 -21.687 0.375 -17.687 1.00 0.00 H new ATOM 0 HG1 THR A 123 -22.546 1.070 -20.343 1.00 0.00 H new ATOM 0 HG21 THR A 123 -23.008 2.451 -18.014 1.00 0.00 H new ATOM 0 HG22 THR A 123 -21.335 2.803 -17.521 1.00 0.00 H new ATOM 0 HG23 THR A 123 -21.824 3.009 -19.219 1.00 0.00 H new ATOM 1992 N ILE A 124 -18.700 2.644 -18.270 1.00 0.00 N ATOM 1993 CA ILE A 124 -17.810 3.408 -17.415 1.00 0.00 C ATOM 1994 C ILE A 124 -18.137 4.901 -17.613 1.00 0.00 C ATOM 1995 O ILE A 124 -18.355 5.348 -18.750 1.00 0.00 O ATOM 1996 CB ILE A 124 -16.276 3.071 -17.736 1.00 0.00 C ATOM 1997 CG1 ILE A 124 -15.556 2.478 -16.499 1.00 0.00 C ATOM 1998 CG2 ILE A 124 -15.463 4.279 -18.289 1.00 0.00 C ATOM 1999 CD1 ILE A 124 -14.095 2.169 -16.682 1.00 0.00 C ATOM 0 H ILE A 124 -18.954 3.140 -19.124 1.00 0.00 H new ATOM 0 HA ILE A 124 -17.960 3.143 -16.368 1.00 0.00 H new ATOM 0 HB ILE A 124 -16.313 2.326 -18.531 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -15.660 3.179 -15.670 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -16.069 1.561 -16.207 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -14.436 3.969 -18.481 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -15.916 4.628 -19.217 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -15.468 5.086 -17.557 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -13.691 1.759 -15.756 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -13.975 1.441 -17.484 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -13.559 3.083 -16.939 1.00 0.00 H new ATOM 2011 N PHE A 125 -18.247 5.653 -16.512 1.00 0.00 N ATOM 2012 CA PHE A 125 -18.239 7.115 -16.553 1.00 0.00 C ATOM 2013 C PHE A 125 -16.779 7.571 -16.636 1.00 0.00 C ATOM 2014 O PHE A 125 -15.956 7.208 -15.781 1.00 0.00 O ATOM 2015 CB PHE A 125 -18.935 7.738 -15.309 1.00 0.00 C ATOM 2016 CG PHE A 125 -19.073 9.262 -15.397 1.00 0.00 C ATOM 2017 CD1 PHE A 125 -20.125 9.840 -16.106 1.00 0.00 C ATOM 2018 CD2 PHE A 125 -18.132 10.116 -14.812 1.00 0.00 C ATOM 2019 CE1 PHE A 125 -20.236 11.214 -16.218 1.00 0.00 C ATOM 2020 CE2 PHE A 125 -18.241 11.490 -14.931 1.00 0.00 C ATOM 2021 CZ PHE A 125 -19.294 12.038 -15.637 1.00 0.00 C ATOM 0 H PHE A 125 -18.343 5.265 -15.573 1.00 0.00 H new ATOM 0 HA PHE A 125 -18.802 7.454 -17.423 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -19.925 7.296 -15.194 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -18.366 7.482 -14.415 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -20.863 9.206 -16.574 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -17.306 9.695 -14.258 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -21.064 11.644 -16.763 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -17.504 12.133 -14.473 1.00 0.00 H new ATOM 0 HZ PHE A 125 -19.380 13.110 -15.734 1.00 0.00 H new ATOM 2031 N LEU A 126 -16.469 8.331 -17.685 1.00 0.00 N ATOM 2032 CA LEU A 126 -15.160 8.941 -17.884 1.00 0.00 C ATOM 2033 C LEU A 126 -15.189 10.341 -17.245 1.00 0.00 C ATOM 2034 O LEU A 126 -16.053 11.173 -17.552 1.00 0.00 O ATOM 2035 CB LEU A 126 -14.819 8.959 -19.399 1.00 0.00 C ATOM 2036 CG LEU A 126 -13.418 9.509 -19.848 1.00 0.00 C ATOM 2037 CD1 LEU A 126 -13.456 11.005 -20.197 1.00 0.00 C ATOM 2038 CD2 LEU A 126 -12.304 9.194 -18.827 1.00 0.00 C ATOM 0 H LEU A 126 -17.132 8.542 -18.431 1.00 0.00 H new ATOM 0 HA LEU A 126 -14.367 8.369 -17.402 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -14.908 7.938 -19.770 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -15.584 9.550 -19.903 1.00 0.00 H new ATOM 0 HG LEU A 126 -13.170 8.975 -20.765 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -12.462 11.333 -20.501 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -14.158 11.170 -21.014 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -13.775 11.574 -19.324 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -11.357 9.596 -19.186 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -12.551 9.649 -17.868 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -12.217 8.114 -18.705 1.00 0.00 H new ATOM 2050 N GLU A 127 -14.229 10.554 -16.348 1.00 0.00 N ATOM 2051 CA GLU A 127 -14.142 11.712 -15.455 1.00 0.00 C ATOM 2052 C GLU A 127 -12.782 12.408 -15.644 1.00 0.00 C ATOM 2053 O GLU A 127 -11.790 11.758 -16.007 1.00 0.00 O ATOM 2054 CB GLU A 127 -14.318 11.201 -13.994 1.00 0.00 C ATOM 2055 CG GLU A 127 -14.213 12.256 -12.876 1.00 0.00 C ATOM 2056 CD GLU A 127 -15.355 13.280 -12.895 1.00 0.00 C ATOM 2057 OE1 GLU A 127 -16.415 13.015 -12.281 1.00 0.00 O ATOM 2058 OE2 GLU A 127 -15.199 14.355 -13.509 1.00 0.00 O ATOM 0 H GLU A 127 -13.458 9.899 -16.216 1.00 0.00 H new ATOM 0 HA GLU A 127 -14.920 12.441 -15.680 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -15.293 10.719 -13.917 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -13.567 10.433 -13.809 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -14.204 11.751 -11.910 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -13.263 12.781 -12.970 1.00 0.00 H new ATOM 2065 N THR A 128 -12.747 13.729 -15.397 1.00 0.00 N ATOM 2066 CA THR A 128 -11.513 14.523 -15.470 1.00 0.00 C ATOM 2067 C THR A 128 -10.753 14.375 -14.131 1.00 0.00 C ATOM 2068 O THR A 128 -11.242 14.909 -13.110 1.00 0.00 O ATOM 2069 CB THR A 128 -11.811 16.043 -15.756 1.00 0.00 C ATOM 2070 OG1 THR A 128 -12.919 16.183 -16.649 1.00 0.00 O ATOM 2071 CG2 THR A 128 -10.595 16.764 -16.361 1.00 0.00 C ATOM 2072 OXT THR A 128 -9.691 13.740 -14.096 1.00 0.00 O ATOM 0 H THR A 128 -13.572 14.273 -15.142 1.00 0.00 H new ATOM 0 HA THR A 128 -10.907 14.152 -16.297 1.00 0.00 H new ATOM 0 HB THR A 128 -12.047 16.500 -14.795 1.00 0.00 H new ATOM 0 HG1 THR A 128 -12.757 15.653 -17.457 1.00 0.00 H new ATOM 0 HG21 THR A 128 -10.845 17.809 -16.542 1.00 0.00 H new ATOM 0 HG22 THR A 128 -9.756 16.706 -15.668 1.00 0.00 H new ATOM 0 HG23 THR A 128 -10.321 16.288 -17.303 1.00 0.00 H new