USER MOD reduce.3.24.130724 H: found=0, std=0, add=935, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 933 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 47 CYS SG : rot -143:sc= 0.00048 USER MOD Set 1.2: A 49 HIS : no HE2:sc= -3.99! C(o=-5.9!,f=-13!) USER MOD Set 1.3: A 50 CYS SG : rot 170:sc= -1.89 USER MOD Set 2.1: A 28 ASN : amide:sc= -3.07 K(o=-6.1,f=-5!) USER MOD Set 2.2: A 33 GLN : amide:sc= -2.99! K(o=-6.1!,f=-3.7) USER MOD Set 3.1: A 23 THR OG1 : rot -112:sc= 1.17 USER MOD Set 3.2: A 26 ASN : amide:sc= -0.963! C(o=0.2!,f=-4!) USER MOD Set 4.1: A 14 SER OG : rot -109:sc= 0.671 USER MOD Set 4.2: A 16 SER OG : rot 180:sc= 0.612 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot -58:sc= 0.0196 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 35:sc= -0.625 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot -138:sc= 0.893 USER MOD Single : A 43 TYR OH : rot 180:sc= 0.0884 USER MOD Single : A 51 GLN : amide:sc= -1.71 X(o=-1.7,f=-1.7) USER MOD Single : A 54 THR OG1 : rot 88:sc= 0.832 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ -143:sc= 0.178 (180deg=-0.191) USER MOD Single : A 62 THR OG1 : rot -69:sc= 0.618 USER MOD Single : A 65 LYS NZ :NH3+ 152:sc= 1.08 (180deg=-0.036) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= -7.73! C(o=-7.7!,f=-19!) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 HIS : no HD1:sc= -7.11! C(o=-7.1!,f=-5.4!) USER MOD Single : A 79 GLN : amide:sc= -0.417 K(o=-0.42,f=-3.6!) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 TYR OH : rot 93:sc= 1.5 USER MOD Single : A 88 GLN : amide:sc= -1.88 K(o=-1.9,f=-4.7!) USER MOD Single : A 92 THR OG1 : rot 2:sc= -0.784 USER MOD Single : A 94 LYS NZ :NH3+ 152:sc= -0.285 (180deg=-1.81!) USER MOD Single : A 99 ASN : amide:sc= -2.8 X(o=-2.8,f=-3.1) USER MOD Single : A 100 LYS NZ :NH3+ 161:sc= 1.28 (180deg=0.854) USER MOD Single : A 101 ASN : amide:sc= -0.0587 X(o=-0.059,f=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 TYR OH : rot -140:sc= 0.0395 USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 THR OG1 : rot 180:sc= 0.0213 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 59:sc= -0.322 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 38:sc= 0.947 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -8.351 -0.504 -22.118 1.00 0.00 N ATOM 2 CA GLY A 1 -9.173 0.250 -21.189 1.00 0.00 C ATOM 3 C GLY A 1 -8.709 1.685 -21.038 1.00 0.00 C ATOM 4 O GLY A 1 -9.439 2.619 -21.370 1.00 0.00 O ATOM 0 H1 GLY A 1 -8.709 -1.478 -22.186 1.00 0.00 H new ATOM 0 H2 GLY A 1 -8.386 -0.056 -23.056 1.00 0.00 H new ATOM 0 H3 GLY A 1 -7.368 -0.519 -21.778 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -10.207 0.240 -21.533 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.156 -0.239 -20.215 1.00 0.00 H new ATOM 8 N SER A 2 -7.492 1.862 -20.532 1.00 0.00 N ATOM 9 CA SER A 2 -6.934 3.194 -20.332 1.00 0.00 C ATOM 10 C SER A 2 -7.744 3.973 -19.300 1.00 0.00 C ATOM 11 O SER A 2 -8.026 5.157 -19.481 1.00 0.00 O ATOM 12 CB SER A 2 -6.901 3.960 -21.655 1.00 0.00 C ATOM 13 OG SER A 2 -5.979 5.035 -21.600 1.00 0.00 O ATOM 0 H SER A 2 -6.874 1.100 -20.253 1.00 0.00 H new ATOM 0 HA SER A 2 -5.916 3.082 -19.960 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.627 3.283 -22.464 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.896 4.342 -21.882 1.00 0.00 H new ATOM 0 HG SER A 2 -6.227 5.641 -20.871 1.00 0.00 H new ATOM 19 N SER A 3 -8.115 3.298 -18.217 1.00 0.00 N ATOM 20 CA SER A 3 -8.896 3.924 -17.156 1.00 0.00 C ATOM 21 C SER A 3 -8.096 5.029 -16.473 1.00 0.00 C ATOM 22 O SER A 3 -6.868 5.049 -16.533 1.00 0.00 O ATOM 23 CB SER A 3 -9.328 2.879 -16.126 1.00 0.00 C ATOM 24 OG SER A 3 -8.204 2.289 -15.497 1.00 0.00 O ATOM 0 H SER A 3 -7.888 2.318 -18.051 1.00 0.00 H new ATOM 0 HA SER A 3 -9.784 4.367 -17.606 1.00 0.00 H new ATOM 0 HB2 SER A 3 -9.966 3.346 -15.375 1.00 0.00 H new ATOM 0 HB3 SER A 3 -9.923 2.107 -16.614 1.00 0.00 H new ATOM 0 HG SER A 3 -8.506 1.626 -14.842 1.00 0.00 H new ATOM 30 N GLY A 4 -8.804 5.948 -15.822 1.00 0.00 N ATOM 31 CA GLY A 4 -8.145 7.043 -15.136 1.00 0.00 C ATOM 32 C GLY A 4 -8.442 8.387 -15.770 1.00 0.00 C ATOM 33 O GLY A 4 -9.589 8.833 -15.788 1.00 0.00 O ATOM 0 H GLY A 4 -9.822 5.953 -15.758 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -8.463 7.058 -14.094 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -7.068 6.874 -15.138 1.00 0.00 H new ATOM 37 N SER A 5 -7.405 9.036 -16.291 1.00 0.00 N ATOM 38 CA SER A 5 -7.560 10.340 -16.925 1.00 0.00 C ATOM 39 C SER A 5 -6.253 10.788 -17.572 1.00 0.00 C ATOM 40 O SER A 5 -5.201 10.188 -17.352 1.00 0.00 O ATOM 41 CB SER A 5 -8.016 11.379 -15.899 1.00 0.00 C ATOM 42 OG SER A 5 -6.928 11.833 -15.114 1.00 0.00 O ATOM 0 H SER A 5 -6.449 8.680 -16.286 1.00 0.00 H new ATOM 0 HA SER A 5 -8.319 10.250 -17.702 1.00 0.00 H new ATOM 0 HB2 SER A 5 -8.476 12.224 -16.412 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.779 10.945 -15.252 1.00 0.00 H new ATOM 0 HG SER A 5 -7.246 12.497 -14.467 1.00 0.00 H new ATOM 48 N SER A 6 -6.328 11.848 -18.371 1.00 0.00 N ATOM 49 CA SER A 6 -5.153 12.375 -19.054 1.00 0.00 C ATOM 50 C SER A 6 -4.172 12.983 -18.056 1.00 0.00 C ATOM 51 O SER A 6 -4.229 14.175 -17.759 1.00 0.00 O ATOM 52 CB SER A 6 -5.565 13.427 -20.085 1.00 0.00 C ATOM 53 OG SER A 6 -4.620 13.507 -21.138 1.00 0.00 O ATOM 0 H SER A 6 -7.190 12.358 -18.561 1.00 0.00 H new ATOM 0 HA SER A 6 -4.660 11.548 -19.566 1.00 0.00 H new ATOM 0 HB2 SER A 6 -6.546 13.179 -20.491 1.00 0.00 H new ATOM 0 HB3 SER A 6 -5.657 14.399 -19.600 1.00 0.00 H new ATOM 0 HG SER A 6 -4.907 14.185 -21.784 1.00 0.00 H new ATOM 59 N GLY A 7 -3.271 12.152 -17.540 1.00 0.00 N ATOM 60 CA GLY A 7 -2.290 12.623 -16.580 1.00 0.00 C ATOM 61 C GLY A 7 -2.915 13.007 -15.253 1.00 0.00 C ATOM 62 O GLY A 7 -3.951 13.669 -15.216 1.00 0.00 O ATOM 0 H GLY A 7 -3.203 11.161 -17.770 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.545 11.845 -16.415 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -1.766 13.484 -16.994 1.00 0.00 H new ATOM 66 N ALA A 8 -2.283 12.588 -14.161 1.00 0.00 N ATOM 67 CA ALA A 8 -2.784 12.891 -12.826 1.00 0.00 C ATOM 68 C ALA A 8 -2.628 14.374 -12.505 1.00 0.00 C ATOM 69 O ALA A 8 -1.818 15.070 -13.118 1.00 0.00 O ATOM 70 CB ALA A 8 -2.062 12.046 -11.787 1.00 0.00 C ATOM 0 H ALA A 8 -1.424 12.038 -14.175 1.00 0.00 H new ATOM 0 HA ALA A 8 -3.847 12.650 -12.800 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -2.446 12.283 -10.795 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -2.228 10.990 -11.998 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -0.994 12.260 -11.823 1.00 0.00 H new ATOM 76 N VAL A 9 -3.409 14.852 -11.542 1.00 0.00 N ATOM 77 CA VAL A 9 -3.358 16.253 -11.140 1.00 0.00 C ATOM 78 C VAL A 9 -2.850 16.395 -9.710 1.00 0.00 C ATOM 79 O VAL A 9 -2.317 17.438 -9.330 1.00 0.00 O ATOM 80 CB VAL A 9 -4.741 16.920 -11.251 1.00 0.00 C ATOM 81 CG1 VAL A 9 -5.694 16.351 -10.210 1.00 0.00 C ATOM 82 CG2 VAL A 9 -4.618 18.429 -11.104 1.00 0.00 C ATOM 0 H VAL A 9 -4.085 14.290 -11.025 1.00 0.00 H new ATOM 0 HA VAL A 9 -2.668 16.753 -11.819 1.00 0.00 H new ATOM 0 HB VAL A 9 -5.150 16.706 -12.239 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -6.666 16.835 -10.304 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -5.806 15.278 -10.367 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -5.294 16.532 -9.213 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -5.605 18.884 -11.185 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -4.188 18.666 -10.131 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -3.973 18.820 -11.891 1.00 0.00 H new ATOM 92 N SER A 10 -3.018 15.339 -8.920 1.00 0.00 N ATOM 93 CA SER A 10 -2.579 15.348 -7.529 1.00 0.00 C ATOM 94 C SER A 10 -1.692 14.143 -7.232 1.00 0.00 C ATOM 95 O SER A 10 -0.808 14.204 -6.379 1.00 0.00 O ATOM 96 CB SER A 10 -3.788 15.349 -6.591 1.00 0.00 C ATOM 97 OG SER A 10 -3.487 16.006 -5.373 1.00 0.00 O ATOM 0 H SER A 10 -3.455 14.467 -9.219 1.00 0.00 H new ATOM 0 HA SER A 10 -1.998 16.255 -7.363 1.00 0.00 H new ATOM 0 HB2 SER A 10 -4.629 15.844 -7.077 1.00 0.00 H new ATOM 0 HB3 SER A 10 -4.096 14.323 -6.388 1.00 0.00 H new ATOM 0 HG SER A 10 -4.276 15.995 -4.792 1.00 0.00 H new ATOM 103 N GLY A 11 -1.935 13.046 -7.944 1.00 0.00 N ATOM 104 CA GLY A 11 -1.151 11.842 -7.743 1.00 0.00 C ATOM 105 C GLY A 11 0.340 12.097 -7.846 1.00 0.00 C ATOM 106 O GLY A 11 0.854 12.386 -8.927 1.00 0.00 O ATOM 0 H GLY A 11 -2.661 12.970 -8.656 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -1.378 11.424 -6.762 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -1.441 11.096 -8.483 1.00 0.00 H new ATOM 110 N LEU A 12 1.036 11.991 -6.720 1.00 0.00 N ATOM 111 CA LEU A 12 2.477 12.214 -6.687 1.00 0.00 C ATOM 112 C LEU A 12 3.193 11.288 -7.666 1.00 0.00 C ATOM 113 O LEU A 12 3.856 11.746 -8.597 1.00 0.00 O ATOM 114 CB LEU A 12 3.015 11.993 -5.272 1.00 0.00 C ATOM 115 CG LEU A 12 2.298 12.753 -4.156 1.00 0.00 C ATOM 116 CD1 LEU A 12 2.779 12.279 -2.793 1.00 0.00 C ATOM 117 CD2 LEU A 12 2.514 14.252 -4.307 1.00 0.00 C ATOM 0 H LEU A 12 0.626 11.752 -5.817 1.00 0.00 H new ATOM 0 HA LEU A 12 2.668 13.245 -6.984 1.00 0.00 H new ATOM 0 HB2 LEU A 12 2.966 10.927 -5.048 1.00 0.00 H new ATOM 0 HB3 LEU A 12 4.068 12.274 -5.257 1.00 0.00 H new ATOM 0 HG LEU A 12 1.230 12.550 -4.233 1.00 0.00 H new ATOM 0 HD11 LEU A 12 2.258 12.831 -2.011 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.573 11.214 -2.684 1.00 0.00 H new ATOM 0 HD13 LEU A 12 3.852 12.452 -2.705 1.00 0.00 H new ATOM 0 HD21 LEU A 12 1.996 14.777 -3.504 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.580 14.473 -4.257 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.120 14.581 -5.269 1.00 0.00 H new ATOM 129 N TYR A 13 3.054 9.985 -7.450 1.00 0.00 N ATOM 130 CA TYR A 13 3.688 8.995 -8.312 1.00 0.00 C ATOM 131 C TYR A 13 3.246 9.173 -9.762 1.00 0.00 C ATOM 132 O TYR A 13 2.284 9.886 -10.046 1.00 0.00 O ATOM 133 CB TYR A 13 3.350 7.582 -7.835 1.00 0.00 C ATOM 134 CG TYR A 13 3.835 7.284 -6.434 1.00 0.00 C ATOM 135 CD1 TYR A 13 3.115 7.708 -5.324 1.00 0.00 C ATOM 136 CD2 TYR A 13 5.012 6.577 -6.221 1.00 0.00 C ATOM 137 CE1 TYR A 13 3.555 7.439 -4.042 1.00 0.00 C ATOM 138 CE2 TYR A 13 5.459 6.303 -4.942 1.00 0.00 C ATOM 139 CZ TYR A 13 4.727 6.736 -3.857 1.00 0.00 C ATOM 140 OH TYR A 13 5.167 6.464 -2.581 1.00 0.00 O ATOM 0 H TYR A 13 2.508 9.590 -6.685 1.00 0.00 H new ATOM 0 HA TYR A 13 4.767 9.141 -8.259 1.00 0.00 H new ATOM 0 HB2 TYR A 13 2.270 7.443 -7.874 1.00 0.00 H new ATOM 0 HB3 TYR A 13 3.789 6.860 -8.524 1.00 0.00 H new ATOM 0 HD1 TYR A 13 2.196 8.257 -5.466 1.00 0.00 H new ATOM 0 HD2 TYR A 13 5.587 6.236 -7.069 1.00 0.00 H new ATOM 0 HE1 TYR A 13 2.984 7.777 -3.190 1.00 0.00 H new ATOM 0 HE2 TYR A 13 6.376 5.753 -4.794 1.00 0.00 H new ATOM 0 HH TYR A 13 4.397 6.305 -1.996 1.00 0.00 H new ATOM 150 N SER A 14 3.958 8.520 -10.675 1.00 0.00 N ATOM 151 CA SER A 14 3.643 8.607 -12.096 1.00 0.00 C ATOM 152 C SER A 14 3.510 7.217 -12.709 1.00 0.00 C ATOM 153 O SER A 14 4.419 6.393 -12.611 1.00 0.00 O ATOM 154 CB SER A 14 4.725 9.400 -12.832 1.00 0.00 C ATOM 155 OG SER A 14 4.356 9.638 -14.179 1.00 0.00 O ATOM 0 H SER A 14 4.757 7.925 -10.456 1.00 0.00 H new ATOM 0 HA SER A 14 2.689 9.124 -12.201 1.00 0.00 H new ATOM 0 HB2 SER A 14 4.893 10.350 -12.324 1.00 0.00 H new ATOM 0 HB3 SER A 14 5.666 8.852 -12.801 1.00 0.00 H new ATOM 0 HG SER A 14 4.915 9.094 -14.772 1.00 0.00 H new ATOM 161 N SER A 15 2.369 6.963 -13.343 1.00 0.00 N ATOM 162 CA SER A 15 2.113 5.672 -13.970 1.00 0.00 C ATOM 163 C SER A 15 3.361 5.157 -14.681 1.00 0.00 C ATOM 164 O SER A 15 3.628 3.955 -14.697 1.00 0.00 O ATOM 165 CB SER A 15 0.955 5.784 -14.963 1.00 0.00 C ATOM 166 OG SER A 15 -0.253 6.116 -14.302 1.00 0.00 O ATOM 0 H SER A 15 1.607 7.635 -13.436 1.00 0.00 H new ATOM 0 HA SER A 15 1.843 4.963 -13.188 1.00 0.00 H new ATOM 0 HB2 SER A 15 1.185 6.543 -15.710 1.00 0.00 H new ATOM 0 HB3 SER A 15 0.835 4.840 -15.494 1.00 0.00 H new ATOM 0 HG SER A 15 -0.977 6.183 -14.959 1.00 0.00 H new ATOM 172 N SER A 16 4.121 6.075 -15.269 1.00 0.00 N ATOM 173 CA SER A 16 5.338 5.715 -15.986 1.00 0.00 C ATOM 174 C SER A 16 6.266 4.888 -15.101 1.00 0.00 C ATOM 175 O SER A 16 6.801 3.865 -15.528 1.00 0.00 O ATOM 176 CB SER A 16 6.063 6.973 -16.468 1.00 0.00 C ATOM 177 OG SER A 16 6.297 7.869 -15.395 1.00 0.00 O ATOM 0 H SER A 16 3.915 7.074 -15.263 1.00 0.00 H new ATOM 0 HA SER A 16 5.056 5.113 -16.850 1.00 0.00 H new ATOM 0 HB2 SER A 16 7.011 6.696 -16.928 1.00 0.00 H new ATOM 0 HB3 SER A 16 5.468 7.468 -17.236 1.00 0.00 H new ATOM 0 HG SER A 16 6.763 8.664 -15.728 1.00 0.00 H new ATOM 183 N ASP A 17 6.451 5.339 -13.865 1.00 0.00 N ATOM 184 CA ASP A 17 7.312 4.642 -12.917 1.00 0.00 C ATOM 185 C ASP A 17 6.930 3.168 -12.819 1.00 0.00 C ATOM 186 O ASP A 17 6.059 2.692 -13.547 1.00 0.00 O ATOM 187 CB ASP A 17 7.225 5.297 -11.538 1.00 0.00 C ATOM 188 CG ASP A 17 7.045 6.800 -11.622 1.00 0.00 C ATOM 189 OD1 ASP A 17 7.532 7.402 -12.601 1.00 0.00 O ATOM 190 OD2 ASP A 17 6.416 7.374 -10.708 1.00 0.00 O ATOM 0 H ASP A 17 6.016 6.185 -13.496 1.00 0.00 H new ATOM 0 HA ASP A 17 8.338 4.710 -13.278 1.00 0.00 H new ATOM 0 HB2 ASP A 17 6.391 4.864 -10.985 1.00 0.00 H new ATOM 0 HB3 ASP A 17 8.131 5.073 -10.975 1.00 0.00 H new ATOM 195 N ASP A 18 7.589 2.451 -11.915 1.00 0.00 N ATOM 196 CA ASP A 18 7.318 1.031 -11.721 1.00 0.00 C ATOM 197 C ASP A 18 6.105 0.827 -10.818 1.00 0.00 C ATOM 198 O ASP A 18 5.452 -0.215 -10.865 1.00 0.00 O ATOM 199 CB ASP A 18 8.540 0.335 -11.119 1.00 0.00 C ATOM 200 CG ASP A 18 9.794 0.552 -11.943 1.00 0.00 C ATOM 201 OD1 ASP A 18 10.316 1.686 -11.941 1.00 0.00 O ATOM 202 OD2 ASP A 18 10.254 -0.413 -12.590 1.00 0.00 O ATOM 0 H ASP A 18 8.314 2.829 -11.305 1.00 0.00 H new ATOM 0 HA ASP A 18 7.101 0.591 -12.695 1.00 0.00 H new ATOM 0 HB2 ASP A 18 8.705 0.706 -10.108 1.00 0.00 H new ATOM 0 HB3 ASP A 18 8.342 -0.734 -11.038 1.00 0.00 H new ATOM 207 N VAL A 19 5.811 1.829 -9.996 1.00 0.00 N ATOM 208 CA VAL A 19 4.677 1.760 -9.082 1.00 0.00 C ATOM 209 C VAL A 19 3.358 1.713 -9.846 1.00 0.00 C ATOM 210 O VAL A 19 3.133 2.501 -10.765 1.00 0.00 O ATOM 211 CB VAL A 19 4.658 2.962 -8.120 1.00 0.00 C ATOM 212 CG1 VAL A 19 3.420 2.920 -7.237 1.00 0.00 C ATOM 213 CG2 VAL A 19 5.923 2.989 -7.276 1.00 0.00 C ATOM 0 H VAL A 19 6.342 2.698 -9.944 1.00 0.00 H new ATOM 0 HA VAL A 19 4.791 0.843 -8.504 1.00 0.00 H new ATOM 0 HB VAL A 19 4.623 3.877 -8.711 1.00 0.00 H new ATOM 0 HG11 VAL A 19 3.424 3.777 -6.564 1.00 0.00 H new ATOM 0 HG12 VAL A 19 2.527 2.953 -7.861 1.00 0.00 H new ATOM 0 HG13 VAL A 19 3.421 2.000 -6.653 1.00 0.00 H new ATOM 0 HG21 VAL A 19 5.892 3.845 -6.602 1.00 0.00 H new ATOM 0 HG22 VAL A 19 5.991 2.070 -6.693 1.00 0.00 H new ATOM 0 HG23 VAL A 19 6.793 3.071 -7.927 1.00 0.00 H new ATOM 223 N ILE A 20 2.490 0.784 -9.459 1.00 0.00 N ATOM 224 CA ILE A 20 1.192 0.636 -10.107 1.00 0.00 C ATOM 225 C ILE A 20 0.134 1.493 -9.420 1.00 0.00 C ATOM 226 O ILE A 20 -0.117 1.346 -8.224 1.00 0.00 O ATOM 227 CB ILE A 20 0.728 -0.833 -10.106 1.00 0.00 C ATOM 228 CG1 ILE A 20 1.672 -1.690 -10.951 1.00 0.00 C ATOM 229 CG2 ILE A 20 -0.699 -0.937 -10.625 1.00 0.00 C ATOM 230 CD1 ILE A 20 1.506 -3.176 -10.724 1.00 0.00 C ATOM 0 H ILE A 20 2.662 0.123 -8.701 1.00 0.00 H new ATOM 0 HA ILE A 20 1.313 0.970 -11.138 1.00 0.00 H new ATOM 0 HB ILE A 20 0.750 -1.205 -9.082 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.503 -1.471 -12.005 1.00 0.00 H new ATOM 0 HG13 ILE A 20 2.701 -1.410 -10.728 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -1.013 -1.981 -10.619 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -1.362 -0.354 -9.986 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -0.745 -0.551 -11.643 1.00 0.00 H new ATOM 0 HD11 ILE A 20 2.207 -3.721 -11.356 1.00 0.00 H new ATOM 0 HD12 ILE A 20 1.704 -3.409 -9.678 1.00 0.00 H new ATOM 0 HD13 ILE A 20 0.487 -3.471 -10.975 1.00 0.00 H new ATOM 242 N GLU A 21 -0.484 2.386 -10.186 1.00 0.00 N ATOM 243 CA GLU A 21 -1.517 3.266 -9.651 1.00 0.00 C ATOM 244 C GLU A 21 -2.758 2.471 -9.257 1.00 0.00 C ATOM 245 O GLU A 21 -3.614 2.178 -10.093 1.00 0.00 O ATOM 246 CB GLU A 21 -1.888 4.337 -10.678 1.00 0.00 C ATOM 247 CG GLU A 21 -2.552 5.560 -10.069 1.00 0.00 C ATOM 248 CD GLU A 21 -2.323 6.816 -10.887 1.00 0.00 C ATOM 249 OE1 GLU A 21 -2.267 6.712 -12.130 1.00 0.00 O ATOM 250 OE2 GLU A 21 -2.201 7.903 -10.285 1.00 0.00 O ATOM 0 H GLU A 21 -0.288 2.519 -11.178 1.00 0.00 H new ATOM 0 HA GLU A 21 -1.119 3.751 -8.759 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -0.987 4.649 -11.207 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -2.558 3.901 -11.419 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -3.623 5.380 -9.979 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -2.168 5.713 -9.060 1.00 0.00 H new ATOM 257 N LEU A 22 -2.850 2.123 -7.978 1.00 0.00 N ATOM 258 CA LEU A 22 -3.986 1.362 -7.471 1.00 0.00 C ATOM 259 C LEU A 22 -5.175 2.276 -7.194 1.00 0.00 C ATOM 260 O LEU A 22 -5.022 3.355 -6.619 1.00 0.00 O ATOM 261 CB LEU A 22 -3.596 0.613 -6.196 1.00 0.00 C ATOM 262 CG LEU A 22 -2.704 -0.615 -6.384 1.00 0.00 C ATOM 263 CD1 LEU A 22 -2.363 -1.238 -5.040 1.00 0.00 C ATOM 264 CD2 LEU A 22 -3.384 -1.633 -7.289 1.00 0.00 C ATOM 0 H LEU A 22 -2.151 2.356 -7.273 1.00 0.00 H new ATOM 0 HA LEU A 22 -4.277 0.640 -8.234 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -3.085 1.310 -5.531 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -4.509 0.300 -5.689 1.00 0.00 H new ATOM 0 HG LEU A 22 -1.776 -0.298 -6.859 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -1.728 -2.110 -5.194 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -1.836 -0.509 -4.424 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -3.281 -1.542 -4.536 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -2.736 -2.501 -7.412 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -4.327 -1.946 -6.841 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -3.577 -1.183 -8.263 1.00 0.00 H new ATOM 276 N THR A 23 -6.361 1.838 -7.604 1.00 0.00 N ATOM 277 CA THR A 23 -7.576 2.615 -7.400 1.00 0.00 C ATOM 278 C THR A 23 -8.711 1.738 -6.884 1.00 0.00 C ATOM 279 O THR A 23 -8.679 0.512 -6.994 1.00 0.00 O ATOM 280 CB THR A 23 -8.027 3.306 -8.701 1.00 0.00 C ATOM 281 OG1 THR A 23 -9.025 2.514 -9.355 1.00 0.00 O ATOM 282 CG2 THR A 23 -6.848 3.519 -9.637 1.00 0.00 C ATOM 0 H THR A 23 -6.505 0.948 -8.080 1.00 0.00 H new ATOM 0 HA THR A 23 -7.342 3.376 -6.655 1.00 0.00 H new ATOM 0 HB THR A 23 -8.446 4.279 -8.444 1.00 0.00 H new ATOM 0 HG1 THR A 23 -8.663 2.158 -10.193 1.00 0.00 H new ATOM 0 HG21 THR A 23 -7.191 4.008 -10.549 1.00 0.00 H new ATOM 0 HG22 THR A 23 -6.103 4.146 -9.147 1.00 0.00 H new ATOM 0 HG23 THR A 23 -6.404 2.556 -9.887 1.00 0.00 H new ATOM 290 N PRO A 24 -9.740 2.377 -6.308 1.00 0.00 N ATOM 291 CA PRO A 24 -10.905 1.672 -5.764 1.00 0.00 C ATOM 292 C PRO A 24 -11.772 1.057 -6.857 1.00 0.00 C ATOM 293 O PRO A 24 -12.937 0.732 -6.629 1.00 0.00 O ATOM 294 CB PRO A 24 -11.673 2.773 -5.028 1.00 0.00 C ATOM 295 CG PRO A 24 -11.271 4.036 -5.708 1.00 0.00 C ATOM 296 CD PRO A 24 -9.845 3.836 -6.142 1.00 0.00 C ATOM 0 HA PRO A 24 -10.616 0.836 -5.127 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -12.750 2.615 -5.092 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -11.416 2.795 -3.969 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -11.914 4.241 -6.564 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -11.358 4.887 -5.033 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -9.630 4.363 -7.072 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -9.142 4.207 -5.396 1.00 0.00 H new ATOM 304 N SER A 25 -11.196 0.901 -8.045 1.00 0.00 N ATOM 305 CA SER A 25 -11.918 0.327 -9.175 1.00 0.00 C ATOM 306 C SER A 25 -11.196 -0.904 -9.713 1.00 0.00 C ATOM 307 O SER A 25 -11.800 -1.757 -10.361 1.00 0.00 O ATOM 308 CB SER A 25 -12.076 1.367 -10.287 1.00 0.00 C ATOM 309 OG SER A 25 -13.213 2.183 -10.064 1.00 0.00 O ATOM 0 H SER A 25 -10.232 1.164 -8.250 1.00 0.00 H new ATOM 0 HA SER A 25 -12.906 0.024 -8.827 1.00 0.00 H new ATOM 0 HB2 SER A 25 -11.182 1.989 -10.337 1.00 0.00 H new ATOM 0 HB3 SER A 25 -12.169 0.864 -11.249 1.00 0.00 H new ATOM 0 HG SER A 25 -13.291 2.840 -10.787 1.00 0.00 H new ATOM 315 N ASN A 26 -9.898 -0.987 -9.440 1.00 0.00 N ATOM 316 CA ASN A 26 -9.091 -2.113 -9.897 1.00 0.00 C ATOM 317 C ASN A 26 -8.362 -2.769 -8.728 1.00 0.00 C ATOM 318 O ASN A 26 -7.883 -3.898 -8.837 1.00 0.00 O ATOM 319 CB ASN A 26 -8.080 -1.650 -10.948 1.00 0.00 C ATOM 320 CG ASN A 26 -7.623 -0.222 -10.720 1.00 0.00 C ATOM 321 OD1 ASN A 26 -8.364 0.727 -10.975 1.00 0.00 O ATOM 322 ND2 ASN A 26 -6.396 -0.064 -10.238 1.00 0.00 N ATOM 0 H ASN A 26 -9.382 -0.288 -8.905 1.00 0.00 H new ATOM 0 HA ASN A 26 -9.759 -2.849 -10.345 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -7.215 -2.313 -10.933 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -8.527 -1.732 -11.939 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -6.033 0.873 -10.065 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -5.816 -0.880 -10.041 1.00 0.00 H new ATOM 329 N PHE A 27 -8.282 -2.054 -7.611 1.00 0.00 N ATOM 330 CA PHE A 27 -7.611 -2.566 -6.422 1.00 0.00 C ATOM 331 C PHE A 27 -7.878 -4.058 -6.247 1.00 0.00 C ATOM 332 O PHE A 27 -7.040 -4.792 -5.724 1.00 0.00 O ATOM 333 CB PHE A 27 -8.077 -1.804 -5.179 1.00 0.00 C ATOM 334 CG PHE A 27 -7.274 -2.116 -3.949 1.00 0.00 C ATOM 335 CD1 PHE A 27 -7.332 -3.372 -3.367 1.00 0.00 C ATOM 336 CD2 PHE A 27 -6.461 -1.152 -3.373 1.00 0.00 C ATOM 337 CE1 PHE A 27 -6.595 -3.662 -2.235 1.00 0.00 C ATOM 338 CE2 PHE A 27 -5.721 -1.437 -2.242 1.00 0.00 C ATOM 339 CZ PHE A 27 -5.789 -2.693 -1.671 1.00 0.00 C ATOM 0 H PHE A 27 -8.674 -1.118 -7.504 1.00 0.00 H new ATOM 0 HA PHE A 27 -6.538 -2.419 -6.549 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -8.022 -0.734 -5.377 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -9.124 -2.040 -4.989 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -7.961 -4.134 -3.804 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -6.406 -0.167 -3.813 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -6.649 -4.645 -1.792 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -5.089 -0.678 -1.804 1.00 0.00 H new ATOM 0 HZ PHE A 27 -5.213 -2.917 -0.785 1.00 0.00 H new ATOM 349 N ASN A 28 -9.052 -4.499 -6.687 1.00 0.00 N ATOM 350 CA ASN A 28 -9.431 -5.903 -6.579 1.00 0.00 C ATOM 351 C ASN A 28 -8.888 -6.706 -7.757 1.00 0.00 C ATOM 352 O ASN A 28 -8.366 -7.807 -7.583 1.00 0.00 O ATOM 353 CB ASN A 28 -10.954 -6.038 -6.514 1.00 0.00 C ATOM 354 CG ASN A 28 -11.394 -7.442 -6.145 1.00 0.00 C ATOM 355 OD1 ASN A 28 -11.747 -7.713 -4.997 1.00 0.00 O ATOM 356 ND2 ASN A 28 -11.376 -8.342 -7.121 1.00 0.00 N ATOM 0 H ASN A 28 -9.757 -3.904 -7.122 1.00 0.00 H new ATOM 0 HA ASN A 28 -8.998 -6.301 -5.661 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -11.348 -5.333 -5.782 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -11.382 -5.768 -7.480 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -11.662 -9.303 -6.934 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -11.076 -8.072 -8.058 1.00 0.00 H new ATOM 363 N ARG A 29 -9.014 -6.146 -8.956 1.00 0.00 N ATOM 364 CA ARG A 29 -8.537 -6.809 -10.163 1.00 0.00 C ATOM 365 C ARG A 29 -7.021 -6.684 -10.289 1.00 0.00 C ATOM 366 O ARG A 29 -6.413 -7.269 -11.185 1.00 0.00 O ATOM 367 CB ARG A 29 -9.213 -6.214 -11.399 1.00 0.00 C ATOM 368 CG ARG A 29 -10.546 -6.862 -11.736 1.00 0.00 C ATOM 369 CD ARG A 29 -11.645 -6.397 -10.794 1.00 0.00 C ATOM 370 NE ARG A 29 -12.961 -6.434 -11.427 1.00 0.00 N ATOM 371 CZ ARG A 29 -13.365 -5.551 -12.334 1.00 0.00 C ATOM 372 NH1 ARG A 29 -12.561 -4.568 -12.711 1.00 0.00 N ATOM 373 NH2 ARG A 29 -14.577 -5.652 -12.865 1.00 0.00 N ATOM 0 H ARG A 29 -9.443 -5.235 -9.117 1.00 0.00 H new ATOM 0 HA ARG A 29 -8.793 -7.866 -10.092 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -9.367 -5.147 -11.240 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -8.543 -6.315 -12.253 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -10.820 -6.621 -12.763 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -10.450 -7.946 -11.678 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -11.652 -7.029 -9.906 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -11.431 -5.381 -10.461 1.00 0.00 H new ATOM 0 HE ARG A 29 -13.605 -7.178 -11.158 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -11.629 -4.487 -12.305 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -12.874 -3.892 -13.407 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -15.199 -6.408 -12.577 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -14.887 -4.974 -13.561 1.00 0.00 H new ATOM 387 N GLU A 30 -6.419 -5.917 -9.386 1.00 0.00 N ATOM 388 CA GLU A 30 -4.975 -5.714 -9.398 1.00 0.00 C ATOM 389 C GLU A 30 -4.308 -6.481 -8.259 1.00 0.00 C ATOM 390 O GLU A 30 -3.345 -7.217 -8.471 1.00 0.00 O ATOM 391 CB GLU A 30 -4.645 -4.224 -9.286 1.00 0.00 C ATOM 392 CG GLU A 30 -4.539 -3.522 -10.629 1.00 0.00 C ATOM 393 CD GLU A 30 -3.241 -3.833 -11.349 1.00 0.00 C ATOM 394 OE1 GLU A 30 -2.189 -3.883 -10.679 1.00 0.00 O ATOM 395 OE2 GLU A 30 -3.278 -4.026 -12.582 1.00 0.00 O ATOM 0 H GLU A 30 -6.908 -5.426 -8.637 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.589 -6.094 -10.344 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.414 -3.734 -8.689 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -3.703 -4.108 -8.750 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -5.379 -3.819 -11.257 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -4.618 -2.445 -10.479 1.00 0.00 H new ATOM 402 N VAL A 31 -4.829 -6.301 -7.049 1.00 0.00 N ATOM 403 CA VAL A 31 -4.286 -6.975 -5.875 1.00 0.00 C ATOM 404 C VAL A 31 -5.103 -8.213 -5.525 1.00 0.00 C ATOM 405 O VAL A 31 -4.605 -9.337 -5.591 1.00 0.00 O ATOM 406 CB VAL A 31 -4.249 -6.036 -4.655 1.00 0.00 C ATOM 407 CG1 VAL A 31 -3.686 -6.759 -3.441 1.00 0.00 C ATOM 408 CG2 VAL A 31 -3.436 -4.789 -4.968 1.00 0.00 C ATOM 0 H VAL A 31 -5.626 -5.694 -6.856 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.268 -7.274 -6.125 1.00 0.00 H new ATOM 0 HB VAL A 31 -5.269 -5.729 -4.424 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -3.668 -6.079 -2.589 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -4.314 -7.619 -3.206 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.673 -7.098 -3.657 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -3.420 -4.136 -4.095 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -2.416 -5.075 -5.226 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.888 -4.261 -5.808 1.00 0.00 H new ATOM 418 N ILE A 32 -6.361 -7.999 -5.154 1.00 0.00 N ATOM 419 CA ILE A 32 -7.248 -9.098 -4.795 1.00 0.00 C ATOM 420 C ILE A 32 -7.221 -10.195 -5.854 1.00 0.00 C ATOM 421 O ILE A 32 -7.365 -11.377 -5.540 1.00 0.00 O ATOM 422 CB ILE A 32 -8.699 -8.614 -4.611 1.00 0.00 C ATOM 423 CG1 ILE A 32 -8.752 -7.467 -3.601 1.00 0.00 C ATOM 424 CG2 ILE A 32 -9.588 -9.764 -4.163 1.00 0.00 C ATOM 425 CD1 ILE A 32 -8.311 -7.865 -2.210 1.00 0.00 C ATOM 0 H ILE A 32 -6.788 -7.075 -5.094 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.885 -9.500 -3.849 1.00 0.00 H new ATOM 0 HB ILE A 32 -9.069 -8.247 -5.568 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -8.119 -6.653 -3.955 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -9.771 -7.082 -3.554 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -10.610 -9.406 -4.037 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -9.570 -10.553 -4.915 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -9.222 -10.158 -3.215 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -8.374 -7.002 -1.547 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -8.959 -8.658 -1.836 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -7.282 -8.222 -2.243 1.00 0.00 H new ATOM 437 N GLN A 33 -7.033 -9.796 -7.107 1.00 0.00 N ATOM 438 CA GLN A 33 -6.985 -10.746 -8.212 1.00 0.00 C ATOM 439 C GLN A 33 -5.543 -11.083 -8.578 1.00 0.00 C ATOM 440 O GLN A 33 -5.238 -11.377 -9.734 1.00 0.00 O ATOM 441 CB GLN A 33 -7.714 -10.179 -9.432 1.00 0.00 C ATOM 442 CG GLN A 33 -9.227 -10.165 -9.284 1.00 0.00 C ATOM 443 CD GLN A 33 -9.737 -11.285 -8.399 1.00 0.00 C ATOM 444 OE1 GLN A 33 -9.937 -12.410 -8.856 1.00 0.00 O ATOM 445 NE2 GLN A 33 -9.950 -10.981 -7.124 1.00 0.00 N ATOM 0 H GLN A 33 -6.911 -8.822 -7.383 1.00 0.00 H new ATOM 0 HA GLN A 33 -7.483 -11.661 -7.893 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -7.365 -9.162 -9.613 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -7.448 -10.768 -10.310 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -9.539 -9.207 -8.867 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -9.685 -10.248 -10.269 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -9.770 -10.035 -6.788 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -10.293 -11.694 -6.480 1.00 0.00 H new ATOM 454 N SER A 34 -4.660 -11.039 -7.586 1.00 0.00 N ATOM 455 CA SER A 34 -3.249 -11.336 -7.804 1.00 0.00 C ATOM 456 C SER A 34 -2.735 -12.326 -6.763 1.00 0.00 C ATOM 457 O SER A 34 -2.477 -11.961 -5.616 1.00 0.00 O ATOM 458 CB SER A 34 -2.422 -10.050 -7.753 1.00 0.00 C ATOM 459 OG SER A 34 -1.061 -10.307 -8.052 1.00 0.00 O ATOM 0 H SER A 34 -4.897 -10.800 -6.623 1.00 0.00 H new ATOM 0 HA SER A 34 -3.146 -11.787 -8.791 1.00 0.00 H new ATOM 0 HB2 SER A 34 -2.823 -9.327 -8.463 1.00 0.00 H new ATOM 0 HB3 SER A 34 -2.502 -9.602 -6.763 1.00 0.00 H new ATOM 0 HG SER A 34 -0.490 -9.798 -7.439 1.00 0.00 H new ATOM 465 N ASP A 35 -2.589 -13.582 -7.173 1.00 0.00 N ATOM 466 CA ASP A 35 -2.105 -14.626 -6.278 1.00 0.00 C ATOM 467 C ASP A 35 -0.772 -14.230 -5.651 1.00 0.00 C ATOM 468 O ASP A 35 -0.468 -14.611 -4.521 1.00 0.00 O ATOM 469 CB ASP A 35 -1.954 -15.947 -7.035 1.00 0.00 C ATOM 470 CG ASP A 35 -0.793 -15.927 -8.009 1.00 0.00 C ATOM 471 OD1 ASP A 35 0.354 -16.153 -7.570 1.00 0.00 O ATOM 472 OD2 ASP A 35 -1.031 -15.685 -9.211 1.00 0.00 O ATOM 0 H ASP A 35 -2.799 -13.901 -8.119 1.00 0.00 H new ATOM 0 HA ASP A 35 -2.837 -14.754 -5.481 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -1.811 -16.757 -6.320 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -2.876 -16.159 -7.577 1.00 0.00 H new ATOM 477 N GLY A 36 0.022 -13.464 -6.394 1.00 0.00 N ATOM 478 CA GLY A 36 1.313 -13.030 -5.895 1.00 0.00 C ATOM 479 C GLY A 36 1.192 -12.020 -4.771 1.00 0.00 C ATOM 480 O GLY A 36 0.085 -11.676 -4.353 1.00 0.00 O ATOM 0 H GLY A 36 -0.207 -13.137 -7.333 1.00 0.00 H new ATOM 0 HA2 GLY A 36 1.872 -13.896 -5.542 1.00 0.00 H new ATOM 0 HA3 GLY A 36 1.886 -12.592 -6.712 1.00 0.00 H new ATOM 484 N LEU A 37 2.330 -11.545 -4.279 1.00 0.00 N ATOM 485 CA LEU A 37 2.347 -10.569 -3.195 1.00 0.00 C ATOM 486 C LEU A 37 2.097 -9.161 -3.725 1.00 0.00 C ATOM 487 O LEU A 37 2.517 -8.820 -4.831 1.00 0.00 O ATOM 488 CB LEU A 37 3.687 -10.619 -2.458 1.00 0.00 C ATOM 489 CG LEU A 37 3.648 -10.268 -0.971 1.00 0.00 C ATOM 490 CD1 LEU A 37 3.003 -11.391 -0.174 1.00 0.00 C ATOM 491 CD2 LEU A 37 5.051 -9.982 -0.454 1.00 0.00 C ATOM 0 H LEU A 37 3.254 -11.820 -4.613 1.00 0.00 H new ATOM 0 HA LEU A 37 1.547 -10.822 -2.499 1.00 0.00 H new ATOM 0 HB2 LEU A 37 4.100 -11.622 -2.563 1.00 0.00 H new ATOM 0 HB3 LEU A 37 4.377 -9.937 -2.954 1.00 0.00 H new ATOM 0 HG LEU A 37 3.045 -9.369 -0.845 1.00 0.00 H new ATOM 0 HD11 LEU A 37 2.984 -11.123 0.882 1.00 0.00 H new ATOM 0 HD12 LEU A 37 1.984 -11.549 -0.527 1.00 0.00 H new ATOM 0 HD13 LEU A 37 3.578 -12.307 -0.306 1.00 0.00 H new ATOM 0 HD21 LEU A 37 5.004 -9.734 0.606 1.00 0.00 H new ATOM 0 HD22 LEU A 37 5.677 -10.864 -0.593 1.00 0.00 H new ATOM 0 HD23 LEU A 37 5.478 -9.144 -1.004 1.00 0.00 H new ATOM 503 N TRP A 38 1.412 -8.348 -2.929 1.00 0.00 N ATOM 504 CA TRP A 38 1.108 -6.975 -3.318 1.00 0.00 C ATOM 505 C TRP A 38 1.409 -6.008 -2.179 1.00 0.00 C ATOM 506 O TRP A 38 1.000 -6.229 -1.038 1.00 0.00 O ATOM 507 CB TRP A 38 -0.359 -6.854 -3.733 1.00 0.00 C ATOM 508 CG TRP A 38 -0.560 -6.876 -5.218 1.00 0.00 C ATOM 509 CD1 TRP A 38 -0.799 -7.972 -5.997 1.00 0.00 C ATOM 510 CD2 TRP A 38 -0.538 -5.750 -6.102 1.00 0.00 C ATOM 511 NE1 TRP A 38 -0.927 -7.595 -7.312 1.00 0.00 N ATOM 512 CE2 TRP A 38 -0.772 -6.237 -7.403 1.00 0.00 C ATOM 513 CE3 TRP A 38 -0.346 -4.378 -5.922 1.00 0.00 C ATOM 514 CZ2 TRP A 38 -0.816 -5.400 -8.514 1.00 0.00 C ATOM 515 CZ3 TRP A 38 -0.390 -3.548 -7.026 1.00 0.00 C ATOM 516 CH2 TRP A 38 -0.625 -4.061 -8.309 1.00 0.00 C ATOM 0 H TRP A 38 1.057 -8.615 -2.011 1.00 0.00 H new ATOM 0 HA TRP A 38 1.741 -6.715 -4.167 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -0.924 -7.671 -3.285 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -0.767 -5.926 -3.332 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -0.876 -8.986 -5.633 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -1.108 -8.224 -8.094 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -0.166 -3.973 -4.937 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -0.995 -5.794 -9.504 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -0.241 -2.486 -6.898 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -0.656 -3.386 -9.152 1.00 0.00 H new ATOM 527 N LEU A 39 2.125 -4.934 -2.494 1.00 0.00 N ATOM 528 CA LEU A 39 2.480 -3.931 -1.496 1.00 0.00 C ATOM 529 C LEU A 39 1.779 -2.607 -1.781 1.00 0.00 C ATOM 530 O LEU A 39 2.207 -1.838 -2.642 1.00 0.00 O ATOM 531 CB LEU A 39 3.996 -3.724 -1.470 1.00 0.00 C ATOM 532 CG LEU A 39 4.776 -4.598 -0.487 1.00 0.00 C ATOM 533 CD1 LEU A 39 6.267 -4.528 -0.779 1.00 0.00 C ATOM 534 CD2 LEU A 39 4.490 -4.174 0.946 1.00 0.00 C ATOM 0 H LEU A 39 2.471 -4.735 -3.433 1.00 0.00 H new ATOM 0 HA LEU A 39 2.152 -4.292 -0.521 1.00 0.00 H new ATOM 0 HB2 LEU A 39 4.384 -3.904 -2.472 1.00 0.00 H new ATOM 0 HB3 LEU A 39 4.196 -2.679 -1.234 1.00 0.00 H new ATOM 0 HG LEU A 39 4.451 -5.631 -0.610 1.00 0.00 H new ATOM 0 HD11 LEU A 39 6.806 -5.156 -0.070 1.00 0.00 H new ATOM 0 HD12 LEU A 39 6.456 -4.881 -1.793 1.00 0.00 H new ATOM 0 HD13 LEU A 39 6.608 -3.497 -0.684 1.00 0.00 H new ATOM 0 HD21 LEU A 39 5.053 -4.807 1.632 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.787 -3.134 1.084 1.00 0.00 H new ATOM 0 HD23 LEU A 39 3.424 -4.277 1.150 1.00 0.00 H new ATOM 546 N VAL A 40 0.700 -2.345 -1.050 1.00 0.00 N ATOM 547 CA VAL A 40 -0.059 -1.112 -1.222 1.00 0.00 C ATOM 548 C VAL A 40 0.256 -0.115 -0.113 1.00 0.00 C ATOM 549 O VAL A 40 0.184 -0.444 1.070 1.00 0.00 O ATOM 550 CB VAL A 40 -1.575 -1.384 -1.238 1.00 0.00 C ATOM 551 CG1 VAL A 40 -2.342 -0.113 -1.568 1.00 0.00 C ATOM 552 CG2 VAL A 40 -1.907 -2.490 -2.228 1.00 0.00 C ATOM 0 H VAL A 40 0.332 -2.970 -0.333 1.00 0.00 H new ATOM 0 HA VAL A 40 0.236 -0.689 -2.182 1.00 0.00 H new ATOM 0 HB VAL A 40 -1.878 -1.714 -0.245 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -3.411 -0.325 -1.575 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -2.127 0.647 -0.817 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -2.038 0.251 -2.549 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.982 -2.669 -2.226 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -1.590 -2.191 -3.227 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -1.387 -3.404 -1.941 1.00 0.00 H new ATOM 562 N GLU A 41 0.604 1.107 -0.505 1.00 0.00 N ATOM 563 CA GLU A 41 0.930 2.153 0.457 1.00 0.00 C ATOM 564 C GLU A 41 -0.070 3.303 0.370 1.00 0.00 C ATOM 565 O GLU A 41 -0.417 3.758 -0.720 1.00 0.00 O ATOM 566 CB GLU A 41 2.347 2.677 0.214 1.00 0.00 C ATOM 567 CG GLU A 41 2.651 3.974 0.944 1.00 0.00 C ATOM 568 CD GLU A 41 2.364 5.200 0.100 1.00 0.00 C ATOM 569 OE1 GLU A 41 1.178 5.444 -0.207 1.00 0.00 O ATOM 570 OE2 GLU A 41 3.324 5.916 -0.254 1.00 0.00 O ATOM 0 H GLU A 41 0.667 1.396 -1.481 1.00 0.00 H new ATOM 0 HA GLU A 41 0.876 1.721 1.456 1.00 0.00 H new ATOM 0 HB2 GLU A 41 3.064 1.918 0.526 1.00 0.00 H new ATOM 0 HB3 GLU A 41 2.490 2.830 -0.856 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.058 4.020 1.858 1.00 0.00 H new ATOM 0 HG3 GLU A 41 3.699 3.981 1.243 1.00 0.00 H new ATOM 577 N PHE A 42 -0.531 3.766 1.527 1.00 0.00 N ATOM 578 CA PHE A 42 -1.492 4.861 1.584 1.00 0.00 C ATOM 579 C PHE A 42 -0.804 6.171 1.958 1.00 0.00 C ATOM 580 O PHE A 42 -0.529 6.427 3.130 1.00 0.00 O ATOM 581 CB PHE A 42 -2.598 4.546 2.594 1.00 0.00 C ATOM 582 CG PHE A 42 -3.406 3.331 2.238 1.00 0.00 C ATOM 583 CD1 PHE A 42 -2.958 2.063 2.568 1.00 0.00 C ATOM 584 CD2 PHE A 42 -4.615 3.458 1.572 1.00 0.00 C ATOM 585 CE1 PHE A 42 -3.700 0.943 2.243 1.00 0.00 C ATOM 586 CE2 PHE A 42 -5.361 2.342 1.244 1.00 0.00 C ATOM 587 CZ PHE A 42 -4.902 1.083 1.579 1.00 0.00 C ATOM 0 H PHE A 42 -0.255 3.400 2.438 1.00 0.00 H new ATOM 0 HA PHE A 42 -1.935 4.974 0.594 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -2.150 4.400 3.577 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -3.264 5.405 2.672 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -2.017 1.948 3.086 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -4.978 4.440 1.307 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -3.340 -0.040 2.508 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -6.302 2.454 0.726 1.00 0.00 H new ATOM 0 HZ PHE A 42 -5.483 0.209 1.322 1.00 0.00 H new ATOM 597 N TYR A 43 -0.529 6.995 0.954 1.00 0.00 N ATOM 598 CA TYR A 43 0.130 8.277 1.176 1.00 0.00 C ATOM 599 C TYR A 43 -0.847 9.433 0.981 1.00 0.00 C ATOM 600 O TYR A 43 -2.008 9.226 0.629 1.00 0.00 O ATOM 601 CB TYR A 43 1.319 8.434 0.227 1.00 0.00 C ATOM 602 CG TYR A 43 0.922 8.799 -1.186 1.00 0.00 C ATOM 603 CD1 TYR A 43 0.618 10.111 -1.526 1.00 0.00 C ATOM 604 CD2 TYR A 43 0.851 7.831 -2.181 1.00 0.00 C ATOM 605 CE1 TYR A 43 0.254 10.449 -2.816 1.00 0.00 C ATOM 606 CE2 TYR A 43 0.489 8.160 -3.473 1.00 0.00 C ATOM 607 CZ TYR A 43 0.192 9.470 -3.785 1.00 0.00 C ATOM 608 OH TYR A 43 -0.170 9.801 -5.071 1.00 0.00 O ATOM 0 H TYR A 43 -0.752 6.799 -0.022 1.00 0.00 H new ATOM 0 HA TYR A 43 0.489 8.299 2.205 1.00 0.00 H new ATOM 0 HB2 TYR A 43 1.986 9.202 0.618 1.00 0.00 H new ATOM 0 HB3 TYR A 43 1.883 7.502 0.208 1.00 0.00 H new ATOM 0 HD1 TYR A 43 0.667 10.880 -0.770 1.00 0.00 H new ATOM 0 HD2 TYR A 43 1.083 6.804 -1.940 1.00 0.00 H new ATOM 0 HE1 TYR A 43 0.020 11.474 -3.063 1.00 0.00 H new ATOM 0 HE2 TYR A 43 0.439 7.396 -4.234 1.00 0.00 H new ATOM 0 HH TYR A 43 -0.163 8.996 -5.630 1.00 0.00 H new ATOM 618 N ALA A 44 -0.367 10.650 1.212 1.00 0.00 N ATOM 619 CA ALA A 44 -1.195 11.840 1.059 1.00 0.00 C ATOM 620 C ALA A 44 -0.442 12.943 0.324 1.00 0.00 C ATOM 621 O ALA A 44 0.613 13.405 0.760 1.00 0.00 O ATOM 622 CB ALA A 44 -1.663 12.334 2.420 1.00 0.00 C ATOM 0 H ALA A 44 0.591 10.838 1.506 1.00 0.00 H new ATOM 0 HA ALA A 44 -2.066 11.572 0.462 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -2.280 13.223 2.292 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -2.247 11.554 2.909 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -0.797 12.579 3.035 1.00 0.00 H new ATOM 628 N PRO A 45 -0.993 13.376 -0.820 1.00 0.00 N ATOM 629 CA PRO A 45 -0.389 14.430 -1.640 1.00 0.00 C ATOM 630 C PRO A 45 -0.463 15.799 -0.972 1.00 0.00 C ATOM 631 O PRO A 45 -0.086 16.810 -1.564 1.00 0.00 O ATOM 632 CB PRO A 45 -1.232 14.412 -2.918 1.00 0.00 C ATOM 633 CG PRO A 45 -2.548 13.856 -2.495 1.00 0.00 C ATOM 634 CD PRO A 45 -2.248 12.870 -1.400 1.00 0.00 C ATOM 0 HA PRO A 45 0.673 14.255 -1.811 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -1.341 15.413 -3.335 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -0.770 13.794 -3.688 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -3.209 14.646 -2.139 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -3.053 13.370 -3.330 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -3.048 12.836 -0.660 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -2.131 11.859 -1.790 1.00 0.00 H new ATOM 642 N TRP A 46 -0.950 15.823 0.263 1.00 0.00 N ATOM 643 CA TRP A 46 -1.073 17.068 1.012 1.00 0.00 C ATOM 644 C TRP A 46 -0.180 17.051 2.248 1.00 0.00 C ATOM 645 O TRP A 46 0.068 18.090 2.860 1.00 0.00 O ATOM 646 CB TRP A 46 -2.528 17.300 1.422 1.00 0.00 C ATOM 647 CG TRP A 46 -3.114 16.161 2.200 1.00 0.00 C ATOM 648 CD1 TRP A 46 -4.059 15.274 1.769 1.00 0.00 C ATOM 649 CD2 TRP A 46 -2.796 15.788 3.546 1.00 0.00 C ATOM 650 NE1 TRP A 46 -4.347 14.372 2.765 1.00 0.00 N ATOM 651 CE2 TRP A 46 -3.584 14.666 3.865 1.00 0.00 C ATOM 652 CE3 TRP A 46 -1.919 16.292 4.510 1.00 0.00 C ATOM 653 CZ2 TRP A 46 -3.522 14.042 5.108 1.00 0.00 C ATOM 654 CZ3 TRP A 46 -1.859 15.673 5.744 1.00 0.00 C ATOM 655 CH2 TRP A 46 -2.656 14.557 6.034 1.00 0.00 C ATOM 0 H TRP A 46 -1.266 14.995 0.767 1.00 0.00 H new ATOM 0 HA TRP A 46 -0.751 17.884 0.365 1.00 0.00 H new ATOM 0 HB2 TRP A 46 -2.589 18.209 2.020 1.00 0.00 H new ATOM 0 HB3 TRP A 46 -3.128 17.467 0.527 1.00 0.00 H new ATOM 0 HD1 TRP A 46 -4.513 15.281 0.789 1.00 0.00 H new ATOM 0 HE1 TRP A 46 -5.019 13.608 2.697 1.00 0.00 H new ATOM 0 HE3 TRP A 46 -1.299 17.150 4.295 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 -4.135 13.182 5.333 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 -1.187 16.056 6.498 1.00 0.00 H new ATOM 0 HH2 TRP A 46 -2.585 14.094 7.007 1.00 0.00 H new ATOM 666 N CYS A 47 0.299 15.866 2.609 1.00 0.00 N ATOM 667 CA CYS A 47 1.164 15.714 3.774 1.00 0.00 C ATOM 668 C CYS A 47 2.627 15.926 3.396 1.00 0.00 C ATOM 669 O CYS A 47 2.955 16.118 2.226 1.00 0.00 O ATOM 670 CB CYS A 47 0.981 14.328 4.394 1.00 0.00 C ATOM 671 SG CYS A 47 1.143 14.298 6.195 1.00 0.00 S ATOM 0 H CYS A 47 0.103 14.997 2.112 1.00 0.00 H new ATOM 0 HA CYS A 47 0.883 16.471 4.506 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -0.003 13.947 4.122 1.00 0.00 H new ATOM 0 HB3 CYS A 47 1.716 13.649 3.962 1.00 0.00 H new ATOM 0 HG CYS A 47 1.739 13.202 6.559 1.00 0.00 H new ATOM 677 N GLY A 48 3.502 15.891 4.396 1.00 0.00 N ATOM 678 CA GLY A 48 4.919 16.083 4.148 1.00 0.00 C ATOM 679 C GLY A 48 5.677 14.772 4.075 1.00 0.00 C ATOM 680 O GLY A 48 6.134 14.370 3.005 1.00 0.00 O ATOM 0 H GLY A 48 3.255 15.733 5.373 1.00 0.00 H new ATOM 0 HA2 GLY A 48 5.051 16.628 3.213 1.00 0.00 H new ATOM 0 HA3 GLY A 48 5.343 16.701 4.940 1.00 0.00 H new ATOM 684 N HIS A 49 5.814 14.105 5.217 1.00 0.00 N ATOM 685 CA HIS A 49 6.523 12.832 5.278 1.00 0.00 C ATOM 686 C HIS A 49 6.078 11.907 4.149 1.00 0.00 C ATOM 687 O HIS A 49 6.842 11.055 3.694 1.00 0.00 O ATOM 688 CB HIS A 49 6.288 12.157 6.629 1.00 0.00 C ATOM 689 CG HIS A 49 4.868 12.239 7.100 1.00 0.00 C ATOM 690 ND1 HIS A 49 4.514 12.729 8.340 1.00 0.00 N ATOM 691 CD2 HIS A 49 3.711 11.892 6.490 1.00 0.00 C ATOM 692 CE1 HIS A 49 3.200 12.678 8.472 1.00 0.00 C ATOM 693 NE2 HIS A 49 2.689 12.174 7.363 1.00 0.00 N ATOM 0 H HIS A 49 5.444 14.425 6.112 1.00 0.00 H new ATOM 0 HA HIS A 49 7.588 13.032 5.161 1.00 0.00 H new ATOM 0 HB2 HIS A 49 6.579 11.109 6.558 1.00 0.00 H new ATOM 0 HB3 HIS A 49 6.937 12.618 7.374 1.00 0.00 H new ATOM 0 HD1 HIS A 49 5.165 13.076 9.045 1.00 0.00 H new ATOM 0 HD2 HIS A 49 3.610 11.471 5.500 1.00 0.00 H new ATOM 0 HE1 HIS A 49 2.639 12.995 9.339 1.00 0.00 H new ATOM 702 N CYS A 50 4.838 12.079 3.704 1.00 0.00 N ATOM 703 CA CYS A 50 4.291 11.259 2.629 1.00 0.00 C ATOM 704 C CYS A 50 4.952 11.595 1.297 1.00 0.00 C ATOM 705 O CYS A 50 5.428 10.708 0.589 1.00 0.00 O ATOM 706 CB CYS A 50 2.778 11.459 2.527 1.00 0.00 C ATOM 707 SG CYS A 50 1.832 10.618 3.818 1.00 0.00 S ATOM 0 H CYS A 50 4.193 12.779 4.071 1.00 0.00 H new ATOM 0 HA CYS A 50 4.497 10.214 2.862 1.00 0.00 H new ATOM 0 HB2 CYS A 50 2.560 12.526 2.569 1.00 0.00 H new ATOM 0 HB3 CYS A 50 2.440 11.103 1.554 1.00 0.00 H new ATOM 0 HG CYS A 50 0.595 11.015 3.778 1.00 0.00 H new ATOM 713 N GLN A 51 4.977 12.881 0.963 1.00 0.00 N ATOM 714 CA GLN A 51 5.578 13.334 -0.286 1.00 0.00 C ATOM 715 C GLN A 51 7.055 12.959 -0.347 1.00 0.00 C ATOM 716 O GLN A 51 7.670 12.987 -1.413 1.00 0.00 O ATOM 717 CB GLN A 51 5.417 14.848 -0.435 1.00 0.00 C ATOM 718 CG GLN A 51 3.969 15.310 -0.417 1.00 0.00 C ATOM 719 CD GLN A 51 3.840 16.821 -0.392 1.00 0.00 C ATOM 720 OE1 GLN A 51 4.792 17.542 -0.690 1.00 0.00 O ATOM 721 NE2 GLN A 51 2.657 17.308 -0.036 1.00 0.00 N ATOM 0 H GLN A 51 4.588 13.627 1.539 1.00 0.00 H new ATOM 0 HA GLN A 51 5.062 12.839 -1.109 1.00 0.00 H new ATOM 0 HB2 GLN A 51 5.958 15.344 0.371 1.00 0.00 H new ATOM 0 HB3 GLN A 51 5.879 15.164 -1.370 1.00 0.00 H new ATOM 0 HG2 GLN A 51 3.456 14.920 -1.296 1.00 0.00 H new ATOM 0 HG3 GLN A 51 3.469 14.892 0.456 1.00 0.00 H new ATOM 0 HE21 GLN A 51 1.895 16.673 0.203 1.00 0.00 H new ATOM 0 HE22 GLN A 51 2.510 18.317 -0.002 1.00 0.00 H new ATOM 730 N ARG A 52 7.619 12.609 0.805 1.00 0.00 N ATOM 731 CA ARG A 52 9.025 12.231 0.883 1.00 0.00 C ATOM 732 C ARG A 52 9.188 10.718 0.764 1.00 0.00 C ATOM 733 O ARG A 52 10.305 10.199 0.793 1.00 0.00 O ATOM 734 CB ARG A 52 9.634 12.718 2.199 1.00 0.00 C ATOM 735 CG ARG A 52 9.383 14.191 2.477 1.00 0.00 C ATOM 736 CD ARG A 52 10.187 14.677 3.673 1.00 0.00 C ATOM 737 NE ARG A 52 11.618 14.729 3.387 1.00 0.00 N ATOM 738 CZ ARG A 52 12.557 14.686 4.325 1.00 0.00 C ATOM 739 NH1 ARG A 52 12.218 14.590 5.604 1.00 0.00 N ATOM 740 NH2 ARG A 52 13.839 14.738 3.986 1.00 0.00 N ATOM 0 H ARG A 52 7.124 12.579 1.696 1.00 0.00 H new ATOM 0 HA ARG A 52 9.549 12.703 0.052 1.00 0.00 H new ATOM 0 HB2 ARG A 52 9.226 12.127 3.019 1.00 0.00 H new ATOM 0 HB3 ARG A 52 10.709 12.538 2.181 1.00 0.00 H new ATOM 0 HG2 ARG A 52 9.646 14.778 1.597 1.00 0.00 H new ATOM 0 HG3 ARG A 52 8.321 14.352 2.662 1.00 0.00 H new ATOM 0 HD2 ARG A 52 9.840 15.668 3.964 1.00 0.00 H new ATOM 0 HD3 ARG A 52 10.011 14.015 4.521 1.00 0.00 H new ATOM 0 HE ARG A 52 11.913 14.802 2.413 1.00 0.00 H new ATOM 0 HH11 ARG A 52 11.234 14.549 5.869 1.00 0.00 H new ATOM 0 HH12 ARG A 52 12.941 14.557 6.322 1.00 0.00 H new ATOM 0 HH21 ARG A 52 14.104 14.811 3.004 1.00 0.00 H new ATOM 0 HH22 ARG A 52 14.559 14.705 4.708 1.00 0.00 H new ATOM 754 N LEU A 53 8.068 10.016 0.632 1.00 0.00 N ATOM 755 CA LEU A 53 8.086 8.563 0.509 1.00 0.00 C ATOM 756 C LEU A 53 7.855 8.135 -0.937 1.00 0.00 C ATOM 757 O LEU A 53 7.767 6.944 -1.238 1.00 0.00 O ATOM 758 CB LEU A 53 7.020 7.942 1.413 1.00 0.00 C ATOM 759 CG LEU A 53 7.023 6.416 1.505 1.00 0.00 C ATOM 760 CD1 LEU A 53 8.366 5.914 2.013 1.00 0.00 C ATOM 761 CD2 LEU A 53 5.895 5.933 2.405 1.00 0.00 C ATOM 0 H LEU A 53 7.136 10.430 0.607 1.00 0.00 H new ATOM 0 HA LEU A 53 9.069 8.209 0.820 1.00 0.00 H new ATOM 0 HB2 LEU A 53 7.144 8.347 2.418 1.00 0.00 H new ATOM 0 HB3 LEU A 53 6.040 8.263 1.059 1.00 0.00 H new ATOM 0 HG LEU A 53 6.862 6.011 0.506 1.00 0.00 H new ATOM 0 HD11 LEU A 53 8.349 4.826 2.072 1.00 0.00 H new ATOM 0 HD12 LEU A 53 9.154 6.228 1.329 1.00 0.00 H new ATOM 0 HD13 LEU A 53 8.558 6.328 3.003 1.00 0.00 H new ATOM 0 HD21 LEU A 53 5.913 4.844 2.458 1.00 0.00 H new ATOM 0 HD22 LEU A 53 6.024 6.348 3.405 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.939 6.261 1.997 1.00 0.00 H new ATOM 773 N THR A 54 7.758 9.115 -1.830 1.00 0.00 N ATOM 774 CA THR A 54 7.539 8.841 -3.244 1.00 0.00 C ATOM 775 C THR A 54 8.741 8.135 -3.861 1.00 0.00 C ATOM 776 O THR A 54 8.617 7.093 -4.505 1.00 0.00 O ATOM 777 CB THR A 54 7.259 10.136 -4.031 1.00 0.00 C ATOM 778 OG1 THR A 54 6.735 11.139 -3.153 1.00 0.00 O ATOM 779 CG2 THR A 54 6.274 9.880 -5.161 1.00 0.00 C ATOM 0 H THR A 54 7.828 10.106 -1.598 1.00 0.00 H new ATOM 0 HA THR A 54 6.667 8.190 -3.308 1.00 0.00 H new ATOM 0 HB THR A 54 8.198 10.484 -4.461 1.00 0.00 H new ATOM 0 HG1 THR A 54 7.475 11.643 -2.754 1.00 0.00 H new ATOM 0 HG21 THR A 54 6.092 10.808 -5.702 1.00 0.00 H new ATOM 0 HG22 THR A 54 6.688 9.137 -5.843 1.00 0.00 H new ATOM 0 HG23 THR A 54 5.335 9.510 -4.749 1.00 0.00 H new ATOM 787 N PRO A 55 9.934 8.714 -3.661 1.00 0.00 N ATOM 788 CA PRO A 55 11.183 8.156 -4.188 1.00 0.00 C ATOM 789 C PRO A 55 11.582 6.862 -3.486 1.00 0.00 C ATOM 790 O PRO A 55 12.217 5.993 -4.082 1.00 0.00 O ATOM 791 CB PRO A 55 12.210 9.256 -3.907 1.00 0.00 C ATOM 792 CG PRO A 55 11.652 10.008 -2.749 1.00 0.00 C ATOM 793 CD PRO A 55 10.157 9.957 -2.903 1.00 0.00 C ATOM 0 HA PRO A 55 11.098 7.892 -5.242 1.00 0.00 H new ATOM 0 HB2 PRO A 55 13.187 8.834 -3.672 1.00 0.00 H new ATOM 0 HB3 PRO A 55 12.343 9.904 -4.773 1.00 0.00 H new ATOM 0 HG2 PRO A 55 11.963 9.559 -1.806 1.00 0.00 H new ATOM 0 HG3 PRO A 55 12.009 11.038 -2.744 1.00 0.00 H new ATOM 0 HD2 PRO A 55 9.654 9.934 -1.936 1.00 0.00 H new ATOM 0 HD3 PRO A 55 9.778 10.828 -3.438 1.00 0.00 H new ATOM 801 N GLU A 56 11.206 6.743 -2.217 1.00 0.00 N ATOM 802 CA GLU A 56 11.526 5.555 -1.434 1.00 0.00 C ATOM 803 C GLU A 56 10.630 4.385 -1.831 1.00 0.00 C ATOM 804 O GLU A 56 11.100 3.260 -2.004 1.00 0.00 O ATOM 805 CB GLU A 56 11.373 5.845 0.060 1.00 0.00 C ATOM 806 CG GLU A 56 12.337 6.899 0.577 1.00 0.00 C ATOM 807 CD GLU A 56 13.765 6.653 0.130 1.00 0.00 C ATOM 808 OE1 GLU A 56 14.472 5.873 0.802 1.00 0.00 O ATOM 809 OE2 GLU A 56 14.176 7.242 -0.892 1.00 0.00 O ATOM 0 H GLU A 56 10.680 7.454 -1.709 1.00 0.00 H new ATOM 0 HA GLU A 56 12.562 5.284 -1.639 1.00 0.00 H new ATOM 0 HB2 GLU A 56 10.352 6.172 0.255 1.00 0.00 H new ATOM 0 HB3 GLU A 56 11.524 4.921 0.618 1.00 0.00 H new ATOM 0 HG2 GLU A 56 12.016 7.881 0.230 1.00 0.00 H new ATOM 0 HG3 GLU A 56 12.299 6.918 1.666 1.00 0.00 H new ATOM 816 N TRP A 57 9.338 4.658 -1.972 1.00 0.00 N ATOM 817 CA TRP A 57 8.376 3.629 -2.348 1.00 0.00 C ATOM 818 C TRP A 57 8.608 3.163 -3.781 1.00 0.00 C ATOM 819 O TRP A 57 8.555 1.968 -4.072 1.00 0.00 O ATOM 820 CB TRP A 57 6.948 4.156 -2.195 1.00 0.00 C ATOM 821 CG TRP A 57 5.915 3.071 -2.159 1.00 0.00 C ATOM 822 CD1 TRP A 57 4.827 2.948 -2.976 1.00 0.00 C ATOM 823 CD2 TRP A 57 5.872 1.958 -1.260 1.00 0.00 C ATOM 824 NE1 TRP A 57 4.110 1.825 -2.638 1.00 0.00 N ATOM 825 CE2 TRP A 57 4.731 1.200 -1.589 1.00 0.00 C ATOM 826 CE3 TRP A 57 6.687 1.526 -0.210 1.00 0.00 C ATOM 827 CZ2 TRP A 57 4.386 0.038 -0.904 1.00 0.00 C ATOM 828 CZ3 TRP A 57 6.343 0.373 0.469 1.00 0.00 C ATOM 829 CH2 TRP A 57 5.202 -0.361 0.120 1.00 0.00 C ATOM 0 H TRP A 57 8.932 5.583 -1.832 1.00 0.00 H new ATOM 0 HA TRP A 57 8.515 2.777 -1.682 1.00 0.00 H new ATOM 0 HB2 TRP A 57 6.881 4.742 -1.278 1.00 0.00 H new ATOM 0 HB3 TRP A 57 6.727 4.831 -3.022 1.00 0.00 H new ATOM 0 HD1 TRP A 57 4.568 3.632 -3.770 1.00 0.00 H new ATOM 0 HE1 TRP A 57 3.254 1.508 -3.094 1.00 0.00 H new ATOM 0 HE3 TRP A 57 7.570 2.084 0.066 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 3.506 -0.528 -1.171 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 6.965 0.031 1.283 1.00 0.00 H new ATOM 0 HH2 TRP A 57 4.962 -1.259 0.670 1.00 0.00 H new ATOM 840 N LYS A 58 8.867 4.113 -4.673 1.00 0.00 N ATOM 841 CA LYS A 58 9.109 3.800 -6.076 1.00 0.00 C ATOM 842 C LYS A 58 10.299 2.858 -6.226 1.00 0.00 C ATOM 843 O LYS A 58 10.210 1.830 -6.897 1.00 0.00 O ATOM 844 CB LYS A 58 9.358 5.084 -6.870 1.00 0.00 C ATOM 845 CG LYS A 58 8.084 5.777 -7.322 1.00 0.00 C ATOM 846 CD LYS A 58 8.383 7.087 -8.031 1.00 0.00 C ATOM 847 CE LYS A 58 7.245 8.083 -7.866 1.00 0.00 C ATOM 848 NZ LYS A 58 7.598 9.424 -8.408 1.00 0.00 N ATOM 0 H LYS A 58 8.915 5.107 -4.449 1.00 0.00 H new ATOM 0 HA LYS A 58 8.223 3.302 -6.470 1.00 0.00 H new ATOM 0 HB2 LYS A 58 9.939 5.773 -6.257 1.00 0.00 H new ATOM 0 HB3 LYS A 58 9.963 4.848 -7.745 1.00 0.00 H new ATOM 0 HG2 LYS A 58 7.528 5.119 -7.990 1.00 0.00 H new ATOM 0 HG3 LYS A 58 7.446 5.967 -6.459 1.00 0.00 H new ATOM 0 HD2 LYS A 58 9.303 7.515 -7.633 1.00 0.00 H new ATOM 0 HD3 LYS A 58 8.551 6.898 -9.091 1.00 0.00 H new ATOM 0 HE2 LYS A 58 6.357 7.708 -8.375 1.00 0.00 H new ATOM 0 HE3 LYS A 58 6.992 8.173 -6.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 6.797 10.074 -8.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 8.430 9.794 -7.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 7.815 9.343 -9.422 1.00 0.00 H new ATOM 862 N LYS A 59 11.413 3.214 -5.595 1.00 0.00 N ATOM 863 CA LYS A 59 12.621 2.400 -5.655 1.00 0.00 C ATOM 864 C LYS A 59 12.288 0.920 -5.495 1.00 0.00 C ATOM 865 O LYS A 59 12.653 0.098 -6.334 1.00 0.00 O ATOM 866 CB LYS A 59 13.607 2.833 -4.568 1.00 0.00 C ATOM 867 CG LYS A 59 14.569 3.920 -5.017 1.00 0.00 C ATOM 868 CD LYS A 59 15.654 4.167 -3.982 1.00 0.00 C ATOM 869 CE LYS A 59 15.144 5.024 -2.834 1.00 0.00 C ATOM 870 NZ LYS A 59 16.142 5.125 -1.733 1.00 0.00 N ATOM 0 H LYS A 59 11.504 4.062 -5.036 1.00 0.00 H new ATOM 0 HA LYS A 59 13.080 2.547 -6.632 1.00 0.00 H new ATOM 0 HB2 LYS A 59 13.048 3.189 -3.703 1.00 0.00 H new ATOM 0 HB3 LYS A 59 14.180 1.965 -4.242 1.00 0.00 H new ATOM 0 HG2 LYS A 59 15.027 3.634 -5.964 1.00 0.00 H new ATOM 0 HG3 LYS A 59 14.018 4.844 -5.196 1.00 0.00 H new ATOM 0 HD2 LYS A 59 16.012 3.213 -3.594 1.00 0.00 H new ATOM 0 HD3 LYS A 59 16.504 4.659 -4.455 1.00 0.00 H new ATOM 0 HE2 LYS A 59 14.907 6.022 -3.203 1.00 0.00 H new ATOM 0 HE3 LYS A 59 14.218 4.599 -2.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 15.650 5.123 -0.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 16.792 4.314 -1.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 16.682 6.008 -1.834 1.00 0.00 H new ATOM 884 N ALA A 60 11.593 0.589 -4.412 1.00 0.00 N ATOM 885 CA ALA A 60 11.208 -0.791 -4.143 1.00 0.00 C ATOM 886 C ALA A 60 10.329 -1.343 -5.261 1.00 0.00 C ATOM 887 O ALA A 60 10.393 -2.528 -5.586 1.00 0.00 O ATOM 888 CB ALA A 60 10.488 -0.888 -2.806 1.00 0.00 C ATOM 0 H ALA A 60 11.285 1.258 -3.706 1.00 0.00 H new ATOM 0 HA ALA A 60 12.115 -1.393 -4.098 1.00 0.00 H new ATOM 0 HB1 ALA A 60 10.207 -1.924 -2.619 1.00 0.00 H new ATOM 0 HB2 ALA A 60 11.149 -0.542 -2.011 1.00 0.00 H new ATOM 0 HB3 ALA A 60 9.592 -0.267 -2.829 1.00 0.00 H new ATOM 894 N ALA A 61 9.508 -0.476 -5.845 1.00 0.00 N ATOM 895 CA ALA A 61 8.617 -0.877 -6.926 1.00 0.00 C ATOM 896 C ALA A 61 9.407 -1.270 -8.171 1.00 0.00 C ATOM 897 O ALA A 61 8.978 -2.123 -8.948 1.00 0.00 O ATOM 898 CB ALA A 61 7.642 0.245 -7.250 1.00 0.00 C ATOM 0 H ALA A 61 9.442 0.509 -5.587 1.00 0.00 H new ATOM 0 HA ALA A 61 8.053 -1.749 -6.595 1.00 0.00 H new ATOM 0 HB1 ALA A 61 6.983 -0.068 -8.059 1.00 0.00 H new ATOM 0 HB2 ALA A 61 7.047 0.477 -6.366 1.00 0.00 H new ATOM 0 HB3 ALA A 61 8.197 1.132 -7.557 1.00 0.00 H new ATOM 904 N THR A 62 10.564 -0.641 -8.355 1.00 0.00 N ATOM 905 CA THR A 62 11.412 -0.923 -9.506 1.00 0.00 C ATOM 906 C THR A 62 12.051 -2.303 -9.392 1.00 0.00 C ATOM 907 O THR A 62 12.082 -3.064 -10.359 1.00 0.00 O ATOM 908 CB THR A 62 12.522 0.133 -9.658 1.00 0.00 C ATOM 909 OG1 THR A 62 11.944 1.437 -9.783 1.00 0.00 O ATOM 910 CG2 THR A 62 13.388 -0.162 -10.874 1.00 0.00 C ATOM 0 H THR A 62 10.935 0.067 -7.721 1.00 0.00 H new ATOM 0 HA THR A 62 10.770 -0.894 -10.387 1.00 0.00 H new ATOM 0 HB THR A 62 13.150 0.098 -8.768 1.00 0.00 H new ATOM 0 HG1 THR A 62 11.489 1.511 -10.648 1.00 0.00 H new ATOM 0 HG21 THR A 62 14.165 0.598 -10.960 1.00 0.00 H new ATOM 0 HG22 THR A 62 13.850 -1.143 -10.762 1.00 0.00 H new ATOM 0 HG23 THR A 62 12.770 -0.152 -11.772 1.00 0.00 H new ATOM 918 N ALA A 63 12.560 -2.618 -8.206 1.00 0.00 N ATOM 919 CA ALA A 63 13.196 -3.908 -7.966 1.00 0.00 C ATOM 920 C ALA A 63 12.156 -5.011 -7.803 1.00 0.00 C ATOM 921 O ALA A 63 12.306 -6.106 -8.348 1.00 0.00 O ATOM 922 CB ALA A 63 14.088 -3.835 -6.735 1.00 0.00 C ATOM 0 H ALA A 63 12.545 -1.998 -7.396 1.00 0.00 H new ATOM 0 HA ALA A 63 13.810 -4.150 -8.833 1.00 0.00 H new ATOM 0 HB1 ALA A 63 14.557 -4.805 -6.567 1.00 0.00 H new ATOM 0 HB2 ALA A 63 14.860 -3.081 -6.889 1.00 0.00 H new ATOM 0 HB3 ALA A 63 13.487 -3.567 -5.866 1.00 0.00 H new ATOM 928 N LEU A 64 11.101 -4.717 -7.051 1.00 0.00 N ATOM 929 CA LEU A 64 10.035 -5.685 -6.816 1.00 0.00 C ATOM 930 C LEU A 64 8.981 -5.612 -7.916 1.00 0.00 C ATOM 931 O LEU A 64 7.914 -6.217 -7.810 1.00 0.00 O ATOM 932 CB LEU A 64 9.385 -5.437 -5.453 1.00 0.00 C ATOM 933 CG LEU A 64 10.344 -5.233 -4.280 1.00 0.00 C ATOM 934 CD1 LEU A 64 9.664 -4.454 -3.165 1.00 0.00 C ATOM 935 CD2 LEU A 64 10.849 -6.573 -3.765 1.00 0.00 C ATOM 0 H LEU A 64 10.961 -3.816 -6.594 1.00 0.00 H new ATOM 0 HA LEU A 64 10.475 -6.682 -6.826 1.00 0.00 H new ATOM 0 HB2 LEU A 64 8.747 -4.557 -5.532 1.00 0.00 H new ATOM 0 HB3 LEU A 64 8.736 -6.282 -5.223 1.00 0.00 H new ATOM 0 HG LEU A 64 11.199 -4.655 -4.631 1.00 0.00 H new ATOM 0 HD11 LEU A 64 10.361 -4.318 -2.338 1.00 0.00 H new ATOM 0 HD12 LEU A 64 9.352 -3.479 -3.540 1.00 0.00 H new ATOM 0 HD13 LEU A 64 8.791 -5.005 -2.816 1.00 0.00 H new ATOM 0 HD21 LEU A 64 11.530 -6.409 -2.930 1.00 0.00 H new ATOM 0 HD22 LEU A 64 10.005 -7.176 -3.431 1.00 0.00 H new ATOM 0 HD23 LEU A 64 11.374 -7.096 -4.565 1.00 0.00 H new ATOM 947 N LYS A 65 9.288 -4.869 -8.973 1.00 0.00 N ATOM 948 CA LYS A 65 8.369 -4.719 -10.096 1.00 0.00 C ATOM 949 C LYS A 65 7.952 -6.080 -10.643 1.00 0.00 C ATOM 950 O LYS A 65 6.781 -6.303 -10.952 1.00 0.00 O ATOM 951 CB LYS A 65 9.019 -3.889 -11.206 1.00 0.00 C ATOM 952 CG LYS A 65 8.517 -4.234 -12.597 1.00 0.00 C ATOM 953 CD LYS A 65 9.169 -3.363 -13.657 1.00 0.00 C ATOM 954 CE LYS A 65 8.423 -2.050 -13.837 1.00 0.00 C ATOM 955 NZ LYS A 65 9.099 -1.158 -14.820 1.00 0.00 N ATOM 0 H LYS A 65 10.166 -4.361 -9.076 1.00 0.00 H new ATOM 0 HA LYS A 65 7.478 -4.202 -9.738 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.834 -2.832 -11.014 1.00 0.00 H new ATOM 0 HB3 LYS A 65 10.099 -4.035 -11.172 1.00 0.00 H new ATOM 0 HG2 LYS A 65 8.723 -5.283 -12.809 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.435 -4.108 -12.636 1.00 0.00 H new ATOM 0 HD2 LYS A 65 10.203 -3.160 -13.377 1.00 0.00 H new ATOM 0 HD3 LYS A 65 9.195 -3.900 -14.605 1.00 0.00 H new ATOM 0 HE2 LYS A 65 7.405 -2.253 -14.171 1.00 0.00 H new ATOM 0 HE3 LYS A 65 8.347 -1.541 -12.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 8.394 -0.540 -15.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 9.808 -0.575 -14.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 9.568 -1.735 -15.547 1.00 0.00 H new ATOM 969 N ASP A 66 8.915 -6.987 -10.759 1.00 0.00 N ATOM 970 CA ASP A 66 8.647 -8.327 -11.266 1.00 0.00 C ATOM 971 C ASP A 66 8.508 -9.325 -10.120 1.00 0.00 C ATOM 972 O ASP A 66 8.073 -10.459 -10.319 1.00 0.00 O ATOM 973 CB ASP A 66 9.763 -8.771 -12.213 1.00 0.00 C ATOM 974 CG ASP A 66 9.608 -8.190 -13.604 1.00 0.00 C ATOM 975 OD1 ASP A 66 8.797 -8.730 -14.385 1.00 0.00 O ATOM 976 OD2 ASP A 66 10.297 -7.195 -13.913 1.00 0.00 O ATOM 0 H ASP A 66 9.889 -6.818 -10.508 1.00 0.00 H new ATOM 0 HA ASP A 66 7.706 -8.298 -11.815 1.00 0.00 H new ATOM 0 HB2 ASP A 66 10.726 -8.469 -11.802 1.00 0.00 H new ATOM 0 HB3 ASP A 66 9.771 -9.859 -12.276 1.00 0.00 H new ATOM 981 N VAL A 67 8.883 -8.894 -8.920 1.00 0.00 N ATOM 982 CA VAL A 67 8.801 -9.749 -7.741 1.00 0.00 C ATOM 983 C VAL A 67 7.503 -9.511 -6.979 1.00 0.00 C ATOM 984 O VAL A 67 6.621 -10.369 -6.948 1.00 0.00 O ATOM 985 CB VAL A 67 9.991 -9.513 -6.793 1.00 0.00 C ATOM 986 CG1 VAL A 67 10.233 -10.738 -5.924 1.00 0.00 C ATOM 987 CG2 VAL A 67 11.240 -9.156 -7.585 1.00 0.00 C ATOM 0 H VAL A 67 9.246 -7.958 -8.738 1.00 0.00 H new ATOM 0 HA VAL A 67 8.827 -10.780 -8.095 1.00 0.00 H new ATOM 0 HB VAL A 67 9.751 -8.675 -6.139 1.00 0.00 H new ATOM 0 HG11 VAL A 67 11.078 -10.552 -5.261 1.00 0.00 H new ATOM 0 HG12 VAL A 67 9.343 -10.944 -5.329 1.00 0.00 H new ATOM 0 HG13 VAL A 67 10.452 -11.597 -6.559 1.00 0.00 H new ATOM 0 HG21 VAL A 67 12.071 -8.993 -6.899 1.00 0.00 H new ATOM 0 HG22 VAL A 67 11.485 -9.972 -8.265 1.00 0.00 H new ATOM 0 HG23 VAL A 67 11.059 -8.247 -8.159 1.00 0.00 H new ATOM 997 N VAL A 68 7.391 -8.337 -6.364 1.00 0.00 N ATOM 998 CA VAL A 68 6.199 -7.984 -5.601 1.00 0.00 C ATOM 999 C VAL A 68 5.515 -6.755 -6.189 1.00 0.00 C ATOM 1000 O VAL A 68 6.119 -5.688 -6.300 1.00 0.00 O ATOM 1001 CB VAL A 68 6.538 -7.712 -4.124 1.00 0.00 C ATOM 1002 CG1 VAL A 68 5.293 -7.291 -3.359 1.00 0.00 C ATOM 1003 CG2 VAL A 68 7.175 -8.939 -3.489 1.00 0.00 C ATOM 0 H VAL A 68 8.111 -7.615 -6.379 1.00 0.00 H new ATOM 0 HA VAL A 68 5.522 -8.836 -5.659 1.00 0.00 H new ATOM 0 HB VAL A 68 7.257 -6.894 -4.079 1.00 0.00 H new ATOM 0 HG11 VAL A 68 5.552 -7.103 -2.317 1.00 0.00 H new ATOM 0 HG12 VAL A 68 4.884 -6.382 -3.801 1.00 0.00 H new ATOM 0 HG13 VAL A 68 4.549 -8.086 -3.410 1.00 0.00 H new ATOM 0 HG21 VAL A 68 7.408 -8.729 -2.445 1.00 0.00 H new ATOM 0 HG22 VAL A 68 6.482 -9.778 -3.544 1.00 0.00 H new ATOM 0 HG23 VAL A 68 8.092 -9.190 -4.022 1.00 0.00 H new ATOM 1013 N LYS A 69 4.251 -6.912 -6.566 1.00 0.00 N ATOM 1014 CA LYS A 69 3.482 -5.815 -7.142 1.00 0.00 C ATOM 1015 C LYS A 69 3.336 -4.670 -6.144 1.00 0.00 C ATOM 1016 O LYS A 69 2.475 -4.706 -5.264 1.00 0.00 O ATOM 1017 CB LYS A 69 2.099 -6.307 -7.576 1.00 0.00 C ATOM 1018 CG LYS A 69 2.124 -7.158 -8.834 1.00 0.00 C ATOM 1019 CD LYS A 69 2.034 -6.303 -10.087 1.00 0.00 C ATOM 1020 CE LYS A 69 2.410 -7.095 -11.330 1.00 0.00 C ATOM 1021 NZ LYS A 69 2.162 -6.321 -12.577 1.00 0.00 N ATOM 0 H LYS A 69 3.737 -7.789 -6.483 1.00 0.00 H new ATOM 0 HA LYS A 69 4.020 -5.446 -8.015 1.00 0.00 H new ATOM 0 HB2 LYS A 69 1.657 -6.885 -6.765 1.00 0.00 H new ATOM 0 HB3 LYS A 69 1.452 -5.446 -7.743 1.00 0.00 H new ATOM 0 HG2 LYS A 69 3.042 -7.746 -8.859 1.00 0.00 H new ATOM 0 HG3 LYS A 69 1.294 -7.864 -8.814 1.00 0.00 H new ATOM 0 HD2 LYS A 69 1.020 -5.917 -10.193 1.00 0.00 H new ATOM 0 HD3 LYS A 69 2.695 -5.442 -9.989 1.00 0.00 H new ATOM 0 HE2 LYS A 69 3.463 -7.373 -11.279 1.00 0.00 H new ATOM 0 HE3 LYS A 69 1.836 -8.021 -11.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 2.431 -6.895 -13.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 1.153 -6.077 -12.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 2.729 -5.449 -12.563 1.00 0.00 H new ATOM 1035 N VAL A 70 4.181 -3.655 -6.287 1.00 0.00 N ATOM 1036 CA VAL A 70 4.144 -2.498 -5.400 1.00 0.00 C ATOM 1037 C VAL A 70 3.292 -1.380 -5.990 1.00 0.00 C ATOM 1038 O VAL A 70 3.736 -0.646 -6.871 1.00 0.00 O ATOM 1039 CB VAL A 70 5.560 -1.958 -5.123 1.00 0.00 C ATOM 1040 CG1 VAL A 70 5.499 -0.745 -4.206 1.00 0.00 C ATOM 1041 CG2 VAL A 70 6.437 -3.046 -4.523 1.00 0.00 C ATOM 0 H VAL A 70 4.900 -3.610 -7.009 1.00 0.00 H new ATOM 0 HA VAL A 70 3.700 -2.832 -4.462 1.00 0.00 H new ATOM 0 HB VAL A 70 6.003 -1.647 -6.069 1.00 0.00 H new ATOM 0 HG11 VAL A 70 6.508 -0.377 -4.021 1.00 0.00 H new ATOM 0 HG12 VAL A 70 4.908 0.039 -4.679 1.00 0.00 H new ATOM 0 HG13 VAL A 70 5.037 -1.027 -3.260 1.00 0.00 H new ATOM 0 HG21 VAL A 70 7.434 -2.647 -4.334 1.00 0.00 H new ATOM 0 HG22 VAL A 70 6.000 -3.390 -3.586 1.00 0.00 H new ATOM 0 HG23 VAL A 70 6.507 -3.882 -5.219 1.00 0.00 H new ATOM 1051 N GLY A 71 2.063 -1.257 -5.497 1.00 0.00 N ATOM 1052 CA GLY A 71 1.167 -0.225 -5.986 1.00 0.00 C ATOM 1053 C GLY A 71 1.247 1.048 -5.168 1.00 0.00 C ATOM 1054 O GLY A 71 2.258 1.313 -4.518 1.00 0.00 O ATOM 0 H GLY A 71 1.672 -1.854 -4.768 1.00 0.00 H new ATOM 0 HA2 GLY A 71 1.408 -0.001 -7.025 1.00 0.00 H new ATOM 0 HA3 GLY A 71 0.143 -0.600 -5.970 1.00 0.00 H new ATOM 1058 N ALA A 72 0.180 1.840 -5.202 1.00 0.00 N ATOM 1059 CA ALA A 72 0.134 3.092 -4.458 1.00 0.00 C ATOM 1060 C ALA A 72 -1.269 3.690 -4.477 1.00 0.00 C ATOM 1061 O ALA A 72 -1.823 3.966 -5.541 1.00 0.00 O ATOM 1062 CB ALA A 72 1.139 4.082 -5.028 1.00 0.00 C ATOM 0 H ALA A 72 -0.664 1.636 -5.737 1.00 0.00 H new ATOM 0 HA ALA A 72 0.397 2.880 -3.422 1.00 0.00 H new ATOM 0 HB1 ALA A 72 1.094 5.013 -4.463 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.143 3.663 -4.957 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.902 4.281 -6.073 1.00 0.00 H new ATOM 1068 N VAL A 73 -1.839 3.887 -3.292 1.00 0.00 N ATOM 1069 CA VAL A 73 -3.177 4.453 -3.173 1.00 0.00 C ATOM 1070 C VAL A 73 -3.151 5.768 -2.401 1.00 0.00 C ATOM 1071 O VAL A 73 -2.658 5.829 -1.276 1.00 0.00 O ATOM 1072 CB VAL A 73 -4.139 3.477 -2.469 1.00 0.00 C ATOM 1073 CG1 VAL A 73 -5.309 4.229 -1.855 1.00 0.00 C ATOM 1074 CG2 VAL A 73 -4.628 2.417 -3.445 1.00 0.00 C ATOM 0 H VAL A 73 -1.395 3.663 -2.402 1.00 0.00 H new ATOM 0 HA VAL A 73 -3.534 4.636 -4.186 1.00 0.00 H new ATOM 0 HB VAL A 73 -3.599 2.977 -1.665 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -5.977 3.523 -1.362 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -4.937 4.947 -1.124 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -5.853 4.758 -2.638 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -5.307 1.735 -2.932 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -5.152 2.897 -4.271 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -3.776 1.858 -3.832 1.00 0.00 H new ATOM 1084 N ASN A 74 -3.686 6.818 -3.015 1.00 0.00 N ATOM 1085 CA ASN A 74 -3.724 8.133 -2.385 1.00 0.00 C ATOM 1086 C ASN A 74 -4.798 8.187 -1.303 1.00 0.00 C ATOM 1087 O ASN A 74 -5.959 8.489 -1.580 1.00 0.00 O ATOM 1088 CB ASN A 74 -3.986 9.216 -3.433 1.00 0.00 C ATOM 1089 CG ASN A 74 -4.181 10.586 -2.813 1.00 0.00 C ATOM 1090 OD1 ASN A 74 -3.986 10.769 -1.612 1.00 0.00 O ATOM 1091 ND2 ASN A 74 -4.568 11.557 -3.633 1.00 0.00 N ATOM 0 H ASN A 74 -4.099 6.784 -3.947 1.00 0.00 H new ATOM 0 HA ASN A 74 -2.755 8.313 -1.920 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -3.150 9.252 -4.131 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -4.872 8.952 -4.010 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -4.715 12.500 -3.273 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -4.718 11.360 -4.622 1.00 0.00 H new ATOM 1098 N ALA A 75 -4.402 7.893 -0.069 1.00 0.00 N ATOM 1099 CA ALA A 75 -5.330 7.911 1.056 1.00 0.00 C ATOM 1100 C ALA A 75 -6.251 9.124 0.988 1.00 0.00 C ATOM 1101 O ALA A 75 -7.445 9.025 1.275 1.00 0.00 O ATOM 1102 CB ALA A 75 -4.565 7.900 2.371 1.00 0.00 C ATOM 0 H ALA A 75 -3.445 7.640 0.177 1.00 0.00 H new ATOM 0 HA ALA A 75 -5.948 7.015 1.000 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -5.270 7.914 3.202 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -3.953 7.000 2.429 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -3.923 8.779 2.426 1.00 0.00 H new ATOM 1108 N ASP A 76 -5.691 10.266 0.608 1.00 0.00 N ATOM 1109 CA ASP A 76 -6.463 11.499 0.502 1.00 0.00 C ATOM 1110 C ASP A 76 -7.585 11.352 -0.521 1.00 0.00 C ATOM 1111 O ASP A 76 -8.738 11.683 -0.245 1.00 0.00 O ATOM 1112 CB ASP A 76 -5.552 12.665 0.114 1.00 0.00 C ATOM 1113 CG ASP A 76 -6.301 13.981 0.029 1.00 0.00 C ATOM 1114 OD1 ASP A 76 -7.059 14.294 0.970 1.00 0.00 O ATOM 1115 OD2 ASP A 76 -6.129 14.697 -0.980 1.00 0.00 O ATOM 0 H ASP A 76 -4.705 10.364 0.368 1.00 0.00 H new ATOM 0 HA ASP A 76 -6.908 11.704 1.476 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -4.749 12.754 0.846 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -5.085 12.453 -0.848 1.00 0.00 H new ATOM 1120 N LYS A 77 -7.239 10.853 -1.703 1.00 0.00 N ATOM 1121 CA LYS A 77 -8.216 10.661 -2.768 1.00 0.00 C ATOM 1122 C LYS A 77 -9.051 9.409 -2.521 1.00 0.00 C ATOM 1123 O LYS A 77 -10.275 9.481 -2.403 1.00 0.00 O ATOM 1124 CB LYS A 77 -7.510 10.557 -4.122 1.00 0.00 C ATOM 1125 CG LYS A 77 -8.422 10.106 -5.250 1.00 0.00 C ATOM 1126 CD LYS A 77 -7.635 9.472 -6.384 1.00 0.00 C ATOM 1127 CE LYS A 77 -7.018 10.525 -7.292 1.00 0.00 C ATOM 1128 NZ LYS A 77 -8.005 11.060 -8.271 1.00 0.00 N ATOM 0 H LYS A 77 -6.289 10.574 -1.947 1.00 0.00 H new ATOM 0 HA LYS A 77 -8.882 11.524 -2.777 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -7.085 11.528 -4.376 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -6.679 9.857 -4.036 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -9.150 9.391 -4.867 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -8.983 10.960 -5.629 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -6.849 8.839 -5.973 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -8.292 8.827 -6.967 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -6.627 11.343 -6.687 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -6.173 10.093 -7.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -7.546 11.775 -8.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -8.359 10.284 -8.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -8.800 11.495 -7.760 1.00 0.00 H new ATOM 1142 N HIS A 78 -8.383 8.263 -2.442 1.00 0.00 N ATOM 1143 CA HIS A 78 -9.064 6.995 -2.206 1.00 0.00 C ATOM 1144 C HIS A 78 -9.364 6.807 -0.722 1.00 0.00 C ATOM 1145 O HIS A 78 -9.165 5.725 -0.172 1.00 0.00 O ATOM 1146 CB HIS A 78 -8.214 5.832 -2.718 1.00 0.00 C ATOM 1147 CG HIS A 78 -7.819 5.967 -4.156 1.00 0.00 C ATOM 1148 ND1 HIS A 78 -8.680 6.418 -5.134 1.00 0.00 N ATOM 1149 CD2 HIS A 78 -6.646 5.707 -4.780 1.00 0.00 C ATOM 1150 CE1 HIS A 78 -8.054 6.429 -6.297 1.00 0.00 C ATOM 1151 NE2 HIS A 78 -6.818 6.003 -6.110 1.00 0.00 N ATOM 0 H HIS A 78 -7.370 8.186 -2.538 1.00 0.00 H new ATOM 0 HA HIS A 78 -10.008 7.012 -2.750 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -7.314 5.755 -2.108 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -8.768 4.903 -2.588 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -5.743 5.336 -4.318 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -8.481 6.735 -7.241 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -6.107 5.909 -6.835 1.00 0.00 H new ATOM 1160 N GLN A 79 -9.843 7.869 -0.081 1.00 0.00 N ATOM 1161 CA GLN A 79 -10.168 7.820 1.340 1.00 0.00 C ATOM 1162 C GLN A 79 -10.962 6.561 1.674 1.00 0.00 C ATOM 1163 O GLN A 79 -10.885 6.044 2.788 1.00 0.00 O ATOM 1164 CB GLN A 79 -10.965 9.061 1.745 1.00 0.00 C ATOM 1165 CG GLN A 79 -10.093 10.236 2.156 1.00 0.00 C ATOM 1166 CD GLN A 79 -9.472 10.052 3.527 1.00 0.00 C ATOM 1167 OE1 GLN A 79 -9.256 8.926 3.977 1.00 0.00 O ATOM 1168 NE2 GLN A 79 -9.182 11.159 4.200 1.00 0.00 N ATOM 0 H GLN A 79 -10.014 8.772 -0.523 1.00 0.00 H new ATOM 0 HA GLN A 79 -9.233 7.798 1.900 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -11.599 9.364 0.911 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -11.627 8.804 2.572 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -9.302 10.372 1.419 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -10.692 11.147 2.152 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -9.378 12.072 3.789 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -8.763 11.097 5.128 1.00 0.00 H new ATOM 1177 N SER A 80 -11.724 6.072 0.700 1.00 0.00 N ATOM 1178 CA SER A 80 -12.535 4.876 0.892 1.00 0.00 C ATOM 1179 C SER A 80 -11.652 3.648 1.097 1.00 0.00 C ATOM 1180 O SER A 80 -11.861 2.866 2.026 1.00 0.00 O ATOM 1181 CB SER A 80 -13.457 4.661 -0.309 1.00 0.00 C ATOM 1182 OG SER A 80 -14.642 5.428 -0.187 1.00 0.00 O ATOM 0 H SER A 80 -11.796 6.486 -0.229 1.00 0.00 H new ATOM 0 HA SER A 80 -13.142 5.018 1.786 1.00 0.00 H new ATOM 0 HB2 SER A 80 -12.935 4.936 -1.226 1.00 0.00 H new ATOM 0 HB3 SER A 80 -13.711 3.604 -0.392 1.00 0.00 H new ATOM 0 HG SER A 80 -15.213 5.274 -0.968 1.00 0.00 H new ATOM 1188 N LEU A 81 -10.666 3.485 0.222 1.00 0.00 N ATOM 1189 CA LEU A 81 -9.750 2.352 0.305 1.00 0.00 C ATOM 1190 C LEU A 81 -8.985 2.366 1.625 1.00 0.00 C ATOM 1191 O LEU A 81 -8.991 1.386 2.368 1.00 0.00 O ATOM 1192 CB LEU A 81 -8.767 2.379 -0.867 1.00 0.00 C ATOM 1193 CG LEU A 81 -9.367 2.133 -2.252 1.00 0.00 C ATOM 1194 CD1 LEU A 81 -8.298 2.252 -3.326 1.00 0.00 C ATOM 1195 CD2 LEU A 81 -10.033 0.766 -2.309 1.00 0.00 C ATOM 0 H LEU A 81 -10.480 4.122 -0.553 1.00 0.00 H new ATOM 0 HA LEU A 81 -10.339 1.436 0.257 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -8.269 3.349 -0.876 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.998 1.628 -0.688 1.00 0.00 H new ATOM 0 HG LEU A 81 -10.126 2.893 -2.438 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -8.744 2.074 -4.305 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -7.867 3.253 -3.301 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -7.516 1.515 -3.144 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -10.455 0.608 -3.302 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -9.294 -0.008 -2.101 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -10.828 0.717 -1.565 1.00 0.00 H new ATOM 1207 N GLY A 82 -8.328 3.486 1.911 1.00 0.00 N ATOM 1208 CA GLY A 82 -7.569 3.607 3.142 1.00 0.00 C ATOM 1209 C GLY A 82 -8.392 3.260 4.367 1.00 0.00 C ATOM 1210 O GLY A 82 -8.081 2.309 5.082 1.00 0.00 O ATOM 0 H GLY A 82 -8.308 4.312 1.312 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -6.699 2.952 3.095 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -7.195 4.627 3.236 1.00 0.00 H new ATOM 1214 N GLY A 83 -9.445 4.034 4.610 1.00 0.00 N ATOM 1215 CA GLY A 83 -10.298 3.789 5.758 1.00 0.00 C ATOM 1216 C GLY A 83 -10.881 2.389 5.758 1.00 0.00 C ATOM 1217 O GLY A 83 -10.852 1.699 6.776 1.00 0.00 O ATOM 0 H GLY A 83 -9.723 4.827 4.032 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -9.724 3.940 6.672 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -11.109 4.517 5.766 1.00 0.00 H new ATOM 1221 N GLN A 84 -11.413 1.972 4.614 1.00 0.00 N ATOM 1222 CA GLN A 84 -12.008 0.647 4.487 1.00 0.00 C ATOM 1223 C GLN A 84 -11.126 -0.411 5.142 1.00 0.00 C ATOM 1224 O GLN A 84 -11.599 -1.484 5.516 1.00 0.00 O ATOM 1225 CB GLN A 84 -12.229 0.302 3.014 1.00 0.00 C ATOM 1226 CG GLN A 84 -12.803 -1.088 2.793 1.00 0.00 C ATOM 1227 CD GLN A 84 -13.365 -1.272 1.397 1.00 0.00 C ATOM 1228 OE1 GLN A 84 -14.580 -1.348 1.209 1.00 0.00 O ATOM 1229 NE2 GLN A 84 -12.482 -1.347 0.408 1.00 0.00 N ATOM 0 H GLN A 84 -11.444 2.532 3.762 1.00 0.00 H new ATOM 0 HA GLN A 84 -12.971 0.659 4.998 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -12.902 1.038 2.574 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -11.280 0.382 2.485 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -12.024 -1.830 2.968 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -13.590 -1.273 3.525 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -11.484 -1.279 0.609 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -12.801 -1.472 -0.553 1.00 0.00 H new ATOM 1238 N TYR A 85 -9.841 -0.101 5.277 1.00 0.00 N ATOM 1239 CA TYR A 85 -8.892 -1.026 5.884 1.00 0.00 C ATOM 1240 C TYR A 85 -8.589 -0.628 7.326 1.00 0.00 C ATOM 1241 O TYR A 85 -8.444 -1.482 8.200 1.00 0.00 O ATOM 1242 CB TYR A 85 -7.596 -1.066 5.072 1.00 0.00 C ATOM 1243 CG TYR A 85 -7.689 -1.918 3.826 1.00 0.00 C ATOM 1244 CD1 TYR A 85 -8.578 -1.598 2.807 1.00 0.00 C ATOM 1245 CD2 TYR A 85 -6.888 -3.042 3.668 1.00 0.00 C ATOM 1246 CE1 TYR A 85 -8.666 -2.373 1.667 1.00 0.00 C ATOM 1247 CE2 TYR A 85 -6.969 -3.822 2.531 1.00 0.00 C ATOM 1248 CZ TYR A 85 -7.860 -3.484 1.534 1.00 0.00 C ATOM 1249 OH TYR A 85 -7.944 -4.259 0.400 1.00 0.00 O ATOM 0 H TYR A 85 -9.433 0.784 4.974 1.00 0.00 H new ATOM 0 HA TYR A 85 -9.343 -2.019 5.887 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -7.324 -0.050 4.788 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -6.793 -1.446 5.703 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -9.211 -0.729 2.908 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -6.190 -3.310 4.447 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -9.362 -2.110 0.884 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -6.338 -4.692 2.423 1.00 0.00 H new ATOM 0 HH TYR A 85 -7.286 -3.950 -0.257 1.00 0.00 H new ATOM 1259 N GLY A 86 -8.497 0.676 7.566 1.00 0.00 N ATOM 1260 CA GLY A 86 -8.213 1.166 8.902 1.00 0.00 C ATOM 1261 C GLY A 86 -7.113 2.209 8.916 1.00 0.00 C ATOM 1262 O GLY A 86 -6.452 2.412 9.934 1.00 0.00 O ATOM 0 H GLY A 86 -8.614 1.402 6.859 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -9.120 1.594 9.329 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -7.924 0.330 9.539 1.00 0.00 H new ATOM 1266 N VAL A 87 -6.915 2.873 7.781 1.00 0.00 N ATOM 1267 CA VAL A 87 -5.888 3.901 7.666 1.00 0.00 C ATOM 1268 C VAL A 87 -6.350 5.213 8.291 1.00 0.00 C ATOM 1269 O VAL A 87 -7.374 5.771 7.898 1.00 0.00 O ATOM 1270 CB VAL A 87 -5.507 4.152 6.195 1.00 0.00 C ATOM 1271 CG1 VAL A 87 -4.399 5.190 6.099 1.00 0.00 C ATOM 1272 CG2 VAL A 87 -5.090 2.852 5.524 1.00 0.00 C ATOM 0 H VAL A 87 -7.453 2.717 6.928 1.00 0.00 H new ATOM 0 HA VAL A 87 -5.013 3.535 8.203 1.00 0.00 H new ATOM 0 HB VAL A 87 -6.381 4.540 5.673 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -4.144 5.354 5.052 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -4.739 6.127 6.540 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -3.520 4.834 6.636 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -4.824 3.048 4.485 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -4.230 2.433 6.046 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -5.917 2.143 5.559 1.00 0.00 H new ATOM 1282 N GLN A 88 -5.588 5.699 9.265 1.00 0.00 N ATOM 1283 CA GLN A 88 -5.921 6.946 9.944 1.00 0.00 C ATOM 1284 C GLN A 88 -4.733 7.903 9.936 1.00 0.00 C ATOM 1285 O GLN A 88 -4.905 9.121 9.909 1.00 0.00 O ATOM 1286 CB GLN A 88 -6.356 6.667 11.383 1.00 0.00 C ATOM 1287 CG GLN A 88 -5.296 5.962 12.214 1.00 0.00 C ATOM 1288 CD GLN A 88 -4.306 6.926 12.836 1.00 0.00 C ATOM 1289 OE1 GLN A 88 -4.479 8.143 12.765 1.00 0.00 O ATOM 1290 NE2 GLN A 88 -3.259 6.386 13.449 1.00 0.00 N ATOM 0 H GLN A 88 -4.737 5.249 9.602 1.00 0.00 H new ATOM 0 HA GLN A 88 -6.746 7.414 9.407 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -6.615 7.610 11.864 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -7.259 6.057 11.369 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -5.781 5.386 13.002 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -4.759 5.252 11.585 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -3.156 5.372 13.484 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -2.558 6.985 13.885 1.00 0.00 H new ATOM 1299 N GLY A 89 -3.528 7.343 9.960 1.00 0.00 N ATOM 1300 CA GLY A 89 -2.329 8.162 9.956 1.00 0.00 C ATOM 1301 C GLY A 89 -1.313 7.697 8.932 1.00 0.00 C ATOM 1302 O GLY A 89 -0.769 6.598 9.041 1.00 0.00 O ATOM 0 H GLY A 89 -3.360 6.337 9.982 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -2.601 9.197 9.750 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -1.876 8.143 10.947 1.00 0.00 H new ATOM 1306 N PHE A 90 -1.056 8.535 7.933 1.00 0.00 N ATOM 1307 CA PHE A 90 -0.100 8.202 6.883 1.00 0.00 C ATOM 1308 C PHE A 90 1.281 8.763 7.208 1.00 0.00 C ATOM 1309 O PHE A 90 1.435 9.663 8.034 1.00 0.00 O ATOM 1310 CB PHE A 90 -0.580 8.747 5.536 1.00 0.00 C ATOM 1311 CG PHE A 90 -2.048 9.060 5.505 1.00 0.00 C ATOM 1312 CD1 PHE A 90 -2.968 8.193 6.072 1.00 0.00 C ATOM 1313 CD2 PHE A 90 -2.509 10.223 4.909 1.00 0.00 C ATOM 1314 CE1 PHE A 90 -4.319 8.479 6.044 1.00 0.00 C ATOM 1315 CE2 PHE A 90 -3.860 10.514 4.878 1.00 0.00 C ATOM 1316 CZ PHE A 90 -4.766 9.641 5.448 1.00 0.00 C ATOM 0 H PHE A 90 -1.496 9.449 7.828 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.027 7.116 6.823 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -0.019 9.651 5.298 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -0.356 8.018 4.757 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -2.625 7.283 6.541 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -1.805 10.910 4.464 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -5.025 7.794 6.488 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -4.207 11.423 4.409 1.00 0.00 H new ATOM 0 HZ PHE A 90 -5.822 9.867 5.427 1.00 0.00 H new ATOM 1326 N PRO A 91 2.312 8.219 6.544 1.00 0.00 N ATOM 1327 CA PRO A 91 2.141 7.147 5.559 1.00 0.00 C ATOM 1328 C PRO A 91 1.733 5.827 6.203 1.00 0.00 C ATOM 1329 O PRO A 91 2.117 5.532 7.336 1.00 0.00 O ATOM 1330 CB PRO A 91 3.528 7.026 4.923 1.00 0.00 C ATOM 1331 CG PRO A 91 4.467 7.532 5.962 1.00 0.00 C ATOM 1332 CD PRO A 91 3.723 8.609 6.703 1.00 0.00 C ATOM 0 HA PRO A 91 1.348 7.371 4.846 1.00 0.00 H new ATOM 0 HB2 PRO A 91 3.752 5.993 4.656 1.00 0.00 H new ATOM 0 HB3 PRO A 91 3.596 7.614 4.008 1.00 0.00 H new ATOM 0 HG2 PRO A 91 4.770 6.732 6.637 1.00 0.00 H new ATOM 0 HG3 PRO A 91 5.376 7.927 5.508 1.00 0.00 H new ATOM 0 HD2 PRO A 91 4.013 8.649 7.753 1.00 0.00 H new ATOM 0 HD3 PRO A 91 3.918 9.595 6.281 1.00 0.00 H new ATOM 1340 N THR A 92 0.951 5.035 5.476 1.00 0.00 N ATOM 1341 CA THR A 92 0.491 3.747 5.977 1.00 0.00 C ATOM 1342 C THR A 92 0.635 2.661 4.917 1.00 0.00 C ATOM 1343 O THR A 92 -0.153 2.592 3.974 1.00 0.00 O ATOM 1344 CB THR A 92 -0.980 3.813 6.430 1.00 0.00 C ATOM 1345 OG1 THR A 92 -1.114 4.722 7.529 1.00 0.00 O ATOM 1346 CG2 THR A 92 -1.483 2.437 6.839 1.00 0.00 C ATOM 0 H THR A 92 0.623 5.264 4.538 1.00 0.00 H new ATOM 0 HA THR A 92 1.117 3.500 6.834 1.00 0.00 H new ATOM 0 HB THR A 92 -1.580 4.167 5.591 1.00 0.00 H new ATOM 0 HG1 THR A 92 -0.244 5.130 7.724 1.00 0.00 H new ATOM 0 HG21 THR A 92 -2.524 2.509 7.155 1.00 0.00 H new ATOM 0 HG22 THR A 92 -1.407 1.755 5.992 1.00 0.00 H new ATOM 0 HG23 THR A 92 -0.879 2.059 7.664 1.00 0.00 H new ATOM 1354 N ILE A 93 1.646 1.813 5.079 1.00 0.00 N ATOM 1355 CA ILE A 93 1.892 0.729 4.136 1.00 0.00 C ATOM 1356 C ILE A 93 1.168 -0.544 4.562 1.00 0.00 C ATOM 1357 O ILE A 93 1.039 -0.830 5.752 1.00 0.00 O ATOM 1358 CB ILE A 93 3.397 0.431 4.002 1.00 0.00 C ATOM 1359 CG1 ILE A 93 4.097 1.559 3.242 1.00 0.00 C ATOM 1360 CG2 ILE A 93 3.611 -0.901 3.299 1.00 0.00 C ATOM 1361 CD1 ILE A 93 5.548 1.739 3.630 1.00 0.00 C ATOM 0 H ILE A 93 2.307 1.856 5.854 1.00 0.00 H new ATOM 0 HA ILE A 93 1.508 1.056 3.170 1.00 0.00 H new ATOM 0 HB ILE A 93 3.831 0.368 5.000 1.00 0.00 H new ATOM 0 HG12 ILE A 93 4.038 1.357 2.173 1.00 0.00 H new ATOM 0 HG13 ILE A 93 3.563 2.492 3.420 1.00 0.00 H new ATOM 0 HG21 ILE A 93 4.679 -1.099 3.211 1.00 0.00 H new ATOM 0 HG22 ILE A 93 3.141 -1.697 3.877 1.00 0.00 H new ATOM 0 HG23 ILE A 93 3.166 -0.863 2.305 1.00 0.00 H new ATOM 0 HD11 ILE A 93 5.981 2.555 3.052 1.00 0.00 H new ATOM 0 HD12 ILE A 93 5.614 1.972 4.693 1.00 0.00 H new ATOM 0 HD13 ILE A 93 6.096 0.819 3.425 1.00 0.00 H new ATOM 1373 N LYS A 94 0.699 -1.307 3.581 1.00 0.00 N ATOM 1374 CA LYS A 94 -0.009 -2.553 3.851 1.00 0.00 C ATOM 1375 C LYS A 94 0.491 -3.671 2.943 1.00 0.00 C ATOM 1376 O LYS A 94 0.682 -3.470 1.743 1.00 0.00 O ATOM 1377 CB LYS A 94 -1.515 -2.359 3.659 1.00 0.00 C ATOM 1378 CG LYS A 94 -2.135 -1.388 4.649 1.00 0.00 C ATOM 1379 CD LYS A 94 -2.459 -2.068 5.969 1.00 0.00 C ATOM 1380 CE LYS A 94 -3.270 -1.160 6.879 1.00 0.00 C ATOM 1381 NZ LYS A 94 -2.399 -0.370 7.794 1.00 0.00 N ATOM 0 H LYS A 94 0.796 -1.084 2.590 1.00 0.00 H new ATOM 0 HA LYS A 94 0.186 -2.836 4.885 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -1.700 -2.000 2.647 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -2.012 -3.325 3.751 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -1.450 -0.559 4.824 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -3.045 -0.965 4.224 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -3.015 -2.986 5.780 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -1.534 -2.354 6.469 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -3.870 -0.481 6.273 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -3.964 -1.761 7.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -2.872 0.523 8.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -2.220 -0.916 8.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -1.495 -0.165 7.322 1.00 0.00 H new ATOM 1395 N ILE A 95 0.698 -4.849 3.521 1.00 0.00 N ATOM 1396 CA ILE A 95 1.173 -6.000 2.763 1.00 0.00 C ATOM 1397 C ILE A 95 0.020 -6.926 2.390 1.00 0.00 C ATOM 1398 O ILE A 95 -0.882 -7.165 3.192 1.00 0.00 O ATOM 1399 CB ILE A 95 2.225 -6.800 3.553 1.00 0.00 C ATOM 1400 CG1 ILE A 95 3.494 -5.968 3.743 1.00 0.00 C ATOM 1401 CG2 ILE A 95 2.543 -8.106 2.839 1.00 0.00 C ATOM 1402 CD1 ILE A 95 4.313 -6.380 4.946 1.00 0.00 C ATOM 0 H ILE A 95 0.544 -5.032 4.513 1.00 0.00 H new ATOM 0 HA ILE A 95 1.632 -5.611 1.854 1.00 0.00 H new ATOM 0 HB ILE A 95 1.818 -7.036 4.536 1.00 0.00 H new ATOM 0 HG12 ILE A 95 4.111 -6.052 2.848 1.00 0.00 H new ATOM 0 HG13 ILE A 95 3.219 -4.918 3.844 1.00 0.00 H new ATOM 0 HG21 ILE A 95 3.288 -8.660 3.409 1.00 0.00 H new ATOM 0 HG22 ILE A 95 1.635 -8.703 2.751 1.00 0.00 H new ATOM 0 HG23 ILE A 95 2.934 -7.891 1.844 1.00 0.00 H new ATOM 0 HD11 ILE A 95 5.197 -5.747 5.018 1.00 0.00 H new ATOM 0 HD12 ILE A 95 3.713 -6.270 5.849 1.00 0.00 H new ATOM 0 HD13 ILE A 95 4.619 -7.421 4.839 1.00 0.00 H new ATOM 1414 N PHE A 96 0.058 -7.445 1.167 1.00 0.00 N ATOM 1415 CA PHE A 96 -0.983 -8.347 0.687 1.00 0.00 C ATOM 1416 C PHE A 96 -0.388 -9.684 0.256 1.00 0.00 C ATOM 1417 O PHE A 96 0.551 -9.731 -0.537 1.00 0.00 O ATOM 1418 CB PHE A 96 -1.739 -7.711 -0.482 1.00 0.00 C ATOM 1419 CG PHE A 96 -2.702 -6.638 -0.060 1.00 0.00 C ATOM 1420 CD1 PHE A 96 -2.240 -5.437 0.453 1.00 0.00 C ATOM 1421 CD2 PHE A 96 -4.069 -6.831 -0.177 1.00 0.00 C ATOM 1422 CE1 PHE A 96 -3.124 -4.447 0.841 1.00 0.00 C ATOM 1423 CE2 PHE A 96 -4.957 -5.845 0.209 1.00 0.00 C ATOM 1424 CZ PHE A 96 -4.484 -4.652 0.720 1.00 0.00 C ATOM 0 H PHE A 96 0.798 -7.257 0.491 1.00 0.00 H new ATOM 0 HA PHE A 96 -1.679 -8.527 1.506 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -1.019 -7.287 -1.182 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -2.285 -8.488 -1.017 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -1.177 -5.272 0.551 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -4.445 -7.762 -0.574 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -2.751 -3.515 1.238 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -6.020 -6.007 0.111 1.00 0.00 H new ATOM 0 HZ PHE A 96 -5.177 -3.881 1.024 1.00 0.00 H new ATOM 1434 N GLY A 97 -0.943 -10.770 0.785 1.00 0.00 N ATOM 1435 CA GLY A 97 -0.455 -12.094 0.444 1.00 0.00 C ATOM 1436 C GLY A 97 -1.332 -13.197 1.002 1.00 0.00 C ATOM 1437 O GLY A 97 -2.188 -13.734 0.300 1.00 0.00 O ATOM 0 H GLY A 97 -1.722 -10.757 1.444 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -0.402 -12.190 -0.640 1.00 0.00 H new ATOM 0 HA3 GLY A 97 0.559 -12.213 0.825 1.00 0.00 H new ATOM 1441 N ALA A 98 -1.118 -13.537 2.269 1.00 0.00 N ATOM 1442 CA ALA A 98 -1.896 -14.583 2.921 1.00 0.00 C ATOM 1443 C ALA A 98 -3.392 -14.338 2.756 1.00 0.00 C ATOM 1444 O ALA A 98 -4.094 -15.130 2.130 1.00 0.00 O ATOM 1445 CB ALA A 98 -1.533 -14.669 4.396 1.00 0.00 C ATOM 0 H ALA A 98 -0.412 -13.103 2.864 1.00 0.00 H new ATOM 0 HA ALA A 98 -1.655 -15.532 2.443 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -2.122 -15.454 4.870 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -0.472 -14.899 4.497 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -1.745 -13.715 4.879 1.00 0.00 H new ATOM 1451 N ASN A 99 -3.873 -13.236 3.323 1.00 0.00 N ATOM 1452 CA ASN A 99 -5.286 -12.888 3.239 1.00 0.00 C ATOM 1453 C ASN A 99 -5.480 -11.578 2.483 1.00 0.00 C ATOM 1454 O ASN A 99 -5.424 -10.496 3.068 1.00 0.00 O ATOM 1455 CB ASN A 99 -5.889 -12.775 4.641 1.00 0.00 C ATOM 1456 CG ASN A 99 -7.404 -12.711 4.616 1.00 0.00 C ATOM 1457 OD1 ASN A 99 -8.036 -13.099 3.633 1.00 0.00 O ATOM 1458 ND2 ASN A 99 -7.993 -12.220 5.700 1.00 0.00 N ATOM 0 H ASN A 99 -3.305 -12.569 3.845 1.00 0.00 H new ATOM 0 HA ASN A 99 -5.798 -13.681 2.693 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -5.574 -13.630 5.239 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -5.499 -11.883 5.131 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -9.010 -12.152 5.742 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -7.429 -11.910 6.491 1.00 0.00 H new ATOM 1465 N LYS A 100 -5.709 -11.682 1.179 1.00 0.00 N ATOM 1466 CA LYS A 100 -5.914 -10.506 0.341 1.00 0.00 C ATOM 1467 C LYS A 100 -7.043 -9.639 0.887 1.00 0.00 C ATOM 1468 O LYS A 100 -7.204 -8.488 0.484 1.00 0.00 O ATOM 1469 CB LYS A 100 -6.229 -10.927 -1.096 1.00 0.00 C ATOM 1470 CG LYS A 100 -4.993 -11.234 -1.925 1.00 0.00 C ATOM 1471 CD LYS A 100 -4.009 -10.077 -1.908 1.00 0.00 C ATOM 1472 CE LYS A 100 -3.004 -10.182 -3.045 1.00 0.00 C ATOM 1473 NZ LYS A 100 -2.028 -11.284 -2.822 1.00 0.00 N ATOM 0 H LYS A 100 -5.757 -12.569 0.679 1.00 0.00 H new ATOM 0 HA LYS A 100 -4.994 -9.921 0.348 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -6.870 -11.808 -1.075 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -6.795 -10.132 -1.583 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -4.508 -12.131 -1.539 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -5.287 -11.448 -2.953 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -4.552 -9.135 -1.987 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -3.481 -10.061 -0.955 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -3.533 -10.350 -3.983 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -2.469 -9.238 -3.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -1.578 -11.537 -3.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -1.300 -10.972 -2.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -2.523 -12.114 -2.437 1.00 0.00 H new ATOM 1487 N ASN A 101 -7.822 -10.199 1.807 1.00 0.00 N ATOM 1488 CA ASN A 101 -8.936 -9.476 2.408 1.00 0.00 C ATOM 1489 C ASN A 101 -8.471 -8.665 3.614 1.00 0.00 C ATOM 1490 O ASN A 101 -9.052 -7.631 3.943 1.00 0.00 O ATOM 1491 CB ASN A 101 -10.037 -10.451 2.830 1.00 0.00 C ATOM 1492 CG ASN A 101 -11.049 -10.693 1.727 1.00 0.00 C ATOM 1493 OD1 ASN A 101 -12.247 -10.476 1.911 1.00 0.00 O ATOM 1494 ND2 ASN A 101 -10.571 -11.145 0.574 1.00 0.00 N ATOM 0 H ASN A 101 -7.702 -11.151 2.152 1.00 0.00 H new ATOM 0 HA ASN A 101 -9.335 -8.789 1.662 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -9.586 -11.400 3.120 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -10.549 -10.059 3.709 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -11.204 -11.327 -0.205 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -9.570 -11.311 0.467 1.00 0.00 H new ATOM 1501 N LYS A 102 -7.417 -9.141 4.269 1.00 0.00 N ATOM 1502 CA LYS A 102 -6.870 -8.460 5.437 1.00 0.00 C ATOM 1503 C LYS A 102 -5.345 -8.458 5.401 1.00 0.00 C ATOM 1504 O LYS A 102 -4.690 -9.438 5.755 1.00 0.00 O ATOM 1505 CB LYS A 102 -7.359 -9.135 6.721 1.00 0.00 C ATOM 1506 CG LYS A 102 -8.868 -9.298 6.786 1.00 0.00 C ATOM 1507 CD LYS A 102 -9.323 -9.734 8.168 1.00 0.00 C ATOM 1508 CE LYS A 102 -9.380 -11.250 8.284 1.00 0.00 C ATOM 1509 NZ LYS A 102 -10.279 -11.688 9.387 1.00 0.00 N ATOM 0 H LYS A 102 -6.924 -9.996 4.011 1.00 0.00 H new ATOM 0 HA LYS A 102 -7.218 -7.427 5.421 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -6.892 -10.116 6.806 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -7.028 -8.549 7.578 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -9.348 -8.355 6.525 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -9.187 -10.034 6.048 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -8.641 -9.336 8.919 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -10.307 -9.315 8.377 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -9.728 -11.674 7.342 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -8.377 -11.639 8.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -10.291 -12.727 9.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -9.933 -11.305 10.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -11.242 -11.338 9.209 1.00 0.00 H new ATOM 1523 N PRO A 103 -4.765 -7.330 4.964 1.00 0.00 N ATOM 1524 CA PRO A 103 -3.311 -7.172 4.873 1.00 0.00 C ATOM 1525 C PRO A 103 -2.649 -7.097 6.245 1.00 0.00 C ATOM 1526 O PRO A 103 -3.327 -6.982 7.265 1.00 0.00 O ATOM 1527 CB PRO A 103 -3.144 -5.846 4.126 1.00 0.00 C ATOM 1528 CG PRO A 103 -4.396 -5.091 4.410 1.00 0.00 C ATOM 1529 CD PRO A 103 -5.485 -6.122 4.525 1.00 0.00 C ATOM 0 HA PRO A 103 -2.840 -8.020 4.376 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -2.266 -5.303 4.475 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -3.014 -6.008 3.056 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -4.304 -4.516 5.331 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -4.613 -4.381 3.612 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -6.246 -5.824 5.246 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -5.992 -6.280 3.573 1.00 0.00 H new ATOM 1537 N GLU A 104 -1.322 -7.162 6.261 1.00 0.00 N ATOM 1538 CA GLU A 104 -0.570 -7.102 7.509 1.00 0.00 C ATOM 1539 C GLU A 104 0.203 -5.790 7.616 1.00 0.00 C ATOM 1540 O GLU A 104 0.833 -5.348 6.655 1.00 0.00 O ATOM 1541 CB GLU A 104 0.397 -8.284 7.606 1.00 0.00 C ATOM 1542 CG GLU A 104 1.384 -8.359 6.454 1.00 0.00 C ATOM 1543 CD GLU A 104 2.309 -9.556 6.555 1.00 0.00 C ATOM 1544 OE1 GLU A 104 1.850 -10.687 6.290 1.00 0.00 O ATOM 1545 OE2 GLU A 104 3.494 -9.362 6.900 1.00 0.00 O ATOM 0 H GLU A 104 -0.746 -7.256 5.425 1.00 0.00 H new ATOM 0 HA GLU A 104 -1.281 -7.154 8.334 1.00 0.00 H new ATOM 0 HB2 GLU A 104 0.950 -8.214 8.543 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -0.177 -9.210 7.643 1.00 0.00 H new ATOM 0 HG2 GLU A 104 0.836 -8.407 5.513 1.00 0.00 H new ATOM 0 HG3 GLU A 104 1.979 -7.446 6.430 1.00 0.00 H new ATOM 1552 N ASP A 105 0.148 -5.172 8.791 1.00 0.00 N ATOM 1553 CA ASP A 105 0.842 -3.911 9.025 1.00 0.00 C ATOM 1554 C ASP A 105 2.328 -4.041 8.703 1.00 0.00 C ATOM 1555 O ASP A 105 3.035 -4.850 9.304 1.00 0.00 O ATOM 1556 CB ASP A 105 0.659 -3.465 10.477 1.00 0.00 C ATOM 1557 CG ASP A 105 -0.717 -2.883 10.734 1.00 0.00 C ATOM 1558 OD1 ASP A 105 -1.658 -3.236 9.994 1.00 0.00 O ATOM 1559 OD2 ASP A 105 -0.852 -2.072 11.674 1.00 0.00 O ATOM 0 H ASP A 105 -0.370 -5.524 9.596 1.00 0.00 H new ATOM 0 HA ASP A 105 0.410 -3.159 8.365 1.00 0.00 H new ATOM 0 HB2 ASP A 105 0.820 -4.316 11.139 1.00 0.00 H new ATOM 0 HB3 ASP A 105 1.417 -2.722 10.724 1.00 0.00 H new ATOM 1564 N TYR A 106 2.793 -3.240 7.751 1.00 0.00 N ATOM 1565 CA TYR A 106 4.194 -3.268 7.347 1.00 0.00 C ATOM 1566 C TYR A 106 5.066 -2.521 8.352 1.00 0.00 C ATOM 1567 O TYR A 106 5.170 -1.295 8.308 1.00 0.00 O ATOM 1568 CB TYR A 106 4.357 -2.652 5.956 1.00 0.00 C ATOM 1569 CG TYR A 106 5.799 -2.517 5.519 1.00 0.00 C ATOM 1570 CD1 TYR A 106 6.712 -3.540 5.745 1.00 0.00 C ATOM 1571 CD2 TYR A 106 6.246 -1.368 4.880 1.00 0.00 C ATOM 1572 CE1 TYR A 106 8.030 -3.420 5.348 1.00 0.00 C ATOM 1573 CE2 TYR A 106 7.562 -1.240 4.478 1.00 0.00 C ATOM 1574 CZ TYR A 106 8.450 -2.269 4.715 1.00 0.00 C ATOM 1575 OH TYR A 106 9.761 -2.147 4.316 1.00 0.00 O ATOM 0 H TYR A 106 2.221 -2.564 7.245 1.00 0.00 H new ATOM 0 HA TYR A 106 4.517 -4.309 7.317 1.00 0.00 H new ATOM 0 HB2 TYR A 106 3.822 -3.266 5.231 1.00 0.00 H new ATOM 0 HB3 TYR A 106 3.889 -1.667 5.947 1.00 0.00 H new ATOM 0 HD1 TYR A 106 6.386 -4.443 6.239 1.00 0.00 H new ATOM 0 HD2 TYR A 106 5.553 -0.561 4.694 1.00 0.00 H new ATOM 0 HE1 TYR A 106 8.728 -4.223 5.532 1.00 0.00 H new ATOM 0 HE2 TYR A 106 7.893 -0.340 3.981 1.00 0.00 H new ATOM 0 HH TYR A 106 10.070 -1.232 4.483 1.00 0.00 H new ATOM 1585 N GLN A 107 5.690 -3.269 9.255 1.00 0.00 N ATOM 1586 CA GLN A 107 6.553 -2.679 10.271 1.00 0.00 C ATOM 1587 C GLN A 107 8.023 -2.836 9.896 1.00 0.00 C ATOM 1588 O GLN A 107 8.867 -3.105 10.750 1.00 0.00 O ATOM 1589 CB GLN A 107 6.290 -3.325 11.633 1.00 0.00 C ATOM 1590 CG GLN A 107 4.850 -3.193 12.101 1.00 0.00 C ATOM 1591 CD GLN A 107 4.606 -1.920 12.887 1.00 0.00 C ATOM 1592 OE1 GLN A 107 4.936 -1.835 14.070 1.00 0.00 O ATOM 1593 NE2 GLN A 107 4.026 -0.921 12.232 1.00 0.00 N ATOM 0 H GLN A 107 5.614 -4.285 9.304 1.00 0.00 H new ATOM 0 HA GLN A 107 6.324 -1.615 10.331 1.00 0.00 H new ATOM 0 HB2 GLN A 107 6.551 -4.382 11.581 1.00 0.00 H new ATOM 0 HB3 GLN A 107 6.947 -2.871 12.374 1.00 0.00 H new ATOM 0 HG2 GLN A 107 4.187 -3.214 11.236 1.00 0.00 H new ATOM 0 HG3 GLN A 107 4.593 -4.053 12.720 1.00 0.00 H new ATOM 0 HE21 GLN A 107 3.769 -1.035 11.252 1.00 0.00 H new ATOM 0 HE22 GLN A 107 3.837 -0.040 12.709 1.00 0.00 H new ATOM 1602 N GLY A 108 8.322 -2.667 8.611 1.00 0.00 N ATOM 1603 CA GLY A 108 9.691 -2.795 8.145 1.00 0.00 C ATOM 1604 C GLY A 108 10.259 -1.481 7.647 1.00 0.00 C ATOM 1605 O GLY A 108 9.519 -0.526 7.412 1.00 0.00 O ATOM 0 H GLY A 108 7.641 -2.444 7.885 1.00 0.00 H new ATOM 0 HA2 GLY A 108 10.314 -3.172 8.956 1.00 0.00 H new ATOM 0 HA3 GLY A 108 9.731 -3.532 7.343 1.00 0.00 H new ATOM 1609 N GLY A 109 11.578 -1.431 7.488 1.00 0.00 N ATOM 1610 CA GLY A 109 12.223 -0.219 7.018 1.00 0.00 C ATOM 1611 C GLY A 109 11.479 0.423 5.863 1.00 0.00 C ATOM 1612 O GLY A 109 11.161 -0.239 4.876 1.00 0.00 O ATOM 0 H GLY A 109 12.211 -2.208 7.676 1.00 0.00 H new ATOM 0 HA2 GLY A 109 12.295 0.493 7.840 1.00 0.00 H new ATOM 0 HA3 GLY A 109 13.242 -0.450 6.706 1.00 0.00 H new ATOM 1616 N ARG A 110 11.199 1.717 5.988 1.00 0.00 N ATOM 1617 CA ARG A 110 10.485 2.447 4.948 1.00 0.00 C ATOM 1618 C ARG A 110 11.460 3.051 3.941 1.00 0.00 C ATOM 1619 O ARG A 110 11.384 4.238 3.622 1.00 0.00 O ATOM 1620 CB ARG A 110 9.627 3.552 5.568 1.00 0.00 C ATOM 1621 CG ARG A 110 8.716 3.062 6.682 1.00 0.00 C ATOM 1622 CD ARG A 110 7.474 2.382 6.128 1.00 0.00 C ATOM 1623 NE ARG A 110 6.767 1.615 7.150 1.00 0.00 N ATOM 1624 CZ ARG A 110 5.990 2.166 8.076 1.00 0.00 C ATOM 1625 NH1 ARG A 110 5.821 3.481 8.108 1.00 0.00 N ATOM 1626 NH2 ARG A 110 5.381 1.402 8.973 1.00 0.00 N ATOM 0 H ARG A 110 11.456 2.280 6.799 1.00 0.00 H new ATOM 0 HA ARG A 110 9.837 1.744 4.425 1.00 0.00 H new ATOM 0 HB2 ARG A 110 10.281 4.331 5.961 1.00 0.00 H new ATOM 0 HB3 ARG A 110 9.019 4.010 4.788 1.00 0.00 H new ATOM 0 HG2 ARG A 110 9.261 2.365 7.318 1.00 0.00 H new ATOM 0 HG3 ARG A 110 8.422 3.903 7.310 1.00 0.00 H new ATOM 0 HD2 ARG A 110 6.804 3.134 5.712 1.00 0.00 H new ATOM 0 HD3 ARG A 110 7.758 1.720 5.310 1.00 0.00 H new ATOM 0 HE ARG A 110 6.876 0.601 7.153 1.00 0.00 H new ATOM 0 HH11 ARG A 110 6.288 4.072 7.420 1.00 0.00 H new ATOM 0 HH12 ARG A 110 5.224 3.901 8.820 1.00 0.00 H new ATOM 0 HH21 ARG A 110 5.509 0.390 8.952 1.00 0.00 H new ATOM 0 HH22 ARG A 110 4.785 1.826 9.684 1.00 0.00 H new ATOM 1640 N THR A 111 12.376 2.226 3.444 1.00 0.00 N ATOM 1641 CA THR A 111 13.366 2.678 2.475 1.00 0.00 C ATOM 1642 C THR A 111 13.411 1.754 1.263 1.00 0.00 C ATOM 1643 O THR A 111 13.375 0.532 1.399 1.00 0.00 O ATOM 1644 CB THR A 111 14.771 2.752 3.101 1.00 0.00 C ATOM 1645 OG1 THR A 111 15.044 1.554 3.837 1.00 0.00 O ATOM 1646 CG2 THR A 111 14.890 3.957 4.022 1.00 0.00 C ATOM 0 H THR A 111 12.453 1.241 3.697 1.00 0.00 H new ATOM 0 HA THR A 111 13.064 3.676 2.157 1.00 0.00 H new ATOM 0 HB THR A 111 15.498 2.856 2.296 1.00 0.00 H new ATOM 0 HG1 THR A 111 15.940 1.609 4.230 1.00 0.00 H new ATOM 0 HG21 THR A 111 15.891 3.988 4.453 1.00 0.00 H new ATOM 0 HG22 THR A 111 14.711 4.869 3.453 1.00 0.00 H new ATOM 0 HG23 THR A 111 14.153 3.878 4.822 1.00 0.00 H new ATOM 1654 N GLY A 112 13.489 2.348 0.075 1.00 0.00 N ATOM 1655 CA GLY A 112 13.538 1.563 -1.145 1.00 0.00 C ATOM 1656 C GLY A 112 14.293 0.260 -0.966 1.00 0.00 C ATOM 1657 O GLY A 112 13.974 -0.741 -1.605 1.00 0.00 O ATOM 0 H GLY A 112 13.519 3.358 -0.064 1.00 0.00 H new ATOM 0 HA2 GLY A 112 12.522 1.348 -1.476 1.00 0.00 H new ATOM 0 HA3 GLY A 112 14.013 2.149 -1.932 1.00 0.00 H new ATOM 1661 N GLU A 113 15.298 0.275 -0.096 1.00 0.00 N ATOM 1662 CA GLU A 113 16.102 -0.914 0.162 1.00 0.00 C ATOM 1663 C GLU A 113 15.379 -1.863 1.114 1.00 0.00 C ATOM 1664 O GLU A 113 15.154 -3.029 0.792 1.00 0.00 O ATOM 1665 CB GLU A 113 17.459 -0.521 0.748 1.00 0.00 C ATOM 1666 CG GLU A 113 17.923 0.866 0.335 1.00 0.00 C ATOM 1667 CD GLU A 113 19.433 0.996 0.324 1.00 0.00 C ATOM 1668 OE1 GLU A 113 20.079 0.339 -0.519 1.00 0.00 O ATOM 1669 OE2 GLU A 113 19.970 1.756 1.157 1.00 0.00 O ATOM 0 H GLU A 113 15.575 1.097 0.442 1.00 0.00 H new ATOM 0 HA GLU A 113 16.259 -1.429 -0.786 1.00 0.00 H new ATOM 0 HB2 GLU A 113 17.402 -0.567 1.836 1.00 0.00 H new ATOM 0 HB3 GLU A 113 18.205 -1.252 0.436 1.00 0.00 H new ATOM 0 HG2 GLU A 113 17.535 1.094 -0.658 1.00 0.00 H new ATOM 0 HG3 GLU A 113 17.503 1.604 1.019 1.00 0.00 H new ATOM 1676 N ALA A 114 15.019 -1.354 2.287 1.00 0.00 N ATOM 1677 CA ALA A 114 14.322 -2.154 3.286 1.00 0.00 C ATOM 1678 C ALA A 114 13.076 -2.805 2.695 1.00 0.00 C ATOM 1679 O ALA A 114 12.881 -4.015 2.812 1.00 0.00 O ATOM 1680 CB ALA A 114 13.952 -1.296 4.487 1.00 0.00 C ATOM 0 H ALA A 114 15.199 -0.390 2.569 1.00 0.00 H new ATOM 0 HA ALA A 114 14.994 -2.947 3.614 1.00 0.00 H new ATOM 0 HB1 ALA A 114 13.432 -1.907 5.225 1.00 0.00 H new ATOM 0 HB2 ALA A 114 14.857 -0.883 4.932 1.00 0.00 H new ATOM 0 HB3 ALA A 114 13.301 -0.483 4.166 1.00 0.00 H new ATOM 1686 N ILE A 115 12.235 -1.995 2.061 1.00 0.00 N ATOM 1687 CA ILE A 115 11.008 -2.493 1.452 1.00 0.00 C ATOM 1688 C ILE A 115 11.282 -3.715 0.583 1.00 0.00 C ATOM 1689 O ILE A 115 10.574 -4.719 0.663 1.00 0.00 O ATOM 1690 CB ILE A 115 10.325 -1.410 0.594 1.00 0.00 C ATOM 1691 CG1 ILE A 115 10.035 -0.168 1.439 1.00 0.00 C ATOM 1692 CG2 ILE A 115 9.043 -1.952 -0.019 1.00 0.00 C ATOM 1693 CD1 ILE A 115 10.102 1.124 0.655 1.00 0.00 C ATOM 0 H ILE A 115 12.381 -0.991 1.956 1.00 0.00 H new ATOM 0 HA ILE A 115 10.342 -2.772 2.268 1.00 0.00 H new ATOM 0 HB ILE A 115 11.000 -1.127 -0.214 1.00 0.00 H new ATOM 0 HG12 ILE A 115 9.044 -0.263 1.883 1.00 0.00 H new ATOM 0 HG13 ILE A 115 10.749 -0.123 2.261 1.00 0.00 H new ATOM 0 HG21 ILE A 115 8.572 -1.176 -0.622 1.00 0.00 H new ATOM 0 HG22 ILE A 115 9.276 -2.810 -0.649 1.00 0.00 H new ATOM 0 HG23 ILE A 115 8.362 -2.259 0.775 1.00 0.00 H new ATOM 0 HD11 ILE A 115 9.886 1.963 1.317 1.00 0.00 H new ATOM 0 HD12 ILE A 115 11.100 1.242 0.233 1.00 0.00 H new ATOM 0 HD13 ILE A 115 9.368 1.099 -0.151 1.00 0.00 H new ATOM 1705 N VAL A 116 12.318 -3.625 -0.246 1.00 0.00 N ATOM 1706 CA VAL A 116 12.689 -4.725 -1.128 1.00 0.00 C ATOM 1707 C VAL A 116 12.893 -6.015 -0.342 1.00 0.00 C ATOM 1708 O VAL A 116 12.427 -7.081 -0.746 1.00 0.00 O ATOM 1709 CB VAL A 116 13.975 -4.405 -1.913 1.00 0.00 C ATOM 1710 CG1 VAL A 116 14.458 -5.633 -2.670 1.00 0.00 C ATOM 1711 CG2 VAL A 116 13.743 -3.240 -2.863 1.00 0.00 C ATOM 0 H VAL A 116 12.915 -2.802 -0.325 1.00 0.00 H new ATOM 0 HA VAL A 116 11.867 -4.858 -1.831 1.00 0.00 H new ATOM 0 HB VAL A 116 14.751 -4.117 -1.204 1.00 0.00 H new ATOM 0 HG11 VAL A 116 15.367 -5.388 -3.219 1.00 0.00 H new ATOM 0 HG12 VAL A 116 14.666 -6.437 -1.964 1.00 0.00 H new ATOM 0 HG13 VAL A 116 13.687 -5.955 -3.370 1.00 0.00 H new ATOM 0 HG21 VAL A 116 14.662 -3.028 -3.409 1.00 0.00 H new ATOM 0 HG22 VAL A 116 12.953 -3.497 -3.568 1.00 0.00 H new ATOM 0 HG23 VAL A 116 13.448 -2.359 -2.293 1.00 0.00 H new ATOM 1721 N ASP A 117 13.592 -5.911 0.783 1.00 0.00 N ATOM 1722 CA ASP A 117 13.857 -7.070 1.628 1.00 0.00 C ATOM 1723 C ASP A 117 12.569 -7.589 2.258 1.00 0.00 C ATOM 1724 O ASP A 117 12.384 -8.796 2.410 1.00 0.00 O ATOM 1725 CB ASP A 117 14.866 -6.711 2.720 1.00 0.00 C ATOM 1726 CG ASP A 117 15.568 -7.930 3.284 1.00 0.00 C ATOM 1727 OD1 ASP A 117 14.958 -9.021 3.281 1.00 0.00 O ATOM 1728 OD2 ASP A 117 16.727 -7.795 3.727 1.00 0.00 O ATOM 0 H ASP A 117 13.985 -5.037 1.131 1.00 0.00 H new ATOM 0 HA ASP A 117 14.276 -7.858 1.002 1.00 0.00 H new ATOM 0 HB2 ASP A 117 15.608 -6.024 2.313 1.00 0.00 H new ATOM 0 HB3 ASP A 117 14.353 -6.186 3.526 1.00 0.00 H new ATOM 1733 N ALA A 118 11.682 -6.670 2.623 1.00 0.00 N ATOM 1734 CA ALA A 118 10.411 -7.035 3.236 1.00 0.00 C ATOM 1735 C ALA A 118 9.514 -7.768 2.244 1.00 0.00 C ATOM 1736 O ALA A 118 8.984 -8.837 2.546 1.00 0.00 O ATOM 1737 CB ALA A 118 9.708 -5.796 3.771 1.00 0.00 C ATOM 0 H ALA A 118 11.820 -5.666 2.505 1.00 0.00 H new ATOM 0 HA ALA A 118 10.617 -7.710 4.067 1.00 0.00 H new ATOM 0 HB1 ALA A 118 8.760 -6.083 4.226 1.00 0.00 H new ATOM 0 HB2 ALA A 118 10.338 -5.314 4.519 1.00 0.00 H new ATOM 0 HB3 ALA A 118 9.521 -5.101 2.952 1.00 0.00 H new ATOM 1743 N ALA A 119 9.349 -7.186 1.061 1.00 0.00 N ATOM 1744 CA ALA A 119 8.517 -7.785 0.025 1.00 0.00 C ATOM 1745 C ALA A 119 8.966 -9.209 -0.284 1.00 0.00 C ATOM 1746 O ALA A 119 8.141 -10.105 -0.473 1.00 0.00 O ATOM 1747 CB ALA A 119 8.549 -6.934 -1.236 1.00 0.00 C ATOM 0 H ALA A 119 9.780 -6.300 0.796 1.00 0.00 H new ATOM 0 HA ALA A 119 7.493 -7.827 0.395 1.00 0.00 H new ATOM 0 HB1 ALA A 119 7.923 -7.394 -2.001 1.00 0.00 H new ATOM 0 HB2 ALA A 119 8.173 -5.936 -1.011 1.00 0.00 H new ATOM 0 HB3 ALA A 119 9.574 -6.862 -1.600 1.00 0.00 H new ATOM 1753 N LEU A 120 10.278 -9.413 -0.336 1.00 0.00 N ATOM 1754 CA LEU A 120 10.837 -10.729 -0.623 1.00 0.00 C ATOM 1755 C LEU A 120 10.496 -11.720 0.485 1.00 0.00 C ATOM 1756 O LEU A 120 9.893 -12.764 0.234 1.00 0.00 O ATOM 1757 CB LEU A 120 12.355 -10.635 -0.788 1.00 0.00 C ATOM 1758 CG LEU A 120 12.851 -9.788 -1.961 1.00 0.00 C ATOM 1759 CD1 LEU A 120 14.242 -9.244 -1.675 1.00 0.00 C ATOM 1760 CD2 LEU A 120 12.850 -10.603 -3.246 1.00 0.00 C ATOM 0 H LEU A 120 10.974 -8.684 -0.183 1.00 0.00 H new ATOM 0 HA LEU A 120 10.397 -11.087 -1.554 1.00 0.00 H new ATOM 0 HB2 LEU A 120 12.776 -10.228 0.132 1.00 0.00 H new ATOM 0 HB3 LEU A 120 12.751 -11.644 -0.901 1.00 0.00 H new ATOM 0 HG LEU A 120 12.172 -8.945 -2.088 1.00 0.00 H new ATOM 0 HD11 LEU A 120 14.579 -8.644 -2.520 1.00 0.00 H new ATOM 0 HD12 LEU A 120 14.213 -8.624 -0.779 1.00 0.00 H new ATOM 0 HD13 LEU A 120 14.932 -10.073 -1.521 1.00 0.00 H new ATOM 0 HD21 LEU A 120 13.206 -9.984 -4.070 1.00 0.00 H new ATOM 0 HD22 LEU A 120 13.506 -11.465 -3.130 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.837 -10.944 -3.460 1.00 0.00 H new ATOM 1772 N SER A 121 10.883 -11.385 1.712 1.00 0.00 N ATOM 1773 CA SER A 121 10.619 -12.246 2.859 1.00 0.00 C ATOM 1774 C SER A 121 9.187 -12.771 2.825 1.00 0.00 C ATOM 1775 O SER A 121 8.945 -13.959 3.039 1.00 0.00 O ATOM 1776 CB SER A 121 10.864 -11.483 4.162 1.00 0.00 C ATOM 1777 OG SER A 121 11.230 -12.366 5.208 1.00 0.00 O ATOM 0 H SER A 121 11.380 -10.523 1.937 1.00 0.00 H new ATOM 0 HA SER A 121 11.300 -13.096 2.810 1.00 0.00 H new ATOM 0 HB2 SER A 121 11.652 -10.745 4.012 1.00 0.00 H new ATOM 0 HB3 SER A 121 9.964 -10.936 4.442 1.00 0.00 H new ATOM 0 HG SER A 121 11.383 -11.854 6.030 1.00 0.00 H new ATOM 1783 N ALA A 122 8.241 -11.877 2.555 1.00 0.00 N ATOM 1784 CA ALA A 122 6.834 -12.250 2.491 1.00 0.00 C ATOM 1785 C ALA A 122 6.547 -13.106 1.262 1.00 0.00 C ATOM 1786 O ALA A 122 5.867 -14.129 1.349 1.00 0.00 O ATOM 1787 CB ALA A 122 5.958 -11.006 2.486 1.00 0.00 C ATOM 0 H ALA A 122 8.424 -10.889 2.377 1.00 0.00 H new ATOM 0 HA ALA A 122 6.601 -12.842 3.376 1.00 0.00 H new ATOM 0 HB1 ALA A 122 4.909 -11.300 2.438 1.00 0.00 H new ATOM 0 HB2 ALA A 122 6.133 -10.434 3.397 1.00 0.00 H new ATOM 0 HB3 ALA A 122 6.203 -10.392 1.619 1.00 0.00 H new ATOM 1793 N LEU A 123 7.070 -12.681 0.117 1.00 0.00 N ATOM 1794 CA LEU A 123 6.870 -13.408 -1.132 1.00 0.00 C ATOM 1795 C LEU A 123 6.956 -14.914 -0.905 1.00 0.00 C ATOM 1796 O LEU A 123 6.039 -15.658 -1.253 1.00 0.00 O ATOM 1797 CB LEU A 123 7.909 -12.977 -2.169 1.00 0.00 C ATOM 1798 CG LEU A 123 7.586 -13.317 -3.624 1.00 0.00 C ATOM 1799 CD1 LEU A 123 7.425 -14.819 -3.798 1.00 0.00 C ATOM 1800 CD2 LEU A 123 6.329 -12.588 -4.076 1.00 0.00 C ATOM 0 H LEU A 123 7.636 -11.837 0.028 1.00 0.00 H new ATOM 0 HA LEU A 123 5.874 -13.171 -1.505 1.00 0.00 H new ATOM 0 HB2 LEU A 123 8.045 -11.898 -2.091 1.00 0.00 H new ATOM 0 HB3 LEU A 123 8.862 -13.438 -1.912 1.00 0.00 H new ATOM 0 HG LEU A 123 8.417 -12.987 -4.247 1.00 0.00 H new ATOM 0 HD11 LEU A 123 7.195 -15.042 -4.840 1.00 0.00 H new ATOM 0 HD12 LEU A 123 8.351 -15.319 -3.515 1.00 0.00 H new ATOM 0 HD13 LEU A 123 6.613 -15.174 -3.164 1.00 0.00 H new ATOM 0 HD21 LEU A 123 6.114 -12.842 -5.114 1.00 0.00 H new ATOM 0 HD22 LEU A 123 5.489 -12.887 -3.448 1.00 0.00 H new ATOM 0 HD23 LEU A 123 6.481 -11.512 -3.990 1.00 0.00 H new ATOM 1812 N ARG A 124 8.063 -15.356 -0.317 1.00 0.00 N ATOM 1813 CA ARG A 124 8.268 -16.773 -0.042 1.00 0.00 C ATOM 1814 C ARG A 124 7.387 -17.236 1.115 1.00 0.00 C ATOM 1815 O ARG A 124 6.824 -18.330 1.081 1.00 0.00 O ATOM 1816 CB ARG A 124 9.738 -17.043 0.282 1.00 0.00 C ATOM 1817 CG ARG A 124 10.215 -16.368 1.558 1.00 0.00 C ATOM 1818 CD ARG A 124 11.733 -16.344 1.641 1.00 0.00 C ATOM 1819 NE ARG A 124 12.263 -17.527 2.313 1.00 0.00 N ATOM 1820 CZ ARG A 124 12.480 -18.685 1.699 1.00 0.00 C ATOM 1821 NH1 ARG A 124 12.214 -18.814 0.407 1.00 0.00 N ATOM 1822 NH2 ARG A 124 12.965 -19.717 2.379 1.00 0.00 N ATOM 0 H ARG A 124 8.831 -14.753 -0.022 1.00 0.00 H new ATOM 0 HA ARG A 124 7.990 -17.335 -0.934 1.00 0.00 H new ATOM 0 HB2 ARG A 124 9.890 -18.119 0.372 1.00 0.00 H new ATOM 0 HB3 ARG A 124 10.353 -16.703 -0.551 1.00 0.00 H new ATOM 0 HG2 ARG A 124 9.831 -15.349 1.597 1.00 0.00 H new ATOM 0 HG3 ARG A 124 9.810 -16.894 2.423 1.00 0.00 H new ATOM 0 HD2 ARG A 124 12.150 -16.281 0.636 1.00 0.00 H new ATOM 0 HD3 ARG A 124 12.053 -15.450 2.176 1.00 0.00 H new ATOM 0 HE ARG A 124 12.478 -17.461 3.308 1.00 0.00 H new ATOM 0 HH11 ARG A 124 11.842 -18.023 -0.119 1.00 0.00 H new ATOM 0 HH12 ARG A 124 12.382 -19.704 -0.062 1.00 0.00 H new ATOM 0 HH21 ARG A 124 13.171 -19.621 3.373 1.00 0.00 H new ATOM 0 HH22 ARG A 124 13.131 -20.606 1.907 1.00 0.00 H new ATOM 1836 N SER A 125 7.274 -16.395 2.139 1.00 0.00 N ATOM 1837 CA SER A 125 6.466 -16.719 3.308 1.00 0.00 C ATOM 1838 C SER A 125 5.024 -16.258 3.117 1.00 0.00 C ATOM 1839 O SER A 125 4.423 -15.672 4.016 1.00 0.00 O ATOM 1840 CB SER A 125 7.059 -16.070 4.560 1.00 0.00 C ATOM 1841 OG SER A 125 6.758 -14.686 4.608 1.00 0.00 O ATOM 0 H SER A 125 7.732 -15.485 2.182 1.00 0.00 H new ATOM 0 HA SER A 125 6.469 -17.802 3.432 1.00 0.00 H new ATOM 0 HB2 SER A 125 6.666 -16.562 5.450 1.00 0.00 H new ATOM 0 HB3 SER A 125 8.140 -16.211 4.569 1.00 0.00 H new ATOM 0 HG SER A 125 5.786 -14.562 4.601 1.00 0.00 H new ATOM 1847 N GLY A 126 4.474 -16.529 1.937 1.00 0.00 N ATOM 1848 CA GLY A 126 3.108 -16.135 1.647 1.00 0.00 C ATOM 1849 C GLY A 126 2.367 -17.173 0.827 1.00 0.00 C ATOM 1850 O GLY A 126 1.993 -18.236 1.323 1.00 0.00 O ATOM 0 H GLY A 126 4.950 -17.014 1.177 1.00 0.00 H new ATOM 0 HA2 GLY A 126 2.575 -15.967 2.583 1.00 0.00 H new ATOM 0 HA3 GLY A 126 3.113 -15.187 1.109 1.00 0.00 H new ATOM 1854 N PRO A 127 2.143 -16.867 -0.459 1.00 0.00 N ATOM 1855 CA PRO A 127 1.439 -17.768 -1.376 1.00 0.00 C ATOM 1856 C PRO A 127 2.258 -19.009 -1.713 1.00 0.00 C ATOM 1857 O PRO A 127 2.947 -19.052 -2.732 1.00 0.00 O ATOM 1858 CB PRO A 127 1.231 -16.909 -2.627 1.00 0.00 C ATOM 1859 CG PRO A 127 2.321 -15.896 -2.576 1.00 0.00 C ATOM 1860 CD PRO A 127 2.561 -15.617 -1.118 1.00 0.00 C ATOM 0 HA PRO A 127 0.513 -18.148 -0.943 1.00 0.00 H new ATOM 0 HB2 PRO A 127 1.291 -17.510 -3.534 1.00 0.00 H new ATOM 0 HB3 PRO A 127 0.249 -16.435 -2.623 1.00 0.00 H new ATOM 0 HG2 PRO A 127 3.225 -16.272 -3.055 1.00 0.00 H new ATOM 0 HG3 PRO A 127 2.034 -14.987 -3.105 1.00 0.00 H new ATOM 0 HD2 PRO A 127 3.608 -15.389 -0.919 1.00 0.00 H new ATOM 0 HD3 PRO A 127 1.977 -14.765 -0.770 1.00 0.00 H new ATOM 1868 N SER A 128 2.178 -20.017 -0.850 1.00 0.00 N ATOM 1869 CA SER A 128 2.916 -21.258 -1.054 1.00 0.00 C ATOM 1870 C SER A 128 2.911 -21.657 -2.527 1.00 0.00 C ATOM 1871 O SER A 128 1.854 -21.856 -3.124 1.00 0.00 O ATOM 1872 CB SER A 128 2.311 -22.380 -0.208 1.00 0.00 C ATOM 1873 OG SER A 128 2.272 -22.022 1.162 1.00 0.00 O ATOM 0 H SER A 128 1.610 -19.999 -0.003 1.00 0.00 H new ATOM 0 HA SER A 128 3.948 -21.094 -0.743 1.00 0.00 H new ATOM 0 HB2 SER A 128 1.303 -22.600 -0.558 1.00 0.00 H new ATOM 0 HB3 SER A 128 2.898 -23.290 -0.333 1.00 0.00 H new ATOM 0 HG SER A 128 1.880 -22.755 1.681 1.00 0.00 H new ATOM 1879 N SER A 129 4.102 -21.771 -3.106 1.00 0.00 N ATOM 1880 CA SER A 129 4.237 -22.142 -4.510 1.00 0.00 C ATOM 1881 C SER A 129 3.606 -23.506 -4.774 1.00 0.00 C ATOM 1882 O SER A 129 4.190 -24.543 -4.464 1.00 0.00 O ATOM 1883 CB SER A 129 5.712 -22.163 -4.914 1.00 0.00 C ATOM 1884 OG SER A 129 6.433 -23.127 -4.167 1.00 0.00 O ATOM 0 H SER A 129 4.987 -21.612 -2.625 1.00 0.00 H new ATOM 0 HA SER A 129 3.714 -21.397 -5.109 1.00 0.00 H new ATOM 0 HB2 SER A 129 5.797 -22.385 -5.978 1.00 0.00 H new ATOM 0 HB3 SER A 129 6.149 -21.177 -4.758 1.00 0.00 H new ATOM 0 HG SER A 129 5.876 -23.922 -4.035 1.00 0.00 H new ATOM 1890 N GLY A 130 2.408 -23.495 -5.351 1.00 0.00 N ATOM 1891 CA GLY A 130 1.717 -24.736 -5.648 1.00 0.00 C ATOM 1892 C GLY A 130 0.729 -24.590 -6.788 1.00 0.00 C ATOM 1893 O GLY A 130 0.978 -25.060 -7.898 1.00 0.00 O ATOM 0 H GLY A 130 1.904 -22.649 -5.618 1.00 0.00 H new ATOM 0 HA2 GLY A 130 2.448 -25.504 -5.901 1.00 0.00 H new ATOM 0 HA3 GLY A 130 1.191 -25.078 -4.757 1.00 0.00 H new TER 1897 GLY A 130