USER MOD reduce.3.24.130724 H: found=0, std=0, add=1085, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1085 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 22 GLN : amide:sc= -3.02! C(o=-3!,f=-11!) USER MOD Set 1.2: A 26 ASN : amide:sc= 0 X(o=-3,f=-3) USER MOD Set 1.3: A 102 SER OG : rot 150:sc= 0.0684 USER MOD Set 2.1: A 71 HIS : no HE2:sc= 0.772 K(o=1.8,f=-3!) USER MOD Set 2.2: A 135 THR OG1 : rot 101:sc= 1.07 USER MOD Set 3.1: A 48 HIS : no HE2:sc= -2.34! C(o=-2.3!,f=-8!) USER MOD Set 3.2: A 63 HIS :FLIP no HD1:sc= 0 F(o=-2.8,f=-2.3) USER MOD Set 4.1: A 1 ALA N :NH3+ 148:sc= 1.46 (180deg=0.995) USER MOD Set 4.2: A 153 GLN : amide:sc= 1.12 K(o=2.6,f=-11!) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 LYS NZ :NH3+ -156:sc= 1.77 (180deg=0.00562!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 GLN : amide:sc= -0.0212 X(o=-0.021,f=-0.03) USER MOD Single : A 19 ASN : amide:sc= 0.557 K(o=0.56,f=-0.88) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 180:sc= -0.0387 USER MOD Single : A 30 LYS NZ :NH3+ -148:sc= 1.24 (180deg=0.88) USER MOD Single : A 34 SER OG : rot 42:sc= 0.212 USER MOD Single : A 36 LYS NZ :NH3+ 159:sc= 1.21 (180deg=0.742) USER MOD Single : A 39 THR OG1 : rot 180:sc= -1.14 USER MOD Single : A 43 HIS : no HE2:sc= -0.0153 X(o=-0.015,f=-0.38) USER MOD Single : A 46 HIS : +bothHN:sc= 0.678 K(o=0.68,f=-9!) USER MOD Single : A 53 ASN : amide:sc= -0.825 X(o=-0.82,f=-1.2) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0.025 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= -4.81! C(o=-4.8!,f=-5.5!) USER MOD Single : A 68 SER OG : rot -136:sc= 0.935 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 HIS : +bothHN:sc= -0.94 K(o=-0.94,f=-3.9!) USER MOD Single : A 86 ASN : amide:sc= -0.922 K(o=-0.92,f=-3!) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 45:sc= 0.0202 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 170:sc= 0 USER MOD Single : A 110 HIS : no HE2:sc= 1.09 K(o=1.1,f=-5.7!) USER MOD Single : A 111 SER OG : rot 180:sc= -0.291 USER MOD Single : A 116 THR OG1 : rot 37:sc= -0.275 USER MOD Single : A 120 HIS : no HD1:sc= -0.43 K(o=-0.43,f=-2.3!) USER MOD Single : A 122 LYS NZ :NH3+ -147:sc= 1.22 (180deg=0.204!) USER MOD Single : A 128 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00739) USER MOD Single : A 131 ASN : amide:sc= -0.11 K(o=-0.11,f=-2.9!) USER MOD Single : A 134 SER OG : rot -150:sc= 0.34 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot -32:sc= 0.341 USER MOD Single : A 139 ASN : amide:sc= -0.0276 X(o=-0.028,f=0) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 6.484 -16.615 -0.040 1.00 0.00 N ATOM 2 CA ALA A 1 6.308 -16.298 -1.454 1.00 0.00 C ATOM 3 C ALA A 1 4.907 -16.664 -1.936 1.00 0.00 C ATOM 4 O ALA A 1 4.660 -16.712 -3.138 1.00 0.00 O ATOM 5 CB ALA A 1 7.356 -17.000 -2.287 1.00 0.00 C ATOM 0 H1 ALA A 1 7.474 -16.880 0.136 1.00 0.00 H new ATOM 0 H2 ALA A 1 6.241 -15.783 0.535 1.00 0.00 H new ATOM 0 H3 ALA A 1 5.862 -17.408 0.218 1.00 0.00 H new ATOM 0 HA ALA A 1 6.430 -15.221 -1.573 1.00 0.00 H new ATOM 0 HB1 ALA A 1 7.210 -16.753 -3.339 1.00 0.00 H new ATOM 0 HB2 ALA A 1 8.348 -16.676 -1.972 1.00 0.00 H new ATOM 0 HB3 ALA A 1 7.266 -18.078 -2.152 1.00 0.00 H new ATOM 13 N THR A 2 3.987 -16.869 -1.021 1.00 0.00 N ATOM 14 CA THR A 2 2.659 -17.273 -1.391 1.00 0.00 C ATOM 15 C THR A 2 1.592 -16.250 -0.942 1.00 0.00 C ATOM 16 O THR A 2 0.806 -15.764 -1.754 1.00 0.00 O ATOM 17 CB THR A 2 2.325 -18.649 -0.772 1.00 0.00 C ATOM 18 OG1 THR A 2 3.351 -19.604 -1.102 1.00 0.00 O ATOM 19 CG2 THR A 2 0.985 -19.167 -1.270 1.00 0.00 C ATOM 0 H THR A 2 4.138 -16.762 -0.018 1.00 0.00 H new ATOM 0 HA THR A 2 2.639 -17.334 -2.479 1.00 0.00 H new ATOM 0 HB THR A 2 2.272 -18.521 0.309 1.00 0.00 H new ATOM 0 HG1 THR A 2 3.131 -20.472 -0.704 1.00 0.00 H new ATOM 0 HG21 THR A 2 0.778 -20.136 -0.817 1.00 0.00 H new ATOM 0 HG22 THR A 2 0.199 -18.464 -0.997 1.00 0.00 H new ATOM 0 HG23 THR A 2 1.016 -19.273 -2.354 1.00 0.00 H new ATOM 27 N LYS A 3 1.580 -15.919 0.320 1.00 0.00 N ATOM 28 CA LYS A 3 0.496 -15.161 0.827 1.00 0.00 C ATOM 29 C LYS A 3 0.937 -14.215 1.890 1.00 0.00 C ATOM 30 O LYS A 3 1.916 -14.453 2.594 1.00 0.00 O ATOM 31 CB LYS A 3 -0.627 -16.080 1.363 1.00 0.00 C ATOM 32 CG LYS A 3 -0.231 -16.941 2.561 1.00 0.00 C ATOM 33 CD LYS A 3 -1.368 -17.855 2.996 1.00 0.00 C ATOM 34 CE LYS A 3 -0.980 -18.685 4.215 1.00 0.00 C ATOM 35 NZ LYS A 3 -0.843 -17.873 5.444 1.00 0.00 N ATOM 0 H LYS A 3 2.302 -16.163 0.998 1.00 0.00 H new ATOM 0 HA LYS A 3 0.099 -14.577 -0.003 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -1.480 -15.462 1.643 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -0.958 -16.734 0.557 1.00 0.00 H new ATOM 0 HG2 LYS A 3 0.642 -17.542 2.305 1.00 0.00 H new ATOM 0 HG3 LYS A 3 0.058 -16.298 3.392 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -2.249 -17.257 3.227 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -1.639 -18.518 2.174 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -1.732 -19.457 4.377 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -0.038 -19.195 4.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -0.213 -18.360 6.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -0.442 -16.944 5.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -1.778 -17.744 5.881 1.00 0.00 H new ATOM 49 N ALA A 4 0.206 -13.164 2.000 1.00 0.00 N ATOM 50 CA ALA A 4 0.424 -12.179 2.988 1.00 0.00 C ATOM 51 C ALA A 4 -0.921 -11.724 3.468 1.00 0.00 C ATOM 52 O ALA A 4 -1.918 -11.956 2.788 1.00 0.00 O ATOM 53 CB ALA A 4 1.231 -11.019 2.442 1.00 0.00 C ATOM 0 H ALA A 4 -0.583 -12.963 1.385 1.00 0.00 H new ATOM 0 HA ALA A 4 1.003 -12.594 3.813 1.00 0.00 H new ATOM 0 HB1 ALA A 4 1.381 -10.278 3.228 1.00 0.00 H new ATOM 0 HB2 ALA A 4 2.199 -11.381 2.095 1.00 0.00 H new ATOM 0 HB3 ALA A 4 0.695 -10.562 1.610 1.00 0.00 H new ATOM 59 N VAL A 5 -0.971 -11.117 4.610 1.00 0.00 N ATOM 60 CA VAL A 5 -2.216 -10.673 5.169 1.00 0.00 C ATOM 61 C VAL A 5 -2.073 -9.232 5.615 1.00 0.00 C ATOM 62 O VAL A 5 -1.163 -8.894 6.376 1.00 0.00 O ATOM 63 CB VAL A 5 -2.678 -11.558 6.375 1.00 0.00 C ATOM 64 CG1 VAL A 5 -4.000 -11.054 6.949 1.00 0.00 C ATOM 65 CG2 VAL A 5 -2.823 -13.019 5.965 1.00 0.00 C ATOM 0 H VAL A 5 -0.153 -10.913 5.184 1.00 0.00 H new ATOM 0 HA VAL A 5 -2.979 -10.760 4.396 1.00 0.00 H new ATOM 0 HB VAL A 5 -1.908 -11.485 7.143 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -4.298 -11.686 7.785 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -3.879 -10.028 7.295 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -4.768 -11.088 6.177 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -3.145 -13.608 6.824 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -3.564 -13.102 5.170 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -1.864 -13.393 5.607 1.00 0.00 H new ATOM 75 N ALA A 6 -2.906 -8.398 5.086 1.00 0.00 N ATOM 76 CA ALA A 6 -2.971 -7.011 5.468 1.00 0.00 C ATOM 77 C ALA A 6 -4.320 -6.755 6.104 1.00 0.00 C ATOM 78 O ALA A 6 -5.343 -7.120 5.525 1.00 0.00 O ATOM 79 CB ALA A 6 -2.779 -6.123 4.250 1.00 0.00 C ATOM 0 H ALA A 6 -3.576 -8.658 4.362 1.00 0.00 H new ATOM 0 HA ALA A 6 -2.178 -6.780 6.180 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -2.830 -5.077 4.551 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -1.806 -6.325 3.802 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -3.563 -6.330 3.522 1.00 0.00 H new ATOM 85 N VAL A 7 -4.323 -6.175 7.290 1.00 0.00 N ATOM 86 CA VAL A 7 -5.549 -5.904 8.013 1.00 0.00 C ATOM 87 C VAL A 7 -5.781 -4.411 8.126 1.00 0.00 C ATOM 88 O VAL A 7 -4.830 -3.639 8.217 1.00 0.00 O ATOM 89 CB VAL A 7 -5.558 -6.558 9.425 1.00 0.00 C ATOM 90 CG1 VAL A 7 -5.521 -8.070 9.305 1.00 0.00 C ATOM 91 CG2 VAL A 7 -4.384 -6.073 10.271 1.00 0.00 C ATOM 0 H VAL A 7 -3.477 -5.880 7.777 1.00 0.00 H new ATOM 0 HA VAL A 7 -6.362 -6.351 7.442 1.00 0.00 H new ATOM 0 HB VAL A 7 -6.480 -6.260 9.924 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -5.528 -8.514 10.300 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -6.394 -8.412 8.749 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -4.615 -8.371 8.779 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -4.420 -6.549 11.251 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -3.448 -6.332 9.776 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -4.444 -4.991 10.391 1.00 0.00 H new ATOM 101 N LEU A 8 -7.023 -4.012 8.071 1.00 0.00 N ATOM 102 CA LEU A 8 -7.385 -2.611 8.148 1.00 0.00 C ATOM 103 C LEU A 8 -8.428 -2.358 9.233 1.00 0.00 C ATOM 104 O LEU A 8 -9.416 -3.108 9.359 1.00 0.00 O ATOM 105 CB LEU A 8 -7.899 -2.120 6.789 1.00 0.00 C ATOM 106 CG LEU A 8 -6.889 -2.144 5.637 1.00 0.00 C ATOM 107 CD1 LEU A 8 -7.565 -1.797 4.330 1.00 0.00 C ATOM 108 CD2 LEU A 8 -5.754 -1.170 5.907 1.00 0.00 C ATOM 0 H LEU A 8 -7.817 -4.644 7.972 1.00 0.00 H new ATOM 0 HA LEU A 8 -6.489 -2.050 8.414 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -8.757 -2.730 6.506 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -8.260 -1.098 6.908 1.00 0.00 H new ATOM 0 HG LEU A 8 -6.480 -3.152 5.563 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -6.832 -1.819 3.524 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -8.353 -2.522 4.124 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -7.999 -0.799 4.398 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -5.045 -1.199 5.080 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -6.156 -0.162 6.006 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -5.246 -1.450 6.830 1.00 0.00 H new ATOM 120 N LYS A 9 -8.204 -1.316 10.010 1.00 0.00 N ATOM 121 CA LYS A 9 -9.095 -0.865 11.056 1.00 0.00 C ATOM 122 C LYS A 9 -9.083 0.642 11.020 1.00 0.00 C ATOM 123 O LYS A 9 -8.007 1.241 11.067 1.00 0.00 O ATOM 124 CB LYS A 9 -8.601 -1.312 12.435 1.00 0.00 C ATOM 125 CG LYS A 9 -8.501 -2.809 12.643 1.00 0.00 C ATOM 126 CD LYS A 9 -8.019 -3.104 14.044 1.00 0.00 C ATOM 127 CE LYS A 9 -8.005 -4.582 14.337 1.00 0.00 C ATOM 128 NZ LYS A 9 -7.677 -4.845 15.750 1.00 0.00 N ATOM 0 H LYS A 9 -7.366 -0.741 9.925 1.00 0.00 H new ATOM 0 HA LYS A 9 -10.090 -1.281 10.895 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -7.618 -0.873 12.609 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -9.271 -0.903 13.191 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -9.473 -3.273 12.479 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -7.814 -3.241 11.915 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -7.016 -2.699 14.175 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -8.663 -2.598 14.763 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -8.979 -5.011 14.102 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -7.276 -5.075 13.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -7.675 -5.871 15.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -6.737 -4.456 15.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -8.387 -4.394 16.361 1.00 0.00 H new ATOM 142 N GLY A 10 -10.227 1.259 10.917 1.00 0.00 N ATOM 143 CA GLY A 10 -10.240 2.690 10.864 1.00 0.00 C ATOM 144 C GLY A 10 -11.521 3.289 11.349 1.00 0.00 C ATOM 145 O GLY A 10 -12.452 2.566 11.734 1.00 0.00 O ATOM 0 H GLY A 10 -11.140 0.806 10.869 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -9.416 3.076 11.464 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -10.063 3.010 9.837 1.00 0.00 H new ATOM 149 N ASP A 11 -11.556 4.611 11.344 1.00 0.00 N ATOM 150 CA ASP A 11 -12.739 5.373 11.720 1.00 0.00 C ATOM 151 C ASP A 11 -13.750 5.239 10.600 1.00 0.00 C ATOM 152 O ASP A 11 -14.944 5.095 10.832 1.00 0.00 O ATOM 153 CB ASP A 11 -12.395 6.853 11.939 1.00 0.00 C ATOM 154 CG ASP A 11 -11.260 7.067 12.919 1.00 0.00 C ATOM 155 OD1 ASP A 11 -11.498 7.177 14.154 1.00 0.00 O ATOM 156 OD2 ASP A 11 -10.105 7.156 12.483 1.00 0.00 O ATOM 0 H ASP A 11 -10.760 5.191 11.078 1.00 0.00 H new ATOM 0 HA ASP A 11 -13.143 4.987 12.656 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -12.129 7.302 10.982 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -13.281 7.375 12.301 1.00 0.00 H new ATOM 161 N GLY A 12 -13.248 5.292 9.383 1.00 0.00 N ATOM 162 CA GLY A 12 -14.029 4.984 8.220 1.00 0.00 C ATOM 163 C GLY A 12 -13.659 3.579 7.827 1.00 0.00 C ATOM 164 O GLY A 12 -12.633 3.382 7.183 1.00 0.00 O ATOM 0 H GLY A 12 -12.283 5.552 9.180 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -15.095 5.060 8.435 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -13.816 5.683 7.412 1.00 0.00 H new ATOM 168 N PRO A 13 -14.430 2.571 8.257 1.00 0.00 N ATOM 169 CA PRO A 13 -14.027 1.188 8.120 1.00 0.00 C ATOM 170 C PRO A 13 -14.016 0.653 6.691 1.00 0.00 C ATOM 171 O PRO A 13 -15.004 0.740 5.945 1.00 0.00 O ATOM 172 CB PRO A 13 -15.029 0.420 8.990 1.00 0.00 C ATOM 173 CG PRO A 13 -16.242 1.279 9.029 1.00 0.00 C ATOM 174 CD PRO A 13 -15.766 2.702 8.881 1.00 0.00 C ATOM 0 HA PRO A 13 -12.988 1.071 8.428 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -15.252 -0.559 8.565 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -14.633 0.250 9.991 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -16.930 1.015 8.226 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -16.781 1.146 9.967 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -16.442 3.286 8.257 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -15.708 3.206 9.846 1.00 0.00 H new ATOM 182 N VAL A 14 -12.896 0.095 6.349 1.00 0.00 N ATOM 183 CA VAL A 14 -12.654 -0.605 5.143 1.00 0.00 C ATOM 184 C VAL A 14 -12.178 -1.968 5.579 1.00 0.00 C ATOM 185 O VAL A 14 -11.168 -2.091 6.280 1.00 0.00 O ATOM 186 CB VAL A 14 -11.591 0.113 4.234 1.00 0.00 C ATOM 187 CG1 VAL A 14 -12.169 1.374 3.650 1.00 0.00 C ATOM 188 CG2 VAL A 14 -10.332 0.470 5.010 1.00 0.00 C ATOM 0 H VAL A 14 -12.075 0.124 6.953 1.00 0.00 H new ATOM 0 HA VAL A 14 -13.552 -0.657 4.527 1.00 0.00 H new ATOM 0 HB VAL A 14 -11.327 -0.585 3.440 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -11.422 1.860 3.023 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -13.044 1.128 3.048 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -12.461 2.048 4.456 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.623 0.964 4.346 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -10.588 1.140 5.831 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -9.882 -0.438 5.410 1.00 0.00 H new ATOM 198 N GLN A 15 -12.919 -2.970 5.292 1.00 0.00 N ATOM 199 CA GLN A 15 -12.553 -4.258 5.810 1.00 0.00 C ATOM 200 C GLN A 15 -12.200 -5.178 4.670 1.00 0.00 C ATOM 201 O GLN A 15 -13.031 -5.441 3.783 1.00 0.00 O ATOM 202 CB GLN A 15 -13.707 -4.819 6.656 1.00 0.00 C ATOM 203 CG GLN A 15 -13.275 -5.631 7.883 1.00 0.00 C ATOM 204 CD GLN A 15 -12.449 -6.853 7.557 1.00 0.00 C ATOM 205 OE1 GLN A 15 -11.226 -6.792 7.498 1.00 0.00 O ATOM 206 NE2 GLN A 15 -13.101 -7.953 7.344 1.00 0.00 N ATOM 0 H GLN A 15 -13.762 -2.942 4.719 1.00 0.00 H new ATOM 0 HA GLN A 15 -11.678 -4.169 6.453 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -14.330 -3.989 6.989 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -14.329 -5.450 6.022 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -12.702 -4.986 8.548 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -14.165 -5.943 8.430 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -14.119 -7.962 7.403 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -12.596 -8.810 7.118 1.00 0.00 H new ATOM 215 N GLY A 16 -10.976 -5.628 4.665 1.00 0.00 N ATOM 216 CA GLY A 16 -10.536 -6.524 3.667 1.00 0.00 C ATOM 217 C GLY A 16 -9.185 -7.057 3.960 1.00 0.00 C ATOM 218 O GLY A 16 -8.526 -6.578 4.880 1.00 0.00 O ATOM 0 H GLY A 16 -10.268 -5.377 5.355 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -11.242 -7.350 3.584 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -10.525 -6.016 2.703 1.00 0.00 H new ATOM 222 N ILE A 17 -8.756 -8.029 3.182 1.00 0.00 N ATOM 223 CA ILE A 17 -7.471 -8.638 3.364 1.00 0.00 C ATOM 224 C ILE A 17 -6.809 -8.731 2.025 1.00 0.00 C ATOM 225 O ILE A 17 -7.407 -9.244 1.058 1.00 0.00 O ATOM 226 CB ILE A 17 -7.531 -10.047 4.044 1.00 0.00 C ATOM 227 CG1 ILE A 17 -8.528 -10.981 3.323 1.00 0.00 C ATOM 228 CG2 ILE A 17 -7.861 -9.924 5.532 1.00 0.00 C ATOM 229 CD1 ILE A 17 -8.546 -12.397 3.857 1.00 0.00 C ATOM 0 H ILE A 17 -9.295 -8.414 2.407 1.00 0.00 H new ATOM 0 HA ILE A 17 -6.898 -8.012 4.048 1.00 0.00 H new ATOM 0 HB ILE A 17 -6.543 -10.498 3.957 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -9.530 -10.560 3.407 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -8.282 -11.008 2.262 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -7.897 -10.917 5.980 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -7.093 -9.330 6.027 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -8.829 -9.437 5.651 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -9.271 -12.988 3.298 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -7.556 -12.840 3.748 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -8.824 -12.385 4.911 1.00 0.00 H new ATOM 241 N ILE A 18 -5.638 -8.182 1.933 1.00 0.00 N ATOM 242 CA ILE A 18 -4.910 -8.177 0.698 1.00 0.00 C ATOM 243 C ILE A 18 -3.673 -9.026 0.881 1.00 0.00 C ATOM 244 O ILE A 18 -3.054 -9.002 1.949 1.00 0.00 O ATOM 245 CB ILE A 18 -4.476 -6.732 0.214 1.00 0.00 C ATOM 246 CG1 ILE A 18 -5.607 -5.675 0.319 1.00 0.00 C ATOM 247 CG2 ILE A 18 -3.978 -6.781 -1.231 1.00 0.00 C ATOM 248 CD1 ILE A 18 -5.839 -5.124 1.718 1.00 0.00 C ATOM 0 H ILE A 18 -5.159 -7.725 2.709 1.00 0.00 H new ATOM 0 HA ILE A 18 -5.574 -8.571 -0.071 1.00 0.00 H new ATOM 0 HB ILE A 18 -3.678 -6.422 0.888 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -5.373 -4.846 -0.348 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -6.535 -6.120 -0.039 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -3.684 -5.781 -1.549 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -3.120 -7.450 -1.298 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -4.775 -7.147 -1.878 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -6.647 -4.393 1.692 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -6.108 -5.939 2.390 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -4.928 -4.645 2.076 1.00 0.00 H new ATOM 260 N ASN A 19 -3.344 -9.788 -0.125 1.00 0.00 N ATOM 261 CA ASN A 19 -2.172 -10.638 -0.113 1.00 0.00 C ATOM 262 C ASN A 19 -1.093 -9.920 -0.867 1.00 0.00 C ATOM 263 O ASN A 19 -1.421 -9.105 -1.710 1.00 0.00 O ATOM 264 CB ASN A 19 -2.477 -11.966 -0.832 1.00 0.00 C ATOM 265 CG ASN A 19 -3.471 -12.861 -0.116 1.00 0.00 C ATOM 266 OD1 ASN A 19 -3.083 -13.724 0.672 1.00 0.00 O ATOM 267 ND2 ASN A 19 -4.753 -12.679 -0.384 1.00 0.00 N ATOM 0 H ASN A 19 -3.884 -9.841 -0.989 1.00 0.00 H new ATOM 0 HA ASN A 19 -1.870 -10.852 0.912 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -2.860 -11.744 -1.828 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -1.544 -12.515 -0.964 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -5.456 -13.263 0.068 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -5.038 -11.954 -1.042 1.00 0.00 H new ATOM 274 N PHE A 20 0.182 -10.135 -0.537 1.00 0.00 N ATOM 275 CA PHE A 20 1.276 -9.533 -1.307 1.00 0.00 C ATOM 276 C PHE A 20 2.447 -10.454 -1.242 1.00 0.00 C ATOM 277 O PHE A 20 2.953 -10.664 -0.152 1.00 0.00 O ATOM 278 CB PHE A 20 1.731 -8.174 -0.707 1.00 0.00 C ATOM 279 CG PHE A 20 0.725 -7.054 -0.721 1.00 0.00 C ATOM 280 CD1 PHE A 20 0.591 -6.244 -1.834 1.00 0.00 C ATOM 281 CD2 PHE A 20 -0.061 -6.795 0.388 1.00 0.00 C ATOM 282 CE1 PHE A 20 -0.310 -5.202 -1.845 1.00 0.00 C ATOM 283 CE2 PHE A 20 -0.961 -5.751 0.385 1.00 0.00 C ATOM 284 CZ PHE A 20 -1.084 -4.951 -0.733 1.00 0.00 C ATOM 0 H PHE A 20 0.482 -10.714 0.248 1.00 0.00 H new ATOM 0 HA PHE A 20 0.922 -9.370 -2.325 1.00 0.00 H new ATOM 0 HB2 PHE A 20 2.036 -8.344 0.326 1.00 0.00 H new ATOM 0 HB3 PHE A 20 2.616 -7.842 -1.250 1.00 0.00 H new ATOM 0 HD1 PHE A 20 1.201 -6.431 -2.706 1.00 0.00 H new ATOM 0 HD2 PHE A 20 0.032 -7.418 1.266 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -0.410 -4.583 -2.724 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -1.569 -5.559 1.257 1.00 0.00 H new ATOM 0 HZ PHE A 20 -1.786 -4.130 -0.736 1.00 0.00 H new ATOM 294 N GLU A 21 2.909 -11.001 -2.350 1.00 0.00 N ATOM 295 CA GLU A 21 4.111 -11.770 -2.284 1.00 0.00 C ATOM 296 C GLU A 21 5.054 -11.443 -3.373 1.00 0.00 C ATOM 297 O GLU A 21 4.650 -11.062 -4.478 1.00 0.00 O ATOM 298 CB GLU A 21 3.827 -13.238 -2.161 1.00 0.00 C ATOM 299 CG GLU A 21 3.479 -13.619 -0.751 1.00 0.00 C ATOM 300 CD GLU A 21 4.689 -13.731 0.136 1.00 0.00 C ATOM 301 OE1 GLU A 21 5.523 -12.806 0.180 1.00 0.00 O ATOM 302 OE2 GLU A 21 4.849 -14.788 0.761 1.00 0.00 O ATOM 0 H GLU A 21 2.479 -10.925 -3.272 1.00 0.00 H new ATOM 0 HA GLU A 21 4.624 -11.484 -1.366 1.00 0.00 H new ATOM 0 HB2 GLU A 21 3.005 -13.507 -2.824 1.00 0.00 H new ATOM 0 HB3 GLU A 21 4.698 -13.806 -2.487 1.00 0.00 H new ATOM 0 HG2 GLU A 21 2.797 -12.877 -0.336 1.00 0.00 H new ATOM 0 HG3 GLU A 21 2.948 -14.571 -0.757 1.00 0.00 H new ATOM 309 N GLN A 22 6.289 -11.479 -3.048 1.00 0.00 N ATOM 310 CA GLN A 22 7.286 -11.148 -3.983 1.00 0.00 C ATOM 311 C GLN A 22 8.303 -12.224 -4.057 1.00 0.00 C ATOM 312 O GLN A 22 8.525 -12.979 -3.112 1.00 0.00 O ATOM 313 CB GLN A 22 7.957 -9.858 -3.558 1.00 0.00 C ATOM 314 CG GLN A 22 8.893 -9.189 -4.585 1.00 0.00 C ATOM 315 CD GLN A 22 8.267 -8.962 -5.962 1.00 0.00 C ATOM 316 OE1 GLN A 22 7.584 -7.976 -6.187 1.00 0.00 O ATOM 317 NE2 GLN A 22 8.639 -9.760 -6.919 1.00 0.00 N ATOM 0 H GLN A 22 6.636 -11.739 -2.125 1.00 0.00 H new ATOM 0 HA GLN A 22 6.826 -11.028 -4.964 1.00 0.00 H new ATOM 0 HB2 GLN A 22 7.179 -9.143 -3.291 1.00 0.00 H new ATOM 0 HB3 GLN A 22 8.532 -10.056 -2.653 1.00 0.00 H new ATOM 0 HG2 GLN A 22 9.221 -8.229 -4.187 1.00 0.00 H new ATOM 0 HG3 GLN A 22 9.783 -9.807 -4.702 1.00 0.00 H new ATOM 0 HE21 GLN A 22 9.210 -10.578 -6.708 1.00 0.00 H new ATOM 0 HE22 GLN A 22 8.360 -9.567 -7.881 1.00 0.00 H new ATOM 326 N LYS A 23 8.876 -12.293 -5.177 1.00 0.00 N ATOM 327 CA LYS A 23 10.010 -13.075 -5.426 1.00 0.00 C ATOM 328 C LYS A 23 11.067 -12.005 -5.518 1.00 0.00 C ATOM 329 O LYS A 23 11.057 -11.226 -6.475 1.00 0.00 O ATOM 330 CB LYS A 23 9.822 -13.807 -6.755 1.00 0.00 C ATOM 331 CG LYS A 23 10.847 -14.872 -7.069 1.00 0.00 C ATOM 332 CD LYS A 23 10.518 -15.527 -8.399 1.00 0.00 C ATOM 333 CE LYS A 23 11.461 -16.663 -8.719 1.00 0.00 C ATOM 334 NZ LYS A 23 11.180 -17.239 -10.048 1.00 0.00 N ATOM 0 H LYS A 23 8.552 -11.778 -5.996 1.00 0.00 H new ATOM 0 HA LYS A 23 10.236 -13.847 -4.691 1.00 0.00 H new ATOM 0 HB2 LYS A 23 8.834 -14.268 -6.758 1.00 0.00 H new ATOM 0 HB3 LYS A 23 9.833 -13.071 -7.559 1.00 0.00 H new ATOM 0 HG2 LYS A 23 11.843 -14.431 -7.107 1.00 0.00 H new ATOM 0 HG3 LYS A 23 10.860 -15.621 -6.278 1.00 0.00 H new ATOM 0 HD2 LYS A 23 9.494 -15.901 -8.375 1.00 0.00 H new ATOM 0 HD3 LYS A 23 10.567 -14.781 -9.192 1.00 0.00 H new ATOM 0 HE2 LYS A 23 12.490 -16.304 -8.687 1.00 0.00 H new ATOM 0 HE3 LYS A 23 11.370 -17.438 -7.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 11.845 -18.016 -10.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 10.206 -17.603 -10.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 11.291 -16.504 -10.775 1.00 0.00 H new ATOM 348 N GLU A 24 11.882 -11.876 -4.484 1.00 0.00 N ATOM 349 CA GLU A 24 12.779 -10.722 -4.331 1.00 0.00 C ATOM 350 C GLU A 24 13.850 -10.554 -5.399 1.00 0.00 C ATOM 351 O GLU A 24 14.543 -9.537 -5.428 1.00 0.00 O ATOM 352 CB GLU A 24 13.293 -10.531 -2.897 1.00 0.00 C ATOM 353 CG GLU A 24 13.937 -11.740 -2.259 1.00 0.00 C ATOM 354 CD GLU A 24 14.365 -11.448 -0.843 1.00 0.00 C ATOM 355 OE1 GLU A 24 13.506 -11.429 0.066 1.00 0.00 O ATOM 356 OE2 GLU A 24 15.559 -11.204 -0.610 1.00 0.00 O ATOM 0 H GLU A 24 11.947 -12.557 -3.728 1.00 0.00 H new ATOM 0 HA GLU A 24 12.121 -9.876 -4.528 1.00 0.00 H new ATOM 0 HB2 GLU A 24 14.017 -9.716 -2.897 1.00 0.00 H new ATOM 0 HB3 GLU A 24 12.458 -10.216 -2.271 1.00 0.00 H new ATOM 0 HG2 GLU A 24 13.235 -12.574 -2.265 1.00 0.00 H new ATOM 0 HG3 GLU A 24 14.802 -12.047 -2.847 1.00 0.00 H new ATOM 363 N SER A 25 14.000 -11.535 -6.242 1.00 0.00 N ATOM 364 CA SER A 25 14.826 -11.408 -7.397 1.00 0.00 C ATOM 365 C SER A 25 14.043 -10.569 -8.428 1.00 0.00 C ATOM 366 O SER A 25 14.449 -9.467 -8.811 1.00 0.00 O ATOM 367 CB SER A 25 15.114 -12.811 -7.913 1.00 0.00 C ATOM 368 OG SER A 25 13.910 -13.593 -7.912 1.00 0.00 O ATOM 0 H SER A 25 13.550 -12.445 -6.143 1.00 0.00 H new ATOM 0 HA SER A 25 15.775 -10.914 -7.189 1.00 0.00 H new ATOM 0 HB2 SER A 25 15.523 -12.759 -8.922 1.00 0.00 H new ATOM 0 HB3 SER A 25 15.868 -13.289 -7.288 1.00 0.00 H new ATOM 0 HG SER A 25 14.104 -14.493 -8.247 1.00 0.00 H new ATOM 374 N ASN A 26 12.903 -11.114 -8.813 1.00 0.00 N ATOM 375 CA ASN A 26 11.902 -10.506 -9.681 1.00 0.00 C ATOM 376 C ASN A 26 10.839 -11.553 -9.917 1.00 0.00 C ATOM 377 O ASN A 26 11.169 -12.722 -10.107 1.00 0.00 O ATOM 378 CB ASN A 26 12.484 -10.046 -11.034 1.00 0.00 C ATOM 379 CG ASN A 26 11.443 -9.365 -11.914 1.00 0.00 C ATOM 380 OD1 ASN A 26 10.769 -10.010 -12.729 1.00 0.00 O ATOM 381 ND2 ASN A 26 11.280 -8.074 -11.747 1.00 0.00 N ATOM 0 H ASN A 26 12.632 -12.050 -8.511 1.00 0.00 H new ATOM 0 HA ASN A 26 11.506 -9.612 -9.199 1.00 0.00 H new ATOM 0 HB2 ASN A 26 13.311 -9.358 -10.856 1.00 0.00 H new ATOM 0 HB3 ASN A 26 12.894 -10.907 -11.561 1.00 0.00 H new ATOM 0 HD21 ASN A 26 10.582 -7.573 -12.297 1.00 0.00 H new ATOM 0 HD22 ASN A 26 11.851 -7.572 -11.067 1.00 0.00 H new ATOM 388 N GLY A 27 9.591 -11.177 -9.856 1.00 0.00 N ATOM 389 CA GLY A 27 8.530 -12.149 -10.072 1.00 0.00 C ATOM 390 C GLY A 27 7.352 -11.761 -9.332 1.00 0.00 C ATOM 391 O GLY A 27 7.266 -12.040 -8.129 1.00 0.00 O ATOM 0 H GLY A 27 9.277 -10.226 -9.663 1.00 0.00 H new ATOM 0 HA2 GLY A 27 8.297 -12.216 -11.135 1.00 0.00 H new ATOM 0 HA3 GLY A 27 8.860 -13.138 -9.755 1.00 0.00 H new ATOM 395 N PRO A 28 6.433 -11.075 -9.977 1.00 0.00 N ATOM 396 CA PRO A 28 5.246 -10.632 -9.336 1.00 0.00 C ATOM 397 C PRO A 28 4.461 -11.818 -8.884 1.00 0.00 C ATOM 398 O PRO A 28 4.163 -12.718 -9.680 1.00 0.00 O ATOM 399 CB PRO A 28 4.467 -9.929 -10.451 1.00 0.00 C ATOM 400 CG PRO A 28 5.468 -9.615 -11.488 1.00 0.00 C ATOM 401 CD PRO A 28 6.467 -10.709 -11.406 1.00 0.00 C ATOM 0 HA PRO A 28 5.442 -9.995 -8.473 1.00 0.00 H new ATOM 0 HB2 PRO A 28 3.680 -10.571 -10.846 1.00 0.00 H new ATOM 0 HB3 PRO A 28 3.985 -9.023 -10.083 1.00 0.00 H new ATOM 0 HG2 PRO A 28 5.011 -9.572 -12.477 1.00 0.00 H new ATOM 0 HG3 PRO A 28 5.931 -8.645 -11.308 1.00 0.00 H new ATOM 0 HD2 PRO A 28 6.199 -11.550 -12.046 1.00 0.00 H new ATOM 0 HD3 PRO A 28 7.458 -10.376 -11.715 1.00 0.00 H new ATOM 409 N VAL A 29 4.173 -11.878 -7.637 1.00 0.00 N ATOM 410 CA VAL A 29 3.298 -12.878 -7.198 1.00 0.00 C ATOM 411 C VAL A 29 1.957 -12.261 -7.331 1.00 0.00 C ATOM 412 O VAL A 29 1.808 -11.036 -7.223 1.00 0.00 O ATOM 413 CB VAL A 29 3.599 -13.450 -5.772 1.00 0.00 C ATOM 414 CG1 VAL A 29 2.584 -14.523 -5.363 1.00 0.00 C ATOM 415 CG2 VAL A 29 5.005 -14.050 -5.740 1.00 0.00 C ATOM 0 H VAL A 29 4.529 -11.251 -6.916 1.00 0.00 H new ATOM 0 HA VAL A 29 3.401 -13.782 -7.797 1.00 0.00 H new ATOM 0 HB VAL A 29 3.525 -12.624 -5.064 1.00 0.00 H new ATOM 0 HG11 VAL A 29 2.828 -14.894 -4.368 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.583 -14.092 -5.354 1.00 0.00 H new ATOM 0 HG13 VAL A 29 2.618 -15.347 -6.076 1.00 0.00 H new ATOM 0 HG21 VAL A 29 5.209 -14.446 -4.745 1.00 0.00 H new ATOM 0 HG22 VAL A 29 5.074 -14.854 -6.472 1.00 0.00 H new ATOM 0 HG23 VAL A 29 5.736 -13.278 -5.979 1.00 0.00 H new ATOM 425 N LYS A 30 1.033 -13.046 -7.602 1.00 0.00 N ATOM 426 CA LYS A 30 -0.224 -12.582 -8.016 1.00 0.00 C ATOM 427 C LYS A 30 -1.113 -12.616 -6.857 1.00 0.00 C ATOM 428 O LYS A 30 -1.467 -13.687 -6.355 1.00 0.00 O ATOM 429 CB LYS A 30 -0.784 -13.395 -9.174 1.00 0.00 C ATOM 430 CG LYS A 30 0.001 -13.323 -10.455 1.00 0.00 C ATOM 431 CD LYS A 30 1.221 -14.228 -10.443 1.00 0.00 C ATOM 432 CE LYS A 30 2.127 -13.977 -11.647 1.00 0.00 C ATOM 433 NZ LYS A 30 1.397 -14.008 -12.923 1.00 0.00 N ATOM 0 H LYS A 30 1.112 -14.061 -7.547 1.00 0.00 H new ATOM 0 HA LYS A 30 -0.132 -11.563 -8.392 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -0.847 -14.438 -8.865 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -1.802 -13.059 -9.373 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -0.644 -13.600 -11.289 1.00 0.00 H new ATOM 0 HG3 LYS A 30 0.318 -12.294 -10.626 1.00 0.00 H new ATOM 0 HD2 LYS A 30 1.785 -14.066 -9.524 1.00 0.00 H new ATOM 0 HD3 LYS A 30 0.900 -15.270 -10.441 1.00 0.00 H new ATOM 0 HE2 LYS A 30 2.613 -13.008 -11.535 1.00 0.00 H new ATOM 0 HE3 LYS A 30 2.916 -14.729 -11.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 2.022 -14.370 -13.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 0.568 -14.629 -12.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 1.085 -13.047 -13.168 1.00 0.00 H new ATOM 447 N VAL A 31 -1.429 -11.476 -6.397 1.00 0.00 N ATOM 448 CA VAL A 31 -2.093 -11.334 -5.170 1.00 0.00 C ATOM 449 C VAL A 31 -3.363 -10.560 -5.305 1.00 0.00 C ATOM 450 O VAL A 31 -3.527 -9.752 -6.200 1.00 0.00 O ATOM 451 CB VAL A 31 -1.161 -10.705 -4.140 1.00 0.00 C ATOM 452 CG1 VAL A 31 -0.063 -11.703 -3.773 1.00 0.00 C ATOM 453 CG2 VAL A 31 -0.533 -9.422 -4.705 1.00 0.00 C ATOM 0 H VAL A 31 -1.230 -10.596 -6.872 1.00 0.00 H new ATOM 0 HA VAL A 31 -2.374 -12.328 -4.823 1.00 0.00 H new ATOM 0 HB VAL A 31 -1.734 -10.449 -3.248 1.00 0.00 H new ATOM 0 HG11 VAL A 31 0.604 -11.255 -3.037 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -0.514 -12.603 -3.354 1.00 0.00 H new ATOM 0 HG13 VAL A 31 0.505 -11.964 -4.666 1.00 0.00 H new ATOM 0 HG21 VAL A 31 0.130 -8.983 -3.960 1.00 0.00 H new ATOM 0 HG22 VAL A 31 0.037 -9.661 -5.603 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -1.320 -8.711 -4.954 1.00 0.00 H new ATOM 463 N TRP A 32 -4.252 -10.837 -4.446 1.00 0.00 N ATOM 464 CA TRP A 32 -5.541 -10.257 -4.494 1.00 0.00 C ATOM 465 C TRP A 32 -5.947 -9.792 -3.106 1.00 0.00 C ATOM 466 O TRP A 32 -5.427 -10.310 -2.089 1.00 0.00 O ATOM 467 CB TRP A 32 -6.532 -11.289 -5.057 1.00 0.00 C ATOM 468 CG TRP A 32 -6.587 -12.585 -4.272 1.00 0.00 C ATOM 469 CD1 TRP A 32 -7.434 -12.892 -3.245 1.00 0.00 C ATOM 470 CD2 TRP A 32 -5.754 -13.735 -4.452 1.00 0.00 C ATOM 471 NE1 TRP A 32 -7.179 -14.155 -2.784 1.00 0.00 N ATOM 472 CE2 TRP A 32 -6.156 -14.694 -3.506 1.00 0.00 C ATOM 473 CE3 TRP A 32 -4.711 -14.049 -5.323 1.00 0.00 C ATOM 474 CZ2 TRP A 32 -5.550 -15.935 -3.406 1.00 0.00 C ATOM 475 CZ3 TRP A 32 -4.114 -15.283 -5.217 1.00 0.00 C ATOM 476 CH2 TRP A 32 -4.536 -16.208 -4.268 1.00 0.00 C ATOM 0 H TRP A 32 -4.111 -11.485 -3.671 1.00 0.00 H new ATOM 0 HA TRP A 32 -5.541 -9.385 -5.148 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -7.528 -10.847 -5.078 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -6.261 -11.513 -6.089 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -8.195 -12.233 -2.853 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -7.675 -14.619 -2.023 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -4.379 -13.338 -6.065 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -5.871 -16.658 -2.671 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -3.303 -15.539 -5.883 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -4.045 -17.168 -4.215 1.00 0.00 H new ATOM 487 N GLY A 33 -6.809 -8.815 -3.060 1.00 0.00 N ATOM 488 CA GLY A 33 -7.331 -8.315 -1.843 1.00 0.00 C ATOM 489 C GLY A 33 -8.605 -7.593 -2.114 1.00 0.00 C ATOM 490 O GLY A 33 -8.728 -6.956 -3.152 1.00 0.00 O ATOM 0 H GLY A 33 -7.168 -8.343 -3.890 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -7.505 -9.134 -1.145 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -6.612 -7.644 -1.374 1.00 0.00 H new ATOM 494 N SER A 34 -9.559 -7.768 -1.246 1.00 0.00 N ATOM 495 CA SER A 34 -10.854 -7.171 -1.350 1.00 0.00 C ATOM 496 C SER A 34 -11.112 -6.214 -0.183 1.00 0.00 C ATOM 497 O SER A 34 -11.155 -6.667 0.931 1.00 0.00 O ATOM 498 CB SER A 34 -11.848 -8.313 -1.373 1.00 0.00 C ATOM 499 OG SER A 34 -11.549 -9.258 -0.327 1.00 0.00 O ATOM 0 H SER A 34 -9.450 -8.352 -0.417 1.00 0.00 H new ATOM 0 HA SER A 34 -10.943 -6.568 -2.254 1.00 0.00 H new ATOM 0 HB2 SER A 34 -12.859 -7.927 -1.245 1.00 0.00 H new ATOM 0 HB3 SER A 34 -11.817 -8.811 -2.342 1.00 0.00 H new ATOM 0 HG SER A 34 -11.318 -8.775 0.494 1.00 0.00 H new ATOM 505 N ILE A 35 -11.253 -4.920 -0.416 1.00 0.00 N ATOM 506 CA ILE A 35 -11.607 -3.990 0.683 1.00 0.00 C ATOM 507 C ILE A 35 -12.805 -3.119 0.294 1.00 0.00 C ATOM 508 O ILE A 35 -12.787 -2.471 -0.739 1.00 0.00 O ATOM 509 CB ILE A 35 -10.411 -3.069 1.176 1.00 0.00 C ATOM 510 CG1 ILE A 35 -9.852 -2.177 0.057 1.00 0.00 C ATOM 511 CG2 ILE A 35 -9.300 -3.888 1.800 1.00 0.00 C ATOM 512 CD1 ILE A 35 -8.754 -1.224 0.499 1.00 0.00 C ATOM 0 H ILE A 35 -11.134 -4.481 -1.329 1.00 0.00 H new ATOM 0 HA ILE A 35 -11.865 -4.632 1.526 1.00 0.00 H new ATOM 0 HB ILE A 35 -10.830 -2.412 1.938 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -9.464 -2.814 -0.738 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -10.670 -1.596 -0.370 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -8.498 -3.225 2.126 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -9.690 -4.436 2.658 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -8.911 -4.593 1.066 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -8.419 -0.634 -0.354 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -9.139 -0.558 1.272 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -7.915 -1.795 0.897 1.00 0.00 H new ATOM 524 N LYS A 36 -13.855 -3.158 1.083 1.00 0.00 N ATOM 525 CA LYS A 36 -15.007 -2.355 0.847 1.00 0.00 C ATOM 526 C LYS A 36 -14.884 -1.055 1.623 1.00 0.00 C ATOM 527 O LYS A 36 -14.390 -1.051 2.751 1.00 0.00 O ATOM 528 CB LYS A 36 -16.297 -3.103 1.179 1.00 0.00 C ATOM 529 CG LYS A 36 -16.531 -3.424 2.653 1.00 0.00 C ATOM 530 CD LYS A 36 -17.906 -4.068 2.865 1.00 0.00 C ATOM 531 CE LYS A 36 -19.028 -3.168 2.339 1.00 0.00 C ATOM 532 NZ LYS A 36 -20.369 -3.728 2.576 1.00 0.00 N ATOM 0 H LYS A 36 -13.922 -3.755 1.908 1.00 0.00 H new ATOM 0 HA LYS A 36 -15.061 -2.120 -0.216 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -17.138 -2.510 0.820 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -16.304 -4.038 0.620 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -15.752 -4.097 3.010 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -16.459 -2.511 3.243 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -17.941 -5.032 2.357 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -18.060 -4.262 3.927 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -18.958 -2.191 2.817 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -18.889 -3.010 1.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -21.075 -2.965 2.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -20.584 -4.435 1.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -20.396 -4.180 3.512 1.00 0.00 H new ATOM 546 N GLY A 37 -15.329 0.007 1.033 1.00 0.00 N ATOM 547 CA GLY A 37 -15.067 1.308 1.540 1.00 0.00 C ATOM 548 C GLY A 37 -16.196 2.246 1.331 1.00 0.00 C ATOM 549 O GLY A 37 -17.250 1.851 0.825 1.00 0.00 O ATOM 0 H GLY A 37 -15.888 -0.008 0.180 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -14.850 1.240 2.606 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -14.175 1.708 1.058 1.00 0.00 H new ATOM 553 N LEU A 38 -16.033 3.438 1.861 1.00 0.00 N ATOM 554 CA LEU A 38 -16.967 4.537 1.660 1.00 0.00 C ATOM 555 C LEU A 38 -16.856 4.962 0.176 1.00 0.00 C ATOM 556 O LEU A 38 -15.975 4.478 -0.542 1.00 0.00 O ATOM 557 CB LEU A 38 -16.590 5.708 2.568 1.00 0.00 C ATOM 558 CG LEU A 38 -16.343 5.373 4.043 1.00 0.00 C ATOM 559 CD1 LEU A 38 -15.869 6.602 4.782 1.00 0.00 C ATOM 560 CD2 LEU A 38 -17.589 4.807 4.703 1.00 0.00 C ATOM 0 H LEU A 38 -15.238 3.680 2.453 1.00 0.00 H new ATOM 0 HA LEU A 38 -17.986 4.234 1.901 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -15.690 6.175 2.168 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -17.385 6.452 2.515 1.00 0.00 H new ATOM 0 HG LEU A 38 -15.568 4.607 4.088 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -15.696 6.353 5.829 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -14.941 6.959 4.336 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -16.627 7.382 4.715 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -17.377 4.581 5.748 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -18.395 5.539 4.646 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -17.891 3.895 4.189 1.00 0.00 H new ATOM 572 N THR A 39 -17.721 5.820 -0.300 1.00 0.00 N ATOM 573 CA THR A 39 -17.738 6.070 -1.727 1.00 0.00 C ATOM 574 C THR A 39 -16.555 6.896 -2.229 1.00 0.00 C ATOM 575 O THR A 39 -16.529 8.089 -2.032 1.00 0.00 O ATOM 576 CB THR A 39 -18.967 6.947 -2.033 1.00 0.00 C ATOM 577 OG1 THR A 39 -20.061 6.572 -1.189 1.00 0.00 O ATOM 578 CG2 THR A 39 -19.379 6.825 -3.491 1.00 0.00 C ATOM 0 H THR A 39 -18.402 6.343 0.251 1.00 0.00 H new ATOM 0 HA THR A 39 -17.726 5.091 -2.205 1.00 0.00 H new ATOM 0 HB THR A 39 -18.697 7.985 -1.838 1.00 0.00 H new ATOM 0 HG1 THR A 39 -20.837 7.136 -1.389 1.00 0.00 H new ATOM 0 HG21 THR A 39 -20.249 7.455 -3.677 1.00 0.00 H new ATOM 0 HG22 THR A 39 -18.556 7.145 -4.130 1.00 0.00 H new ATOM 0 HG23 THR A 39 -19.628 5.787 -3.713 1.00 0.00 H new ATOM 586 N GLU A 40 -15.620 6.247 -2.842 1.00 0.00 N ATOM 587 CA GLU A 40 -14.694 6.820 -3.756 1.00 0.00 C ATOM 588 C GLU A 40 -13.854 5.706 -4.268 1.00 0.00 C ATOM 589 O GLU A 40 -13.738 4.684 -3.606 1.00 0.00 O ATOM 590 CB GLU A 40 -13.832 7.995 -3.232 1.00 0.00 C ATOM 591 CG GLU A 40 -13.220 8.783 -4.397 1.00 0.00 C ATOM 592 CD GLU A 40 -12.477 10.014 -4.011 1.00 0.00 C ATOM 593 OE1 GLU A 40 -13.108 11.020 -3.666 1.00 0.00 O ATOM 594 OE2 GLU A 40 -11.261 10.043 -4.130 1.00 0.00 O ATOM 0 H GLU A 40 -15.476 5.246 -2.709 1.00 0.00 H new ATOM 0 HA GLU A 40 -15.274 7.306 -4.541 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -14.445 8.658 -2.621 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -13.039 7.612 -2.590 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -12.543 8.126 -4.943 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -14.018 9.061 -5.085 1.00 0.00 H new ATOM 601 N GLY A 41 -13.290 5.875 -5.396 1.00 0.00 N ATOM 602 CA GLY A 41 -12.299 4.949 -5.874 1.00 0.00 C ATOM 603 C GLY A 41 -10.922 5.378 -5.385 1.00 0.00 C ATOM 604 O GLY A 41 -10.819 6.114 -4.404 1.00 0.00 O ATOM 0 H GLY A 41 -13.488 6.651 -6.027 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -12.525 3.943 -5.519 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -12.315 4.914 -6.963 1.00 0.00 H new ATOM 608 N LEU A 42 -9.897 4.932 -6.030 1.00 0.00 N ATOM 609 CA LEU A 42 -8.615 5.286 -5.728 1.00 0.00 C ATOM 610 C LEU A 42 -7.783 5.011 -6.919 1.00 0.00 C ATOM 611 O LEU A 42 -8.303 4.724 -8.004 1.00 0.00 O ATOM 612 CB LEU A 42 -8.055 4.598 -4.450 1.00 0.00 C ATOM 613 CG LEU A 42 -8.011 3.089 -4.308 1.00 0.00 C ATOM 614 CD1 LEU A 42 -7.020 2.769 -3.192 1.00 0.00 C ATOM 615 CD2 LEU A 42 -9.392 2.548 -3.920 1.00 0.00 C ATOM 0 H LEU A 42 -9.969 4.282 -6.813 1.00 0.00 H new ATOM 0 HA LEU A 42 -8.594 6.348 -5.482 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -7.034 4.957 -4.321 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -8.635 4.977 -3.608 1.00 0.00 H new ATOM 0 HG LEU A 42 -7.714 2.631 -5.251 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -6.959 1.689 -3.058 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -6.037 3.158 -3.456 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -7.356 3.231 -2.264 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -9.344 1.463 -3.822 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -9.700 2.985 -2.970 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.116 2.811 -4.692 1.00 0.00 H new ATOM 627 N HIS A 43 -6.553 5.098 -6.731 1.00 0.00 N ATOM 628 CA HIS A 43 -5.587 4.915 -7.736 1.00 0.00 C ATOM 629 C HIS A 43 -4.545 4.099 -7.063 1.00 0.00 C ATOM 630 O HIS A 43 -4.617 3.993 -5.827 1.00 0.00 O ATOM 631 CB HIS A 43 -5.046 6.297 -8.145 1.00 0.00 C ATOM 632 CG HIS A 43 -4.025 6.309 -9.256 1.00 0.00 C ATOM 633 ND1 HIS A 43 -2.711 6.717 -9.086 1.00 0.00 N ATOM 634 CD2 HIS A 43 -4.143 6.004 -10.566 1.00 0.00 C ATOM 635 CE1 HIS A 43 -2.088 6.661 -10.241 1.00 0.00 C ATOM 636 NE2 HIS A 43 -2.929 6.231 -11.148 1.00 0.00 N ATOM 0 H HIS A 43 -6.149 5.312 -5.819 1.00 0.00 H new ATOM 0 HA HIS A 43 -5.955 4.434 -8.643 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -5.888 6.919 -8.447 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -4.602 6.765 -7.266 1.00 0.00 H new ATOM 0 HD1 HIS A 43 -2.294 7.014 -8.204 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -5.033 5.646 -11.062 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -1.055 6.925 -10.414 1.00 0.00 H new ATOM 645 N GLY A 44 -3.639 3.512 -7.842 1.00 0.00 N ATOM 646 CA GLY A 44 -2.525 2.715 -7.315 1.00 0.00 C ATOM 647 C GLY A 44 -2.007 3.243 -6.005 1.00 0.00 C ATOM 648 O GLY A 44 -1.459 4.363 -5.929 1.00 0.00 O ATOM 0 H GLY A 44 -3.654 3.574 -8.860 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -2.851 1.683 -7.184 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -1.715 2.703 -8.044 1.00 0.00 H new ATOM 652 N PHE A 45 -2.241 2.469 -4.965 1.00 0.00 N ATOM 653 CA PHE A 45 -1.946 2.884 -3.629 1.00 0.00 C ATOM 654 C PHE A 45 -0.473 2.969 -3.361 1.00 0.00 C ATOM 655 O PHE A 45 0.344 2.363 -4.040 1.00 0.00 O ATOM 656 CB PHE A 45 -2.702 2.060 -2.567 1.00 0.00 C ATOM 657 CG PHE A 45 -2.582 0.559 -2.683 1.00 0.00 C ATOM 658 CD1 PHE A 45 -1.529 -0.123 -2.099 1.00 0.00 C ATOM 659 CD2 PHE A 45 -3.545 -0.169 -3.363 1.00 0.00 C ATOM 660 CE1 PHE A 45 -1.436 -1.496 -2.194 1.00 0.00 C ATOM 661 CE2 PHE A 45 -3.460 -1.543 -3.460 1.00 0.00 C ATOM 662 CZ PHE A 45 -2.405 -2.208 -2.876 1.00 0.00 C ATOM 0 H PHE A 45 -2.642 1.534 -5.034 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.325 3.902 -3.540 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -2.343 2.358 -1.582 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -3.758 2.325 -2.615 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.770 0.427 -1.562 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -4.375 0.347 -3.824 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -0.607 -2.014 -1.736 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -4.220 -2.096 -3.993 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.335 -3.283 -2.951 1.00 0.00 H new ATOM 672 N HIS A 46 -0.134 3.746 -2.380 1.00 0.00 N ATOM 673 CA HIS A 46 1.216 4.027 -2.080 1.00 0.00 C ATOM 674 C HIS A 46 1.404 3.986 -0.601 1.00 0.00 C ATOM 675 O HIS A 46 1.014 5.011 0.171 1.00 0.00 O ATOM 676 CB HIS A 46 1.685 5.357 -2.703 1.00 0.00 C ATOM 677 CG HIS A 46 1.984 5.308 -4.187 1.00 0.00 C ATOM 678 ND1 HIS A 46 1.023 5.367 -5.181 1.00 0.00 N ATOM 679 CD2 HIS A 46 3.170 5.246 -4.832 1.00 0.00 C ATOM 680 CE1 HIS A 46 1.619 5.347 -6.364 1.00 0.00 C ATOM 681 NE2 HIS A 46 2.913 5.276 -6.165 1.00 0.00 N ATOM 0 H HIS A 46 -0.804 4.204 -1.763 1.00 0.00 H new ATOM 0 HA HIS A 46 1.849 3.262 -2.531 1.00 0.00 H new ATOM 0 HB2 HIS A 46 0.918 6.111 -2.529 1.00 0.00 H new ATOM 0 HB3 HIS A 46 2.582 5.688 -2.179 1.00 0.00 H new ATOM 0 HD1 HIS A 46 0.016 5.418 -5.027 1.00 0.00 H new ATOM 0 HD2 HIS A 46 4.145 5.184 -4.371 1.00 0.00 H new ATOM 0 HE1 HIS A 46 1.126 5.383 -7.324 1.00 0.00 H new ATOM 0 HE2 HIS A 46 3.620 5.248 -6.900 1.00 0.00 H new ATOM 690 N VAL A 47 1.819 2.862 -0.152 1.00 0.00 N ATOM 691 CA VAL A 47 1.974 2.588 1.236 1.00 0.00 C ATOM 692 C VAL A 47 3.444 2.579 1.594 1.00 0.00 C ATOM 693 O VAL A 47 4.286 2.411 0.729 1.00 0.00 O ATOM 694 CB VAL A 47 1.340 1.211 1.578 1.00 0.00 C ATOM 695 CG1 VAL A 47 -0.098 1.166 1.096 1.00 0.00 C ATOM 696 CG2 VAL A 47 2.123 0.053 0.978 1.00 0.00 C ATOM 0 H VAL A 47 2.070 2.078 -0.755 1.00 0.00 H new ATOM 0 HA VAL A 47 1.469 3.364 1.811 1.00 0.00 H new ATOM 0 HB VAL A 47 1.369 1.100 2.662 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -0.533 0.197 1.340 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -0.670 1.955 1.584 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.125 1.314 0.016 1.00 0.00 H new ATOM 0 HG21 VAL A 47 1.642 -0.888 1.244 1.00 0.00 H new ATOM 0 HG22 VAL A 47 2.148 0.154 -0.107 1.00 0.00 H new ATOM 0 HG23 VAL A 47 3.141 0.062 1.366 1.00 0.00 H new ATOM 706 N HIS A 48 3.737 2.808 2.835 1.00 0.00 N ATOM 707 CA HIS A 48 5.105 2.723 3.296 1.00 0.00 C ATOM 708 C HIS A 48 5.231 1.890 4.556 1.00 0.00 C ATOM 709 O HIS A 48 4.677 2.201 5.617 1.00 0.00 O ATOM 710 CB HIS A 48 5.776 4.083 3.438 1.00 0.00 C ATOM 711 CG HIS A 48 7.200 4.012 3.935 1.00 0.00 C ATOM 712 ND1 HIS A 48 8.110 3.058 3.526 1.00 0.00 N ATOM 713 CD2 HIS A 48 7.853 4.764 4.834 1.00 0.00 C ATOM 714 CE1 HIS A 48 9.242 3.237 4.141 1.00 0.00 C ATOM 715 NE2 HIS A 48 9.122 4.261 4.942 1.00 0.00 N ATOM 0 H HIS A 48 3.056 3.055 3.553 1.00 0.00 H new ATOM 0 HA HIS A 48 5.653 2.202 2.511 1.00 0.00 H new ATOM 0 HB2 HIS A 48 5.763 4.587 2.471 1.00 0.00 H new ATOM 0 HB3 HIS A 48 5.192 4.696 4.124 1.00 0.00 H new ATOM 0 HD1 HIS A 48 7.923 2.323 2.844 1.00 0.00 H new ATOM 0 HD2 HIS A 48 7.452 5.610 5.373 1.00 0.00 H new ATOM 0 HE1 HIS A 48 10.132 2.639 4.011 1.00 0.00 H new ATOM 724 N GLU A 49 6.005 0.889 4.419 1.00 0.00 N ATOM 725 CA GLU A 49 6.245 -0.107 5.401 1.00 0.00 C ATOM 726 C GLU A 49 7.427 0.177 6.372 1.00 0.00 C ATOM 727 O GLU A 49 8.572 -0.093 6.059 1.00 0.00 O ATOM 728 CB GLU A 49 6.427 -1.488 4.710 1.00 0.00 C ATOM 729 CG GLU A 49 7.015 -1.470 3.283 1.00 0.00 C ATOM 730 CD GLU A 49 8.270 -0.629 3.099 1.00 0.00 C ATOM 731 OE1 GLU A 49 9.383 -1.129 3.279 1.00 0.00 O ATOM 732 OE2 GLU A 49 8.124 0.568 2.733 1.00 0.00 O ATOM 0 H GLU A 49 6.529 0.725 3.559 1.00 0.00 H new ATOM 0 HA GLU A 49 5.362 -0.102 6.040 1.00 0.00 H new ATOM 0 HB2 GLU A 49 7.073 -2.102 5.338 1.00 0.00 H new ATOM 0 HB3 GLU A 49 5.456 -1.982 4.673 1.00 0.00 H new ATOM 0 HG2 GLU A 49 7.240 -2.495 2.989 1.00 0.00 H new ATOM 0 HG3 GLU A 49 6.250 -1.103 2.599 1.00 0.00 H new ATOM 739 N PHE A 50 7.150 0.739 7.553 1.00 0.00 N ATOM 740 CA PHE A 50 8.216 0.794 8.560 1.00 0.00 C ATOM 741 C PHE A 50 7.794 0.303 9.953 1.00 0.00 C ATOM 742 O PHE A 50 8.636 0.106 10.811 1.00 0.00 O ATOM 743 CB PHE A 50 9.023 2.120 8.613 1.00 0.00 C ATOM 744 CG PHE A 50 8.348 3.351 9.143 1.00 0.00 C ATOM 745 CD1 PHE A 50 8.066 3.478 10.493 1.00 0.00 C ATOM 746 CD2 PHE A 50 8.057 4.403 8.306 1.00 0.00 C ATOM 747 CE1 PHE A 50 7.494 4.620 10.988 1.00 0.00 C ATOM 748 CE2 PHE A 50 7.497 5.554 8.799 1.00 0.00 C ATOM 749 CZ PHE A 50 7.215 5.662 10.142 1.00 0.00 C ATOM 0 H PHE A 50 6.253 1.140 7.827 1.00 0.00 H new ATOM 0 HA PHE A 50 8.928 0.060 8.183 1.00 0.00 H new ATOM 0 HB2 PHE A 50 9.911 1.943 9.219 1.00 0.00 H new ATOM 0 HB3 PHE A 50 9.366 2.340 7.602 1.00 0.00 H new ATOM 0 HD1 PHE A 50 8.300 2.665 11.165 1.00 0.00 H new ATOM 0 HD2 PHE A 50 8.271 4.322 7.251 1.00 0.00 H new ATOM 0 HE1 PHE A 50 7.264 4.699 12.040 1.00 0.00 H new ATOM 0 HE2 PHE A 50 7.277 6.376 8.133 1.00 0.00 H new ATOM 0 HZ PHE A 50 6.774 6.568 10.529 1.00 0.00 H new ATOM 759 N GLY A 51 6.515 0.002 10.140 1.00 0.00 N ATOM 760 CA GLY A 51 6.051 -0.466 11.461 1.00 0.00 C ATOM 761 C GLY A 51 5.378 0.609 12.250 1.00 0.00 C ATOM 762 O GLY A 51 6.004 1.630 12.536 1.00 0.00 O ATOM 0 H GLY A 51 5.791 0.067 9.424 1.00 0.00 H new ATOM 0 HA2 GLY A 51 5.360 -1.298 11.325 1.00 0.00 H new ATOM 0 HA3 GLY A 51 6.902 -0.847 12.026 1.00 0.00 H new ATOM 766 N ASP A 52 4.095 0.427 12.589 1.00 0.00 N ATOM 767 CA ASP A 52 3.440 1.452 13.408 1.00 0.00 C ATOM 768 C ASP A 52 2.435 0.820 14.387 1.00 0.00 C ATOM 769 O ASP A 52 2.798 0.451 15.503 1.00 0.00 O ATOM 770 CB ASP A 52 2.766 2.527 12.519 1.00 0.00 C ATOM 771 CG ASP A 52 2.369 3.785 13.268 1.00 0.00 C ATOM 772 OD1 ASP A 52 1.422 3.763 14.056 1.00 0.00 O ATOM 773 OD2 ASP A 52 3.006 4.842 13.056 1.00 0.00 O ATOM 0 H ASP A 52 3.518 -0.372 12.327 1.00 0.00 H new ATOM 0 HA ASP A 52 4.207 1.949 14.001 1.00 0.00 H new ATOM 0 HB2 ASP A 52 3.448 2.796 11.712 1.00 0.00 H new ATOM 0 HB3 ASP A 52 1.878 2.097 12.056 1.00 0.00 H new ATOM 778 N ASN A 53 1.220 0.604 13.928 1.00 0.00 N ATOM 779 CA ASN A 53 0.148 0.039 14.734 1.00 0.00 C ATOM 780 C ASN A 53 -0.840 -0.656 13.828 1.00 0.00 C ATOM 781 O ASN A 53 -1.205 -0.126 12.784 1.00 0.00 O ATOM 782 CB ASN A 53 -0.567 1.153 15.530 1.00 0.00 C ATOM 783 CG ASN A 53 -1.817 0.694 16.289 1.00 0.00 C ATOM 784 OD1 ASN A 53 -1.927 -0.455 16.738 1.00 0.00 O ATOM 785 ND2 ASN A 53 -2.774 1.572 16.419 1.00 0.00 N ATOM 0 H ASN A 53 0.941 0.818 12.970 1.00 0.00 H new ATOM 0 HA ASN A 53 0.568 -0.678 15.439 1.00 0.00 H new ATOM 0 HB2 ASN A 53 0.138 1.581 16.243 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -0.848 1.950 14.842 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -3.637 1.318 16.899 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -2.659 2.512 16.040 1.00 0.00 H new ATOM 792 N THR A 54 -1.270 -1.821 14.238 1.00 0.00 N ATOM 793 CA THR A 54 -2.231 -2.664 13.540 1.00 0.00 C ATOM 794 C THR A 54 -3.559 -1.933 13.247 1.00 0.00 C ATOM 795 O THR A 54 -4.321 -2.331 12.370 1.00 0.00 O ATOM 796 CB THR A 54 -2.515 -3.887 14.443 1.00 0.00 C ATOM 797 OG1 THR A 54 -1.264 -4.464 14.848 1.00 0.00 O ATOM 798 CG2 THR A 54 -3.362 -4.943 13.740 1.00 0.00 C ATOM 0 H THR A 54 -0.948 -2.237 15.112 1.00 0.00 H new ATOM 0 HA THR A 54 -1.808 -2.952 12.578 1.00 0.00 H new ATOM 0 HB THR A 54 -3.082 -3.543 15.308 1.00 0.00 H new ATOM 0 HG1 THR A 54 -1.432 -5.240 15.423 1.00 0.00 H new ATOM 0 HG21 THR A 54 -3.533 -5.781 14.416 1.00 0.00 H new ATOM 0 HG22 THR A 54 -4.319 -4.508 13.451 1.00 0.00 H new ATOM 0 HG23 THR A 54 -2.840 -5.295 12.850 1.00 0.00 H new ATOM 806 N ALA A 55 -3.805 -0.872 13.954 1.00 0.00 N ATOM 807 CA ALA A 55 -5.033 -0.164 13.816 1.00 0.00 C ATOM 808 C ALA A 55 -4.833 1.236 13.247 1.00 0.00 C ATOM 809 O ALA A 55 -5.796 1.980 13.109 1.00 0.00 O ATOM 810 CB ALA A 55 -5.747 -0.110 15.155 1.00 0.00 C ATOM 0 H ALA A 55 -3.161 -0.477 14.639 1.00 0.00 H new ATOM 0 HA ALA A 55 -5.652 -0.704 13.100 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -6.686 0.433 15.045 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -5.952 -1.124 15.499 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.116 0.400 15.883 1.00 0.00 H new ATOM 816 N GLY A 56 -3.609 1.612 12.907 1.00 0.00 N ATOM 817 CA GLY A 56 -3.433 2.954 12.408 1.00 0.00 C ATOM 818 C GLY A 56 -1.994 3.346 12.261 1.00 0.00 C ATOM 819 O GLY A 56 -1.178 3.010 13.091 1.00 0.00 O ATOM 0 H GLY A 56 -2.768 1.038 12.964 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -3.927 3.043 11.441 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -3.926 3.653 13.083 1.00 0.00 H new ATOM 823 N CYS A 57 -1.678 4.006 11.181 1.00 0.00 N ATOM 824 CA CYS A 57 -0.342 4.445 10.912 1.00 0.00 C ATOM 825 C CYS A 57 -0.130 5.902 11.275 1.00 0.00 C ATOM 826 O CYS A 57 -0.405 6.785 10.493 1.00 0.00 O ATOM 827 CB CYS A 57 0.077 4.132 9.467 1.00 0.00 C ATOM 828 SG CYS A 57 -0.945 4.813 8.094 1.00 0.00 S ATOM 0 H CYS A 57 -2.351 4.256 10.456 1.00 0.00 H new ATOM 0 HA CYS A 57 0.319 3.873 11.563 1.00 0.00 H new ATOM 0 HB2 CYS A 57 1.097 4.491 9.332 1.00 0.00 H new ATOM 0 HB3 CYS A 57 0.103 3.048 9.356 1.00 0.00 H new ATOM 833 N THR A 58 0.347 6.161 12.455 1.00 0.00 N ATOM 834 CA THR A 58 0.555 7.521 12.872 1.00 0.00 C ATOM 835 C THR A 58 1.782 8.119 12.193 1.00 0.00 C ATOM 836 O THR A 58 1.701 9.166 11.541 1.00 0.00 O ATOM 837 CB THR A 58 0.705 7.608 14.407 1.00 0.00 C ATOM 838 OG1 THR A 58 -0.428 6.977 15.021 1.00 0.00 O ATOM 839 CG2 THR A 58 0.773 9.064 14.870 1.00 0.00 C ATOM 0 H THR A 58 0.600 5.454 13.146 1.00 0.00 H new ATOM 0 HA THR A 58 -0.321 8.097 12.573 1.00 0.00 H new ATOM 0 HB THR A 58 1.629 7.108 14.696 1.00 0.00 H new ATOM 0 HG1 THR A 58 -0.341 7.026 15.996 1.00 0.00 H new ATOM 0 HG21 THR A 58 0.878 9.096 15.954 1.00 0.00 H new ATOM 0 HG22 THR A 58 1.630 9.553 14.407 1.00 0.00 H new ATOM 0 HG23 THR A 58 -0.141 9.581 14.579 1.00 0.00 H new ATOM 847 N SER A 59 2.877 7.435 12.290 1.00 0.00 N ATOM 848 CA SER A 59 4.113 7.934 11.774 1.00 0.00 C ATOM 849 C SER A 59 4.312 7.502 10.331 1.00 0.00 C ATOM 850 O SER A 59 4.848 8.256 9.503 1.00 0.00 O ATOM 851 CB SER A 59 5.237 7.418 12.646 1.00 0.00 C ATOM 852 OG SER A 59 5.007 7.776 14.005 1.00 0.00 O ATOM 0 H SER A 59 2.941 6.516 12.728 1.00 0.00 H new ATOM 0 HA SER A 59 4.103 9.024 11.788 1.00 0.00 H new ATOM 0 HB2 SER A 59 5.310 6.334 12.555 1.00 0.00 H new ATOM 0 HB3 SER A 59 6.188 7.831 12.309 1.00 0.00 H new ATOM 0 HG SER A 59 5.739 7.436 14.561 1.00 0.00 H new ATOM 858 N ALA A 60 3.846 6.306 10.028 1.00 0.00 N ATOM 859 CA ALA A 60 4.039 5.713 8.718 1.00 0.00 C ATOM 860 C ALA A 60 3.076 6.245 7.674 1.00 0.00 C ATOM 861 O ALA A 60 3.251 5.972 6.493 1.00 0.00 O ATOM 862 CB ALA A 60 3.977 4.199 8.803 1.00 0.00 C ATOM 0 H ALA A 60 3.325 5.720 10.680 1.00 0.00 H new ATOM 0 HA ALA A 60 5.035 6.006 8.385 1.00 0.00 H new ATOM 0 HB1 ALA A 60 4.124 3.773 7.811 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.759 3.840 9.472 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.003 3.896 9.188 1.00 0.00 H new ATOM 868 N GLY A 61 2.091 6.999 8.102 1.00 0.00 N ATOM 869 CA GLY A 61 1.088 7.542 7.193 1.00 0.00 C ATOM 870 C GLY A 61 1.652 8.468 6.096 1.00 0.00 C ATOM 871 O GLY A 61 1.570 8.139 4.907 1.00 0.00 O ATOM 0 H GLY A 61 1.955 7.256 9.080 1.00 0.00 H new ATOM 0 HA2 GLY A 61 0.562 6.715 6.717 1.00 0.00 H new ATOM 0 HA3 GLY A 61 0.351 8.096 7.775 1.00 0.00 H new ATOM 875 N PRO A 62 2.223 9.639 6.464 1.00 0.00 N ATOM 876 CA PRO A 62 2.744 10.621 5.493 1.00 0.00 C ATOM 877 C PRO A 62 4.215 10.400 5.098 1.00 0.00 C ATOM 878 O PRO A 62 4.826 11.240 4.411 1.00 0.00 O ATOM 879 CB PRO A 62 2.604 11.926 6.261 1.00 0.00 C ATOM 880 CG PRO A 62 2.881 11.550 7.679 1.00 0.00 C ATOM 881 CD PRO A 62 2.361 10.142 7.853 1.00 0.00 C ATOM 0 HA PRO A 62 2.209 10.569 4.544 1.00 0.00 H new ATOM 0 HB2 PRO A 62 3.309 12.676 5.903 1.00 0.00 H new ATOM 0 HB3 PRO A 62 1.605 12.348 6.149 1.00 0.00 H new ATOM 0 HG2 PRO A 62 3.949 11.600 7.893 1.00 0.00 H new ATOM 0 HG3 PRO A 62 2.386 12.235 8.367 1.00 0.00 H new ATOM 0 HD2 PRO A 62 3.052 9.530 8.433 1.00 0.00 H new ATOM 0 HD3 PRO A 62 1.406 10.131 8.379 1.00 0.00 H new ATOM 889 N HIS A 63 4.791 9.317 5.552 1.00 0.00 N ATOM 890 CA HIS A 63 6.196 9.056 5.302 1.00 0.00 C ATOM 891 C HIS A 63 6.310 8.089 4.125 1.00 0.00 C ATOM 892 O HIS A 63 5.622 7.087 4.091 1.00 0.00 O ATOM 893 CB HIS A 63 6.831 8.466 6.567 1.00 0.00 C ATOM 894 CG HIS A 63 8.339 8.526 6.623 1.00 0.00 C ATOM 895 ND1 HIS A 63 9.287 7.729 6.077 1.00 0.00 N flip ATOM 896 CD2 HIS A 63 9.024 9.471 7.357 1.00 0.00 C flip ATOM 897 CE1 HIS A 63 10.499 8.196 6.484 1.00 0.00 C flip ATOM 898 NE2 HIS A 63 10.318 9.247 7.253 1.00 0.00 N flip ATOM 0 H HIS A 63 4.314 8.598 6.097 1.00 0.00 H new ATOM 0 HA HIS A 63 6.723 9.977 5.053 1.00 0.00 H new ATOM 0 HB2 HIS A 63 6.431 8.993 7.433 1.00 0.00 H new ATOM 0 HB3 HIS A 63 6.522 7.425 6.656 1.00 0.00 H new ATOM 0 HD2 HIS A 63 8.571 10.269 7.927 1.00 0.00 H new ATOM 0 HE1 HIS A 63 11.456 7.771 6.218 1.00 0.00 H new ATOM 0 HE2 HIS A 63 11.055 9.796 7.695 1.00 0.00 H new ATOM 907 N PHE A 64 7.186 8.381 3.193 1.00 0.00 N ATOM 908 CA PHE A 64 7.326 7.585 1.978 1.00 0.00 C ATOM 909 C PHE A 64 8.624 6.784 1.955 1.00 0.00 C ATOM 910 O PHE A 64 9.464 6.936 2.834 1.00 0.00 O ATOM 911 CB PHE A 64 7.210 8.473 0.723 1.00 0.00 C ATOM 912 CG PHE A 64 8.159 9.655 0.670 1.00 0.00 C ATOM 913 CD1 PHE A 64 9.433 9.524 0.134 1.00 0.00 C ATOM 914 CD2 PHE A 64 7.765 10.899 1.145 1.00 0.00 C ATOM 915 CE1 PHE A 64 10.292 10.609 0.073 1.00 0.00 C ATOM 916 CE2 PHE A 64 8.620 11.984 1.085 1.00 0.00 C ATOM 917 CZ PHE A 64 9.884 11.838 0.550 1.00 0.00 C ATOM 0 H PHE A 64 7.825 9.174 3.247 1.00 0.00 H new ATOM 0 HA PHE A 64 6.507 6.866 1.974 1.00 0.00 H new ATOM 0 HB2 PHE A 64 7.381 7.853 -0.157 1.00 0.00 H new ATOM 0 HB3 PHE A 64 6.188 8.846 0.657 1.00 0.00 H new ATOM 0 HD1 PHE A 64 9.758 8.564 -0.240 1.00 0.00 H new ATOM 0 HD2 PHE A 64 6.778 11.021 1.567 1.00 0.00 H new ATOM 0 HE1 PHE A 64 11.280 10.493 -0.347 1.00 0.00 H new ATOM 0 HE2 PHE A 64 8.299 12.946 1.457 1.00 0.00 H new ATOM 0 HZ PHE A 64 10.553 12.685 0.505 1.00 0.00 H new ATOM 927 N ASN A 65 8.741 5.893 0.979 1.00 0.00 N ATOM 928 CA ASN A 65 9.951 5.088 0.770 1.00 0.00 C ATOM 929 C ASN A 65 10.717 5.576 -0.438 1.00 0.00 C ATOM 930 O ASN A 65 10.391 5.234 -1.555 1.00 0.00 O ATOM 931 CB ASN A 65 9.673 3.597 0.622 1.00 0.00 C ATOM 932 CG ASN A 65 10.954 2.790 0.413 1.00 0.00 C ATOM 933 OD1 ASN A 65 12.015 3.144 0.910 1.00 0.00 O ATOM 934 ND2 ASN A 65 10.867 1.720 -0.341 1.00 0.00 N ATOM 0 H ASN A 65 8.000 5.703 0.304 1.00 0.00 H new ATOM 0 HA ASN A 65 10.549 5.216 1.672 1.00 0.00 H new ATOM 0 HB2 ASN A 65 9.158 3.235 1.512 1.00 0.00 H new ATOM 0 HB3 ASN A 65 9.002 3.436 -0.222 1.00 0.00 H new ATOM 0 HD21 ASN A 65 11.698 1.158 -0.527 1.00 0.00 H new ATOM 0 HD22 ASN A 65 9.969 1.450 -0.741 1.00 0.00 H new ATOM 941 N PRO A 66 11.719 6.391 -0.227 1.00 0.00 N ATOM 942 CA PRO A 66 12.522 6.980 -1.273 1.00 0.00 C ATOM 943 C PRO A 66 13.288 5.966 -2.127 1.00 0.00 C ATOM 944 O PRO A 66 13.844 6.347 -3.159 1.00 0.00 O ATOM 945 CB PRO A 66 13.488 7.927 -0.553 1.00 0.00 C ATOM 946 CG PRO A 66 12.908 8.091 0.795 1.00 0.00 C ATOM 947 CD PRO A 66 12.216 6.800 1.084 1.00 0.00 C ATOM 0 HA PRO A 66 11.876 7.488 -1.989 1.00 0.00 H new ATOM 0 HB2 PRO A 66 14.493 7.508 -0.504 1.00 0.00 H new ATOM 0 HB3 PRO A 66 13.566 8.883 -1.071 1.00 0.00 H new ATOM 0 HG2 PRO A 66 13.682 8.297 1.534 1.00 0.00 H new ATOM 0 HG3 PRO A 66 12.209 8.927 0.824 1.00 0.00 H new ATOM 0 HD2 PRO A 66 12.899 6.062 1.505 1.00 0.00 H new ATOM 0 HD3 PRO A 66 11.405 6.929 1.801 1.00 0.00 H new ATOM 955 N LEU A 67 13.309 4.668 -1.705 1.00 0.00 N ATOM 956 CA LEU A 67 14.183 3.668 -2.289 1.00 0.00 C ATOM 957 C LEU A 67 13.878 3.482 -3.770 1.00 0.00 C ATOM 958 O LEU A 67 14.695 2.960 -4.518 1.00 0.00 O ATOM 959 CB LEU A 67 14.023 2.336 -1.522 1.00 0.00 C ATOM 960 CG LEU A 67 15.274 1.440 -1.335 1.00 0.00 C ATOM 961 CD1 LEU A 67 15.865 0.965 -2.647 1.00 0.00 C ATOM 962 CD2 LEU A 67 16.317 2.156 -0.507 1.00 0.00 C ATOM 0 H LEU A 67 12.716 4.312 -0.955 1.00 0.00 H new ATOM 0 HA LEU A 67 15.216 4.004 -2.205 1.00 0.00 H new ATOM 0 HB2 LEU A 67 13.629 2.568 -0.532 1.00 0.00 H new ATOM 0 HB3 LEU A 67 13.265 1.745 -2.036 1.00 0.00 H new ATOM 0 HG LEU A 67 14.944 0.547 -0.804 1.00 0.00 H new ATOM 0 HD11 LEU A 67 16.738 0.343 -2.449 1.00 0.00 H new ATOM 0 HD12 LEU A 67 15.121 0.384 -3.192 1.00 0.00 H new ATOM 0 HD13 LEU A 67 16.162 1.826 -3.245 1.00 0.00 H new ATOM 0 HD21 LEU A 67 17.189 1.513 -0.385 1.00 0.00 H new ATOM 0 HD22 LEU A 67 16.612 3.076 -1.011 1.00 0.00 H new ATOM 0 HD23 LEU A 67 15.903 2.395 0.472 1.00 0.00 H new ATOM 974 N SER A 68 12.729 3.921 -4.215 1.00 0.00 N ATOM 975 CA SER A 68 12.488 3.755 -5.594 1.00 0.00 C ATOM 976 C SER A 68 13.104 4.919 -6.395 1.00 0.00 C ATOM 977 O SER A 68 14.279 4.921 -6.739 1.00 0.00 O ATOM 978 CB SER A 68 10.979 3.670 -5.851 1.00 0.00 C ATOM 979 OG SER A 68 10.673 3.587 -7.238 1.00 0.00 O ATOM 0 H SER A 68 11.994 4.369 -3.668 1.00 0.00 H new ATOM 0 HA SER A 68 12.957 2.828 -5.924 1.00 0.00 H new ATOM 0 HB2 SER A 68 10.574 2.797 -5.339 1.00 0.00 H new ATOM 0 HB3 SER A 68 10.490 4.546 -5.425 1.00 0.00 H new ATOM 0 HG SER A 68 9.925 4.186 -7.444 1.00 0.00 H new ATOM 985 N ARG A 69 12.348 5.913 -6.592 1.00 0.00 N ATOM 986 CA ARG A 69 12.751 7.083 -7.275 1.00 0.00 C ATOM 987 C ARG A 69 12.237 8.201 -6.476 1.00 0.00 C ATOM 988 O ARG A 69 11.626 9.123 -6.994 1.00 0.00 O ATOM 989 CB ARG A 69 12.203 7.073 -8.703 1.00 0.00 C ATOM 990 CG ARG A 69 12.626 8.273 -9.579 1.00 0.00 C ATOM 991 CD ARG A 69 14.136 8.504 -9.552 1.00 0.00 C ATOM 992 NE ARG A 69 14.920 7.288 -9.827 1.00 0.00 N ATOM 993 CZ ARG A 69 16.226 7.163 -9.554 1.00 0.00 C ATOM 994 NH1 ARG A 69 16.904 8.198 -9.038 1.00 0.00 N ATOM 995 NH2 ARG A 69 16.849 6.015 -9.798 1.00 0.00 N ATOM 0 H ARG A 69 11.381 5.945 -6.269 1.00 0.00 H new ATOM 0 HA ARG A 69 13.833 7.162 -7.378 1.00 0.00 H new ATOM 0 HB2 ARG A 69 12.527 6.154 -9.193 1.00 0.00 H new ATOM 0 HB3 ARG A 69 11.114 7.043 -8.657 1.00 0.00 H new ATOM 0 HG2 ARG A 69 12.305 8.102 -10.606 1.00 0.00 H new ATOM 0 HG3 ARG A 69 12.116 9.172 -9.231 1.00 0.00 H new ATOM 0 HD2 ARG A 69 14.392 9.266 -10.288 1.00 0.00 H new ATOM 0 HD3 ARG A 69 14.418 8.896 -8.575 1.00 0.00 H new ATOM 0 HE ARG A 69 14.440 6.494 -10.250 1.00 0.00 H new ATOM 0 HH11 ARG A 69 16.426 9.080 -8.853 1.00 0.00 H new ATOM 0 HH12 ARG A 69 17.898 8.104 -8.830 1.00 0.00 H new ATOM 0 HH21 ARG A 69 16.333 5.229 -10.193 1.00 0.00 H new ATOM 0 HH22 ARG A 69 17.843 5.920 -9.590 1.00 0.00 H new ATOM 1009 N LYS A 70 12.384 8.024 -5.178 1.00 0.00 N ATOM 1010 CA LYS A 70 11.906 8.956 -4.197 1.00 0.00 C ATOM 1011 C LYS A 70 10.404 8.806 -4.091 1.00 0.00 C ATOM 1012 O LYS A 70 9.899 7.700 -4.314 1.00 0.00 O ATOM 1013 CB LYS A 70 12.387 10.400 -4.455 1.00 0.00 C ATOM 1014 CG LYS A 70 13.901 10.537 -4.329 1.00 0.00 C ATOM 1015 CD LYS A 70 14.355 11.961 -4.536 1.00 0.00 C ATOM 1016 CE LYS A 70 15.856 12.086 -4.397 1.00 0.00 C ATOM 1017 NZ LYS A 70 16.313 13.475 -4.585 1.00 0.00 N ATOM 0 H LYS A 70 12.849 7.210 -4.776 1.00 0.00 H new ATOM 0 HA LYS A 70 12.339 8.723 -3.224 1.00 0.00 H new ATOM 0 HB2 LYS A 70 12.078 10.711 -5.453 1.00 0.00 H new ATOM 0 HB3 LYS A 70 11.903 11.074 -3.748 1.00 0.00 H new ATOM 0 HG2 LYS A 70 14.216 10.195 -3.343 1.00 0.00 H new ATOM 0 HG3 LYS A 70 14.386 9.891 -5.061 1.00 0.00 H new ATOM 0 HD2 LYS A 70 14.050 12.302 -5.525 1.00 0.00 H new ATOM 0 HD3 LYS A 70 13.865 12.610 -3.810 1.00 0.00 H new ATOM 0 HE2 LYS A 70 16.160 11.735 -3.411 1.00 0.00 H new ATOM 0 HE3 LYS A 70 16.343 11.442 -5.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 17.347 13.517 -4.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 16.046 13.803 -5.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 15.869 14.086 -3.871 1.00 0.00 H new ATOM 1031 N HIS A 71 9.696 9.838 -3.696 1.00 0.00 N ATOM 1032 CA HIS A 71 8.249 9.720 -3.495 1.00 0.00 C ATOM 1033 C HIS A 71 7.443 9.482 -4.792 1.00 0.00 C ATOM 1034 O HIS A 71 6.962 10.430 -5.407 1.00 0.00 O ATOM 1035 CB HIS A 71 7.646 10.909 -2.666 1.00 0.00 C ATOM 1036 CG HIS A 71 7.680 12.290 -3.311 1.00 0.00 C ATOM 1037 ND1 HIS A 71 6.546 13.019 -3.584 1.00 0.00 N ATOM 1038 CD2 HIS A 71 8.711 13.070 -3.689 1.00 0.00 C ATOM 1039 CE1 HIS A 71 6.882 14.178 -4.089 1.00 0.00 C ATOM 1040 NE2 HIS A 71 8.187 14.235 -4.164 1.00 0.00 N ATOM 0 H HIS A 71 10.081 10.763 -3.506 1.00 0.00 H new ATOM 0 HA HIS A 71 8.141 8.813 -2.900 1.00 0.00 H new ATOM 0 HB2 HIS A 71 6.608 10.669 -2.435 1.00 0.00 H new ATOM 0 HB3 HIS A 71 8.179 10.965 -1.717 1.00 0.00 H new ATOM 0 HD1 HIS A 71 5.590 12.704 -3.418 1.00 0.00 H new ATOM 0 HD2 HIS A 71 9.760 12.819 -3.627 1.00 0.00 H new ATOM 0 HE1 HIS A 71 6.198 14.956 -4.393 1.00 0.00 H new ATOM 1049 N GLY A 72 7.349 8.236 -5.248 1.00 0.00 N ATOM 1050 CA GLY A 72 6.430 7.984 -6.302 1.00 0.00 C ATOM 1051 C GLY A 72 7.076 8.074 -7.616 1.00 0.00 C ATOM 1052 O GLY A 72 7.183 9.154 -8.214 1.00 0.00 O ATOM 0 H GLY A 72 7.880 7.433 -4.910 1.00 0.00 H new ATOM 0 HA2 GLY A 72 5.995 6.992 -6.177 1.00 0.00 H new ATOM 0 HA3 GLY A 72 5.610 8.700 -6.249 1.00 0.00 H new ATOM 1056 N GLY A 73 7.534 6.984 -8.058 1.00 0.00 N ATOM 1057 CA GLY A 73 8.127 6.924 -9.316 1.00 0.00 C ATOM 1058 C GLY A 73 8.324 5.517 -9.739 1.00 0.00 C ATOM 1059 O GLY A 73 8.724 4.676 -8.935 1.00 0.00 O ATOM 0 H GLY A 73 7.508 6.099 -7.552 1.00 0.00 H new ATOM 0 HA2 GLY A 73 7.502 7.443 -10.043 1.00 0.00 H new ATOM 0 HA3 GLY A 73 9.087 7.440 -9.295 1.00 0.00 H new ATOM 1063 N PRO A 74 8.143 5.232 -11.014 1.00 0.00 N ATOM 1064 CA PRO A 74 8.326 3.911 -11.550 1.00 0.00 C ATOM 1065 C PRO A 74 9.777 3.713 -11.911 1.00 0.00 C ATOM 1066 O PRO A 74 10.188 2.642 -12.313 1.00 0.00 O ATOM 1067 CB PRO A 74 7.448 3.926 -12.800 1.00 0.00 C ATOM 1068 CG PRO A 74 7.521 5.334 -13.287 1.00 0.00 C ATOM 1069 CD PRO A 74 7.730 6.193 -12.066 1.00 0.00 C ATOM 0 HA PRO A 74 8.064 3.108 -10.861 1.00 0.00 H new ATOM 0 HB2 PRO A 74 7.814 3.226 -13.551 1.00 0.00 H new ATOM 0 HB3 PRO A 74 6.422 3.638 -12.569 1.00 0.00 H new ATOM 0 HG2 PRO A 74 8.340 5.459 -13.995 1.00 0.00 H new ATOM 0 HG3 PRO A 74 6.605 5.614 -13.807 1.00 0.00 H new ATOM 0 HD2 PRO A 74 8.495 6.950 -12.237 1.00 0.00 H new ATOM 0 HD3 PRO A 74 6.817 6.720 -11.788 1.00 0.00 H new ATOM 1077 N LYS A 75 10.578 4.760 -11.662 1.00 0.00 N ATOM 1078 CA LYS A 75 11.962 4.815 -12.094 1.00 0.00 C ATOM 1079 C LYS A 75 12.860 4.114 -11.075 1.00 0.00 C ATOM 1080 O LYS A 75 13.967 4.573 -10.800 1.00 0.00 O ATOM 1081 CB LYS A 75 12.408 6.262 -12.357 1.00 0.00 C ATOM 1082 CG LYS A 75 13.328 6.513 -13.601 1.00 0.00 C ATOM 1083 CD LYS A 75 14.731 5.859 -13.540 1.00 0.00 C ATOM 1084 CE LYS A 75 14.710 4.363 -13.857 1.00 0.00 C ATOM 1085 NZ LYS A 75 16.036 3.734 -13.711 1.00 0.00 N ATOM 0 H LYS A 75 10.273 5.590 -11.153 1.00 0.00 H new ATOM 0 HA LYS A 75 12.053 4.284 -13.041 1.00 0.00 H new ATOM 0 HB2 LYS A 75 11.514 6.876 -12.468 1.00 0.00 H new ATOM 0 HB3 LYS A 75 12.932 6.620 -11.471 1.00 0.00 H new ATOM 0 HG2 LYS A 75 12.814 6.146 -14.490 1.00 0.00 H new ATOM 0 HG3 LYS A 75 13.454 7.588 -13.726 1.00 0.00 H new ATOM 0 HD2 LYS A 75 15.392 6.364 -14.244 1.00 0.00 H new ATOM 0 HD3 LYS A 75 15.152 6.008 -12.546 1.00 0.00 H new ATOM 0 HE2 LYS A 75 14.001 3.865 -13.196 1.00 0.00 H new ATOM 0 HE3 LYS A 75 14.352 4.216 -14.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 15.967 2.721 -13.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 16.709 4.188 -14.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 16.368 3.848 -12.732 1.00 0.00 H new ATOM 1099 N ASP A 76 12.274 3.154 -10.403 1.00 0.00 N ATOM 1100 CA ASP A 76 12.975 2.138 -9.631 1.00 0.00 C ATOM 1101 C ASP A 76 11.936 1.217 -9.015 1.00 0.00 C ATOM 1102 O ASP A 76 11.972 0.848 -7.833 1.00 0.00 O ATOM 1103 CB ASP A 76 13.904 2.693 -8.595 1.00 0.00 C ATOM 1104 CG ASP A 76 14.993 1.734 -8.218 1.00 0.00 C ATOM 1105 OD1 ASP A 76 14.712 0.595 -7.866 1.00 0.00 O ATOM 1106 OD2 ASP A 76 16.191 2.100 -8.304 1.00 0.00 O ATOM 0 H ASP A 76 11.260 3.048 -10.373 1.00 0.00 H new ATOM 0 HA ASP A 76 13.627 1.586 -10.308 1.00 0.00 H new ATOM 0 HB2 ASP A 76 14.351 3.614 -8.970 1.00 0.00 H new ATOM 0 HB3 ASP A 76 13.333 2.955 -7.705 1.00 0.00 H new ATOM 1111 N GLU A 77 10.944 0.955 -9.844 1.00 0.00 N ATOM 1112 CA GLU A 77 9.914 -0.046 -9.645 1.00 0.00 C ATOM 1113 C GLU A 77 8.949 0.248 -8.516 1.00 0.00 C ATOM 1114 O GLU A 77 8.136 -0.626 -8.175 1.00 0.00 O ATOM 1115 CB GLU A 77 10.553 -1.430 -9.526 1.00 0.00 C ATOM 1116 CG GLU A 77 11.387 -1.774 -10.750 1.00 0.00 C ATOM 1117 CD GLU A 77 12.053 -3.104 -10.662 1.00 0.00 C ATOM 1118 OE1 GLU A 77 11.441 -4.115 -11.066 1.00 0.00 O ATOM 1119 OE2 GLU A 77 13.231 -3.169 -10.234 1.00 0.00 O ATOM 0 H GLU A 77 10.829 1.462 -10.721 1.00 0.00 H new ATOM 0 HA GLU A 77 9.280 -0.019 -10.531 1.00 0.00 H new ATOM 0 HB2 GLU A 77 11.182 -1.465 -8.636 1.00 0.00 H new ATOM 0 HB3 GLU A 77 9.773 -2.180 -9.395 1.00 0.00 H new ATOM 0 HG2 GLU A 77 10.747 -1.755 -11.632 1.00 0.00 H new ATOM 0 HG3 GLU A 77 12.147 -1.005 -10.890 1.00 0.00 H new ATOM 1126 N GLU A 78 9.034 1.486 -7.944 1.00 0.00 N ATOM 1127 CA GLU A 78 8.129 1.961 -6.900 1.00 0.00 C ATOM 1128 C GLU A 78 8.326 1.060 -5.671 1.00 0.00 C ATOM 1129 O GLU A 78 7.427 0.895 -4.867 1.00 0.00 O ATOM 1130 CB GLU A 78 6.665 1.930 -7.420 1.00 0.00 C ATOM 1131 CG GLU A 78 5.695 2.819 -6.661 1.00 0.00 C ATOM 1132 CD GLU A 78 5.924 4.286 -6.928 1.00 0.00 C ATOM 1133 OE1 GLU A 78 6.928 4.841 -6.464 1.00 0.00 O ATOM 1134 OE2 GLU A 78 5.072 4.912 -7.617 1.00 0.00 O ATOM 0 H GLU A 78 9.742 2.171 -8.209 1.00 0.00 H new ATOM 0 HA GLU A 78 8.345 2.993 -6.624 1.00 0.00 H new ATOM 0 HB2 GLU A 78 6.662 2.227 -8.469 1.00 0.00 H new ATOM 0 HB3 GLU A 78 6.302 0.903 -7.378 1.00 0.00 H new ATOM 0 HG2 GLU A 78 4.674 2.558 -6.939 1.00 0.00 H new ATOM 0 HG3 GLU A 78 5.793 2.628 -5.592 1.00 0.00 H new ATOM 1141 N ARG A 79 9.627 0.682 -5.455 1.00 0.00 N ATOM 1142 CA ARG A 79 10.103 -0.438 -4.542 1.00 0.00 C ATOM 1143 C ARG A 79 9.638 -0.462 -3.087 1.00 0.00 C ATOM 1144 O ARG A 79 10.148 -1.250 -2.312 1.00 0.00 O ATOM 1145 CB ARG A 79 11.610 -0.762 -4.660 1.00 0.00 C ATOM 1146 CG ARG A 79 11.934 -1.698 -5.826 1.00 0.00 C ATOM 1147 CD ARG A 79 13.358 -2.271 -5.750 1.00 0.00 C ATOM 1148 NE ARG A 79 14.394 -1.276 -6.025 1.00 0.00 N ATOM 1149 CZ ARG A 79 15.682 -1.327 -5.630 1.00 0.00 C ATOM 1150 NH1 ARG A 79 16.148 -2.335 -4.895 1.00 0.00 N ATOM 1151 NH2 ARG A 79 16.508 -0.374 -6.020 1.00 0.00 N ATOM 0 H ARG A 79 10.403 1.155 -5.919 1.00 0.00 H new ATOM 0 HA ARG A 79 9.531 -1.255 -4.983 1.00 0.00 H new ATOM 0 HB2 ARG A 79 12.167 0.167 -4.783 1.00 0.00 H new ATOM 0 HB3 ARG A 79 11.951 -1.218 -3.731 1.00 0.00 H new ATOM 0 HG2 ARG A 79 11.217 -2.519 -5.837 1.00 0.00 H new ATOM 0 HG3 ARG A 79 11.814 -1.157 -6.765 1.00 0.00 H new ATOM 0 HD2 ARG A 79 13.521 -2.691 -4.758 1.00 0.00 H new ATOM 0 HD3 ARG A 79 13.452 -3.090 -6.463 1.00 0.00 H new ATOM 0 HE ARG A 79 14.114 -0.461 -6.571 1.00 0.00 H new ATOM 0 HH11 ARG A 79 15.526 -3.094 -4.617 1.00 0.00 H new ATOM 0 HH12 ARG A 79 17.127 -2.348 -4.610 1.00 0.00 H new ATOM 0 HH21 ARG A 79 16.168 0.385 -6.611 1.00 0.00 H new ATOM 0 HH22 ARG A 79 17.486 -0.397 -5.731 1.00 0.00 H new ATOM 1165 N HIS A 80 8.799 0.462 -2.733 1.00 0.00 N ATOM 1166 CA HIS A 80 7.928 0.462 -1.544 1.00 0.00 C ATOM 1167 C HIS A 80 7.409 1.788 -1.226 1.00 0.00 C ATOM 1168 O HIS A 80 7.116 2.102 -0.090 1.00 0.00 O ATOM 1169 CB HIS A 80 8.348 -0.346 -0.319 1.00 0.00 C ATOM 1170 CG HIS A 80 7.704 -1.696 -0.359 1.00 0.00 C ATOM 1171 ND1 HIS A 80 8.296 -2.798 -0.909 1.00 0.00 N ATOM 1172 CD2 HIS A 80 6.467 -2.085 0.002 1.00 0.00 C ATOM 1173 CE1 HIS A 80 7.449 -3.801 -0.886 1.00 0.00 C ATOM 1174 NE2 HIS A 80 6.330 -3.394 -0.343 1.00 0.00 N ATOM 0 H HIS A 80 8.678 1.307 -3.292 1.00 0.00 H new ATOM 0 HA HIS A 80 7.099 -0.154 -1.891 1.00 0.00 H new ATOM 0 HB2 HIS A 80 9.433 -0.451 -0.295 1.00 0.00 H new ATOM 0 HB3 HIS A 80 8.058 0.179 0.591 1.00 0.00 H new ATOM 0 HD1 HIS A 80 9.246 -2.835 -1.279 1.00 0.00 H new ATOM 0 HD2 HIS A 80 5.719 -1.470 0.479 1.00 0.00 H new ATOM 0 HE1 HIS A 80 7.644 -4.797 -1.254 1.00 0.00 H new ATOM 0 HE2 HIS A 80 5.495 -3.963 -0.202 1.00 0.00 H new ATOM 1183 N VAL A 81 7.270 2.587 -2.254 1.00 0.00 N ATOM 1184 CA VAL A 81 6.653 3.865 -2.088 1.00 0.00 C ATOM 1185 C VAL A 81 5.185 3.588 -2.156 1.00 0.00 C ATOM 1186 O VAL A 81 4.351 4.352 -1.673 1.00 0.00 O ATOM 1187 CB VAL A 81 6.982 4.847 -3.222 1.00 0.00 C ATOM 1188 CG1 VAL A 81 6.651 6.266 -2.803 1.00 0.00 C ATOM 1189 CG2 VAL A 81 8.412 4.724 -3.684 1.00 0.00 C ATOM 0 H VAL A 81 7.575 2.372 -3.203 1.00 0.00 H new ATOM 0 HA VAL A 81 6.999 4.319 -1.160 1.00 0.00 H new ATOM 0 HB VAL A 81 6.359 4.587 -4.078 1.00 0.00 H new ATOM 0 HG11 VAL A 81 6.890 6.951 -3.617 1.00 0.00 H new ATOM 0 HG12 VAL A 81 5.589 6.338 -2.568 1.00 0.00 H new ATOM 0 HG13 VAL A 81 7.236 6.531 -1.922 1.00 0.00 H new ATOM 0 HG21 VAL A 81 8.598 5.438 -4.486 1.00 0.00 H new ATOM 0 HG22 VAL A 81 9.083 4.932 -2.851 1.00 0.00 H new ATOM 0 HG23 VAL A 81 8.591 3.713 -4.049 1.00 0.00 H new ATOM 1199 N GLY A 82 4.889 2.479 -2.796 1.00 0.00 N ATOM 1200 CA GLY A 82 3.595 2.027 -2.948 1.00 0.00 C ATOM 1201 C GLY A 82 3.559 0.764 -3.679 1.00 0.00 C ATOM 1202 O GLY A 82 4.094 0.700 -4.761 1.00 0.00 O ATOM 0 H GLY A 82 5.590 1.875 -3.225 1.00 0.00 H new ATOM 0 HA2 GLY A 82 3.135 1.896 -1.968 1.00 0.00 H new ATOM 0 HA3 GLY A 82 3.006 2.775 -3.479 1.00 0.00 H new ATOM 1206 N ASP A 83 2.975 -0.253 -3.091 1.00 0.00 N ATOM 1207 CA ASP A 83 2.789 -1.494 -3.784 1.00 0.00 C ATOM 1208 C ASP A 83 1.761 -1.240 -4.852 1.00 0.00 C ATOM 1209 O ASP A 83 0.585 -1.008 -4.582 1.00 0.00 O ATOM 1210 CB ASP A 83 2.374 -2.625 -2.831 1.00 0.00 C ATOM 1211 CG ASP A 83 3.435 -2.907 -1.778 1.00 0.00 C ATOM 1212 OD1 ASP A 83 3.428 -2.248 -0.738 1.00 0.00 O ATOM 1213 OD2 ASP A 83 4.318 -3.771 -1.991 1.00 0.00 O ATOM 0 H ASP A 83 2.622 -0.240 -2.134 1.00 0.00 H new ATOM 0 HA ASP A 83 3.724 -1.832 -4.231 1.00 0.00 H new ATOM 0 HB2 ASP A 83 1.438 -2.359 -2.339 1.00 0.00 H new ATOM 0 HB3 ASP A 83 2.185 -3.532 -3.406 1.00 0.00 H new ATOM 1218 N LEU A 84 2.250 -1.220 -6.054 1.00 0.00 N ATOM 1219 CA LEU A 84 1.527 -0.802 -7.219 1.00 0.00 C ATOM 1220 C LEU A 84 0.408 -1.754 -7.603 1.00 0.00 C ATOM 1221 O LEU A 84 0.591 -2.739 -8.346 1.00 0.00 O ATOM 1222 CB LEU A 84 2.501 -0.570 -8.387 1.00 0.00 C ATOM 1223 CG LEU A 84 1.910 -0.042 -9.693 1.00 0.00 C ATOM 1224 CD1 LEU A 84 1.245 1.308 -9.480 1.00 0.00 C ATOM 1225 CD2 LEU A 84 2.993 0.058 -10.750 1.00 0.00 C ATOM 0 H LEU A 84 3.207 -1.507 -6.260 1.00 0.00 H new ATOM 0 HA LEU A 84 1.036 0.140 -6.974 1.00 0.00 H new ATOM 0 HB2 LEU A 84 3.267 0.131 -8.055 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.004 -1.513 -8.600 1.00 0.00 H new ATOM 0 HG LEU A 84 1.147 -0.741 -10.036 1.00 0.00 H new ATOM 0 HD11 LEU A 84 0.832 1.663 -10.424 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.443 1.207 -8.748 1.00 0.00 H new ATOM 0 HD13 LEU A 84 1.982 2.023 -9.115 1.00 0.00 H new ATOM 0 HD21 LEU A 84 2.562 0.435 -11.678 1.00 0.00 H new ATOM 0 HD22 LEU A 84 3.773 0.739 -10.409 1.00 0.00 H new ATOM 0 HD23 LEU A 84 3.423 -0.928 -10.924 1.00 0.00 H new ATOM 1237 N GLY A 85 -0.723 -1.462 -7.042 1.00 0.00 N ATOM 1238 CA GLY A 85 -1.940 -2.120 -7.328 1.00 0.00 C ATOM 1239 C GLY A 85 -3.024 -1.090 -7.367 1.00 0.00 C ATOM 1240 O GLY A 85 -3.029 -0.180 -6.530 1.00 0.00 O ATOM 0 H GLY A 85 -0.818 -0.725 -6.343 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -1.876 -2.642 -8.283 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -2.155 -2.871 -6.568 1.00 0.00 H new ATOM 1244 N ASN A 86 -3.924 -1.194 -8.301 1.00 0.00 N ATOM 1245 CA ASN A 86 -4.944 -0.154 -8.453 1.00 0.00 C ATOM 1246 C ASN A 86 -6.254 -0.714 -8.033 1.00 0.00 C ATOM 1247 O ASN A 86 -6.643 -1.771 -8.521 1.00 0.00 O ATOM 1248 CB ASN A 86 -5.046 0.283 -9.921 1.00 0.00 C ATOM 1249 CG ASN A 86 -6.041 1.417 -10.130 1.00 0.00 C ATOM 1250 OD1 ASN A 86 -6.193 2.294 -9.285 1.00 0.00 O ATOM 1251 ND2 ASN A 86 -6.756 1.381 -11.228 1.00 0.00 N ATOM 0 H ASN A 86 -3.988 -1.965 -8.965 1.00 0.00 H new ATOM 0 HA ASN A 86 -4.674 0.707 -7.842 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -4.063 0.599 -10.271 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -5.342 -0.571 -10.530 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -7.463 2.096 -11.400 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -6.605 0.638 -11.911 1.00 0.00 H new ATOM 1258 N VAL A 87 -6.977 -0.041 -7.164 1.00 0.00 N ATOM 1259 CA VAL A 87 -8.208 -0.594 -6.740 1.00 0.00 C ATOM 1260 C VAL A 87 -9.324 0.407 -6.872 1.00 0.00 C ATOM 1261 O VAL A 87 -9.081 1.609 -6.907 1.00 0.00 O ATOM 1262 CB VAL A 87 -8.132 -1.225 -5.329 1.00 0.00 C ATOM 1263 CG1 VAL A 87 -7.520 -2.618 -5.379 1.00 0.00 C ATOM 1264 CG2 VAL A 87 -7.306 -0.387 -4.399 1.00 0.00 C ATOM 0 H VAL A 87 -6.730 0.861 -6.758 1.00 0.00 H new ATOM 0 HA VAL A 87 -8.435 -1.423 -7.410 1.00 0.00 H new ATOM 0 HB VAL A 87 -9.156 -1.283 -4.961 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -7.480 -3.034 -4.372 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -8.130 -3.261 -6.014 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -6.511 -2.558 -5.787 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -7.273 -0.858 -3.417 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -6.294 -0.297 -4.793 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -7.750 0.604 -4.311 1.00 0.00 H new ATOM 1274 N THR A 88 -10.537 -0.078 -6.983 1.00 0.00 N ATOM 1275 CA THR A 88 -11.667 0.773 -7.206 1.00 0.00 C ATOM 1276 C THR A 88 -12.846 0.419 -6.298 1.00 0.00 C ATOM 1277 O THR A 88 -13.595 -0.500 -6.559 1.00 0.00 O ATOM 1278 CB THR A 88 -12.070 0.756 -8.702 1.00 0.00 C ATOM 1279 OG1 THR A 88 -11.918 -0.584 -9.238 1.00 0.00 O ATOM 1280 CG2 THR A 88 -11.234 1.739 -9.516 1.00 0.00 C ATOM 0 H THR A 88 -10.762 -1.071 -6.921 1.00 0.00 H new ATOM 0 HA THR A 88 -11.373 1.789 -6.943 1.00 0.00 H new ATOM 0 HB THR A 88 -13.114 1.063 -8.774 1.00 0.00 H new ATOM 0 HG1 THR A 88 -12.176 -0.589 -10.183 1.00 0.00 H new ATOM 0 HG21 THR A 88 -11.543 1.701 -10.561 1.00 0.00 H new ATOM 0 HG22 THR A 88 -11.381 2.748 -9.130 1.00 0.00 H new ATOM 0 HG23 THR A 88 -10.180 1.471 -9.439 1.00 0.00 H new ATOM 1288 N ALA A 89 -12.930 1.136 -5.221 1.00 0.00 N ATOM 1289 CA ALA A 89 -13.948 1.069 -4.228 1.00 0.00 C ATOM 1290 C ALA A 89 -15.034 2.080 -4.564 1.00 0.00 C ATOM 1291 O ALA A 89 -14.837 2.964 -5.402 1.00 0.00 O ATOM 1292 CB ALA A 89 -13.366 1.330 -2.846 1.00 0.00 C ATOM 0 H ALA A 89 -12.227 1.841 -4.999 1.00 0.00 H new ATOM 0 HA ALA A 89 -14.382 0.069 -4.216 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -14.159 1.275 -2.101 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -12.606 0.581 -2.624 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -12.915 2.322 -2.823 1.00 0.00 H new ATOM 1298 N ASP A 90 -16.186 1.841 -4.085 1.00 0.00 N ATOM 1299 CA ASP A 90 -17.299 2.755 -4.250 1.00 0.00 C ATOM 1300 C ASP A 90 -18.013 2.828 -2.895 1.00 0.00 C ATOM 1301 O ASP A 90 -17.481 2.318 -1.946 1.00 0.00 O ATOM 1302 CB ASP A 90 -18.237 2.276 -5.375 1.00 0.00 C ATOM 1303 CG ASP A 90 -19.217 3.344 -5.805 1.00 0.00 C ATOM 1304 OD1 ASP A 90 -18.830 4.239 -6.570 1.00 0.00 O ATOM 1305 OD2 ASP A 90 -20.371 3.324 -5.345 1.00 0.00 O ATOM 0 H ASP A 90 -16.413 1.000 -3.555 1.00 0.00 H new ATOM 0 HA ASP A 90 -16.959 3.747 -4.547 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -17.641 1.967 -6.234 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -18.787 1.398 -5.036 1.00 0.00 H new ATOM 1310 N LYS A 91 -19.208 3.407 -2.837 1.00 0.00 N ATOM 1311 CA LYS A 91 -20.031 3.616 -1.599 1.00 0.00 C ATOM 1312 C LYS A 91 -20.069 2.418 -0.659 1.00 0.00 C ATOM 1313 O LYS A 91 -20.088 2.565 0.559 1.00 0.00 O ATOM 1314 CB LYS A 91 -21.466 3.985 -1.994 1.00 0.00 C ATOM 1315 CG LYS A 91 -22.365 4.332 -0.810 1.00 0.00 C ATOM 1316 CD LYS A 91 -23.757 4.744 -1.246 1.00 0.00 C ATOM 1317 CE LYS A 91 -24.469 3.628 -1.983 1.00 0.00 C ATOM 1318 NZ LYS A 91 -25.846 3.992 -2.324 1.00 0.00 N ATOM 0 H LYS A 91 -19.669 3.766 -3.673 1.00 0.00 H new ATOM 0 HA LYS A 91 -19.545 4.423 -1.051 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -21.437 4.834 -2.677 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -21.907 3.152 -2.541 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -22.435 3.471 -0.145 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -21.912 5.141 -0.237 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -24.341 5.033 -0.372 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -23.692 5.621 -1.890 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -23.921 3.387 -2.894 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -24.473 2.730 -1.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -26.299 3.203 -2.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -26.376 4.198 -1.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -25.842 4.834 -2.934 1.00 0.00 H new ATOM 1332 N ASP A 92 -20.132 1.273 -1.229 1.00 0.00 N ATOM 1333 CA ASP A 92 -20.128 0.006 -0.502 1.00 0.00 C ATOM 1334 C ASP A 92 -19.161 -0.891 -1.243 1.00 0.00 C ATOM 1335 O ASP A 92 -18.905 -2.046 -0.883 1.00 0.00 O ATOM 1336 CB ASP A 92 -21.551 -0.597 -0.517 1.00 0.00 C ATOM 1337 CG ASP A 92 -21.698 -1.862 0.299 1.00 0.00 C ATOM 1338 OD1 ASP A 92 -21.925 -1.777 1.521 1.00 0.00 O ATOM 1339 OD2 ASP A 92 -21.615 -2.964 -0.248 1.00 0.00 O ATOM 0 H ASP A 92 -20.190 1.160 -2.241 1.00 0.00 H new ATOM 0 HA ASP A 92 -19.831 0.127 0.540 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -22.253 0.148 -0.141 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -21.833 -0.809 -1.548 1.00 0.00 H new ATOM 1344 N GLY A 93 -18.542 -0.261 -2.229 1.00 0.00 N ATOM 1345 CA GLY A 93 -17.727 -0.904 -3.200 1.00 0.00 C ATOM 1346 C GLY A 93 -16.537 -1.549 -2.617 1.00 0.00 C ATOM 1347 O GLY A 93 -16.140 -1.242 -1.517 1.00 0.00 O ATOM 0 H GLY A 93 -18.607 0.748 -2.364 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -18.319 -1.654 -3.725 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -17.410 -0.172 -3.942 1.00 0.00 H new ATOM 1351 N VAL A 94 -15.892 -2.289 -3.419 1.00 0.00 N ATOM 1352 CA VAL A 94 -14.924 -3.208 -3.028 1.00 0.00 C ATOM 1353 C VAL A 94 -13.774 -3.060 -3.926 1.00 0.00 C ATOM 1354 O VAL A 94 -13.912 -2.955 -5.144 1.00 0.00 O ATOM 1355 CB VAL A 94 -15.433 -4.700 -3.071 1.00 0.00 C ATOM 1356 CG1 VAL A 94 -16.457 -4.963 -1.993 1.00 0.00 C ATOM 1357 CG2 VAL A 94 -16.019 -5.070 -4.438 1.00 0.00 C ATOM 0 H VAL A 94 -16.038 -2.264 -4.428 1.00 0.00 H new ATOM 0 HA VAL A 94 -14.660 -3.000 -1.991 1.00 0.00 H new ATOM 0 HB VAL A 94 -14.560 -5.328 -2.893 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -16.787 -6.000 -2.050 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -16.012 -4.777 -1.015 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -17.312 -4.302 -2.134 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -16.357 -6.106 -4.421 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -16.863 -4.417 -4.661 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -15.255 -4.950 -5.206 1.00 0.00 H new ATOM 1367 N ALA A 95 -12.679 -2.986 -3.352 1.00 0.00 N ATOM 1368 CA ALA A 95 -11.491 -2.940 -4.045 1.00 0.00 C ATOM 1369 C ALA A 95 -11.014 -4.342 -4.065 1.00 0.00 C ATOM 1370 O ALA A 95 -10.403 -4.784 -3.125 1.00 0.00 O ATOM 1371 CB ALA A 95 -10.542 -2.056 -3.294 1.00 0.00 C ATOM 0 H ALA A 95 -12.573 -2.954 -2.338 1.00 0.00 H new ATOM 0 HA ALA A 95 -11.585 -2.542 -5.055 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -9.593 -2.006 -3.827 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -10.965 -1.055 -3.211 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -10.377 -2.464 -2.297 1.00 0.00 H new ATOM 1377 N ASP A 96 -11.417 -5.067 -5.078 1.00 0.00 N ATOM 1378 CA ASP A 96 -11.062 -6.452 -5.217 1.00 0.00 C ATOM 1379 C ASP A 96 -10.354 -6.568 -6.508 1.00 0.00 C ATOM 1380 O ASP A 96 -10.963 -6.721 -7.579 1.00 0.00 O ATOM 1381 CB ASP A 96 -12.318 -7.356 -5.205 1.00 0.00 C ATOM 1382 CG ASP A 96 -12.009 -8.848 -5.311 1.00 0.00 C ATOM 1383 OD1 ASP A 96 -11.789 -9.360 -6.439 1.00 0.00 O ATOM 1384 OD2 ASP A 96 -12.001 -9.533 -4.278 1.00 0.00 O ATOM 0 H ASP A 96 -12.003 -4.709 -5.832 1.00 0.00 H new ATOM 0 HA ASP A 96 -10.436 -6.778 -4.386 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -12.875 -7.175 -4.286 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -12.967 -7.070 -6.033 1.00 0.00 H new ATOM 1389 N VAL A 97 -9.095 -6.389 -6.449 1.00 0.00 N ATOM 1390 CA VAL A 97 -8.290 -6.420 -7.607 1.00 0.00 C ATOM 1391 C VAL A 97 -7.165 -7.372 -7.387 1.00 0.00 C ATOM 1392 O VAL A 97 -6.662 -7.520 -6.268 1.00 0.00 O ATOM 1393 CB VAL A 97 -7.796 -4.996 -8.046 1.00 0.00 C ATOM 1394 CG1 VAL A 97 -6.945 -5.059 -9.312 1.00 0.00 C ATOM 1395 CG2 VAL A 97 -8.986 -4.078 -8.298 1.00 0.00 C ATOM 0 H VAL A 97 -8.584 -6.214 -5.584 1.00 0.00 H new ATOM 0 HA VAL A 97 -8.895 -6.772 -8.442 1.00 0.00 H new ATOM 0 HB VAL A 97 -7.185 -4.603 -7.234 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -6.622 -4.054 -9.584 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -6.071 -5.685 -9.132 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -7.534 -5.483 -10.125 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.629 -3.094 -8.602 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -9.608 -4.498 -9.088 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -9.573 -3.985 -7.385 1.00 0.00 H new ATOM 1405 N SER A 98 -6.821 -8.027 -8.414 1.00 0.00 N ATOM 1406 CA SER A 98 -5.781 -8.987 -8.405 1.00 0.00 C ATOM 1407 C SER A 98 -4.597 -8.374 -9.091 1.00 0.00 C ATOM 1408 O SER A 98 -4.568 -8.226 -10.315 1.00 0.00 O ATOM 1409 CB SER A 98 -6.261 -10.286 -9.064 1.00 0.00 C ATOM 1410 OG SER A 98 -7.047 -10.009 -10.229 1.00 0.00 O ATOM 0 H SER A 98 -7.266 -7.913 -9.324 1.00 0.00 H new ATOM 0 HA SER A 98 -5.488 -9.259 -7.391 1.00 0.00 H new ATOM 0 HB2 SER A 98 -5.402 -10.899 -9.337 1.00 0.00 H new ATOM 0 HB3 SER A 98 -6.850 -10.863 -8.352 1.00 0.00 H new ATOM 0 HG SER A 98 -6.604 -9.319 -10.766 1.00 0.00 H new ATOM 1416 N ILE A 99 -3.672 -7.954 -8.303 1.00 0.00 N ATOM 1417 CA ILE A 99 -2.559 -7.234 -8.782 1.00 0.00 C ATOM 1418 C ILE A 99 -1.331 -8.089 -8.764 1.00 0.00 C ATOM 1419 O ILE A 99 -1.180 -8.983 -7.925 1.00 0.00 O ATOM 1420 CB ILE A 99 -2.313 -5.879 -8.026 1.00 0.00 C ATOM 1421 CG1 ILE A 99 -1.888 -6.049 -6.522 1.00 0.00 C ATOM 1422 CG2 ILE A 99 -3.554 -5.008 -8.126 1.00 0.00 C ATOM 1423 CD1 ILE A 99 -2.969 -6.540 -5.558 1.00 0.00 C ATOM 0 H ILE A 99 -3.672 -8.106 -7.294 1.00 0.00 H new ATOM 0 HA ILE A 99 -2.791 -6.962 -9.812 1.00 0.00 H new ATOM 0 HB ILE A 99 -1.467 -5.401 -8.519 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -1.052 -6.747 -6.481 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -1.520 -5.089 -6.161 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -3.382 -4.068 -7.601 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -3.772 -4.804 -9.174 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -4.400 -5.526 -7.674 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -2.553 -6.616 -4.553 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -3.800 -5.835 -5.554 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -3.325 -7.519 -5.879 1.00 0.00 H new ATOM 1435 N GLU A 100 -0.488 -7.847 -9.700 1.00 0.00 N ATOM 1436 CA GLU A 100 0.733 -8.551 -9.830 1.00 0.00 C ATOM 1437 C GLU A 100 1.741 -7.605 -10.443 1.00 0.00 C ATOM 1438 O GLU A 100 1.510 -7.091 -11.513 1.00 0.00 O ATOM 1439 CB GLU A 100 0.506 -9.801 -10.709 1.00 0.00 C ATOM 1440 CG GLU A 100 -0.073 -9.505 -12.096 1.00 0.00 C ATOM 1441 CD GLU A 100 -0.378 -10.733 -12.896 1.00 0.00 C ATOM 1442 OE1 GLU A 100 0.547 -11.489 -13.224 1.00 0.00 O ATOM 1443 OE2 GLU A 100 -1.557 -10.955 -13.240 1.00 0.00 O ATOM 0 H GLU A 100 -0.633 -7.135 -10.416 1.00 0.00 H new ATOM 0 HA GLU A 100 1.108 -8.894 -8.866 1.00 0.00 H new ATOM 0 HB2 GLU A 100 1.456 -10.322 -10.829 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -0.167 -10.480 -10.186 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -0.986 -8.921 -11.982 1.00 0.00 H new ATOM 0 HG3 GLU A 100 0.633 -8.887 -12.650 1.00 0.00 H new ATOM 1450 N ASP A 101 2.795 -7.297 -9.738 1.00 0.00 N ATOM 1451 CA ASP A 101 3.842 -6.432 -10.275 1.00 0.00 C ATOM 1452 C ASP A 101 5.051 -6.568 -9.388 1.00 0.00 C ATOM 1453 O ASP A 101 4.899 -6.997 -8.234 1.00 0.00 O ATOM 1454 CB ASP A 101 3.366 -4.969 -10.317 1.00 0.00 C ATOM 1455 CG ASP A 101 4.302 -4.099 -11.095 1.00 0.00 C ATOM 1456 OD1 ASP A 101 4.266 -4.157 -12.349 1.00 0.00 O ATOM 1457 OD2 ASP A 101 5.088 -3.386 -10.494 1.00 0.00 O ATOM 0 H ASP A 101 2.963 -7.626 -8.787 1.00 0.00 H new ATOM 0 HA ASP A 101 4.087 -6.726 -11.296 1.00 0.00 H new ATOM 0 HB2 ASP A 101 2.373 -4.923 -10.763 1.00 0.00 H new ATOM 0 HB3 ASP A 101 3.276 -4.587 -9.300 1.00 0.00 H new ATOM 1462 N SER A 102 6.241 -6.232 -9.859 1.00 0.00 N ATOM 1463 CA SER A 102 7.366 -6.364 -8.995 1.00 0.00 C ATOM 1464 C SER A 102 7.676 -5.010 -8.449 1.00 0.00 C ATOM 1465 O SER A 102 8.555 -4.267 -8.914 1.00 0.00 O ATOM 1466 CB SER A 102 8.578 -6.983 -9.699 1.00 0.00 C ATOM 1467 OG SER A 102 8.279 -8.278 -10.222 1.00 0.00 O ATOM 0 H SER A 102 6.434 -5.882 -10.797 1.00 0.00 H new ATOM 0 HA SER A 102 7.124 -7.053 -8.186 1.00 0.00 H new ATOM 0 HB2 SER A 102 8.902 -6.329 -10.509 1.00 0.00 H new ATOM 0 HB3 SER A 102 9.409 -7.057 -8.997 1.00 0.00 H new ATOM 0 HG SER A 102 8.823 -8.442 -11.020 1.00 0.00 H new ATOM 1473 N VAL A 103 6.862 -4.684 -7.532 1.00 0.00 N ATOM 1474 CA VAL A 103 6.922 -3.500 -6.772 1.00 0.00 C ATOM 1475 C VAL A 103 7.058 -3.902 -5.316 1.00 0.00 C ATOM 1476 O VAL A 103 7.523 -3.145 -4.455 1.00 0.00 O ATOM 1477 CB VAL A 103 5.644 -2.681 -7.032 1.00 0.00 C ATOM 1478 CG1 VAL A 103 4.395 -3.503 -6.738 1.00 0.00 C ATOM 1479 CG2 VAL A 103 5.657 -1.414 -6.240 1.00 0.00 C ATOM 0 H VAL A 103 6.076 -5.279 -7.270 1.00 0.00 H new ATOM 0 HA VAL A 103 7.773 -2.876 -7.045 1.00 0.00 H new ATOM 0 HB VAL A 103 5.622 -2.416 -8.089 1.00 0.00 H new ATOM 0 HG11 VAL A 103 3.508 -2.899 -6.930 1.00 0.00 H new ATOM 0 HG12 VAL A 103 4.380 -4.384 -7.379 1.00 0.00 H new ATOM 0 HG13 VAL A 103 4.402 -3.815 -5.694 1.00 0.00 H new ATOM 0 HG21 VAL A 103 4.745 -0.851 -6.439 1.00 0.00 H new ATOM 0 HG22 VAL A 103 5.713 -1.650 -5.177 1.00 0.00 H new ATOM 0 HG23 VAL A 103 6.522 -0.815 -6.525 1.00 0.00 H new ATOM 1489 N ILE A 104 6.740 -5.176 -5.089 1.00 0.00 N ATOM 1490 CA ILE A 104 6.713 -5.775 -3.784 1.00 0.00 C ATOM 1491 C ILE A 104 8.160 -6.156 -3.425 1.00 0.00 C ATOM 1492 O ILE A 104 8.434 -6.712 -2.356 1.00 0.00 O ATOM 1493 CB ILE A 104 5.837 -7.077 -3.790 1.00 0.00 C ATOM 1494 CG1 ILE A 104 4.540 -6.914 -4.610 1.00 0.00 C ATOM 1495 CG2 ILE A 104 5.485 -7.522 -2.363 1.00 0.00 C ATOM 1496 CD1 ILE A 104 3.536 -5.935 -4.057 1.00 0.00 C ATOM 0 H ILE A 104 6.490 -5.824 -5.836 1.00 0.00 H new ATOM 0 HA ILE A 104 6.288 -5.075 -3.064 1.00 0.00 H new ATOM 0 HB ILE A 104 6.445 -7.845 -4.268 1.00 0.00 H new ATOM 0 HG12 ILE A 104 4.807 -6.601 -5.619 1.00 0.00 H new ATOM 0 HG13 ILE A 104 4.060 -7.889 -4.695 1.00 0.00 H new ATOM 0 HG21 ILE A 104 4.878 -8.426 -2.403 1.00 0.00 H new ATOM 0 HG22 ILE A 104 6.401 -7.725 -1.809 1.00 0.00 H new ATOM 0 HG23 ILE A 104 4.926 -6.731 -1.863 1.00 0.00 H new ATOM 0 HD11 ILE A 104 2.665 -5.899 -4.711 1.00 0.00 H new ATOM 0 HD12 ILE A 104 3.229 -6.252 -3.060 1.00 0.00 H new ATOM 0 HD13 ILE A 104 3.987 -4.944 -3.999 1.00 0.00 H new ATOM 1508 N SER A 105 9.093 -5.811 -4.323 1.00 0.00 N ATOM 1509 CA SER A 105 10.480 -6.083 -4.143 1.00 0.00 C ATOM 1510 C SER A 105 10.961 -5.287 -2.979 1.00 0.00 C ATOM 1511 O SER A 105 10.992 -4.024 -2.996 1.00 0.00 O ATOM 1512 CB SER A 105 11.236 -5.696 -5.417 1.00 0.00 C ATOM 1513 OG SER A 105 10.669 -6.345 -6.557 1.00 0.00 O ATOM 0 H SER A 105 8.878 -5.331 -5.197 1.00 0.00 H new ATOM 0 HA SER A 105 10.650 -7.142 -3.951 1.00 0.00 H new ATOM 0 HB2 SER A 105 11.201 -4.615 -5.553 1.00 0.00 H new ATOM 0 HB3 SER A 105 12.286 -5.971 -5.320 1.00 0.00 H new ATOM 0 HG SER A 105 11.164 -6.084 -7.362 1.00 0.00 H new ATOM 1519 N LEU A 106 11.231 -6.043 -1.926 1.00 0.00 N ATOM 1520 CA LEU A 106 11.603 -5.526 -0.684 1.00 0.00 C ATOM 1521 C LEU A 106 12.940 -4.903 -0.685 1.00 0.00 C ATOM 1522 O LEU A 106 13.968 -5.546 -0.510 1.00 0.00 O ATOM 1523 CB LEU A 106 11.496 -6.564 0.445 1.00 0.00 C ATOM 1524 CG LEU A 106 12.008 -6.109 1.837 1.00 0.00 C ATOM 1525 CD1 LEU A 106 11.299 -4.840 2.314 1.00 0.00 C ATOM 1526 CD2 LEU A 106 11.857 -7.226 2.856 1.00 0.00 C ATOM 0 H LEU A 106 11.186 -7.062 -1.947 1.00 0.00 H new ATOM 0 HA LEU A 106 10.879 -4.735 -0.486 1.00 0.00 H new ATOM 0 HB2 LEU A 106 10.451 -6.859 0.543 1.00 0.00 H new ATOM 0 HB3 LEU A 106 12.052 -7.453 0.148 1.00 0.00 H new ATOM 0 HG LEU A 106 13.067 -5.873 1.736 1.00 0.00 H new ATOM 0 HD11 LEU A 106 11.685 -4.553 3.292 1.00 0.00 H new ATOM 0 HD12 LEU A 106 11.478 -4.034 1.603 1.00 0.00 H new ATOM 0 HD13 LEU A 106 10.228 -5.027 2.387 1.00 0.00 H new ATOM 0 HD21 LEU A 106 12.222 -6.886 3.825 1.00 0.00 H new ATOM 0 HD22 LEU A 106 10.806 -7.502 2.940 1.00 0.00 H new ATOM 0 HD23 LEU A 106 12.435 -8.092 2.534 1.00 0.00 H new ATOM 1538 N SER A 107 12.906 -3.688 -0.988 1.00 0.00 N ATOM 1539 CA SER A 107 13.887 -2.832 -0.631 1.00 0.00 C ATOM 1540 C SER A 107 13.081 -1.648 -0.217 1.00 0.00 C ATOM 1541 O SER A 107 12.734 -0.766 -1.009 1.00 0.00 O ATOM 1542 CB SER A 107 14.860 -2.527 -1.776 1.00 0.00 C ATOM 1543 OG SER A 107 16.041 -1.906 -1.283 1.00 0.00 O ATOM 0 H SER A 107 12.148 -3.258 -1.518 1.00 0.00 H new ATOM 0 HA SER A 107 14.555 -3.211 0.143 1.00 0.00 H new ATOM 0 HB2 SER A 107 15.119 -3.450 -2.295 1.00 0.00 H new ATOM 0 HB3 SER A 107 14.378 -1.875 -2.505 1.00 0.00 H new ATOM 0 HG SER A 107 16.712 -1.866 -1.996 1.00 0.00 H new ATOM 1549 N GLY A 108 12.685 -1.717 1.001 1.00 0.00 N ATOM 1550 CA GLY A 108 11.885 -0.705 1.595 1.00 0.00 C ATOM 1551 C GLY A 108 12.587 -0.166 2.770 1.00 0.00 C ATOM 1552 O GLY A 108 13.825 -0.015 2.735 1.00 0.00 O ATOM 0 H GLY A 108 12.911 -2.491 1.626 1.00 0.00 H new ATOM 0 HA2 GLY A 108 11.689 0.090 0.876 1.00 0.00 H new ATOM 0 HA3 GLY A 108 10.918 -1.114 1.889 1.00 0.00 H new ATOM 1556 N ASP A 109 11.855 0.176 3.792 1.00 0.00 N ATOM 1557 CA ASP A 109 12.491 0.605 5.027 1.00 0.00 C ATOM 1558 C ASP A 109 13.210 -0.576 5.642 1.00 0.00 C ATOM 1559 O ASP A 109 14.446 -0.649 5.620 1.00 0.00 O ATOM 1560 CB ASP A 109 11.509 1.210 6.037 1.00 0.00 C ATOM 1561 CG ASP A 109 12.192 1.610 7.335 1.00 0.00 C ATOM 1562 OD1 ASP A 109 12.800 2.704 7.384 1.00 0.00 O ATOM 1563 OD2 ASP A 109 12.140 0.833 8.323 1.00 0.00 O ATOM 0 H ASP A 109 10.835 0.170 3.807 1.00 0.00 H new ATOM 0 HA ASP A 109 13.194 1.399 4.775 1.00 0.00 H new ATOM 0 HB2 ASP A 109 11.030 2.084 5.596 1.00 0.00 H new ATOM 0 HB3 ASP A 109 10.720 0.489 6.251 1.00 0.00 H new ATOM 1568 N HIS A 110 12.458 -1.493 6.214 1.00 0.00 N ATOM 1569 CA HIS A 110 13.059 -2.705 6.734 1.00 0.00 C ATOM 1570 C HIS A 110 12.446 -3.970 6.185 1.00 0.00 C ATOM 1571 O HIS A 110 13.161 -4.879 5.761 1.00 0.00 O ATOM 1572 CB HIS A 110 13.142 -2.722 8.261 1.00 0.00 C ATOM 1573 CG HIS A 110 14.290 -1.919 8.799 1.00 0.00 C ATOM 1574 ND1 HIS A 110 14.230 -0.571 9.036 1.00 0.00 N ATOM 1575 CD2 HIS A 110 15.547 -2.291 9.125 1.00 0.00 C ATOM 1576 CE1 HIS A 110 15.387 -0.149 9.481 1.00 0.00 C ATOM 1577 NE2 HIS A 110 16.207 -1.173 9.544 1.00 0.00 N ATOM 0 H HIS A 110 11.447 -1.426 6.330 1.00 0.00 H new ATOM 0 HA HIS A 110 14.084 -2.687 6.365 1.00 0.00 H new ATOM 0 HB2 HIS A 110 12.211 -2.334 8.673 1.00 0.00 H new ATOM 0 HB3 HIS A 110 13.237 -3.753 8.602 1.00 0.00 H new ATOM 0 HD1 HIS A 110 13.408 0.015 8.888 1.00 0.00 H new ATOM 0 HD2 HIS A 110 15.954 -3.289 9.065 1.00 0.00 H new ATOM 0 HE1 HIS A 110 15.626 0.869 9.751 1.00 0.00 H new ATOM 1586 N SER A 111 11.133 -4.048 6.177 1.00 0.00 N ATOM 1587 CA SER A 111 10.429 -5.244 5.751 1.00 0.00 C ATOM 1588 C SER A 111 9.005 -4.856 5.434 1.00 0.00 C ATOM 1589 O SER A 111 8.619 -3.743 5.725 1.00 0.00 O ATOM 1590 CB SER A 111 10.414 -6.278 6.896 1.00 0.00 C ATOM 1591 OG SER A 111 11.726 -6.568 7.369 1.00 0.00 O ATOM 0 H SER A 111 10.521 -3.285 6.465 1.00 0.00 H new ATOM 0 HA SER A 111 10.922 -5.677 4.881 1.00 0.00 H new ATOM 0 HB2 SER A 111 9.807 -5.900 7.719 1.00 0.00 H new ATOM 0 HB3 SER A 111 9.942 -7.197 6.549 1.00 0.00 H new ATOM 0 HG SER A 111 11.674 -7.225 8.094 1.00 0.00 H new ATOM 1597 N ILE A 112 8.246 -5.746 4.827 1.00 0.00 N ATOM 1598 CA ILE A 112 6.821 -5.496 4.602 1.00 0.00 C ATOM 1599 C ILE A 112 6.029 -5.836 5.874 1.00 0.00 C ATOM 1600 O ILE A 112 5.136 -5.112 6.266 1.00 0.00 O ATOM 1601 CB ILE A 112 6.201 -6.314 3.389 1.00 0.00 C ATOM 1602 CG1 ILE A 112 6.838 -5.960 2.041 1.00 0.00 C ATOM 1603 CG2 ILE A 112 4.693 -6.121 3.293 1.00 0.00 C ATOM 1604 CD1 ILE A 112 8.145 -6.639 1.764 1.00 0.00 C ATOM 0 H ILE A 112 8.581 -6.645 4.480 1.00 0.00 H new ATOM 0 HA ILE A 112 6.742 -4.439 4.348 1.00 0.00 H new ATOM 0 HB ILE A 112 6.422 -7.360 3.604 1.00 0.00 H new ATOM 0 HG12 ILE A 112 6.137 -6.215 1.246 1.00 0.00 H new ATOM 0 HG13 ILE A 112 6.989 -4.881 1.999 1.00 0.00 H new ATOM 0 HG21 ILE A 112 4.305 -6.696 2.452 1.00 0.00 H new ATOM 0 HG22 ILE A 112 4.223 -6.464 4.214 1.00 0.00 H new ATOM 0 HG23 ILE A 112 4.470 -5.064 3.144 1.00 0.00 H new ATOM 0 HD11 ILE A 112 8.518 -6.327 0.789 1.00 0.00 H new ATOM 0 HD12 ILE A 112 8.867 -6.366 2.533 1.00 0.00 H new ATOM 0 HD13 ILE A 112 8.002 -7.720 1.769 1.00 0.00 H new ATOM 1616 N ILE A 113 6.414 -6.919 6.535 1.00 0.00 N ATOM 1617 CA ILE A 113 5.659 -7.439 7.689 1.00 0.00 C ATOM 1618 C ILE A 113 5.837 -6.577 8.960 1.00 0.00 C ATOM 1619 O ILE A 113 6.962 -6.230 9.337 1.00 0.00 O ATOM 1620 CB ILE A 113 5.998 -8.974 7.936 1.00 0.00 C ATOM 1621 CG1 ILE A 113 5.046 -9.698 8.962 1.00 0.00 C ATOM 1622 CG2 ILE A 113 7.467 -9.183 8.310 1.00 0.00 C ATOM 1623 CD1 ILE A 113 5.193 -9.322 10.432 1.00 0.00 C ATOM 0 H ILE A 113 7.245 -7.462 6.299 1.00 0.00 H new ATOM 0 HA ILE A 113 4.599 -7.371 7.444 1.00 0.00 H new ATOM 0 HB ILE A 113 5.812 -9.453 6.974 1.00 0.00 H new ATOM 0 HG12 ILE A 113 4.016 -9.501 8.664 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.205 -10.772 8.870 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.654 -10.245 8.470 1.00 0.00 H new ATOM 0 HG22 ILE A 113 8.103 -8.820 7.503 1.00 0.00 H new ATOM 0 HG23 ILE A 113 7.691 -8.634 9.224 1.00 0.00 H new ATOM 0 HD11 ILE A 113 4.480 -9.893 11.027 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.206 -9.547 10.766 1.00 0.00 H new ATOM 0 HD13 ILE A 113 4.999 -8.257 10.556 1.00 0.00 H new ATOM 1635 N GLY A 114 4.701 -6.140 9.539 1.00 0.00 N ATOM 1636 CA GLY A 114 4.695 -5.472 10.828 1.00 0.00 C ATOM 1637 C GLY A 114 4.542 -4.016 10.627 1.00 0.00 C ATOM 1638 O GLY A 114 4.401 -3.223 11.566 1.00 0.00 O ATOM 0 H GLY A 114 3.777 -6.245 9.120 1.00 0.00 H new ATOM 0 HA2 GLY A 114 3.880 -5.853 11.443 1.00 0.00 H new ATOM 0 HA3 GLY A 114 5.622 -5.681 11.362 1.00 0.00 H new ATOM 1642 N ARG A 115 4.533 -3.676 9.391 1.00 0.00 N ATOM 1643 CA ARG A 115 4.513 -2.349 8.958 1.00 0.00 C ATOM 1644 C ARG A 115 3.106 -2.034 8.543 1.00 0.00 C ATOM 1645 O ARG A 115 2.354 -2.919 8.323 1.00 0.00 O ATOM 1646 CB ARG A 115 5.475 -2.245 7.805 1.00 0.00 C ATOM 1647 CG ARG A 115 6.734 -3.134 7.962 1.00 0.00 C ATOM 1648 CD ARG A 115 7.553 -2.837 9.196 1.00 0.00 C ATOM 1649 NE ARG A 115 8.518 -3.886 9.479 1.00 0.00 N ATOM 1650 CZ ARG A 115 9.640 -3.727 10.182 1.00 0.00 C ATOM 1651 NH1 ARG A 115 9.962 -2.533 10.672 1.00 0.00 N ATOM 1652 NH2 ARG A 115 10.421 -4.772 10.417 1.00 0.00 N ATOM 0 H ARG A 115 4.540 -4.353 8.628 1.00 0.00 H new ATOM 0 HA ARG A 115 4.813 -1.641 9.730 1.00 0.00 H new ATOM 0 HB2 ARG A 115 4.958 -2.522 6.886 1.00 0.00 H new ATOM 0 HB3 ARG A 115 5.786 -1.206 7.695 1.00 0.00 H new ATOM 0 HG2 ARG A 115 6.426 -4.179 7.987 1.00 0.00 H new ATOM 0 HG3 ARG A 115 7.365 -3.009 7.082 1.00 0.00 H new ATOM 0 HD2 ARG A 115 8.076 -1.890 9.064 1.00 0.00 H new ATOM 0 HD3 ARG A 115 6.888 -2.717 10.051 1.00 0.00 H new ATOM 0 HE ARG A 115 8.322 -4.817 9.111 1.00 0.00 H new ATOM 0 HH11 ARG A 115 9.350 -1.733 10.511 1.00 0.00 H new ATOM 0 HH12 ARG A 115 10.821 -2.417 11.209 1.00 0.00 H new ATOM 0 HH21 ARG A 115 10.163 -5.692 10.061 1.00 0.00 H new ATOM 0 HH22 ARG A 115 11.280 -4.656 10.954 1.00 0.00 H new ATOM 1666 N THR A 116 2.743 -0.805 8.495 1.00 0.00 N ATOM 1667 CA THR A 116 1.395 -0.444 8.169 1.00 0.00 C ATOM 1668 C THR A 116 1.209 -0.020 6.724 1.00 0.00 C ATOM 1669 O THR A 116 2.008 0.754 6.198 1.00 0.00 O ATOM 1670 CB THR A 116 0.976 0.686 9.065 1.00 0.00 C ATOM 1671 OG1 THR A 116 2.035 1.659 9.071 1.00 0.00 O ATOM 1672 CG2 THR A 116 0.742 0.189 10.464 1.00 0.00 C ATOM 0 H THR A 116 3.363 -0.016 8.678 1.00 0.00 H new ATOM 0 HA THR A 116 0.781 -1.333 8.315 1.00 0.00 H new ATOM 0 HB THR A 116 0.048 1.125 8.700 1.00 0.00 H new ATOM 0 HG1 THR A 116 2.439 1.709 8.179 1.00 0.00 H new ATOM 0 HG21 THR A 116 0.439 1.021 11.100 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.044 -0.566 10.455 1.00 0.00 H new ATOM 0 HG23 THR A 116 1.661 -0.249 10.853 1.00 0.00 H new ATOM 1680 N LEU A 117 0.159 -0.509 6.098 1.00 0.00 N ATOM 1681 CA LEU A 117 -0.166 -0.064 4.764 1.00 0.00 C ATOM 1682 C LEU A 117 -1.076 1.161 4.861 1.00 0.00 C ATOM 1683 O LEU A 117 -2.029 1.156 5.622 1.00 0.00 O ATOM 1684 CB LEU A 117 -0.813 -1.171 3.868 1.00 0.00 C ATOM 1685 CG LEU A 117 -2.269 -1.625 4.152 1.00 0.00 C ATOM 1686 CD1 LEU A 117 -2.776 -2.476 3.003 1.00 0.00 C ATOM 1687 CD2 LEU A 117 -2.378 -2.418 5.442 1.00 0.00 C ATOM 0 H LEU A 117 -0.476 -1.206 6.487 1.00 0.00 H new ATOM 0 HA LEU A 117 0.770 0.193 4.268 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -0.775 -0.821 2.836 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -0.177 -2.054 3.929 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.875 -0.725 4.255 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -3.799 -2.792 3.208 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -2.754 -1.894 2.082 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -2.140 -3.354 2.893 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -3.415 -2.715 5.600 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -1.752 -3.308 5.376 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -2.046 -1.802 6.277 1.00 0.00 H new ATOM 1699 N VAL A 118 -0.733 2.215 4.144 1.00 0.00 N ATOM 1700 CA VAL A 118 -1.523 3.460 4.163 1.00 0.00 C ATOM 1701 C VAL A 118 -2.390 3.537 2.920 1.00 0.00 C ATOM 1702 O VAL A 118 -1.872 3.892 1.825 1.00 0.00 O ATOM 1703 CB VAL A 118 -0.615 4.707 4.145 1.00 0.00 C ATOM 1704 CG1 VAL A 118 -1.404 5.982 4.430 1.00 0.00 C ATOM 1705 CG2 VAL A 118 0.542 4.550 5.090 1.00 0.00 C ATOM 0 H VAL A 118 0.086 2.247 3.537 1.00 0.00 H new ATOM 0 HA VAL A 118 -2.120 3.444 5.075 1.00 0.00 H new ATOM 0 HB VAL A 118 -0.207 4.801 3.139 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.731 6.839 4.409 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -2.177 6.109 3.672 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -1.869 5.910 5.413 1.00 0.00 H new ATOM 0 HG21 VAL A 118 1.164 5.444 5.055 1.00 0.00 H new ATOM 0 HG22 VAL A 118 0.167 4.408 6.104 1.00 0.00 H new ATOM 0 HG23 VAL A 118 1.136 3.684 4.798 1.00 0.00 H new ATOM 1715 N VAL A 119 -3.662 3.233 3.064 1.00 0.00 N ATOM 1716 CA VAL A 119 -4.611 3.203 1.970 1.00 0.00 C ATOM 1717 C VAL A 119 -5.901 3.861 2.423 1.00 0.00 C ATOM 1718 O VAL A 119 -6.026 4.224 3.574 1.00 0.00 O ATOM 1719 CB VAL A 119 -4.939 1.741 1.502 1.00 0.00 C ATOM 1720 CG1 VAL A 119 -3.717 1.042 0.938 1.00 0.00 C ATOM 1721 CG2 VAL A 119 -5.531 0.916 2.639 1.00 0.00 C ATOM 0 H VAL A 119 -4.075 2.994 3.965 1.00 0.00 H new ATOM 0 HA VAL A 119 -4.162 3.733 1.130 1.00 0.00 H new ATOM 0 HB VAL A 119 -5.680 1.825 0.707 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -3.987 0.033 0.626 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -3.343 1.600 0.080 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -2.942 0.990 1.703 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -5.747 -0.091 2.283 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -4.817 0.865 3.461 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -6.452 1.384 2.987 1.00 0.00 H new ATOM 1731 N HIS A 120 -6.786 4.105 1.496 1.00 0.00 N ATOM 1732 CA HIS A 120 -8.131 4.568 1.761 1.00 0.00 C ATOM 1733 C HIS A 120 -8.822 4.499 0.414 1.00 0.00 C ATOM 1734 O HIS A 120 -8.129 4.252 -0.585 1.00 0.00 O ATOM 1735 CB HIS A 120 -8.161 6.031 2.313 1.00 0.00 C ATOM 1736 CG HIS A 120 -9.527 6.478 2.800 1.00 0.00 C ATOM 1737 ND1 HIS A 120 -10.361 7.312 2.082 1.00 0.00 N ATOM 1738 CD2 HIS A 120 -10.203 6.172 3.933 1.00 0.00 C ATOM 1739 CE1 HIS A 120 -11.478 7.493 2.752 1.00 0.00 C ATOM 1740 NE2 HIS A 120 -11.419 6.808 3.874 1.00 0.00 N ATOM 0 H HIS A 120 -6.590 3.985 0.502 1.00 0.00 H new ATOM 0 HA HIS A 120 -8.615 3.961 2.526 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -7.449 6.113 3.134 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -7.825 6.711 1.530 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -9.850 5.543 4.737 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -12.309 8.105 2.433 1.00 0.00 H new ATOM 0 HE2 HIS A 120 -12.153 6.758 4.581 1.00 0.00 H new ATOM 1749 N GLU A 121 -10.105 4.668 0.343 1.00 0.00 N ATOM 1750 CA GLU A 121 -10.730 4.802 -0.947 1.00 0.00 C ATOM 1751 C GLU A 121 -10.433 6.228 -1.375 1.00 0.00 C ATOM 1752 O GLU A 121 -11.223 7.133 -1.143 1.00 0.00 O ATOM 1753 CB GLU A 121 -12.271 4.640 -0.864 1.00 0.00 C ATOM 1754 CG GLU A 121 -12.813 3.759 0.266 1.00 0.00 C ATOM 1755 CD GLU A 121 -12.720 4.433 1.628 1.00 0.00 C ATOM 1756 OE1 GLU A 121 -13.588 5.241 1.974 1.00 0.00 O ATOM 1757 OE2 GLU A 121 -11.732 4.206 2.337 1.00 0.00 O ATOM 0 H GLU A 121 -10.736 4.717 1.143 1.00 0.00 H new ATOM 0 HA GLU A 121 -10.357 4.041 -1.632 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -12.712 5.632 -0.763 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -12.621 4.231 -1.812 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -13.853 3.508 0.059 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -12.257 2.822 0.290 1.00 0.00 H new ATOM 1764 N LYS A 122 -9.270 6.401 -1.945 1.00 0.00 N ATOM 1765 CA LYS A 122 -8.716 7.694 -2.338 1.00 0.00 C ATOM 1766 C LYS A 122 -7.481 7.412 -3.071 1.00 0.00 C ATOM 1767 O LYS A 122 -6.701 6.578 -2.590 1.00 0.00 O ATOM 1768 CB LYS A 122 -8.318 8.594 -1.117 1.00 0.00 C ATOM 1769 CG LYS A 122 -9.425 9.429 -0.480 1.00 0.00 C ATOM 1770 CD LYS A 122 -9.934 10.483 -1.439 1.00 0.00 C ATOM 1771 CE LYS A 122 -11.065 11.291 -0.837 1.00 0.00 C ATOM 1772 NZ LYS A 122 -11.624 12.265 -1.796 1.00 0.00 N ATOM 0 H LYS A 122 -8.649 5.622 -2.162 1.00 0.00 H new ATOM 0 HA LYS A 122 -9.473 8.225 -2.914 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -7.893 7.951 -0.346 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -7.526 9.271 -1.439 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -10.247 8.780 -0.179 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -9.049 9.907 0.425 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -9.117 11.150 -1.714 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -10.277 10.005 -2.356 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -11.854 10.617 -0.504 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -10.703 11.819 0.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -11.941 13.113 -1.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -10.893 12.530 -2.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -12.432 11.838 -2.293 1.00 0.00 H new ATOM 1786 N ALA A 123 -7.329 7.959 -4.259 1.00 0.00 N ATOM 1787 CA ALA A 123 -6.042 7.936 -4.929 1.00 0.00 C ATOM 1788 C ALA A 123 -4.933 8.310 -3.935 1.00 0.00 C ATOM 1789 O ALA A 123 -4.761 9.476 -3.575 1.00 0.00 O ATOM 1790 CB ALA A 123 -6.044 8.916 -6.095 1.00 0.00 C ATOM 0 H ALA A 123 -8.074 8.422 -4.779 1.00 0.00 H new ATOM 0 HA ALA A 123 -5.857 6.932 -5.311 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -5.074 8.892 -6.592 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -6.822 8.636 -6.805 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -6.237 9.923 -5.724 1.00 0.00 H new ATOM 1796 N ASP A 124 -4.213 7.306 -3.488 1.00 0.00 N ATOM 1797 CA ASP A 124 -3.164 7.470 -2.515 1.00 0.00 C ATOM 1798 C ASP A 124 -1.898 7.379 -3.232 1.00 0.00 C ATOM 1799 O ASP A 124 -1.305 6.310 -3.402 1.00 0.00 O ATOM 1800 CB ASP A 124 -3.269 6.442 -1.360 1.00 0.00 C ATOM 1801 CG ASP A 124 -1.992 6.284 -0.530 1.00 0.00 C ATOM 1802 OD1 ASP A 124 -1.460 7.133 0.168 1.00 0.00 O ATOM 1803 OD2 ASP A 124 -1.365 5.282 -0.509 1.00 0.00 O ATOM 0 H ASP A 124 -4.343 6.342 -3.795 1.00 0.00 H new ATOM 0 HA ASP A 124 -3.248 8.441 -2.027 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -4.082 6.740 -0.698 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -3.538 5.472 -1.778 1.00 0.00 H new ATOM 1808 N ASP A 125 -1.519 8.468 -3.728 1.00 0.00 N ATOM 1809 CA ASP A 125 -0.419 8.516 -4.577 1.00 0.00 C ATOM 1810 C ASP A 125 0.601 9.437 -3.994 1.00 0.00 C ATOM 1811 O ASP A 125 0.275 10.529 -3.538 1.00 0.00 O ATOM 1812 CB ASP A 125 -0.874 9.000 -5.929 1.00 0.00 C ATOM 1813 CG ASP A 125 0.107 8.693 -6.999 1.00 0.00 C ATOM 1814 OD1 ASP A 125 1.223 9.216 -6.955 1.00 0.00 O ATOM 1815 OD2 ASP A 125 -0.237 7.917 -7.900 1.00 0.00 O ATOM 0 H ASP A 125 -1.968 9.368 -3.556 1.00 0.00 H new ATOM 0 HA ASP A 125 0.029 7.529 -4.690 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -1.831 8.539 -6.174 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -1.040 10.077 -5.890 1.00 0.00 H new ATOM 1820 N LEU A 126 1.816 8.995 -3.988 1.00 0.00 N ATOM 1821 CA LEU A 126 2.907 9.774 -3.420 1.00 0.00 C ATOM 1822 C LEU A 126 3.542 10.678 -4.450 1.00 0.00 C ATOM 1823 O LEU A 126 4.325 11.546 -4.111 1.00 0.00 O ATOM 1824 CB LEU A 126 3.963 8.866 -2.765 1.00 0.00 C ATOM 1825 CG LEU A 126 3.931 8.750 -1.222 1.00 0.00 C ATOM 1826 CD1 LEU A 126 4.278 10.082 -0.576 1.00 0.00 C ATOM 1827 CD2 LEU A 126 2.581 8.252 -0.718 1.00 0.00 C ATOM 0 H LEU A 126 2.096 8.092 -4.370 1.00 0.00 H new ATOM 0 HA LEU A 126 2.478 10.407 -2.643 1.00 0.00 H new ATOM 0 HB2 LEU A 126 3.854 7.865 -3.182 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.949 9.228 -3.057 1.00 0.00 H new ATOM 0 HG LEU A 126 4.682 8.013 -0.937 1.00 0.00 H new ATOM 0 HD11 LEU A 126 4.250 9.979 0.509 1.00 0.00 H new ATOM 0 HD12 LEU A 126 5.278 10.387 -0.886 1.00 0.00 H new ATOM 0 HD13 LEU A 126 3.556 10.837 -0.887 1.00 0.00 H new ATOM 0 HD21 LEU A 126 2.601 8.185 0.370 1.00 0.00 H new ATOM 0 HD22 LEU A 126 1.799 8.947 -1.024 1.00 0.00 H new ATOM 0 HD23 LEU A 126 2.376 7.267 -1.139 1.00 0.00 H new ATOM 1839 N GLY A 127 3.234 10.448 -5.695 1.00 0.00 N ATOM 1840 CA GLY A 127 3.773 11.260 -6.735 1.00 0.00 C ATOM 1841 C GLY A 127 2.787 12.317 -7.105 1.00 0.00 C ATOM 1842 O GLY A 127 3.153 13.446 -7.443 1.00 0.00 O ATOM 0 H GLY A 127 2.612 9.703 -6.009 1.00 0.00 H new ATOM 0 HA2 GLY A 127 4.706 11.718 -6.407 1.00 0.00 H new ATOM 0 HA3 GLY A 127 4.008 10.647 -7.605 1.00 0.00 H new ATOM 1846 N LYS A 128 1.525 11.965 -7.037 1.00 0.00 N ATOM 1847 CA LYS A 128 0.488 12.908 -7.339 1.00 0.00 C ATOM 1848 C LYS A 128 0.121 13.727 -6.101 1.00 0.00 C ATOM 1849 O LYS A 128 0.208 14.951 -6.152 1.00 0.00 O ATOM 1850 CB LYS A 128 -0.757 12.171 -7.866 1.00 0.00 C ATOM 1851 CG LYS A 128 -1.901 13.065 -8.334 1.00 0.00 C ATOM 1852 CD LYS A 128 -3.085 12.222 -8.799 1.00 0.00 C ATOM 1853 CE LYS A 128 -4.209 13.072 -9.390 1.00 0.00 C ATOM 1854 NZ LYS A 128 -4.793 14.021 -8.414 1.00 0.00 N ATOM 0 H LYS A 128 1.198 11.035 -6.776 1.00 0.00 H new ATOM 0 HA LYS A 128 0.856 13.588 -8.107 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -0.455 11.532 -8.696 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -1.130 11.516 -7.079 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -2.212 13.722 -7.522 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -1.560 13.704 -9.149 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -2.745 11.504 -9.545 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -3.472 11.648 -7.957 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -3.825 13.629 -10.244 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -4.995 12.416 -9.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -5.583 14.533 -8.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -5.141 13.497 -7.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -4.066 14.701 -8.113 1.00 0.00 H new ATOM 1868 N GLY A 129 -0.114 13.057 -4.970 1.00 0.00 N ATOM 1869 CA GLY A 129 -0.668 13.687 -3.766 1.00 0.00 C ATOM 1870 C GLY A 129 -1.896 14.562 -4.018 1.00 0.00 C ATOM 1871 O GLY A 129 -3.024 14.157 -3.767 1.00 0.00 O ATOM 0 H GLY A 129 0.074 12.060 -4.862 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -0.933 12.907 -3.052 1.00 0.00 H new ATOM 0 HA3 GLY A 129 0.107 14.296 -3.300 1.00 0.00 H new ATOM 1875 N GLY A 130 -1.650 15.760 -4.522 1.00 0.00 N ATOM 1876 CA GLY A 130 -2.658 16.760 -4.777 1.00 0.00 C ATOM 1877 C GLY A 130 -1.975 18.065 -5.156 1.00 0.00 C ATOM 1878 O GLY A 130 -1.534 18.233 -6.297 1.00 0.00 O ATOM 0 H GLY A 130 -0.710 16.067 -4.771 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -3.318 16.433 -5.581 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -3.279 16.903 -3.893 1.00 0.00 H new ATOM 1882 N ASN A 131 -1.826 18.941 -4.189 1.00 0.00 N ATOM 1883 CA ASN A 131 -1.128 20.223 -4.344 1.00 0.00 C ATOM 1884 C ASN A 131 0.382 19.989 -4.031 1.00 0.00 C ATOM 1885 O ASN A 131 0.757 18.841 -3.721 1.00 0.00 O ATOM 1886 CB ASN A 131 -1.778 21.238 -3.370 1.00 0.00 C ATOM 1887 CG ASN A 131 -1.226 22.644 -3.455 1.00 0.00 C ATOM 1888 OD1 ASN A 131 -0.732 23.062 -4.482 1.00 0.00 O ATOM 1889 ND2 ASN A 131 -1.332 23.383 -2.388 1.00 0.00 N ATOM 0 H ASN A 131 -2.190 18.791 -3.248 1.00 0.00 H new ATOM 0 HA ASN A 131 -1.207 20.622 -5.355 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -2.850 21.272 -3.565 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -1.651 20.874 -2.350 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -0.994 24.345 -2.399 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -1.753 22.999 -1.542 1.00 0.00 H new ATOM 1896 N GLU A 132 1.245 21.031 -4.106 1.00 0.00 N ATOM 1897 CA GLU A 132 2.705 20.855 -3.849 1.00 0.00 C ATOM 1898 C GLU A 132 3.009 20.242 -2.471 1.00 0.00 C ATOM 1899 O GLU A 132 4.000 19.534 -2.297 1.00 0.00 O ATOM 1900 CB GLU A 132 3.510 22.149 -4.022 1.00 0.00 C ATOM 1901 CG GLU A 132 3.585 22.694 -5.442 1.00 0.00 C ATOM 1902 CD GLU A 132 2.276 23.206 -5.947 1.00 0.00 C ATOM 1903 OE1 GLU A 132 1.865 24.304 -5.507 1.00 0.00 O ATOM 1904 OE2 GLU A 132 1.649 22.537 -6.788 1.00 0.00 O ATOM 0 H GLU A 132 0.969 21.985 -4.337 1.00 0.00 H new ATOM 0 HA GLU A 132 3.025 20.149 -4.615 1.00 0.00 H new ATOM 0 HB2 GLU A 132 3.074 22.915 -3.381 1.00 0.00 H new ATOM 0 HB3 GLU A 132 4.525 21.974 -3.665 1.00 0.00 H new ATOM 0 HG2 GLU A 132 4.320 23.498 -5.477 1.00 0.00 H new ATOM 0 HG3 GLU A 132 3.941 21.908 -6.107 1.00 0.00 H new ATOM 1911 N GLU A 133 2.190 20.533 -1.502 1.00 0.00 N ATOM 1912 CA GLU A 133 2.344 19.941 -0.186 1.00 0.00 C ATOM 1913 C GLU A 133 1.861 18.504 -0.211 1.00 0.00 C ATOM 1914 O GLU A 133 2.543 17.583 0.247 1.00 0.00 O ATOM 1915 CB GLU A 133 1.540 20.717 0.862 1.00 0.00 C ATOM 1916 CG GLU A 133 2.076 22.093 1.231 1.00 0.00 C ATOM 1917 CD GLU A 133 2.210 23.049 0.071 1.00 0.00 C ATOM 1918 OE1 GLU A 133 1.269 23.172 -0.745 1.00 0.00 O ATOM 1919 OE2 GLU A 133 3.243 23.723 -0.031 1.00 0.00 O ATOM 0 H GLU A 133 1.404 21.177 -1.589 1.00 0.00 H new ATOM 0 HA GLU A 133 3.400 19.978 0.080 1.00 0.00 H new ATOM 0 HB2 GLU A 133 0.520 20.833 0.496 1.00 0.00 H new ATOM 0 HB3 GLU A 133 1.487 20.115 1.769 1.00 0.00 H new ATOM 0 HG2 GLU A 133 1.416 22.537 1.976 1.00 0.00 H new ATOM 0 HG3 GLU A 133 3.052 21.974 1.701 1.00 0.00 H new ATOM 1926 N SER A 134 0.712 18.323 -0.802 1.00 0.00 N ATOM 1927 CA SER A 134 0.021 17.069 -0.852 1.00 0.00 C ATOM 1928 C SER A 134 0.835 15.982 -1.568 1.00 0.00 C ATOM 1929 O SER A 134 0.753 14.822 -1.201 1.00 0.00 O ATOM 1930 CB SER A 134 -1.276 17.302 -1.557 1.00 0.00 C ATOM 1931 OG SER A 134 -1.779 18.583 -1.210 1.00 0.00 O ATOM 0 H SER A 134 0.215 19.075 -1.279 1.00 0.00 H new ATOM 0 HA SER A 134 -0.142 16.706 0.163 1.00 0.00 H new ATOM 0 HB2 SER A 134 -1.133 17.235 -2.636 1.00 0.00 H new ATOM 0 HB3 SER A 134 -1.995 16.530 -1.283 1.00 0.00 H new ATOM 0 HG SER A 134 -2.758 18.570 -1.244 1.00 0.00 H new ATOM 1937 N THR A 135 1.611 16.361 -2.578 1.00 0.00 N ATOM 1938 CA THR A 135 2.442 15.407 -3.301 1.00 0.00 C ATOM 1939 C THR A 135 3.567 14.871 -2.428 1.00 0.00 C ATOM 1940 O THR A 135 3.891 13.696 -2.474 1.00 0.00 O ATOM 1941 CB THR A 135 2.991 15.992 -4.640 1.00 0.00 C ATOM 1942 OG1 THR A 135 3.789 15.027 -5.339 1.00 0.00 O ATOM 1943 CG2 THR A 135 3.814 17.249 -4.431 1.00 0.00 C ATOM 0 H THR A 135 1.681 17.322 -2.914 1.00 0.00 H new ATOM 0 HA THR A 135 1.797 14.568 -3.564 1.00 0.00 H new ATOM 0 HB THR A 135 2.115 16.249 -5.236 1.00 0.00 H new ATOM 0 HG1 THR A 135 3.259 14.622 -6.057 1.00 0.00 H new ATOM 0 HG21 THR A 135 4.171 17.614 -5.394 1.00 0.00 H new ATOM 0 HG22 THR A 135 3.197 18.014 -3.959 1.00 0.00 H new ATOM 0 HG23 THR A 135 4.666 17.024 -3.790 1.00 0.00 H new ATOM 1951 N LYS A 136 4.102 15.693 -1.582 1.00 0.00 N ATOM 1952 CA LYS A 136 5.227 15.263 -0.790 1.00 0.00 C ATOM 1953 C LYS A 136 4.772 14.471 0.426 1.00 0.00 C ATOM 1954 O LYS A 136 5.502 13.621 0.931 1.00 0.00 O ATOM 1955 CB LYS A 136 6.204 16.436 -0.452 1.00 0.00 C ATOM 1956 CG LYS A 136 5.697 17.563 0.476 1.00 0.00 C ATOM 1957 CD LYS A 136 5.635 17.154 1.958 1.00 0.00 C ATOM 1958 CE LYS A 136 7.015 16.806 2.518 1.00 0.00 C ATOM 1959 NZ LYS A 136 6.956 16.391 3.934 1.00 0.00 N ATOM 0 H LYS A 136 3.791 16.650 -1.418 1.00 0.00 H new ATOM 0 HA LYS A 136 5.818 14.577 -1.396 1.00 0.00 H new ATOM 0 HB2 LYS A 136 7.096 16.006 0.003 1.00 0.00 H new ATOM 0 HB3 LYS A 136 6.514 16.893 -1.392 1.00 0.00 H new ATOM 0 HG2 LYS A 136 6.350 18.429 0.373 1.00 0.00 H new ATOM 0 HG3 LYS A 136 4.704 17.872 0.150 1.00 0.00 H new ATOM 0 HD2 LYS A 136 5.203 17.968 2.540 1.00 0.00 H new ATOM 0 HD3 LYS A 136 4.972 16.296 2.069 1.00 0.00 H new ATOM 0 HE2 LYS A 136 7.454 16.004 1.924 1.00 0.00 H new ATOM 0 HE3 LYS A 136 7.672 17.670 2.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 7.914 16.165 4.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 6.562 17.165 4.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 6.350 15.550 4.024 1.00 0.00 H new ATOM 1973 N THR A 137 3.587 14.777 0.906 1.00 0.00 N ATOM 1974 CA THR A 137 3.031 14.062 2.023 1.00 0.00 C ATOM 1975 C THR A 137 2.274 12.811 1.573 1.00 0.00 C ATOM 1976 O THR A 137 1.965 11.949 2.399 1.00 0.00 O ATOM 1977 CB THR A 137 2.120 14.965 2.908 1.00 0.00 C ATOM 1978 OG1 THR A 137 1.648 14.222 4.039 1.00 0.00 O ATOM 1979 CG2 THR A 137 0.921 15.488 2.141 1.00 0.00 C ATOM 0 H THR A 137 2.992 15.519 0.536 1.00 0.00 H new ATOM 0 HA THR A 137 3.875 13.746 2.636 1.00 0.00 H new ATOM 0 HB THR A 137 2.724 15.814 3.229 1.00 0.00 H new ATOM 0 HG1 THR A 137 1.543 13.280 3.791 1.00 0.00 H new ATOM 0 HG21 THR A 137 0.314 16.112 2.796 1.00 0.00 H new ATOM 0 HG22 THR A 137 1.262 16.079 1.291 1.00 0.00 H new ATOM 0 HG23 THR A 137 0.324 14.649 1.783 1.00 0.00 H new ATOM 1987 N GLY A 138 1.973 12.728 0.280 1.00 0.00 N ATOM 1988 CA GLY A 138 1.185 11.632 -0.233 1.00 0.00 C ATOM 1989 C GLY A 138 -0.201 11.674 0.339 1.00 0.00 C ATOM 1990 O GLY A 138 -0.618 10.739 1.031 1.00 0.00 O ATOM 0 H GLY A 138 2.265 13.408 -0.422 1.00 0.00 H new ATOM 0 HA2 GLY A 138 1.139 11.687 -1.321 1.00 0.00 H new ATOM 0 HA3 GLY A 138 1.661 10.684 0.019 1.00 0.00 H new ATOM 1994 N ASN A 139 -0.898 12.776 0.061 1.00 0.00 N ATOM 1995 CA ASN A 139 -2.232 13.054 0.616 1.00 0.00 C ATOM 1996 C ASN A 139 -3.222 11.921 0.422 1.00 0.00 C ATOM 1997 O ASN A 139 -3.692 11.652 -0.691 1.00 0.00 O ATOM 1998 CB ASN A 139 -2.818 14.366 0.065 1.00 0.00 C ATOM 1999 CG ASN A 139 -4.233 14.650 0.583 1.00 0.00 C ATOM 2000 OD1 ASN A 139 -4.413 15.251 1.650 1.00 0.00 O ATOM 2001 ND2 ASN A 139 -5.231 14.270 -0.173 1.00 0.00 N ATOM 0 H ASN A 139 -0.554 13.509 -0.560 1.00 0.00 H new ATOM 0 HA ASN A 139 -2.074 13.158 1.690 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -2.163 15.194 0.338 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -2.837 14.321 -1.024 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -6.190 14.467 0.112 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -5.050 13.776 -1.047 1.00 0.00 H new ATOM 2008 N ALA A 140 -3.459 11.245 1.505 1.00 0.00 N ATOM 2009 CA ALA A 140 -4.427 10.213 1.647 1.00 0.00 C ATOM 2010 C ALA A 140 -4.828 10.221 3.092 1.00 0.00 C ATOM 2011 O ALA A 140 -4.211 10.953 3.885 1.00 0.00 O ATOM 2012 CB ALA A 140 -3.850 8.868 1.278 1.00 0.00 C ATOM 0 H ALA A 140 -2.943 11.416 2.368 1.00 0.00 H new ATOM 0 HA ALA A 140 -5.277 10.384 0.986 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -4.614 8.099 1.397 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -3.514 8.888 0.241 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -3.005 8.643 1.929 1.00 0.00 H new ATOM 2018 N GLY A 141 -5.842 9.463 3.444 1.00 0.00 N ATOM 2019 CA GLY A 141 -6.205 9.309 4.838 1.00 0.00 C ATOM 2020 C GLY A 141 -5.133 8.541 5.596 1.00 0.00 C ATOM 2021 O GLY A 141 -5.218 7.325 5.730 1.00 0.00 O ATOM 0 H GLY A 141 -6.428 8.945 2.789 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -6.345 10.290 5.292 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -7.157 8.784 4.914 1.00 0.00 H new ATOM 2025 N SER A 142 -4.152 9.271 6.092 1.00 0.00 N ATOM 2026 CA SER A 142 -2.981 8.736 6.766 1.00 0.00 C ATOM 2027 C SER A 142 -3.300 8.047 8.098 1.00 0.00 C ATOM 2028 O SER A 142 -2.430 7.463 8.703 1.00 0.00 O ATOM 2029 CB SER A 142 -1.981 9.858 6.978 1.00 0.00 C ATOM 2030 OG SER A 142 -1.722 10.540 5.751 1.00 0.00 O ATOM 0 H SER A 142 -4.147 10.289 6.035 1.00 0.00 H new ATOM 0 HA SER A 142 -2.563 7.961 6.124 1.00 0.00 H new ATOM 0 HB2 SER A 142 -2.366 10.561 7.716 1.00 0.00 H new ATOM 0 HB3 SER A 142 -1.052 9.453 7.378 1.00 0.00 H new ATOM 0 HG SER A 142 -1.077 11.261 5.907 1.00 0.00 H new ATOM 2036 N ARG A 143 -4.458 8.177 8.562 1.00 0.00 N ATOM 2037 CA ARG A 143 -4.799 7.420 9.693 1.00 0.00 C ATOM 2038 C ARG A 143 -5.891 6.471 9.351 1.00 0.00 C ATOM 2039 O ARG A 143 -5.918 5.346 9.848 1.00 0.00 O ATOM 2040 CB ARG A 143 -5.220 8.310 10.860 1.00 0.00 C ATOM 2041 CG ARG A 143 -4.135 9.255 11.354 1.00 0.00 C ATOM 2042 CD ARG A 143 -4.612 10.053 12.553 1.00 0.00 C ATOM 2043 NE ARG A 143 -4.935 9.179 13.691 1.00 0.00 N ATOM 2044 CZ ARG A 143 -6.148 9.060 14.260 1.00 0.00 C ATOM 2045 NH1 ARG A 143 -7.191 9.708 13.751 1.00 0.00 N ATOM 2046 NH2 ARG A 143 -6.317 8.271 15.320 1.00 0.00 N ATOM 0 H ARG A 143 -5.186 8.788 8.192 1.00 0.00 H new ATOM 0 HA ARG A 143 -3.916 6.863 10.006 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -6.087 8.898 10.558 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -5.537 7.676 11.688 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -3.246 8.684 11.623 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -3.847 9.935 10.552 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -3.841 10.765 12.847 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -5.493 10.633 12.278 1.00 0.00 H new ATOM 0 HE ARG A 143 -4.178 8.618 14.080 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -7.073 10.297 12.927 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -8.110 9.616 14.184 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -5.525 7.755 15.703 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -7.238 8.183 15.749 1.00 0.00 H new ATOM 2060 N LEU A 144 -6.801 6.940 8.516 1.00 0.00 N ATOM 2061 CA LEU A 144 -8.087 6.295 8.256 1.00 0.00 C ATOM 2062 C LEU A 144 -8.023 4.825 7.951 1.00 0.00 C ATOM 2063 O LEU A 144 -8.895 4.077 8.396 1.00 0.00 O ATOM 2064 CB LEU A 144 -8.927 7.047 7.205 1.00 0.00 C ATOM 2065 CG LEU A 144 -9.594 8.377 7.640 1.00 0.00 C ATOM 2066 CD1 LEU A 144 -10.540 8.161 8.813 1.00 0.00 C ATOM 2067 CD2 LEU A 144 -8.567 9.454 7.966 1.00 0.00 C ATOM 0 H LEU A 144 -6.668 7.800 7.984 1.00 0.00 H new ATOM 0 HA LEU A 144 -8.599 6.362 9.216 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -8.285 7.257 6.349 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -9.712 6.375 6.858 1.00 0.00 H new ATOM 0 HG LEU A 144 -10.177 8.731 6.790 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -10.992 9.112 9.095 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -11.322 7.458 8.525 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -9.984 7.758 9.660 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -9.080 10.368 8.266 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -7.928 9.113 8.781 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -7.957 9.653 7.085 1.00 0.00 H new ATOM 2079 N ALA A 145 -7.038 4.392 7.229 1.00 0.00 N ATOM 2080 CA ALA A 145 -6.947 3.011 6.911 1.00 0.00 C ATOM 2081 C ALA A 145 -5.524 2.552 6.891 1.00 0.00 C ATOM 2082 O ALA A 145 -4.808 2.695 5.887 1.00 0.00 O ATOM 2083 CB ALA A 145 -7.655 2.692 5.613 1.00 0.00 C ATOM 0 H ALA A 145 -6.291 4.975 6.852 1.00 0.00 H new ATOM 0 HA ALA A 145 -7.458 2.458 7.699 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -7.565 1.627 5.402 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -8.709 2.957 5.699 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -7.202 3.263 4.802 1.00 0.00 H new ATOM 2089 N CYS A 146 -5.091 2.070 8.016 1.00 0.00 N ATOM 2090 CA CYS A 146 -3.793 1.507 8.130 1.00 0.00 C ATOM 2091 C CYS A 146 -3.909 0.298 9.003 1.00 0.00 C ATOM 2092 O CYS A 146 -4.818 0.205 9.842 1.00 0.00 O ATOM 2093 CB CYS A 146 -2.797 2.443 8.798 1.00 0.00 C ATOM 2094 SG CYS A 146 -2.886 4.209 8.366 1.00 0.00 S ATOM 0 H CYS A 146 -5.634 2.059 8.879 1.00 0.00 H new ATOM 0 HA CYS A 146 -3.433 1.290 7.124 1.00 0.00 H new ATOM 0 HB2 CYS A 146 -2.923 2.354 9.877 1.00 0.00 H new ATOM 0 HB3 CYS A 146 -1.793 2.089 8.564 1.00 0.00 H new ATOM 2099 N GLY A 147 -3.032 -0.605 8.802 1.00 0.00 N ATOM 2100 CA GLY A 147 -2.950 -1.773 9.581 1.00 0.00 C ATOM 2101 C GLY A 147 -1.702 -2.452 9.207 1.00 0.00 C ATOM 2102 O GLY A 147 -1.062 -2.028 8.243 1.00 0.00 O ATOM 0 H GLY A 147 -2.328 -0.549 8.066 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -2.953 -1.529 10.643 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -3.809 -2.418 9.400 1.00 0.00 H new ATOM 2106 N VAL A 148 -1.305 -3.433 9.943 1.00 0.00 N ATOM 2107 CA VAL A 148 -0.124 -4.164 9.605 1.00 0.00 C ATOM 2108 C VAL A 148 -0.311 -5.027 8.361 1.00 0.00 C ATOM 2109 O VAL A 148 -1.217 -5.876 8.267 1.00 0.00 O ATOM 2110 CB VAL A 148 0.477 -4.988 10.782 1.00 0.00 C ATOM 2111 CG1 VAL A 148 0.976 -4.064 11.881 1.00 0.00 C ATOM 2112 CG2 VAL A 148 -0.530 -5.975 11.344 1.00 0.00 C ATOM 0 H VAL A 148 -1.781 -3.751 10.787 1.00 0.00 H new ATOM 0 HA VAL A 148 0.615 -3.398 9.373 1.00 0.00 H new ATOM 0 HB VAL A 148 1.319 -5.557 10.388 1.00 0.00 H new ATOM 0 HG11 VAL A 148 1.392 -4.658 12.695 1.00 0.00 H new ATOM 0 HG12 VAL A 148 1.747 -3.406 11.481 1.00 0.00 H new ATOM 0 HG13 VAL A 148 0.147 -3.465 12.257 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -0.075 -6.532 12.163 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -1.402 -5.435 11.712 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -0.837 -6.668 10.560 1.00 0.00 H new ATOM 2122 N ILE A 149 0.521 -4.759 7.421 1.00 0.00 N ATOM 2123 CA ILE A 149 0.633 -5.462 6.211 1.00 0.00 C ATOM 2124 C ILE A 149 1.797 -6.378 6.439 1.00 0.00 C ATOM 2125 O ILE A 149 2.714 -6.034 7.213 1.00 0.00 O ATOM 2126 CB ILE A 149 0.926 -4.477 5.011 1.00 0.00 C ATOM 2127 CG1 ILE A 149 1.067 -5.220 3.675 1.00 0.00 C ATOM 2128 CG2 ILE A 149 2.153 -3.593 5.270 1.00 0.00 C ATOM 2129 CD1 ILE A 149 1.367 -4.306 2.495 1.00 0.00 C ATOM 0 H ILE A 149 1.184 -3.987 7.490 1.00 0.00 H new ATOM 0 HA ILE A 149 -0.281 -5.994 5.947 1.00 0.00 H new ATOM 0 HB ILE A 149 0.057 -3.823 4.939 1.00 0.00 H new ATOM 0 HG12 ILE A 149 1.864 -5.959 3.763 1.00 0.00 H new ATOM 0 HG13 ILE A 149 0.146 -5.767 3.475 1.00 0.00 H new ATOM 0 HG21 ILE A 149 2.313 -2.934 4.417 1.00 0.00 H new ATOM 0 HG22 ILE A 149 1.987 -2.994 6.165 1.00 0.00 H new ATOM 0 HG23 ILE A 149 3.031 -4.222 5.412 1.00 0.00 H new ATOM 0 HD11 ILE A 149 1.453 -4.902 1.586 1.00 0.00 H new ATOM 0 HD12 ILE A 149 0.559 -3.583 2.380 1.00 0.00 H new ATOM 0 HD13 ILE A 149 2.304 -3.778 2.673 1.00 0.00 H new ATOM 2141 N GLY A 150 1.740 -7.547 5.942 1.00 0.00 N ATOM 2142 CA GLY A 150 2.848 -8.365 6.110 1.00 0.00 C ATOM 2143 C GLY A 150 2.657 -9.689 5.570 1.00 0.00 C ATOM 2144 O GLY A 150 1.525 -10.156 5.451 1.00 0.00 O ATOM 0 H GLY A 150 0.954 -7.945 5.428 1.00 0.00 H new ATOM 0 HA2 GLY A 150 3.710 -7.903 5.629 1.00 0.00 H new ATOM 0 HA3 GLY A 150 3.079 -8.442 7.173 1.00 0.00 H new ATOM 2148 N ILE A 151 3.744 -10.304 5.226 1.00 0.00 N ATOM 2149 CA ILE A 151 3.758 -11.678 4.824 1.00 0.00 C ATOM 2150 C ILE A 151 3.387 -12.563 6.020 1.00 0.00 C ATOM 2151 O ILE A 151 4.143 -12.702 6.978 1.00 0.00 O ATOM 2152 CB ILE A 151 5.151 -12.103 4.223 1.00 0.00 C ATOM 2153 CG1 ILE A 151 5.218 -13.635 3.998 1.00 0.00 C ATOM 2154 CG2 ILE A 151 6.329 -11.597 5.070 1.00 0.00 C ATOM 2155 CD1 ILE A 151 6.555 -14.138 3.478 1.00 0.00 C ATOM 0 H ILE A 151 4.662 -9.860 5.216 1.00 0.00 H new ATOM 0 HA ILE A 151 3.021 -11.810 4.032 1.00 0.00 H new ATOM 0 HB ILE A 151 5.243 -11.622 3.249 1.00 0.00 H new ATOM 0 HG12 ILE A 151 4.996 -14.138 4.939 1.00 0.00 H new ATOM 0 HG13 ILE A 151 4.438 -13.920 3.293 1.00 0.00 H new ATOM 0 HG21 ILE A 151 7.267 -11.915 4.615 1.00 0.00 H new ATOM 0 HG22 ILE A 151 6.300 -10.508 5.119 1.00 0.00 H new ATOM 0 HG23 ILE A 151 6.256 -12.008 6.077 1.00 0.00 H new ATOM 0 HD11 ILE A 151 6.512 -15.220 3.350 1.00 0.00 H new ATOM 0 HD12 ILE A 151 6.773 -13.667 2.519 1.00 0.00 H new ATOM 0 HD13 ILE A 151 7.340 -13.888 4.192 1.00 0.00 H new ATOM 2167 N ALA A 152 2.193 -13.058 5.997 1.00 0.00 N ATOM 2168 CA ALA A 152 1.769 -14.007 6.956 1.00 0.00 C ATOM 2169 C ALA A 152 1.532 -15.279 6.203 1.00 0.00 C ATOM 2170 O ALA A 152 0.496 -15.463 5.542 1.00 0.00 O ATOM 2171 CB ALA A 152 0.518 -13.536 7.685 1.00 0.00 C ATOM 0 H ALA A 152 1.485 -12.810 5.306 1.00 0.00 H new ATOM 0 HA ALA A 152 2.521 -14.151 7.732 1.00 0.00 H new ATOM 0 HB1 ALA A 152 0.218 -14.288 8.415 1.00 0.00 H new ATOM 0 HB2 ALA A 152 0.727 -12.596 8.196 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -0.288 -13.386 6.966 1.00 0.00 H new ATOM 2177 N GLN A 153 2.493 -16.130 6.247 1.00 0.00 N ATOM 2178 CA GLN A 153 2.459 -17.322 5.486 1.00 0.00 C ATOM 2179 C GLN A 153 2.408 -18.492 6.413 1.00 0.00 C ATOM 2180 O GLN A 153 1.288 -18.913 6.759 1.00 0.00 O ATOM 2181 CB GLN A 153 3.662 -17.376 4.547 1.00 0.00 C ATOM 2182 CG GLN A 153 3.685 -18.576 3.627 1.00 0.00 C ATOM 2183 CD GLN A 153 4.818 -18.506 2.644 1.00 0.00 C ATOM 2184 OE1 GLN A 153 4.666 -17.965 1.551 1.00 0.00 O ATOM 2185 NE2 GLN A 153 5.959 -19.024 3.016 1.00 0.00 N ATOM 2186 OXT GLN A 153 3.461 -18.963 6.861 1.00 0.00 O ATOM 0 H GLN A 153 3.331 -16.016 6.817 1.00 0.00 H new ATOM 0 HA GLN A 153 1.566 -17.349 4.862 1.00 0.00 H new ATOM 0 HB2 GLN A 153 3.676 -16.470 3.942 1.00 0.00 H new ATOM 0 HB3 GLN A 153 4.574 -17.374 5.144 1.00 0.00 H new ATOM 0 HG2 GLN A 153 3.774 -19.486 4.220 1.00 0.00 H new ATOM 0 HG3 GLN A 153 2.740 -18.638 3.088 1.00 0.00 H new ATOM 0 HE21 GLN A 153 6.045 -19.465 3.932 1.00 0.00 H new ATOM 0 HE22 GLN A 153 6.764 -18.988 2.390 1.00 0.00 H new TER 2195 GLN A 153 HETATM 2196 CU CU A 201 -0.378 6.042 0.531 1.00 0.00 CU