USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 991 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 73 SER OG : rot -65:sc= 1.13 USER MOD Set 1.2: A 74 ASN : amide:sc= 0 X(o=1.1,f=1.1) USER MOD Set 2.1: A 37 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 26 SER OG : rot 180:sc= -0.133 USER MOD Set 3.2: A 27 GLN : amide:sc= 0.443 K(o=0.31,f=-7.3!) USER MOD Set 4.1: A 13 HIS : no HD1:sc= -2.74 X(o=-7.6,f=-7.4) USER MOD Set 4.2: A 86 ASN : amide:sc= -4.85! C(o=-7.6!,f=-14!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.0344 USER MOD Single : A 3 SER OG : rot 37:sc= 0.0542 USER MOD Single : A 5 SER OG : rot 180:sc= 0.0571 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -2.19 K(o=-2.2,f=-10!) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 ASN : amide:sc= -0.421 K(o=-0.42,f=-1.3) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 26:sc= 0.368 USER MOD Single : A 22 ASN : amide:sc=-0.00704 X(o=-0.007,f=-0.28) USER MOD Single : A 25 TYR OH : rot -172:sc= 1.3 USER MOD Single : A 31 GLN : amide:sc= -0.0745 K(o=-0.075,f=-3.8!) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -76:sc= -0.0485 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.00103 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 GLN : amide:sc= -0.723 K(o=-0.72,f=-2.1!) USER MOD Single : A 39 GLN : amide:sc= -0.0168 X(o=-0.017,f=-0.28) USER MOD Single : A 40 THR OG1 : rot 92:sc= 1.15 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -0.11 K(o=-0.11,f=-1.1) USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 GLN : amide:sc= -0.722 K(o=-0.72,f=-0.1) USER MOD Single : A 54 ASN : amide:sc= -0.0147 X(o=-0.015,f=-0.12) USER MOD Single : A 55 SER OG : rot 12:sc= 0.0396 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 170:sc= -1.19 USER MOD Single : A 64 CYS SG : rot 180:sc= -1.56 USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 SER OG : rot 89:sc= 0.564 USER MOD Single : A 75 ASN : amide:sc= -0.0448 X(o=-0.045,f=0) USER MOD Single : A 76 ASN : amide:sc= -0.179 X(o=-0.18,f=-0.0008) USER MOD Single : A 77 ASN : amide:sc= -0.0553 X(o=-0.055,f=-0.071) USER MOD Single : A 78 HIS : no HD1:sc= -3.9! K(o=-3.9!,f=-2) USER MOD Single : A 79 THR OG1 : rot 115:sc= -0.095 USER MOD Single : A 83 SER OG : rot -120:sc= -3.39! USER MOD Single : A 85 CYS SG : rot -85:sc= -10.8! USER MOD Single : A 88 SER OG : rot 180:sc= -0.166 USER MOD Single : A 100 TYR OH : rot 22:sc= 0.00336 USER MOD Single : A 106 MET CE :methyl -130:sc= -6.75! (180deg=-8.91!) USER MOD Single : A 107 THR OG1 : rot -118:sc= 0.266 USER MOD Single : A 108 HIS : no HD1:sc=-0.00701 X(o=-0.007,f=-0.15) USER MOD Single : A 109 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 THR OG1 : rot -79:sc= -0.787 USER MOD Single : A 112 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 115 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.915 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot 82:sc= -0.993 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot -113:sc= 0.127 USER MOD Single : A 131 SER OG : rot 43:sc= 1.27 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -11.231 26.894 4.355 1.00 0.00 N ATOM 2 CA GLY A 1 -9.971 27.661 4.156 1.00 0.00 C ATOM 3 C GLY A 1 -9.339 27.398 2.803 1.00 0.00 C ATOM 4 O GLY A 1 -8.523 26.488 2.658 1.00 0.00 O ATOM 0 H1 GLY A 1 -11.623 27.108 5.294 1.00 0.00 H new ATOM 0 H2 GLY A 1 -11.919 27.161 3.623 1.00 0.00 H new ATOM 0 H3 GLY A 1 -11.032 25.875 4.287 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -10.178 28.726 4.256 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.262 27.399 4.942 1.00 0.00 H new ATOM 10 N SER A 2 -9.716 28.197 1.810 1.00 0.00 N ATOM 11 CA SER A 2 -9.182 28.047 0.463 1.00 0.00 C ATOM 12 C SER A 2 -7.717 28.468 0.408 1.00 0.00 C ATOM 13 O SER A 2 -7.143 28.887 1.413 1.00 0.00 O ATOM 14 CB SER A 2 -9.999 28.877 -0.529 1.00 0.00 C ATOM 15 OG SER A 2 -9.803 28.426 -1.858 1.00 0.00 O ATOM 0 H SER A 2 -10.390 28.955 1.914 1.00 0.00 H new ATOM 0 HA SER A 2 -9.250 26.994 0.189 1.00 0.00 H new ATOM 0 HB2 SER A 2 -11.057 28.816 -0.274 1.00 0.00 H new ATOM 0 HB3 SER A 2 -9.713 29.926 -0.452 1.00 0.00 H new ATOM 0 HG SER A 2 -10.338 28.972 -2.471 1.00 0.00 H new ATOM 21 N SER A 3 -7.117 28.352 -0.772 1.00 0.00 N ATOM 22 CA SER A 3 -5.718 28.721 -0.958 1.00 0.00 C ATOM 23 C SER A 3 -5.456 29.154 -2.397 1.00 0.00 C ATOM 24 O SER A 3 -5.245 28.321 -3.278 1.00 0.00 O ATOM 25 CB SER A 3 -4.807 27.548 -0.592 1.00 0.00 C ATOM 26 OG SER A 3 -4.324 27.671 0.734 1.00 0.00 O ATOM 0 H SER A 3 -7.577 28.006 -1.614 1.00 0.00 H new ATOM 0 HA SER A 3 -5.499 29.562 -0.299 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.355 26.612 -0.697 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.967 27.506 -1.286 1.00 0.00 H new ATOM 0 HG SER A 3 -5.025 28.050 1.304 1.00 0.00 H new ATOM 32 N GLY A 4 -5.472 30.464 -2.628 1.00 0.00 N ATOM 33 CA GLY A 4 -5.235 30.984 -3.961 1.00 0.00 C ATOM 34 C GLY A 4 -3.840 30.678 -4.465 1.00 0.00 C ATOM 35 O GLY A 4 -3.619 30.558 -5.669 1.00 0.00 O ATOM 0 H GLY A 4 -5.645 31.173 -1.916 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -5.967 30.560 -4.648 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -5.388 32.063 -3.959 1.00 0.00 H new ATOM 39 N SER A 5 -2.894 30.551 -3.539 1.00 0.00 N ATOM 40 CA SER A 5 -1.511 30.255 -3.896 1.00 0.00 C ATOM 41 C SER A 5 -1.408 28.918 -4.622 1.00 0.00 C ATOM 42 O SER A 5 -0.857 28.837 -5.720 1.00 0.00 O ATOM 43 CB SER A 5 -0.632 30.238 -2.643 1.00 0.00 C ATOM 44 OG SER A 5 -1.094 31.171 -1.682 1.00 0.00 O ATOM 0 H SER A 5 -3.060 30.648 -2.537 1.00 0.00 H new ATOM 0 HA SER A 5 -1.161 31.039 -4.568 1.00 0.00 H new ATOM 0 HB2 SER A 5 -0.629 29.237 -2.211 1.00 0.00 H new ATOM 0 HB3 SER A 5 0.398 30.471 -2.914 1.00 0.00 H new ATOM 0 HG SER A 5 -0.516 31.139 -0.891 1.00 0.00 H new ATOM 50 N SER A 6 -1.943 27.872 -4.001 1.00 0.00 N ATOM 51 CA SER A 6 -1.912 26.537 -4.589 1.00 0.00 C ATOM 52 C SER A 6 -2.994 26.387 -5.652 1.00 0.00 C ATOM 53 O SER A 6 -2.796 25.714 -6.664 1.00 0.00 O ATOM 54 CB SER A 6 -2.095 25.475 -3.504 1.00 0.00 C ATOM 55 OG SER A 6 -0.887 25.260 -2.792 1.00 0.00 O ATOM 0 H SER A 6 -2.403 27.922 -3.092 1.00 0.00 H new ATOM 0 HA SER A 6 -0.940 26.398 -5.063 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.878 25.788 -2.813 1.00 0.00 H new ATOM 0 HB3 SER A 6 -2.425 24.540 -3.957 1.00 0.00 H new ATOM 0 HG SER A 6 -1.030 24.578 -2.103 1.00 0.00 H new ATOM 61 N GLY A 7 -4.141 27.017 -5.416 1.00 0.00 N ATOM 62 CA GLY A 7 -5.238 26.940 -6.362 1.00 0.00 C ATOM 63 C GLY A 7 -6.206 25.820 -6.037 1.00 0.00 C ATOM 64 O GLY A 7 -7.419 26.031 -5.992 1.00 0.00 O ATOM 0 H GLY A 7 -4.330 27.579 -4.586 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -5.774 27.889 -6.370 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -4.839 26.791 -7.365 1.00 0.00 H new ATOM 68 N SER A 8 -5.672 24.624 -5.811 1.00 0.00 N ATOM 69 CA SER A 8 -6.497 23.467 -5.489 1.00 0.00 C ATOM 70 C SER A 8 -5.638 22.305 -5.001 1.00 0.00 C ATOM 71 O SER A 8 -5.730 21.896 -3.843 1.00 0.00 O ATOM 72 CB SER A 8 -7.309 23.038 -6.712 1.00 0.00 C ATOM 73 OG SER A 8 -8.603 22.600 -6.338 1.00 0.00 O ATOM 0 H SER A 8 -4.671 24.432 -5.845 1.00 0.00 H new ATOM 0 HA SER A 8 -7.181 23.751 -4.689 1.00 0.00 H new ATOM 0 HB2 SER A 8 -7.392 23.873 -7.408 1.00 0.00 H new ATOM 0 HB3 SER A 8 -6.788 22.236 -7.235 1.00 0.00 H new ATOM 0 HG SER A 8 -9.102 22.333 -7.138 1.00 0.00 H new ATOM 79 N SER A 9 -4.805 21.776 -5.891 1.00 0.00 N ATOM 80 CA SER A 9 -3.930 20.660 -5.551 1.00 0.00 C ATOM 81 C SER A 9 -2.491 20.949 -5.970 1.00 0.00 C ATOM 82 O SER A 9 -2.250 21.596 -6.989 1.00 0.00 O ATOM 83 CB SER A 9 -4.421 19.376 -6.221 1.00 0.00 C ATOM 84 OG SER A 9 -5.815 19.203 -6.032 1.00 0.00 O ATOM 0 H SER A 9 -4.717 22.102 -6.853 1.00 0.00 H new ATOM 0 HA SER A 9 -3.955 20.528 -4.469 1.00 0.00 H new ATOM 0 HB2 SER A 9 -4.197 19.410 -7.287 1.00 0.00 H new ATOM 0 HB3 SER A 9 -3.886 18.520 -5.810 1.00 0.00 H new ATOM 0 HG SER A 9 -6.105 18.376 -6.471 1.00 0.00 H new ATOM 90 N SER A 10 -1.541 20.465 -5.178 1.00 0.00 N ATOM 91 CA SER A 10 -0.125 20.672 -5.467 1.00 0.00 C ATOM 92 C SER A 10 0.704 19.476 -5.009 1.00 0.00 C ATOM 93 O SER A 10 1.871 19.619 -4.646 1.00 0.00 O ATOM 94 CB SER A 10 0.374 21.949 -4.786 1.00 0.00 C ATOM 95 OG SER A 10 0.461 23.019 -5.710 1.00 0.00 O ATOM 0 H SER A 10 -1.724 19.927 -4.331 1.00 0.00 H new ATOM 0 HA SER A 10 -0.010 20.777 -6.546 1.00 0.00 H new ATOM 0 HB2 SER A 10 -0.301 22.220 -3.974 1.00 0.00 H new ATOM 0 HB3 SER A 10 1.352 21.769 -4.340 1.00 0.00 H new ATOM 0 HG SER A 10 0.780 23.823 -5.250 1.00 0.00 H new ATOM 101 N SER A 11 0.093 18.295 -5.030 1.00 0.00 N ATOM 102 CA SER A 11 0.776 17.074 -4.618 1.00 0.00 C ATOM 103 C SER A 11 0.901 16.100 -5.785 1.00 0.00 C ATOM 104 O SER A 11 0.380 16.350 -6.873 1.00 0.00 O ATOM 105 CB SER A 11 0.024 16.409 -3.464 1.00 0.00 C ATOM 106 OG SER A 11 -1.378 16.489 -3.656 1.00 0.00 O ATOM 0 H SER A 11 -0.873 18.158 -5.328 1.00 0.00 H new ATOM 0 HA SER A 11 1.778 17.343 -4.284 1.00 0.00 H new ATOM 0 HB2 SER A 11 0.324 15.364 -3.384 1.00 0.00 H new ATOM 0 HB3 SER A 11 0.294 16.891 -2.524 1.00 0.00 H new ATOM 0 HG SER A 11 -1.836 16.055 -2.906 1.00 0.00 H new ATOM 111 N GLN A 12 1.592 14.990 -5.552 1.00 0.00 N ATOM 112 CA GLN A 12 1.784 13.979 -6.586 1.00 0.00 C ATOM 113 C GLN A 12 0.886 12.770 -6.338 1.00 0.00 C ATOM 114 O GLN A 12 0.672 12.367 -5.195 1.00 0.00 O ATOM 115 CB GLN A 12 3.249 13.540 -6.638 1.00 0.00 C ATOM 116 CG GLN A 12 3.728 12.866 -5.363 1.00 0.00 C ATOM 117 CD GLN A 12 4.564 13.785 -4.495 1.00 0.00 C ATOM 118 OE1 GLN A 12 4.170 14.136 -3.382 1.00 0.00 O ATOM 119 NE2 GLN A 12 5.726 14.182 -5.001 1.00 0.00 N ATOM 0 H GLN A 12 2.028 14.767 -4.657 1.00 0.00 H new ATOM 0 HA GLN A 12 1.512 14.421 -7.545 1.00 0.00 H new ATOM 0 HB2 GLN A 12 3.385 12.854 -7.474 1.00 0.00 H new ATOM 0 HB3 GLN A 12 3.874 14.411 -6.835 1.00 0.00 H new ATOM 0 HG2 GLN A 12 2.865 12.520 -4.793 1.00 0.00 H new ATOM 0 HG3 GLN A 12 4.314 11.984 -5.621 1.00 0.00 H new ATOM 0 HE21 GLN A 12 6.013 13.867 -5.928 1.00 0.00 H new ATOM 0 HE22 GLN A 12 6.331 14.802 -4.463 1.00 0.00 H new ATOM 128 N HIS A 13 0.363 12.200 -7.419 1.00 0.00 N ATOM 129 CA HIS A 13 -0.514 11.038 -7.323 1.00 0.00 C ATOM 130 C HIS A 13 0.060 9.858 -8.100 1.00 0.00 C ATOM 131 O HIS A 13 0.120 9.882 -9.330 1.00 0.00 O ATOM 132 CB HIS A 13 -1.908 11.380 -7.853 1.00 0.00 C ATOM 133 CG HIS A 13 -2.738 12.175 -6.894 1.00 0.00 C ATOM 134 ND1 HIS A 13 -4.090 11.967 -6.715 1.00 0.00 N ATOM 135 CD2 HIS A 13 -2.402 13.187 -6.057 1.00 0.00 C ATOM 136 CE1 HIS A 13 -4.549 12.815 -5.811 1.00 0.00 C ATOM 137 NE2 HIS A 13 -3.545 13.566 -5.397 1.00 0.00 N ATOM 0 H HIS A 13 0.531 12.524 -8.372 1.00 0.00 H new ATOM 0 HA HIS A 13 -0.590 10.757 -6.272 1.00 0.00 H new ATOM 0 HB2 HIS A 13 -1.806 11.940 -8.783 1.00 0.00 H new ATOM 0 HB3 HIS A 13 -2.432 10.455 -8.094 1.00 0.00 H new ATOM 0 HD2 HIS A 13 -1.418 13.615 -5.932 1.00 0.00 H new ATOM 0 HE1 HIS A 13 -5.571 12.882 -5.469 1.00 0.00 H new ATOM 0 HE2 HIS A 13 -3.608 14.308 -4.700 1.00 0.00 H new ATOM 146 N PHE A 14 0.484 8.827 -7.377 1.00 0.00 N ATOM 147 CA PHE A 14 1.054 7.638 -8.001 1.00 0.00 C ATOM 148 C PHE A 14 0.061 6.480 -7.971 1.00 0.00 C ATOM 149 O PHE A 14 -0.463 6.127 -6.916 1.00 0.00 O ATOM 150 CB PHE A 14 2.349 7.236 -7.292 1.00 0.00 C ATOM 151 CG PHE A 14 3.548 8.021 -7.741 1.00 0.00 C ATOM 152 CD1 PHE A 14 4.263 7.637 -8.865 1.00 0.00 C ATOM 153 CD2 PHE A 14 3.962 9.143 -7.040 1.00 0.00 C ATOM 154 CE1 PHE A 14 5.366 8.357 -9.281 1.00 0.00 C ATOM 155 CE2 PHE A 14 5.065 9.867 -7.452 1.00 0.00 C ATOM 156 CZ PHE A 14 5.767 9.474 -8.574 1.00 0.00 C ATOM 0 H PHE A 14 0.444 8.791 -6.358 1.00 0.00 H new ATOM 0 HA PHE A 14 1.277 7.874 -9.041 1.00 0.00 H new ATOM 0 HB2 PHE A 14 2.221 7.367 -6.217 1.00 0.00 H new ATOM 0 HB3 PHE A 14 2.534 6.176 -7.464 1.00 0.00 H new ATOM 0 HD1 PHE A 14 3.954 6.765 -9.422 1.00 0.00 H new ATOM 0 HD2 PHE A 14 3.416 9.455 -6.162 1.00 0.00 H new ATOM 0 HE1 PHE A 14 5.914 8.047 -10.158 1.00 0.00 H new ATOM 0 HE2 PHE A 14 5.377 10.739 -6.897 1.00 0.00 H new ATOM 0 HZ PHE A 14 6.628 10.039 -8.898 1.00 0.00 H new ATOM 166 N ASN A 15 -0.195 5.894 -9.137 1.00 0.00 N ATOM 167 CA ASN A 15 -1.128 4.777 -9.243 1.00 0.00 C ATOM 168 C ASN A 15 -0.568 3.531 -8.561 1.00 0.00 C ATOM 169 O ASN A 15 0.401 2.937 -9.032 1.00 0.00 O ATOM 170 CB ASN A 15 -1.431 4.477 -10.712 1.00 0.00 C ATOM 171 CG ASN A 15 -2.521 5.369 -11.271 1.00 0.00 C ATOM 172 OD1 ASN A 15 -2.244 6.358 -11.951 1.00 0.00 O ATOM 173 ND2 ASN A 15 -3.772 5.025 -10.986 1.00 0.00 N ATOM 0 H ASN A 15 0.230 6.174 -10.021 1.00 0.00 H new ATOM 0 HA ASN A 15 -2.052 5.059 -8.739 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -0.523 4.605 -11.301 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -1.732 3.434 -10.813 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -4.548 5.588 -11.334 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -3.957 4.197 -10.419 1.00 0.00 H new ATOM 180 N LEU A 16 -1.189 3.140 -7.452 1.00 0.00 N ATOM 181 CA LEU A 16 -0.755 1.963 -6.706 1.00 0.00 C ATOM 182 C LEU A 16 -1.493 0.718 -7.187 1.00 0.00 C ATOM 183 O LEU A 16 -2.706 0.747 -7.397 1.00 0.00 O ATOM 184 CB LEU A 16 -0.995 2.168 -5.209 1.00 0.00 C ATOM 185 CG LEU A 16 -0.349 1.123 -4.299 1.00 0.00 C ATOM 186 CD1 LEU A 16 1.166 1.156 -4.439 1.00 0.00 C ATOM 187 CD2 LEU A 16 -0.760 1.351 -2.851 1.00 0.00 C ATOM 0 H LEU A 16 -1.994 3.621 -7.050 1.00 0.00 H new ATOM 0 HA LEU A 16 0.312 1.822 -6.879 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.621 3.153 -4.928 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -2.070 2.172 -5.026 1.00 0.00 H new ATOM 0 HG LEU A 16 -0.699 0.137 -4.604 1.00 0.00 H new ATOM 0 HD11 LEU A 16 1.608 0.406 -3.784 1.00 0.00 H new ATOM 0 HD12 LEU A 16 1.441 0.943 -5.472 1.00 0.00 H new ATOM 0 HD13 LEU A 16 1.536 2.143 -4.161 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -0.291 0.598 -2.217 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -0.440 2.343 -2.534 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -1.844 1.275 -2.764 1.00 0.00 H new ATOM 199 N ASN A 17 -0.756 -0.374 -7.366 1.00 0.00 N ATOM 200 CA ASN A 17 -1.349 -1.623 -7.827 1.00 0.00 C ATOM 201 C ASN A 17 -0.532 -2.828 -7.369 1.00 0.00 C ATOM 202 O ASN A 17 0.679 -2.889 -7.582 1.00 0.00 O ATOM 203 CB ASN A 17 -1.460 -1.624 -9.353 1.00 0.00 C ATOM 204 CG ASN A 17 -2.742 -0.979 -9.842 1.00 0.00 C ATOM 205 OD1 ASN A 17 -3.784 -1.630 -9.928 1.00 0.00 O ATOM 206 ND2 ASN A 17 -2.673 0.307 -10.163 1.00 0.00 N ATOM 0 H ASN A 17 0.249 -0.419 -7.199 1.00 0.00 H new ATOM 0 HA ASN A 17 -2.345 -1.699 -7.391 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -0.606 -1.095 -9.777 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -1.412 -2.650 -9.717 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -3.504 0.795 -10.496 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -1.788 0.808 -10.076 1.00 0.00 H new ATOM 213 N PHE A 18 -1.208 -3.790 -6.747 1.00 0.00 N ATOM 214 CA PHE A 18 -0.552 -5.002 -6.266 1.00 0.00 C ATOM 215 C PHE A 18 -1.583 -6.070 -5.913 1.00 0.00 C ATOM 216 O PHE A 18 -2.358 -5.914 -4.970 1.00 0.00 O ATOM 217 CB PHE A 18 0.328 -4.695 -5.051 1.00 0.00 C ATOM 218 CG PHE A 18 -0.439 -4.243 -3.842 1.00 0.00 C ATOM 219 CD1 PHE A 18 -0.986 -2.972 -3.790 1.00 0.00 C ATOM 220 CD2 PHE A 18 -0.609 -5.089 -2.757 1.00 0.00 C ATOM 221 CE1 PHE A 18 -1.689 -2.551 -2.678 1.00 0.00 C ATOM 222 CE2 PHE A 18 -1.312 -4.674 -1.643 1.00 0.00 C ATOM 223 CZ PHE A 18 -1.853 -3.403 -1.602 1.00 0.00 C ATOM 0 H PHE A 18 -2.211 -3.754 -6.564 1.00 0.00 H new ATOM 0 HA PHE A 18 0.082 -5.383 -7.067 1.00 0.00 H new ATOM 0 HB2 PHE A 18 0.899 -5.587 -4.794 1.00 0.00 H new ATOM 0 HB3 PHE A 18 1.048 -3.923 -5.322 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -0.862 -2.302 -4.628 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -0.187 -6.083 -2.783 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -2.110 -1.557 -2.649 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -1.439 -5.342 -0.804 1.00 0.00 H new ATOM 0 HZ PHE A 18 -2.402 -3.076 -0.732 1.00 0.00 H new ATOM 233 N THR A 19 -1.587 -7.152 -6.684 1.00 0.00 N ATOM 234 CA THR A 19 -2.524 -8.248 -6.464 1.00 0.00 C ATOM 235 C THR A 19 -2.201 -8.999 -5.177 1.00 0.00 C ATOM 236 O THR A 19 -1.045 -9.321 -4.906 1.00 0.00 O ATOM 237 CB THR A 19 -2.496 -9.214 -7.649 1.00 0.00 C ATOM 238 OG1 THR A 19 -2.768 -8.532 -8.860 1.00 0.00 O ATOM 239 CG2 THR A 19 -3.495 -10.344 -7.525 1.00 0.00 C ATOM 0 H THR A 19 -0.951 -7.294 -7.468 1.00 0.00 H new ATOM 0 HA THR A 19 -3.523 -7.821 -6.371 1.00 0.00 H new ATOM 0 HB THR A 19 -1.491 -9.637 -7.651 1.00 0.00 H new ATOM 0 HG1 THR A 19 -2.744 -9.167 -9.606 1.00 0.00 H new ATOM 0 HG21 THR A 19 -3.422 -10.992 -8.399 1.00 0.00 H new ATOM 0 HG22 THR A 19 -3.281 -10.922 -6.626 1.00 0.00 H new ATOM 0 HG23 THR A 19 -4.503 -9.933 -7.461 1.00 0.00 H new ATOM 247 N ILE A 20 -3.235 -9.278 -4.387 1.00 0.00 N ATOM 248 CA ILE A 20 -3.065 -9.996 -3.130 1.00 0.00 C ATOM 249 C ILE A 20 -3.567 -11.432 -3.250 1.00 0.00 C ATOM 250 O ILE A 20 -4.771 -11.683 -3.223 1.00 0.00 O ATOM 251 CB ILE A 20 -3.810 -9.299 -1.975 1.00 0.00 C ATOM 252 CG1 ILE A 20 -3.494 -7.802 -1.961 1.00 0.00 C ATOM 253 CG2 ILE A 20 -3.437 -9.936 -0.645 1.00 0.00 C ATOM 254 CD1 ILE A 20 -4.516 -6.978 -1.209 1.00 0.00 C ATOM 0 H ILE A 20 -4.199 -9.017 -4.596 1.00 0.00 H new ATOM 0 HA ILE A 20 -1.997 -10.000 -2.910 1.00 0.00 H new ATOM 0 HB ILE A 20 -4.882 -9.422 -2.129 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -2.513 -7.650 -1.511 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -3.433 -7.442 -2.988 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -3.971 -9.433 0.162 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -3.709 -10.991 -0.658 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -2.363 -9.840 -0.484 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -4.229 -5.927 -1.239 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -5.495 -7.101 -1.673 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -4.561 -7.312 -0.172 1.00 0.00 H new ATOM 266 N THR A 21 -2.633 -12.369 -3.384 1.00 0.00 N ATOM 267 CA THR A 21 -2.978 -13.780 -3.513 1.00 0.00 C ATOM 268 C THR A 21 -3.792 -14.260 -2.315 1.00 0.00 C ATOM 269 O THR A 21 -4.617 -15.165 -2.437 1.00 0.00 O ATOM 270 CB THR A 21 -1.709 -14.623 -3.652 1.00 0.00 C ATOM 271 OG1 THR A 21 -0.719 -14.195 -2.733 1.00 0.00 O ATOM 272 CG2 THR A 21 -1.103 -14.567 -5.038 1.00 0.00 C ATOM 0 H THR A 21 -1.632 -12.176 -3.406 1.00 0.00 H new ATOM 0 HA THR A 21 -3.588 -13.897 -4.409 1.00 0.00 H new ATOM 0 HB THR A 21 -2.019 -15.648 -3.449 1.00 0.00 H new ATOM 0 HG1 THR A 21 -1.150 -13.764 -1.965 1.00 0.00 H new ATOM 0 HG21 THR A 21 -0.206 -15.186 -5.068 1.00 0.00 H new ATOM 0 HG22 THR A 21 -1.825 -14.938 -5.766 1.00 0.00 H new ATOM 0 HG23 THR A 21 -0.841 -13.537 -5.279 1.00 0.00 H new ATOM 280 N ASN A 22 -3.554 -13.650 -1.159 1.00 0.00 N ATOM 281 CA ASN A 22 -4.267 -14.018 0.059 1.00 0.00 C ATOM 282 C ASN A 22 -5.722 -13.565 -0.002 1.00 0.00 C ATOM 283 O ASN A 22 -6.638 -14.348 0.254 1.00 0.00 O ATOM 284 CB ASN A 22 -3.581 -13.404 1.281 1.00 0.00 C ATOM 285 CG ASN A 22 -3.776 -14.237 2.533 1.00 0.00 C ATOM 286 OD1 ASN A 22 -3.528 -15.443 2.535 1.00 0.00 O ATOM 287 ND2 ASN A 22 -4.225 -13.596 3.606 1.00 0.00 N ATOM 0 H ASN A 22 -2.874 -12.899 -1.040 1.00 0.00 H new ATOM 0 HA ASN A 22 -4.248 -15.104 0.146 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -2.515 -13.298 1.081 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -3.975 -12.402 1.450 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -4.377 -14.104 4.477 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -4.417 -12.595 3.559 1.00 0.00 H new ATOM 294 N LEU A 23 -5.926 -12.297 -0.342 1.00 0.00 N ATOM 295 CA LEU A 23 -7.269 -11.736 -0.437 1.00 0.00 C ATOM 296 C LEU A 23 -7.991 -12.255 -1.681 1.00 0.00 C ATOM 297 O LEU A 23 -7.610 -11.933 -2.806 1.00 0.00 O ATOM 298 CB LEU A 23 -7.200 -10.208 -0.476 1.00 0.00 C ATOM 299 CG LEU A 23 -8.410 -9.491 0.123 1.00 0.00 C ATOM 300 CD1 LEU A 23 -9.667 -9.814 -0.669 1.00 0.00 C ATOM 301 CD2 LEU A 23 -8.586 -9.874 1.585 1.00 0.00 C ATOM 0 H LEU A 23 -5.178 -11.638 -0.557 1.00 0.00 H new ATOM 0 HA LEU A 23 -7.831 -12.048 0.443 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -6.305 -9.886 0.057 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.085 -9.891 -1.512 1.00 0.00 H new ATOM 0 HG LEU A 23 -8.236 -8.416 0.068 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -10.518 -9.295 -0.228 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.540 -9.490 -1.702 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.846 -10.889 -0.645 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -9.452 -9.354 1.996 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -8.738 -10.951 1.663 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.694 -9.592 2.145 1.00 0.00 H new ATOM 313 N PRO A 24 -9.048 -13.068 -1.498 1.00 0.00 N ATOM 314 CA PRO A 24 -9.815 -13.623 -2.616 1.00 0.00 C ATOM 315 C PRO A 24 -10.748 -12.594 -3.244 1.00 0.00 C ATOM 316 O PRO A 24 -10.790 -11.440 -2.820 1.00 0.00 O ATOM 317 CB PRO A 24 -10.617 -14.747 -1.963 1.00 0.00 C ATOM 318 CG PRO A 24 -10.813 -14.295 -0.557 1.00 0.00 C ATOM 319 CD PRO A 24 -9.580 -13.510 -0.192 1.00 0.00 C ATOM 0 HA PRO A 24 -9.173 -13.956 -3.431 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -11.571 -14.899 -2.468 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -10.080 -15.694 -2.004 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -11.708 -13.679 -0.467 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -10.944 -15.146 0.111 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -9.820 -12.663 0.450 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -8.859 -14.124 0.347 1.00 0.00 H new ATOM 327 N TYR A 25 -11.498 -13.022 -4.254 1.00 0.00 N ATOM 328 CA TYR A 25 -12.432 -12.136 -4.939 1.00 0.00 C ATOM 329 C TYR A 25 -13.757 -12.844 -5.205 1.00 0.00 C ATOM 330 O TYR A 25 -13.815 -13.811 -5.964 1.00 0.00 O ATOM 331 CB TYR A 25 -11.831 -11.644 -6.256 1.00 0.00 C ATOM 332 CG TYR A 25 -12.382 -10.312 -6.712 1.00 0.00 C ATOM 333 CD1 TYR A 25 -13.741 -10.147 -6.955 1.00 0.00 C ATOM 334 CD2 TYR A 25 -11.545 -9.219 -6.898 1.00 0.00 C ATOM 335 CE1 TYR A 25 -14.248 -8.932 -7.372 1.00 0.00 C ATOM 336 CE2 TYR A 25 -12.046 -8.000 -7.313 1.00 0.00 C ATOM 337 CZ TYR A 25 -13.397 -7.862 -7.549 1.00 0.00 C ATOM 338 OH TYR A 25 -13.899 -6.649 -7.963 1.00 0.00 O ATOM 0 H TYR A 25 -11.477 -13.975 -4.616 1.00 0.00 H new ATOM 0 HA TYR A 25 -12.621 -11.279 -4.292 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -10.750 -11.561 -6.144 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -12.015 -12.388 -7.031 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -14.411 -10.983 -6.815 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -10.486 -9.324 -6.715 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -15.306 -8.821 -7.559 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -11.382 -7.159 -7.452 1.00 0.00 H new ATOM 0 HH TYR A 25 -13.158 -6.039 -8.161 1.00 0.00 H new ATOM 348 N SER A 26 -14.818 -12.354 -4.574 1.00 0.00 N ATOM 349 CA SER A 26 -16.144 -12.938 -4.742 1.00 0.00 C ATOM 350 C SER A 26 -17.131 -11.901 -5.267 1.00 0.00 C ATOM 351 O SER A 26 -16.757 -10.767 -5.566 1.00 0.00 O ATOM 352 CB SER A 26 -16.643 -13.508 -3.413 1.00 0.00 C ATOM 353 OG SER A 26 -17.664 -14.470 -3.620 1.00 0.00 O ATOM 0 H SER A 26 -14.786 -11.554 -3.942 1.00 0.00 H new ATOM 0 HA SER A 26 -16.071 -13.745 -5.471 1.00 0.00 H new ATOM 0 HB2 SER A 26 -15.812 -13.965 -2.875 1.00 0.00 H new ATOM 0 HB3 SER A 26 -17.022 -12.700 -2.787 1.00 0.00 H new ATOM 0 HG SER A 26 -17.964 -14.819 -2.755 1.00 0.00 H new ATOM 359 N GLN A 27 -18.395 -12.298 -5.377 1.00 0.00 N ATOM 360 CA GLN A 27 -19.437 -11.402 -5.866 1.00 0.00 C ATOM 361 C GLN A 27 -19.573 -10.181 -4.963 1.00 0.00 C ATOM 362 O GLN A 27 -19.906 -9.089 -5.425 1.00 0.00 O ATOM 363 CB GLN A 27 -20.774 -12.140 -5.952 1.00 0.00 C ATOM 364 CG GLN A 27 -21.108 -12.940 -4.703 1.00 0.00 C ATOM 365 CD GLN A 27 -20.800 -14.417 -4.858 1.00 0.00 C ATOM 366 OE1 GLN A 27 -19.705 -14.794 -5.275 1.00 0.00 O ATOM 367 NE2 GLN A 27 -21.768 -15.262 -4.522 1.00 0.00 N ATOM 0 H GLN A 27 -18.722 -13.233 -5.134 1.00 0.00 H new ATOM 0 HA GLN A 27 -19.152 -11.064 -6.862 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -21.568 -11.416 -6.133 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -20.754 -12.812 -6.810 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -20.545 -12.542 -3.859 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -22.165 -12.816 -4.468 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -22.661 -14.905 -4.181 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -21.619 -16.268 -4.605 1.00 0.00 H new ATOM 376 N ASP A 28 -19.313 -10.373 -3.674 1.00 0.00 N ATOM 377 CA ASP A 28 -19.406 -9.287 -2.705 1.00 0.00 C ATOM 378 C ASP A 28 -18.418 -8.173 -3.039 1.00 0.00 C ATOM 379 O ASP A 28 -18.773 -6.995 -3.044 1.00 0.00 O ATOM 380 CB ASP A 28 -19.143 -9.812 -1.293 1.00 0.00 C ATOM 381 CG ASP A 28 -19.970 -11.040 -0.969 1.00 0.00 C ATOM 382 OD1 ASP A 28 -19.812 -12.063 -1.668 1.00 0.00 O ATOM 383 OD2 ASP A 28 -20.775 -10.980 -0.017 1.00 0.00 O ATOM 0 H ASP A 28 -19.036 -11.271 -3.276 1.00 0.00 H new ATOM 0 HA ASP A 28 -20.415 -8.878 -2.751 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -18.085 -10.052 -1.189 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -19.364 -9.027 -0.570 1.00 0.00 H new ATOM 388 N ILE A 29 -17.175 -8.554 -3.317 1.00 0.00 N ATOM 389 CA ILE A 29 -16.137 -7.587 -3.651 1.00 0.00 C ATOM 390 C ILE A 29 -16.487 -6.806 -4.917 1.00 0.00 C ATOM 391 O ILE A 29 -15.898 -5.760 -5.192 1.00 0.00 O ATOM 392 CB ILE A 29 -14.770 -8.275 -3.844 1.00 0.00 C ATOM 393 CG1 ILE A 29 -14.451 -9.174 -2.647 1.00 0.00 C ATOM 394 CG2 ILE A 29 -13.675 -7.236 -4.038 1.00 0.00 C ATOM 395 CD1 ILE A 29 -14.504 -8.453 -1.317 1.00 0.00 C ATOM 0 H ILE A 29 -16.863 -9.525 -3.317 1.00 0.00 H new ATOM 0 HA ILE A 29 -16.073 -6.894 -2.812 1.00 0.00 H new ATOM 0 HB ILE A 29 -14.818 -8.896 -4.738 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -15.156 -10.005 -2.629 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.457 -9.602 -2.779 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -12.717 -7.738 -4.173 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -13.897 -6.634 -4.919 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -13.626 -6.591 -3.161 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -14.267 -9.152 -0.515 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -13.779 -7.639 -1.315 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -15.504 -8.048 -1.162 1.00 0.00 H new ATOM 407 N ALA A 30 -17.444 -7.315 -5.688 1.00 0.00 N ATOM 408 CA ALA A 30 -17.864 -6.658 -6.920 1.00 0.00 C ATOM 409 C ALA A 30 -18.941 -5.610 -6.651 1.00 0.00 C ATOM 410 O ALA A 30 -19.105 -4.666 -7.424 1.00 0.00 O ATOM 411 CB ALA A 30 -18.366 -7.688 -7.920 1.00 0.00 C ATOM 0 H ALA A 30 -17.943 -8.180 -5.481 1.00 0.00 H new ATOM 0 HA ALA A 30 -16.998 -6.147 -7.341 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -18.677 -7.185 -8.836 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -17.567 -8.394 -8.147 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -19.214 -8.224 -7.495 1.00 0.00 H new ATOM 417 N GLN A 31 -19.675 -5.782 -5.555 1.00 0.00 N ATOM 418 CA GLN A 31 -20.738 -4.849 -5.192 1.00 0.00 C ATOM 419 C GLN A 31 -20.397 -4.102 -3.901 1.00 0.00 C ATOM 420 O GLN A 31 -20.288 -4.711 -2.837 1.00 0.00 O ATOM 421 CB GLN A 31 -22.062 -5.594 -5.027 1.00 0.00 C ATOM 422 CG GLN A 31 -22.884 -5.663 -6.305 1.00 0.00 C ATOM 423 CD GLN A 31 -23.667 -4.392 -6.562 1.00 0.00 C ATOM 424 OE1 GLN A 31 -23.131 -3.287 -6.462 1.00 0.00 O ATOM 425 NE2 GLN A 31 -24.945 -4.539 -6.895 1.00 0.00 N ATOM 0 H GLN A 31 -19.554 -6.557 -4.904 1.00 0.00 H new ATOM 0 HA GLN A 31 -20.835 -4.119 -5.996 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -21.859 -6.607 -4.680 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -22.651 -5.104 -4.252 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -22.221 -5.854 -7.149 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -23.574 -6.505 -6.244 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -25.349 -5.473 -6.967 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -25.522 -3.718 -7.079 1.00 0.00 H new ATOM 434 N PRO A 32 -20.223 -2.768 -3.974 1.00 0.00 N ATOM 435 CA PRO A 32 -19.894 -1.950 -2.801 1.00 0.00 C ATOM 436 C PRO A 32 -20.965 -2.022 -1.715 1.00 0.00 C ATOM 437 O PRO A 32 -20.710 -1.695 -0.556 1.00 0.00 O ATOM 438 CB PRO A 32 -19.805 -0.524 -3.361 1.00 0.00 C ATOM 439 CG PRO A 32 -19.608 -0.693 -4.828 1.00 0.00 C ATOM 440 CD PRO A 32 -20.331 -1.954 -5.197 1.00 0.00 C ATOM 0 HA PRO A 32 -18.977 -2.293 -2.322 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -20.713 0.040 -3.148 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -18.976 0.024 -2.913 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -20.006 0.161 -5.377 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -18.549 -0.764 -5.074 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -21.370 -1.760 -5.462 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -19.870 -2.448 -6.053 1.00 0.00 H new ATOM 448 N SER A 33 -22.167 -2.447 -2.097 1.00 0.00 N ATOM 449 CA SER A 33 -23.274 -2.554 -1.154 1.00 0.00 C ATOM 450 C SER A 33 -23.020 -3.649 -0.120 1.00 0.00 C ATOM 451 O SER A 33 -23.458 -3.545 1.025 1.00 0.00 O ATOM 452 CB SER A 33 -24.579 -2.836 -1.900 1.00 0.00 C ATOM 453 OG SER A 33 -25.690 -2.293 -1.208 1.00 0.00 O ATOM 0 H SER A 33 -22.398 -2.722 -3.052 1.00 0.00 H new ATOM 0 HA SER A 33 -23.357 -1.603 -0.628 1.00 0.00 H new ATOM 0 HB2 SER A 33 -24.528 -2.411 -2.902 1.00 0.00 H new ATOM 0 HB3 SER A 33 -24.710 -3.912 -2.017 1.00 0.00 H new ATOM 0 HG SER A 33 -26.512 -2.486 -1.706 1.00 0.00 H new ATOM 459 N THR A 34 -22.314 -4.698 -0.532 1.00 0.00 N ATOM 460 CA THR A 34 -22.010 -5.810 0.363 1.00 0.00 C ATOM 461 C THR A 34 -21.016 -5.389 1.442 1.00 0.00 C ATOM 462 O THR A 34 -20.398 -4.328 1.352 1.00 0.00 O ATOM 463 CB THR A 34 -21.452 -6.992 -0.428 1.00 0.00 C ATOM 464 OG1 THR A 34 -20.320 -6.598 -1.182 1.00 0.00 O ATOM 465 CG2 THR A 34 -22.454 -7.598 -1.386 1.00 0.00 C ATOM 0 H THR A 34 -21.943 -4.801 -1.476 1.00 0.00 H new ATOM 0 HA THR A 34 -22.937 -6.113 0.849 1.00 0.00 H new ATOM 0 HB THR A 34 -21.189 -7.742 0.318 1.00 0.00 H new ATOM 0 HG1 THR A 34 -20.611 -6.095 -1.971 1.00 0.00 H new ATOM 0 HG21 THR A 34 -21.993 -8.432 -1.915 1.00 0.00 H new ATOM 0 HG22 THR A 34 -23.320 -7.956 -0.829 1.00 0.00 H new ATOM 0 HG23 THR A 34 -22.772 -6.843 -2.105 1.00 0.00 H new ATOM 473 N THR A 35 -20.868 -6.230 2.461 1.00 0.00 N ATOM 474 CA THR A 35 -19.951 -5.949 3.559 1.00 0.00 C ATOM 475 C THR A 35 -18.525 -6.357 3.201 1.00 0.00 C ATOM 476 O THR A 35 -17.562 -5.719 3.627 1.00 0.00 O ATOM 477 CB THR A 35 -20.401 -6.682 4.824 1.00 0.00 C ATOM 478 OG1 THR A 35 -21.808 -6.837 4.841 1.00 0.00 O ATOM 479 CG2 THR A 35 -20.001 -5.973 6.101 1.00 0.00 C ATOM 0 H THR A 35 -21.372 -7.112 2.549 1.00 0.00 H new ATOM 0 HA THR A 35 -19.964 -4.875 3.743 1.00 0.00 H new ATOM 0 HB THR A 35 -19.898 -7.649 4.791 1.00 0.00 H new ATOM 0 HG1 THR A 35 -22.075 -7.309 5.657 1.00 0.00 H new ATOM 0 HG21 THR A 35 -20.351 -6.546 6.960 1.00 0.00 H new ATOM 0 HG22 THR A 35 -18.916 -5.883 6.143 1.00 0.00 H new ATOM 0 HG23 THR A 35 -20.448 -4.979 6.121 1.00 0.00 H new ATOM 487 N LYS A 36 -18.397 -7.425 2.421 1.00 0.00 N ATOM 488 CA LYS A 36 -17.086 -7.921 2.010 1.00 0.00 C ATOM 489 C LYS A 36 -16.285 -6.830 1.305 1.00 0.00 C ATOM 490 O LYS A 36 -15.055 -6.811 1.370 1.00 0.00 O ATOM 491 CB LYS A 36 -17.241 -9.131 1.088 1.00 0.00 C ATOM 492 CG LYS A 36 -16.134 -10.161 1.247 1.00 0.00 C ATOM 493 CD LYS A 36 -16.110 -10.746 2.651 1.00 0.00 C ATOM 494 CE LYS A 36 -14.906 -10.255 3.440 1.00 0.00 C ATOM 495 NZ LYS A 36 -14.597 -11.144 4.594 1.00 0.00 N ATOM 0 H LYS A 36 -19.184 -7.964 2.060 1.00 0.00 H new ATOM 0 HA LYS A 36 -16.544 -8.222 2.906 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -18.201 -9.608 1.286 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -17.262 -8.789 0.053 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -16.275 -10.962 0.521 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -15.172 -9.698 1.029 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -17.026 -10.473 3.176 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -16.089 -11.834 2.592 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -14.039 -10.200 2.782 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -15.097 -9.244 3.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -13.770 -10.774 5.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -15.415 -11.177 5.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -14.390 -12.103 4.248 1.00 0.00 H new ATOM 509 N TYR A 37 -16.986 -5.924 0.634 1.00 0.00 N ATOM 510 CA TYR A 37 -16.336 -4.831 -0.080 1.00 0.00 C ATOM 511 C TYR A 37 -15.865 -3.751 0.889 1.00 0.00 C ATOM 512 O TYR A 37 -14.685 -3.404 0.921 1.00 0.00 O ATOM 513 CB TYR A 37 -17.291 -4.228 -1.112 1.00 0.00 C ATOM 514 CG TYR A 37 -16.694 -3.080 -1.895 1.00 0.00 C ATOM 515 CD1 TYR A 37 -16.665 -1.795 -1.366 1.00 0.00 C ATOM 516 CD2 TYR A 37 -16.160 -3.282 -3.161 1.00 0.00 C ATOM 517 CE1 TYR A 37 -16.121 -0.744 -2.080 1.00 0.00 C ATOM 518 CE2 TYR A 37 -15.614 -2.235 -3.880 1.00 0.00 C ATOM 519 CZ TYR A 37 -15.597 -0.969 -3.335 1.00 0.00 C ATOM 520 OH TYR A 37 -15.056 0.076 -4.048 1.00 0.00 O ATOM 0 H TYR A 37 -18.004 -5.924 0.569 1.00 0.00 H new ATOM 0 HA TYR A 37 -15.465 -5.235 -0.595 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -17.600 -5.008 -1.807 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -18.190 -3.880 -0.603 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -17.074 -1.615 -0.383 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -16.171 -4.273 -3.591 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -16.107 0.249 -1.656 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -15.203 -2.408 -4.864 1.00 0.00 H new ATOM 0 HH TYR A 37 -14.730 -0.252 -4.912 1.00 0.00 H new ATOM 530 N GLN A 38 -16.797 -3.223 1.677 1.00 0.00 N ATOM 531 CA GLN A 38 -16.477 -2.182 2.646 1.00 0.00 C ATOM 532 C GLN A 38 -15.448 -2.677 3.658 1.00 0.00 C ATOM 533 O GLN A 38 -14.641 -1.899 4.168 1.00 0.00 O ATOM 534 CB GLN A 38 -17.744 -1.724 3.370 1.00 0.00 C ATOM 535 CG GLN A 38 -18.624 -0.808 2.535 1.00 0.00 C ATOM 536 CD GLN A 38 -20.101 -1.100 2.711 1.00 0.00 C ATOM 537 OE1 GLN A 38 -20.494 -1.871 3.587 1.00 0.00 O ATOM 538 NE2 GLN A 38 -20.929 -0.482 1.877 1.00 0.00 N ATOM 0 H GLN A 38 -17.779 -3.499 1.663 1.00 0.00 H new ATOM 0 HA GLN A 38 -16.050 -1.337 2.106 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -18.322 -2.600 3.664 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -17.462 -1.206 4.287 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -18.427 0.228 2.809 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -18.359 -0.915 1.483 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -20.560 0.149 1.166 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -21.935 -0.638 1.948 1.00 0.00 H new ATOM 547 N GLN A 39 -15.484 -3.973 3.948 1.00 0.00 N ATOM 548 CA GLN A 39 -14.554 -4.570 4.899 1.00 0.00 C ATOM 549 C GLN A 39 -13.151 -4.658 4.308 1.00 0.00 C ATOM 550 O GLN A 39 -12.204 -4.077 4.838 1.00 0.00 O ATOM 551 CB GLN A 39 -15.036 -5.963 5.310 1.00 0.00 C ATOM 552 CG GLN A 39 -15.909 -5.963 6.554 1.00 0.00 C ATOM 553 CD GLN A 39 -15.156 -6.400 7.794 1.00 0.00 C ATOM 554 OE1 GLN A 39 -13.957 -6.152 7.926 1.00 0.00 O ATOM 555 NE2 GLN A 39 -15.857 -7.054 8.713 1.00 0.00 N ATOM 0 H GLN A 39 -16.147 -4.630 3.538 1.00 0.00 H new ATOM 0 HA GLN A 39 -14.516 -3.931 5.781 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -15.595 -6.403 4.484 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -14.170 -6.601 5.484 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -16.311 -4.962 6.711 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -16.759 -6.627 6.397 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -16.849 -7.238 8.562 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -15.404 -7.372 9.569 1.00 0.00 H new ATOM 564 N THR A 40 -13.024 -5.392 3.207 1.00 0.00 N ATOM 565 CA THR A 40 -11.736 -5.558 2.543 1.00 0.00 C ATOM 566 C THR A 40 -11.167 -4.211 2.106 1.00 0.00 C ATOM 567 O THR A 40 -9.951 -4.028 2.048 1.00 0.00 O ATOM 568 CB THR A 40 -11.879 -6.481 1.332 1.00 0.00 C ATOM 569 OG1 THR A 40 -12.636 -7.630 1.665 1.00 0.00 O ATOM 570 CG2 THR A 40 -10.551 -6.952 0.776 1.00 0.00 C ATOM 0 H THR A 40 -13.797 -5.881 2.756 1.00 0.00 H new ATOM 0 HA THR A 40 -11.045 -6.008 3.256 1.00 0.00 H new ATOM 0 HB THR A 40 -12.381 -5.883 0.571 1.00 0.00 H new ATOM 0 HG1 THR A 40 -13.582 -7.468 1.465 1.00 0.00 H new ATOM 0 HG21 THR A 40 -10.726 -7.603 -0.081 1.00 0.00 H new ATOM 0 HG22 THR A 40 -9.961 -6.090 0.463 1.00 0.00 H new ATOM 0 HG23 THR A 40 -10.009 -7.502 1.545 1.00 0.00 H new ATOM 578 N LYS A 41 -12.054 -3.272 1.795 1.00 0.00 N ATOM 579 CA LYS A 41 -11.640 -1.943 1.362 1.00 0.00 C ATOM 580 C LYS A 41 -11.021 -1.159 2.514 1.00 0.00 C ATOM 581 O LYS A 41 -10.023 -0.460 2.338 1.00 0.00 O ATOM 582 CB LYS A 41 -12.833 -1.174 0.792 1.00 0.00 C ATOM 583 CG LYS A 41 -12.447 0.113 0.084 1.00 0.00 C ATOM 584 CD LYS A 41 -13.581 0.636 -0.782 1.00 0.00 C ATOM 585 CE LYS A 41 -13.236 1.980 -1.401 1.00 0.00 C ATOM 586 NZ LYS A 41 -14.455 2.730 -1.814 1.00 0.00 N ATOM 0 H LYS A 41 -13.064 -3.407 1.835 1.00 0.00 H new ATOM 0 HA LYS A 41 -10.887 -2.064 0.584 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -13.368 -1.817 0.093 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -13.524 -0.940 1.602 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -12.174 0.867 0.822 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -11.566 -0.061 -0.534 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -13.799 -0.084 -1.571 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -14.485 0.733 -0.180 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -12.669 2.575 -0.685 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -12.593 1.826 -2.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -14.177 3.641 -2.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -14.983 2.174 -2.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -15.057 2.899 -0.983 1.00 0.00 H new ATOM 600 N ARG A 42 -11.621 -1.277 3.695 1.00 0.00 N ATOM 601 CA ARG A 42 -11.129 -0.578 4.876 1.00 0.00 C ATOM 602 C ARG A 42 -9.963 -1.328 5.512 1.00 0.00 C ATOM 603 O ARG A 42 -9.083 -0.723 6.125 1.00 0.00 O ATOM 604 CB ARG A 42 -12.256 -0.403 5.896 1.00 0.00 C ATOM 605 CG ARG A 42 -12.152 0.881 6.705 1.00 0.00 C ATOM 606 CD ARG A 42 -13.489 1.600 6.785 1.00 0.00 C ATOM 607 NE ARG A 42 -14.305 1.117 7.897 1.00 0.00 N ATOM 608 CZ ARG A 42 -15.386 1.747 8.353 1.00 0.00 C ATOM 609 NH1 ARG A 42 -15.786 2.883 7.796 1.00 0.00 N ATOM 610 NH2 ARG A 42 -16.071 1.238 9.369 1.00 0.00 N ATOM 0 H ARG A 42 -12.449 -1.850 3.859 1.00 0.00 H new ATOM 0 HA ARG A 42 -10.774 0.404 4.563 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -13.213 -0.417 5.374 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -12.253 -1.253 6.578 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -11.801 0.651 7.711 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -11.411 1.539 6.251 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -13.319 2.671 6.899 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -14.032 1.461 5.850 1.00 0.00 H new ATOM 0 HE ARG A 42 -14.030 0.246 8.351 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -15.265 3.279 7.014 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -16.615 3.360 8.150 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -15.770 0.364 9.801 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -16.899 1.720 9.718 1.00 0.00 H new ATOM 624 N SER A 43 -9.963 -2.649 5.366 1.00 0.00 N ATOM 625 CA SER A 43 -8.906 -3.481 5.928 1.00 0.00 C ATOM 626 C SER A 43 -7.555 -3.144 5.303 1.00 0.00 C ATOM 627 O SER A 43 -6.572 -2.922 6.008 1.00 0.00 O ATOM 628 CB SER A 43 -9.224 -4.961 5.715 1.00 0.00 C ATOM 629 OG SER A 43 -8.799 -5.739 6.819 1.00 0.00 O ATOM 0 H SER A 43 -10.684 -3.166 4.863 1.00 0.00 H new ATOM 0 HA SER A 43 -8.851 -3.279 6.998 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.297 -5.088 5.568 1.00 0.00 H new ATOM 0 HB3 SER A 43 -8.734 -5.314 4.808 1.00 0.00 H new ATOM 0 HG SER A 43 -9.016 -6.681 6.658 1.00 0.00 H new ATOM 635 N ILE A 44 -7.515 -3.112 3.976 1.00 0.00 N ATOM 636 CA ILE A 44 -6.286 -2.804 3.255 1.00 0.00 C ATOM 637 C ILE A 44 -5.870 -1.352 3.470 1.00 0.00 C ATOM 638 O ILE A 44 -4.694 -1.057 3.683 1.00 0.00 O ATOM 639 CB ILE A 44 -6.439 -3.068 1.744 1.00 0.00 C ATOM 640 CG1 ILE A 44 -6.953 -4.488 1.501 1.00 0.00 C ATOM 641 CG2 ILE A 44 -5.114 -2.850 1.028 1.00 0.00 C ATOM 642 CD1 ILE A 44 -7.383 -4.740 0.072 1.00 0.00 C ATOM 0 H ILE A 44 -8.320 -3.296 3.377 1.00 0.00 H new ATOM 0 HA ILE A 44 -5.513 -3.461 3.653 1.00 0.00 H new ATOM 0 HB ILE A 44 -7.167 -2.363 1.341 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -6.171 -5.199 1.767 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -7.796 -4.679 2.165 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -5.241 -3.041 -0.038 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -4.785 -1.821 1.176 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -4.366 -3.532 1.432 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -7.736 -5.767 -0.026 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -8.187 -4.053 -0.192 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -6.536 -4.582 -0.596 1.00 0.00 H new ATOM 654 N GLU A 45 -6.843 -0.448 3.414 1.00 0.00 N ATOM 655 CA GLU A 45 -6.576 0.974 3.601 1.00 0.00 C ATOM 656 C GLU A 45 -5.946 1.235 4.967 1.00 0.00 C ATOM 657 O GLU A 45 -5.156 2.165 5.131 1.00 0.00 O ATOM 658 CB GLU A 45 -7.869 1.781 3.458 1.00 0.00 C ATOM 659 CG GLU A 45 -7.768 2.920 2.456 1.00 0.00 C ATOM 660 CD GLU A 45 -7.289 4.212 3.088 1.00 0.00 C ATOM 661 OE1 GLU A 45 -6.059 4.402 3.191 1.00 0.00 O ATOM 662 OE2 GLU A 45 -8.144 5.033 3.482 1.00 0.00 O ATOM 0 H GLU A 45 -7.822 -0.674 3.241 1.00 0.00 H new ATOM 0 HA GLU A 45 -5.872 1.290 2.831 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -8.674 1.111 3.154 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -8.143 2.188 4.431 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -7.084 2.636 1.656 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -8.744 3.084 1.998 1.00 0.00 H new ATOM 669 N ASN A 46 -6.301 0.406 5.944 1.00 0.00 N ATOM 670 CA ASN A 46 -5.771 0.545 7.295 1.00 0.00 C ATOM 671 C ASN A 46 -4.322 0.076 7.361 1.00 0.00 C ATOM 672 O ASN A 46 -3.482 0.710 8.000 1.00 0.00 O ATOM 673 CB ASN A 46 -6.627 -0.253 8.283 1.00 0.00 C ATOM 674 CG ASN A 46 -7.027 0.564 9.495 1.00 0.00 C ATOM 675 OD1 ASN A 46 -6.344 1.519 9.867 1.00 0.00 O ATOM 676 ND2 ASN A 46 -8.140 0.193 10.117 1.00 0.00 N ATOM 0 H ASN A 46 -6.953 -0.369 5.825 1.00 0.00 H new ATOM 0 HA ASN A 46 -5.803 1.600 7.567 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -7.524 -0.609 7.777 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -6.074 -1.134 8.609 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -8.460 0.706 10.938 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -8.674 -0.605 9.773 1.00 0.00 H new ATOM 683 N ALA A 47 -4.037 -1.039 6.697 1.00 0.00 N ATOM 684 CA ALA A 47 -2.690 -1.596 6.679 1.00 0.00 C ATOM 685 C ALA A 47 -1.713 -0.652 5.986 1.00 0.00 C ATOM 686 O ALA A 47 -0.645 -0.348 6.518 1.00 0.00 O ATOM 687 CB ALA A 47 -2.693 -2.955 5.993 1.00 0.00 C ATOM 0 H ALA A 47 -4.722 -1.575 6.164 1.00 0.00 H new ATOM 0 HA ALA A 47 -2.360 -1.721 7.710 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -1.681 -3.361 5.986 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -3.353 -3.634 6.533 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -3.047 -2.844 4.968 1.00 0.00 H new ATOM 693 N LEU A 48 -2.085 -0.193 4.796 1.00 0.00 N ATOM 694 CA LEU A 48 -1.240 0.714 4.028 1.00 0.00 C ATOM 695 C LEU A 48 -0.979 2.004 4.800 1.00 0.00 C ATOM 696 O LEU A 48 0.068 2.633 4.639 1.00 0.00 O ATOM 697 CB LEU A 48 -1.892 1.035 2.682 1.00 0.00 C ATOM 698 CG LEU A 48 -2.154 -0.175 1.783 1.00 0.00 C ATOM 699 CD1 LEU A 48 -2.924 0.239 0.539 1.00 0.00 C ATOM 700 CD2 LEU A 48 -0.842 -0.846 1.403 1.00 0.00 C ATOM 0 H LEU A 48 -2.966 -0.434 4.342 1.00 0.00 H new ATOM 0 HA LEU A 48 -0.285 0.218 3.853 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -2.839 1.543 2.866 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -1.253 1.736 2.144 1.00 0.00 H new ATOM 0 HG LEU A 48 -2.761 -0.892 2.336 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -3.100 -0.635 -0.087 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -3.879 0.675 0.831 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -2.345 0.974 -0.019 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -1.045 -1.705 0.763 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -0.212 -0.136 0.868 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -0.329 -1.178 2.305 1.00 0.00 H new ATOM 712 N ASN A 49 -1.935 2.394 5.636 1.00 0.00 N ATOM 713 CA ASN A 49 -1.807 3.610 6.431 1.00 0.00 C ATOM 714 C ASN A 49 -0.583 3.546 7.338 1.00 0.00 C ATOM 715 O ASN A 49 0.330 4.364 7.225 1.00 0.00 O ATOM 716 CB ASN A 49 -3.067 3.830 7.270 1.00 0.00 C ATOM 717 CG ASN A 49 -3.284 5.290 7.614 1.00 0.00 C ATOM 718 OD1 ASN A 49 -2.754 5.793 8.603 1.00 0.00 O ATOM 719 ND2 ASN A 49 -4.070 5.980 6.793 1.00 0.00 N ATOM 0 H ASN A 49 -2.807 1.886 5.781 1.00 0.00 H new ATOM 0 HA ASN A 49 -1.682 4.448 5.746 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -3.933 3.455 6.725 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -2.994 3.250 8.190 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -4.254 6.967 6.973 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -4.489 5.522 5.984 1.00 0.00 H new ATOM 726 N GLN A 50 -0.570 2.571 8.242 1.00 0.00 N ATOM 727 CA GLN A 50 0.543 2.402 9.170 1.00 0.00 C ATOM 728 C GLN A 50 1.859 2.212 8.421 1.00 0.00 C ATOM 729 O GLN A 50 2.923 2.587 8.913 1.00 0.00 O ATOM 730 CB GLN A 50 0.291 1.208 10.092 1.00 0.00 C ATOM 731 CG GLN A 50 0.035 -0.092 9.349 1.00 0.00 C ATOM 732 CD GLN A 50 -0.227 -1.256 10.285 1.00 0.00 C ATOM 733 OE1 GLN A 50 0.663 -1.692 11.015 1.00 0.00 O ATOM 734 NE2 GLN A 50 -1.452 -1.766 10.267 1.00 0.00 N ATOM 0 H GLN A 50 -1.318 1.886 8.352 1.00 0.00 H new ATOM 0 HA GLN A 50 0.618 3.308 9.771 1.00 0.00 H new ATOM 0 HB2 GLN A 50 1.152 1.078 10.748 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -0.565 1.427 10.730 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -0.820 0.035 8.685 1.00 0.00 H new ATOM 0 HG3 GLN A 50 0.895 -0.322 8.720 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -2.159 -1.373 9.646 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -1.687 -2.551 10.875 1.00 0.00 H new ATOM 743 N LEU A 51 1.778 1.629 7.229 1.00 0.00 N ATOM 744 CA LEU A 51 2.965 1.391 6.414 1.00 0.00 C ATOM 745 C LEU A 51 3.646 2.707 6.049 1.00 0.00 C ATOM 746 O LEU A 51 4.874 2.794 6.016 1.00 0.00 O ATOM 747 CB LEU A 51 2.594 0.625 5.143 1.00 0.00 C ATOM 748 CG LEU A 51 3.755 -0.098 4.459 1.00 0.00 C ATOM 749 CD1 LEU A 51 3.260 -1.342 3.737 1.00 0.00 C ATOM 750 CD2 LEU A 51 4.467 0.835 3.490 1.00 0.00 C ATOM 0 H LEU A 51 0.905 1.313 6.806 1.00 0.00 H new ATOM 0 HA LEU A 51 3.662 0.791 6.999 1.00 0.00 H new ATOM 0 HB2 LEU A 51 1.825 -0.107 5.390 1.00 0.00 H new ATOM 0 HB3 LEU A 51 2.152 1.323 4.432 1.00 0.00 H new ATOM 0 HG LEU A 51 4.466 -0.407 5.225 1.00 0.00 H new ATOM 0 HD11 LEU A 51 4.101 -1.843 3.257 1.00 0.00 H new ATOM 0 HD12 LEU A 51 2.796 -2.019 4.455 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.528 -1.057 2.982 1.00 0.00 H new ATOM 0 HD21 LEU A 51 5.290 0.304 3.012 1.00 0.00 H new ATOM 0 HD22 LEU A 51 3.764 1.175 2.729 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.857 1.695 4.034 1.00 0.00 H new ATOM 762 N PHE A 52 2.841 3.729 5.778 1.00 0.00 N ATOM 763 CA PHE A 52 3.368 5.041 5.418 1.00 0.00 C ATOM 764 C PHE A 52 4.075 5.687 6.604 1.00 0.00 C ATOM 765 O PHE A 52 5.119 6.321 6.448 1.00 0.00 O ATOM 766 CB PHE A 52 2.240 5.950 4.928 1.00 0.00 C ATOM 767 CG PHE A 52 1.313 5.286 3.949 1.00 0.00 C ATOM 768 CD1 PHE A 52 1.816 4.520 2.909 1.00 0.00 C ATOM 769 CD2 PHE A 52 -0.060 5.428 4.069 1.00 0.00 C ATOM 770 CE1 PHE A 52 0.965 3.909 2.007 1.00 0.00 C ATOM 771 CE2 PHE A 52 -0.915 4.820 3.170 1.00 0.00 C ATOM 772 CZ PHE A 52 -0.402 4.059 2.138 1.00 0.00 C ATOM 0 H PHE A 52 1.823 3.675 5.801 1.00 0.00 H new ATOM 0 HA PHE A 52 4.092 4.905 4.615 1.00 0.00 H new ATOM 0 HB2 PHE A 52 1.663 6.293 5.786 1.00 0.00 H new ATOM 0 HB3 PHE A 52 2.674 6.834 4.462 1.00 0.00 H new ATOM 0 HD1 PHE A 52 2.884 4.399 2.802 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -0.467 6.021 4.875 1.00 0.00 H new ATOM 0 HE1 PHE A 52 1.369 3.315 1.200 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -1.983 4.940 3.274 1.00 0.00 H new ATOM 0 HZ PHE A 52 -1.068 3.582 1.435 1.00 0.00 H new ATOM 782 N ARG A 53 3.499 5.524 7.791 1.00 0.00 N ATOM 783 CA ARG A 53 4.072 6.092 9.006 1.00 0.00 C ATOM 784 C ARG A 53 5.295 5.301 9.468 1.00 0.00 C ATOM 785 O ARG A 53 6.041 5.750 10.337 1.00 0.00 O ATOM 786 CB ARG A 53 3.024 6.126 10.119 1.00 0.00 C ATOM 787 CG ARG A 53 1.668 6.638 9.663 1.00 0.00 C ATOM 788 CD ARG A 53 0.867 7.208 10.822 1.00 0.00 C ATOM 789 NE ARG A 53 0.863 8.669 10.820 1.00 0.00 N ATOM 790 CZ ARG A 53 -0.022 9.409 11.483 1.00 0.00 C ATOM 791 NH1 ARG A 53 -0.974 8.830 12.204 1.00 0.00 N ATOM 792 NH2 ARG A 53 0.045 10.732 11.427 1.00 0.00 N ATOM 0 H ARG A 53 2.635 5.002 7.937 1.00 0.00 H new ATOM 0 HA ARG A 53 4.391 7.109 8.779 1.00 0.00 H new ATOM 0 HB2 ARG A 53 2.906 5.122 10.526 1.00 0.00 H new ATOM 0 HB3 ARG A 53 3.388 6.758 10.930 1.00 0.00 H new ATOM 0 HG2 ARG A 53 1.806 7.406 8.902 1.00 0.00 H new ATOM 0 HG3 ARG A 53 1.109 5.826 9.198 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -0.159 6.843 10.768 1.00 0.00 H new ATOM 0 HD3 ARG A 53 1.284 6.848 11.762 1.00 0.00 H new ATOM 0 HE ARG A 53 1.581 9.150 10.278 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -1.030 7.813 12.252 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -1.650 9.402 12.710 1.00 0.00 H new ATOM 0 HH21 ARG A 53 0.775 11.183 10.876 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -0.634 11.299 11.935 1.00 0.00 H new ATOM 806 N ASN A 54 5.498 4.120 8.885 1.00 0.00 N ATOM 807 CA ASN A 54 6.631 3.277 9.248 1.00 0.00 C ATOM 808 C ASN A 54 7.718 3.331 8.178 1.00 0.00 C ATOM 809 O ASN A 54 8.903 3.177 8.475 1.00 0.00 O ATOM 810 CB ASN A 54 6.173 1.832 9.451 1.00 0.00 C ATOM 811 CG ASN A 54 5.579 1.602 10.827 1.00 0.00 C ATOM 812 OD1 ASN A 54 6.198 1.916 11.844 1.00 0.00 O ATOM 813 ND2 ASN A 54 4.370 1.052 10.865 1.00 0.00 N ATOM 0 H ASN A 54 4.894 3.729 8.162 1.00 0.00 H new ATOM 0 HA ASN A 54 7.047 3.655 10.182 1.00 0.00 H new ATOM 0 HB2 ASN A 54 5.433 1.578 8.692 1.00 0.00 H new ATOM 0 HB3 ASN A 54 7.020 1.162 9.307 1.00 0.00 H new ATOM 0 HD21 ASN A 54 3.919 0.874 11.762 1.00 0.00 H new ATOM 0 HD22 ASN A 54 3.893 0.808 9.997 1.00 0.00 H new ATOM 820 N SER A 55 7.308 3.550 6.933 1.00 0.00 N ATOM 821 CA SER A 55 8.247 3.622 5.819 1.00 0.00 C ATOM 822 C SER A 55 9.270 4.733 6.039 1.00 0.00 C ATOM 823 O SER A 55 9.000 5.712 6.734 1.00 0.00 O ATOM 824 CB SER A 55 7.498 3.857 4.507 1.00 0.00 C ATOM 825 OG SER A 55 6.505 4.858 4.658 1.00 0.00 O ATOM 0 H SER A 55 6.331 3.681 6.670 1.00 0.00 H new ATOM 0 HA SER A 55 8.776 2.671 5.762 1.00 0.00 H new ATOM 0 HB2 SER A 55 8.203 4.154 3.730 1.00 0.00 H new ATOM 0 HB3 SER A 55 7.034 2.927 4.178 1.00 0.00 H new ATOM 0 HG SER A 55 6.632 5.318 5.514 1.00 0.00 H new ATOM 831 N SER A 56 10.446 4.573 5.438 1.00 0.00 N ATOM 832 CA SER A 56 11.510 5.562 5.565 1.00 0.00 C ATOM 833 C SER A 56 11.047 6.927 5.063 1.00 0.00 C ATOM 834 O SER A 56 11.547 7.963 5.500 1.00 0.00 O ATOM 835 CB SER A 56 12.747 5.112 4.787 1.00 0.00 C ATOM 836 OG SER A 56 13.716 6.145 4.728 1.00 0.00 O ATOM 0 H SER A 56 10.685 3.768 4.859 1.00 0.00 H new ATOM 0 HA SER A 56 11.766 5.651 6.621 1.00 0.00 H new ATOM 0 HB2 SER A 56 13.179 4.231 5.262 1.00 0.00 H new ATOM 0 HB3 SER A 56 12.459 4.821 3.777 1.00 0.00 H new ATOM 0 HG SER A 56 14.498 5.832 4.227 1.00 0.00 H new ATOM 842 N ILE A 57 10.086 6.919 4.144 1.00 0.00 N ATOM 843 CA ILE A 57 9.552 8.154 3.586 1.00 0.00 C ATOM 844 C ILE A 57 8.304 8.597 4.343 1.00 0.00 C ATOM 845 O ILE A 57 7.285 8.936 3.741 1.00 0.00 O ATOM 846 CB ILE A 57 9.209 7.992 2.091 1.00 0.00 C ATOM 847 CG1 ILE A 57 8.172 6.885 1.898 1.00 0.00 C ATOM 848 CG2 ILE A 57 10.465 7.695 1.287 1.00 0.00 C ATOM 849 CD1 ILE A 57 7.476 6.936 0.555 1.00 0.00 C ATOM 0 H ILE A 57 9.662 6.070 3.771 1.00 0.00 H new ATOM 0 HA ILE A 57 10.326 8.915 3.689 1.00 0.00 H new ATOM 0 HB ILE A 57 8.783 8.928 1.730 1.00 0.00 H new ATOM 0 HG12 ILE A 57 8.661 5.917 2.008 1.00 0.00 H new ATOM 0 HG13 ILE A 57 7.425 6.956 2.688 1.00 0.00 H new ATOM 0 HG21 ILE A 57 10.205 7.584 0.234 1.00 0.00 H new ATOM 0 HG22 ILE A 57 11.173 8.516 1.401 1.00 0.00 H new ATOM 0 HG23 ILE A 57 10.919 6.772 1.648 1.00 0.00 H new ATOM 0 HD11 ILE A 57 6.754 6.122 0.488 1.00 0.00 H new ATOM 0 HD12 ILE A 57 6.958 7.889 0.450 1.00 0.00 H new ATOM 0 HD13 ILE A 57 8.213 6.834 -0.241 1.00 0.00 H new ATOM 861 N LYS A 58 8.393 8.590 5.669 1.00 0.00 N ATOM 862 CA LYS A 58 7.272 8.988 6.514 1.00 0.00 C ATOM 863 C LYS A 58 7.325 10.480 6.840 1.00 0.00 C ATOM 864 O LYS A 58 6.812 10.916 7.870 1.00 0.00 O ATOM 865 CB LYS A 58 7.270 8.175 7.810 1.00 0.00 C ATOM 866 CG LYS A 58 8.553 8.305 8.613 1.00 0.00 C ATOM 867 CD LYS A 58 8.311 8.066 10.095 1.00 0.00 C ATOM 868 CE LYS A 58 8.235 9.373 10.868 1.00 0.00 C ATOM 869 NZ LYS A 58 9.493 9.652 11.613 1.00 0.00 N ATOM 0 H LYS A 58 9.230 8.313 6.182 1.00 0.00 H new ATOM 0 HA LYS A 58 6.353 8.791 5.962 1.00 0.00 H new ATOM 0 HB2 LYS A 58 6.431 8.495 8.428 1.00 0.00 H new ATOM 0 HB3 LYS A 58 7.107 7.124 7.570 1.00 0.00 H new ATOM 0 HG2 LYS A 58 9.288 7.590 8.244 1.00 0.00 H new ATOM 0 HG3 LYS A 58 8.975 9.300 8.468 1.00 0.00 H new ATOM 0 HD2 LYS A 58 7.383 7.510 10.228 1.00 0.00 H new ATOM 0 HD3 LYS A 58 9.113 7.449 10.500 1.00 0.00 H new ATOM 0 HE2 LYS A 58 8.033 10.192 10.177 1.00 0.00 H new ATOM 0 HE3 LYS A 58 7.400 9.333 11.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 9.400 10.552 12.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 9.673 8.884 12.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 10.286 9.716 10.943 1.00 0.00 H new ATOM 883 N SER A 59 7.941 11.259 5.955 1.00 0.00 N ATOM 884 CA SER A 59 8.052 12.699 6.152 1.00 0.00 C ATOM 885 C SER A 59 7.426 13.455 4.983 1.00 0.00 C ATOM 886 O SER A 59 7.776 14.604 4.716 1.00 0.00 O ATOM 887 CB SER A 59 9.519 13.103 6.308 1.00 0.00 C ATOM 888 OG SER A 59 10.373 12.197 5.631 1.00 0.00 O ATOM 0 H SER A 59 8.370 10.916 5.095 1.00 0.00 H new ATOM 0 HA SER A 59 7.513 12.959 7.063 1.00 0.00 H new ATOM 0 HB2 SER A 59 9.666 14.109 5.915 1.00 0.00 H new ATOM 0 HB3 SER A 59 9.781 13.133 7.366 1.00 0.00 H new ATOM 0 HG SER A 59 11.305 12.479 5.745 1.00 0.00 H new ATOM 894 N TYR A 60 6.498 12.801 4.290 1.00 0.00 N ATOM 895 CA TYR A 60 5.821 13.408 3.150 1.00 0.00 C ATOM 896 C TYR A 60 4.538 12.653 2.816 1.00 0.00 C ATOM 897 O TYR A 60 3.503 13.259 2.541 1.00 0.00 O ATOM 898 CB TYR A 60 6.746 13.424 1.930 1.00 0.00 C ATOM 899 CG TYR A 60 7.810 14.497 1.991 1.00 0.00 C ATOM 900 CD1 TYR A 60 7.467 15.840 2.082 1.00 0.00 C ATOM 901 CD2 TYR A 60 9.159 14.165 1.959 1.00 0.00 C ATOM 902 CE1 TYR A 60 8.438 16.822 2.138 1.00 0.00 C ATOM 903 CE2 TYR A 60 10.135 15.141 2.015 1.00 0.00 C ATOM 904 CZ TYR A 60 9.770 16.467 2.105 1.00 0.00 C ATOM 905 OH TYR A 60 10.740 17.442 2.161 1.00 0.00 O ATOM 0 H TYR A 60 6.198 11.849 4.499 1.00 0.00 H new ATOM 0 HA TYR A 60 5.562 14.433 3.416 1.00 0.00 H new ATOM 0 HB2 TYR A 60 7.228 12.451 1.837 1.00 0.00 H new ATOM 0 HB3 TYR A 60 6.146 13.569 1.032 1.00 0.00 H new ATOM 0 HD1 TYR A 60 6.425 16.121 2.109 1.00 0.00 H new ATOM 0 HD2 TYR A 60 9.449 13.127 1.889 1.00 0.00 H new ATOM 0 HE1 TYR A 60 8.155 17.862 2.207 1.00 0.00 H new ATOM 0 HE2 TYR A 60 11.179 14.866 1.988 1.00 0.00 H new ATOM 0 HH TYR A 60 11.626 17.024 2.128 1.00 0.00 H new ATOM 915 N PHE A 61 4.613 11.324 2.843 1.00 0.00 N ATOM 916 CA PHE A 61 3.456 10.485 2.544 1.00 0.00 C ATOM 917 C PHE A 61 2.256 10.881 3.399 1.00 0.00 C ATOM 918 O PHE A 61 2.274 10.731 4.620 1.00 0.00 O ATOM 919 CB PHE A 61 3.798 9.011 2.777 1.00 0.00 C ATOM 920 CG PHE A 61 3.006 8.068 1.916 1.00 0.00 C ATOM 921 CD1 PHE A 61 1.621 8.106 1.914 1.00 0.00 C ATOM 922 CD2 PHE A 61 3.649 7.142 1.109 1.00 0.00 C ATOM 923 CE1 PHE A 61 0.892 7.238 1.124 1.00 0.00 C ATOM 924 CE2 PHE A 61 2.924 6.272 0.317 1.00 0.00 C ATOM 925 CZ PHE A 61 1.544 6.321 0.323 1.00 0.00 C ATOM 0 H PHE A 61 5.462 10.806 3.069 1.00 0.00 H new ATOM 0 HA PHE A 61 3.194 10.632 1.496 1.00 0.00 H new ATOM 0 HB2 PHE A 61 4.860 8.858 2.587 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.623 8.767 3.825 1.00 0.00 H new ATOM 0 HD1 PHE A 61 1.106 8.822 2.537 1.00 0.00 H new ATOM 0 HD2 PHE A 61 4.728 7.100 1.099 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -0.187 7.277 1.133 1.00 0.00 H new ATOM 0 HE2 PHE A 61 3.436 5.554 -0.306 1.00 0.00 H new ATOM 0 HZ PHE A 61 0.976 5.644 -0.297 1.00 0.00 H new ATOM 935 N SER A 62 1.215 11.389 2.747 1.00 0.00 N ATOM 936 CA SER A 62 0.006 11.809 3.445 1.00 0.00 C ATOM 937 C SER A 62 -0.920 10.623 3.692 1.00 0.00 C ATOM 938 O SER A 62 -1.174 10.250 4.837 1.00 0.00 O ATOM 939 CB SER A 62 -0.724 12.884 2.639 1.00 0.00 C ATOM 940 OG SER A 62 -0.401 12.798 1.262 1.00 0.00 O ATOM 0 H SER A 62 1.185 11.520 1.736 1.00 0.00 H new ATOM 0 HA SER A 62 0.298 12.224 4.410 1.00 0.00 H new ATOM 0 HB2 SER A 62 -1.800 12.773 2.771 1.00 0.00 H new ATOM 0 HB3 SER A 62 -0.457 13.871 3.017 1.00 0.00 H new ATOM 0 HG SER A 62 -0.996 13.384 0.749 1.00 0.00 H new ATOM 946 N ASP A 63 -1.424 10.037 2.612 1.00 0.00 N ATOM 947 CA ASP A 63 -2.324 8.894 2.714 1.00 0.00 C ATOM 948 C ASP A 63 -2.495 8.208 1.363 1.00 0.00 C ATOM 949 O ASP A 63 -1.858 8.581 0.377 1.00 0.00 O ATOM 950 CB ASP A 63 -3.686 9.340 3.249 1.00 0.00 C ATOM 951 CG ASP A 63 -4.335 10.394 2.373 1.00 0.00 C ATOM 952 OD1 ASP A 63 -4.886 10.029 1.313 1.00 0.00 O ATOM 953 OD2 ASP A 63 -4.290 11.585 2.748 1.00 0.00 O ATOM 0 H ASP A 63 -1.225 10.334 1.657 1.00 0.00 H new ATOM 0 HA ASP A 63 -1.883 8.178 3.408 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -4.346 8.475 3.321 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -3.565 9.734 4.258 1.00 0.00 H new ATOM 958 N CYS A 64 -3.362 7.201 1.327 1.00 0.00 N ATOM 959 CA CYS A 64 -3.620 6.458 0.099 1.00 0.00 C ATOM 960 C CYS A 64 -5.107 6.471 -0.241 1.00 0.00 C ATOM 961 O CYS A 64 -5.953 6.658 0.634 1.00 0.00 O ATOM 962 CB CYS A 64 -3.130 5.017 0.240 1.00 0.00 C ATOM 963 SG CYS A 64 -3.321 4.022 -1.257 1.00 0.00 S ATOM 0 H CYS A 64 -3.898 6.881 2.134 1.00 0.00 H new ATOM 0 HA CYS A 64 -3.076 6.942 -0.712 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -2.078 5.029 0.524 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -3.674 4.538 1.054 1.00 0.00 H new ATOM 0 HG CYS A 64 -2.876 2.820 -1.039 1.00 0.00 H new ATOM 969 N GLN A 65 -5.419 6.274 -1.518 1.00 0.00 N ATOM 970 CA GLN A 65 -6.803 6.262 -1.975 1.00 0.00 C ATOM 971 C GLN A 65 -7.098 5.004 -2.785 1.00 0.00 C ATOM 972 O GLN A 65 -6.681 4.884 -3.938 1.00 0.00 O ATOM 973 CB GLN A 65 -7.094 7.505 -2.817 1.00 0.00 C ATOM 974 CG GLN A 65 -8.534 7.591 -3.297 1.00 0.00 C ATOM 975 CD GLN A 65 -8.910 8.983 -3.768 1.00 0.00 C ATOM 976 OE1 GLN A 65 -9.058 9.904 -2.965 1.00 0.00 O ATOM 977 NE2 GLN A 65 -9.066 9.141 -5.077 1.00 0.00 N ATOM 0 H GLN A 65 -4.731 6.120 -2.255 1.00 0.00 H new ATOM 0 HA GLN A 65 -7.449 6.266 -1.097 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -6.862 8.394 -2.230 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -6.430 7.511 -3.682 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -8.684 6.883 -4.112 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -9.201 7.293 -2.488 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -8.933 8.349 -5.706 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -9.319 10.055 -5.454 1.00 0.00 H new ATOM 986 N VAL A 66 -7.818 4.068 -2.175 1.00 0.00 N ATOM 987 CA VAL A 66 -8.169 2.820 -2.841 1.00 0.00 C ATOM 988 C VAL A 66 -9.269 3.040 -3.876 1.00 0.00 C ATOM 989 O VAL A 66 -10.409 3.346 -3.530 1.00 0.00 O ATOM 990 CB VAL A 66 -8.630 1.754 -1.826 1.00 0.00 C ATOM 991 CG1 VAL A 66 -9.870 2.222 -1.081 1.00 0.00 C ATOM 992 CG2 VAL A 66 -8.886 0.425 -2.523 1.00 0.00 C ATOM 0 H VAL A 66 -8.169 4.151 -1.221 1.00 0.00 H new ATOM 0 HA VAL A 66 -7.271 2.463 -3.345 1.00 0.00 H new ATOM 0 HB VAL A 66 -7.833 1.607 -1.097 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -10.178 1.455 -0.370 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -9.646 3.145 -0.545 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -10.676 2.402 -1.793 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -9.210 -0.314 -1.790 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -9.663 0.553 -3.277 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -7.969 0.083 -3.002 1.00 0.00 H new ATOM 1002 N LEU A 67 -8.916 2.884 -5.148 1.00 0.00 N ATOM 1003 CA LEU A 67 -9.871 3.068 -6.235 1.00 0.00 C ATOM 1004 C LEU A 67 -10.884 1.928 -6.272 1.00 0.00 C ATOM 1005 O LEU A 67 -12.071 2.133 -6.016 1.00 0.00 O ATOM 1006 CB LEU A 67 -9.137 3.157 -7.575 1.00 0.00 C ATOM 1007 CG LEU A 67 -8.016 4.195 -7.632 1.00 0.00 C ATOM 1008 CD1 LEU A 67 -7.414 4.254 -9.027 1.00 0.00 C ATOM 1009 CD2 LEU A 67 -8.536 5.564 -7.216 1.00 0.00 C ATOM 0 H LEU A 67 -7.976 2.631 -5.451 1.00 0.00 H new ATOM 0 HA LEU A 67 -10.408 4.000 -6.058 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -8.717 2.178 -7.807 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -9.863 3.386 -8.355 1.00 0.00 H new ATOM 0 HG LEU A 67 -7.234 3.897 -6.933 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -6.618 4.998 -9.049 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -7.006 3.278 -9.289 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -8.187 4.528 -9.745 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -7.725 6.291 -7.262 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -9.336 5.870 -7.890 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -8.920 5.513 -6.197 1.00 0.00 H new ATOM 1021 N ALA A 68 -10.410 0.730 -6.595 1.00 0.00 N ATOM 1022 CA ALA A 68 -11.277 -0.440 -6.666 1.00 0.00 C ATOM 1023 C ALA A 68 -10.463 -1.729 -6.663 1.00 0.00 C ATOM 1024 O ALA A 68 -9.244 -1.705 -6.495 1.00 0.00 O ATOM 1025 CB ALA A 68 -12.154 -0.371 -7.907 1.00 0.00 C ATOM 0 H ALA A 68 -9.431 0.544 -6.812 1.00 0.00 H new ATOM 0 HA ALA A 68 -11.915 -0.443 -5.782 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -12.796 -1.251 -7.948 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -12.770 0.527 -7.867 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -11.524 -0.340 -8.796 1.00 0.00 H new ATOM 1031 N PHE A 69 -11.146 -2.853 -6.851 1.00 0.00 N ATOM 1032 CA PHE A 69 -10.488 -4.155 -6.871 1.00 0.00 C ATOM 1033 C PHE A 69 -10.729 -4.865 -8.199 1.00 0.00 C ATOM 1034 O PHE A 69 -11.872 -5.043 -8.621 1.00 0.00 O ATOM 1035 CB PHE A 69 -10.992 -5.023 -5.718 1.00 0.00 C ATOM 1036 CG PHE A 69 -10.670 -4.465 -4.361 1.00 0.00 C ATOM 1037 CD1 PHE A 69 -9.381 -4.533 -3.858 1.00 0.00 C ATOM 1038 CD2 PHE A 69 -11.656 -3.872 -3.590 1.00 0.00 C ATOM 1039 CE1 PHE A 69 -9.082 -4.020 -2.610 1.00 0.00 C ATOM 1040 CE2 PHE A 69 -11.363 -3.358 -2.340 1.00 0.00 C ATOM 1041 CZ PHE A 69 -10.074 -3.432 -1.851 1.00 0.00 C ATOM 0 H PHE A 69 -12.156 -2.889 -6.992 1.00 0.00 H new ATOM 0 HA PHE A 69 -9.416 -3.994 -6.754 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -12.072 -5.139 -5.807 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -10.556 -6.018 -5.806 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -8.601 -4.992 -4.448 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -12.665 -3.810 -3.969 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -8.073 -4.079 -2.229 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -12.141 -2.900 -1.748 1.00 0.00 H new ATOM 0 HZ PHE A 69 -9.842 -3.030 -0.876 1.00 0.00 H new ATOM 1051 N ARG A 70 -9.646 -5.271 -8.853 1.00 0.00 N ATOM 1052 CA ARG A 70 -9.741 -5.964 -10.132 1.00 0.00 C ATOM 1053 C ARG A 70 -9.722 -7.476 -9.934 1.00 0.00 C ATOM 1054 O ARG A 70 -8.712 -8.047 -9.523 1.00 0.00 O ATOM 1055 CB ARG A 70 -8.592 -5.545 -11.051 1.00 0.00 C ATOM 1056 CG ARG A 70 -8.968 -5.526 -12.524 1.00 0.00 C ATOM 1057 CD ARG A 70 -9.266 -4.116 -13.011 1.00 0.00 C ATOM 1058 NE ARG A 70 -10.613 -4.002 -13.564 1.00 0.00 N ATOM 1059 CZ ARG A 70 -11.706 -3.814 -12.828 1.00 0.00 C ATOM 1060 NH1 ARG A 70 -11.617 -3.713 -11.507 1.00 0.00 N ATOM 1061 NH2 ARG A 70 -12.893 -3.726 -13.413 1.00 0.00 N ATOM 0 H ARG A 70 -8.693 -5.132 -8.518 1.00 0.00 H new ATOM 0 HA ARG A 70 -10.688 -5.687 -10.596 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -8.248 -4.553 -10.759 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -7.755 -6.228 -10.907 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -8.154 -5.950 -13.113 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -9.841 -6.159 -12.685 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -9.153 -3.415 -12.184 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -8.537 -3.833 -13.770 1.00 0.00 H new ATOM 0 HE ARG A 70 -10.723 -4.071 -14.576 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -10.707 -3.779 -11.051 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -12.458 -3.569 -10.949 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -12.969 -3.802 -14.427 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -13.730 -3.582 -12.849 1.00 0.00 H new ATOM 1075 N SER A 71 -10.847 -8.120 -10.228 1.00 0.00 N ATOM 1076 CA SER A 71 -10.962 -9.565 -10.082 1.00 0.00 C ATOM 1077 C SER A 71 -10.145 -10.287 -11.150 1.00 0.00 C ATOM 1078 O SER A 71 -10.439 -10.189 -12.340 1.00 0.00 O ATOM 1079 CB SER A 71 -12.428 -9.993 -10.169 1.00 0.00 C ATOM 1080 OG SER A 71 -12.585 -11.353 -9.802 1.00 0.00 O ATOM 0 H SER A 71 -11.692 -7.662 -10.569 1.00 0.00 H new ATOM 0 HA SER A 71 -10.569 -9.838 -9.103 1.00 0.00 H new ATOM 0 HB2 SER A 71 -13.033 -9.365 -9.515 1.00 0.00 H new ATOM 0 HB3 SER A 71 -12.794 -9.842 -11.184 1.00 0.00 H new ATOM 0 HG SER A 71 -12.729 -11.416 -8.835 1.00 0.00 H new ATOM 1086 N VAL A 72 -9.119 -11.011 -10.713 1.00 0.00 N ATOM 1087 CA VAL A 72 -8.261 -11.750 -11.631 1.00 0.00 C ATOM 1088 C VAL A 72 -9.027 -12.874 -12.324 1.00 0.00 C ATOM 1089 O VAL A 72 -8.613 -13.362 -13.375 1.00 0.00 O ATOM 1090 CB VAL A 72 -7.044 -12.351 -10.904 1.00 0.00 C ATOM 1091 CG1 VAL A 72 -6.044 -11.262 -10.546 1.00 0.00 C ATOM 1092 CG2 VAL A 72 -7.486 -13.109 -9.661 1.00 0.00 C ATOM 0 H VAL A 72 -8.862 -11.101 -9.730 1.00 0.00 H new ATOM 0 HA VAL A 72 -7.915 -11.036 -12.378 1.00 0.00 H new ATOM 0 HB VAL A 72 -6.553 -13.055 -11.576 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -5.191 -11.706 -10.033 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -5.703 -10.768 -11.456 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -6.520 -10.531 -9.892 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -6.613 -13.527 -9.160 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -8.002 -12.428 -8.984 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -8.161 -13.916 -9.948 1.00 0.00 H new ATOM 1102 N SER A 73 -10.146 -13.282 -11.728 1.00 0.00 N ATOM 1103 CA SER A 73 -10.967 -14.350 -12.289 1.00 0.00 C ATOM 1104 C SER A 73 -10.208 -15.673 -12.297 1.00 0.00 C ATOM 1105 O SER A 73 -9.143 -15.791 -11.691 1.00 0.00 O ATOM 1106 CB SER A 73 -11.415 -13.990 -13.709 1.00 0.00 C ATOM 1107 OG SER A 73 -10.450 -14.388 -14.669 1.00 0.00 O ATOM 0 H SER A 73 -10.504 -12.889 -10.857 1.00 0.00 H new ATOM 0 HA SER A 73 -11.849 -14.464 -11.659 1.00 0.00 H new ATOM 0 HB2 SER A 73 -12.368 -14.473 -13.926 1.00 0.00 H new ATOM 0 HB3 SER A 73 -11.579 -12.915 -13.779 1.00 0.00 H new ATOM 0 HG SER A 73 -9.628 -13.871 -14.540 1.00 0.00 H new ATOM 1112 N ASN A 74 -10.763 -16.665 -12.986 1.00 0.00 N ATOM 1113 CA ASN A 74 -10.142 -17.982 -13.074 1.00 0.00 C ATOM 1114 C ASN A 74 -10.059 -18.640 -11.699 1.00 0.00 C ATOM 1115 O ASN A 74 -10.874 -19.497 -11.361 1.00 0.00 O ATOM 1116 CB ASN A 74 -8.746 -17.873 -13.692 1.00 0.00 C ATOM 1117 CG ASN A 74 -8.779 -17.918 -15.207 1.00 0.00 C ATOM 1118 OD1 ASN A 74 -8.886 -18.989 -15.805 1.00 0.00 O ATOM 1119 ND2 ASN A 74 -8.684 -16.752 -15.835 1.00 0.00 N ATOM 0 H ASN A 74 -11.644 -16.581 -13.493 1.00 0.00 H new ATOM 0 HA ASN A 74 -10.764 -18.607 -13.715 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -8.280 -16.942 -13.369 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -8.123 -18.687 -13.321 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -8.698 -16.719 -16.854 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -8.597 -15.889 -15.298 1.00 0.00 H new ATOM 1126 N ASN A 75 -9.069 -18.232 -10.910 1.00 0.00 N ATOM 1127 CA ASN A 75 -8.883 -18.783 -9.572 1.00 0.00 C ATOM 1128 C ASN A 75 -9.296 -17.773 -8.506 1.00 0.00 C ATOM 1129 O ASN A 75 -8.754 -16.671 -8.438 1.00 0.00 O ATOM 1130 CB ASN A 75 -7.424 -19.193 -9.365 1.00 0.00 C ATOM 1131 CG ASN A 75 -7.291 -20.474 -8.566 1.00 0.00 C ATOM 1132 OD1 ASN A 75 -7.215 -21.566 -9.129 1.00 0.00 O ATOM 1133 ND2 ASN A 75 -7.264 -20.347 -7.244 1.00 0.00 N ATOM 0 H ASN A 75 -8.385 -17.523 -11.174 1.00 0.00 H new ATOM 0 HA ASN A 75 -9.517 -19.664 -9.477 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -6.945 -19.322 -10.335 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -6.894 -18.391 -8.852 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -7.177 -21.174 -6.654 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -7.330 -19.422 -6.819 1.00 0.00 H new ATOM 1140 N ASN A 76 -10.259 -18.159 -7.676 1.00 0.00 N ATOM 1141 CA ASN A 76 -10.746 -17.287 -6.612 1.00 0.00 C ATOM 1142 C ASN A 76 -9.786 -17.286 -5.428 1.00 0.00 C ATOM 1143 O ASN A 76 -9.909 -18.105 -4.516 1.00 0.00 O ATOM 1144 CB ASN A 76 -12.137 -17.731 -6.157 1.00 0.00 C ATOM 1145 CG ASN A 76 -13.201 -17.463 -7.203 1.00 0.00 C ATOM 1146 OD1 ASN A 76 -13.933 -18.367 -7.605 1.00 0.00 O ATOM 1147 ND2 ASN A 76 -13.292 -16.216 -7.648 1.00 0.00 N ATOM 0 H ASN A 76 -10.718 -19.069 -7.719 1.00 0.00 H new ATOM 0 HA ASN A 76 -10.808 -16.273 -7.007 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -12.118 -18.796 -5.927 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -12.398 -17.210 -5.236 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -13.990 -15.975 -8.352 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -12.664 -15.498 -7.286 1.00 0.00 H new ATOM 1154 N ASN A 77 -8.831 -16.363 -5.447 1.00 0.00 N ATOM 1155 CA ASN A 77 -7.850 -16.255 -4.374 1.00 0.00 C ATOM 1156 C ASN A 77 -7.097 -14.930 -4.457 1.00 0.00 C ATOM 1157 O ASN A 77 -6.888 -14.260 -3.446 1.00 0.00 O ATOM 1158 CB ASN A 77 -6.863 -17.423 -4.440 1.00 0.00 C ATOM 1159 CG ASN A 77 -6.656 -18.079 -3.088 1.00 0.00 C ATOM 1160 OD1 ASN A 77 -5.523 -18.302 -2.661 1.00 0.00 O ATOM 1161 ND2 ASN A 77 -7.753 -18.393 -2.410 1.00 0.00 N ATOM 0 H ASN A 77 -8.715 -15.678 -6.194 1.00 0.00 H new ATOM 0 HA ASN A 77 -8.381 -16.290 -3.423 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -7.229 -18.165 -5.149 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -5.905 -17.066 -4.818 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -7.677 -18.838 -1.495 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -8.672 -18.189 -2.804 1.00 0.00 H new ATOM 1168 N HIS A 78 -6.695 -14.558 -5.667 1.00 0.00 N ATOM 1169 CA HIS A 78 -5.966 -13.314 -5.883 1.00 0.00 C ATOM 1170 C HIS A 78 -6.931 -12.147 -6.070 1.00 0.00 C ATOM 1171 O HIS A 78 -8.128 -12.347 -6.281 1.00 0.00 O ATOM 1172 CB HIS A 78 -5.050 -13.436 -7.103 1.00 0.00 C ATOM 1173 CG HIS A 78 -4.332 -14.749 -7.185 1.00 0.00 C ATOM 1174 ND1 HIS A 78 -3.822 -15.256 -8.362 1.00 0.00 N ATOM 1175 CD2 HIS A 78 -4.040 -15.661 -6.227 1.00 0.00 C ATOM 1176 CE1 HIS A 78 -3.249 -16.423 -8.124 1.00 0.00 C ATOM 1177 NE2 HIS A 78 -3.367 -16.690 -6.837 1.00 0.00 N ATOM 0 H HIS A 78 -6.862 -15.101 -6.514 1.00 0.00 H new ATOM 0 HA HIS A 78 -5.355 -13.122 -5.001 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -5.643 -13.298 -8.007 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -4.316 -12.631 -7.078 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -4.290 -15.591 -5.179 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -2.766 -17.051 -8.858 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -3.015 -17.526 -6.371 1.00 0.00 H new ATOM 1186 N THR A 79 -6.405 -10.929 -5.990 1.00 0.00 N ATOM 1187 CA THR A 79 -7.224 -9.732 -6.151 1.00 0.00 C ATOM 1188 C THR A 79 -6.356 -8.505 -6.409 1.00 0.00 C ATOM 1189 O THR A 79 -5.576 -8.091 -5.550 1.00 0.00 O ATOM 1190 CB THR A 79 -8.084 -9.507 -4.905 1.00 0.00 C ATOM 1191 OG1 THR A 79 -8.902 -10.636 -4.650 1.00 0.00 O ATOM 1192 CG2 THR A 79 -8.990 -8.300 -5.012 1.00 0.00 C ATOM 0 H THR A 79 -5.417 -10.745 -5.815 1.00 0.00 H new ATOM 0 HA THR A 79 -7.873 -9.882 -7.014 1.00 0.00 H new ATOM 0 HB THR A 79 -7.377 -9.339 -4.093 1.00 0.00 H new ATOM 0 HG1 THR A 79 -8.634 -11.049 -3.803 1.00 0.00 H new ATOM 0 HG21 THR A 79 -9.571 -8.199 -4.095 1.00 0.00 H new ATOM 0 HG22 THR A 79 -8.387 -7.404 -5.160 1.00 0.00 H new ATOM 0 HG23 THR A 79 -9.666 -8.426 -5.858 1.00 0.00 H new ATOM 1200 N GLY A 80 -6.498 -7.923 -7.596 1.00 0.00 N ATOM 1201 CA GLY A 80 -5.724 -6.746 -7.944 1.00 0.00 C ATOM 1202 C GLY A 80 -6.205 -5.506 -7.219 1.00 0.00 C ATOM 1203 O GLY A 80 -7.291 -4.998 -7.498 1.00 0.00 O ATOM 0 H GLY A 80 -7.136 -8.246 -8.323 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -4.675 -6.920 -7.705 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -5.782 -6.581 -9.020 1.00 0.00 H new ATOM 1207 N VAL A 81 -5.398 -5.018 -6.282 1.00 0.00 N ATOM 1208 CA VAL A 81 -5.750 -3.833 -5.512 1.00 0.00 C ATOM 1209 C VAL A 81 -5.327 -2.557 -6.233 1.00 0.00 C ATOM 1210 O VAL A 81 -4.152 -2.189 -6.225 1.00 0.00 O ATOM 1211 CB VAL A 81 -5.101 -3.858 -4.114 1.00 0.00 C ATOM 1212 CG1 VAL A 81 -5.540 -2.655 -3.291 1.00 0.00 C ATOM 1213 CG2 VAL A 81 -5.440 -5.156 -3.395 1.00 0.00 C ATOM 0 H VAL A 81 -4.496 -5.426 -6.039 1.00 0.00 H new ATOM 0 HA VAL A 81 -6.835 -3.841 -5.403 1.00 0.00 H new ATOM 0 HB VAL A 81 -4.019 -3.804 -4.237 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -5.069 -2.695 -2.309 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -5.242 -1.738 -3.799 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -6.624 -2.670 -3.175 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -4.974 -5.158 -2.409 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -6.521 -5.240 -3.286 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -5.067 -6.001 -3.974 1.00 0.00 H new ATOM 1223 N ASP A 82 -6.295 -1.882 -6.846 1.00 0.00 N ATOM 1224 CA ASP A 82 -6.026 -0.641 -7.563 1.00 0.00 C ATOM 1225 C ASP A 82 -6.100 0.549 -6.611 1.00 0.00 C ATOM 1226 O ASP A 82 -7.156 1.161 -6.449 1.00 0.00 O ATOM 1227 CB ASP A 82 -7.025 -0.459 -8.707 1.00 0.00 C ATOM 1228 CG ASP A 82 -6.459 0.371 -9.842 1.00 0.00 C ATOM 1229 OD1 ASP A 82 -5.863 1.432 -9.561 1.00 0.00 O ATOM 1230 OD2 ASP A 82 -6.612 -0.038 -11.012 1.00 0.00 O ATOM 0 H ASP A 82 -7.272 -2.174 -6.860 1.00 0.00 H new ATOM 0 HA ASP A 82 -5.021 -0.695 -7.980 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -7.320 -1.437 -9.088 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -7.927 0.019 -8.325 1.00 0.00 H new ATOM 1235 N SER A 83 -4.976 0.861 -5.977 1.00 0.00 N ATOM 1236 CA SER A 83 -4.914 1.969 -5.031 1.00 0.00 C ATOM 1237 C SER A 83 -4.221 3.183 -5.645 1.00 0.00 C ATOM 1238 O SER A 83 -3.883 3.184 -6.828 1.00 0.00 O ATOM 1239 CB SER A 83 -4.182 1.531 -3.762 1.00 0.00 C ATOM 1240 OG SER A 83 -3.219 0.532 -4.047 1.00 0.00 O ATOM 0 H SER A 83 -4.095 0.362 -6.101 1.00 0.00 H new ATOM 0 HA SER A 83 -5.934 2.257 -4.778 1.00 0.00 H new ATOM 0 HB2 SER A 83 -3.693 2.392 -3.305 1.00 0.00 H new ATOM 0 HB3 SER A 83 -4.901 1.151 -3.037 1.00 0.00 H new ATOM 0 HG SER A 83 -3.431 -0.281 -3.542 1.00 0.00 H new ATOM 1246 N LEU A 84 -4.019 4.215 -4.831 1.00 0.00 N ATOM 1247 CA LEU A 84 -3.371 5.438 -5.293 1.00 0.00 C ATOM 1248 C LEU A 84 -2.439 6.000 -4.223 1.00 0.00 C ATOM 1249 O LEU A 84 -2.891 6.534 -3.211 1.00 0.00 O ATOM 1250 CB LEU A 84 -4.425 6.484 -5.665 1.00 0.00 C ATOM 1251 CG LEU A 84 -3.943 7.594 -6.601 1.00 0.00 C ATOM 1252 CD1 LEU A 84 -2.830 8.399 -5.949 1.00 0.00 C ATOM 1253 CD2 LEU A 84 -3.476 7.010 -7.926 1.00 0.00 C ATOM 0 H LEU A 84 -4.294 4.229 -3.849 1.00 0.00 H new ATOM 0 HA LEU A 84 -2.777 5.195 -6.174 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -5.267 5.976 -6.134 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -4.799 6.941 -4.749 1.00 0.00 H new ATOM 0 HG LEU A 84 -4.780 8.264 -6.797 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.501 9.183 -6.631 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.199 8.850 -5.028 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.991 7.741 -5.721 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -3.137 7.814 -8.579 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -2.654 6.316 -7.748 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -4.302 6.481 -8.401 1.00 0.00 H new ATOM 1265 N CYS A 85 -1.134 5.884 -4.458 1.00 0.00 N ATOM 1266 CA CYS A 85 -0.140 6.389 -3.519 1.00 0.00 C ATOM 1267 C CYS A 85 -0.139 7.914 -3.518 1.00 0.00 C ATOM 1268 O CYS A 85 0.563 8.543 -4.310 1.00 0.00 O ATOM 1269 CB CYS A 85 1.251 5.865 -3.881 1.00 0.00 C ATOM 1270 SG CYS A 85 1.532 4.139 -3.418 1.00 0.00 S ATOM 0 H CYS A 85 -0.742 5.445 -5.291 1.00 0.00 H new ATOM 0 HA CYS A 85 -0.399 6.036 -2.521 1.00 0.00 H new ATOM 0 HB2 CYS A 85 1.399 5.971 -4.956 1.00 0.00 H new ATOM 0 HB3 CYS A 85 2.001 6.488 -3.393 1.00 0.00 H new ATOM 0 HG CYS A 85 1.922 4.080 -2.179 1.00 0.00 H new ATOM 1276 N ASN A 86 -0.936 8.506 -2.633 1.00 0.00 N ATOM 1277 CA ASN A 86 -1.030 9.959 -2.544 1.00 0.00 C ATOM 1278 C ASN A 86 0.007 10.525 -1.580 1.00 0.00 C ATOM 1279 O ASN A 86 0.324 9.912 -0.561 1.00 0.00 O ATOM 1280 CB ASN A 86 -2.434 10.371 -2.099 1.00 0.00 C ATOM 1281 CG ASN A 86 -3.422 10.389 -3.247 1.00 0.00 C ATOM 1282 OD1 ASN A 86 -3.172 11.000 -4.287 1.00 0.00 O ATOM 1283 ND2 ASN A 86 -4.554 9.719 -3.067 1.00 0.00 N ATOM 0 H ASN A 86 -1.525 8.003 -1.969 1.00 0.00 H new ATOM 0 HA ASN A 86 -0.831 10.367 -3.535 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.786 9.682 -1.331 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -2.392 11.361 -1.644 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -5.257 9.697 -3.806 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -4.721 9.226 -2.190 1.00 0.00 H new ATOM 1290 N PHE A 87 0.528 11.703 -1.910 1.00 0.00 N ATOM 1291 CA PHE A 87 1.527 12.361 -1.074 1.00 0.00 C ATOM 1292 C PHE A 87 1.133 13.807 -0.794 1.00 0.00 C ATOM 1293 O PHE A 87 0.169 14.319 -1.364 1.00 0.00 O ATOM 1294 CB PHE A 87 2.899 12.315 -1.750 1.00 0.00 C ATOM 1295 CG PHE A 87 3.635 11.026 -1.526 1.00 0.00 C ATOM 1296 CD1 PHE A 87 3.168 9.842 -2.074 1.00 0.00 C ATOM 1297 CD2 PHE A 87 4.793 10.997 -0.765 1.00 0.00 C ATOM 1298 CE1 PHE A 87 3.842 8.654 -1.869 1.00 0.00 C ATOM 1299 CE2 PHE A 87 5.471 9.812 -0.557 1.00 0.00 C ATOM 1300 CZ PHE A 87 4.997 8.639 -1.109 1.00 0.00 C ATOM 0 H PHE A 87 0.275 12.222 -2.751 1.00 0.00 H new ATOM 0 HA PHE A 87 1.580 11.827 -0.125 1.00 0.00 H new ATOM 0 HB2 PHE A 87 2.772 12.470 -2.821 1.00 0.00 H new ATOM 0 HB3 PHE A 87 3.506 13.140 -1.378 1.00 0.00 H new ATOM 0 HD1 PHE A 87 2.266 9.848 -2.668 1.00 0.00 H new ATOM 0 HD2 PHE A 87 5.169 11.911 -0.330 1.00 0.00 H new ATOM 0 HE1 PHE A 87 3.467 7.738 -2.302 1.00 0.00 H new ATOM 0 HE2 PHE A 87 6.372 9.803 0.038 1.00 0.00 H new ATOM 0 HZ PHE A 87 5.527 7.712 -0.948 1.00 0.00 H new ATOM 1310 N SER A 88 1.881 14.462 0.089 1.00 0.00 N ATOM 1311 CA SER A 88 1.606 15.850 0.442 1.00 0.00 C ATOM 1312 C SER A 88 2.210 16.805 -0.586 1.00 0.00 C ATOM 1313 O SER A 88 3.031 16.405 -1.410 1.00 0.00 O ATOM 1314 CB SER A 88 2.157 16.163 1.837 1.00 0.00 C ATOM 1315 OG SER A 88 1.106 16.385 2.762 1.00 0.00 O ATOM 0 H SER A 88 2.681 14.054 0.572 1.00 0.00 H new ATOM 0 HA SER A 88 0.525 15.990 0.447 1.00 0.00 H new ATOM 0 HB2 SER A 88 2.779 15.336 2.180 1.00 0.00 H new ATOM 0 HB3 SER A 88 2.796 17.044 1.790 1.00 0.00 H new ATOM 0 HG SER A 88 1.483 16.581 3.645 1.00 0.00 H new ATOM 1321 N PRO A 89 1.808 18.088 -0.548 1.00 0.00 N ATOM 1322 CA PRO A 89 2.314 19.101 -1.480 1.00 0.00 C ATOM 1323 C PRO A 89 3.765 19.473 -1.197 1.00 0.00 C ATOM 1324 O PRO A 89 4.501 19.870 -2.100 1.00 0.00 O ATOM 1325 CB PRO A 89 1.396 20.300 -1.231 1.00 0.00 C ATOM 1326 CG PRO A 89 0.929 20.133 0.173 1.00 0.00 C ATOM 1327 CD PRO A 89 0.832 18.649 0.405 1.00 0.00 C ATOM 0 HA PRO A 89 2.307 18.748 -2.511 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.930 21.241 -1.361 1.00 0.00 H new ATOM 0 HB3 PRO A 89 0.558 20.309 -1.929 1.00 0.00 H new ATOM 0 HG2 PRO A 89 1.627 20.592 0.873 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -0.037 20.615 0.323 1.00 0.00 H new ATOM 0 HD2 PRO A 89 1.079 18.386 1.434 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -0.175 18.278 0.214 1.00 0.00 H new ATOM 1335 N LEU A 90 4.171 19.344 0.062 1.00 0.00 N ATOM 1336 CA LEU A 90 5.535 19.667 0.464 1.00 0.00 C ATOM 1337 C LEU A 90 6.543 18.816 -0.302 1.00 0.00 C ATOM 1338 O LEU A 90 7.662 19.252 -0.570 1.00 0.00 O ATOM 1339 CB LEU A 90 5.708 19.456 1.969 1.00 0.00 C ATOM 1340 CG LEU A 90 5.235 20.618 2.845 1.00 0.00 C ATOM 1341 CD1 LEU A 90 3.725 20.579 3.011 1.00 0.00 C ATOM 1342 CD2 LEU A 90 5.925 20.577 4.201 1.00 0.00 C ATOM 0 H LEU A 90 3.574 19.018 0.822 1.00 0.00 H new ATOM 0 HA LEU A 90 5.720 20.715 0.228 1.00 0.00 H new ATOM 0 HB2 LEU A 90 5.164 18.557 2.259 1.00 0.00 H new ATOM 0 HB3 LEU A 90 6.762 19.271 2.176 1.00 0.00 H new ATOM 0 HG LEU A 90 5.501 21.553 2.352 1.00 0.00 H new ATOM 0 HD11 LEU A 90 3.406 21.413 3.637 1.00 0.00 H new ATOM 0 HD12 LEU A 90 3.249 20.657 2.033 1.00 0.00 H new ATOM 0 HD13 LEU A 90 3.435 19.640 3.482 1.00 0.00 H new ATOM 0 HD21 LEU A 90 5.577 21.410 4.812 1.00 0.00 H new ATOM 0 HD22 LEU A 90 5.689 19.638 4.701 1.00 0.00 H new ATOM 0 HD23 LEU A 90 7.003 20.654 4.063 1.00 0.00 H new ATOM 1354 N ALA A 91 6.138 17.598 -0.651 1.00 0.00 N ATOM 1355 CA ALA A 91 7.006 16.686 -1.387 1.00 0.00 C ATOM 1356 C ALA A 91 7.043 17.041 -2.870 1.00 0.00 C ATOM 1357 O ALA A 91 6.012 17.339 -3.473 1.00 0.00 O ATOM 1358 CB ALA A 91 6.542 15.250 -1.197 1.00 0.00 C ATOM 0 H ALA A 91 5.215 17.221 -0.436 1.00 0.00 H new ATOM 0 HA ALA A 91 8.017 16.785 -0.992 1.00 0.00 H new ATOM 0 HB1 ALA A 91 7.198 14.579 -1.752 1.00 0.00 H new ATOM 0 HB2 ALA A 91 6.573 14.995 -0.138 1.00 0.00 H new ATOM 0 HB3 ALA A 91 5.521 15.146 -1.565 1.00 0.00 H new ATOM 1364 N ARG A 92 8.238 17.009 -3.452 1.00 0.00 N ATOM 1365 CA ARG A 92 8.409 17.328 -4.864 1.00 0.00 C ATOM 1366 C ARG A 92 9.569 16.540 -5.465 1.00 0.00 C ATOM 1367 O ARG A 92 10.255 17.017 -6.368 1.00 0.00 O ATOM 1368 CB ARG A 92 8.647 18.828 -5.046 1.00 0.00 C ATOM 1369 CG ARG A 92 9.937 19.321 -4.411 1.00 0.00 C ATOM 1370 CD ARG A 92 10.354 20.673 -4.966 1.00 0.00 C ATOM 1371 NE ARG A 92 10.171 21.747 -3.992 1.00 0.00 N ATOM 1372 CZ ARG A 92 10.857 21.842 -2.855 1.00 0.00 C ATOM 1373 NH1 ARG A 92 11.773 20.932 -2.546 1.00 0.00 N ATOM 1374 NH2 ARG A 92 10.626 22.849 -2.025 1.00 0.00 N ATOM 0 H ARG A 92 9.102 16.765 -2.967 1.00 0.00 H new ATOM 0 HA ARG A 92 7.494 17.047 -5.386 1.00 0.00 H new ATOM 0 HB2 ARG A 92 8.665 19.058 -6.111 1.00 0.00 H new ATOM 0 HB3 ARG A 92 7.808 19.375 -4.616 1.00 0.00 H new ATOM 0 HG2 ARG A 92 9.806 19.395 -3.331 1.00 0.00 H new ATOM 0 HG3 ARG A 92 10.730 18.595 -4.587 1.00 0.00 H new ATOM 0 HD2 ARG A 92 11.400 20.633 -5.269 1.00 0.00 H new ATOM 0 HD3 ARG A 92 9.771 20.892 -5.861 1.00 0.00 H new ATOM 0 HE ARG A 92 9.477 22.466 -4.195 1.00 0.00 H new ATOM 0 HH11 ARG A 92 11.954 20.155 -3.181 1.00 0.00 H new ATOM 0 HH12 ARG A 92 12.295 21.010 -1.673 1.00 0.00 H new ATOM 0 HH21 ARG A 92 9.923 23.551 -2.257 1.00 0.00 H new ATOM 0 HH22 ARG A 92 11.151 22.922 -1.154 1.00 0.00 H new ATOM 1388 N ARG A 93 9.782 15.331 -4.956 1.00 0.00 N ATOM 1389 CA ARG A 93 10.859 14.476 -5.442 1.00 0.00 C ATOM 1390 C ARG A 93 10.589 13.013 -5.102 1.00 0.00 C ATOM 1391 O ARG A 93 11.481 12.294 -4.648 1.00 0.00 O ATOM 1392 CB ARG A 93 12.199 14.918 -4.844 1.00 0.00 C ATOM 1393 CG ARG A 93 13.311 15.044 -5.873 1.00 0.00 C ATOM 1394 CD ARG A 93 13.687 13.692 -6.460 1.00 0.00 C ATOM 1395 NE ARG A 93 14.950 13.193 -5.922 1.00 0.00 N ATOM 1396 CZ ARG A 93 15.627 12.174 -6.444 1.00 0.00 C ATOM 1397 NH1 ARG A 93 15.168 11.542 -7.517 1.00 0.00 N ATOM 1398 NH2 ARG A 93 16.769 11.784 -5.891 1.00 0.00 N ATOM 0 H ARG A 93 9.223 14.921 -4.207 1.00 0.00 H new ATOM 0 HA ARG A 93 10.906 14.572 -6.527 1.00 0.00 H new ATOM 0 HB2 ARG A 93 12.066 15.878 -4.345 1.00 0.00 H new ATOM 0 HB3 ARG A 93 12.501 14.201 -4.080 1.00 0.00 H new ATOM 0 HG2 ARG A 93 12.993 15.713 -6.673 1.00 0.00 H new ATOM 0 HG3 ARG A 93 14.187 15.496 -5.409 1.00 0.00 H new ATOM 0 HD2 ARG A 93 12.895 12.973 -6.251 1.00 0.00 H new ATOM 0 HD3 ARG A 93 13.763 13.776 -7.544 1.00 0.00 H new ATOM 0 HE ARG A 93 15.336 13.653 -5.097 1.00 0.00 H new ATOM 0 HH11 ARG A 93 14.291 11.837 -7.946 1.00 0.00 H new ATOM 0 HH12 ARG A 93 15.692 10.761 -7.912 1.00 0.00 H new ATOM 0 HH21 ARG A 93 17.127 12.266 -5.066 1.00 0.00 H new ATOM 0 HH22 ARG A 93 17.289 11.003 -6.291 1.00 0.00 H new ATOM 1412 N VAL A 94 9.353 12.577 -5.324 1.00 0.00 N ATOM 1413 CA VAL A 94 8.967 11.200 -5.042 1.00 0.00 C ATOM 1414 C VAL A 94 8.750 10.417 -6.333 1.00 0.00 C ATOM 1415 O VAL A 94 7.726 10.571 -6.999 1.00 0.00 O ATOM 1416 CB VAL A 94 7.682 11.136 -4.195 1.00 0.00 C ATOM 1417 CG1 VAL A 94 7.402 9.707 -3.756 1.00 0.00 C ATOM 1418 CG2 VAL A 94 7.787 12.061 -2.989 1.00 0.00 C ATOM 0 H VAL A 94 8.602 13.157 -5.698 1.00 0.00 H new ATOM 0 HA VAL A 94 9.785 10.752 -4.479 1.00 0.00 H new ATOM 0 HB VAL A 94 6.848 11.473 -4.810 1.00 0.00 H new ATOM 0 HG11 VAL A 94 6.491 9.682 -3.159 1.00 0.00 H new ATOM 0 HG12 VAL A 94 7.278 9.074 -4.635 1.00 0.00 H new ATOM 0 HG13 VAL A 94 8.237 9.339 -3.159 1.00 0.00 H new ATOM 0 HG21 VAL A 94 6.869 12.001 -2.404 1.00 0.00 H new ATOM 0 HG22 VAL A 94 8.632 11.758 -2.371 1.00 0.00 H new ATOM 0 HG23 VAL A 94 7.935 13.086 -3.329 1.00 0.00 H new ATOM 1428 N ASP A 95 9.719 9.577 -6.679 1.00 0.00 N ATOM 1429 CA ASP A 95 9.633 8.769 -7.890 1.00 0.00 C ATOM 1430 C ASP A 95 8.798 7.515 -7.649 1.00 0.00 C ATOM 1431 O ASP A 95 8.631 7.078 -6.511 1.00 0.00 O ATOM 1432 CB ASP A 95 11.033 8.379 -8.368 1.00 0.00 C ATOM 1433 CG ASP A 95 11.145 8.368 -9.880 1.00 0.00 C ATOM 1434 OD1 ASP A 95 10.120 8.113 -10.549 1.00 0.00 O ATOM 1435 OD2 ASP A 95 12.255 8.615 -10.395 1.00 0.00 O ATOM 0 H ASP A 95 10.573 9.438 -6.139 1.00 0.00 H new ATOM 0 HA ASP A 95 9.146 9.366 -8.661 1.00 0.00 H new ATOM 0 HB2 ASP A 95 11.762 9.078 -7.957 1.00 0.00 H new ATOM 0 HB3 ASP A 95 11.284 7.392 -7.981 1.00 0.00 H new ATOM 1440 N ARG A 96 8.276 6.942 -8.728 1.00 0.00 N ATOM 1441 CA ARG A 96 7.458 5.738 -8.634 1.00 0.00 C ATOM 1442 C ARG A 96 8.249 4.592 -8.012 1.00 0.00 C ATOM 1443 O ARG A 96 7.688 3.734 -7.333 1.00 0.00 O ATOM 1444 CB ARG A 96 6.949 5.331 -10.018 1.00 0.00 C ATOM 1445 CG ARG A 96 8.057 5.125 -11.039 1.00 0.00 C ATOM 1446 CD ARG A 96 7.560 4.350 -12.249 1.00 0.00 C ATOM 1447 NE ARG A 96 8.242 4.755 -13.476 1.00 0.00 N ATOM 1448 CZ ARG A 96 9.484 4.392 -13.788 1.00 0.00 C ATOM 1449 NH1 ARG A 96 10.183 3.616 -12.968 1.00 0.00 N ATOM 1450 NH2 ARG A 96 10.029 4.805 -14.924 1.00 0.00 N ATOM 0 H ARG A 96 8.405 7.292 -9.678 1.00 0.00 H new ATOM 0 HA ARG A 96 6.605 5.957 -7.992 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.374 4.409 -9.928 1.00 0.00 H new ATOM 0 HB3 ARG A 96 6.267 6.098 -10.385 1.00 0.00 H new ATOM 0 HG2 ARG A 96 8.444 6.093 -11.359 1.00 0.00 H new ATOM 0 HG3 ARG A 96 8.885 4.588 -10.576 1.00 0.00 H new ATOM 0 HD2 ARG A 96 7.713 3.283 -12.084 1.00 0.00 H new ATOM 0 HD3 ARG A 96 6.487 4.504 -12.363 1.00 0.00 H new ATOM 0 HE ARG A 96 7.737 5.351 -14.132 1.00 0.00 H new ATOM 0 HH11 ARG A 96 9.769 3.295 -12.093 1.00 0.00 H new ATOM 0 HH12 ARG A 96 11.134 3.341 -13.213 1.00 0.00 H new ATOM 0 HH21 ARG A 96 9.497 5.401 -15.558 1.00 0.00 H new ATOM 0 HH22 ARG A 96 10.981 4.527 -15.164 1.00 0.00 H new ATOM 1464 N VAL A 97 9.557 4.587 -8.249 1.00 0.00 N ATOM 1465 CA VAL A 97 10.428 3.548 -7.712 1.00 0.00 C ATOM 1466 C VAL A 97 10.547 3.658 -6.196 1.00 0.00 C ATOM 1467 O VAL A 97 10.741 2.658 -5.504 1.00 0.00 O ATOM 1468 CB VAL A 97 11.836 3.619 -8.332 1.00 0.00 C ATOM 1469 CG1 VAL A 97 12.665 2.414 -7.917 1.00 0.00 C ATOM 1470 CG2 VAL A 97 11.747 3.718 -9.847 1.00 0.00 C ATOM 0 H VAL A 97 10.037 5.291 -8.810 1.00 0.00 H new ATOM 0 HA VAL A 97 9.973 2.591 -7.969 1.00 0.00 H new ATOM 0 HB VAL A 97 12.332 4.516 -7.960 1.00 0.00 H new ATOM 0 HG11 VAL A 97 13.656 2.483 -8.365 1.00 0.00 H new ATOM 0 HG12 VAL A 97 12.758 2.393 -6.831 1.00 0.00 H new ATOM 0 HG13 VAL A 97 12.176 1.501 -8.257 1.00 0.00 H new ATOM 0 HG21 VAL A 97 12.751 3.767 -10.268 1.00 0.00 H new ATOM 0 HG22 VAL A 97 11.232 2.841 -10.239 1.00 0.00 H new ATOM 0 HG23 VAL A 97 11.194 4.617 -10.121 1.00 0.00 H new ATOM 1480 N ALA A 98 10.429 4.879 -5.684 1.00 0.00 N ATOM 1481 CA ALA A 98 10.524 5.119 -4.248 1.00 0.00 C ATOM 1482 C ALA A 98 9.470 4.323 -3.486 1.00 0.00 C ATOM 1483 O ALA A 98 9.798 3.484 -2.647 1.00 0.00 O ATOM 1484 CB ALA A 98 10.382 6.604 -3.951 1.00 0.00 C ATOM 0 H ALA A 98 10.267 5.718 -6.242 1.00 0.00 H new ATOM 0 HA ALA A 98 11.506 4.784 -3.914 1.00 0.00 H new ATOM 0 HB1 ALA A 98 10.455 6.769 -2.876 1.00 0.00 H new ATOM 0 HB2 ALA A 98 11.176 7.154 -4.457 1.00 0.00 H new ATOM 0 HB3 ALA A 98 9.414 6.955 -4.307 1.00 0.00 H new ATOM 1490 N ILE A 99 8.203 4.590 -3.787 1.00 0.00 N ATOM 1491 CA ILE A 99 7.101 3.895 -3.130 1.00 0.00 C ATOM 1492 C ILE A 99 7.093 2.414 -3.493 1.00 0.00 C ATOM 1493 O ILE A 99 6.597 1.582 -2.735 1.00 0.00 O ATOM 1494 CB ILE A 99 5.739 4.516 -3.503 1.00 0.00 C ATOM 1495 CG1 ILE A 99 5.765 6.030 -3.285 1.00 0.00 C ATOM 1496 CG2 ILE A 99 4.623 3.878 -2.689 1.00 0.00 C ATOM 1497 CD1 ILE A 99 4.857 6.792 -4.227 1.00 0.00 C ATOM 0 H ILE A 99 7.914 5.281 -4.480 1.00 0.00 H new ATOM 0 HA ILE A 99 7.254 4.002 -2.056 1.00 0.00 H new ATOM 0 HB ILE A 99 5.548 4.323 -4.559 1.00 0.00 H new ATOM 0 HG12 ILE A 99 5.473 6.246 -2.257 1.00 0.00 H new ATOM 0 HG13 ILE A 99 6.787 6.389 -3.408 1.00 0.00 H new ATOM 0 HG21 ILE A 99 3.669 4.328 -2.964 1.00 0.00 H new ATOM 0 HG22 ILE A 99 4.591 2.807 -2.891 1.00 0.00 H new ATOM 0 HG23 ILE A 99 4.808 4.041 -1.627 1.00 0.00 H new ATOM 0 HD11 ILE A 99 4.926 7.859 -4.015 1.00 0.00 H new ATOM 0 HD12 ILE A 99 5.162 6.606 -5.257 1.00 0.00 H new ATOM 0 HD13 ILE A 99 3.828 6.460 -4.088 1.00 0.00 H new ATOM 1509 N TYR A 100 7.650 2.092 -4.658 1.00 0.00 N ATOM 1510 CA TYR A 100 7.709 0.709 -5.122 1.00 0.00 C ATOM 1511 C TYR A 100 8.737 -0.087 -4.325 1.00 0.00 C ATOM 1512 O TYR A 100 8.484 -1.224 -3.928 1.00 0.00 O ATOM 1513 CB TYR A 100 8.058 0.666 -6.611 1.00 0.00 C ATOM 1514 CG TYR A 100 7.981 -0.720 -7.212 1.00 0.00 C ATOM 1515 CD1 TYR A 100 6.778 -1.412 -7.260 1.00 0.00 C ATOM 1516 CD2 TYR A 100 9.113 -1.335 -7.733 1.00 0.00 C ATOM 1517 CE1 TYR A 100 6.705 -2.678 -7.809 1.00 0.00 C ATOM 1518 CE2 TYR A 100 9.048 -2.600 -8.285 1.00 0.00 C ATOM 1519 CZ TYR A 100 7.842 -3.267 -8.321 1.00 0.00 C ATOM 1520 OH TYR A 100 7.772 -4.527 -8.870 1.00 0.00 O ATOM 0 H TYR A 100 8.066 2.769 -5.297 1.00 0.00 H new ATOM 0 HA TYR A 100 6.729 0.257 -4.971 1.00 0.00 H new ATOM 0 HB2 TYR A 100 7.381 1.326 -7.153 1.00 0.00 H new ATOM 0 HB3 TYR A 100 9.065 1.058 -6.751 1.00 0.00 H new ATOM 0 HD1 TYR A 100 5.885 -0.953 -6.862 1.00 0.00 H new ATOM 0 HD2 TYR A 100 10.059 -0.815 -7.706 1.00 0.00 H new ATOM 0 HE1 TYR A 100 5.762 -3.204 -7.837 1.00 0.00 H new ATOM 0 HE2 TYR A 100 9.937 -3.064 -8.686 1.00 0.00 H new ATOM 0 HH TYR A 100 6.849 -4.716 -9.138 1.00 0.00 H new ATOM 1530 N GLU A 101 9.899 0.518 -4.100 1.00 0.00 N ATOM 1531 CA GLU A 101 10.968 -0.133 -3.355 1.00 0.00 C ATOM 1532 C GLU A 101 10.652 -0.172 -1.863 1.00 0.00 C ATOM 1533 O GLU A 101 10.992 -1.131 -1.171 1.00 0.00 O ATOM 1534 CB GLU A 101 12.292 0.596 -3.590 1.00 0.00 C ATOM 1535 CG GLU A 101 12.996 0.180 -4.871 1.00 0.00 C ATOM 1536 CD GLU A 101 14.502 0.104 -4.709 1.00 0.00 C ATOM 1537 OE1 GLU A 101 14.997 -0.946 -4.248 1.00 0.00 O ATOM 1538 OE2 GLU A 101 15.186 1.095 -5.044 1.00 0.00 O ATOM 0 H GLU A 101 10.123 1.459 -4.424 1.00 0.00 H new ATOM 0 HA GLU A 101 11.054 -1.159 -3.713 1.00 0.00 H new ATOM 0 HB2 GLU A 101 12.106 1.670 -3.620 1.00 0.00 H new ATOM 0 HB3 GLU A 101 12.954 0.411 -2.744 1.00 0.00 H new ATOM 0 HG2 GLU A 101 12.619 -0.792 -5.190 1.00 0.00 H new ATOM 0 HG3 GLU A 101 12.754 0.891 -5.661 1.00 0.00 H new ATOM 1545 N GLU A 102 9.998 0.877 -1.374 1.00 0.00 N ATOM 1546 CA GLU A 102 9.637 0.962 0.037 1.00 0.00 C ATOM 1547 C GLU A 102 8.536 -0.037 0.379 1.00 0.00 C ATOM 1548 O GLU A 102 8.674 -0.833 1.308 1.00 0.00 O ATOM 1549 CB GLU A 102 9.182 2.384 0.382 1.00 0.00 C ATOM 1550 CG GLU A 102 9.996 3.028 1.492 1.00 0.00 C ATOM 1551 CD GLU A 102 10.946 4.092 0.977 1.00 0.00 C ATOM 1552 OE1 GLU A 102 10.613 4.745 -0.035 1.00 0.00 O ATOM 1553 OE2 GLU A 102 12.022 4.272 1.585 1.00 0.00 O ATOM 0 H GLU A 102 9.707 1.679 -1.933 1.00 0.00 H new ATOM 0 HA GLU A 102 10.519 0.716 0.629 1.00 0.00 H new ATOM 0 HB2 GLU A 102 9.246 3.005 -0.512 1.00 0.00 H new ATOM 0 HB3 GLU A 102 8.133 2.360 0.678 1.00 0.00 H new ATOM 0 HG2 GLU A 102 9.320 3.473 2.222 1.00 0.00 H new ATOM 0 HG3 GLU A 102 10.566 2.259 2.013 1.00 0.00 H new ATOM 1560 N PHE A 103 7.444 0.010 -0.378 1.00 0.00 N ATOM 1561 CA PHE A 103 6.318 -0.890 -0.156 1.00 0.00 C ATOM 1562 C PHE A 103 6.750 -2.349 -0.273 1.00 0.00 C ATOM 1563 O PHE A 103 6.161 -3.232 0.349 1.00 0.00 O ATOM 1564 CB PHE A 103 5.201 -0.597 -1.158 1.00 0.00 C ATOM 1565 CG PHE A 103 3.976 -1.444 -0.958 1.00 0.00 C ATOM 1566 CD1 PHE A 103 3.254 -1.374 0.223 1.00 0.00 C ATOM 1567 CD2 PHE A 103 3.549 -2.312 -1.950 1.00 0.00 C ATOM 1568 CE1 PHE A 103 2.128 -2.153 0.410 1.00 0.00 C ATOM 1569 CE2 PHE A 103 2.423 -3.093 -1.769 1.00 0.00 C ATOM 1570 CZ PHE A 103 1.712 -3.014 -0.587 1.00 0.00 C ATOM 0 H PHE A 103 7.315 0.663 -1.151 1.00 0.00 H new ATOM 0 HA PHE A 103 5.947 -0.722 0.855 1.00 0.00 H new ATOM 0 HB2 PHE A 103 4.922 0.454 -1.082 1.00 0.00 H new ATOM 0 HB3 PHE A 103 5.580 -0.754 -2.168 1.00 0.00 H new ATOM 0 HD1 PHE A 103 3.575 -0.703 1.006 1.00 0.00 H new ATOM 0 HD2 PHE A 103 4.102 -2.379 -2.875 1.00 0.00 H new ATOM 0 HE1 PHE A 103 1.574 -2.089 1.335 1.00 0.00 H new ATOM 0 HE2 PHE A 103 2.099 -3.764 -2.551 1.00 0.00 H new ATOM 0 HZ PHE A 103 0.833 -3.624 -0.443 1.00 0.00 H new ATOM 1580 N LEU A 104 7.780 -2.594 -1.075 1.00 0.00 N ATOM 1581 CA LEU A 104 8.289 -3.947 -1.275 1.00 0.00 C ATOM 1582 C LEU A 104 9.298 -4.325 -0.193 1.00 0.00 C ATOM 1583 O LEU A 104 9.535 -5.506 0.060 1.00 0.00 O ATOM 1584 CB LEU A 104 8.936 -4.069 -2.656 1.00 0.00 C ATOM 1585 CG LEU A 104 7.956 -4.078 -3.831 1.00 0.00 C ATOM 1586 CD1 LEU A 104 8.707 -4.124 -5.151 1.00 0.00 C ATOM 1587 CD2 LEU A 104 7.001 -5.256 -3.715 1.00 0.00 C ATOM 0 H LEU A 104 8.279 -1.874 -1.597 1.00 0.00 H new ATOM 0 HA LEU A 104 7.446 -4.635 -1.210 1.00 0.00 H new ATOM 0 HB2 LEU A 104 9.632 -3.241 -2.789 1.00 0.00 H new ATOM 0 HB3 LEU A 104 9.524 -4.987 -2.686 1.00 0.00 H new ATOM 0 HG LEU A 104 7.372 -3.158 -3.803 1.00 0.00 H new ATOM 0 HD11 LEU A 104 7.994 -4.130 -5.975 1.00 0.00 H new ATOM 0 HD12 LEU A 104 9.351 -3.248 -5.234 1.00 0.00 H new ATOM 0 HD13 LEU A 104 9.316 -5.027 -5.192 1.00 0.00 H new ATOM 0 HD21 LEU A 104 6.310 -5.249 -4.558 1.00 0.00 H new ATOM 0 HD22 LEU A 104 7.569 -6.186 -3.719 1.00 0.00 H new ATOM 0 HD23 LEU A 104 6.439 -5.178 -2.784 1.00 0.00 H new ATOM 1599 N ARG A 105 9.895 -3.318 0.439 1.00 0.00 N ATOM 1600 CA ARG A 105 10.881 -3.552 1.489 1.00 0.00 C ATOM 1601 C ARG A 105 10.205 -3.850 2.824 1.00 0.00 C ATOM 1602 O ARG A 105 10.743 -4.585 3.653 1.00 0.00 O ATOM 1603 CB ARG A 105 11.803 -2.337 1.628 1.00 0.00 C ATOM 1604 CG ARG A 105 13.131 -2.496 0.904 1.00 0.00 C ATOM 1605 CD ARG A 105 14.300 -2.566 1.877 1.00 0.00 C ATOM 1606 NE ARG A 105 15.241 -1.466 1.681 1.00 0.00 N ATOM 1607 CZ ARG A 105 15.040 -0.230 2.131 1.00 0.00 C ATOM 1608 NH1 ARG A 105 13.933 0.069 2.800 1.00 0.00 N ATOM 1609 NH2 ARG A 105 15.949 0.711 1.911 1.00 0.00 N ATOM 0 H ARG A 105 9.713 -2.334 0.242 1.00 0.00 H new ATOM 0 HA ARG A 105 11.474 -4.422 1.207 1.00 0.00 H new ATOM 0 HB2 ARG A 105 11.291 -1.456 1.241 1.00 0.00 H new ATOM 0 HB3 ARG A 105 11.994 -2.155 2.686 1.00 0.00 H new ATOM 0 HG2 ARG A 105 13.108 -3.401 0.297 1.00 0.00 H new ATOM 0 HG3 ARG A 105 13.276 -1.658 0.222 1.00 0.00 H new ATOM 0 HD2 ARG A 105 13.923 -2.543 2.899 1.00 0.00 H new ATOM 0 HD3 ARG A 105 14.820 -3.515 1.751 1.00 0.00 H new ATOM 0 HE ARG A 105 16.103 -1.657 1.169 1.00 0.00 H new ATOM 0 HH11 ARG A 105 13.231 -0.651 2.972 1.00 0.00 H new ATOM 0 HH12 ARG A 105 13.785 1.018 3.142 1.00 0.00 H new ATOM 0 HH21 ARG A 105 16.801 0.487 1.397 1.00 0.00 H new ATOM 0 HH22 ARG A 105 15.796 1.659 2.256 1.00 0.00 H new ATOM 1623 N MET A 106 9.026 -3.273 3.031 1.00 0.00 N ATOM 1624 CA MET A 106 8.282 -3.476 4.270 1.00 0.00 C ATOM 1625 C MET A 106 7.355 -4.686 4.171 1.00 0.00 C ATOM 1626 O MET A 106 6.928 -5.233 5.187 1.00 0.00 O ATOM 1627 CB MET A 106 7.471 -2.227 4.614 1.00 0.00 C ATOM 1628 CG MET A 106 6.823 -2.285 5.988 1.00 0.00 C ATOM 1629 SD MET A 106 7.263 -0.881 7.030 1.00 0.00 S ATOM 1630 CE MET A 106 6.673 0.481 6.027 1.00 0.00 C ATOM 0 H MET A 106 8.565 -2.661 2.358 1.00 0.00 H new ATOM 0 HA MET A 106 9.005 -3.665 5.063 1.00 0.00 H new ATOM 0 HB2 MET A 106 8.123 -1.355 4.565 1.00 0.00 H new ATOM 0 HB3 MET A 106 6.696 -2.088 3.861 1.00 0.00 H new ATOM 0 HG2 MET A 106 5.740 -2.320 5.872 1.00 0.00 H new ATOM 0 HG3 MET A 106 7.120 -3.208 6.486 1.00 0.00 H new ATOM 0 HE1 MET A 106 7.461 1.228 5.928 1.00 0.00 H new ATOM 0 HE2 MET A 106 6.397 0.112 5.039 1.00 0.00 H new ATOM 0 HE3 MET A 106 5.802 0.932 6.502 1.00 0.00 H new ATOM 1640 N THR A 107 7.041 -5.096 2.946 1.00 0.00 N ATOM 1641 CA THR A 107 6.160 -6.239 2.727 1.00 0.00 C ATOM 1642 C THR A 107 6.962 -7.519 2.508 1.00 0.00 C ATOM 1643 O THR A 107 6.531 -8.415 1.782 1.00 0.00 O ATOM 1644 CB THR A 107 5.251 -5.985 1.524 1.00 0.00 C ATOM 1645 OG1 THR A 107 6.017 -5.720 0.363 1.00 0.00 O ATOM 1646 CG2 THR A 107 4.305 -4.820 1.725 1.00 0.00 C ATOM 0 H THR A 107 7.382 -4.655 2.092 1.00 0.00 H new ATOM 0 HA THR A 107 5.548 -6.366 3.620 1.00 0.00 H new ATOM 0 HB THR A 107 4.663 -6.895 1.409 1.00 0.00 H new ATOM 0 HG1 THR A 107 5.824 -4.814 0.043 1.00 0.00 H new ATOM 0 HG21 THR A 107 3.689 -4.694 0.835 1.00 0.00 H new ATOM 0 HG22 THR A 107 3.665 -5.016 2.585 1.00 0.00 H new ATOM 0 HG23 THR A 107 4.880 -3.911 1.900 1.00 0.00 H new ATOM 1654 N HIS A 108 8.129 -7.601 3.142 1.00 0.00 N ATOM 1655 CA HIS A 108 8.988 -8.775 3.016 1.00 0.00 C ATOM 1656 C HIS A 108 9.270 -9.087 1.548 1.00 0.00 C ATOM 1657 O HIS A 108 9.046 -10.205 1.085 1.00 0.00 O ATOM 1658 CB HIS A 108 8.336 -9.983 3.691 1.00 0.00 C ATOM 1659 CG HIS A 108 8.428 -9.954 5.186 1.00 0.00 C ATOM 1660 ND1 HIS A 108 8.700 -8.807 5.902 1.00 0.00 N ATOM 1661 CD2 HIS A 108 8.284 -10.942 6.102 1.00 0.00 C ATOM 1662 CE1 HIS A 108 8.719 -9.090 7.192 1.00 0.00 C ATOM 1663 NE2 HIS A 108 8.469 -10.378 7.340 1.00 0.00 N ATOM 0 H HIS A 108 8.501 -6.869 3.747 1.00 0.00 H new ATOM 0 HA HIS A 108 9.935 -8.558 3.511 1.00 0.00 H new ATOM 0 HB2 HIS A 108 7.286 -10.029 3.400 1.00 0.00 H new ATOM 0 HB3 HIS A 108 8.809 -10.894 3.323 1.00 0.00 H new ATOM 0 HD2 HIS A 108 8.065 -11.979 5.897 1.00 0.00 H new ATOM 0 HE1 HIS A 108 8.907 -8.387 7.990 1.00 0.00 H new ATOM 0 HE2 HIS A 108 8.421 -10.874 8.230 1.00 0.00 H new ATOM 1672 N ASN A 109 9.762 -8.088 0.822 1.00 0.00 N ATOM 1673 CA ASN A 109 10.074 -8.253 -0.594 1.00 0.00 C ATOM 1674 C ASN A 109 8.803 -8.505 -1.400 1.00 0.00 C ATOM 1675 O ASN A 109 8.796 -9.302 -2.338 1.00 0.00 O ATOM 1676 CB ASN A 109 11.063 -9.406 -0.791 1.00 0.00 C ATOM 1677 CG ASN A 109 12.354 -8.954 -1.445 1.00 0.00 C ATOM 1678 OD1 ASN A 109 13.291 -8.530 -0.769 1.00 0.00 O ATOM 1679 ND2 ASN A 109 12.409 -9.042 -2.769 1.00 0.00 N ATOM 0 H ASN A 109 9.953 -7.156 1.190 1.00 0.00 H new ATOM 0 HA ASN A 109 10.533 -7.332 -0.953 1.00 0.00 H new ATOM 0 HB2 ASN A 109 11.287 -9.858 0.175 1.00 0.00 H new ATOM 0 HB3 ASN A 109 10.599 -10.178 -1.404 1.00 0.00 H new ATOM 0 HD21 ASN A 109 13.252 -8.752 -3.265 1.00 0.00 H new ATOM 0 HD22 ASN A 109 11.608 -9.400 -3.290 1.00 0.00 H new ATOM 1686 N GLY A 110 7.727 -7.818 -1.027 1.00 0.00 N ATOM 1687 CA GLY A 110 6.465 -7.979 -1.723 1.00 0.00 C ATOM 1688 C GLY A 110 5.891 -9.373 -1.564 1.00 0.00 C ATOM 1689 O GLY A 110 5.319 -9.926 -2.503 1.00 0.00 O ATOM 0 H GLY A 110 7.708 -7.152 -0.254 1.00 0.00 H new ATOM 0 HA2 GLY A 110 5.749 -7.249 -1.345 1.00 0.00 H new ATOM 0 HA3 GLY A 110 6.608 -7.767 -2.783 1.00 0.00 H new ATOM 1693 N THR A 111 6.044 -9.941 -0.374 1.00 0.00 N ATOM 1694 CA THR A 111 5.536 -11.280 -0.096 1.00 0.00 C ATOM 1695 C THR A 111 4.337 -11.228 0.844 1.00 0.00 C ATOM 1696 O THR A 111 3.351 -11.940 0.646 1.00 0.00 O ATOM 1697 CB THR A 111 6.636 -12.151 0.512 1.00 0.00 C ATOM 1698 OG1 THR A 111 7.086 -11.605 1.739 1.00 0.00 O ATOM 1699 CG2 THR A 111 7.842 -12.310 -0.389 1.00 0.00 C ATOM 0 H THR A 111 6.515 -9.496 0.414 1.00 0.00 H new ATOM 0 HA THR A 111 5.214 -11.718 -1.040 1.00 0.00 H new ATOM 0 HB THR A 111 6.181 -13.131 0.658 1.00 0.00 H new ATOM 0 HG1 THR A 111 7.698 -10.860 1.561 1.00 0.00 H new ATOM 0 HG21 THR A 111 8.584 -12.939 0.103 1.00 0.00 H new ATOM 0 HG22 THR A 111 7.537 -12.775 -1.327 1.00 0.00 H new ATOM 0 HG23 THR A 111 8.275 -11.331 -0.593 1.00 0.00 H new ATOM 1707 N GLN A 112 4.427 -10.387 1.869 1.00 0.00 N ATOM 1708 CA GLN A 112 3.345 -10.253 2.838 1.00 0.00 C ATOM 1709 C GLN A 112 3.252 -8.827 3.372 1.00 0.00 C ATOM 1710 O GLN A 112 4.189 -8.323 3.992 1.00 0.00 O ATOM 1711 CB GLN A 112 3.549 -11.231 3.997 1.00 0.00 C ATOM 1712 CG GLN A 112 2.364 -11.305 4.946 1.00 0.00 C ATOM 1713 CD GLN A 112 2.656 -12.133 6.182 1.00 0.00 C ATOM 1714 OE1 GLN A 112 3.744 -12.052 6.755 1.00 0.00 O ATOM 1715 NE2 GLN A 112 1.686 -12.939 6.598 1.00 0.00 N ATOM 0 H GLN A 112 5.234 -9.790 2.050 1.00 0.00 H new ATOM 0 HA GLN A 112 2.410 -10.487 2.329 1.00 0.00 H new ATOM 0 HB2 GLN A 112 3.743 -12.225 3.593 1.00 0.00 H new ATOM 0 HB3 GLN A 112 4.436 -10.936 4.558 1.00 0.00 H new ATOM 0 HG2 GLN A 112 2.082 -10.296 5.248 1.00 0.00 H new ATOM 0 HG3 GLN A 112 1.509 -11.732 4.421 1.00 0.00 H new ATOM 0 HE21 GLN A 112 0.801 -12.974 6.093 1.00 0.00 H new ATOM 0 HE22 GLN A 112 1.826 -13.523 7.423 1.00 0.00 H new ATOM 1724 N LEU A 113 2.113 -8.187 3.131 1.00 0.00 N ATOM 1725 CA LEU A 113 1.887 -6.823 3.591 1.00 0.00 C ATOM 1726 C LEU A 113 1.232 -6.827 4.970 1.00 0.00 C ATOM 1727 O LEU A 113 0.023 -7.014 5.090 1.00 0.00 O ATOM 1728 CB LEU A 113 1.008 -6.064 2.589 1.00 0.00 C ATOM 1729 CG LEU A 113 0.576 -4.653 3.010 1.00 0.00 C ATOM 1730 CD1 LEU A 113 -0.662 -4.710 3.891 1.00 0.00 C ATOM 1731 CD2 LEU A 113 1.707 -3.922 3.724 1.00 0.00 C ATOM 0 H LEU A 113 1.330 -8.593 2.618 1.00 0.00 H new ATOM 0 HA LEU A 113 2.850 -6.318 3.666 1.00 0.00 H new ATOM 0 HB2 LEU A 113 1.547 -5.991 1.645 1.00 0.00 H new ATOM 0 HB3 LEU A 113 0.112 -6.656 2.400 1.00 0.00 H new ATOM 0 HG LEU A 113 0.331 -4.095 2.106 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.951 -3.699 4.178 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -1.478 -5.179 3.341 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -0.445 -5.293 4.786 1.00 0.00 H new ATOM 0 HD21 LEU A 113 1.372 -2.925 4.011 1.00 0.00 H new ATOM 0 HD22 LEU A 113 1.994 -4.479 4.616 1.00 0.00 H new ATOM 0 HD23 LEU A 113 2.565 -3.839 3.057 1.00 0.00 H new ATOM 1743 N LEU A 114 2.044 -6.629 6.004 1.00 0.00 N ATOM 1744 CA LEU A 114 1.550 -6.615 7.379 1.00 0.00 C ATOM 1745 C LEU A 114 0.947 -7.965 7.757 1.00 0.00 C ATOM 1746 O LEU A 114 1.574 -8.760 8.458 1.00 0.00 O ATOM 1747 CB LEU A 114 0.512 -5.505 7.561 1.00 0.00 C ATOM 1748 CG LEU A 114 1.072 -4.084 7.510 1.00 0.00 C ATOM 1749 CD1 LEU A 114 -0.056 -3.067 7.435 1.00 0.00 C ATOM 1750 CD2 LEU A 114 1.954 -3.817 8.721 1.00 0.00 C ATOM 0 H LEU A 114 3.049 -6.476 5.917 1.00 0.00 H new ATOM 0 HA LEU A 114 2.395 -6.421 8.039 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -0.248 -5.608 6.787 1.00 0.00 H new ATOM 0 HB3 LEU A 114 0.012 -5.649 8.519 1.00 0.00 H new ATOM 0 HG LEU A 114 1.681 -3.985 6.611 1.00 0.00 H new ATOM 0 HD11 LEU A 114 0.363 -2.061 7.399 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -0.648 -3.246 6.537 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -0.693 -3.164 8.314 1.00 0.00 H new ATOM 0 HD21 LEU A 114 2.345 -2.801 8.669 1.00 0.00 H new ATOM 0 HD22 LEU A 114 1.367 -3.934 9.632 1.00 0.00 H new ATOM 0 HD23 LEU A 114 2.783 -4.525 8.730 1.00 0.00 H new ATOM 1762 N ASN A 115 -0.271 -8.219 7.291 1.00 0.00 N ATOM 1763 CA ASN A 115 -0.955 -9.474 7.581 1.00 0.00 C ATOM 1764 C ASN A 115 -1.683 -9.997 6.347 1.00 0.00 C ATOM 1765 O ASN A 115 -2.790 -10.527 6.445 1.00 0.00 O ATOM 1766 CB ASN A 115 -1.945 -9.284 8.732 1.00 0.00 C ATOM 1767 CG ASN A 115 -1.257 -9.207 10.081 1.00 0.00 C ATOM 1768 OD1 ASN A 115 -0.976 -10.229 10.707 1.00 0.00 O ATOM 1769 ND2 ASN A 115 -0.980 -7.991 10.534 1.00 0.00 N ATOM 0 H ASN A 115 -0.805 -7.572 6.711 1.00 0.00 H new ATOM 0 HA ASN A 115 -0.205 -10.209 7.874 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -2.518 -8.372 8.567 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -2.655 -10.111 8.736 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -0.516 -7.876 11.435 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -1.231 -7.171 9.981 1.00 0.00 H new ATOM 1776 N PHE A 116 -1.056 -9.845 5.185 1.00 0.00 N ATOM 1777 CA PHE A 116 -1.646 -10.304 3.932 1.00 0.00 C ATOM 1778 C PHE A 116 -0.565 -10.702 2.932 1.00 0.00 C ATOM 1779 O PHE A 116 0.267 -9.883 2.542 1.00 0.00 O ATOM 1780 CB PHE A 116 -2.533 -9.210 3.333 1.00 0.00 C ATOM 1781 CG PHE A 116 -3.887 -9.118 3.975 1.00 0.00 C ATOM 1782 CD1 PHE A 116 -4.921 -9.945 3.566 1.00 0.00 C ATOM 1783 CD2 PHE A 116 -4.127 -8.204 4.989 1.00 0.00 C ATOM 1784 CE1 PHE A 116 -6.168 -9.863 4.155 1.00 0.00 C ATOM 1785 CE2 PHE A 116 -5.372 -8.117 5.582 1.00 0.00 C ATOM 1786 CZ PHE A 116 -6.394 -8.947 5.164 1.00 0.00 C ATOM 0 H PHE A 116 -0.140 -9.408 5.085 1.00 0.00 H new ATOM 0 HA PHE A 116 -2.255 -11.182 4.147 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -2.027 -8.249 3.431 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -2.657 -9.398 2.267 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -4.750 -10.662 2.777 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -3.332 -7.552 5.319 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -6.965 -10.514 3.827 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -5.546 -7.401 6.371 1.00 0.00 H new ATOM 0 HZ PHE A 116 -7.368 -8.880 5.625 1.00 0.00 H new ATOM 1796 N THR A 117 -0.579 -11.967 2.523 1.00 0.00 N ATOM 1797 CA THR A 117 0.403 -12.475 1.570 1.00 0.00 C ATOM 1798 C THR A 117 0.031 -12.092 0.141 1.00 0.00 C ATOM 1799 O THR A 117 -1.026 -12.476 -0.361 1.00 0.00 O ATOM 1800 CB THR A 117 0.519 -13.995 1.689 1.00 0.00 C ATOM 1801 OG1 THR A 117 -0.732 -14.615 1.451 1.00 0.00 O ATOM 1802 CG2 THR A 117 1.009 -14.453 3.047 1.00 0.00 C ATOM 0 H THR A 117 -1.259 -12.659 2.836 1.00 0.00 H new ATOM 0 HA THR A 117 1.366 -12.023 1.806 1.00 0.00 H new ATOM 0 HB THR A 117 1.253 -14.288 0.938 1.00 0.00 H new ATOM 0 HG1 THR A 117 -0.636 -15.587 1.530 1.00 0.00 H new ATOM 0 HG21 THR A 117 1.069 -15.541 3.064 1.00 0.00 H new ATOM 0 HG22 THR A 117 1.996 -14.032 3.238 1.00 0.00 H new ATOM 0 HG23 THR A 117 0.315 -14.115 3.817 1.00 0.00 H new ATOM 1810 N LEU A 118 0.909 -11.337 -0.514 1.00 0.00 N ATOM 1811 CA LEU A 118 0.674 -10.907 -1.889 1.00 0.00 C ATOM 1812 C LEU A 118 1.935 -11.077 -2.733 1.00 0.00 C ATOM 1813 O LEU A 118 3.041 -11.171 -2.202 1.00 0.00 O ATOM 1814 CB LEU A 118 0.206 -9.450 -1.924 1.00 0.00 C ATOM 1815 CG LEU A 118 1.135 -8.447 -1.239 1.00 0.00 C ATOM 1816 CD1 LEU A 118 2.153 -7.905 -2.226 1.00 0.00 C ATOM 1817 CD2 LEU A 118 0.330 -7.313 -0.622 1.00 0.00 C ATOM 0 H LEU A 118 1.789 -11.011 -0.115 1.00 0.00 H new ATOM 0 HA LEU A 118 -0.110 -11.536 -2.311 1.00 0.00 H new ATOM 0 HB2 LEU A 118 0.080 -9.151 -2.965 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -0.776 -9.390 -1.454 1.00 0.00 H new ATOM 0 HG LEU A 118 1.672 -8.961 -0.442 1.00 0.00 H new ATOM 0 HD11 LEU A 118 2.806 -7.193 -1.721 1.00 0.00 H new ATOM 0 HD12 LEU A 118 2.750 -8.727 -2.621 1.00 0.00 H new ATOM 0 HD13 LEU A 118 1.636 -7.406 -3.045 1.00 0.00 H new ATOM 0 HD21 LEU A 118 1.006 -6.608 -0.138 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -0.232 -6.800 -1.402 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -0.361 -7.718 0.117 1.00 0.00 H new ATOM 1829 N ASP A 119 1.756 -11.118 -4.050 1.00 0.00 N ATOM 1830 CA ASP A 119 2.878 -11.283 -4.970 1.00 0.00 C ATOM 1831 C ASP A 119 3.673 -9.988 -5.108 1.00 0.00 C ATOM 1832 O ASP A 119 3.107 -8.895 -5.089 1.00 0.00 O ATOM 1833 CB ASP A 119 2.374 -11.732 -6.343 1.00 0.00 C ATOM 1834 CG ASP A 119 3.300 -12.737 -6.998 1.00 0.00 C ATOM 1835 OD1 ASP A 119 3.332 -13.900 -6.543 1.00 0.00 O ATOM 1836 OD2 ASP A 119 3.994 -12.362 -7.967 1.00 0.00 O ATOM 0 H ASP A 119 0.846 -11.039 -4.504 1.00 0.00 H new ATOM 0 HA ASP A 119 3.538 -12.048 -4.560 1.00 0.00 H new ATOM 0 HB2 ASP A 119 1.382 -12.171 -6.237 1.00 0.00 H new ATOM 0 HB3 ASP A 119 2.270 -10.862 -6.991 1.00 0.00 H new ATOM 1841 N ARG A 120 4.989 -10.121 -5.250 1.00 0.00 N ATOM 1842 CA ARG A 120 5.864 -8.963 -5.396 1.00 0.00 C ATOM 1843 C ARG A 120 6.010 -8.575 -6.863 1.00 0.00 C ATOM 1844 O ARG A 120 5.993 -7.393 -7.209 1.00 0.00 O ATOM 1845 CB ARG A 120 7.241 -9.257 -4.798 1.00 0.00 C ATOM 1846 CG ARG A 120 8.181 -8.061 -4.821 1.00 0.00 C ATOM 1847 CD ARG A 120 9.542 -8.429 -5.390 1.00 0.00 C ATOM 1848 NE ARG A 120 10.529 -7.375 -5.173 1.00 0.00 N ATOM 1849 CZ ARG A 120 11.773 -7.415 -5.646 1.00 0.00 C ATOM 1850 NH1 ARG A 120 12.186 -8.453 -6.363 1.00 0.00 N ATOM 1851 NH2 ARG A 120 12.608 -6.413 -5.403 1.00 0.00 N ATOM 0 H ARG A 120 5.472 -11.019 -5.267 1.00 0.00 H new ATOM 0 HA ARG A 120 5.412 -8.129 -4.859 1.00 0.00 H new ATOM 0 HB2 ARG A 120 7.117 -9.592 -3.768 1.00 0.00 H new ATOM 0 HB3 ARG A 120 7.699 -10.079 -5.348 1.00 0.00 H new ATOM 0 HG2 ARG A 120 7.740 -7.263 -5.418 1.00 0.00 H new ATOM 0 HG3 ARG A 120 8.302 -7.673 -3.810 1.00 0.00 H new ATOM 0 HD2 ARG A 120 9.890 -9.353 -4.928 1.00 0.00 H new ATOM 0 HD3 ARG A 120 9.448 -8.623 -6.458 1.00 0.00 H new ATOM 0 HE ARG A 120 10.249 -6.560 -4.627 1.00 0.00 H new ATOM 0 HH11 ARG A 120 11.549 -9.226 -6.555 1.00 0.00 H new ATOM 0 HH12 ARG A 120 13.140 -8.477 -6.722 1.00 0.00 H new ATOM 0 HH21 ARG A 120 12.297 -5.612 -4.854 1.00 0.00 H new ATOM 0 HH22 ARG A 120 13.561 -6.444 -5.765 1.00 0.00 H new ATOM 1865 N LYS A 121 6.157 -9.578 -7.722 1.00 0.00 N ATOM 1866 CA LYS A 121 6.309 -9.347 -9.153 1.00 0.00 C ATOM 1867 C LYS A 121 5.066 -8.680 -9.734 1.00 0.00 C ATOM 1868 O LYS A 121 5.153 -7.896 -10.679 1.00 0.00 O ATOM 1869 CB LYS A 121 6.578 -10.668 -9.879 1.00 0.00 C ATOM 1870 CG LYS A 121 7.746 -11.453 -9.304 1.00 0.00 C ATOM 1871 CD LYS A 121 9.074 -10.764 -9.581 1.00 0.00 C ATOM 1872 CE LYS A 121 9.898 -11.532 -10.601 1.00 0.00 C ATOM 1873 NZ LYS A 121 9.770 -10.956 -11.968 1.00 0.00 N ATOM 0 H LYS A 121 6.174 -10.561 -7.451 1.00 0.00 H new ATOM 0 HA LYS A 121 7.158 -8.680 -9.298 1.00 0.00 H new ATOM 0 HB2 LYS A 121 5.681 -11.285 -9.837 1.00 0.00 H new ATOM 0 HB3 LYS A 121 6.773 -10.461 -10.931 1.00 0.00 H new ATOM 0 HG2 LYS A 121 7.613 -11.569 -8.228 1.00 0.00 H new ATOM 0 HG3 LYS A 121 7.759 -12.455 -9.733 1.00 0.00 H new ATOM 0 HD2 LYS A 121 8.891 -9.753 -9.946 1.00 0.00 H new ATOM 0 HD3 LYS A 121 9.637 -10.671 -8.653 1.00 0.00 H new ATOM 0 HE2 LYS A 121 10.946 -11.524 -10.301 1.00 0.00 H new ATOM 0 HE3 LYS A 121 9.578 -12.574 -10.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 10.347 -11.509 -12.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 8.774 -10.987 -12.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 10.099 -9.969 -11.961 1.00 0.00 H new ATOM 1887 N SER A 122 3.908 -8.997 -9.162 1.00 0.00 N ATOM 1888 CA SER A 122 2.646 -8.430 -9.623 1.00 0.00 C ATOM 1889 C SER A 122 2.538 -6.954 -9.249 1.00 0.00 C ATOM 1890 O SER A 122 1.845 -6.185 -9.914 1.00 0.00 O ATOM 1891 CB SER A 122 1.469 -9.206 -9.031 1.00 0.00 C ATOM 1892 OG SER A 122 1.331 -8.948 -7.645 1.00 0.00 O ATOM 0 H SER A 122 3.818 -9.644 -8.378 1.00 0.00 H new ATOM 0 HA SER A 122 2.617 -8.511 -10.710 1.00 0.00 H new ATOM 0 HB2 SER A 122 0.550 -8.929 -9.548 1.00 0.00 H new ATOM 0 HB3 SER A 122 1.616 -10.274 -9.192 1.00 0.00 H new ATOM 0 HG SER A 122 0.845 -8.107 -7.516 1.00 0.00 H new ATOM 1898 N VAL A 123 3.224 -6.566 -8.179 1.00 0.00 N ATOM 1899 CA VAL A 123 3.201 -5.182 -7.717 1.00 0.00 C ATOM 1900 C VAL A 123 3.706 -4.234 -8.799 1.00 0.00 C ATOM 1901 O VAL A 123 4.533 -4.608 -9.630 1.00 0.00 O ATOM 1902 CB VAL A 123 4.055 -4.996 -6.450 1.00 0.00 C ATOM 1903 CG1 VAL A 123 3.841 -3.610 -5.860 1.00 0.00 C ATOM 1904 CG2 VAL A 123 3.735 -6.074 -5.426 1.00 0.00 C ATOM 0 H VAL A 123 3.802 -7.189 -7.616 1.00 0.00 H new ATOM 0 HA VAL A 123 2.163 -4.945 -7.483 1.00 0.00 H new ATOM 0 HB VAL A 123 5.105 -5.090 -6.726 1.00 0.00 H new ATOM 0 HG11 VAL A 123 4.453 -3.497 -4.965 1.00 0.00 H new ATOM 0 HG12 VAL A 123 4.126 -2.855 -6.592 1.00 0.00 H new ATOM 0 HG13 VAL A 123 2.790 -3.484 -5.599 1.00 0.00 H new ATOM 0 HG21 VAL A 123 4.349 -5.926 -4.538 1.00 0.00 H new ATOM 0 HG22 VAL A 123 2.681 -6.015 -5.153 1.00 0.00 H new ATOM 0 HG23 VAL A 123 3.945 -7.055 -5.852 1.00 0.00 H new ATOM 1914 N PHE A 124 3.203 -3.004 -8.782 1.00 0.00 N ATOM 1915 CA PHE A 124 3.604 -2.001 -9.761 1.00 0.00 C ATOM 1916 C PHE A 124 2.991 -0.645 -9.429 1.00 0.00 C ATOM 1917 O PHE A 124 1.844 -0.563 -8.990 1.00 0.00 O ATOM 1918 CB PHE A 124 3.185 -2.434 -11.168 1.00 0.00 C ATOM 1919 CG PHE A 124 3.758 -1.572 -12.257 1.00 0.00 C ATOM 1920 CD1 PHE A 124 3.320 -0.269 -12.430 1.00 0.00 C ATOM 1921 CD2 PHE A 124 4.736 -2.065 -13.106 1.00 0.00 C ATOM 1922 CE1 PHE A 124 3.845 0.527 -13.431 1.00 0.00 C ATOM 1923 CE2 PHE A 124 5.265 -1.274 -14.109 1.00 0.00 C ATOM 1924 CZ PHE A 124 4.819 0.023 -14.271 1.00 0.00 C ATOM 0 H PHE A 124 2.517 -2.678 -8.101 1.00 0.00 H new ATOM 0 HA PHE A 124 4.689 -1.908 -9.727 1.00 0.00 H new ATOM 0 HB2 PHE A 124 3.498 -3.466 -11.330 1.00 0.00 H new ATOM 0 HB3 PHE A 124 2.097 -2.416 -11.236 1.00 0.00 H new ATOM 0 HD1 PHE A 124 2.559 0.130 -11.775 1.00 0.00 H new ATOM 0 HD2 PHE A 124 5.089 -3.078 -12.983 1.00 0.00 H new ATOM 0 HE1 PHE A 124 3.494 1.541 -13.556 1.00 0.00 H new ATOM 0 HE2 PHE A 124 6.026 -1.670 -14.765 1.00 0.00 H new ATOM 0 HZ PHE A 124 5.231 0.643 -15.054 1.00 0.00 H new ATOM 1934 N VAL A 125 3.761 0.417 -9.640 1.00 0.00 N ATOM 1935 CA VAL A 125 3.286 1.766 -9.361 1.00 0.00 C ATOM 1936 C VAL A 125 3.714 2.740 -10.455 1.00 0.00 C ATOM 1937 O VAL A 125 4.903 2.891 -10.736 1.00 0.00 O ATOM 1938 CB VAL A 125 3.801 2.273 -7.999 1.00 0.00 C ATOM 1939 CG1 VAL A 125 5.317 2.394 -8.006 1.00 0.00 C ATOM 1940 CG2 VAL A 125 3.152 3.604 -7.643 1.00 0.00 C ATOM 0 H VAL A 125 4.713 0.370 -10.002 1.00 0.00 H new ATOM 0 HA VAL A 125 2.197 1.718 -9.332 1.00 0.00 H new ATOM 0 HB VAL A 125 3.525 1.545 -7.236 1.00 0.00 H new ATOM 0 HG11 VAL A 125 5.658 2.753 -7.035 1.00 0.00 H new ATOM 0 HG12 VAL A 125 5.759 1.418 -8.207 1.00 0.00 H new ATOM 0 HG13 VAL A 125 5.622 3.097 -8.781 1.00 0.00 H new ATOM 0 HG21 VAL A 125 3.528 3.946 -6.679 1.00 0.00 H new ATOM 0 HG22 VAL A 125 3.392 4.342 -8.408 1.00 0.00 H new ATOM 0 HG23 VAL A 125 2.071 3.478 -7.587 1.00 0.00 H new ATOM 1950 N ASP A 126 2.736 3.398 -11.068 1.00 0.00 N ATOM 1951 CA ASP A 126 3.008 4.359 -12.131 1.00 0.00 C ATOM 1952 C ASP A 126 2.735 5.783 -11.661 1.00 0.00 C ATOM 1953 O ASP A 126 2.049 5.996 -10.660 1.00 0.00 O ATOM 1954 CB ASP A 126 2.158 4.044 -13.363 1.00 0.00 C ATOM 1955 CG ASP A 126 2.799 4.526 -14.649 1.00 0.00 C ATOM 1956 OD1 ASP A 126 3.036 5.746 -14.775 1.00 0.00 O ATOM 1957 OD2 ASP A 126 3.067 3.682 -15.531 1.00 0.00 O ATOM 0 H ASP A 126 1.747 3.283 -10.847 1.00 0.00 H new ATOM 0 HA ASP A 126 4.062 4.280 -12.396 1.00 0.00 H new ATOM 0 HB2 ASP A 126 1.996 2.968 -13.423 1.00 0.00 H new ATOM 0 HB3 ASP A 126 1.178 4.509 -13.253 1.00 0.00 H new ATOM 1962 N SER A 127 3.272 6.756 -12.388 1.00 0.00 N ATOM 1963 CA SER A 127 3.084 8.160 -12.044 1.00 0.00 C ATOM 1964 C SER A 127 1.765 8.684 -12.602 1.00 0.00 C ATOM 1965 O SER A 127 1.566 8.730 -13.815 1.00 0.00 O ATOM 1966 CB SER A 127 4.248 8.997 -12.580 1.00 0.00 C ATOM 1967 OG SER A 127 4.126 10.353 -12.183 1.00 0.00 O ATOM 0 H SER A 127 3.841 6.598 -13.220 1.00 0.00 H new ATOM 0 HA SER A 127 3.056 8.243 -10.958 1.00 0.00 H new ATOM 0 HB2 SER A 127 5.191 8.591 -12.214 1.00 0.00 H new ATOM 0 HB3 SER A 127 4.275 8.934 -13.668 1.00 0.00 H new ATOM 0 HG SER A 127 4.882 10.867 -12.536 1.00 0.00 H new ATOM 1973 N GLY A 128 0.865 9.079 -11.706 1.00 0.00 N ATOM 1974 CA GLY A 128 -0.424 9.596 -12.128 1.00 0.00 C ATOM 1975 C GLY A 128 -0.299 10.862 -12.956 1.00 0.00 C ATOM 1976 O GLY A 128 -0.677 10.879 -14.127 1.00 0.00 O ATOM 0 H GLY A 128 1.006 9.050 -10.696 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -0.944 8.835 -12.710 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -1.036 9.799 -11.249 1.00 0.00 H new ATOM 1980 N PRO A 129 0.233 11.946 -12.368 1.00 0.00 N ATOM 1981 CA PRO A 129 0.403 13.224 -13.069 1.00 0.00 C ATOM 1982 C PRO A 129 1.453 13.142 -14.173 1.00 0.00 C ATOM 1983 O PRO A 129 2.654 13.141 -13.903 1.00 0.00 O ATOM 1984 CB PRO A 129 0.862 14.180 -11.965 1.00 0.00 C ATOM 1985 CG PRO A 129 1.483 13.300 -10.935 1.00 0.00 C ATOM 1986 CD PRO A 129 0.710 12.012 -10.975 1.00 0.00 C ATOM 0 HA PRO A 129 -0.513 13.539 -13.568 1.00 0.00 H new ATOM 0 HB2 PRO A 129 1.577 14.910 -12.345 1.00 0.00 H new ATOM 0 HB3 PRO A 129 0.023 14.741 -11.553 1.00 0.00 H new ATOM 0 HG2 PRO A 129 2.538 13.130 -11.151 1.00 0.00 H new ATOM 0 HG3 PRO A 129 1.430 13.757 -9.947 1.00 0.00 H new ATOM 0 HD2 PRO A 129 1.339 11.158 -10.724 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -0.118 12.018 -10.266 1.00 0.00 H new ATOM 1994 N SER A 130 0.992 13.074 -15.417 1.00 0.00 N ATOM 1995 CA SER A 130 1.891 12.994 -16.563 1.00 0.00 C ATOM 1996 C SER A 130 1.119 13.131 -17.871 1.00 0.00 C ATOM 1997 O SER A 130 0.778 12.135 -18.510 1.00 0.00 O ATOM 1998 CB SER A 130 2.656 11.670 -16.546 1.00 0.00 C ATOM 1999 OG SER A 130 1.793 10.584 -16.258 1.00 0.00 O ATOM 0 H SER A 130 0.001 13.073 -15.658 1.00 0.00 H new ATOM 0 HA SER A 130 2.602 13.818 -16.493 1.00 0.00 H new ATOM 0 HB2 SER A 130 3.135 11.511 -17.512 1.00 0.00 H new ATOM 0 HB3 SER A 130 3.450 11.715 -15.800 1.00 0.00 H new ATOM 0 HG SER A 130 2.030 10.200 -15.388 1.00 0.00 H new ATOM 2005 N SER A 131 0.847 14.371 -18.263 1.00 0.00 N ATOM 2006 CA SER A 131 0.116 14.640 -19.495 1.00 0.00 C ATOM 2007 C SER A 131 0.543 15.972 -20.101 1.00 0.00 C ATOM 2008 O SER A 131 0.154 17.037 -19.621 1.00 0.00 O ATOM 2009 CB SER A 131 -1.390 14.649 -19.226 1.00 0.00 C ATOM 2010 OG SER A 131 -1.765 15.778 -18.458 1.00 0.00 O ATOM 0 H SER A 131 1.122 15.206 -17.745 1.00 0.00 H new ATOM 0 HA SER A 131 0.347 13.847 -20.206 1.00 0.00 H new ATOM 0 HB2 SER A 131 -1.931 14.653 -20.172 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.674 13.737 -18.700 1.00 0.00 H new ATOM 0 HG SER A 131 -1.296 16.571 -18.792 1.00 0.00 H new ATOM 2016 N GLY A 132 1.347 15.906 -21.158 1.00 0.00 N ATOM 2017 CA GLY A 132 1.815 17.114 -21.811 1.00 0.00 C ATOM 2018 C GLY A 132 0.843 17.621 -22.858 1.00 0.00 C ATOM 0 H GLY A 132 1.682 15.037 -21.574 1.00 0.00 H new ATOM 0 HA2 GLY A 132 1.975 17.890 -21.062 1.00 0.00 H new ATOM 0 HA3 GLY A 132 2.780 16.920 -22.279 1.00 0.00 H new TER 2022 GLY A 132