USER MOD reduce.3.24.130724 H: found=0, std=0, add=1030, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 861 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 84 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 111 SER OG : rot 16:sc= 1.65 USER MOD Set 1.3: A 123 TYR OH : rot 165:sc= 0.445 USER MOD Set 2.1: A 34 LYS NZ :NH3+ 174:sc= 0.878 (180deg=0) USER MOD Set 2.2: A 77 TYR OH : rot 0:sc= 0.765 USER MOD Set 3.1: A 25 ASN : amide:sc= 0.468 X(o=0.9,f=0.9) USER MOD Set 3.2: A 31 SER OG : rot -70:sc= 0.435 USER MOD Single : A 4 LYS NZ :NH3+ -107:sc= 0.348 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 160:sc= 0.708 (180deg=-0.0358!) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 158:sc= 0.708 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl 161:sc= -0.268 (180deg=-1.34) USER MOD Single : A 23 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.00937) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -1.75! C(o=-1.7!,f=-2.2!) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -0.337 X(o=-0.34,f=-0.098) USER MOD Single : A 71 ASN :FLIP amide:sc= -0.0964 F(o=-1,f=-0.096) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= -0.321 K(o=-0.32,f=-1.2) USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 88 SER OG : rot 120:sc= -0.0048 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 50:sc= -0.305 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 100:sc= 0.0182 USER MOD Single : A 101 GLN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 102 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 52:sc= 0.607 USER MOD Single : A 115 SER OG : rot 90:sc= -0.412 USER MOD Single : A 118 THR OG1 : rot -159:sc= 0.138 USER MOD Single : A 119 ASN : amide:sc= -1.46 K(o=-1.5,f=-4.9!) USER MOD Single : A 120 HIS :FLIP no HD1:sc= -0.0763 F(o=-1.1,f=-0.076) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 HIS : no HE2:sc= -1.43 K(o=-1.4,f=-3.4!) USER MOD Single : A 128 ASN : amide:sc= 0.788 K(o=0.79,f=0) USER MOD Single : A 135 ASN :FLIP amide:sc= -0.011 F(o=-1.2,f=-0.011) USER MOD Single : A 144 SER OG : rot -30:sc= 0.0178 USER MOD Single : A 148 LYS NZ :NH3+ 161:sc= 1.3 (180deg=0.397) USER MOD Single : A 150 SER OG : rot -23:sc= -0.0291 USER MOD Single : A 151 LYS NZ :NH3+ -160:sc= -0.0939 (180deg=-0.432) USER MOD ----------------------------------------------------------------- ATOM 23 N ALA A 3 -1.456 -20.030 -10.651 1.00 10.43 N ATOM 24 CA ALA A 3 -0.575 -18.920 -10.960 1.00 30.01 C ATOM 25 C ALA A 3 -0.527 -18.089 -9.681 1.00 43.23 C ATOM 26 O ALA A 3 -1.579 -17.673 -9.191 1.00 51.54 O ATOM 27 CB ALA A 3 -1.139 -18.070 -12.109 1.00 1.11 C ATOM 0 HA ALA A 3 0.409 -19.267 -11.276 1.00 30.01 H new ATOM 0 HB1 ALA A 3 -0.458 -17.245 -12.319 1.00 1.11 H new ATOM 0 HB2 ALA A 3 -1.246 -18.688 -13.000 1.00 1.11 H new ATOM 0 HB3 ALA A 3 -2.113 -17.673 -11.824 1.00 1.11 H new ATOM 33 N LYS A 4 0.666 -17.842 -9.135 1.00 24.24 N ATOM 34 CA LYS A 4 0.866 -16.844 -8.083 1.00 42.24 C ATOM 35 C LYS A 4 1.769 -15.722 -8.598 1.00 14.41 C ATOM 36 O LYS A 4 2.996 -15.781 -8.462 1.00 42.23 O ATOM 37 CB LYS A 4 1.272 -17.491 -6.746 1.00 23.44 C ATOM 38 CG LYS A 4 2.660 -18.167 -6.682 1.00 24.32 C ATOM 39 CD LYS A 4 3.528 -17.462 -5.624 1.00 45.15 C ATOM 40 CE LYS A 4 4.988 -17.943 -5.519 1.00 3.14 C ATOM 41 NZ LYS A 4 5.333 -18.559 -4.214 1.00 1.51 N ATOM 0 H LYS A 4 1.520 -18.328 -9.410 1.00 24.24 H new ATOM 0 HA LYS A 4 -0.079 -16.359 -7.837 1.00 42.24 H new ATOM 0 HB2 LYS A 4 1.234 -16.723 -5.974 1.00 23.44 H new ATOM 0 HB3 LYS A 4 0.520 -18.238 -6.490 1.00 23.44 H new ATOM 0 HG2 LYS A 4 2.551 -19.223 -6.433 1.00 24.32 H new ATOM 0 HG3 LYS A 4 3.145 -18.118 -7.657 1.00 24.32 H new ATOM 0 HD2 LYS A 4 3.533 -16.394 -5.840 1.00 45.15 H new ATOM 0 HD3 LYS A 4 3.054 -17.588 -4.651 1.00 45.15 H new ATOM 0 HE2 LYS A 4 5.178 -18.667 -6.311 1.00 3.14 H new ATOM 0 HE3 LYS A 4 5.651 -17.096 -5.695 1.00 3.14 H new ATOM 0 HZ1 LYS A 4 5.935 -17.907 -3.671 1.00 1.51 H new ATOM 0 HZ2 LYS A 4 4.462 -18.752 -3.680 1.00 1.51 H new ATOM 0 HZ3 LYS A 4 5.845 -19.450 -4.375 1.00 1.51 H new ATOM 51 N LYS A 5 1.187 -14.734 -9.287 1.00 50.12 N ATOM 52 CA LYS A 5 1.941 -13.528 -9.641 1.00 3.44 C ATOM 53 C LYS A 5 2.082 -12.647 -8.414 1.00 72.42 C ATOM 54 O LYS A 5 1.372 -12.827 -7.422 1.00 73.33 O ATOM 55 CB LYS A 5 1.264 -12.664 -10.715 1.00 72.02 C ATOM 56 CG LYS A 5 0.628 -13.395 -11.889 1.00 31.11 C ATOM 57 CD LYS A 5 1.145 -12.930 -13.247 1.00 3.23 C ATOM 58 CE LYS A 5 2.644 -13.227 -13.329 1.00 74.43 C ATOM 59 NZ LYS A 5 3.027 -13.708 -14.659 1.00 11.24 N ATOM 0 H LYS A 5 0.218 -14.744 -9.604 1.00 50.12 H new ATOM 0 HA LYS A 5 2.896 -13.883 -10.029 1.00 3.44 H new ATOM 0 HB2 LYS A 5 0.493 -12.064 -10.231 1.00 72.02 H new ATOM 0 HB3 LYS A 5 2.006 -11.970 -11.110 1.00 72.02 H new ATOM 0 HG2 LYS A 5 0.814 -14.464 -11.785 1.00 31.11 H new ATOM 0 HG3 LYS A 5 -0.452 -13.254 -11.853 1.00 31.11 H new ATOM 0 HD2 LYS A 5 0.614 -13.442 -14.049 1.00 3.23 H new ATOM 0 HD3 LYS A 5 0.964 -11.863 -13.375 1.00 3.23 H new ATOM 0 HE2 LYS A 5 3.208 -12.325 -13.092 1.00 74.43 H new ATOM 0 HE3 LYS A 5 2.909 -13.974 -12.581 1.00 74.43 H new ATOM 0 HZ1 LYS A 5 4.050 -13.579 -14.794 1.00 11.24 H new ATOM 0 HZ2 LYS A 5 2.791 -14.717 -14.744 1.00 11.24 H new ATOM 0 HZ3 LYS A 5 2.512 -13.170 -15.385 1.00 11.24 H new ATOM 69 N THR A 6 2.879 -11.604 -8.590 1.00 24.23 N ATOM 70 CA THR A 6 3.098 -10.567 -7.600 1.00 31.33 C ATOM 71 C THR A 6 3.125 -9.224 -8.316 1.00 53.12 C ATOM 72 O THR A 6 3.579 -9.151 -9.459 1.00 11.31 O ATOM 73 CB THR A 6 4.397 -10.882 -6.839 1.00 64.12 C ATOM 74 OG1 THR A 6 4.161 -12.067 -6.116 1.00 30.21 O ATOM 75 CG2 THR A 6 4.807 -9.757 -5.886 1.00 23.41 C ATOM 0 H THR A 6 3.405 -11.454 -9.451 1.00 24.23 H new ATOM 0 HA THR A 6 2.299 -10.525 -6.860 1.00 31.33 H new ATOM 0 HB THR A 6 5.219 -10.991 -7.547 1.00 64.12 H new ATOM 0 HG1 THR A 6 4.967 -12.310 -5.613 1.00 30.21 H new ATOM 0 HG21 THR A 6 5.730 -10.031 -5.375 1.00 23.41 H new ATOM 0 HG22 THR A 6 4.965 -8.840 -6.453 1.00 23.41 H new ATOM 0 HG23 THR A 6 4.018 -9.598 -5.151 1.00 23.41 H new ATOM 83 N LEU A 7 2.692 -8.155 -7.648 1.00 72.01 N ATOM 84 CA LEU A 7 2.774 -6.798 -8.167 1.00 12.12 C ATOM 85 C LEU A 7 3.427 -5.890 -7.151 1.00 24.31 C ATOM 86 O LEU A 7 3.283 -6.118 -5.950 1.00 70.31 O ATOM 87 CB LEU A 7 1.365 -6.261 -8.495 1.00 41.24 C ATOM 88 CG LEU A 7 1.104 -5.893 -9.966 1.00 52.42 C ATOM 89 CD1 LEU A 7 -0.073 -4.930 -10.000 1.00 3.13 C ATOM 90 CD2 LEU A 7 2.263 -5.217 -10.695 1.00 62.05 C ATOM 0 H LEU A 7 2.270 -8.212 -6.721 1.00 72.01 H new ATOM 0 HA LEU A 7 3.373 -6.816 -9.077 1.00 12.12 H new ATOM 0 HB2 LEU A 7 0.634 -7.011 -8.195 1.00 41.24 H new ATOM 0 HB3 LEU A 7 1.184 -5.377 -7.883 1.00 41.24 H new ATOM 0 HG LEU A 7 0.929 -6.838 -10.481 1.00 52.42 H new ATOM 0 HD11 LEU A 7 -0.284 -4.649 -11.032 1.00 3.13 H new ATOM 0 HD12 LEU A 7 -0.950 -5.412 -9.569 1.00 3.13 H new ATOM 0 HD13 LEU A 7 0.170 -4.037 -9.424 1.00 3.13 H new ATOM 0 HD21 LEU A 7 1.971 -5.002 -11.723 1.00 62.05 H new ATOM 0 HD22 LEU A 7 2.518 -4.286 -10.188 1.00 62.05 H new ATOM 0 HD23 LEU A 7 3.129 -5.879 -10.695 1.00 62.05 H new ATOM 101 N ILE A 8 4.075 -4.830 -7.630 1.00 25.12 N ATOM 102 CA ILE A 8 4.598 -3.768 -6.793 1.00 14.14 C ATOM 103 C ILE A 8 4.233 -2.419 -7.430 1.00 13.40 C ATOM 104 O ILE A 8 4.500 -2.206 -8.618 1.00 65.32 O ATOM 105 CB ILE A 8 6.128 -3.913 -6.603 1.00 13.40 C ATOM 106 CG1 ILE A 8 6.656 -5.326 -6.194 1.00 32.04 C ATOM 107 CG2 ILE A 8 6.508 -2.823 -5.587 1.00 22.43 C ATOM 108 CD1 ILE A 8 7.377 -6.160 -7.291 1.00 50.24 C ATOM 0 H ILE A 8 4.251 -4.689 -8.625 1.00 25.12 H new ATOM 0 HA ILE A 8 4.153 -3.828 -5.800 1.00 14.14 H new ATOM 0 HB ILE A 8 6.615 -3.790 -7.570 1.00 13.40 H new ATOM 0 HG12 ILE A 8 7.344 -5.201 -5.358 1.00 32.04 H new ATOM 0 HG13 ILE A 8 5.811 -5.909 -5.827 1.00 32.04 H new ATOM 0 HG21 ILE A 8 7.581 -2.860 -5.398 1.00 22.43 H new ATOM 0 HG22 ILE A 8 6.244 -1.844 -5.987 1.00 22.43 H new ATOM 0 HG23 ILE A 8 5.969 -2.991 -4.654 1.00 22.43 H new ATOM 0 HD11 ILE A 8 7.691 -7.116 -6.873 1.00 50.24 H new ATOM 0 HD12 ILE A 8 6.695 -6.334 -8.123 1.00 50.24 H new ATOM 0 HD13 ILE A 8 8.251 -5.615 -7.647 1.00 50.24 H new ATOM 119 N LEU A 9 3.657 -1.509 -6.630 1.00 31.22 N ATOM 120 CA LEU A 9 3.300 -0.138 -6.951 1.00 51.53 C ATOM 121 C LEU A 9 4.082 0.761 -5.996 1.00 23.31 C ATOM 122 O LEU A 9 4.000 0.576 -4.773 1.00 11.53 O ATOM 123 CB LEU A 9 1.802 0.084 -6.695 1.00 70.35 C ATOM 124 CG LEU A 9 0.834 -0.376 -7.798 1.00 12.33 C ATOM 125 CD1 LEU A 9 0.816 0.674 -8.904 1.00 63.05 C ATOM 126 CD2 LEU A 9 1.133 -1.731 -8.418 1.00 21.01 C ATOM 0 H LEU A 9 3.414 -1.742 -5.667 1.00 31.22 H new ATOM 0 HA LEU A 9 3.524 0.079 -7.995 1.00 51.53 H new ATOM 0 HB2 LEU A 9 1.535 -0.431 -5.772 1.00 70.35 H new ATOM 0 HB3 LEU A 9 1.641 1.148 -6.524 1.00 70.35 H new ATOM 0 HG LEU A 9 -0.131 -0.490 -7.305 1.00 12.33 H new ATOM 0 HD11 LEU A 9 0.133 0.360 -9.693 1.00 63.05 H new ATOM 0 HD12 LEU A 9 0.483 1.628 -8.495 1.00 63.05 H new ATOM 0 HD13 LEU A 9 1.819 0.786 -9.316 1.00 63.05 H new ATOM 0 HD21 LEU A 9 0.388 -1.954 -9.182 1.00 21.01 H new ATOM 0 HD22 LEU A 9 2.124 -1.713 -8.871 1.00 21.01 H new ATOM 0 HD23 LEU A 9 1.101 -2.500 -7.646 1.00 21.01 H new ATOM 137 N TYR A 10 4.812 1.749 -6.509 1.00 2.24 N ATOM 138 CA TYR A 10 5.893 2.391 -5.753 1.00 21.21 C ATOM 139 C TYR A 10 5.685 3.909 -5.698 1.00 50.13 C ATOM 140 O TYR A 10 6.385 4.652 -6.385 1.00 50.10 O ATOM 141 CB TYR A 10 7.248 1.951 -6.359 1.00 72.22 C ATOM 142 CG TYR A 10 7.305 1.852 -7.877 1.00 21.04 C ATOM 143 CD1 TYR A 10 6.959 0.637 -8.498 1.00 43.51 C ATOM 144 CD2 TYR A 10 7.669 2.957 -8.673 1.00 33.44 C ATOM 145 CE1 TYR A 10 6.937 0.534 -9.897 1.00 52.15 C ATOM 146 CE2 TYR A 10 7.648 2.863 -10.075 1.00 70.31 C ATOM 147 CZ TYR A 10 7.265 1.651 -10.693 1.00 52.54 C ATOM 148 OH TYR A 10 7.206 1.557 -12.049 1.00 61.02 O ATOM 0 H TYR A 10 4.677 2.125 -7.447 1.00 2.24 H new ATOM 0 HA TYR A 10 5.890 2.070 -4.711 1.00 21.21 H new ATOM 0 HB2 TYR A 10 8.014 2.655 -6.033 1.00 72.22 H new ATOM 0 HB3 TYR A 10 7.510 0.979 -5.942 1.00 72.22 H new ATOM 0 HD1 TYR A 10 6.709 -0.222 -7.893 1.00 43.51 H new ATOM 0 HD2 TYR A 10 7.966 3.882 -8.202 1.00 33.44 H new ATOM 0 HE1 TYR A 10 6.669 -0.402 -10.365 1.00 52.15 H new ATOM 0 HE2 TYR A 10 7.924 3.715 -10.679 1.00 70.31 H new ATOM 0 HH TYR A 10 7.461 2.415 -12.448 1.00 61.02 H new ATOM 157 N TYR A 11 4.720 4.403 -4.904 1.00 33.05 N ATOM 158 CA TYR A 11 4.321 5.815 -4.978 1.00 65.33 C ATOM 159 C TYR A 11 5.405 6.698 -4.350 1.00 52.50 C ATOM 160 O TYR A 11 5.456 6.893 -3.136 1.00 22.33 O ATOM 161 CB TYR A 11 2.866 6.098 -4.525 1.00 72.22 C ATOM 162 CG TYR A 11 2.532 7.524 -4.088 1.00 25.05 C ATOM 163 CD1 TYR A 11 2.873 7.981 -2.805 1.00 10.51 C ATOM 164 CD2 TYR A 11 1.886 8.416 -4.971 1.00 62.04 C ATOM 165 CE1 TYR A 11 2.700 9.328 -2.439 1.00 10.43 C ATOM 166 CE2 TYR A 11 1.668 9.751 -4.589 1.00 21.22 C ATOM 167 CZ TYR A 11 2.095 10.231 -3.337 1.00 71.21 C ATOM 168 OH TYR A 11 1.906 11.540 -3.024 1.00 65.10 O ATOM 0 H TYR A 11 4.209 3.853 -4.213 1.00 33.05 H new ATOM 0 HA TYR A 11 4.265 6.098 -6.029 1.00 65.33 H new ATOM 0 HB2 TYR A 11 2.200 5.832 -5.346 1.00 72.22 H new ATOM 0 HB3 TYR A 11 2.635 5.429 -3.697 1.00 72.22 H new ATOM 0 HD1 TYR A 11 3.276 7.284 -2.085 1.00 10.51 H new ATOM 0 HD2 TYR A 11 1.559 8.072 -5.941 1.00 62.04 H new ATOM 0 HE1 TYR A 11 3.031 9.671 -1.470 1.00 10.43 H new ATOM 0 HE2 TYR A 11 1.163 10.421 -5.269 1.00 21.22 H new ATOM 0 HH TYR A 11 1.474 11.997 -3.776 1.00 65.10 H new ATOM 227 N GLU A 16 12.869 8.496 -6.733 1.00 10.31 N ATOM 228 CA GLU A 16 12.744 8.209 -5.296 1.00 73.31 C ATOM 229 C GLU A 16 12.737 6.707 -4.971 1.00 73.35 C ATOM 230 O GLU A 16 13.797 6.142 -4.698 1.00 14.30 O ATOM 231 CB GLU A 16 11.520 8.925 -4.708 1.00 74.24 C ATOM 232 CG GLU A 16 11.713 10.407 -4.384 1.00 41.04 C ATOM 233 CD GLU A 16 12.482 10.593 -3.083 1.00 62.51 C ATOM 234 OE1 GLU A 16 11.865 10.424 -2.010 1.00 44.52 O ATOM 235 OE2 GLU A 16 13.693 10.914 -3.150 1.00 71.33 O ATOM 0 HA GLU A 16 13.640 8.604 -4.818 1.00 73.31 H new ATOM 0 HB2 GLU A 16 10.693 8.830 -5.412 1.00 74.24 H new ATOM 0 HB3 GLU A 16 11.223 8.408 -3.796 1.00 74.24 H new ATOM 0 HG2 GLU A 16 12.250 10.893 -5.199 1.00 41.04 H new ATOM 0 HG3 GLU A 16 10.741 10.894 -4.307 1.00 41.04 H new ATOM 240 N THR A 17 11.583 6.036 -5.022 1.00 62.53 N ATOM 241 CA THR A 17 11.353 4.624 -4.769 1.00 45.21 C ATOM 242 C THR A 17 11.953 3.713 -5.843 1.00 64.43 C ATOM 243 O THR A 17 11.971 2.500 -5.661 1.00 50.32 O ATOM 244 CB THR A 17 9.839 4.376 -4.633 1.00 33.24 C ATOM 245 OG1 THR A 17 9.117 5.223 -5.527 1.00 10.53 O ATOM 246 CG2 THR A 17 9.351 4.667 -3.205 1.00 11.11 C ATOM 0 H THR A 17 10.715 6.515 -5.263 1.00 62.53 H new ATOM 0 HA THR A 17 11.863 4.369 -3.840 1.00 45.21 H new ATOM 0 HB THR A 17 9.662 3.327 -4.871 1.00 33.24 H new ATOM 0 HG1 THR A 17 8.231 4.840 -5.696 1.00 10.53 H new ATOM 0 HG21 THR A 17 8.279 4.482 -3.142 1.00 11.11 H new ATOM 0 HG22 THR A 17 9.873 4.017 -2.503 1.00 11.11 H new ATOM 0 HG23 THR A 17 9.555 5.708 -2.956 1.00 11.11 H new ATOM 254 N LYS A 18 12.449 4.258 -6.956 1.00 44.02 N ATOM 255 CA LYS A 18 12.814 3.483 -8.140 1.00 41.15 C ATOM 256 C LYS A 18 13.870 2.405 -7.890 1.00 25.11 C ATOM 257 O LYS A 18 13.873 1.388 -8.596 1.00 1.11 O ATOM 258 CB LYS A 18 13.236 4.470 -9.237 1.00 12.42 C ATOM 259 CG LYS A 18 13.272 3.801 -10.612 1.00 61.51 C ATOM 260 CD LYS A 18 13.420 4.849 -11.723 1.00 1.12 C ATOM 261 CE LYS A 18 13.126 4.260 -13.107 1.00 1.12 C ATOM 262 NZ LYS A 18 11.684 4.119 -13.369 1.00 73.42 N ATOM 0 H LYS A 18 12.609 5.260 -7.060 1.00 44.02 H new ATOM 0 HA LYS A 18 11.941 2.911 -8.456 1.00 41.15 H new ATOM 0 HB2 LYS A 18 12.542 5.310 -9.258 1.00 12.42 H new ATOM 0 HB3 LYS A 18 14.220 4.876 -9.003 1.00 12.42 H new ATOM 0 HG2 LYS A 18 14.103 3.096 -10.657 1.00 61.51 H new ATOM 0 HG3 LYS A 18 12.358 3.227 -10.766 1.00 61.51 H new ATOM 0 HD2 LYS A 18 12.742 5.680 -11.531 1.00 1.12 H new ATOM 0 HD3 LYS A 18 14.432 5.253 -11.708 1.00 1.12 H new ATOM 0 HE2 LYS A 18 13.569 4.899 -13.871 1.00 1.12 H new ATOM 0 HE3 LYS A 18 13.604 3.284 -13.191 1.00 1.12 H new ATOM 0 HZ1 LYS A 18 11.541 3.717 -14.317 1.00 73.42 H new ATOM 0 HZ2 LYS A 18 11.262 3.488 -12.658 1.00 73.42 H new ATOM 0 HZ3 LYS A 18 11.229 5.053 -13.317 1.00 73.42 H new ATOM 272 N LYS A 19 14.777 2.573 -6.917 1.00 71.45 N ATOM 273 CA LYS A 19 15.701 1.486 -6.587 1.00 33.21 C ATOM 274 C LYS A 19 14.975 0.417 -5.786 1.00 33.11 C ATOM 275 O LYS A 19 15.052 -0.753 -6.169 1.00 33.11 O ATOM 276 CB LYS A 19 16.972 1.982 -5.882 1.00 44.14 C ATOM 277 CG LYS A 19 17.994 2.454 -6.926 1.00 51.14 C ATOM 278 CD LYS A 19 19.339 2.846 -6.314 1.00 12.23 C ATOM 279 CE LYS A 19 19.208 4.181 -5.584 1.00 41.42 C ATOM 280 NZ LYS A 19 20.483 4.649 -5.020 1.00 44.03 N ATOM 0 H LYS A 19 14.888 3.422 -6.363 1.00 71.45 H new ATOM 0 HA LYS A 19 16.046 1.041 -7.521 1.00 33.21 H new ATOM 0 HB2 LYS A 19 16.727 2.799 -5.203 1.00 44.14 H new ATOM 0 HB3 LYS A 19 17.399 1.182 -5.277 1.00 44.14 H new ATOM 0 HG2 LYS A 19 18.151 1.660 -7.656 1.00 51.14 H new ATOM 0 HG3 LYS A 19 17.585 3.308 -7.466 1.00 51.14 H new ATOM 0 HD2 LYS A 19 19.672 2.074 -5.621 1.00 12.23 H new ATOM 0 HD3 LYS A 19 20.096 2.921 -7.095 1.00 12.23 H new ATOM 0 HE2 LYS A 19 18.824 4.932 -6.275 1.00 41.42 H new ATOM 0 HE3 LYS A 19 18.476 4.081 -4.783 1.00 41.42 H new ATOM 0 HZ1 LYS A 19 20.336 5.558 -4.536 1.00 44.03 H new ATOM 0 HZ2 LYS A 19 20.839 3.948 -4.339 1.00 44.03 H new ATOM 0 HZ3 LYS A 19 21.177 4.772 -5.785 1.00 44.03 H new ATOM 290 N MET A 20 14.212 0.811 -4.765 1.00 43.12 N ATOM 291 CA MET A 20 13.285 -0.026 -4.002 1.00 11.01 C ATOM 292 C MET A 20 12.026 -0.386 -4.824 1.00 72.55 C ATOM 293 O MET A 20 10.895 -0.371 -4.326 1.00 61.25 O ATOM 294 CB MET A 20 12.969 0.649 -2.652 1.00 23.50 C ATOM 295 CG MET A 20 13.513 -0.109 -1.443 1.00 70.51 C ATOM 296 SD MET A 20 15.144 0.519 -0.957 1.00 2.03 S ATOM 297 CE MET A 20 16.132 -0.930 -1.314 1.00 71.11 C ATOM 0 H MET A 20 14.225 1.774 -4.430 1.00 43.12 H new ATOM 0 HA MET A 20 13.760 -0.982 -3.783 1.00 11.01 H new ATOM 0 HB2 MET A 20 13.384 1.657 -2.654 1.00 23.50 H new ATOM 0 HB3 MET A 20 11.888 0.749 -2.550 1.00 23.50 H new ATOM 0 HG2 MET A 20 12.819 -0.013 -0.608 1.00 70.51 H new ATOM 0 HG3 MET A 20 13.584 -1.171 -1.678 1.00 70.51 H new ATOM 0 HE1 MET A 20 17.180 -0.643 -1.402 1.00 71.11 H new ATOM 0 HE2 MET A 20 16.021 -1.654 -0.507 1.00 71.11 H new ATOM 0 HE3 MET A 20 15.798 -1.377 -2.251 1.00 71.11 H new ATOM 305 N ALA A 21 12.229 -0.708 -6.099 1.00 4.23 N ATOM 306 CA ALA A 21 11.270 -1.313 -6.994 1.00 42.25 C ATOM 307 C ALA A 21 11.988 -2.418 -7.779 1.00 41.01 C ATOM 308 O ALA A 21 11.649 -3.598 -7.672 1.00 12.33 O ATOM 309 CB ALA A 21 10.640 -0.240 -7.897 1.00 61.51 C ATOM 0 H ALA A 21 13.126 -0.539 -6.554 1.00 4.23 H new ATOM 0 HA ALA A 21 10.444 -1.766 -6.446 1.00 42.25 H new ATOM 0 HB1 ALA A 21 9.919 -0.707 -8.568 1.00 61.51 H new ATOM 0 HB2 ALA A 21 10.134 0.503 -7.281 1.00 61.51 H new ATOM 0 HB3 ALA A 21 11.420 0.245 -8.484 1.00 61.51 H new ATOM 315 N GLU A 22 12.991 -2.057 -8.584 1.00 34.51 N ATOM 316 CA GLU A 22 13.600 -2.995 -9.537 1.00 72.32 C ATOM 317 C GLU A 22 14.344 -4.118 -8.830 1.00 31.30 C ATOM 318 O GLU A 22 14.403 -5.236 -9.341 1.00 43.15 O ATOM 319 CB GLU A 22 14.614 -2.272 -10.420 1.00 22.13 C ATOM 320 CG GLU A 22 13.938 -1.258 -11.341 1.00 70.32 C ATOM 321 CD GLU A 22 13.193 -1.867 -12.546 1.00 21.54 C ATOM 322 OE1 GLU A 22 13.291 -3.083 -12.859 1.00 11.40 O ATOM 323 OE2 GLU A 22 12.503 -1.085 -13.234 1.00 11.03 O ATOM 0 H GLU A 22 13.400 -1.123 -8.596 1.00 34.51 H new ATOM 0 HA GLU A 22 12.783 -3.408 -10.129 1.00 72.32 H new ATOM 0 HB2 GLU A 22 15.346 -1.763 -9.793 1.00 22.13 H new ATOM 0 HB3 GLU A 22 15.160 -3.001 -11.019 1.00 22.13 H new ATOM 0 HG2 GLU A 22 13.231 -0.672 -10.754 1.00 70.32 H new ATOM 0 HG3 GLU A 22 14.694 -0.566 -11.712 1.00 70.32 H new ATOM 328 N LYS A 23 14.953 -3.808 -7.682 1.00 14.30 N ATOM 329 CA LYS A 23 15.666 -4.802 -6.890 1.00 13.13 C ATOM 330 C LYS A 23 14.710 -5.955 -6.546 1.00 33.11 C ATOM 331 O LYS A 23 14.929 -7.075 -7.010 1.00 22.32 O ATOM 332 CB LYS A 23 16.358 -4.142 -5.684 1.00 4.24 C ATOM 333 CG LYS A 23 17.857 -3.900 -5.857 1.00 74.32 C ATOM 334 CD LYS A 23 18.177 -2.508 -6.403 1.00 12.32 C ATOM 335 CE LYS A 23 18.071 -2.424 -7.930 1.00 64.53 C ATOM 336 NZ LYS A 23 18.371 -1.073 -8.453 1.00 4.40 N ATOM 0 H LYS A 23 14.964 -2.870 -7.282 1.00 14.30 H new ATOM 0 HA LYS A 23 16.481 -5.246 -7.461 1.00 13.13 H new ATOM 0 HB2 LYS A 23 15.871 -3.188 -5.482 1.00 4.24 H new ATOM 0 HB3 LYS A 23 16.205 -4.770 -4.807 1.00 4.24 H new ATOM 0 HG2 LYS A 23 18.354 -4.031 -4.896 1.00 74.32 H new ATOM 0 HG3 LYS A 23 18.266 -4.652 -6.532 1.00 74.32 H new ATOM 0 HD2 LYS A 23 17.496 -1.783 -5.957 1.00 12.32 H new ATOM 0 HD3 LYS A 23 19.185 -2.227 -6.098 1.00 12.32 H new ATOM 0 HE2 LYS A 23 18.758 -3.142 -8.377 1.00 64.53 H new ATOM 0 HE3 LYS A 23 17.065 -2.712 -8.236 1.00 64.53 H new ATOM 0 HZ1 LYS A 23 18.351 -1.091 -9.493 1.00 4.40 H new ATOM 0 HZ2 LYS A 23 17.659 -0.400 -8.104 1.00 4.40 H new ATOM 0 HZ3 LYS A 23 19.314 -0.777 -8.130 1.00 4.40 H new ATOM 346 N ILE A 24 13.611 -5.666 -5.849 1.00 65.32 N ATOM 347 CA ILE A 24 12.589 -6.642 -5.468 1.00 74.31 C ATOM 348 C ILE A 24 11.923 -7.309 -6.674 1.00 14.14 C ATOM 349 O ILE A 24 11.657 -8.505 -6.624 1.00 13.23 O ATOM 350 CB ILE A 24 11.549 -5.923 -4.583 1.00 13.42 C ATOM 351 CG1 ILE A 24 12.117 -5.630 -3.186 1.00 31.34 C ATOM 352 CG2 ILE A 24 10.219 -6.680 -4.416 1.00 1.51 C ATOM 353 CD1 ILE A 24 11.429 -4.416 -2.557 1.00 22.12 C ATOM 0 H ILE A 24 13.401 -4.722 -5.525 1.00 65.32 H new ATOM 0 HA ILE A 24 13.066 -7.452 -4.916 1.00 74.31 H new ATOM 0 HB ILE A 24 11.332 -4.999 -5.119 1.00 13.42 H new ATOM 0 HG12 ILE A 24 11.982 -6.501 -2.545 1.00 31.34 H new ATOM 0 HG13 ILE A 24 13.189 -5.449 -3.256 1.00 31.34 H new ATOM 0 HG21 ILE A 24 9.549 -6.102 -3.780 1.00 1.51 H new ATOM 0 HG22 ILE A 24 9.757 -6.824 -5.393 1.00 1.51 H new ATOM 0 HG23 ILE A 24 10.408 -7.650 -3.957 1.00 1.51 H new ATOM 0 HD11 ILE A 24 11.850 -4.231 -1.569 1.00 22.12 H new ATOM 0 HD12 ILE A 24 11.586 -3.541 -3.188 1.00 22.12 H new ATOM 0 HD13 ILE A 24 10.360 -4.610 -2.466 1.00 22.12 H new ATOM 364 N ASN A 25 11.643 -6.582 -7.763 1.00 24.34 N ATOM 365 CA ASN A 25 11.058 -7.200 -8.961 1.00 14.03 C ATOM 366 C ASN A 25 11.910 -8.393 -9.424 1.00 51.25 C ATOM 367 O ASN A 25 11.388 -9.403 -9.889 1.00 24.33 O ATOM 368 CB ASN A 25 10.956 -6.174 -10.098 1.00 42.15 C ATOM 369 CG ASN A 25 10.562 -6.794 -11.432 1.00 22.22 C ATOM 370 OD1 ASN A 25 11.155 -6.478 -12.458 1.00 61.11 O ATOM 371 ND2 ASN A 25 9.523 -7.607 -11.471 1.00 62.52 N ATOM 0 H ASN A 25 11.809 -5.579 -7.840 1.00 24.34 H new ATOM 0 HA ASN A 25 10.059 -7.553 -8.705 1.00 14.03 H new ATOM 0 HB2 ASN A 25 10.223 -5.413 -9.828 1.00 42.15 H new ATOM 0 HB3 ASN A 25 11.915 -5.668 -10.209 1.00 42.15 H new ATOM 0 HD21 ASN A 25 9.202 -7.982 -12.364 1.00 62.52 H new ATOM 0 HD22 ASN A 25 9.041 -7.860 -10.609 1.00 62.52 H new ATOM 377 N SER A 26 13.225 -8.265 -9.282 1.00 62.35 N ATOM 378 CA SER A 26 14.196 -9.285 -9.610 1.00 61.22 C ATOM 379 C SER A 26 14.312 -10.391 -8.554 1.00 5.20 C ATOM 380 O SER A 26 14.781 -11.482 -8.880 1.00 30.14 O ATOM 381 CB SER A 26 15.526 -8.588 -9.806 1.00 3.42 C ATOM 382 OG SER A 26 15.874 -8.486 -11.171 1.00 63.21 O ATOM 0 H SER A 26 13.653 -7.412 -8.921 1.00 62.35 H new ATOM 0 HA SER A 26 13.871 -9.797 -10.516 1.00 61.22 H new ATOM 0 HB2 SER A 26 15.481 -7.591 -9.368 1.00 3.42 H new ATOM 0 HB3 SER A 26 16.304 -9.135 -9.273 1.00 3.42 H new ATOM 0 HG SER A 26 16.737 -8.029 -11.255 1.00 63.21 H new ATOM 387 N GLU A 27 13.948 -10.133 -7.293 1.00 25.12 N ATOM 388 CA GLU A 27 14.117 -11.103 -6.218 1.00 63.13 C ATOM 389 C GLU A 27 12.870 -11.985 -6.050 1.00 42.04 C ATOM 390 O GLU A 27 12.940 -13.062 -5.455 1.00 31.30 O ATOM 391 CB GLU A 27 14.694 -10.448 -4.956 1.00 74.35 C ATOM 392 CG GLU A 27 13.613 -9.974 -4.028 1.00 33.13 C ATOM 393 CD GLU A 27 14.187 -9.088 -2.908 1.00 52.11 C ATOM 394 OE1 GLU A 27 14.603 -7.939 -3.164 1.00 22.13 O ATOM 395 OE2 GLU A 27 14.277 -9.573 -1.753 1.00 45.03 O ATOM 0 H GLU A 27 13.531 -9.251 -6.995 1.00 25.12 H new ATOM 0 HA GLU A 27 14.886 -11.826 -6.489 1.00 63.13 H new ATOM 0 HB2 GLU A 27 15.332 -11.162 -4.436 1.00 74.35 H new ATOM 0 HB3 GLU A 27 15.324 -9.605 -5.240 1.00 74.35 H new ATOM 0 HG2 GLU A 27 12.867 -9.414 -4.591 1.00 33.13 H new ATOM 0 HG3 GLU A 27 13.104 -10.833 -3.591 1.00 33.13 H new ATOM 400 N ILE A 28 11.737 -11.588 -6.633 1.00 61.25 N ATOM 401 CA ILE A 28 10.477 -12.307 -6.564 1.00 32.41 C ATOM 402 C ILE A 28 10.293 -13.117 -7.852 1.00 62.44 C ATOM 403 O ILE A 28 10.717 -12.717 -8.942 1.00 53.14 O ATOM 404 CB ILE A 28 9.347 -11.290 -6.300 1.00 53.21 C ATOM 405 CG1 ILE A 28 9.550 -10.648 -4.906 1.00 52.41 C ATOM 406 CG2 ILE A 28 7.984 -11.986 -6.377 1.00 1.10 C ATOM 407 CD1 ILE A 28 8.423 -9.707 -4.473 1.00 14.51 C ATOM 0 H ILE A 28 11.676 -10.730 -7.181 1.00 61.25 H new ATOM 0 HA ILE A 28 10.460 -13.024 -5.743 1.00 32.41 H new ATOM 0 HB ILE A 28 9.376 -10.509 -7.059 1.00 53.21 H new ATOM 0 HG12 ILE A 28 9.649 -11.441 -4.165 1.00 52.41 H new ATOM 0 HG13 ILE A 28 10.489 -10.094 -4.908 1.00 52.41 H new ATOM 0 HG21 ILE A 28 7.193 -11.260 -6.189 1.00 1.10 H new ATOM 0 HG22 ILE A 28 7.852 -12.418 -7.369 1.00 1.10 H new ATOM 0 HG23 ILE A 28 7.936 -12.776 -5.628 1.00 1.10 H new ATOM 0 HD11 ILE A 28 8.646 -9.302 -3.486 1.00 14.51 H new ATOM 0 HD12 ILE A 28 8.336 -8.890 -5.189 1.00 14.51 H new ATOM 0 HD13 ILE A 28 7.483 -10.258 -4.435 1.00 14.51 H new ATOM 418 N LYS A 29 9.615 -14.265 -7.746 1.00 12.50 N ATOM 419 CA LYS A 29 9.238 -15.056 -8.915 1.00 23.43 C ATOM 420 C LYS A 29 8.070 -14.398 -9.629 1.00 50.34 C ATOM 421 O LYS A 29 7.046 -14.134 -9.002 1.00 43.54 O ATOM 422 CB LYS A 29 8.869 -16.511 -8.546 1.00 5.44 C ATOM 423 CG LYS A 29 9.619 -17.499 -9.452 1.00 11.31 C ATOM 424 CD LYS A 29 11.081 -17.641 -9.006 1.00 72.43 C ATOM 425 CE LYS A 29 11.969 -18.159 -10.134 1.00 44.31 C ATOM 426 NZ LYS A 29 13.389 -18.140 -9.734 1.00 5.11 N ATOM 0 H LYS A 29 9.316 -14.666 -6.857 1.00 12.50 H new ATOM 0 HA LYS A 29 10.106 -15.095 -9.573 1.00 23.43 H new ATOM 0 HB2 LYS A 29 9.119 -16.703 -7.502 1.00 5.44 H new ATOM 0 HB3 LYS A 29 7.794 -16.658 -8.649 1.00 5.44 H new ATOM 0 HG2 LYS A 29 9.128 -18.472 -9.422 1.00 11.31 H new ATOM 0 HG3 LYS A 29 9.581 -17.154 -10.485 1.00 11.31 H new ATOM 0 HD2 LYS A 29 11.453 -16.675 -8.665 1.00 72.43 H new ATOM 0 HD3 LYS A 29 11.138 -18.322 -8.157 1.00 72.43 H new ATOM 0 HE2 LYS A 29 11.674 -19.175 -10.397 1.00 44.31 H new ATOM 0 HE3 LYS A 29 11.829 -17.545 -11.024 1.00 44.31 H new ATOM 0 HZ1 LYS A 29 13.975 -18.496 -10.516 1.00 5.11 H new ATOM 0 HZ2 LYS A 29 13.672 -17.166 -9.505 1.00 5.11 H new ATOM 0 HZ3 LYS A 29 13.522 -18.745 -8.898 1.00 5.11 H new ATOM 436 N ASP A 30 8.211 -14.209 -10.936 1.00 3.43 N ATOM 437 CA ASP A 30 7.137 -13.850 -11.862 1.00 70.11 C ATOM 438 C ASP A 30 6.347 -12.624 -11.395 1.00 44.54 C ATOM 439 O ASP A 30 5.120 -12.572 -11.519 1.00 5.33 O ATOM 440 CB ASP A 30 6.245 -15.081 -12.119 1.00 32.30 C ATOM 441 CG ASP A 30 5.593 -15.069 -13.502 1.00 45.25 C ATOM 442 OD1 ASP A 30 5.780 -14.130 -14.307 1.00 64.05 O ATOM 443 OD2 ASP A 30 4.919 -16.064 -13.864 1.00 50.23 O ATOM 0 H ASP A 30 9.114 -14.305 -11.401 1.00 3.43 H new ATOM 0 HA ASP A 30 7.580 -13.550 -12.812 1.00 70.11 H new ATOM 0 HB2 ASP A 30 6.844 -15.985 -12.014 1.00 32.30 H new ATOM 0 HB3 ASP A 30 5.467 -15.124 -11.357 1.00 32.30 H new ATOM 447 N SER A 31 7.052 -11.668 -10.779 1.00 5.14 N ATOM 448 CA SER A 31 6.453 -10.419 -10.338 1.00 70.32 C ATOM 449 C SER A 31 6.359 -9.419 -11.487 1.00 30.00 C ATOM 450 O SER A 31 7.021 -9.561 -12.522 1.00 31.32 O ATOM 451 CB SER A 31 7.227 -9.832 -9.149 1.00 61.43 C ATOM 452 OG SER A 31 8.551 -9.449 -9.462 1.00 74.14 O ATOM 0 H SER A 31 8.049 -11.745 -10.576 1.00 5.14 H new ATOM 0 HA SER A 31 5.438 -10.631 -10.003 1.00 70.32 H new ATOM 0 HB2 SER A 31 6.688 -8.964 -8.770 1.00 61.43 H new ATOM 0 HB3 SER A 31 7.252 -10.568 -8.345 1.00 61.43 H new ATOM 0 HG SER A 31 9.094 -10.249 -9.621 1.00 74.14 H new ATOM 457 N GLU A 32 5.608 -8.347 -11.264 1.00 21.00 N ATOM 458 CA GLU A 32 5.504 -7.221 -12.164 1.00 70.05 C ATOM 459 C GLU A 32 5.550 -5.904 -11.409 1.00 10.53 C ATOM 460 O GLU A 32 5.371 -5.852 -10.192 1.00 5.11 O ATOM 461 CB GLU A 32 4.202 -7.341 -12.981 1.00 4.42 C ATOM 462 CG GLU A 32 4.360 -8.189 -14.250 1.00 5.40 C ATOM 463 CD GLU A 32 3.955 -9.670 -14.182 1.00 44.24 C ATOM 464 OE1 GLU A 32 3.163 -10.083 -13.315 1.00 22.03 O ATOM 465 OE2 GLU A 32 4.275 -10.391 -15.165 1.00 24.31 O ATOM 0 H GLU A 32 5.040 -8.241 -10.424 1.00 21.00 H new ATOM 0 HA GLU A 32 6.357 -7.233 -12.842 1.00 70.05 H new ATOM 0 HB2 GLU A 32 3.426 -7.779 -12.353 1.00 4.42 H new ATOM 0 HB3 GLU A 32 3.862 -6.343 -13.259 1.00 4.42 H new ATOM 0 HG2 GLU A 32 3.776 -7.719 -15.041 1.00 5.40 H new ATOM 0 HG3 GLU A 32 5.405 -8.142 -14.555 1.00 5.40 H new ATOM 470 N LEU A 33 5.795 -4.837 -12.169 1.00 4.21 N ATOM 471 CA LEU A 33 6.102 -3.500 -11.694 1.00 25.41 C ATOM 472 C LEU A 33 5.227 -2.517 -12.450 1.00 12.30 C ATOM 473 O LEU A 33 5.409 -2.328 -13.659 1.00 63.25 O ATOM 474 CB LEU A 33 7.618 -3.248 -11.883 1.00 74.41 C ATOM 475 CG LEU A 33 8.316 -3.018 -10.553 1.00 4.22 C ATOM 476 CD1 LEU A 33 8.129 -4.281 -9.738 1.00 34.40 C ATOM 477 CD2 LEU A 33 9.793 -2.687 -10.780 1.00 34.20 C ATOM 0 H LEU A 33 5.782 -4.892 -13.187 1.00 4.21 H new ATOM 0 HA LEU A 33 5.888 -3.376 -10.632 1.00 25.41 H new ATOM 0 HB2 LEU A 33 8.069 -4.102 -12.389 1.00 74.41 H new ATOM 0 HB3 LEU A 33 7.766 -2.381 -12.527 1.00 74.41 H new ATOM 0 HG LEU A 33 7.894 -2.168 -10.017 1.00 4.22 H new ATOM 0 HD11 LEU A 33 8.615 -4.164 -8.769 1.00 34.40 H new ATOM 0 HD12 LEU A 33 7.065 -4.464 -9.590 1.00 34.40 H new ATOM 0 HD13 LEU A 33 8.572 -5.124 -10.267 1.00 34.40 H new ATOM 0 HD21 LEU A 33 10.281 -2.525 -9.819 1.00 34.20 H new ATOM 0 HD22 LEU A 33 10.276 -3.516 -11.297 1.00 34.20 H new ATOM 0 HD23 LEU A 33 9.875 -1.784 -11.386 1.00 34.20 H new ATOM 488 N LYS A 34 4.239 -1.945 -11.766 1.00 24.10 N ATOM 489 CA LYS A 34 3.254 -1.044 -12.362 1.00 33.30 C ATOM 490 C LYS A 34 3.342 0.307 -11.664 1.00 4.41 C ATOM 491 O LYS A 34 3.978 0.432 -10.619 1.00 42.31 O ATOM 492 CB LYS A 34 1.834 -1.626 -12.271 1.00 51.32 C ATOM 493 CG LYS A 34 1.061 -1.531 -13.602 1.00 24.32 C ATOM 494 CD LYS A 34 1.177 -2.765 -14.511 1.00 45.34 C ATOM 495 CE LYS A 34 0.359 -3.955 -13.981 1.00 71.34 C ATOM 496 NZ LYS A 34 0.323 -5.096 -14.927 1.00 1.34 N ATOM 0 H LYS A 34 4.098 -2.096 -10.767 1.00 24.10 H new ATOM 0 HA LYS A 34 3.474 -0.920 -13.422 1.00 33.30 H new ATOM 0 HB2 LYS A 34 1.894 -2.670 -11.965 1.00 51.32 H new ATOM 0 HB3 LYS A 34 1.279 -1.098 -11.496 1.00 51.32 H new ATOM 0 HG2 LYS A 34 0.008 -1.359 -13.381 1.00 24.32 H new ATOM 0 HG3 LYS A 34 1.418 -0.660 -14.151 1.00 24.32 H new ATOM 0 HD2 LYS A 34 0.835 -2.509 -15.514 1.00 45.34 H new ATOM 0 HD3 LYS A 34 2.224 -3.055 -14.596 1.00 45.34 H new ATOM 0 HE2 LYS A 34 0.783 -4.288 -13.034 1.00 71.34 H new ATOM 0 HE3 LYS A 34 -0.660 -3.627 -13.776 1.00 71.34 H new ATOM 0 HZ1 LYS A 34 -0.154 -5.904 -14.478 1.00 1.34 H new ATOM 0 HZ2 LYS A 34 -0.197 -4.820 -15.784 1.00 1.34 H new ATOM 0 HZ3 LYS A 34 1.294 -5.366 -15.183 1.00 1.34 H new ATOM 506 N GLU A 35 2.691 1.315 -12.235 1.00 31.14 N ATOM 507 CA GLU A 35 2.805 2.683 -11.763 1.00 63.00 C ATOM 508 C GLU A 35 1.554 3.113 -11.001 1.00 10.54 C ATOM 509 O GLU A 35 0.444 2.624 -11.223 1.00 24.14 O ATOM 510 CB GLU A 35 3.093 3.613 -12.956 1.00 65.24 C ATOM 511 CG GLU A 35 1.908 3.784 -13.908 1.00 72.14 C ATOM 512 CD GLU A 35 2.277 4.631 -15.116 1.00 41.43 C ATOM 513 OE1 GLU A 35 2.219 5.882 -15.053 1.00 61.42 O ATOM 514 OE2 GLU A 35 2.523 4.045 -16.194 1.00 71.11 O ATOM 0 H GLU A 35 2.071 1.203 -13.037 1.00 31.14 H new ATOM 0 HA GLU A 35 3.636 2.749 -11.061 1.00 63.00 H new ATOM 0 HB2 GLU A 35 3.387 4.592 -12.578 1.00 65.24 H new ATOM 0 HB3 GLU A 35 3.942 3.219 -13.515 1.00 65.24 H new ATOM 0 HG2 GLU A 35 1.564 2.805 -14.241 1.00 72.14 H new ATOM 0 HG3 GLU A 35 1.078 4.250 -13.377 1.00 72.14 H new ATOM 519 N VAL A 36 1.753 4.099 -10.139 1.00 70.10 N ATOM 520 CA VAL A 36 0.784 4.752 -9.276 1.00 74.12 C ATOM 521 C VAL A 36 0.785 6.231 -9.679 1.00 30.32 C ATOM 522 O VAL A 36 1.856 6.829 -9.819 1.00 3.11 O ATOM 523 CB VAL A 36 1.164 4.509 -7.789 1.00 45.23 C ATOM 524 CG1 VAL A 36 2.655 4.688 -7.536 1.00 41.12 C ATOM 525 CG2 VAL A 36 0.221 5.316 -6.882 1.00 33.44 C ATOM 0 H VAL A 36 2.684 4.498 -10.016 1.00 70.10 H new ATOM 0 HA VAL A 36 -0.225 4.355 -9.387 1.00 74.12 H new ATOM 0 HB VAL A 36 1.005 3.463 -7.526 1.00 45.23 H new ATOM 0 HG11 VAL A 36 2.870 4.507 -6.483 1.00 41.12 H new ATOM 0 HG12 VAL A 36 3.215 3.980 -8.147 1.00 41.12 H new ATOM 0 HG13 VAL A 36 2.949 5.705 -7.797 1.00 41.12 H new ATOM 0 HG21 VAL A 36 0.486 5.146 -5.838 1.00 33.44 H new ATOM 0 HG22 VAL A 36 0.314 6.377 -7.112 1.00 33.44 H new ATOM 0 HG23 VAL A 36 -0.808 4.997 -7.051 1.00 33.44 H new ATOM 535 N LYS A 37 -0.384 6.846 -9.882 1.00 64.30 N ATOM 536 CA LYS A 37 -0.513 8.243 -10.291 1.00 23.25 C ATOM 537 C LYS A 37 -1.348 8.989 -9.246 1.00 10.13 C ATOM 538 O LYS A 37 -1.878 8.374 -8.318 1.00 25.04 O ATOM 539 CB LYS A 37 -1.127 8.304 -11.702 1.00 42.53 C ATOM 540 CG LYS A 37 -0.505 7.300 -12.688 1.00 24.41 C ATOM 541 CD LYS A 37 -0.980 7.507 -14.129 1.00 4.35 C ATOM 542 CE LYS A 37 -0.835 6.176 -14.876 1.00 62.20 C ATOM 543 NZ LYS A 37 -0.864 6.321 -16.342 1.00 53.43 N ATOM 0 H LYS A 37 -1.282 6.376 -9.764 1.00 64.30 H new ATOM 0 HA LYS A 37 0.460 8.731 -10.343 1.00 23.25 H new ATOM 0 HB2 LYS A 37 -2.198 8.115 -11.632 1.00 42.53 H new ATOM 0 HB3 LYS A 37 -1.006 9.312 -12.098 1.00 42.53 H new ATOM 0 HG2 LYS A 37 0.581 7.389 -12.652 1.00 24.41 H new ATOM 0 HG3 LYS A 37 -0.752 6.287 -12.371 1.00 24.41 H new ATOM 0 HD2 LYS A 37 -2.018 7.840 -14.143 1.00 4.35 H new ATOM 0 HD3 LYS A 37 -0.390 8.283 -14.616 1.00 4.35 H new ATOM 0 HE2 LYS A 37 0.103 5.704 -14.584 1.00 62.20 H new ATOM 0 HE3 LYS A 37 -1.638 5.506 -14.569 1.00 62.20 H new ATOM 0 HZ1 LYS A 37 -0.761 5.386 -16.785 1.00 53.43 H new ATOM 0 HZ2 LYS A 37 -1.769 6.744 -16.631 1.00 53.43 H new ATOM 0 HZ3 LYS A 37 -0.082 6.936 -16.646 1.00 53.43 H new ATOM 553 N VAL A 38 -1.494 10.304 -9.392 1.00 10.44 N ATOM 554 CA VAL A 38 -2.358 11.126 -8.546 1.00 5.11 C ATOM 555 C VAL A 38 -3.478 11.731 -9.382 1.00 32.03 C ATOM 556 O VAL A 38 -3.274 12.026 -10.563 1.00 63.00 O ATOM 557 CB VAL A 38 -1.551 12.204 -7.798 1.00 53.11 C ATOM 558 CG1 VAL A 38 -0.762 11.552 -6.661 1.00 54.11 C ATOM 559 CG2 VAL A 38 -0.587 13.009 -8.678 1.00 25.33 C ATOM 0 H VAL A 38 -1.008 10.837 -10.113 1.00 10.44 H new ATOM 0 HA VAL A 38 -2.809 10.491 -7.784 1.00 5.11 H new ATOM 0 HB VAL A 38 -2.286 12.916 -7.423 1.00 53.11 H new ATOM 0 HG11 VAL A 38 -0.191 12.314 -6.131 1.00 54.11 H new ATOM 0 HG12 VAL A 38 -1.452 11.069 -5.969 1.00 54.11 H new ATOM 0 HG13 VAL A 38 -0.080 10.807 -7.072 1.00 54.11 H new ATOM 0 HG21 VAL A 38 -0.063 13.743 -8.066 1.00 25.33 H new ATOM 0 HG22 VAL A 38 0.137 12.335 -9.136 1.00 25.33 H new ATOM 0 HG23 VAL A 38 -1.149 13.522 -9.459 1.00 25.33 H new ATOM 569 N SER A 39 -4.651 11.912 -8.780 1.00 73.12 N ATOM 570 CA SER A 39 -5.740 12.702 -9.329 1.00 11.43 C ATOM 571 C SER A 39 -5.439 14.193 -9.135 1.00 34.32 C ATOM 572 O SER A 39 -4.435 14.589 -8.541 1.00 24.05 O ATOM 573 CB SER A 39 -7.068 12.262 -8.684 1.00 63.33 C ATOM 574 OG SER A 39 -8.032 11.934 -9.673 1.00 12.55 O ATOM 0 H SER A 39 -4.872 11.501 -7.873 1.00 73.12 H new ATOM 0 HA SER A 39 -5.837 12.536 -10.402 1.00 11.43 H new ATOM 0 HB2 SER A 39 -6.895 11.400 -8.040 1.00 63.33 H new ATOM 0 HB3 SER A 39 -7.451 13.062 -8.050 1.00 63.33 H new ATOM 0 HG SER A 39 -8.865 11.656 -9.238 1.00 12.55 H new ATOM 770 N ALA A 54 4.305 17.678 6.611 1.00 22.34 N ATOM 771 CA ALA A 54 4.156 16.461 7.400 1.00 22.44 C ATOM 772 C ALA A 54 2.661 16.148 7.561 1.00 32.41 C ATOM 773 O ALA A 54 2.075 15.457 6.733 1.00 42.23 O ATOM 774 CB ALA A 54 4.903 16.639 8.735 1.00 43.30 C ATOM 0 HA ALA A 54 4.602 15.599 6.903 1.00 22.44 H new ATOM 0 HB1 ALA A 54 4.798 15.734 9.334 1.00 43.30 H new ATOM 0 HB2 ALA A 54 5.959 16.824 8.539 1.00 43.30 H new ATOM 0 HB3 ALA A 54 4.481 17.485 9.278 1.00 43.30 H new ATOM 780 N LEU A 55 2.003 16.724 8.567 1.00 73.04 N ATOM 781 CA LEU A 55 0.552 16.776 8.664 1.00 24.44 C ATOM 782 C LEU A 55 0.089 17.956 7.818 1.00 1.42 C ATOM 783 O LEU A 55 0.194 19.098 8.267 1.00 51.50 O ATOM 784 CB LEU A 55 0.080 16.907 10.121 1.00 73.31 C ATOM 785 CG LEU A 55 0.022 15.541 10.832 1.00 3.33 C ATOM 786 CD1 LEU A 55 1.298 15.199 11.602 1.00 50.53 C ATOM 787 CD2 LEU A 55 -1.166 15.531 11.786 1.00 73.02 C ATOM 0 H LEU A 55 2.476 17.175 9.350 1.00 73.04 H new ATOM 0 HA LEU A 55 0.116 15.847 8.296 1.00 24.44 H new ATOM 0 HB2 LEU A 55 0.755 17.570 10.663 1.00 73.31 H new ATOM 0 HB3 LEU A 55 -0.907 17.370 10.143 1.00 73.31 H new ATOM 0 HG LEU A 55 -0.085 14.781 10.058 1.00 3.33 H new ATOM 0 HD11 LEU A 55 1.186 14.224 12.077 1.00 50.53 H new ATOM 0 HD12 LEU A 55 2.142 15.172 10.913 1.00 50.53 H new ATOM 0 HD13 LEU A 55 1.476 15.956 12.365 1.00 50.53 H new ATOM 0 HD21 LEU A 55 -1.216 14.568 12.295 1.00 73.02 H new ATOM 0 HD22 LEU A 55 -1.047 16.325 12.523 1.00 73.02 H new ATOM 0 HD23 LEU A 55 -2.086 15.693 11.224 1.00 73.02 H new ATOM 798 N ASP A 56 -0.387 17.684 6.603 1.00 30.12 N ATOM 799 CA ASP A 56 -1.392 18.523 5.947 1.00 32.33 C ATOM 800 C ASP A 56 -2.704 17.762 6.090 1.00 24.35 C ATOM 801 O ASP A 56 -3.426 17.975 7.064 1.00 34.03 O ATOM 802 CB ASP A 56 -1.029 18.851 4.487 1.00 74.34 C ATOM 803 CG ASP A 56 -2.190 19.510 3.733 1.00 5.24 C ATOM 804 OD1 ASP A 56 -2.391 20.738 3.881 1.00 51.40 O ATOM 805 OD2 ASP A 56 -2.933 18.790 3.030 1.00 65.03 O ATOM 0 H ASP A 56 -0.090 16.881 6.048 1.00 30.12 H new ATOM 0 HA ASP A 56 -1.462 19.506 6.412 1.00 32.33 H new ATOM 0 HB2 ASP A 56 -0.164 19.515 4.470 1.00 74.34 H new ATOM 0 HB3 ASP A 56 -0.738 17.935 3.973 1.00 74.34 H new ATOM 809 N GLN A 57 -2.936 16.803 5.193 1.00 44.23 N ATOM 810 CA GLN A 57 -4.142 16.006 4.987 1.00 64.42 C ATOM 811 C GLN A 57 -4.384 14.940 6.072 1.00 13.35 C ATOM 812 O GLN A 57 -4.590 13.762 5.774 1.00 4.42 O ATOM 813 CB GLN A 57 -4.129 15.424 3.561 1.00 70.04 C ATOM 814 CG GLN A 57 -2.911 14.565 3.171 1.00 53.43 C ATOM 815 CD GLN A 57 -1.655 15.354 2.820 1.00 74.01 C ATOM 816 OE1 GLN A 57 -1.619 16.097 1.850 1.00 24.01 O ATOM 817 NE2 GLN A 57 -0.582 15.225 3.578 1.00 3.33 N ATOM 0 H GLN A 57 -2.210 16.540 4.527 1.00 44.23 H new ATOM 0 HA GLN A 57 -5.000 16.670 5.089 1.00 64.42 H new ATOM 0 HB2 GLN A 57 -5.026 14.818 3.433 1.00 70.04 H new ATOM 0 HB3 GLN A 57 -4.200 16.252 2.856 1.00 70.04 H new ATOM 0 HG2 GLN A 57 -2.681 13.892 3.996 1.00 53.43 H new ATOM 0 HG3 GLN A 57 -3.182 13.943 2.318 1.00 53.43 H new ATOM 0 HE21 GLN A 57 -0.602 14.607 4.390 1.00 3.33 H new ATOM 0 HE22 GLN A 57 0.267 15.743 3.352 1.00 3.33 H new ATOM 824 N ILE A 58 -4.338 15.336 7.347 1.00 25.11 N ATOM 825 CA ILE A 58 -4.664 14.478 8.477 1.00 50.11 C ATOM 826 C ILE A 58 -5.566 15.303 9.401 1.00 34.14 C ATOM 827 O ILE A 58 -6.786 15.295 9.246 1.00 12.53 O ATOM 828 CB ILE A 58 -3.367 13.940 9.149 1.00 34.41 C ATOM 829 CG1 ILE A 58 -2.627 12.920 8.255 1.00 41.21 C ATOM 830 CG2 ILE A 58 -3.670 13.265 10.502 1.00 62.32 C ATOM 831 CD1 ILE A 58 -1.598 13.545 7.308 1.00 54.54 C ATOM 0 H ILE A 58 -4.068 16.280 7.622 1.00 25.11 H new ATOM 0 HA ILE A 58 -5.203 13.578 8.180 1.00 50.11 H new ATOM 0 HB ILE A 58 -2.730 14.811 9.303 1.00 34.41 H new ATOM 0 HG12 ILE A 58 -2.123 12.193 8.892 1.00 41.21 H new ATOM 0 HG13 ILE A 58 -3.361 12.371 7.665 1.00 41.21 H new ATOM 0 HG21 ILE A 58 -2.742 12.901 10.943 1.00 62.32 H new ATOM 0 HG22 ILE A 58 -4.132 13.988 11.174 1.00 62.32 H new ATOM 0 HG23 ILE A 58 -4.351 12.428 10.347 1.00 62.32 H new ATOM 0 HD11 ILE A 58 -1.124 12.761 6.717 1.00 54.54 H new ATOM 0 HD12 ILE A 58 -2.097 14.250 6.643 1.00 54.54 H new ATOM 0 HD13 ILE A 58 -0.840 14.069 7.890 1.00 54.54 H new ATOM 842 N GLN A 59 -4.996 16.097 10.310 1.00 10.25 N ATOM 843 CA GLN A 59 -5.771 16.796 11.322 1.00 54.23 C ATOM 844 C GLN A 59 -6.357 18.042 10.674 1.00 54.32 C ATOM 845 O GLN A 59 -5.622 18.850 10.104 1.00 25.45 O ATOM 846 CB GLN A 59 -4.913 17.129 12.554 1.00 65.14 C ATOM 847 CG GLN A 59 -4.811 15.941 13.534 1.00 50.10 C ATOM 848 CD GLN A 59 -4.175 16.339 14.863 1.00 73.01 C ATOM 849 OE1 GLN A 59 -4.579 17.324 15.476 1.00 73.44 O ATOM 850 NE2 GLN A 59 -3.135 15.656 15.312 1.00 41.43 N ATOM 0 H GLN A 59 -3.992 16.269 10.361 1.00 10.25 H new ATOM 0 HA GLN A 59 -6.578 16.162 11.689 1.00 54.23 H new ATOM 0 HB2 GLN A 59 -3.913 17.417 12.230 1.00 65.14 H new ATOM 0 HB3 GLN A 59 -5.341 17.988 13.071 1.00 65.14 H new ATOM 0 HG2 GLN A 59 -5.807 15.537 13.717 1.00 50.10 H new ATOM 0 HG3 GLN A 59 -4.223 15.145 13.077 1.00 50.10 H new ATOM 0 HE21 GLN A 59 -2.802 14.839 14.800 1.00 41.43 H new ATOM 0 HE22 GLN A 59 -2.666 15.947 16.170 1.00 41.43 H new ATOM 857 N GLY A 60 -7.681 18.184 10.731 1.00 2.11 N ATOM 858 CA GLY A 60 -8.397 19.329 10.190 1.00 41.52 C ATOM 859 C GLY A 60 -8.462 19.333 8.668 1.00 74.02 C ATOM 860 O GLY A 60 -9.073 20.242 8.104 1.00 45.10 O ATOM 0 H GLY A 60 -8.293 17.492 11.163 1.00 2.11 H new ATOM 0 HA2 GLY A 60 -9.411 19.337 10.590 1.00 41.52 H new ATOM 0 HA3 GLY A 60 -7.913 20.245 10.529 1.00 41.52 H new ATOM 864 N ASN A 61 -7.877 18.344 7.992 1.00 23.35 N ATOM 865 CA ASN A 61 -7.867 18.208 6.551 1.00 25.43 C ATOM 866 C ASN A 61 -8.136 16.745 6.249 1.00 23.31 C ATOM 867 O ASN A 61 -7.238 15.997 5.873 1.00 10.32 O ATOM 868 CB ASN A 61 -6.522 18.655 5.990 1.00 62.03 C ATOM 869 CG ASN A 61 -6.298 20.142 6.143 1.00 44.41 C ATOM 870 OD1 ASN A 61 -6.962 20.942 5.485 1.00 52.32 O ATOM 871 ND2 ASN A 61 -5.391 20.529 7.023 1.00 33.12 N ATOM 0 H ASN A 61 -7.378 17.588 8.462 1.00 23.35 H new ATOM 0 HA ASN A 61 -8.627 18.835 6.085 1.00 25.43 H new ATOM 0 HB2 ASN A 61 -5.722 18.116 6.498 1.00 62.03 H new ATOM 0 HB3 ASN A 61 -6.465 18.389 4.935 1.00 62.03 H new ATOM 0 HD21 ASN A 61 -5.221 21.523 7.176 1.00 33.12 H new ATOM 0 HD22 ASN A 61 -4.861 19.834 7.549 1.00 33.12 H new ATOM 877 N LYS A 62 -9.372 16.309 6.473 1.00 44.44 N ATOM 878 CA LYS A 62 -9.763 14.929 6.194 1.00 51.14 C ATOM 879 C LYS A 62 -9.801 14.662 4.688 1.00 3.52 C ATOM 880 O LYS A 62 -9.718 13.502 4.285 1.00 2.31 O ATOM 881 CB LYS A 62 -11.096 14.571 6.887 1.00 53.51 C ATOM 882 CG LYS A 62 -12.276 15.528 6.627 1.00 23.22 C ATOM 883 CD LYS A 62 -12.423 16.589 7.730 1.00 0.34 C ATOM 884 CE LYS A 62 -13.504 17.592 7.323 1.00 42.53 C ATOM 885 NZ LYS A 62 -13.736 18.621 8.355 1.00 52.51 N ATOM 0 H LYS A 62 -10.121 16.891 6.847 1.00 44.44 H new ATOM 0 HA LYS A 62 -9.004 14.270 6.616 1.00 51.14 H new ATOM 0 HB2 LYS A 62 -11.390 13.571 6.569 1.00 53.51 H new ATOM 0 HB3 LYS A 62 -10.922 14.526 7.962 1.00 53.51 H new ATOM 0 HG2 LYS A 62 -12.134 16.023 5.667 1.00 23.22 H new ATOM 0 HG3 LYS A 62 -13.199 14.952 6.555 1.00 23.22 H new ATOM 0 HD2 LYS A 62 -12.688 16.114 8.675 1.00 0.34 H new ATOM 0 HD3 LYS A 62 -11.474 17.102 7.886 1.00 0.34 H new ATOM 0 HE2 LYS A 62 -13.214 18.076 6.390 1.00 42.53 H new ATOM 0 HE3 LYS A 62 -14.435 17.059 7.129 1.00 42.53 H new ATOM 0 HZ1 LYS A 62 -14.477 19.276 8.032 1.00 52.51 H new ATOM 0 HZ2 LYS A 62 -14.039 18.164 9.239 1.00 52.51 H new ATOM 0 HZ3 LYS A 62 -12.856 19.149 8.523 1.00 52.51 H new ATOM 895 N ASP A 63 -9.945 15.717 3.882 1.00 45.20 N ATOM 896 CA ASP A 63 -10.152 15.681 2.439 1.00 2.54 C ATOM 897 C ASP A 63 -8.806 15.415 1.744 1.00 52.44 C ATOM 898 O ASP A 63 -8.149 16.337 1.240 1.00 32.22 O ATOM 899 CB ASP A 63 -10.797 17.004 1.982 1.00 51.24 C ATOM 900 CG ASP A 63 -12.129 17.299 2.677 1.00 2.11 C ATOM 901 OD1 ASP A 63 -13.043 16.445 2.669 1.00 71.32 O ATOM 902 OD2 ASP A 63 -12.278 18.383 3.291 1.00 12.51 O ATOM 0 H ASP A 63 -9.918 16.671 4.243 1.00 45.20 H new ATOM 0 HA ASP A 63 -10.832 14.874 2.165 1.00 2.54 H new ATOM 0 HB2 ASP A 63 -10.105 17.824 2.175 1.00 51.24 H new ATOM 0 HB3 ASP A 63 -10.957 16.969 0.904 1.00 51.24 H new ATOM 906 N PHE A 64 -8.351 14.161 1.777 1.00 34.15 N ATOM 907 CA PHE A 64 -7.049 13.758 1.253 1.00 54.50 C ATOM 908 C PHE A 64 -7.006 13.748 -0.288 1.00 2.52 C ATOM 909 O PHE A 64 -8.050 13.565 -0.921 1.00 42.43 O ATOM 910 CB PHE A 64 -6.626 12.401 1.842 1.00 50.43 C ATOM 911 CG PHE A 64 -7.636 11.266 1.860 1.00 73.40 C ATOM 912 CD1 PHE A 64 -8.065 10.670 0.659 1.00 70.12 C ATOM 913 CD2 PHE A 64 -8.079 10.742 3.092 1.00 12.54 C ATOM 914 CE1 PHE A 64 -8.959 9.587 0.690 1.00 65.10 C ATOM 915 CE2 PHE A 64 -8.956 9.642 3.122 1.00 32.44 C ATOM 916 CZ PHE A 64 -9.404 9.071 1.919 1.00 71.30 C ATOM 0 H PHE A 64 -8.885 13.388 2.174 1.00 34.15 H new ATOM 0 HA PHE A 64 -6.326 14.510 1.570 1.00 54.50 H new ATOM 0 HB2 PHE A 64 -5.753 12.058 1.287 1.00 50.43 H new ATOM 0 HB3 PHE A 64 -6.304 12.573 2.869 1.00 50.43 H new ATOM 0 HD1 PHE A 64 -7.706 11.046 -0.288 1.00 70.12 H new ATOM 0 HD2 PHE A 64 -7.744 11.187 4.017 1.00 12.54 H new ATOM 0 HE1 PHE A 64 -9.306 9.149 -0.234 1.00 65.10 H new ATOM 0 HE2 PHE A 64 -9.284 9.237 4.068 1.00 32.44 H new ATOM 0 HZ PHE A 64 -10.089 8.237 1.939 1.00 71.30 H new ATOM 925 N PRO A 65 -5.809 13.926 -0.891 1.00 43.32 N ATOM 926 CA PRO A 65 -5.604 13.871 -2.334 1.00 73.04 C ATOM 927 C PRO A 65 -5.658 12.407 -2.801 1.00 72.34 C ATOM 928 O PRO A 65 -5.023 11.520 -2.217 1.00 42.52 O ATOM 929 CB PRO A 65 -4.249 14.553 -2.574 1.00 31.34 C ATOM 930 CG PRO A 65 -3.468 14.306 -1.292 1.00 5.41 C ATOM 931 CD PRO A 65 -4.542 14.193 -0.215 1.00 54.12 C ATOM 0 HA PRO A 65 -6.374 14.383 -2.911 1.00 73.04 H new ATOM 0 HB2 PRO A 65 -3.738 14.129 -3.438 1.00 31.34 H new ATOM 0 HB3 PRO A 65 -4.369 15.619 -2.767 1.00 31.34 H new ATOM 0 HG2 PRO A 65 -2.873 13.395 -1.358 1.00 5.41 H new ATOM 0 HG3 PRO A 65 -2.778 15.123 -1.082 1.00 5.41 H new ATOM 0 HD2 PRO A 65 -4.303 13.391 0.484 1.00 54.12 H new ATOM 0 HD3 PRO A 65 -4.603 15.114 0.365 1.00 54.12 H new ATOM 936 N GLU A 66 -6.458 12.144 -3.836 1.00 51.42 N ATOM 937 CA GLU A 66 -6.765 10.802 -4.316 1.00 1.35 C ATOM 938 C GLU A 66 -5.760 10.333 -5.360 1.00 63.22 C ATOM 939 O GLU A 66 -5.190 11.124 -6.108 1.00 52.14 O ATOM 940 CB GLU A 66 -8.159 10.779 -4.945 1.00 62.34 C ATOM 941 CG GLU A 66 -9.238 11.022 -3.888 1.00 34.43 C ATOM 942 CD GLU A 66 -10.667 10.905 -4.416 1.00 22.21 C ATOM 943 OE1 GLU A 66 -10.867 10.750 -5.642 1.00 32.35 O ATOM 944 OE2 GLU A 66 -11.578 10.953 -3.555 1.00 73.30 O ATOM 0 H GLU A 66 -6.919 12.878 -4.374 1.00 51.42 H new ATOM 0 HA GLU A 66 -6.719 10.133 -3.457 1.00 1.35 H new ATOM 0 HB2 GLU A 66 -8.225 11.542 -5.720 1.00 62.34 H new ATOM 0 HB3 GLU A 66 -8.328 9.817 -5.429 1.00 62.34 H new ATOM 0 HG2 GLU A 66 -9.103 10.308 -3.076 1.00 34.43 H new ATOM 0 HG3 GLU A 66 -9.099 12.017 -3.465 1.00 34.43 H new ATOM 949 N ILE A 67 -5.568 9.026 -5.459 1.00 1.22 N ATOM 950 CA ILE A 67 -4.712 8.425 -6.482 1.00 34.34 C ATOM 951 C ILE A 67 -5.447 8.333 -7.820 1.00 71.02 C ATOM 952 O ILE A 67 -6.669 8.475 -7.879 1.00 54.13 O ATOM 953 CB ILE A 67 -4.180 7.049 -6.027 1.00 31.12 C ATOM 954 CG1 ILE A 67 -5.295 6.038 -5.683 1.00 61.44 C ATOM 955 CG2 ILE A 67 -3.235 7.232 -4.828 1.00 10.32 C ATOM 956 CD1 ILE A 67 -5.701 5.123 -6.837 1.00 74.34 C ATOM 0 H ILE A 67 -6.001 8.347 -4.833 1.00 1.22 H new ATOM 0 HA ILE A 67 -3.847 9.073 -6.625 1.00 34.34 H new ATOM 0 HB ILE A 67 -3.640 6.624 -6.873 1.00 31.12 H new ATOM 0 HG12 ILE A 67 -4.964 5.422 -4.847 1.00 61.44 H new ATOM 0 HG13 ILE A 67 -6.174 6.587 -5.345 1.00 61.44 H new ATOM 0 HG21 ILE A 67 -2.860 6.260 -4.508 1.00 10.32 H new ATOM 0 HG22 ILE A 67 -2.397 7.866 -5.118 1.00 10.32 H new ATOM 0 HG23 ILE A 67 -3.776 7.700 -4.006 1.00 10.32 H new ATOM 0 HD11 ILE A 67 -6.489 4.447 -6.505 1.00 74.34 H new ATOM 0 HD12 ILE A 67 -6.067 5.726 -7.668 1.00 74.34 H new ATOM 0 HD13 ILE A 67 -4.838 4.543 -7.162 1.00 74.34 H new ATOM 967 N GLN A 68 -4.687 7.998 -8.860 1.00 41.41 N ATOM 968 CA GLN A 68 -5.158 7.487 -10.135 1.00 23.15 C ATOM 969 C GLN A 68 -4.316 6.262 -10.493 1.00 53.51 C ATOM 970 O GLN A 68 -3.178 6.125 -10.030 1.00 42.22 O ATOM 971 CB GLN A 68 -4.977 8.552 -11.225 1.00 53.10 C ATOM 972 CG GLN A 68 -6.197 9.450 -11.403 1.00 53.23 C ATOM 973 CD GLN A 68 -6.001 10.343 -12.619 1.00 53.41 C ATOM 974 OE1 GLN A 68 -6.468 10.044 -13.711 1.00 13.43 O ATOM 975 NE2 GLN A 68 -5.214 11.397 -12.502 1.00 12.11 N ATOM 0 H GLN A 68 -3.671 8.082 -8.829 1.00 41.41 H new ATOM 0 HA GLN A 68 -6.214 7.227 -10.064 1.00 23.15 H new ATOM 0 HB2 GLN A 68 -4.113 9.170 -10.979 1.00 53.10 H new ATOM 0 HB3 GLN A 68 -4.757 8.059 -12.172 1.00 53.10 H new ATOM 0 HG2 GLN A 68 -7.093 8.842 -11.526 1.00 53.23 H new ATOM 0 HG3 GLN A 68 -6.345 10.060 -10.512 1.00 53.23 H new ATOM 0 HE21 GLN A 68 -4.826 11.645 -11.592 1.00 12.11 H new ATOM 0 HE22 GLN A 68 -4.994 11.963 -13.322 1.00 12.11 H new ATOM 982 N LEU A 69 -4.848 5.423 -11.378 1.00 23.12 N ATOM 983 CA LEU A 69 -4.130 4.443 -12.189 1.00 31.13 C ATOM 984 C LEU A 69 -5.076 3.970 -13.287 1.00 24.01 C ATOM 985 O LEU A 69 -6.241 4.365 -13.345 1.00 21.35 O ATOM 986 CB LEU A 69 -3.542 3.272 -11.368 1.00 74.33 C ATOM 987 CG LEU A 69 -4.500 2.151 -10.917 1.00 4.52 C ATOM 988 CD1 LEU A 69 -3.712 1.189 -10.021 1.00 51.52 C ATOM 989 CD2 LEU A 69 -5.723 2.660 -10.149 1.00 1.44 C ATOM 0 H LEU A 69 -5.852 5.408 -11.559 1.00 23.12 H new ATOM 0 HA LEU A 69 -3.253 4.918 -12.628 1.00 31.13 H new ATOM 0 HB2 LEU A 69 -2.748 2.815 -11.959 1.00 74.33 H new ATOM 0 HB3 LEU A 69 -3.075 3.691 -10.477 1.00 74.33 H new ATOM 0 HG LEU A 69 -4.881 1.663 -11.814 1.00 4.52 H new ATOM 0 HD11 LEU A 69 -4.367 0.384 -9.687 1.00 51.52 H new ATOM 0 HD12 LEU A 69 -2.878 0.769 -10.583 1.00 51.52 H new ATOM 0 HD13 LEU A 69 -3.330 1.729 -9.155 1.00 51.52 H new ATOM 0 HD21 LEU A 69 -6.351 1.816 -9.864 1.00 1.44 H new ATOM 0 HD22 LEU A 69 -5.396 3.188 -9.253 1.00 1.44 H new ATOM 0 HD23 LEU A 69 -6.294 3.339 -10.782 1.00 1.44 H new ATOM 1000 N ASP A 70 -4.556 3.134 -14.175 1.00 23.12 N ATOM 1001 CA ASP A 70 -5.306 2.529 -15.270 1.00 14.24 C ATOM 1002 C ASP A 70 -6.443 1.638 -14.777 1.00 52.32 C ATOM 1003 O ASP A 70 -6.610 1.407 -13.575 1.00 45.40 O ATOM 1004 CB ASP A 70 -4.330 1.750 -16.166 1.00 41.41 C ATOM 1005 CG ASP A 70 -4.150 2.446 -17.511 1.00 24.23 C ATOM 1006 OD1 ASP A 70 -5.121 2.515 -18.291 1.00 22.22 O ATOM 1007 OD2 ASP A 70 -3.009 2.893 -17.786 1.00 41.34 O ATOM 0 H ASP A 70 -3.577 2.850 -14.154 1.00 23.12 H new ATOM 0 HA ASP A 70 -5.781 3.323 -15.846 1.00 14.24 H new ATOM 0 HB2 ASP A 70 -3.365 1.660 -15.667 1.00 41.41 H new ATOM 0 HB3 ASP A 70 -4.703 0.738 -16.323 1.00 41.41 H new ATOM 1011 N ASN A 71 -7.214 1.089 -15.715 1.00 45.43 N ATOM 1012 CA ASN A 71 -8.226 0.090 -15.430 1.00 73.10 C ATOM 1013 C ASN A 71 -7.529 -1.248 -15.198 1.00 41.34 C ATOM 1014 O ASN A 71 -7.229 -2.002 -16.125 1.00 45.42 O ATOM 1015 CB ASN A 71 -9.245 0.002 -16.557 1.00 4.54 C ATOM 1016 CG ASN A 71 -10.468 -0.732 -16.062 1.00 72.24 C ATOM 1017 OD1 ASN A 71 -10.353 -2.020 -15.795 1.00 42.33 O flip ATOM 1018 ND2 ASN A 71 -11.517 -0.113 -15.902 1.00 22.22 N flip ATOM 0 H ASN A 71 -7.147 1.333 -16.703 1.00 45.43 H new ATOM 0 HA ASN A 71 -8.780 0.370 -14.534 1.00 73.10 H new ATOM 0 HB2 ASN A 71 -9.518 1.001 -16.896 1.00 4.54 H new ATOM 0 HB3 ASN A 71 -8.815 -0.518 -17.413 1.00 4.54 H new ATOM 0 HD21 ASN A 71 -11.560 0.882 -16.121 1.00 22.22 H new ATOM 0 HD22 ASN A 71 -12.344 -0.594 -15.550 1.00 22.22 H new ATOM 1024 N ILE A 72 -7.207 -1.509 -13.945 1.00 65.13 N ATOM 1025 CA ILE A 72 -6.410 -2.646 -13.499 1.00 62.43 C ATOM 1026 C ILE A 72 -7.222 -3.448 -12.493 1.00 32.33 C ATOM 1027 O ILE A 72 -7.594 -2.948 -11.431 1.00 24.02 O ATOM 1028 CB ILE A 72 -5.077 -2.182 -12.888 1.00 23.34 C ATOM 1029 CG1 ILE A 72 -4.333 -1.273 -13.894 1.00 33.15 C ATOM 1030 CG2 ILE A 72 -4.204 -3.360 -12.444 1.00 50.43 C ATOM 1031 CD1 ILE A 72 -2.966 -0.754 -13.462 1.00 14.51 C ATOM 0 H ILE A 72 -7.505 -0.911 -13.174 1.00 65.13 H new ATOM 0 HA ILE A 72 -6.167 -3.276 -14.355 1.00 62.43 H new ATOM 0 HB ILE A 72 -5.296 -1.608 -11.987 1.00 23.34 H new ATOM 0 HG12 ILE A 72 -4.209 -1.825 -14.825 1.00 33.15 H new ATOM 0 HG13 ILE A 72 -4.969 -0.416 -14.114 1.00 33.15 H new ATOM 0 HG21 ILE A 72 -3.274 -2.983 -12.019 1.00 50.43 H new ATOM 0 HG22 ILE A 72 -4.736 -3.944 -11.693 1.00 50.43 H new ATOM 0 HG23 ILE A 72 -3.981 -3.992 -13.304 1.00 50.43 H new ATOM 0 HD11 ILE A 72 -2.548 -0.130 -14.252 1.00 14.51 H new ATOM 0 HD12 ILE A 72 -3.072 -0.165 -12.551 1.00 14.51 H new ATOM 0 HD13 ILE A 72 -2.300 -1.596 -13.274 1.00 14.51 H new ATOM 1042 N ASP A 73 -7.439 -4.715 -12.819 1.00 61.21 N ATOM 1043 CA ASP A 73 -7.926 -5.716 -11.879 1.00 51.43 C ATOM 1044 C ASP A 73 -6.762 -6.095 -10.973 1.00 14.41 C ATOM 1045 O ASP A 73 -5.686 -6.474 -11.456 1.00 42.21 O ATOM 1046 CB ASP A 73 -8.430 -6.970 -12.607 1.00 64.24 C ATOM 1047 CG ASP A 73 -9.950 -7.125 -12.597 1.00 11.52 C ATOM 1048 OD1 ASP A 73 -10.630 -6.634 -11.669 1.00 21.13 O ATOM 1049 OD2 ASP A 73 -10.441 -7.827 -13.507 1.00 43.53 O ATOM 0 H ASP A 73 -7.279 -5.082 -13.757 1.00 61.21 H new ATOM 0 HA ASP A 73 -8.761 -5.306 -11.311 1.00 51.43 H new ATOM 0 HB2 ASP A 73 -8.085 -6.941 -13.640 1.00 64.24 H new ATOM 0 HB3 ASP A 73 -7.982 -7.850 -12.146 1.00 64.24 H new ATOM 1053 N TYR A 74 -6.957 -5.998 -9.663 1.00 63.25 N ATOM 1054 CA TYR A 74 -5.992 -6.499 -8.686 1.00 45.34 C ATOM 1055 C TYR A 74 -5.970 -8.031 -8.633 1.00 22.31 C ATOM 1056 O TYR A 74 -4.922 -8.618 -8.377 1.00 44.35 O ATOM 1057 CB TYR A 74 -6.235 -5.857 -7.317 1.00 74.33 C ATOM 1058 CG TYR A 74 -6.328 -4.345 -7.386 1.00 62.44 C ATOM 1059 CD1 TYR A 74 -5.208 -3.619 -7.813 1.00 34.22 C ATOM 1060 CD2 TYR A 74 -7.549 -3.682 -7.160 1.00 32.33 C ATOM 1061 CE1 TYR A 74 -5.316 -2.249 -8.091 1.00 74.15 C ATOM 1062 CE2 TYR A 74 -7.660 -2.302 -7.408 1.00 51.35 C ATOM 1063 CZ TYR A 74 -6.555 -1.586 -7.915 1.00 34.43 C ATOM 1064 OH TYR A 74 -6.685 -0.273 -8.250 1.00 22.44 O ATOM 0 H TYR A 74 -7.785 -5.572 -9.247 1.00 63.25 H new ATOM 0 HA TYR A 74 -4.993 -6.204 -9.009 1.00 45.34 H new ATOM 0 HB2 TYR A 74 -7.157 -6.254 -6.893 1.00 74.33 H new ATOM 0 HB3 TYR A 74 -5.427 -6.136 -6.641 1.00 74.33 H new ATOM 0 HD1 TYR A 74 -4.257 -4.117 -7.929 1.00 34.22 H new ATOM 0 HD2 TYR A 74 -8.403 -4.234 -6.795 1.00 32.33 H new ATOM 0 HE1 TYR A 74 -4.454 -1.699 -8.439 1.00 74.15 H new ATOM 0 HE2 TYR A 74 -8.591 -1.791 -7.210 1.00 51.35 H new ATOM 0 HH TYR A 74 -7.601 0.022 -8.066 1.00 22.44 H new ATOM 1073 N ASN A 75 -7.092 -8.691 -8.941 1.00 64.24 N ATOM 1074 CA ASN A 75 -7.269 -10.143 -8.760 1.00 32.44 C ATOM 1075 C ASN A 75 -6.315 -10.984 -9.591 1.00 23.10 C ATOM 1076 O ASN A 75 -6.088 -12.152 -9.278 1.00 61.14 O ATOM 1077 CB ASN A 75 -8.657 -10.608 -9.209 1.00 32.12 C ATOM 1078 CG ASN A 75 -9.772 -9.778 -8.642 1.00 72.44 C ATOM 1079 OD1 ASN A 75 -10.090 -8.757 -9.224 1.00 14.34 O ATOM 1080 ND2 ASN A 75 -10.323 -10.108 -7.491 1.00 41.42 N ATOM 0 H ASN A 75 -7.915 -8.229 -9.328 1.00 64.24 H new ATOM 0 HA ASN A 75 -7.094 -10.285 -7.694 1.00 32.44 H new ATOM 0 HB2 ASN A 75 -8.708 -10.578 -10.297 1.00 32.12 H new ATOM 0 HB3 ASN A 75 -8.799 -11.647 -8.911 1.00 32.12 H new ATOM 0 HD21 ASN A 75 -11.030 -9.504 -7.072 1.00 41.42 H new ATOM 0 HD22 ASN A 75 -10.043 -10.968 -7.019 1.00 41.42 H new ATOM 1086 N ASN A 76 -5.806 -10.437 -10.699 1.00 50.53 N ATOM 1087 CA ASN A 76 -5.010 -11.212 -11.649 1.00 33.24 C ATOM 1088 C ASN A 76 -3.635 -11.590 -11.084 1.00 62.04 C ATOM 1089 O ASN A 76 -2.868 -12.243 -11.791 1.00 72.01 O ATOM 1090 CB ASN A 76 -4.844 -10.452 -12.972 1.00 3.14 C ATOM 1091 CG ASN A 76 -6.163 -10.113 -13.642 1.00 2.41 C ATOM 1092 OD1 ASN A 76 -7.108 -10.899 -13.642 1.00 2.40 O ATOM 1093 ND2 ASN A 76 -6.271 -8.926 -14.211 1.00 14.33 N ATOM 0 H ASN A 76 -5.933 -9.459 -10.958 1.00 50.53 H new ATOM 0 HA ASN A 76 -5.556 -12.137 -11.834 1.00 33.24 H new ATOM 0 HB2 ASN A 76 -4.292 -9.531 -12.786 1.00 3.14 H new ATOM 0 HB3 ASN A 76 -4.242 -11.052 -13.654 1.00 3.14 H new ATOM 0 HD21 ASN A 76 -7.146 -8.652 -14.657 1.00 14.33 H new ATOM 0 HD22 ASN A 76 -5.479 -8.283 -14.204 1.00 14.33 H new ATOM 1099 N TYR A 77 -3.336 -11.185 -9.846 1.00 24.43 N ATOM 1100 CA TYR A 77 -2.107 -11.414 -9.116 1.00 72.21 C ATOM 1101 C TYR A 77 -2.501 -11.998 -7.756 1.00 21.11 C ATOM 1102 O TYR A 77 -3.629 -11.794 -7.298 1.00 10.44 O ATOM 1103 CB TYR A 77 -1.335 -10.077 -8.999 1.00 65.45 C ATOM 1104 CG TYR A 77 -1.180 -9.312 -10.312 1.00 14.12 C ATOM 1105 CD1 TYR A 77 -2.269 -8.577 -10.828 1.00 72.33 C ATOM 1106 CD2 TYR A 77 0.013 -9.382 -11.059 1.00 71.24 C ATOM 1107 CE1 TYR A 77 -2.204 -7.993 -12.105 1.00 30.02 C ATOM 1108 CE2 TYR A 77 0.105 -8.764 -12.319 1.00 61.14 C ATOM 1109 CZ TYR A 77 -1.010 -8.085 -12.853 1.00 53.55 C ATOM 1110 OH TYR A 77 -0.958 -7.566 -14.108 1.00 54.52 O ATOM 0 H TYR A 77 -4.005 -10.648 -9.295 1.00 24.43 H new ATOM 0 HA TYR A 77 -1.441 -12.116 -9.619 1.00 72.21 H new ATOM 0 HB2 TYR A 77 -1.849 -9.438 -8.281 1.00 65.45 H new ATOM 0 HB3 TYR A 77 -0.344 -10.280 -8.593 1.00 65.45 H new ATOM 0 HD1 TYR A 77 -3.164 -8.462 -10.234 1.00 72.33 H new ATOM 0 HD2 TYR A 77 0.864 -9.915 -10.661 1.00 71.24 H new ATOM 0 HE1 TYR A 77 -3.062 -7.477 -12.511 1.00 30.02 H new ATOM 0 HE2 TYR A 77 1.028 -8.809 -12.877 1.00 61.14 H new ATOM 0 HH TYR A 77 -1.826 -7.171 -14.335 1.00 54.52 H new ATOM 1119 N ASP A 78 -1.586 -12.708 -7.100 1.00 70.45 N ATOM 1120 CA ASP A 78 -1.834 -13.390 -5.823 1.00 14.24 C ATOM 1121 C ASP A 78 -1.162 -12.645 -4.668 1.00 34.22 C ATOM 1122 O ASP A 78 -1.434 -12.927 -3.502 1.00 14.31 O ATOM 1123 CB ASP A 78 -1.330 -14.836 -5.940 1.00 43.32 C ATOM 1124 CG ASP A 78 -1.757 -15.768 -4.801 1.00 43.43 C ATOM 1125 OD1 ASP A 78 -2.959 -15.787 -4.434 1.00 42.45 O ATOM 1126 OD2 ASP A 78 -0.962 -16.648 -4.401 1.00 3.20 O ATOM 0 H ASP A 78 -0.633 -12.830 -7.443 1.00 70.45 H new ATOM 0 HA ASP A 78 -2.902 -13.401 -5.606 1.00 14.24 H new ATOM 0 HB2 ASP A 78 -1.685 -15.253 -6.882 1.00 43.32 H new ATOM 0 HB3 ASP A 78 -0.241 -14.822 -5.988 1.00 43.32 H new ATOM 1130 N LEU A 79 -0.289 -11.681 -4.983 1.00 54.52 N ATOM 1131 CA LEU A 79 0.544 -10.965 -4.025 1.00 13.30 C ATOM 1132 C LEU A 79 0.659 -9.499 -4.458 1.00 2.41 C ATOM 1133 O LEU A 79 0.864 -9.223 -5.642 1.00 43.13 O ATOM 1134 CB LEU A 79 1.915 -11.664 -3.991 1.00 33.41 C ATOM 1135 CG LEU A 79 2.196 -12.372 -2.660 1.00 65.12 C ATOM 1136 CD1 LEU A 79 3.394 -13.307 -2.808 1.00 50.23 C ATOM 1137 CD2 LEU A 79 2.461 -11.341 -1.556 1.00 73.42 C ATOM 0 H LEU A 79 -0.142 -11.372 -5.944 1.00 54.52 H new ATOM 0 HA LEU A 79 0.114 -10.977 -3.024 1.00 13.30 H new ATOM 0 HB2 LEU A 79 1.965 -12.392 -4.801 1.00 33.41 H new ATOM 0 HB3 LEU A 79 2.697 -10.927 -4.176 1.00 33.41 H new ATOM 0 HG LEU A 79 1.322 -12.961 -2.383 1.00 65.12 H new ATOM 0 HD11 LEU A 79 3.586 -13.805 -1.858 1.00 50.23 H new ATOM 0 HD12 LEU A 79 3.180 -14.054 -3.573 1.00 50.23 H new ATOM 0 HD13 LEU A 79 4.272 -12.730 -3.099 1.00 50.23 H new ATOM 0 HD21 LEU A 79 2.659 -11.857 -0.616 1.00 73.42 H new ATOM 0 HD22 LEU A 79 3.325 -10.733 -1.825 1.00 73.42 H new ATOM 0 HD23 LEU A 79 1.588 -10.699 -1.440 1.00 73.42 H new ATOM 1148 N ILE A 80 0.510 -8.547 -3.531 1.00 44.33 N ATOM 1149 CA ILE A 80 0.451 -7.111 -3.834 1.00 23.31 C ATOM 1150 C ILE A 80 1.296 -6.333 -2.816 1.00 64.25 C ATOM 1151 O ILE A 80 0.938 -6.247 -1.642 1.00 1.22 O ATOM 1152 CB ILE A 80 -1.019 -6.632 -3.926 1.00 72.33 C ATOM 1153 CG1 ILE A 80 -1.718 -7.303 -5.135 1.00 21.02 C ATOM 1154 CG2 ILE A 80 -1.076 -5.108 -4.090 1.00 54.32 C ATOM 1155 CD1 ILE A 80 -3.144 -6.829 -5.437 1.00 44.24 C ATOM 0 H ILE A 80 0.426 -8.754 -2.536 1.00 44.33 H new ATOM 0 HA ILE A 80 0.885 -6.916 -4.815 1.00 23.31 H new ATOM 0 HB ILE A 80 -1.531 -6.911 -3.005 1.00 72.33 H new ATOM 0 HG12 ILE A 80 -1.106 -7.136 -6.021 1.00 21.02 H new ATOM 0 HG13 ILE A 80 -1.743 -8.379 -4.963 1.00 21.02 H new ATOM 0 HG21 ILE A 80 -2.116 -4.787 -4.153 1.00 54.32 H new ATOM 0 HG22 ILE A 80 -0.601 -4.632 -3.232 1.00 54.32 H new ATOM 0 HG23 ILE A 80 -0.552 -4.820 -5.001 1.00 54.32 H new ATOM 0 HD11 ILE A 80 -3.531 -7.367 -6.302 1.00 44.24 H new ATOM 0 HD12 ILE A 80 -3.782 -7.022 -4.575 1.00 44.24 H new ATOM 0 HD13 ILE A 80 -3.135 -5.760 -5.649 1.00 44.24 H new ATOM 1166 N LEU A 81 2.412 -5.751 -3.263 1.00 5.50 N ATOM 1167 CA LEU A 81 3.318 -4.933 -2.456 1.00 65.13 C ATOM 1168 C LEU A 81 3.074 -3.449 -2.723 1.00 4.34 C ATOM 1169 O LEU A 81 2.582 -3.067 -3.793 1.00 72.05 O ATOM 1170 CB LEU A 81 4.789 -5.287 -2.755 1.00 13.52 C ATOM 1171 CG LEU A 81 5.149 -6.767 -2.517 1.00 74.14 C ATOM 1172 CD1 LEU A 81 6.517 -7.114 -3.104 1.00 14.34 C ATOM 1173 CD2 LEU A 81 5.139 -7.051 -1.016 1.00 74.02 C ATOM 0 H LEU A 81 2.719 -5.840 -4.231 1.00 5.50 H new ATOM 0 HA LEU A 81 3.118 -5.142 -1.405 1.00 65.13 H new ATOM 0 HB2 LEU A 81 5.007 -5.035 -3.793 1.00 13.52 H new ATOM 0 HB3 LEU A 81 5.433 -4.665 -2.134 1.00 13.52 H new ATOM 0 HG LEU A 81 4.407 -7.387 -3.020 1.00 74.14 H new ATOM 0 HD11 LEU A 81 6.737 -8.165 -2.917 1.00 14.34 H new ATOM 0 HD12 LEU A 81 6.509 -6.930 -4.178 1.00 14.34 H new ATOM 0 HD13 LEU A 81 7.282 -6.494 -2.636 1.00 14.34 H new ATOM 0 HD21 LEU A 81 5.393 -8.097 -0.842 1.00 74.02 H new ATOM 0 HD22 LEU A 81 5.870 -6.413 -0.520 1.00 74.02 H new ATOM 0 HD23 LEU A 81 4.147 -6.847 -0.614 1.00 74.02 H new ATOM 1184 N ILE A 82 3.425 -2.598 -1.752 1.00 45.35 N ATOM 1185 CA ILE A 82 3.072 -1.181 -1.751 1.00 23.10 C ATOM 1186 C ILE A 82 4.170 -0.368 -1.041 1.00 72.14 C ATOM 1187 O ILE A 82 4.379 -0.562 0.160 1.00 32.22 O ATOM 1188 CB ILE A 82 1.709 -0.970 -1.034 1.00 32.24 C ATOM 1189 CG1 ILE A 82 0.571 -1.931 -1.456 1.00 31.13 C ATOM 1190 CG2 ILE A 82 1.289 0.480 -1.296 1.00 73.14 C ATOM 1191 CD1 ILE A 82 -0.712 -1.787 -0.626 1.00 1.53 C ATOM 0 H ILE A 82 3.969 -2.881 -0.937 1.00 45.35 H new ATOM 0 HA ILE A 82 2.985 -0.838 -2.782 1.00 23.10 H new ATOM 0 HB ILE A 82 1.863 -1.192 0.022 1.00 32.24 H new ATOM 0 HG12 ILE A 82 0.333 -1.757 -2.505 1.00 31.13 H new ATOM 0 HG13 ILE A 82 0.929 -2.958 -1.377 1.00 31.13 H new ATOM 0 HG21 ILE A 82 0.333 0.675 -0.810 1.00 73.14 H new ATOM 0 HG22 ILE A 82 2.045 1.156 -0.896 1.00 73.14 H new ATOM 0 HG23 ILE A 82 1.190 0.642 -2.369 1.00 73.14 H new ATOM 0 HD11 ILE A 82 -1.459 -2.495 -0.985 1.00 1.53 H new ATOM 0 HD12 ILE A 82 -0.492 -1.992 0.422 1.00 1.53 H new ATOM 0 HD13 ILE A 82 -1.097 -0.772 -0.725 1.00 1.53 H new ATOM 1202 N GLY A 83 4.817 0.578 -1.729 1.00 2.52 N ATOM 1203 CA GLY A 83 5.763 1.527 -1.128 1.00 3.40 C ATOM 1204 C GLY A 83 5.188 2.948 -1.048 1.00 14.24 C ATOM 1205 O GLY A 83 4.448 3.368 -1.944 1.00 10.42 O ATOM 0 H GLY A 83 4.697 0.709 -2.733 1.00 2.52 H new ATOM 0 HA2 GLY A 83 6.029 1.188 -0.127 1.00 3.40 H new ATOM 0 HA3 GLY A 83 6.682 1.541 -1.714 1.00 3.40 H new ATOM 1209 N SER A 84 5.540 3.696 0.006 1.00 11.44 N ATOM 1210 CA SER A 84 5.160 5.085 0.290 1.00 5.14 C ATOM 1211 C SER A 84 6.063 5.672 1.403 1.00 31.01 C ATOM 1212 O SER A 84 6.768 4.906 2.065 1.00 64.13 O ATOM 1213 CB SER A 84 3.679 5.129 0.702 1.00 54.44 C ATOM 1214 OG SER A 84 3.368 4.191 1.719 1.00 5.43 O ATOM 0 H SER A 84 6.143 3.317 0.736 1.00 11.44 H new ATOM 0 HA SER A 84 5.297 5.693 -0.605 1.00 5.14 H new ATOM 0 HB2 SER A 84 3.432 6.132 1.050 1.00 54.44 H new ATOM 0 HB3 SER A 84 3.057 4.932 -0.171 1.00 54.44 H new ATOM 0 HG SER A 84 2.417 4.259 1.947 1.00 5.43 H new ATOM 1219 N PRO A 85 6.105 7.006 1.624 1.00 23.01 N ATOM 1220 CA PRO A 85 6.976 7.636 2.627 1.00 24.13 C ATOM 1221 C PRO A 85 6.314 7.771 4.015 1.00 44.14 C ATOM 1222 O PRO A 85 5.091 7.658 4.123 1.00 30.45 O ATOM 1223 CB PRO A 85 7.285 9.017 2.039 1.00 72.33 C ATOM 1224 CG PRO A 85 5.973 9.377 1.340 1.00 62.14 C ATOM 1225 CD PRO A 85 5.501 8.031 0.783 1.00 70.13 C ATOM 0 HA PRO A 85 7.863 7.030 2.808 1.00 24.13 H new ATOM 0 HB2 PRO A 85 7.545 9.739 2.813 1.00 72.33 H new ATOM 0 HB3 PRO A 85 8.121 8.983 1.341 1.00 72.33 H new ATOM 0 HG2 PRO A 85 5.249 9.803 2.035 1.00 62.14 H new ATOM 0 HG3 PRO A 85 6.125 10.111 0.548 1.00 62.14 H new ATOM 0 HD2 PRO A 85 4.413 7.961 0.805 1.00 70.13 H new ATOM 0 HD3 PRO A 85 5.807 7.911 -0.256 1.00 70.13 H new ATOM 1230 N VAL A 86 7.074 8.112 5.069 1.00 63.11 N ATOM 1231 CA VAL A 86 6.544 8.496 6.388 1.00 51.50 C ATOM 1232 C VAL A 86 7.550 9.356 7.171 1.00 4.24 C ATOM 1233 O VAL A 86 8.750 9.115 7.075 1.00 54.44 O ATOM 1234 CB VAL A 86 6.147 7.225 7.169 1.00 23.21 C ATOM 1235 CG1 VAL A 86 7.275 6.248 7.522 1.00 51.52 C ATOM 1236 CG2 VAL A 86 5.352 7.567 8.439 1.00 31.01 C ATOM 0 H VAL A 86 8.093 8.129 5.027 1.00 63.11 H new ATOM 0 HA VAL A 86 5.656 9.112 6.248 1.00 51.50 H new ATOM 0 HB VAL A 86 5.526 6.691 6.450 1.00 23.21 H new ATOM 0 HG11 VAL A 86 6.864 5.399 8.069 1.00 51.52 H new ATOM 0 HG12 VAL A 86 7.750 5.894 6.607 1.00 51.52 H new ATOM 0 HG13 VAL A 86 8.015 6.755 8.142 1.00 51.52 H new ATOM 0 HG21 VAL A 86 5.090 6.648 8.963 1.00 31.01 H new ATOM 0 HG22 VAL A 86 5.960 8.195 9.090 1.00 31.01 H new ATOM 0 HG23 VAL A 86 4.442 8.101 8.166 1.00 31.01 H new ATOM 1246 N TRP A 87 7.101 10.260 8.051 1.00 52.33 N ATOM 1247 CA TRP A 87 7.987 10.826 9.074 1.00 32.31 C ATOM 1248 C TRP A 87 7.295 11.379 10.314 1.00 34.21 C ATOM 1249 O TRP A 87 7.994 11.751 11.255 1.00 54.21 O ATOM 1250 CB TRP A 87 8.940 11.862 8.457 1.00 33.15 C ATOM 1251 CG TRP A 87 10.146 12.233 9.255 1.00 44.20 C ATOM 1252 CD1 TRP A 87 10.863 11.419 10.063 1.00 45.12 C ATOM 1253 CD2 TRP A 87 10.816 13.519 9.293 1.00 64.13 C ATOM 1254 NE1 TRP A 87 11.923 12.114 10.602 1.00 41.20 N ATOM 1255 CE2 TRP A 87 11.960 13.409 10.140 1.00 63.13 C ATOM 1256 CE3 TRP A 87 10.589 14.760 8.665 1.00 61.02 C ATOM 1257 CZ2 TRP A 87 12.867 14.465 10.309 1.00 71.00 C ATOM 1258 CZ3 TRP A 87 11.494 15.822 8.824 1.00 3.51 C ATOM 1259 CH2 TRP A 87 12.638 15.670 9.625 1.00 45.21 C ATOM 0 H TRP A 87 6.143 10.611 8.076 1.00 52.33 H new ATOM 0 HA TRP A 87 8.559 9.976 9.446 1.00 32.31 H new ATOM 0 HB2 TRP A 87 9.276 11.481 7.493 1.00 33.15 H new ATOM 0 HB3 TRP A 87 8.371 12.771 8.260 1.00 33.15 H new ATOM 0 HD1 TRP A 87 10.638 10.381 10.256 1.00 45.12 H new ATOM 0 HE1 TRP A 87 12.595 11.719 11.260 1.00 41.20 H new ATOM 0 HE3 TRP A 87 9.709 14.896 8.054 1.00 61.02 H new ATOM 0 HZ2 TRP A 87 13.726 14.354 10.954 1.00 71.00 H new ATOM 0 HZ3 TRP A 87 11.309 16.763 8.327 1.00 3.51 H new ATOM 0 HH2 TRP A 87 13.344 16.483 9.715 1.00 45.21 H new ATOM 1269 N SER A 88 5.969 11.327 10.415 1.00 5.53 N ATOM 1270 CA SER A 88 5.247 11.860 11.568 1.00 43.40 C ATOM 1271 C SER A 88 4.155 10.904 12.078 1.00 32.23 C ATOM 1272 O SER A 88 3.321 11.281 12.903 1.00 45.24 O ATOM 1273 CB SER A 88 4.725 13.262 11.214 1.00 31.33 C ATOM 1274 OG SER A 88 4.228 13.306 9.883 1.00 62.11 O ATOM 0 H SER A 88 5.366 10.916 9.702 1.00 5.53 H new ATOM 0 HA SER A 88 5.929 11.951 12.413 1.00 43.40 H new ATOM 0 HB2 SER A 88 3.935 13.545 11.909 1.00 31.33 H new ATOM 0 HB3 SER A 88 5.527 13.991 11.330 1.00 31.33 H new ATOM 0 HG SER A 88 3.281 13.557 9.896 1.00 62.11 H new ATOM 1279 N GLY A 89 4.154 9.661 11.593 1.00 43.13 N ATOM 1280 CA GLY A 89 3.087 8.710 11.825 1.00 50.21 C ATOM 1281 C GLY A 89 2.459 8.306 10.505 1.00 24.03 C ATOM 1282 O GLY A 89 2.543 7.135 10.145 1.00 30.42 O ATOM 0 H GLY A 89 4.911 9.289 11.020 1.00 43.13 H new ATOM 0 HA2 GLY A 89 3.477 7.830 12.336 1.00 50.21 H new ATOM 0 HA3 GLY A 89 2.332 9.149 12.477 1.00 50.21 H new ATOM 1286 N TYR A 90 1.828 9.250 9.810 1.00 63.10 N ATOM 1287 CA TYR A 90 1.018 9.018 8.622 1.00 14.12 C ATOM 1288 C TYR A 90 0.872 10.328 7.836 1.00 14.31 C ATOM 1289 O TYR A 90 -0.222 10.882 7.791 1.00 2.12 O ATOM 1290 CB TYR A 90 -0.350 8.401 9.011 1.00 53.21 C ATOM 1291 CG TYR A 90 -1.104 8.931 10.237 1.00 65.22 C ATOM 1292 CD1 TYR A 90 -0.857 10.196 10.809 1.00 2.31 C ATOM 1293 CD2 TYR A 90 -2.095 8.120 10.821 1.00 61.10 C ATOM 1294 CE1 TYR A 90 -1.495 10.600 11.992 1.00 43.24 C ATOM 1295 CE2 TYR A 90 -2.747 8.512 12.002 1.00 1.14 C ATOM 1296 CZ TYR A 90 -2.435 9.751 12.609 1.00 73.22 C ATOM 1297 OH TYR A 90 -3.062 10.151 13.750 1.00 2.43 O ATOM 0 H TYR A 90 1.870 10.235 10.071 1.00 63.10 H new ATOM 0 HA TYR A 90 1.512 8.297 7.971 1.00 14.12 H new ATOM 0 HB2 TYR A 90 -1.011 8.508 8.151 1.00 53.21 H new ATOM 0 HB3 TYR A 90 -0.194 7.333 9.162 1.00 53.21 H new ATOM 0 HD1 TYR A 90 -0.162 10.868 10.327 1.00 2.31 H new ATOM 0 HD2 TYR A 90 -2.358 7.182 10.354 1.00 61.10 H new ATOM 0 HE1 TYR A 90 -1.266 11.561 12.429 1.00 43.24 H new ATOM 0 HE2 TYR A 90 -3.489 7.866 12.448 1.00 1.14 H new ATOM 0 HH TYR A 90 -3.680 9.451 14.046 1.00 2.43 H new ATOM 1306 N PRO A 91 1.950 10.891 7.259 1.00 13.44 N ATOM 1307 CA PRO A 91 1.874 12.176 6.576 1.00 12.51 C ATOM 1308 C PRO A 91 1.153 12.056 5.236 1.00 43.53 C ATOM 1309 O PRO A 91 0.461 12.984 4.826 1.00 31.45 O ATOM 1310 CB PRO A 91 3.324 12.617 6.374 1.00 21.23 C ATOM 1311 CG PRO A 91 4.082 11.299 6.270 1.00 30.24 C ATOM 1312 CD PRO A 91 3.302 10.369 7.202 1.00 22.04 C ATOM 0 HA PRO A 91 1.305 12.900 7.159 1.00 12.51 H new ATOM 0 HB2 PRO A 91 3.439 13.219 5.473 1.00 21.23 H new ATOM 0 HB3 PRO A 91 3.680 13.221 7.208 1.00 21.23 H new ATOM 0 HG2 PRO A 91 4.097 10.923 5.247 1.00 30.24 H new ATOM 0 HG3 PRO A 91 5.120 11.406 6.585 1.00 30.24 H new ATOM 0 HD2 PRO A 91 3.308 9.346 6.825 1.00 22.04 H new ATOM 0 HD3 PRO A 91 3.752 10.346 8.194 1.00 22.04 H new ATOM 1317 N ALA A 92 1.321 10.932 4.540 1.00 62.00 N ATOM 1318 CA ALA A 92 0.829 10.755 3.195 1.00 31.14 C ATOM 1319 C ALA A 92 -0.509 10.012 3.260 1.00 74.30 C ATOM 1320 O ALA A 92 -0.761 9.235 4.190 1.00 3.22 O ATOM 1321 CB ALA A 92 1.911 10.005 2.397 1.00 41.24 C ATOM 0 H ALA A 92 1.810 10.116 4.908 1.00 62.00 H new ATOM 0 HA ALA A 92 0.639 11.701 2.687 1.00 31.14 H new ATOM 0 HB1 ALA A 92 1.569 9.855 1.373 1.00 41.24 H new ATOM 0 HB2 ALA A 92 2.830 10.591 2.391 1.00 41.24 H new ATOM 0 HB3 ALA A 92 2.101 9.037 2.862 1.00 41.24 H new ATOM 1327 N THR A 93 -1.317 10.137 2.210 1.00 72.02 N ATOM 1328 CA THR A 93 -2.514 9.310 2.032 1.00 70.02 C ATOM 1329 C THR A 93 -2.585 8.771 0.581 1.00 11.34 C ATOM 1330 O THR A 93 -3.646 8.791 -0.039 1.00 50.22 O ATOM 1331 CB THR A 93 -3.742 10.190 2.396 1.00 44.11 C ATOM 1332 OG1 THR A 93 -3.476 11.557 2.150 1.00 52.52 O ATOM 1333 CG2 THR A 93 -4.139 10.094 3.865 1.00 10.33 C ATOM 0 H THR A 93 -1.164 10.811 1.460 1.00 72.02 H new ATOM 0 HA THR A 93 -2.492 8.435 2.681 1.00 70.02 H new ATOM 0 HB THR A 93 -4.550 9.810 1.771 1.00 44.11 H new ATOM 0 HG1 THR A 93 -3.114 11.662 1.245 1.00 52.52 H new ATOM 0 HG21 THR A 93 -5.003 10.733 4.051 1.00 10.33 H new ATOM 0 HG22 THR A 93 -4.392 9.062 4.107 1.00 10.33 H new ATOM 0 HG23 THR A 93 -3.306 10.419 4.489 1.00 10.33 H new ATOM 1341 N PRO A 94 -1.524 8.130 0.043 1.00 1.22 N ATOM 1342 CA PRO A 94 -1.548 7.477 -1.271 1.00 43.31 C ATOM 1343 C PRO A 94 -2.007 6.025 -1.166 1.00 30.15 C ATOM 1344 O PRO A 94 -2.296 5.385 -2.179 1.00 42.12 O ATOM 1345 CB PRO A 94 -0.090 7.520 -1.759 1.00 43.33 C ATOM 1346 CG PRO A 94 0.687 7.383 -0.449 1.00 44.13 C ATOM 1347 CD PRO A 94 -0.140 8.254 0.465 1.00 43.24 C ATOM 0 HA PRO A 94 -2.242 7.977 -1.947 1.00 43.31 H new ATOM 0 HB2 PRO A 94 0.132 6.709 -2.452 1.00 43.33 H new ATOM 0 HB3 PRO A 94 0.140 8.452 -2.275 1.00 43.33 H new ATOM 0 HG2 PRO A 94 0.735 6.350 -0.103 1.00 44.13 H new ATOM 0 HG3 PRO A 94 1.714 7.737 -0.539 1.00 44.13 H new ATOM 0 HD2 PRO A 94 -0.025 7.940 1.503 1.00 43.24 H new ATOM 0 HD3 PRO A 94 0.188 9.292 0.407 1.00 43.24 H new ATOM 1352 N ILE A 95 -2.031 5.468 0.047 1.00 13.45 N ATOM 1353 CA ILE A 95 -2.505 4.124 0.305 1.00 32.01 C ATOM 1354 C ILE A 95 -3.758 4.261 1.180 1.00 64.10 C ATOM 1355 O ILE A 95 -3.876 3.624 2.224 1.00 43.34 O ATOM 1356 CB ILE A 95 -1.394 3.229 0.902 1.00 23.02 C ATOM 1357 CG1 ILE A 95 0.078 3.539 0.533 1.00 3.45 C ATOM 1358 CG2 ILE A 95 -1.722 1.762 0.584 1.00 53.55 C ATOM 1359 CD1 ILE A 95 0.433 3.630 -0.959 1.00 22.03 C ATOM 0 H ILE A 95 -1.714 5.954 0.886 1.00 13.45 H new ATOM 0 HA ILE A 95 -2.776 3.606 -0.615 1.00 32.01 H new ATOM 0 HB ILE A 95 -1.418 3.455 1.968 1.00 23.02 H new ATOM 0 HG12 ILE A 95 0.350 4.485 1.001 1.00 3.45 H new ATOM 0 HG13 ILE A 95 0.706 2.769 0.982 1.00 3.45 H new ATOM 0 HG21 ILE A 95 -0.947 1.118 0.999 1.00 53.55 H new ATOM 0 HG22 ILE A 95 -2.685 1.501 1.024 1.00 53.55 H new ATOM 0 HG23 ILE A 95 -1.768 1.625 -0.496 1.00 53.55 H new ATOM 0 HD11 ILE A 95 1.495 3.852 -1.068 1.00 22.03 H new ATOM 0 HD12 ILE A 95 0.209 2.680 -1.445 1.00 22.03 H new ATOM 0 HD13 ILE A 95 -0.153 4.423 -1.425 1.00 22.03 H new ATOM 1370 N LYS A 96 -4.665 5.144 0.754 1.00 61.04 N ATOM 1371 CA LYS A 96 -6.021 5.274 1.274 1.00 73.24 C ATOM 1372 C LYS A 96 -6.983 4.920 0.147 1.00 71.34 C ATOM 1373 O LYS A 96 -7.560 3.836 0.138 1.00 63.02 O ATOM 1374 CB LYS A 96 -6.277 6.656 1.920 1.00 45.20 C ATOM 1375 CG LYS A 96 -6.617 6.574 3.421 1.00 5.55 C ATOM 1376 CD LYS A 96 -7.971 5.905 3.722 1.00 63.01 C ATOM 1377 CE LYS A 96 -8.392 6.131 5.179 1.00 3.24 C ATOM 1378 NZ LYS A 96 -9.844 5.930 5.365 1.00 53.21 N ATOM 0 H LYS A 96 -4.463 5.811 0.009 1.00 61.04 H new ATOM 0 HA LYS A 96 -6.183 4.579 2.098 1.00 73.24 H new ATOM 0 HB2 LYS A 96 -5.393 7.280 1.788 1.00 45.20 H new ATOM 0 HB3 LYS A 96 -7.096 7.148 1.395 1.00 45.20 H new ATOM 0 HG2 LYS A 96 -5.829 6.021 3.932 1.00 5.55 H new ATOM 0 HG3 LYS A 96 -6.621 7.581 3.838 1.00 5.55 H new ATOM 0 HD2 LYS A 96 -8.734 6.306 3.054 1.00 63.01 H new ATOM 0 HD3 LYS A 96 -7.903 4.836 3.522 1.00 63.01 H new ATOM 0 HE2 LYS A 96 -7.844 5.447 5.827 1.00 3.24 H new ATOM 0 HE3 LYS A 96 -8.123 7.142 5.483 1.00 3.24 H new ATOM 0 HZ1 LYS A 96 -10.092 6.091 6.362 1.00 53.21 H new ATOM 0 HZ2 LYS A 96 -10.367 6.600 4.766 1.00 53.21 H new ATOM 0 HZ3 LYS A 96 -10.097 4.957 5.098 1.00 53.21 H new ATOM 1388 N THR A 97 -7.076 5.785 -0.860 1.00 73.34 N ATOM 1389 CA THR A 97 -7.973 5.668 -1.997 1.00 53.20 C ATOM 1390 C THR A 97 -7.795 4.305 -2.676 1.00 70.30 C ATOM 1391 O THR A 97 -8.779 3.607 -2.863 1.00 5.41 O ATOM 1392 CB THR A 97 -7.685 6.843 -2.949 1.00 43.13 C ATOM 1393 OG1 THR A 97 -7.617 8.070 -2.254 1.00 71.21 O ATOM 1394 CG2 THR A 97 -8.657 6.996 -4.118 1.00 10.51 C ATOM 0 H THR A 97 -6.499 6.625 -0.903 1.00 73.34 H new ATOM 0 HA THR A 97 -9.015 5.719 -1.681 1.00 53.20 H new ATOM 0 HB THR A 97 -6.718 6.586 -3.380 1.00 43.13 H new ATOM 0 HG1 THR A 97 -6.679 8.311 -2.106 1.00 71.21 H new ATOM 0 HG21 THR A 97 -8.364 7.852 -4.725 1.00 10.51 H new ATOM 0 HG22 THR A 97 -8.636 6.094 -4.729 1.00 10.51 H new ATOM 0 HG23 THR A 97 -9.665 7.151 -3.735 1.00 10.51 H new ATOM 1402 N LEU A 98 -6.567 3.880 -3.009 1.00 22.44 N ATOM 1403 CA LEU A 98 -6.340 2.618 -3.730 1.00 61.24 C ATOM 1404 C LEU A 98 -6.941 1.440 -2.946 1.00 43.31 C ATOM 1405 O LEU A 98 -7.749 0.696 -3.486 1.00 70.43 O ATOM 1406 CB LEU A 98 -4.833 2.440 -4.015 1.00 65.03 C ATOM 1407 CG LEU A 98 -4.406 1.388 -5.065 1.00 51.43 C ATOM 1408 CD1 LEU A 98 -4.883 -0.038 -4.819 1.00 25.30 C ATOM 1409 CD2 LEU A 98 -4.784 1.784 -6.486 1.00 11.13 C ATOM 0 H LEU A 98 -5.713 4.393 -2.790 1.00 22.44 H new ATOM 0 HA LEU A 98 -6.849 2.646 -4.693 1.00 61.24 H new ATOM 0 HB2 LEU A 98 -4.438 3.405 -4.332 1.00 65.03 H new ATOM 0 HB3 LEU A 98 -4.344 2.188 -3.074 1.00 65.03 H new ATOM 0 HG LEU A 98 -3.323 1.382 -4.945 1.00 51.43 H new ATOM 0 HD11 LEU A 98 -4.523 -0.685 -5.619 1.00 25.30 H new ATOM 0 HD12 LEU A 98 -4.495 -0.392 -3.864 1.00 25.30 H new ATOM 0 HD13 LEU A 98 -5.973 -0.059 -4.798 1.00 25.30 H new ATOM 0 HD21 LEU A 98 -4.459 1.008 -7.179 1.00 11.13 H new ATOM 0 HD22 LEU A 98 -5.865 1.903 -6.555 1.00 11.13 H new ATOM 0 HD23 LEU A 98 -4.299 2.726 -6.743 1.00 11.13 H new ATOM 1420 N LEU A 99 -6.621 1.284 -1.657 1.00 43.21 N ATOM 1421 CA LEU A 99 -7.212 0.231 -0.818 1.00 71.12 C ATOM 1422 C LEU A 99 -8.738 0.375 -0.724 1.00 34.02 C ATOM 1423 O LEU A 99 -9.444 -0.629 -0.659 1.00 2.22 O ATOM 1424 CB LEU A 99 -6.637 0.304 0.603 1.00 43.14 C ATOM 1425 CG LEU A 99 -5.314 -0.436 0.831 1.00 44.14 C ATOM 1426 CD1 LEU A 99 -4.770 -0.046 2.203 1.00 61.22 C ATOM 1427 CD2 LEU A 99 -5.479 -1.960 0.814 1.00 30.34 C ATOM 0 H LEU A 99 -5.951 1.877 -1.167 1.00 43.21 H new ATOM 0 HA LEU A 99 -6.970 -0.725 -1.282 1.00 71.12 H new ATOM 0 HB2 LEU A 99 -6.493 1.353 0.862 1.00 43.14 H new ATOM 0 HB3 LEU A 99 -7.378 -0.096 1.295 1.00 43.14 H new ATOM 0 HG LEU A 99 -4.641 -0.155 0.021 1.00 44.14 H new ATOM 0 HD11 LEU A 99 -3.828 -0.564 2.382 1.00 61.22 H new ATOM 0 HD12 LEU A 99 -4.604 1.031 2.236 1.00 61.22 H new ATOM 0 HD13 LEU A 99 -5.489 -0.326 2.973 1.00 61.22 H new ATOM 0 HD21 LEU A 99 -4.511 -2.433 0.980 1.00 30.34 H new ATOM 0 HD22 LEU A 99 -6.170 -2.260 1.602 1.00 30.34 H new ATOM 0 HD23 LEU A 99 -5.874 -2.272 -0.153 1.00 30.34 H new ATOM 1438 N ASP A 100 -9.263 1.606 -0.743 1.00 15.55 N ATOM 1439 CA ASP A 100 -10.707 1.884 -0.745 1.00 3.14 C ATOM 1440 C ASP A 100 -11.375 1.420 -2.045 1.00 14.31 C ATOM 1441 O ASP A 100 -12.585 1.189 -2.081 1.00 33.04 O ATOM 1442 CB ASP A 100 -10.959 3.387 -0.537 1.00 44.11 C ATOM 1443 CG ASP A 100 -12.333 3.652 0.069 1.00 21.03 C ATOM 1444 OD1 ASP A 100 -12.457 3.553 1.314 1.00 21.01 O ATOM 1445 OD2 ASP A 100 -13.263 4.060 -0.660 1.00 62.41 O ATOM 0 H ASP A 100 -8.690 2.450 -0.758 1.00 15.55 H new ATOM 0 HA ASP A 100 -11.149 1.322 0.078 1.00 3.14 H new ATOM 0 HB2 ASP A 100 -10.189 3.798 0.115 1.00 44.11 H new ATOM 0 HB3 ASP A 100 -10.877 3.905 -1.493 1.00 44.11 H new ATOM 1449 N GLN A 101 -10.588 1.243 -3.113 1.00 42.20 N ATOM 1450 CA GLN A 101 -11.025 0.611 -4.346 1.00 3.32 C ATOM 1451 C GLN A 101 -10.928 -0.907 -4.191 1.00 73.32 C ATOM 1452 O GLN A 101 -11.812 -1.618 -4.667 1.00 15.25 O ATOM 1453 CB GLN A 101 -10.185 1.078 -5.547 1.00 12.42 C ATOM 1454 CG GLN A 101 -10.253 2.593 -5.789 1.00 62.33 C ATOM 1455 CD GLN A 101 -9.457 3.040 -7.006 1.00 11.51 C ATOM 1456 OE1 GLN A 101 -9.029 2.228 -7.823 1.00 54.11 O ATOM 1457 NE2 GLN A 101 -9.247 4.334 -7.150 1.00 10.35 N ATOM 0 H GLN A 101 -9.613 1.543 -3.137 1.00 42.20 H new ATOM 0 HA GLN A 101 -12.058 0.900 -4.538 1.00 3.32 H new ATOM 0 HB2 GLN A 101 -9.146 0.790 -5.388 1.00 12.42 H new ATOM 0 HB3 GLN A 101 -10.526 0.559 -6.443 1.00 12.42 H new ATOM 0 HG2 GLN A 101 -11.295 2.888 -5.915 1.00 62.33 H new ATOM 0 HG3 GLN A 101 -9.879 3.113 -4.907 1.00 62.33 H new ATOM 0 HE21 GLN A 101 -9.612 4.990 -6.459 1.00 10.35 H new ATOM 0 HE22 GLN A 101 -8.720 4.679 -7.952 1.00 10.35 H new ATOM 1464 N MET A 102 -9.896 -1.431 -3.518 1.00 31.14 N ATOM 1465 CA MET A 102 -9.667 -2.868 -3.374 1.00 14.12 C ATOM 1466 C MET A 102 -10.647 -3.557 -2.395 1.00 51.22 C ATOM 1467 O MET A 102 -10.299 -4.577 -1.819 1.00 60.32 O ATOM 1468 CB MET A 102 -8.218 -3.236 -2.979 1.00 1.44 C ATOM 1469 CG MET A 102 -7.054 -2.604 -3.740 1.00 12.54 C ATOM 1470 SD MET A 102 -5.421 -2.869 -2.976 1.00 62.23 S ATOM 1471 CE MET A 102 -5.173 -4.640 -3.254 1.00 64.35 C ATOM 0 H MET A 102 -9.190 -0.859 -3.054 1.00 31.14 H new ATOM 0 HA MET A 102 -9.854 -3.249 -4.378 1.00 14.12 H new ATOM 0 HB2 MET A 102 -8.093 -2.989 -1.925 1.00 1.44 H new ATOM 0 HB3 MET A 102 -8.119 -4.318 -3.067 1.00 1.44 H new ATOM 0 HG2 MET A 102 -7.037 -3.006 -4.753 1.00 12.54 H new ATOM 0 HG3 MET A 102 -7.232 -1.532 -3.826 1.00 12.54 H new ATOM 0 HE1 MET A 102 -4.212 -4.943 -2.838 1.00 64.35 H new ATOM 0 HE2 MET A 102 -5.972 -5.200 -2.768 1.00 64.35 H new ATOM 0 HE3 MET A 102 -5.186 -4.846 -4.324 1.00 64.35 H new ATOM 1479 N LYS A 103 -11.893 -3.136 -2.192 1.00 52.53 N ATOM 1480 CA LYS A 103 -12.724 -3.752 -1.140 1.00 20.00 C ATOM 1481 C LYS A 103 -13.181 -5.195 -1.395 1.00 1.34 C ATOM 1482 O LYS A 103 -13.656 -5.837 -0.460 1.00 43.52 O ATOM 1483 CB LYS A 103 -13.950 -2.866 -0.896 1.00 0.22 C ATOM 1484 CG LYS A 103 -13.553 -1.549 -0.230 1.00 63.12 C ATOM 1485 CD LYS A 103 -13.378 -1.711 1.290 1.00 21.00 C ATOM 1486 CE LYS A 103 -12.110 -1.001 1.769 1.00 24.04 C ATOM 1487 NZ LYS A 103 -12.218 -0.600 3.183 1.00 42.31 N ATOM 0 H LYS A 103 -12.347 -2.392 -2.721 1.00 52.53 H new ATOM 0 HA LYS A 103 -12.075 -3.820 -0.267 1.00 20.00 H new ATOM 0 HB2 LYS A 103 -14.450 -2.662 -1.843 1.00 0.22 H new ATOM 0 HB3 LYS A 103 -14.665 -3.395 -0.266 1.00 0.22 H new ATOM 0 HG2 LYS A 103 -12.623 -1.186 -0.667 1.00 63.12 H new ATOM 0 HG3 LYS A 103 -14.315 -0.796 -0.431 1.00 63.12 H new ATOM 0 HD2 LYS A 103 -14.246 -1.302 1.806 1.00 21.00 H new ATOM 0 HD3 LYS A 103 -13.326 -2.770 1.544 1.00 21.00 H new ATOM 0 HE2 LYS A 103 -11.252 -1.661 1.641 1.00 24.04 H new ATOM 0 HE3 LYS A 103 -11.930 -0.120 1.153 1.00 24.04 H new ATOM 0 HZ1 LYS A 103 -11.342 -0.122 3.476 1.00 42.31 H new ATOM 0 HZ2 LYS A 103 -13.023 0.049 3.299 1.00 42.31 H new ATOM 0 HZ3 LYS A 103 -12.366 -1.444 3.773 1.00 42.31 H new ATOM 1497 N ASN A 104 -13.047 -5.723 -2.617 1.00 63.32 N ATOM 1498 CA ASN A 104 -13.530 -7.059 -3.003 1.00 52.41 C ATOM 1499 C ASN A 104 -12.406 -8.047 -3.325 1.00 62.35 C ATOM 1500 O ASN A 104 -12.635 -9.092 -3.949 1.00 1.24 O ATOM 1501 CB ASN A 104 -14.537 -6.922 -4.157 1.00 34.24 C ATOM 1502 CG ASN A 104 -15.924 -6.870 -3.565 1.00 40.41 C ATOM 1503 OD1 ASN A 104 -16.560 -7.909 -3.415 1.00 54.54 O ATOM 1504 ND2 ASN A 104 -16.363 -5.707 -3.125 1.00 34.23 N ATOM 0 H ASN A 104 -12.591 -5.226 -3.382 1.00 63.32 H new ATOM 0 HA ASN A 104 -14.034 -7.493 -2.139 1.00 52.41 H new ATOM 0 HB2 ASN A 104 -14.335 -6.019 -4.733 1.00 34.24 H new ATOM 0 HB3 ASN A 104 -14.447 -7.765 -4.843 1.00 34.24 H new ATOM 0 HD21 ASN A 104 -17.259 -5.650 -2.641 1.00 34.23 H new ATOM 0 HD22 ASN A 104 -15.806 -4.864 -3.268 1.00 34.23 H new ATOM 1510 N TYR A 105 -11.177 -7.720 -2.937 1.00 32.40 N ATOM 1511 CA TYR A 105 -9.978 -8.352 -3.453 1.00 73.42 C ATOM 1512 C TYR A 105 -9.358 -9.226 -2.384 1.00 24.11 C ATOM 1513 O TYR A 105 -9.669 -9.140 -1.194 1.00 13.53 O ATOM 1514 CB TYR A 105 -9.046 -7.266 -3.997 1.00 3.13 C ATOM 1515 CG TYR A 105 -9.667 -6.587 -5.200 1.00 2.53 C ATOM 1516 CD1 TYR A 105 -10.588 -5.576 -4.946 1.00 61.33 C ATOM 1517 CD2 TYR A 105 -9.428 -6.983 -6.524 1.00 41.11 C ATOM 1518 CE1 TYR A 105 -11.251 -4.897 -5.978 1.00 55.43 C ATOM 1519 CE2 TYR A 105 -10.023 -6.266 -7.581 1.00 24.21 C ATOM 1520 CZ TYR A 105 -10.942 -5.229 -7.312 1.00 41.42 C ATOM 1521 OH TYR A 105 -11.512 -4.548 -8.341 1.00 71.13 O ATOM 0 H TYR A 105 -10.989 -6.996 -2.244 1.00 32.40 H new ATOM 0 HA TYR A 105 -10.203 -9.020 -4.284 1.00 73.42 H new ATOM 0 HB2 TYR A 105 -8.845 -6.529 -3.220 1.00 3.13 H new ATOM 0 HB3 TYR A 105 -8.088 -7.706 -4.275 1.00 3.13 H new ATOM 0 HD1 TYR A 105 -10.799 -5.306 -3.922 1.00 61.33 H new ATOM 0 HD2 TYR A 105 -8.793 -7.831 -6.732 1.00 41.11 H new ATOM 0 HE1 TYR A 105 -11.983 -4.135 -5.755 1.00 55.43 H new ATOM 0 HE2 TYR A 105 -9.774 -6.511 -8.603 1.00 24.21 H new ATOM 0 HH TYR A 105 -11.186 -4.908 -9.192 1.00 71.13 H new ATOM 1530 N ARG A 106 -8.525 -10.128 -2.875 1.00 55.51 N ATOM 1531 CA ARG A 106 -7.888 -11.221 -2.176 1.00 40.24 C ATOM 1532 C ARG A 106 -6.517 -11.418 -2.812 1.00 75.43 C ATOM 1533 O ARG A 106 -6.190 -10.702 -3.761 1.00 15.33 O ATOM 1534 CB ARG A 106 -8.782 -12.432 -2.073 1.00 11.24 C ATOM 1535 CG ARG A 106 -9.500 -12.830 -3.349 1.00 11.43 C ATOM 1536 CD ARG A 106 -10.884 -13.250 -2.874 1.00 53.41 C ATOM 1537 NE ARG A 106 -11.656 -13.913 -3.932 1.00 31.01 N ATOM 1538 CZ ARG A 106 -12.254 -13.326 -4.976 1.00 62.13 C ATOM 1539 NH1 ARG A 106 -12.347 -12.004 -5.097 1.00 31.14 N ATOM 1540 NH2 ARG A 106 -12.766 -14.075 -5.940 1.00 73.05 N ATOM 0 H ARG A 106 -8.257 -10.108 -3.859 1.00 55.51 H new ATOM 0 HA ARG A 106 -7.719 -10.999 -1.122 1.00 40.24 H new ATOM 0 HB2 ARG A 106 -8.181 -13.277 -1.737 1.00 11.24 H new ATOM 0 HB3 ARG A 106 -9.528 -12.245 -1.301 1.00 11.24 H new ATOM 0 HG2 ARG A 106 -9.554 -11.999 -4.053 1.00 11.43 H new ATOM 0 HG3 ARG A 106 -8.987 -13.646 -3.858 1.00 11.43 H new ATOM 0 HD2 ARG A 106 -10.785 -13.923 -2.023 1.00 53.41 H new ATOM 0 HD3 ARG A 106 -11.428 -12.372 -2.525 1.00 53.41 H new ATOM 0 HE ARG A 106 -11.746 -14.927 -3.865 1.00 31.01 H new ATOM 0 HH11 ARG A 106 -11.954 -11.397 -4.378 1.00 31.14 H new ATOM 0 HH12 ARG A 106 -12.811 -11.598 -5.909 1.00 31.14 H new ATOM 0 HH21 ARG A 106 -12.703 -15.092 -5.884 1.00 73.05 H new ATOM 0 HH22 ARG A 106 -13.223 -13.636 -6.739 1.00 73.05 H new ATOM 1551 N GLY A 107 -5.721 -12.337 -2.286 1.00 3.53 N ATOM 1552 CA GLY A 107 -4.281 -12.282 -2.453 1.00 70.02 C ATOM 1553 C GLY A 107 -3.682 -11.640 -1.206 1.00 21.13 C ATOM 1554 O GLY A 107 -4.388 -11.274 -0.261 1.00 74.22 O ATOM 0 H GLY A 107 -6.052 -13.131 -1.738 1.00 3.53 H new ATOM 0 HA2 GLY A 107 -3.876 -13.284 -2.597 1.00 70.02 H new ATOM 0 HA3 GLY A 107 -4.023 -11.704 -3.340 1.00 70.02 H new ATOM 1558 N GLU A 108 -2.361 -11.554 -1.170 1.00 41.31 N ATOM 1559 CA GLU A 108 -1.590 -11.328 0.038 1.00 14.41 C ATOM 1560 C GLU A 108 -0.978 -9.939 -0.064 1.00 50.21 C ATOM 1561 O GLU A 108 -0.113 -9.691 -0.906 1.00 65.22 O ATOM 1562 CB GLU A 108 -0.582 -12.472 0.189 1.00 22.01 C ATOM 1563 CG GLU A 108 -1.255 -13.778 0.629 1.00 22.02 C ATOM 1564 CD GLU A 108 -0.319 -14.974 0.531 1.00 24.10 C ATOM 1565 OE1 GLU A 108 0.818 -14.912 1.061 1.00 3.31 O ATOM 1566 OE2 GLU A 108 -0.725 -15.980 -0.091 1.00 11.21 O ATOM 0 H GLU A 108 -1.782 -11.642 -2.005 1.00 41.31 H new ATOM 0 HA GLU A 108 -2.190 -11.340 0.948 1.00 14.41 H new ATOM 0 HB2 GLU A 108 -0.069 -12.630 -0.760 1.00 22.01 H new ATOM 0 HB3 GLU A 108 0.177 -12.192 0.919 1.00 22.01 H new ATOM 0 HG2 GLU A 108 -1.603 -13.676 1.657 1.00 22.02 H new ATOM 0 HG3 GLU A 108 -2.135 -13.957 0.011 1.00 22.02 H new ATOM 1571 N VAL A 109 -1.492 -8.999 0.726 1.00 65.41 N ATOM 1572 CA VAL A 109 -1.092 -7.595 0.633 1.00 3.30 C ATOM 1573 C VAL A 109 -0.004 -7.281 1.670 1.00 74.35 C ATOM 1574 O VAL A 109 -0.158 -7.646 2.838 1.00 44.44 O ATOM 1575 CB VAL A 109 -2.342 -6.696 0.770 1.00 13.13 C ATOM 1576 CG1 VAL A 109 -2.003 -5.217 0.515 1.00 4.32 C ATOM 1577 CG2 VAL A 109 -3.464 -7.092 -0.212 1.00 64.31 C ATOM 0 H VAL A 109 -2.192 -9.186 1.444 1.00 65.41 H new ATOM 0 HA VAL A 109 -0.652 -7.390 -0.343 1.00 3.30 H new ATOM 0 HB VAL A 109 -2.689 -6.837 1.794 1.00 13.13 H new ATOM 0 HG11 VAL A 109 -2.905 -4.614 0.620 1.00 4.32 H new ATOM 0 HG12 VAL A 109 -1.258 -4.885 1.238 1.00 4.32 H new ATOM 0 HG13 VAL A 109 -1.605 -5.103 -0.494 1.00 4.32 H new ATOM 0 HG21 VAL A 109 -4.319 -6.430 -0.074 1.00 64.31 H new ATOM 0 HG22 VAL A 109 -3.099 -7.006 -1.235 1.00 64.31 H new ATOM 0 HG23 VAL A 109 -3.768 -8.121 -0.021 1.00 64.31 H new ATOM 1587 N ALA A 110 1.053 -6.557 1.289 1.00 22.14 N ATOM 1588 CA ALA A 110 2.028 -6.014 2.234 1.00 12.20 C ATOM 1589 C ALA A 110 2.443 -4.591 1.868 1.00 12.24 C ATOM 1590 O ALA A 110 2.096 -4.067 0.807 1.00 50.24 O ATOM 1591 CB ALA A 110 3.254 -6.932 2.361 1.00 1.42 C ATOM 0 H ALA A 110 1.255 -6.332 0.315 1.00 22.14 H new ATOM 0 HA ALA A 110 1.540 -5.970 3.208 1.00 12.20 H new ATOM 0 HB1 ALA A 110 3.960 -6.500 3.071 1.00 1.42 H new ATOM 0 HB2 ALA A 110 2.938 -7.914 2.715 1.00 1.42 H new ATOM 0 HB3 ALA A 110 3.734 -7.034 1.388 1.00 1.42 H new ATOM 1597 N SER A 111 3.193 -3.940 2.759 1.00 74.23 N ATOM 1598 CA SER A 111 3.765 -2.628 2.510 1.00 11.50 C ATOM 1599 C SER A 111 5.195 -2.572 3.049 1.00 4.32 C ATOM 1600 O SER A 111 5.513 -3.220 4.051 1.00 42.13 O ATOM 1601 CB SER A 111 2.852 -1.549 3.112 1.00 4.11 C ATOM 1602 OG SER A 111 3.186 -0.264 2.613 1.00 53.41 O ATOM 0 H SER A 111 3.419 -4.317 3.679 1.00 74.23 H new ATOM 0 HA SER A 111 3.827 -2.436 1.439 1.00 11.50 H new ATOM 0 HB2 SER A 111 1.812 -1.775 2.877 1.00 4.11 H new ATOM 0 HB3 SER A 111 2.942 -1.556 4.198 1.00 4.11 H new ATOM 0 HG SER A 111 3.740 -0.359 1.810 1.00 53.41 H new ATOM 1607 N PHE A 112 6.042 -1.785 2.375 1.00 64.43 N ATOM 1608 CA PHE A 112 7.478 -1.728 2.599 1.00 44.51 C ATOM 1609 C PHE A 112 7.980 -0.296 2.373 1.00 13.52 C ATOM 1610 O PHE A 112 8.094 0.154 1.232 1.00 21.00 O ATOM 1611 CB PHE A 112 8.185 -2.782 1.723 1.00 12.52 C ATOM 1612 CG PHE A 112 8.253 -2.533 0.220 1.00 63.11 C ATOM 1613 CD1 PHE A 112 7.112 -2.649 -0.603 1.00 41.11 C ATOM 1614 CD2 PHE A 112 9.496 -2.242 -0.374 1.00 21.20 C ATOM 1615 CE1 PHE A 112 7.223 -2.446 -1.990 1.00 43.13 C ATOM 1616 CE2 PHE A 112 9.596 -2.001 -1.748 1.00 14.32 C ATOM 1617 CZ PHE A 112 8.464 -2.127 -2.564 1.00 34.40 C ATOM 0 H PHE A 112 5.730 -1.153 1.637 1.00 64.43 H new ATOM 0 HA PHE A 112 7.718 -1.978 3.632 1.00 44.51 H new ATOM 0 HB2 PHE A 112 9.205 -2.891 2.090 1.00 12.52 H new ATOM 0 HB3 PHE A 112 7.685 -3.738 1.881 1.00 12.52 H new ATOM 0 HD1 PHE A 112 6.154 -2.894 -0.168 1.00 41.11 H new ATOM 0 HD2 PHE A 112 10.384 -2.204 0.240 1.00 21.20 H new ATOM 0 HE1 PHE A 112 6.349 -2.536 -2.617 1.00 43.13 H new ATOM 0 HE2 PHE A 112 10.545 -1.718 -2.180 1.00 14.32 H new ATOM 0 HZ PHE A 112 8.546 -1.979 -3.631 1.00 34.40 H new ATOM 1626 N PHE A 113 8.283 0.439 3.445 1.00 41.54 N ATOM 1627 CA PHE A 113 8.664 1.854 3.368 1.00 22.41 C ATOM 1628 C PHE A 113 10.177 2.042 3.599 1.00 22.44 C ATOM 1629 O PHE A 113 10.797 1.261 4.332 1.00 44.34 O ATOM 1630 CB PHE A 113 7.817 2.642 4.385 1.00 50.42 C ATOM 1631 CG PHE A 113 8.200 2.409 5.832 1.00 23.42 C ATOM 1632 CD1 PHE A 113 7.844 1.227 6.505 1.00 41.34 C ATOM 1633 CD2 PHE A 113 8.993 3.361 6.485 1.00 41.34 C ATOM 1634 CE1 PHE A 113 8.360 0.968 7.785 1.00 71.13 C ATOM 1635 CE2 PHE A 113 9.454 3.139 7.788 1.00 62.35 C ATOM 1636 CZ PHE A 113 9.173 1.923 8.421 1.00 73.35 C ATOM 0 H PHE A 113 8.271 0.069 4.396 1.00 41.54 H new ATOM 0 HA PHE A 113 8.465 2.238 2.367 1.00 22.41 H new ATOM 0 HB2 PHE A 113 7.905 3.706 4.165 1.00 50.42 H new ATOM 0 HB3 PHE A 113 6.769 2.374 4.252 1.00 50.42 H new ATOM 0 HD1 PHE A 113 7.175 0.519 6.038 1.00 41.34 H new ATOM 0 HD2 PHE A 113 9.252 4.278 5.977 1.00 41.34 H new ATOM 0 HE1 PHE A 113 8.133 0.036 8.281 1.00 71.13 H new ATOM 0 HE2 PHE A 113 10.022 3.901 8.301 1.00 62.35 H new ATOM 0 HZ PHE A 113 9.581 1.718 9.400 1.00 73.35 H new ATOM 1645 N THR A 114 10.762 3.123 3.065 1.00 33.10 N ATOM 1646 CA THR A 114 12.166 3.500 3.250 1.00 61.24 C ATOM 1647 C THR A 114 12.237 4.880 3.907 1.00 22.44 C ATOM 1648 O THR A 114 12.733 5.846 3.315 1.00 61.35 O ATOM 1649 CB THR A 114 12.969 3.419 1.935 1.00 53.22 C ATOM 1650 OG1 THR A 114 12.616 4.429 1.004 1.00 63.44 O ATOM 1651 CG2 THR A 114 12.818 2.102 1.192 1.00 3.10 C ATOM 0 H THR A 114 10.252 3.779 2.473 1.00 33.10 H new ATOM 0 HA THR A 114 12.641 2.781 3.917 1.00 61.24 H new ATOM 0 HB THR A 114 13.995 3.540 2.281 1.00 53.22 H new ATOM 0 HG1 THR A 114 12.652 5.305 1.442 1.00 63.44 H new ATOM 0 HG21 THR A 114 13.414 2.128 0.280 1.00 3.10 H new ATOM 0 HG22 THR A 114 13.161 1.285 1.826 1.00 3.10 H new ATOM 0 HG23 THR A 114 11.770 1.947 0.936 1.00 3.10 H new ATOM 1659 N SER A 115 11.663 4.992 5.100 1.00 50.13 N ATOM 1660 CA SER A 115 11.508 6.257 5.810 1.00 50.54 C ATOM 1661 C SER A 115 11.703 6.057 7.319 1.00 13.22 C ATOM 1662 O SER A 115 11.160 6.790 8.151 1.00 12.40 O ATOM 1663 CB SER A 115 10.131 6.824 5.474 1.00 1.23 C ATOM 1664 OG SER A 115 9.827 6.848 4.095 1.00 21.33 O ATOM 0 H SER A 115 11.286 4.193 5.610 1.00 50.13 H new ATOM 0 HA SER A 115 12.270 6.970 5.495 1.00 50.54 H new ATOM 0 HB2 SER A 115 9.374 6.234 5.990 1.00 1.23 H new ATOM 0 HB3 SER A 115 10.065 7.839 5.865 1.00 1.23 H new ATOM 0 HG SER A 115 9.393 6.007 3.841 1.00 21.33 H new ATOM 1669 N ALA A 116 12.431 5.004 7.685 1.00 4.33 N ATOM 1670 CA ALA A 116 12.649 4.538 9.048 1.00 13.43 C ATOM 1671 C ALA A 116 13.575 5.448 9.867 1.00 25.42 C ATOM 1672 O ALA A 116 13.912 5.096 11.001 1.00 74.44 O ATOM 1673 CB ALA A 116 13.141 3.089 9.040 1.00 33.30 C ATOM 0 H ALA A 116 12.910 4.422 6.998 1.00 4.33 H new ATOM 0 HA ALA A 116 11.685 4.581 9.555 1.00 13.43 H new ATOM 0 HB1 ALA A 116 13.300 2.753 10.065 1.00 33.30 H new ATOM 0 HB2 ALA A 116 12.395 2.454 8.562 1.00 33.30 H new ATOM 0 HB3 ALA A 116 14.079 3.026 8.488 1.00 33.30 H new ATOM 1679 N GLY A 117 13.957 6.623 9.356 1.00 42.45 N ATOM 1680 CA GLY A 117 14.742 7.622 10.066 1.00 14.44 C ATOM 1681 C GLY A 117 14.202 7.939 11.456 1.00 62.12 C ATOM 1682 O GLY A 117 14.997 8.167 12.367 1.00 74.11 O ATOM 0 H GLY A 117 13.718 6.908 8.406 1.00 42.45 H new ATOM 0 HA2 GLY A 117 15.770 7.270 10.155 1.00 14.44 H new ATOM 0 HA3 GLY A 117 14.769 8.539 9.477 1.00 14.44 H new ATOM 1686 N THR A 118 12.879 7.993 11.663 1.00 33.23 N ATOM 1687 CA THR A 118 12.332 8.359 12.983 1.00 21.41 C ATOM 1688 C THR A 118 10.951 7.746 13.294 1.00 54.14 C ATOM 1689 O THR A 118 10.560 7.688 14.465 1.00 72.31 O ATOM 1690 CB THR A 118 12.334 9.902 13.128 1.00 65.32 C ATOM 1691 OG1 THR A 118 13.460 10.485 12.486 1.00 34.34 O ATOM 1692 CG2 THR A 118 12.424 10.355 14.582 1.00 54.44 C ATOM 0 H THR A 118 12.177 7.793 10.951 1.00 33.23 H new ATOM 0 HA THR A 118 12.988 7.920 13.735 1.00 21.41 H new ATOM 0 HB THR A 118 11.394 10.221 12.677 1.00 65.32 H new ATOM 0 HG1 THR A 118 13.623 11.377 12.858 1.00 34.34 H new ATOM 0 HG21 THR A 118 12.422 11.444 14.625 1.00 54.44 H new ATOM 0 HG22 THR A 118 11.569 9.968 15.137 1.00 54.44 H new ATOM 0 HG23 THR A 118 13.345 9.977 15.025 1.00 54.44 H new ATOM 1700 N ASN A 119 10.244 7.214 12.288 1.00 22.43 N ATOM 1701 CA ASN A 119 8.935 6.567 12.398 1.00 65.05 C ATOM 1702 C ASN A 119 9.115 5.128 11.927 1.00 50.32 C ATOM 1703 O ASN A 119 9.796 4.905 10.926 1.00 21.00 O ATOM 1704 CB ASN A 119 7.923 7.319 11.523 1.00 41.41 C ATOM 1705 CG ASN A 119 6.536 7.298 12.117 1.00 32.23 C ATOM 1706 OD1 ASN A 119 5.619 6.779 11.503 1.00 30.30 O ATOM 1707 ND2 ASN A 119 6.339 7.847 13.302 1.00 31.13 N ATOM 0 H ASN A 119 10.589 7.225 11.328 1.00 22.43 H new ATOM 0 HA ASN A 119 8.557 6.580 13.420 1.00 65.05 H new ATOM 0 HB2 ASN A 119 8.248 8.352 11.399 1.00 41.41 H new ATOM 0 HB3 ASN A 119 7.899 6.871 10.530 1.00 41.41 H new ATOM 0 HD21 ASN A 119 5.408 7.841 13.718 1.00 31.13 H new ATOM 0 HD22 ASN A 119 7.118 8.277 13.801 1.00 31.13 H new ATOM 1713 N HIS A 120 8.575 4.142 12.639 1.00 21.32 N ATOM 1714 CA HIS A 120 8.438 2.776 12.138 1.00 22.42 C ATOM 1715 C HIS A 120 7.199 2.171 12.773 1.00 25.32 C ATOM 1716 O HIS A 120 6.190 1.997 12.100 1.00 45.45 O ATOM 1717 CB HIS A 120 9.687 1.907 12.398 1.00 24.20 C ATOM 1718 CG HIS A 120 9.579 0.485 11.873 1.00 31.32 C ATOM 1719 ND1 HIS A 120 8.647 -0.003 10.989 1.00 62.43 N flip ATOM 1720 CD2 HIS A 120 10.443 -0.554 12.150 1.00 21.33 C flip ATOM 1721 CE1 HIS A 120 8.977 -1.323 10.689 1.00 25.24 C flip ATOM 1722 NE2 HIS A 120 10.058 -1.616 11.424 1.00 5.50 N flip ATOM 0 H HIS A 120 8.218 4.269 13.586 1.00 21.32 H new ATOM 0 HA HIS A 120 8.337 2.807 11.053 1.00 22.42 H new ATOM 0 HB2 HIS A 120 10.551 2.387 11.939 1.00 24.20 H new ATOM 0 HB3 HIS A 120 9.874 1.873 13.471 1.00 24.20 H new ATOM 0 HD2 HIS A 120 11.281 -0.519 12.830 1.00 21.33 H new ATOM 0 HE1 HIS A 120 8.464 -1.979 10.001 1.00 25.24 H new ATOM 0 HE2 HIS A 120 10.525 -2.523 11.431 1.00 5.50 H new ATOM 1729 N LYS A 121 7.245 1.895 14.077 1.00 52.41 N ATOM 1730 CA LYS A 121 6.151 1.240 14.783 1.00 52.24 C ATOM 1731 C LYS A 121 4.841 2.023 14.619 1.00 50.35 C ATOM 1732 O LYS A 121 3.791 1.395 14.484 1.00 11.13 O ATOM 1733 CB LYS A 121 6.578 0.999 16.239 1.00 23.31 C ATOM 1734 CG LYS A 121 5.956 -0.240 16.906 1.00 42.43 C ATOM 1735 CD LYS A 121 4.622 0.053 17.603 1.00 5.43 C ATOM 1736 CE LYS A 121 4.110 -1.178 18.364 1.00 54.33 C ATOM 1737 NZ LYS A 121 3.507 -2.195 17.478 1.00 52.32 N ATOM 0 H LYS A 121 8.043 2.121 14.671 1.00 52.41 H new ATOM 0 HA LYS A 121 5.938 0.263 14.349 1.00 52.24 H new ATOM 0 HB2 LYS A 121 7.663 0.903 16.272 1.00 23.31 H new ATOM 0 HB3 LYS A 121 6.318 1.878 16.828 1.00 23.31 H new ATOM 0 HG2 LYS A 121 5.802 -1.012 16.152 1.00 42.43 H new ATOM 0 HG3 LYS A 121 6.659 -0.643 17.636 1.00 42.43 H new ATOM 0 HD2 LYS A 121 4.746 0.886 18.295 1.00 5.43 H new ATOM 0 HD3 LYS A 121 3.882 0.360 16.864 1.00 5.43 H new ATOM 0 HE2 LYS A 121 4.936 -1.628 18.914 1.00 54.33 H new ATOM 0 HE3 LYS A 121 3.371 -0.862 19.100 1.00 54.33 H new ATOM 0 HZ1 LYS A 121 3.180 -3.001 18.047 1.00 52.32 H new ATOM 0 HZ2 LYS A 121 2.700 -1.779 16.971 1.00 52.32 H new ATOM 0 HZ3 LYS A 121 4.216 -2.521 16.791 1.00 52.32 H new ATOM 1747 N ALA A 122 4.896 3.362 14.524 1.00 51.43 N ATOM 1748 CA ALA A 122 3.726 4.162 14.198 1.00 65.11 C ATOM 1749 C ALA A 122 3.160 3.777 12.823 1.00 65.42 C ATOM 1750 O ALA A 122 1.997 3.397 12.739 1.00 22.44 O ATOM 1751 CB ALA A 122 4.140 5.627 14.235 1.00 23.12 C ATOM 0 H ALA A 122 5.746 3.906 14.671 1.00 51.43 H new ATOM 0 HA ALA A 122 2.932 3.981 14.923 1.00 65.11 H new ATOM 0 HB1 ALA A 122 3.282 6.254 13.994 1.00 23.12 H new ATOM 0 HB2 ALA A 122 4.504 5.877 15.232 1.00 23.12 H new ATOM 0 HB3 ALA A 122 4.932 5.800 13.506 1.00 23.12 H new ATOM 1757 N TYR A 123 3.970 3.870 11.759 1.00 22.00 N ATOM 1758 CA TYR A 123 3.587 3.570 10.376 1.00 71.41 C ATOM 1759 C TYR A 123 2.859 2.231 10.255 1.00 5.40 C ATOM 1760 O TYR A 123 1.857 2.148 9.546 1.00 2.41 O ATOM 1761 CB TYR A 123 4.829 3.565 9.464 1.00 71.32 C ATOM 1762 CG TYR A 123 4.520 3.195 8.021 1.00 13.23 C ATOM 1763 CD1 TYR A 123 4.086 4.180 7.116 1.00 71.03 C ATOM 1764 CD2 TYR A 123 4.582 1.848 7.605 1.00 61.24 C ATOM 1765 CE1 TYR A 123 3.673 3.819 5.822 1.00 14.24 C ATOM 1766 CE2 TYR A 123 4.145 1.475 6.320 1.00 64.23 C ATOM 1767 CZ TYR A 123 3.662 2.462 5.432 1.00 25.20 C ATOM 1768 OH TYR A 123 3.110 2.117 4.235 1.00 32.24 O ATOM 0 H TYR A 123 4.942 4.166 11.843 1.00 22.00 H new ATOM 0 HA TYR A 123 2.900 4.354 10.059 1.00 71.41 H new ATOM 0 HB2 TYR A 123 5.291 4.552 9.487 1.00 71.32 H new ATOM 0 HB3 TYR A 123 5.560 2.862 9.863 1.00 71.32 H new ATOM 0 HD1 TYR A 123 4.070 5.217 7.416 1.00 71.03 H new ATOM 0 HD2 TYR A 123 4.968 1.097 8.278 1.00 61.24 H new ATOM 0 HE1 TYR A 123 3.363 4.582 5.124 1.00 14.24 H new ATOM 0 HE2 TYR A 123 4.179 0.440 6.014 1.00 64.23 H new ATOM 0 HH TYR A 123 3.385 1.207 3.998 1.00 32.24 H new ATOM 1777 N VAL A 124 3.372 1.196 10.928 1.00 14.11 N ATOM 1778 CA VAL A 124 2.843 -0.164 10.878 1.00 71.21 C ATOM 1779 C VAL A 124 1.391 -0.163 11.354 1.00 61.14 C ATOM 1780 O VAL A 124 0.499 -0.710 10.701 1.00 73.45 O ATOM 1781 CB VAL A 124 3.721 -1.078 11.761 1.00 73.45 C ATOM 1782 CG1 VAL A 124 3.161 -2.502 11.897 1.00 21.10 C ATOM 1783 CG2 VAL A 124 5.154 -1.188 11.212 1.00 61.15 C ATOM 0 H VAL A 124 4.186 1.287 11.536 1.00 14.11 H new ATOM 0 HA VAL A 124 2.865 -0.543 9.856 1.00 71.21 H new ATOM 0 HB VAL A 124 3.723 -0.603 12.742 1.00 73.45 H new ATOM 0 HG11 VAL A 124 3.823 -3.094 12.529 1.00 21.10 H new ATOM 0 HG12 VAL A 124 2.169 -2.461 12.348 1.00 21.10 H new ATOM 0 HG13 VAL A 124 3.093 -2.962 10.911 1.00 21.10 H new ATOM 0 HG21 VAL A 124 5.742 -1.839 11.859 1.00 61.15 H new ATOM 0 HG22 VAL A 124 5.127 -1.605 10.205 1.00 61.15 H new ATOM 0 HG23 VAL A 124 5.609 -0.198 11.182 1.00 61.15 H new ATOM 1793 N SER A 125 1.182 0.461 12.508 1.00 63.24 N ATOM 1794 CA SER A 125 -0.101 0.622 13.146 1.00 14.34 C ATOM 1795 C SER A 125 -1.030 1.419 12.221 1.00 33.21 C ATOM 1796 O SER A 125 -2.102 0.941 11.865 1.00 33.32 O ATOM 1797 CB SER A 125 0.159 1.316 14.488 1.00 1.23 C ATOM 1798 OG SER A 125 -0.266 0.528 15.578 1.00 41.45 O ATOM 0 H SER A 125 1.942 0.884 13.041 1.00 63.24 H new ATOM 0 HA SER A 125 -0.602 -0.328 13.334 1.00 14.34 H new ATOM 0 HB2 SER A 125 1.224 1.528 14.587 1.00 1.23 H new ATOM 0 HB3 SER A 125 -0.360 2.274 14.508 1.00 1.23 H new ATOM 0 HG SER A 125 -0.082 1.002 16.416 1.00 41.45 H new ATOM 1803 N HIS A 126 -0.603 2.603 11.770 1.00 25.23 N ATOM 1804 CA HIS A 126 -1.406 3.474 10.919 1.00 1.12 C ATOM 1805 C HIS A 126 -1.785 2.819 9.591 1.00 3.31 C ATOM 1806 O HIS A 126 -2.853 3.120 9.062 1.00 64.33 O ATOM 1807 CB HIS A 126 -0.645 4.769 10.650 1.00 23.21 C ATOM 1808 CG HIS A 126 -0.379 5.575 11.893 1.00 33.32 C ATOM 1809 ND1 HIS A 126 0.798 6.219 12.173 1.00 13.34 N ATOM 1810 CD2 HIS A 126 -1.252 5.833 12.916 1.00 12.20 C ATOM 1811 CE1 HIS A 126 0.646 6.858 13.342 1.00 1.13 C ATOM 1812 NE2 HIS A 126 -0.583 6.648 13.840 1.00 42.41 N ATOM 0 H HIS A 126 0.318 2.983 11.990 1.00 25.23 H new ATOM 0 HA HIS A 126 -2.334 3.679 11.453 1.00 1.12 H new ATOM 0 HB2 HIS A 126 0.304 4.531 10.170 1.00 23.21 H new ATOM 0 HB3 HIS A 126 -1.214 5.377 9.947 1.00 23.21 H new ATOM 0 HD1 HIS A 126 1.639 6.213 11.596 1.00 13.34 H new ATOM 0 HD2 HIS A 126 -2.268 5.475 12.996 1.00 12.20 H new ATOM 0 HE1 HIS A 126 1.407 7.459 13.817 1.00 1.13 H new ATOM 1819 N PHE A 127 -0.936 1.946 9.040 1.00 1.42 N ATOM 1820 CA PHE A 127 -1.270 1.229 7.822 1.00 53.52 C ATOM 1821 C PHE A 127 -2.421 0.283 8.112 1.00 24.31 C ATOM 1822 O PHE A 127 -3.413 0.312 7.391 1.00 2.31 O ATOM 1823 CB PHE A 127 -0.073 0.451 7.260 1.00 53.32 C ATOM 1824 CG PHE A 127 -0.389 -0.318 5.987 1.00 12.21 C ATOM 1825 CD1 PHE A 127 -1.087 0.290 4.925 1.00 63.02 C ATOM 1826 CD2 PHE A 127 0.000 -1.662 5.867 1.00 72.02 C ATOM 1827 CE1 PHE A 127 -1.343 -0.429 3.745 1.00 41.44 C ATOM 1828 CE2 PHE A 127 -0.261 -2.387 4.693 1.00 71.22 C ATOM 1829 CZ PHE A 127 -0.931 -1.766 3.627 1.00 61.31 C ATOM 0 H PHE A 127 -0.017 1.724 9.423 1.00 1.42 H new ATOM 0 HA PHE A 127 -1.558 1.957 7.063 1.00 53.52 H new ATOM 0 HB2 PHE A 127 0.741 1.148 7.061 1.00 53.32 H new ATOM 0 HB3 PHE A 127 0.283 -0.247 8.017 1.00 53.32 H new ATOM 0 HD1 PHE A 127 -1.426 1.311 5.018 1.00 63.02 H new ATOM 0 HD2 PHE A 127 0.507 -2.145 6.689 1.00 72.02 H new ATOM 0 HE1 PHE A 127 -1.859 0.049 2.925 1.00 41.44 H new ATOM 0 HE2 PHE A 127 0.052 -3.417 4.611 1.00 71.22 H new ATOM 0 HZ PHE A 127 -1.129 -2.315 2.718 1.00 61.31 H new ATOM 1838 N ASN A 128 -2.295 -0.513 9.181 1.00 50.43 N ATOM 1839 CA ASN A 128 -3.328 -1.445 9.612 1.00 40.43 C ATOM 1840 C ASN A 128 -4.664 -0.724 9.733 1.00 51.24 C ATOM 1841 O ASN A 128 -5.645 -1.220 9.180 1.00 0.10 O ATOM 1842 CB ASN A 128 -2.967 -2.146 10.927 1.00 61.22 C ATOM 1843 CG ASN A 128 -2.154 -3.415 10.714 1.00 61.21 C ATOM 1844 OD1 ASN A 128 -2.712 -4.502 10.576 1.00 23.32 O ATOM 1845 ND2 ASN A 128 -0.836 -3.311 10.676 1.00 74.02 N ATOM 0 H ASN A 128 -1.464 -0.523 9.772 1.00 50.43 H new ATOM 0 HA ASN A 128 -3.408 -2.222 8.852 1.00 40.43 H new ATOM 0 HB2 ASN A 128 -2.402 -1.459 11.557 1.00 61.22 H new ATOM 0 HB3 ASN A 128 -3.882 -2.392 11.466 1.00 61.22 H new ATOM 0 HD21 ASN A 128 -0.263 -4.142 10.530 1.00 74.02 H new ATOM 0 HD22 ASN A 128 -0.393 -2.400 10.793 1.00 74.02 H new ATOM 1851 N GLU A 129 -4.705 0.459 10.365 1.00 53.55 N ATOM 1852 CA GLU A 129 -5.947 1.197 10.533 1.00 43.54 C ATOM 1853 C GLU A 129 -6.690 1.398 9.218 1.00 72.42 C ATOM 1854 O GLU A 129 -7.916 1.267 9.165 1.00 21.24 O ATOM 1855 CB GLU A 129 -5.731 2.576 11.162 1.00 51.23 C ATOM 1856 CG GLU A 129 -4.981 2.673 12.487 1.00 15.31 C ATOM 1857 CD GLU A 129 -5.468 1.798 13.643 1.00 41.51 C ATOM 1858 OE1 GLU A 129 -6.633 1.326 13.618 1.00 0.34 O ATOM 1859 OE2 GLU A 129 -4.695 1.668 14.625 1.00 73.31 O ATOM 0 H GLU A 129 -3.887 0.918 10.765 1.00 53.55 H new ATOM 0 HA GLU A 129 -6.545 0.578 11.202 1.00 43.54 H new ATOM 0 HB2 GLU A 129 -5.198 3.189 10.436 1.00 51.23 H new ATOM 0 HB3 GLU A 129 -6.711 3.030 11.304 1.00 51.23 H new ATOM 0 HG2 GLU A 129 -3.935 2.430 12.299 1.00 15.31 H new ATOM 0 HG3 GLU A 129 -5.013 3.712 12.816 1.00 15.31 H new ATOM 1864 N TRP A 130 -5.961 1.769 8.172 1.00 55.51 N ATOM 1865 CA TRP A 130 -6.548 2.127 6.894 1.00 14.53 C ATOM 1866 C TRP A 130 -6.686 0.865 6.023 1.00 72.34 C ATOM 1867 O TRP A 130 -7.343 0.914 4.986 1.00 55.52 O ATOM 1868 CB TRP A 130 -5.703 3.288 6.327 1.00 60.44 C ATOM 1869 CG TRP A 130 -5.776 4.580 7.122 1.00 15.52 C ATOM 1870 CD1 TRP A 130 -6.526 4.801 8.233 1.00 55.14 C ATOM 1871 CD2 TRP A 130 -5.070 5.847 6.901 1.00 41.43 C ATOM 1872 NE1 TRP A 130 -6.402 6.108 8.651 1.00 13.25 N ATOM 1873 CE2 TRP A 130 -5.522 6.801 7.858 1.00 63.40 C ATOM 1874 CE3 TRP A 130 -4.105 6.306 5.981 1.00 23.24 C ATOM 1875 CZ2 TRP A 130 -5.087 8.129 7.863 1.00 14.53 C ATOM 1876 CZ3 TRP A 130 -3.608 7.625 6.019 1.00 33.13 C ATOM 1877 CH2 TRP A 130 -4.116 8.552 6.946 1.00 14.15 C ATOM 0 H TRP A 130 -4.943 1.829 8.190 1.00 55.51 H new ATOM 0 HA TRP A 130 -7.570 2.500 6.956 1.00 14.53 H new ATOM 0 HB2 TRP A 130 -4.662 2.969 6.275 1.00 60.44 H new ATOM 0 HB3 TRP A 130 -6.026 3.488 5.306 1.00 60.44 H new ATOM 0 HD1 TRP A 130 -7.135 4.055 8.721 1.00 55.14 H new ATOM 0 HE1 TRP A 130 -6.899 6.508 9.446 1.00 13.25 H new ATOM 0 HE3 TRP A 130 -3.736 5.628 5.226 1.00 23.24 H new ATOM 0 HZ2 TRP A 130 -5.500 8.829 8.574 1.00 14.53 H new ATOM 0 HZ3 TRP A 130 -2.832 7.925 5.331 1.00 33.13 H new ATOM 0 HH2 TRP A 130 -3.764 9.573 6.951 1.00 14.15 H new ATOM 1887 N ALA A 131 -6.159 -0.295 6.433 1.00 74.33 N ATOM 1888 CA ALA A 131 -6.034 -1.487 5.582 1.00 53.45 C ATOM 1889 C ALA A 131 -6.814 -2.697 6.098 1.00 0.43 C ATOM 1890 O ALA A 131 -6.840 -3.739 5.432 1.00 74.03 O ATOM 1891 CB ALA A 131 -4.553 -1.838 5.393 1.00 60.11 C ATOM 0 H ALA A 131 -5.802 -0.435 7.378 1.00 74.33 H new ATOM 0 HA ALA A 131 -6.483 -1.234 4.621 1.00 53.45 H new ATOM 0 HB1 ALA A 131 -4.466 -2.722 4.762 1.00 60.11 H new ATOM 0 HB2 ALA A 131 -4.039 -1.002 4.919 1.00 60.11 H new ATOM 0 HB3 ALA A 131 -4.100 -2.040 6.364 1.00 60.11 H new ATOM 1897 N ASP A 132 -7.436 -2.583 7.269 1.00 61.11 N ATOM 1898 CA ASP A 132 -8.158 -3.636 7.978 1.00 42.52 C ATOM 1899 C ASP A 132 -9.459 -4.024 7.263 1.00 53.42 C ATOM 1900 O ASP A 132 -10.570 -3.633 7.628 1.00 11.14 O ATOM 1901 CB ASP A 132 -8.428 -3.156 9.398 1.00 0.23 C ATOM 1902 CG ASP A 132 -8.871 -4.263 10.347 1.00 60.14 C ATOM 1903 OD1 ASP A 132 -8.443 -5.430 10.182 1.00 40.14 O ATOM 1904 OD2 ASP A 132 -9.566 -3.945 11.335 1.00 73.01 O ATOM 0 H ASP A 132 -7.450 -1.700 7.779 1.00 61.11 H new ATOM 0 HA ASP A 132 -7.547 -4.538 8.000 1.00 42.52 H new ATOM 0 HB2 ASP A 132 -7.524 -2.692 9.793 1.00 0.23 H new ATOM 0 HB3 ASP A 132 -9.197 -2.384 9.371 1.00 0.23 H new ATOM 1908 N GLY A 133 -9.320 -4.754 6.168 1.00 73.42 N ATOM 1909 CA GLY A 133 -10.384 -5.489 5.491 1.00 14.54 C ATOM 1910 C GLY A 133 -9.892 -6.266 4.270 1.00 22.24 C ATOM 1911 O GLY A 133 -10.650 -7.039 3.678 1.00 43.31 O ATOM 0 H GLY A 133 -8.419 -4.857 5.702 1.00 73.42 H new ATOM 0 HA2 GLY A 133 -10.843 -6.183 6.195 1.00 14.54 H new ATOM 0 HA3 GLY A 133 -11.160 -4.790 5.181 1.00 14.54 H new ATOM 1915 N LEU A 134 -8.642 -6.053 3.849 1.00 1.13 N ATOM 1916 CA LEU A 134 -7.938 -6.930 2.934 1.00 32.00 C ATOM 1917 C LEU A 134 -6.997 -7.815 3.756 1.00 40.54 C ATOM 1918 O LEU A 134 -6.654 -7.483 4.895 1.00 60.41 O ATOM 1919 CB LEU A 134 -7.121 -6.049 1.992 1.00 60.33 C ATOM 1920 CG LEU A 134 -7.914 -5.213 0.972 1.00 41.32 C ATOM 1921 CD1 LEU A 134 -8.366 -6.033 -0.258 1.00 64.25 C ATOM 1922 CD2 LEU A 134 -9.076 -4.335 1.455 1.00 3.51 C ATOM 0 H LEU A 134 -8.089 -5.249 4.145 1.00 1.13 H new ATOM 0 HA LEU A 134 -8.625 -7.555 2.364 1.00 32.00 H new ATOM 0 HB2 LEU A 134 -6.520 -5.369 2.596 1.00 60.33 H new ATOM 0 HB3 LEU A 134 -6.427 -6.687 1.444 1.00 60.33 H new ATOM 0 HG LEU A 134 -7.143 -4.489 0.709 1.00 41.32 H new ATOM 0 HD11 LEU A 134 -8.920 -5.389 -0.941 1.00 64.25 H new ATOM 0 HD12 LEU A 134 -7.491 -6.436 -0.768 1.00 64.25 H new ATOM 0 HD13 LEU A 134 -9.006 -6.853 0.067 1.00 64.25 H new ATOM 0 HD21 LEU A 134 -9.520 -3.818 0.604 1.00 3.51 H new ATOM 0 HD22 LEU A 134 -9.830 -4.960 1.933 1.00 3.51 H new ATOM 0 HD23 LEU A 134 -8.705 -3.602 2.171 1.00 3.51 H new ATOM 1933 N ASN A 135 -6.536 -8.906 3.151 1.00 23.21 N ATOM 1934 CA ASN A 135 -5.600 -9.858 3.738 1.00 53.35 C ATOM 1935 C ASN A 135 -4.199 -9.266 3.732 1.00 12.10 C ATOM 1936 O ASN A 135 -3.550 -9.284 2.685 1.00 4.12 O ATOM 1937 CB ASN A 135 -5.615 -11.152 2.929 1.00 1.54 C ATOM 1938 CG ASN A 135 -4.602 -12.160 3.430 1.00 43.22 C ATOM 1939 OD1 ASN A 135 -3.715 -12.579 2.556 1.00 55.54 O flip ATOM 1940 ND2 ASN A 135 -4.567 -12.525 4.598 1.00 11.30 N flip ATOM 0 H ASN A 135 -6.815 -9.160 2.203 1.00 23.21 H new ATOM 0 HA ASN A 135 -5.896 -10.071 4.765 1.00 53.35 H new ATOM 0 HB2 ASN A 135 -6.612 -11.592 2.971 1.00 1.54 H new ATOM 0 HB3 ASN A 135 -5.410 -10.925 1.883 1.00 1.54 H new ATOM 0 HD21 ASN A 135 -5.266 -12.187 5.259 1.00 11.30 H new ATOM 0 HD22 ASN A 135 -3.839 -13.167 4.910 1.00 11.30 H new ATOM 1946 N VAL A 136 -3.747 -8.722 4.859 1.00 20.24 N ATOM 1947 CA VAL A 136 -2.457 -8.051 4.950 1.00 55.24 C ATOM 1948 C VAL A 136 -1.500 -8.923 5.762 1.00 43.25 C ATOM 1949 O VAL A 136 -1.638 -9.023 6.981 1.00 51.45 O ATOM 1950 CB VAL A 136 -2.628 -6.611 5.498 1.00 14.42 C ATOM 1951 CG1 VAL A 136 -1.284 -5.891 5.707 1.00 4.44 C ATOM 1952 CG2 VAL A 136 -3.476 -5.730 4.563 1.00 60.15 C ATOM 0 H VAL A 136 -4.268 -8.735 5.736 1.00 20.24 H new ATOM 0 HA VAL A 136 -2.013 -7.928 3.962 1.00 55.24 H new ATOM 0 HB VAL A 136 -3.131 -6.740 6.456 1.00 14.42 H new ATOM 0 HG11 VAL A 136 -1.465 -4.887 6.092 1.00 4.44 H new ATOM 0 HG12 VAL A 136 -0.679 -6.450 6.421 1.00 4.44 H new ATOM 0 HG13 VAL A 136 -0.755 -5.825 4.756 1.00 4.44 H new ATOM 0 HG21 VAL A 136 -3.568 -4.731 4.989 1.00 60.15 H new ATOM 0 HG22 VAL A 136 -2.994 -5.666 3.587 1.00 60.15 H new ATOM 0 HG23 VAL A 136 -4.467 -6.169 4.450 1.00 60.15 H new ATOM 1962 N ILE A 137 -0.516 -9.537 5.100 1.00 21.33 N ATOM 1963 CA ILE A 137 0.398 -10.506 5.703 1.00 1.53 C ATOM 1964 C ILE A 137 1.756 -9.880 6.070 1.00 13.53 C ATOM 1965 O ILE A 137 2.643 -10.594 6.558 1.00 70.04 O ATOM 1966 CB ILE A 137 0.526 -11.756 4.793 1.00 44.22 C ATOM 1967 CG1 ILE A 137 1.489 -11.634 3.597 1.00 22.02 C ATOM 1968 CG2 ILE A 137 -0.844 -12.288 4.335 1.00 52.33 C ATOM 1969 CD1 ILE A 137 1.296 -10.425 2.692 1.00 32.34 C ATOM 0 H ILE A 137 -0.330 -9.370 4.111 1.00 21.33 H new ATOM 0 HA ILE A 137 -0.025 -10.835 6.652 1.00 1.53 H new ATOM 0 HB ILE A 137 0.996 -12.486 5.452 1.00 44.22 H new ATOM 0 HG12 ILE A 137 2.509 -11.614 3.981 1.00 22.02 H new ATOM 0 HG13 ILE A 137 1.395 -12.534 2.989 1.00 22.02 H new ATOM 0 HG21 ILE A 137 -0.701 -13.163 3.701 1.00 52.33 H new ATOM 0 HG22 ILE A 137 -1.437 -12.565 5.207 1.00 52.33 H new ATOM 0 HG23 ILE A 137 -1.366 -11.514 3.773 1.00 52.33 H new ATOM 0 HD11 ILE A 137 2.032 -10.451 1.888 1.00 32.34 H new ATOM 0 HD12 ILE A 137 0.293 -10.446 2.266 1.00 32.34 H new ATOM 0 HD13 ILE A 137 1.425 -9.512 3.273 1.00 32.34 H new ATOM 1980 N GLY A 138 1.957 -8.577 5.825 1.00 34.34 N ATOM 1981 CA GLY A 138 3.270 -7.953 5.898 1.00 33.20 C ATOM 1982 C GLY A 138 3.227 -6.440 6.034 1.00 53.23 C ATOM 1983 O GLY A 138 2.558 -5.769 5.254 1.00 2.50 O ATOM 0 H GLY A 138 1.208 -7.933 5.571 1.00 34.34 H new ATOM 0 HA2 GLY A 138 3.812 -8.369 6.747 1.00 33.20 H new ATOM 0 HA3 GLY A 138 3.834 -8.211 5.002 1.00 33.20 H new ATOM 1987 N VAL A 139 3.979 -5.881 6.982 1.00 2.52 N ATOM 1988 CA VAL A 139 4.146 -4.443 7.140 1.00 1.22 C ATOM 1989 C VAL A 139 5.550 -4.221 7.717 1.00 51.53 C ATOM 1990 O VAL A 139 5.735 -4.223 8.937 1.00 25.01 O ATOM 1991 CB VAL A 139 3.030 -3.834 8.025 1.00 3.41 C ATOM 1992 CG1 VAL A 139 3.018 -2.313 7.823 1.00 33.33 C ATOM 1993 CG2 VAL A 139 1.605 -4.357 7.775 1.00 32.42 C ATOM 0 H VAL A 139 4.496 -6.427 7.671 1.00 2.52 H new ATOM 0 HA VAL A 139 4.055 -3.930 6.183 1.00 1.22 H new ATOM 0 HB VAL A 139 3.281 -4.137 9.041 1.00 3.41 H new ATOM 0 HG11 VAL A 139 2.236 -1.870 8.440 1.00 33.33 H new ATOM 0 HG12 VAL A 139 3.985 -1.900 8.110 1.00 33.33 H new ATOM 0 HG13 VAL A 139 2.824 -2.087 6.775 1.00 33.33 H new ATOM 0 HG21 VAL A 139 0.911 -3.859 8.452 1.00 32.42 H new ATOM 0 HG22 VAL A 139 1.317 -4.151 6.744 1.00 32.42 H new ATOM 0 HG23 VAL A 139 1.576 -5.432 7.952 1.00 32.42 H new ATOM 2003 N ALA A 140 6.560 -4.081 6.857 1.00 71.04 N ATOM 2004 CA ALA A 140 7.954 -3.913 7.266 1.00 61.42 C ATOM 2005 C ALA A 140 8.591 -2.768 6.473 1.00 65.23 C ATOM 2006 O ALA A 140 7.886 -1.891 5.972 1.00 5.11 O ATOM 2007 CB ALA A 140 8.713 -5.244 7.150 1.00 31.21 C ATOM 0 H ALA A 140 6.431 -4.081 5.845 1.00 71.04 H new ATOM 0 HA ALA A 140 8.006 -3.632 8.318 1.00 61.42 H new ATOM 0 HB1 ALA A 140 9.749 -5.100 7.458 1.00 31.21 H new ATOM 0 HB2 ALA A 140 8.243 -5.988 7.793 1.00 31.21 H new ATOM 0 HB3 ALA A 140 8.687 -5.589 6.116 1.00 31.21 H new ATOM 2013 N ARG A 141 9.923 -2.725 6.412 1.00 72.23 N ATOM 2014 CA ARG A 141 10.705 -1.671 5.801 1.00 43.34 C ATOM 2015 C ARG A 141 11.795 -2.280 4.929 1.00 32.11 C ATOM 2016 O ARG A 141 12.188 -3.428 5.149 1.00 43.44 O ATOM 2017 CB ARG A 141 11.302 -0.810 6.924 1.00 2.50 C ATOM 2018 CG ARG A 141 12.296 -1.563 7.814 1.00 3.54 C ATOM 2019 CD ARG A 141 12.752 -0.741 9.021 1.00 44.54 C ATOM 2020 NE ARG A 141 13.565 -1.569 9.926 1.00 54.11 N ATOM 2021 CZ ARG A 141 14.172 -1.187 11.053 1.00 30.32 C ATOM 2022 NH1 ARG A 141 14.179 0.093 11.413 1.00 74.12 N ATOM 2023 NH2 ARG A 141 14.758 -2.102 11.810 1.00 2.20 N ATOM 0 H ARG A 141 10.505 -3.463 6.809 1.00 72.23 H new ATOM 0 HA ARG A 141 10.083 -1.045 5.161 1.00 43.34 H new ATOM 0 HB2 ARG A 141 11.803 0.051 6.482 1.00 2.50 H new ATOM 0 HB3 ARG A 141 10.493 -0.424 7.544 1.00 2.50 H new ATOM 0 HG2 ARG A 141 11.836 -2.488 8.163 1.00 3.54 H new ATOM 0 HG3 ARG A 141 13.167 -1.844 7.222 1.00 3.54 H new ATOM 0 HD2 ARG A 141 13.331 0.119 8.686 1.00 44.54 H new ATOM 0 HD3 ARG A 141 11.884 -0.353 9.554 1.00 44.54 H new ATOM 0 HE ARG A 141 13.678 -2.548 9.662 1.00 54.11 H new ATOM 0 HH11 ARG A 141 13.719 0.790 10.827 1.00 74.12 H new ATOM 0 HH12 ARG A 141 14.644 0.378 12.275 1.00 74.12 H new ATOM 0 HH21 ARG A 141 14.742 -3.083 11.530 1.00 2.20 H new ATOM 0 HH22 ARG A 141 15.226 -1.826 12.673 1.00 2.20 H new ATOM 2034 N ASP A 142 12.342 -1.455 4.044 1.00 74.23 N ATOM 2035 CA ASP A 142 13.449 -1.770 3.136 1.00 61.43 C ATOM 2036 C ASP A 142 13.193 -3.028 2.310 1.00 63.32 C ATOM 2037 O ASP A 142 12.023 -3.322 2.049 1.00 45.35 O ATOM 2038 CB ASP A 142 14.774 -1.756 3.905 1.00 3.42 C ATOM 2039 CG ASP A 142 15.833 -1.087 3.047 1.00 1.44 C ATOM 2040 OD1 ASP A 142 15.873 0.169 3.041 1.00 62.44 O ATOM 2041 OD2 ASP A 142 16.624 -1.810 2.406 1.00 63.51 O ATOM 0 H ASP A 142 12.011 -0.497 3.931 1.00 74.23 H new ATOM 0 HA ASP A 142 13.525 -0.988 2.380 1.00 61.43 H new ATOM 0 HB2 ASP A 142 14.658 -1.220 4.847 1.00 3.42 H new ATOM 0 HB3 ASP A 142 15.077 -2.773 4.153 1.00 3.42 H new ATOM 2045 N ASP A 143 14.231 -3.718 1.826 1.00 74.45 N ATOM 2046 CA ASP A 143 14.138 -5.081 1.310 1.00 12.40 C ATOM 2047 C ASP A 143 14.943 -6.006 2.217 1.00 44.35 C ATOM 2048 O ASP A 143 16.152 -6.164 2.054 1.00 22.21 O ATOM 2049 CB ASP A 143 14.437 -5.297 -0.196 1.00 31.51 C ATOM 2050 CG ASP A 143 15.251 -4.246 -0.954 1.00 5.43 C ATOM 2051 OD1 ASP A 143 16.488 -4.145 -0.752 1.00 45.34 O ATOM 2052 OD2 ASP A 143 14.651 -3.535 -1.799 1.00 65.43 O ATOM 0 H ASP A 143 15.175 -3.335 1.783 1.00 74.45 H new ATOM 0 HA ASP A 143 13.078 -5.334 1.341 1.00 12.40 H new ATOM 0 HB2 ASP A 143 14.959 -6.249 -0.294 1.00 31.51 H new ATOM 0 HB3 ASP A 143 13.481 -5.404 -0.708 1.00 31.51 H new ATOM 2056 N SER A 144 14.267 -6.583 3.213 1.00 44.23 N ATOM 2057 CA SER A 144 14.786 -7.643 4.076 1.00 52.53 C ATOM 2058 C SER A 144 13.693 -8.641 4.513 1.00 73.33 C ATOM 2059 O SER A 144 14.026 -9.717 5.010 1.00 70.24 O ATOM 2060 CB SER A 144 15.483 -6.992 5.281 1.00 65.12 C ATOM 2061 OG SER A 144 16.324 -7.896 5.973 1.00 2.10 O ATOM 0 H SER A 144 13.311 -6.315 3.448 1.00 44.23 H new ATOM 0 HA SER A 144 15.506 -8.236 3.512 1.00 52.53 H new ATOM 0 HB2 SER A 144 16.072 -6.141 4.940 1.00 65.12 H new ATOM 0 HB3 SER A 144 14.730 -6.604 5.967 1.00 65.12 H new ATOM 0 HG SER A 144 15.969 -8.805 5.886 1.00 2.10 H new ATOM 2066 N GLU A 145 12.398 -8.341 4.328 1.00 25.40 N ATOM 2067 CA GLU A 145 11.293 -9.247 4.675 1.00 32.41 C ATOM 2068 C GLU A 145 10.516 -9.682 3.426 1.00 23.34 C ATOM 2069 O GLU A 145 9.437 -10.247 3.543 1.00 44.51 O ATOM 2070 CB GLU A 145 10.378 -8.691 5.788 1.00 65.21 C ATOM 2071 CG GLU A 145 11.184 -8.074 6.954 1.00 72.22 C ATOM 2072 CD GLU A 145 10.439 -7.947 8.294 1.00 50.35 C ATOM 2073 OE1 GLU A 145 9.619 -8.830 8.639 1.00 41.42 O ATOM 2074 OE2 GLU A 145 10.782 -7.048 9.102 1.00 1.50 O ATOM 0 H GLU A 145 12.086 -7.455 3.930 1.00 25.40 H new ATOM 0 HA GLU A 145 11.743 -10.144 5.102 1.00 32.41 H new ATOM 0 HB2 GLU A 145 9.715 -7.935 5.367 1.00 65.21 H new ATOM 0 HB3 GLU A 145 9.746 -9.492 6.170 1.00 65.21 H new ATOM 0 HG2 GLU A 145 12.077 -8.679 7.113 1.00 72.22 H new ATOM 0 HG3 GLU A 145 11.521 -7.082 6.652 1.00 72.22 H new ATOM 2079 N VAL A 146 11.071 -9.483 2.225 1.00 61.25 N ATOM 2080 CA VAL A 146 10.434 -9.885 0.967 1.00 63.35 C ATOM 2081 C VAL A 146 10.165 -11.394 0.949 1.00 63.04 C ATOM 2082 O VAL A 146 9.190 -11.850 0.359 1.00 23.41 O ATOM 2083 CB VAL A 146 11.331 -9.472 -0.215 1.00 10.10 C ATOM 2084 CG1 VAL A 146 10.663 -9.746 -1.568 1.00 71.34 C ATOM 2085 CG2 VAL A 146 11.686 -7.979 -0.167 1.00 21.34 C ATOM 0 H VAL A 146 11.979 -9.036 2.099 1.00 61.25 H new ATOM 0 HA VAL A 146 9.472 -9.380 0.877 1.00 63.35 H new ATOM 0 HB VAL A 146 12.234 -10.075 -0.119 1.00 10.10 H new ATOM 0 HG11 VAL A 146 11.331 -9.439 -2.373 1.00 71.34 H new ATOM 0 HG12 VAL A 146 10.450 -10.811 -1.659 1.00 71.34 H new ATOM 0 HG13 VAL A 146 9.732 -9.183 -1.635 1.00 71.34 H new ATOM 0 HG21 VAL A 146 12.320 -7.728 -1.018 1.00 21.34 H new ATOM 0 HG22 VAL A 146 10.772 -7.386 -0.208 1.00 21.34 H new ATOM 0 HG23 VAL A 146 12.219 -7.761 0.759 1.00 21.34 H new ATOM 2095 N ASP A 147 10.999 -12.170 1.643 1.00 31.02 N ATOM 2096 CA ASP A 147 10.963 -13.628 1.628 1.00 70.23 C ATOM 2097 C ASP A 147 9.620 -14.165 2.132 1.00 14.30 C ATOM 2098 O ASP A 147 9.005 -15.015 1.487 1.00 72.43 O ATOM 2099 CB ASP A 147 12.132 -14.167 2.473 1.00 32.04 C ATOM 2100 CG ASP A 147 13.058 -15.151 1.762 1.00 65.32 C ATOM 2101 OD1 ASP A 147 12.915 -15.399 0.544 1.00 31.03 O ATOM 2102 OD2 ASP A 147 13.946 -15.668 2.479 1.00 4.22 O ATOM 0 H ASP A 147 11.732 -11.792 2.243 1.00 31.02 H new ATOM 0 HA ASP A 147 11.071 -13.974 0.600 1.00 70.23 H new ATOM 0 HB2 ASP A 147 12.726 -13.322 2.820 1.00 32.04 H new ATOM 0 HB3 ASP A 147 11.723 -14.654 3.358 1.00 32.04 H new ATOM 2106 N LYS A 148 9.112 -13.636 3.253 1.00 51.43 N ATOM 2107 CA LYS A 148 7.793 -14.010 3.782 1.00 23.01 C ATOM 2108 C LYS A 148 6.672 -13.571 2.844 1.00 44.35 C ATOM 2109 O LYS A 148 5.590 -14.160 2.922 1.00 11.21 O ATOM 2110 CB LYS A 148 7.543 -13.465 5.205 1.00 53.12 C ATOM 2111 CG LYS A 148 7.836 -11.962 5.306 1.00 62.11 C ATOM 2112 CD LYS A 148 7.192 -11.195 6.460 1.00 25.23 C ATOM 2113 CE LYS A 148 7.849 -11.512 7.795 1.00 32.32 C ATOM 2114 NZ LYS A 148 7.496 -10.500 8.807 1.00 30.01 N ATOM 0 H LYS A 148 9.601 -12.940 3.816 1.00 51.43 H new ATOM 0 HA LYS A 148 7.792 -15.098 3.846 1.00 23.01 H new ATOM 0 HB2 LYS A 148 6.507 -13.652 5.488 1.00 53.12 H new ATOM 0 HB3 LYS A 148 8.170 -14.005 5.915 1.00 53.12 H new ATOM 0 HG2 LYS A 148 8.916 -11.834 5.378 1.00 62.11 H new ATOM 0 HG3 LYS A 148 7.521 -11.494 4.373 1.00 62.11 H new ATOM 0 HD2 LYS A 148 7.262 -10.125 6.267 1.00 25.23 H new ATOM 0 HD3 LYS A 148 6.131 -11.441 6.511 1.00 25.23 H new ATOM 0 HE2 LYS A 148 7.533 -12.498 8.135 1.00 32.32 H new ATOM 0 HE3 LYS A 148 8.932 -11.548 7.673 1.00 32.32 H new ATOM 0 HZ1 LYS A 148 7.671 -10.884 9.758 1.00 30.01 H new ATOM 0 HZ2 LYS A 148 8.077 -9.649 8.665 1.00 30.01 H new ATOM 0 HZ3 LYS A 148 6.490 -10.252 8.714 1.00 30.01 H new ATOM 2124 N TRP A 149 6.916 -12.560 2.002 1.00 65.24 N ATOM 2125 CA TRP A 149 5.969 -12.107 0.993 1.00 72.01 C ATOM 2126 C TRP A 149 6.242 -12.746 -0.378 1.00 11.33 C ATOM 2127 O TRP A 149 5.837 -12.174 -1.387 1.00 22.02 O ATOM 2128 CB TRP A 149 5.961 -10.573 0.884 1.00 63.44 C ATOM 2129 CG TRP A 149 6.037 -9.806 2.170 1.00 50.35 C ATOM 2130 CD1 TRP A 149 5.447 -10.165 3.330 1.00 64.45 C ATOM 2131 CD2 TRP A 149 6.721 -8.547 2.446 1.00 44.41 C ATOM 2132 NE1 TRP A 149 5.809 -9.274 4.314 1.00 54.14 N ATOM 2133 CE2 TRP A 149 6.534 -8.219 3.819 1.00 45.12 C ATOM 2134 CE3 TRP A 149 7.467 -7.635 1.676 1.00 2.53 C ATOM 2135 CZ2 TRP A 149 7.034 -7.045 4.402 1.00 42.45 C ATOM 2136 CZ3 TRP A 149 7.982 -6.459 2.247 1.00 22.04 C ATOM 2137 CH2 TRP A 149 7.759 -6.151 3.598 1.00 73.24 C ATOM 0 H TRP A 149 7.788 -12.032 2.007 1.00 65.24 H new ATOM 0 HA TRP A 149 4.980 -12.432 1.317 1.00 72.01 H new ATOM 0 HB2 TRP A 149 6.801 -10.272 0.258 1.00 63.44 H new ATOM 0 HB3 TRP A 149 5.052 -10.274 0.363 1.00 63.44 H new ATOM 0 HD1 TRP A 149 4.795 -11.016 3.464 1.00 64.45 H new ATOM 0 HE1 TRP A 149 5.566 -9.385 5.298 1.00 54.14 H new ATOM 0 HE3 TRP A 149 7.646 -7.842 0.631 1.00 2.53 H new ATOM 0 HZ2 TRP A 149 6.865 -6.833 5.447 1.00 42.45 H new ATOM 0 HZ3 TRP A 149 8.559 -5.781 1.636 1.00 22.04 H new ATOM 0 HH2 TRP A 149 8.143 -5.232 4.016 1.00 73.24 H new ATOM 2147 N SER A 150 6.974 -13.862 -0.478 1.00 3.51 N ATOM 2148 CA SER A 150 7.182 -14.521 -1.772 1.00 30.22 C ATOM 2149 C SER A 150 7.342 -16.043 -1.662 1.00 53.34 C ATOM 2150 O SER A 150 7.307 -16.729 -2.689 1.00 74.11 O ATOM 2151 CB SER A 150 8.382 -13.849 -2.468 1.00 12.20 C ATOM 2152 OG SER A 150 8.536 -14.285 -3.810 1.00 10.13 O ATOM 0 H SER A 150 7.427 -14.323 0.311 1.00 3.51 H new ATOM 0 HA SER A 150 6.286 -14.392 -2.379 1.00 30.22 H new ATOM 0 HB2 SER A 150 8.250 -12.767 -2.452 1.00 12.20 H new ATOM 0 HB3 SER A 150 9.293 -14.067 -1.910 1.00 12.20 H new ATOM 0 HG SER A 150 8.114 -15.163 -3.919 1.00 10.13 H new ATOM 2157 N LYS A 151 7.554 -16.588 -0.462 1.00 31.20 N ATOM 2158 CA LYS A 151 7.651 -18.026 -0.216 1.00 71.14 C ATOM 2159 C LYS A 151 6.441 -18.806 -0.718 1.00 41.23 C ATOM 2160 O LYS A 151 5.378 -18.215 -0.987 1.00 12.24 O ATOM 2161 CB LYS A 151 7.965 -18.279 1.267 1.00 32.43 C ATOM 2162 CG LYS A 151 7.089 -17.547 2.298 1.00 74.24 C ATOM 2163 CD LYS A 151 5.705 -18.158 2.552 1.00 23.00 C ATOM 2164 CE LYS A 151 5.011 -17.456 3.730 1.00 31.34 C ATOM 2165 NZ LYS A 151 5.764 -17.586 5.001 1.00 54.31 N ATOM 0 H LYS A 151 7.665 -16.028 0.383 1.00 31.20 H new ATOM 0 HA LYS A 151 8.480 -18.415 -0.807 1.00 71.14 H new ATOM 0 HB2 LYS A 151 7.885 -19.350 1.453 1.00 32.43 H new ATOM 0 HB3 LYS A 151 9.004 -18.001 1.446 1.00 32.43 H new ATOM 0 HG2 LYS A 151 7.628 -17.511 3.244 1.00 74.24 H new ATOM 0 HG3 LYS A 151 6.955 -16.517 1.967 1.00 74.24 H new ATOM 0 HD2 LYS A 151 5.092 -18.068 1.655 1.00 23.00 H new ATOM 0 HD3 LYS A 151 5.805 -19.223 2.764 1.00 23.00 H new ATOM 0 HE2 LYS A 151 4.885 -16.399 3.494 1.00 31.34 H new ATOM 0 HE3 LYS A 151 4.013 -17.875 3.860 1.00 31.34 H new ATOM 0 HZ1 LYS A 151 5.126 -17.408 5.802 1.00 54.31 H new ATOM 0 HZ2 LYS A 151 6.155 -18.547 5.076 1.00 54.31 H new ATOM 0 HZ3 LYS A 151 6.540 -16.894 5.017 1.00 54.31 H new