USER MOD reduce.3.24.130724 H: found=0, std=0, add=1125, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1125 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 97 GLN : amide:sc= 0.0419 K(o=0.56,f=-0.33) USER MOD Set 1.2: A 106 TYR OH : rot -14:sc= 0.513 USER MOD Set 2.1: A 71 LYS NZ :NH3+ 147:sc= 1.28 (180deg=0) USER MOD Set 2.2: A 111 SER OG : rot 108:sc= 1.93 USER MOD Set 3.1: A 24 TYR OH : rot 90:sc= 0.944 USER MOD Set 3.2: A 41 LYS NZ :NH3+ 147:sc= 2.35 (180deg=1.04) USER MOD Set 4.1: A 14 SER OG : rot -76:sc= 1.53 USER MOD Set 4.2: A 132 LYS NZ :NH3+ -161:sc= 1.73 (180deg=1.09) USER MOD Set 5.1: A 10 TYR OH : rot 165:sc= 1.01 USER MOD Set 5.2: A 121 ASN : amide:sc= -1.55! X(o=-0.54!,f=-0.9) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 168:sc= 1.19 (180deg=0.895) USER MOD Single : A 5 THR OG1 : rot 46:sc= 0.472 USER MOD Single : A 7 TYR OH : rot 52:sc= 1.25 USER MOD Single : A 11 THR OG1 : rot 47:sc= 0.96 USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -2.76! C(o=-2.8!,f=-1.5!) USER MOD Single : A 19 GLN : amide:sc= -0.0142 X(o=-0.014,f=-0.18) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= -0.0144 (180deg=-0.0144) USER MOD Single : A 31 LYS NZ :NH3+ -158:sc= 1.27 (180deg=1.01) USER MOD Single : A 33 HIS : no HD1:sc=-0.00481 X(o=-0.0048,f=0) USER MOD Single : A 34 TYR OH : rot -133:sc= 1.23 USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 THR OG1 : rot 88:sc= 0.84 USER MOD Single : A 48 MET CE :methyl -161:sc= -0.0908 (180deg=-0.533) USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 147:sc= 0.416 (180deg=0.0501) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 90:sc= 0.718 USER MOD Single : A 67 GLN : amide:sc= -0.824 K(o=-0.82,f=-5.3!) USER MOD Single : A 76 HIS : no HD1:sc= -0.729 K(o=-0.73,f=-0.096) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot -48:sc= 0.707 USER MOD Single : A 90 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0947) USER MOD Single : A 92 LYS NZ :NH3+ 155:sc= 0.474 (180deg=-0.263) USER MOD Single : A 93 ASN : amide:sc= 0.658 K(o=0.66,f=-5.6!) USER MOD Single : A 96 THR OG1 : rot 102:sc= 1.29 USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc= -1.39 X(o=-1.4,f=-1.1) USER MOD Single : A 105 GLN : amide:sc= -2.79! K(o=-2.8!,f=-0.11) USER MOD Single : A 110 TYR OH : rot 80:sc= -0.0765 USER MOD Single : A 114 LYS NZ :NH3+ 166:sc= 0.649 (180deg=0.349) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 HIS : no HD1:sc= -0.0364 X(o=-0.036,f=-0.0057) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -1.49! C(o=-1.5!,f=-3.2!) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 MET CE :methyl -157:sc= -0.256 (180deg=-1) USER MOD Single : A 130 LYS NZ :NH3+ -161:sc= 1.09 (180deg=0.89) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 142 HIS : no HD1:sc= -0.0221 X(o=-0.022,f=-0.48) USER MOD Single : A 143 HIS : no HD1:sc= -0.0597 X(o=-0.06,f=-0.06) USER MOD Single : A 144 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 145 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 146 HIS : no HD1:sc= 0 X(o=0,f=-0.031) USER MOD Single : A 147 HIS : no HD1:sc= 0 X(o=0,f=-0.21) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -14.774 20.122 -1.701 1.00 3.32 N ATOM 2 CA MET A 1 -13.670 19.143 -1.693 1.00 35.41 C ATOM 3 C MET A 1 -14.150 17.819 -1.121 1.00 12.44 C ATOM 4 O MET A 1 -14.327 17.675 0.090 1.00 12.41 O ATOM 5 CB MET A 1 -12.484 19.674 -0.887 1.00 71.44 C ATOM 6 CG MET A 1 -11.726 20.804 -1.566 1.00 25.40 C ATOM 7 SD MET A 1 -12.746 22.260 -1.878 1.00 51.53 S ATOM 8 CE MET A 1 -11.518 23.380 -2.546 1.00 65.22 C ATOM 0 H1 MET A 1 -14.396 21.070 -1.898 1.00 3.32 H new ATOM 0 H2 MET A 1 -15.462 19.864 -2.437 1.00 3.32 H new ATOM 0 H3 MET A 1 -15.244 20.123 -0.773 1.00 3.32 H new ATOM 0 HA MET A 1 -13.340 18.983 -2.720 1.00 35.41 H new ATOM 0 HB2 MET A 1 -12.844 20.023 0.081 1.00 71.44 H new ATOM 0 HB3 MET A 1 -11.794 18.853 -0.693 1.00 71.44 H new ATOM 0 HG2 MET A 1 -10.878 21.089 -0.943 1.00 25.40 H new ATOM 0 HG3 MET A 1 -11.320 20.444 -2.511 1.00 25.40 H new ATOM 0 HE1 MET A 1 -11.989 24.332 -2.792 1.00 65.22 H new ATOM 0 HE2 MET A 1 -10.734 23.543 -1.807 1.00 65.22 H new ATOM 0 HE3 MET A 1 -11.083 22.947 -3.447 1.00 65.22 H new ATOM 20 N ASP A 2 -14.378 16.862 -2.006 1.00 53.50 N ATOM 21 CA ASP A 2 -14.872 15.551 -1.619 1.00 44.14 C ATOM 22 C ASP A 2 -13.974 14.477 -2.205 1.00 20.21 C ATOM 23 O ASP A 2 -13.302 14.707 -3.212 1.00 52.42 O ATOM 24 CB ASP A 2 -16.312 15.349 -2.103 1.00 42.35 C ATOM 25 CG ASP A 2 -17.286 16.319 -1.462 1.00 40.00 C ATOM 26 OD1 ASP A 2 -17.461 17.437 -1.992 1.00 65.21 O ATOM 27 OD2 ASP A 2 -17.878 15.970 -0.419 1.00 53.41 O ATOM 0 H ASP A 2 -14.227 16.971 -3.009 1.00 53.50 H new ATOM 0 HA ASP A 2 -14.863 15.481 -0.531 1.00 44.14 H new ATOM 0 HB2 ASP A 2 -16.347 15.468 -3.186 1.00 42.35 H new ATOM 0 HB3 ASP A 2 -16.625 14.328 -1.884 1.00 42.35 H new ATOM 32 N ASP A 3 -13.975 13.300 -1.599 1.00 2.25 N ATOM 33 CA ASP A 3 -13.091 12.220 -2.034 1.00 54.32 C ATOM 34 C ASP A 3 -13.704 11.436 -3.193 1.00 32.34 C ATOM 35 O ASP A 3 -13.355 10.280 -3.430 1.00 31.50 O ATOM 36 CB ASP A 3 -12.756 11.284 -0.865 1.00 72.44 C ATOM 37 CG ASP A 3 -13.966 10.564 -0.303 1.00 20.02 C ATOM 38 OD1 ASP A 3 -14.927 11.243 0.111 1.00 30.44 O ATOM 39 OD2 ASP A 3 -13.946 9.318 -0.240 1.00 21.44 O ATOM 0 H ASP A 3 -14.574 13.065 -0.807 1.00 2.25 H new ATOM 0 HA ASP A 3 -12.164 12.672 -2.388 1.00 54.32 H new ATOM 0 HB2 ASP A 3 -12.026 10.546 -1.198 1.00 72.44 H new ATOM 0 HB3 ASP A 3 -12.285 11.862 -0.070 1.00 72.44 H new ATOM 44 N ARG A 4 -14.606 12.082 -3.925 1.00 32.12 N ATOM 45 CA ARG A 4 -15.153 11.509 -5.146 1.00 33.50 C ATOM 46 C ARG A 4 -14.124 11.573 -6.258 1.00 14.43 C ATOM 47 O ARG A 4 -14.164 10.801 -7.217 1.00 25.30 O ATOM 48 CB ARG A 4 -16.414 12.253 -5.588 1.00 24.24 C ATOM 49 CG ARG A 4 -17.684 11.833 -4.868 1.00 30.22 C ATOM 50 CD ARG A 4 -18.886 12.579 -5.423 1.00 41.21 C ATOM 51 NE ARG A 4 -20.155 11.983 -5.012 1.00 23.20 N ATOM 52 CZ ARG A 4 -21.293 12.134 -5.690 1.00 74.33 C ATOM 53 NH1 ARG A 4 -21.328 12.920 -6.762 1.00 3.33 N ATOM 54 NH2 ARG A 4 -22.401 11.524 -5.281 1.00 45.22 N ATOM 0 H ARG A 4 -14.973 13.005 -3.692 1.00 32.12 H new ATOM 0 HA ARG A 4 -15.412 10.471 -4.939 1.00 33.50 H new ATOM 0 HB2 ARG A 4 -16.262 13.321 -5.434 1.00 24.24 H new ATOM 0 HB3 ARG A 4 -16.552 12.102 -6.659 1.00 24.24 H new ATOM 0 HG2 ARG A 4 -17.833 10.759 -4.979 1.00 30.22 H new ATOM 0 HG3 ARG A 4 -17.586 12.033 -3.801 1.00 30.22 H new ATOM 0 HD2 ARG A 4 -18.851 13.616 -5.090 1.00 41.21 H new ATOM 0 HD3 ARG A 4 -18.830 12.592 -6.512 1.00 41.21 H new ATOM 0 HE ARG A 4 -20.171 11.421 -4.161 1.00 23.20 H new ATOM 0 HH11 ARG A 4 -20.485 13.407 -7.065 1.00 3.33 H new ATOM 0 HH12 ARG A 4 -22.198 13.036 -7.281 1.00 3.33 H new ATOM 0 HH21 ARG A 4 -22.382 10.938 -4.446 1.00 45.22 H new ATOM 0 HH22 ARG A 4 -23.270 11.642 -5.802 1.00 45.22 H new ATOM 68 N THR A 5 -13.200 12.497 -6.118 1.00 4.43 N ATOM 69 CA THR A 5 -12.203 12.728 -7.140 1.00 2.21 C ATOM 70 C THR A 5 -10.921 11.955 -6.845 1.00 63.35 C ATOM 71 O THR A 5 -10.047 12.440 -6.120 1.00 1.03 O ATOM 72 CB THR A 5 -11.891 14.232 -7.267 1.00 44.33 C ATOM 73 OG1 THR A 5 -11.534 14.773 -5.985 1.00 43.12 O ATOM 74 CG2 THR A 5 -13.089 14.989 -7.819 1.00 5.05 C ATOM 0 H THR A 5 -13.118 13.104 -5.302 1.00 4.43 H new ATOM 0 HA THR A 5 -12.611 12.370 -8.085 1.00 2.21 H new ATOM 0 HB THR A 5 -11.055 14.346 -7.957 1.00 44.33 H new ATOM 0 HG1 THR A 5 -10.891 14.178 -5.546 1.00 43.12 H new ATOM 0 HG21 THR A 5 -12.845 16.048 -7.899 1.00 5.05 H new ATOM 0 HG22 THR A 5 -13.343 14.599 -8.805 1.00 5.05 H new ATOM 0 HG23 THR A 5 -13.939 14.863 -7.149 1.00 5.05 H new ATOM 82 N GLU A 6 -10.834 10.756 -7.426 1.00 51.42 N ATOM 83 CA GLU A 6 -9.661 9.885 -7.312 1.00 5.21 C ATOM 84 C GLU A 6 -9.304 9.549 -5.862 1.00 23.53 C ATOM 85 O GLU A 6 -9.902 10.050 -4.909 1.00 41.52 O ATOM 86 CB GLU A 6 -8.443 10.509 -8.007 1.00 20.35 C ATOM 87 CG GLU A 6 -8.483 10.444 -9.527 1.00 21.11 C ATOM 88 CD GLU A 6 -9.620 11.241 -10.133 1.00 14.53 C ATOM 89 OE1 GLU A 6 -9.469 12.470 -10.303 1.00 25.41 O ATOM 90 OE2 GLU A 6 -10.668 10.642 -10.449 1.00 12.02 O ATOM 0 H GLU A 6 -11.582 10.359 -7.994 1.00 51.42 H new ATOM 0 HA GLU A 6 -9.931 8.953 -7.809 1.00 5.21 H new ATOM 0 HB2 GLU A 6 -8.362 11.552 -7.702 1.00 20.35 H new ATOM 0 HB3 GLU A 6 -7.543 10.004 -7.658 1.00 20.35 H new ATOM 0 HG2 GLU A 6 -7.538 10.814 -9.924 1.00 21.11 H new ATOM 0 HG3 GLU A 6 -8.573 9.403 -9.837 1.00 21.11 H new ATOM 97 N TYR A 7 -8.331 8.665 -5.718 1.00 33.31 N ATOM 98 CA TYR A 7 -7.750 8.352 -4.427 1.00 73.54 C ATOM 99 C TYR A 7 -6.242 8.266 -4.586 1.00 51.44 C ATOM 100 O TYR A 7 -5.752 7.805 -5.619 1.00 60.03 O ATOM 101 CB TYR A 7 -8.301 7.035 -3.868 1.00 41.25 C ATOM 102 CG TYR A 7 -9.726 7.125 -3.362 1.00 51.51 C ATOM 103 CD1 TYR A 7 -9.992 7.552 -2.067 1.00 12.55 C ATOM 104 CD2 TYR A 7 -10.802 6.780 -4.174 1.00 71.43 C ATOM 105 CE1 TYR A 7 -11.287 7.635 -1.593 1.00 21.54 C ATOM 106 CE2 TYR A 7 -12.102 6.861 -3.707 1.00 62.22 C ATOM 107 CZ TYR A 7 -12.338 7.289 -2.416 1.00 62.33 C ATOM 108 OH TYR A 7 -13.632 7.374 -1.946 1.00 70.33 O ATOM 0 H TYR A 7 -7.923 8.145 -6.495 1.00 33.31 H new ATOM 0 HA TYR A 7 -8.012 9.138 -3.719 1.00 73.54 H new ATOM 0 HB2 TYR A 7 -8.251 6.273 -4.646 1.00 41.25 H new ATOM 0 HB3 TYR A 7 -7.658 6.701 -3.053 1.00 41.25 H new ATOM 0 HD1 TYR A 7 -9.172 7.824 -1.419 1.00 12.55 H new ATOM 0 HD2 TYR A 7 -10.620 6.444 -5.184 1.00 71.43 H new ATOM 0 HE1 TYR A 7 -11.475 7.969 -0.583 1.00 21.54 H new ATOM 0 HE2 TYR A 7 -12.927 6.591 -4.349 1.00 62.22 H new ATOM 0 HH TYR A 7 -13.783 8.263 -1.563 1.00 70.33 H new ATOM 118 N ASP A 8 -5.509 8.726 -3.588 1.00 64.22 N ATOM 119 CA ASP A 8 -4.057 8.729 -3.664 1.00 22.13 C ATOM 120 C ASP A 8 -3.475 7.771 -2.645 1.00 43.15 C ATOM 121 O ASP A 8 -3.956 7.682 -1.516 1.00 3.12 O ATOM 122 CB ASP A 8 -3.497 10.136 -3.437 1.00 61.22 C ATOM 123 CG ASP A 8 -3.920 11.112 -4.513 1.00 31.30 C ATOM 124 OD1 ASP A 8 -3.284 11.134 -5.587 1.00 44.24 O ATOM 125 OD2 ASP A 8 -4.897 11.858 -4.294 1.00 12.44 O ATOM 0 H ASP A 8 -5.891 9.101 -2.720 1.00 64.22 H new ATOM 0 HA ASP A 8 -3.772 8.403 -4.664 1.00 22.13 H new ATOM 0 HB2 ASP A 8 -3.831 10.504 -2.467 1.00 61.22 H new ATOM 0 HB3 ASP A 8 -2.409 10.088 -3.402 1.00 61.22 H new ATOM 130 N VAL A 9 -2.455 7.040 -3.053 1.00 60.41 N ATOM 131 CA VAL A 9 -1.785 6.106 -2.168 1.00 44.03 C ATOM 132 C VAL A 9 -0.283 6.356 -2.204 1.00 74.11 C ATOM 133 O VAL A 9 0.370 6.108 -3.219 1.00 54.02 O ATOM 134 CB VAL A 9 -2.072 4.642 -2.578 1.00 24.14 C ATOM 135 CG1 VAL A 9 -1.407 3.664 -1.621 1.00 15.33 C ATOM 136 CG2 VAL A 9 -3.572 4.381 -2.652 1.00 74.42 C ATOM 0 H VAL A 9 -2.071 7.076 -3.997 1.00 60.41 H new ATOM 0 HA VAL A 9 -2.166 6.261 -1.158 1.00 44.03 H new ATOM 0 HB VAL A 9 -1.648 4.487 -3.570 1.00 24.14 H new ATOM 0 HG11 VAL A 9 -1.626 2.643 -1.934 1.00 15.33 H new ATOM 0 HG12 VAL A 9 -0.329 3.823 -1.630 1.00 15.33 H new ATOM 0 HG13 VAL A 9 -1.789 3.824 -0.613 1.00 15.33 H new ATOM 0 HG21 VAL A 9 -3.747 3.345 -2.942 1.00 74.42 H new ATOM 0 HG22 VAL A 9 -4.022 4.566 -1.677 1.00 74.42 H new ATOM 0 HG23 VAL A 9 -4.021 5.045 -3.390 1.00 74.42 H new ATOM 146 N TYR A 10 0.258 6.857 -1.104 1.00 5.51 N ATOM 147 CA TYR A 10 1.692 7.085 -1.005 1.00 24.20 C ATOM 148 C TYR A 10 2.384 5.815 -0.542 1.00 1.51 C ATOM 149 O TYR A 10 2.002 5.226 0.470 1.00 2.34 O ATOM 150 CB TYR A 10 2.008 8.242 -0.052 1.00 64.31 C ATOM 151 CG TYR A 10 1.678 9.605 -0.619 1.00 51.52 C ATOM 152 CD1 TYR A 10 2.338 10.083 -1.744 1.00 51.42 C ATOM 153 CD2 TYR A 10 0.715 10.413 -0.032 1.00 20.20 C ATOM 154 CE1 TYR A 10 2.049 11.328 -2.268 1.00 33.50 C ATOM 155 CE2 TYR A 10 0.421 11.660 -0.549 1.00 63.34 C ATOM 156 CZ TYR A 10 1.091 12.112 -1.667 1.00 62.33 C ATOM 157 OH TYR A 10 0.805 13.356 -2.180 1.00 75.32 O ATOM 0 H TYR A 10 -0.271 7.113 -0.270 1.00 5.51 H new ATOM 0 HA TYR A 10 2.064 7.358 -1.993 1.00 24.20 H new ATOM 0 HB2 TYR A 10 1.452 8.100 0.875 1.00 64.31 H new ATOM 0 HB3 TYR A 10 3.067 8.211 0.204 1.00 64.31 H new ATOM 0 HD1 TYR A 10 3.091 9.470 -2.218 1.00 51.42 H new ATOM 0 HD2 TYR A 10 0.187 10.062 0.842 1.00 20.20 H new ATOM 0 HE1 TYR A 10 2.572 11.684 -3.144 1.00 33.50 H new ATOM 0 HE2 TYR A 10 -0.330 12.278 -0.080 1.00 63.34 H new ATOM 0 HH TYR A 10 -0.038 13.681 -1.799 1.00 75.32 H new ATOM 167 N THR A 11 3.386 5.385 -1.294 1.00 54.33 N ATOM 168 CA THR A 11 4.060 4.134 -0.999 1.00 43.22 C ATOM 169 C THR A 11 5.515 4.149 -1.483 1.00 24.32 C ATOM 170 O THR A 11 6.188 3.113 -1.501 1.00 34.02 O ATOM 171 CB THR A 11 3.292 2.950 -1.639 1.00 63.44 C ATOM 172 OG1 THR A 11 3.827 1.698 -1.193 1.00 62.34 O ATOM 173 CG2 THR A 11 3.342 3.016 -3.161 1.00 62.35 C ATOM 0 H THR A 11 3.747 5.882 -2.108 1.00 54.33 H new ATOM 0 HA THR A 11 4.073 4.009 0.084 1.00 43.22 H new ATOM 0 HB THR A 11 2.252 3.027 -1.323 1.00 63.44 H new ATOM 0 HG1 THR A 11 3.941 1.719 -0.220 1.00 62.34 H new ATOM 0 HG21 THR A 11 2.794 2.172 -3.580 1.00 62.35 H new ATOM 0 HG22 THR A 11 2.888 3.947 -3.500 1.00 62.35 H new ATOM 0 HG23 THR A 11 4.379 2.976 -3.493 1.00 62.35 H new ATOM 181 N ASP A 12 6.020 5.320 -1.851 1.00 13.42 N ATOM 182 CA ASP A 12 7.384 5.407 -2.354 1.00 51.20 C ATOM 183 C ASP A 12 8.373 5.551 -1.209 1.00 63.34 C ATOM 184 O ASP A 12 8.819 6.651 -0.880 1.00 75.35 O ATOM 185 CB ASP A 12 7.558 6.553 -3.353 1.00 75.31 C ATOM 186 CG ASP A 12 8.981 6.631 -3.885 1.00 42.14 C ATOM 187 OD1 ASP A 12 9.428 5.666 -4.547 1.00 13.42 O ATOM 188 OD2 ASP A 12 9.660 7.652 -3.644 1.00 4.53 O ATOM 0 H ASP A 12 5.517 6.206 -1.812 1.00 13.42 H new ATOM 0 HA ASP A 12 7.588 4.476 -2.883 1.00 51.20 H new ATOM 0 HB2 ASP A 12 6.866 6.418 -4.185 1.00 75.31 H new ATOM 0 HB3 ASP A 12 7.298 7.496 -2.872 1.00 75.31 H new ATOM 193 N GLY A 13 8.665 4.429 -0.573 1.00 3.13 N ATOM 194 CA GLY A 13 9.716 4.387 0.414 1.00 73.33 C ATOM 195 C GLY A 13 10.994 3.885 -0.211 1.00 41.23 C ATOM 196 O GLY A 13 11.091 2.707 -0.565 1.00 43.41 O ATOM 0 H GLY A 13 8.187 3.541 -0.726 1.00 3.13 H new ATOM 0 HA2 GLY A 13 9.873 5.381 0.832 1.00 73.33 H new ATOM 0 HA3 GLY A 13 9.425 3.736 1.239 1.00 73.33 H new ATOM 200 N SER A 14 11.954 4.778 -0.385 1.00 73.14 N ATOM 201 CA SER A 14 13.203 4.444 -1.054 1.00 61.25 C ATOM 202 C SER A 14 13.924 3.296 -0.350 1.00 65.03 C ATOM 203 O SER A 14 14.248 3.380 0.835 1.00 13.03 O ATOM 204 CB SER A 14 14.099 5.684 -1.148 1.00 64.40 C ATOM 205 OG SER A 14 14.079 6.431 0.056 1.00 14.43 O ATOM 0 H SER A 14 11.892 5.746 -0.070 1.00 73.14 H new ATOM 0 HA SER A 14 12.970 4.107 -2.064 1.00 61.25 H new ATOM 0 HB2 SER A 14 15.121 5.379 -1.372 1.00 64.40 H new ATOM 0 HB3 SER A 14 13.766 6.313 -1.973 1.00 64.40 H new ATOM 0 HG SER A 14 13.238 6.930 0.117 1.00 14.43 H new ATOM 211 N TYR A 15 14.147 2.217 -1.092 1.00 33.05 N ATOM 212 CA TYR A 15 14.802 1.034 -0.557 1.00 63.32 C ATOM 213 C TYR A 15 16.269 1.319 -0.269 1.00 22.50 C ATOM 214 O TYR A 15 16.900 2.131 -0.951 1.00 50.41 O ATOM 215 CB TYR A 15 14.656 -0.147 -1.528 1.00 54.31 C ATOM 216 CG TYR A 15 15.154 0.124 -2.934 1.00 4.10 C ATOM 217 CD1 TYR A 15 14.327 0.721 -3.879 1.00 20.25 C ATOM 218 CD2 TYR A 15 16.442 -0.224 -3.318 1.00 64.43 C ATOM 219 CE1 TYR A 15 14.770 0.966 -5.164 1.00 52.13 C ATOM 220 CE2 TYR A 15 16.892 0.017 -4.602 1.00 14.41 C ATOM 221 CZ TYR A 15 16.052 0.612 -5.521 1.00 31.51 C ATOM 222 OH TYR A 15 16.496 0.852 -6.801 1.00 53.10 O ATOM 0 H TYR A 15 13.880 2.140 -2.073 1.00 33.05 H new ATOM 0 HA TYR A 15 14.318 0.766 0.382 1.00 63.32 H new ATOM 0 HB2 TYR A 15 15.198 -1.002 -1.123 1.00 54.31 H new ATOM 0 HB3 TYR A 15 13.605 -0.431 -1.578 1.00 54.31 H new ATOM 0 HD1 TYR A 15 13.320 0.998 -3.603 1.00 20.25 H new ATOM 0 HD2 TYR A 15 17.102 -0.690 -2.602 1.00 64.43 H new ATOM 0 HE1 TYR A 15 14.115 1.433 -5.885 1.00 52.13 H new ATOM 0 HE2 TYR A 15 17.897 -0.259 -4.885 1.00 14.41 H new ATOM 0 HH TYR A 15 17.422 0.544 -6.889 1.00 53.10 H new ATOM 232 N VAL A 16 16.803 0.657 0.741 1.00 42.41 N ATOM 233 CA VAL A 16 18.177 0.882 1.150 1.00 63.42 C ATOM 234 C VAL A 16 18.928 -0.448 1.238 1.00 42.21 C ATOM 235 O VAL A 16 18.435 -1.416 1.820 1.00 73.22 O ATOM 236 CB VAL A 16 18.246 1.651 2.496 1.00 34.14 C ATOM 237 CG1 VAL A 16 17.618 0.848 3.627 1.00 61.51 C ATOM 238 CG2 VAL A 16 19.680 2.037 2.831 1.00 44.53 C ATOM 0 H VAL A 16 16.306 -0.041 1.293 1.00 42.41 H new ATOM 0 HA VAL A 16 18.660 1.503 0.395 1.00 63.42 H new ATOM 0 HB VAL A 16 17.668 2.568 2.382 1.00 34.14 H new ATOM 0 HG11 VAL A 16 17.683 1.415 4.556 1.00 61.51 H new ATOM 0 HG12 VAL A 16 16.572 0.650 3.395 1.00 61.51 H new ATOM 0 HG13 VAL A 16 18.149 -0.097 3.741 1.00 61.51 H new ATOM 0 HG21 VAL A 16 19.700 2.575 3.779 1.00 44.53 H new ATOM 0 HG22 VAL A 16 20.290 1.137 2.911 1.00 44.53 H new ATOM 0 HG23 VAL A 16 20.078 2.676 2.043 1.00 44.53 H new ATOM 248 N ASN A 17 20.105 -0.490 0.615 1.00 42.05 N ATOM 249 CA ASN A 17 20.931 -1.703 0.547 1.00 42.43 C ATOM 250 C ASN A 17 20.189 -2.832 -0.160 1.00 63.21 C ATOM 251 O ASN A 17 20.440 -4.008 0.097 1.00 11.34 O ATOM 252 CB ASN A 17 21.366 -2.172 1.943 1.00 33.13 C ATOM 253 CG ASN A 17 22.266 -1.177 2.646 1.00 50.24 C ATOM 254 OD1 ASN A 17 23.473 -1.142 2.414 1.00 1.22 O ATOM 255 ND2 ASN A 17 21.693 -0.377 3.527 1.00 54.32 N ATOM 0 H ASN A 17 20.516 0.315 0.142 1.00 42.05 H new ATOM 0 HA ASN A 17 21.822 -1.447 -0.026 1.00 42.43 H new ATOM 0 HB2 ASN A 17 20.481 -2.348 2.554 1.00 33.13 H new ATOM 0 HB3 ASN A 17 21.887 -3.126 1.854 1.00 33.13 H new ATOM 0 HD21 ASN A 17 22.255 0.300 4.043 1.00 54.32 H new ATOM 0 HD22 ASN A 17 20.688 -0.436 3.692 1.00 54.32 H new ATOM 262 N GLY A 18 19.291 -2.470 -1.069 1.00 73.01 N ATOM 263 CA GLY A 18 18.506 -3.463 -1.783 1.00 70.21 C ATOM 264 C GLY A 18 17.324 -3.975 -0.977 1.00 44.52 C ATOM 265 O GLY A 18 16.442 -4.647 -1.514 1.00 74.20 O ATOM 0 H GLY A 18 19.091 -1.503 -1.326 1.00 73.01 H new ATOM 0 HA2 GLY A 18 18.143 -3.030 -2.715 1.00 70.21 H new ATOM 0 HA3 GLY A 18 19.148 -4.302 -2.050 1.00 70.21 H new ATOM 269 N GLN A 19 17.307 -3.659 0.311 1.00 30.13 N ATOM 270 CA GLN A 19 16.236 -4.096 1.194 1.00 2.51 C ATOM 271 C GLN A 19 14.964 -3.304 0.938 1.00 42.45 C ATOM 272 O GLN A 19 14.973 -2.071 0.949 1.00 52.14 O ATOM 273 CB GLN A 19 16.654 -3.961 2.661 1.00 0.25 C ATOM 274 CG GLN A 19 17.234 -5.236 3.259 1.00 52.22 C ATOM 275 CD GLN A 19 18.329 -5.846 2.407 1.00 34.34 C ATOM 276 OE1 GLN A 19 18.064 -6.674 1.532 1.00 21.55 O ATOM 277 NE2 GLN A 19 19.566 -5.453 2.662 1.00 62.12 N ATOM 0 H GLN A 19 18.027 -3.099 0.768 1.00 30.13 H new ATOM 0 HA GLN A 19 16.037 -5.147 0.983 1.00 2.51 H new ATOM 0 HB2 GLN A 19 17.392 -3.163 2.746 1.00 0.25 H new ATOM 0 HB3 GLN A 19 15.788 -3.658 3.249 1.00 0.25 H new ATOM 0 HG2 GLN A 19 17.632 -5.017 4.250 1.00 52.22 H new ATOM 0 HG3 GLN A 19 16.435 -5.965 3.390 1.00 52.22 H new ATOM 0 HE21 GLN A 19 19.742 -4.766 3.395 1.00 62.12 H new ATOM 0 HE22 GLN A 19 20.344 -5.837 2.126 1.00 62.12 H new ATOM 286 N TYR A 20 13.876 -4.020 0.707 1.00 54.03 N ATOM 287 CA TYR A 20 12.593 -3.391 0.465 1.00 21.30 C ATOM 288 C TYR A 20 11.760 -3.374 1.734 1.00 41.45 C ATOM 289 O TYR A 20 11.664 -4.375 2.446 1.00 60.22 O ATOM 290 CB TYR A 20 11.812 -4.127 -0.628 1.00 73.32 C ATOM 291 CG TYR A 20 12.389 -3.989 -2.019 1.00 13.43 C ATOM 292 CD1 TYR A 20 12.283 -2.795 -2.721 1.00 63.25 C ATOM 293 CD2 TYR A 20 13.025 -5.059 -2.638 1.00 54.23 C ATOM 294 CE1 TYR A 20 12.795 -2.671 -3.998 1.00 64.21 C ATOM 295 CE2 TYR A 20 13.534 -4.942 -3.917 1.00 42.21 C ATOM 296 CZ TYR A 20 13.418 -3.747 -4.591 1.00 52.11 C ATOM 297 OH TYR A 20 13.916 -3.633 -5.869 1.00 65.22 O ATOM 0 H TYR A 20 13.858 -5.040 0.682 1.00 54.03 H new ATOM 0 HA TYR A 20 12.789 -2.370 0.138 1.00 21.30 H new ATOM 0 HB2 TYR A 20 11.765 -5.186 -0.372 1.00 73.32 H new ATOM 0 HB3 TYR A 20 10.787 -3.756 -0.636 1.00 73.32 H new ATOM 0 HD1 TYR A 20 11.792 -1.950 -2.261 1.00 63.25 H new ATOM 0 HD2 TYR A 20 13.123 -5.996 -2.111 1.00 54.23 H new ATOM 0 HE1 TYR A 20 12.707 -1.735 -4.529 1.00 64.21 H new ATOM 0 HE2 TYR A 20 14.021 -5.784 -4.386 1.00 42.21 H new ATOM 0 HH TYR A 20 14.325 -4.482 -6.138 1.00 65.22 H new ATOM 307 N ALA A 21 11.164 -2.233 2.006 1.00 40.41 N ATOM 308 CA ALA A 21 10.211 -2.100 3.086 1.00 24.54 C ATOM 309 C ALA A 21 8.927 -1.533 2.524 1.00 44.51 C ATOM 310 O ALA A 21 8.958 -0.797 1.533 1.00 11.01 O ATOM 311 CB ALA A 21 10.757 -1.199 4.180 1.00 61.25 C ATOM 0 H ALA A 21 11.327 -1.372 1.484 1.00 40.41 H new ATOM 0 HA ALA A 21 10.022 -3.077 3.530 1.00 24.54 H new ATOM 0 HB1 ALA A 21 10.023 -1.114 4.981 1.00 61.25 H new ATOM 0 HB2 ALA A 21 11.679 -1.625 4.576 1.00 61.25 H new ATOM 0 HB3 ALA A 21 10.962 -0.210 3.769 1.00 61.25 H new ATOM 317 N TRP A 22 7.802 -1.873 3.121 1.00 60.31 N ATOM 318 CA TRP A 22 6.543 -1.356 2.639 1.00 0.02 C ATOM 319 C TRP A 22 6.131 -0.137 3.445 1.00 24.23 C ATOM 320 O TRP A 22 6.153 -0.149 4.674 1.00 43.04 O ATOM 321 CB TRP A 22 5.442 -2.428 2.650 1.00 32.41 C ATOM 322 CG TRP A 22 5.239 -3.116 3.969 1.00 4.12 C ATOM 323 CD1 TRP A 22 5.864 -4.250 4.400 1.00 63.52 C ATOM 324 CD2 TRP A 22 4.341 -2.730 5.019 1.00 14.43 C ATOM 325 NE1 TRP A 22 5.411 -4.595 5.647 1.00 44.30 N ATOM 326 CE2 TRP A 22 4.479 -3.674 6.052 1.00 0.40 C ATOM 327 CE3 TRP A 22 3.436 -1.677 5.186 1.00 55.21 C ATOM 328 CZ2 TRP A 22 3.748 -3.597 7.234 1.00 70.43 C ATOM 329 CZ3 TRP A 22 2.711 -1.602 6.361 1.00 3.15 C ATOM 330 CH2 TRP A 22 2.871 -2.557 7.372 1.00 11.55 C ATOM 0 H TRP A 22 7.736 -2.495 3.927 1.00 60.31 H new ATOM 0 HA TRP A 22 6.681 -1.055 1.601 1.00 0.02 H new ATOM 0 HB2 TRP A 22 4.502 -1.965 2.350 1.00 32.41 H new ATOM 0 HB3 TRP A 22 5.681 -3.180 1.898 1.00 32.41 H new ATOM 0 HD1 TRP A 22 6.608 -4.797 3.840 1.00 63.52 H new ATOM 0 HE1 TRP A 22 5.717 -5.405 6.186 1.00 44.30 H new ATOM 0 HE3 TRP A 22 3.306 -0.936 4.411 1.00 55.21 H new ATOM 0 HZ2 TRP A 22 3.869 -4.333 8.015 1.00 70.43 H new ATOM 0 HZ3 TRP A 22 2.009 -0.793 6.501 1.00 3.15 H new ATOM 0 HH2 TRP A 22 2.290 -2.471 8.279 1.00 11.55 H new ATOM 341 N ALA A 23 5.790 0.917 2.736 1.00 71.23 N ATOM 342 CA ALA A 23 5.318 2.139 3.349 1.00 14.35 C ATOM 343 C ALA A 23 4.006 2.530 2.705 1.00 51.35 C ATOM 344 O ALA A 23 3.871 2.446 1.485 1.00 20.12 O ATOM 345 CB ALA A 23 6.353 3.245 3.186 1.00 70.21 C ATOM 0 H ALA A 23 5.832 0.951 1.717 1.00 71.23 H new ATOM 0 HA ALA A 23 5.163 1.983 4.417 1.00 14.35 H new ATOM 0 HB1 ALA A 23 5.985 4.159 3.652 1.00 70.21 H new ATOM 0 HB2 ALA A 23 7.285 2.944 3.664 1.00 70.21 H new ATOM 0 HB3 ALA A 23 6.530 3.424 2.126 1.00 70.21 H new ATOM 351 N TYR A 24 3.036 2.920 3.510 1.00 51.45 N ATOM 352 CA TYR A 24 1.738 3.299 2.984 1.00 74.24 C ATOM 353 C TYR A 24 1.160 4.475 3.744 1.00 24.32 C ATOM 354 O TYR A 24 1.240 4.543 4.971 1.00 42.24 O ATOM 355 CB TYR A 24 0.763 2.116 3.033 1.00 51.13 C ATOM 356 CG TYR A 24 1.061 1.033 2.017 1.00 64.34 C ATOM 357 CD1 TYR A 24 0.593 1.137 0.714 1.00 5.13 C ATOM 358 CD2 TYR A 24 1.816 -0.083 2.355 1.00 41.30 C ATOM 359 CE1 TYR A 24 0.866 0.160 -0.224 1.00 13.33 C ATOM 360 CE2 TYR A 24 2.097 -1.065 1.422 1.00 23.11 C ATOM 361 CZ TYR A 24 1.618 -0.938 0.133 1.00 22.21 C ATOM 362 OH TYR A 24 1.896 -1.910 -0.806 1.00 34.14 O ATOM 0 H TYR A 24 3.121 2.983 4.525 1.00 51.45 H new ATOM 0 HA TYR A 24 1.880 3.596 1.945 1.00 74.24 H new ATOM 0 HB2 TYR A 24 0.786 1.680 4.032 1.00 51.13 H new ATOM 0 HB3 TYR A 24 -0.249 2.485 2.870 1.00 51.13 H new ATOM 0 HD1 TYR A 24 0.005 1.997 0.429 1.00 5.13 H new ATOM 0 HD2 TYR A 24 2.190 -0.186 3.363 1.00 41.30 H new ATOM 0 HE1 TYR A 24 0.492 0.256 -1.232 1.00 13.33 H new ATOM 0 HE2 TYR A 24 2.687 -1.926 1.700 1.00 23.11 H new ATOM 0 HH TYR A 24 2.732 -1.690 -1.267 1.00 34.14 H new ATOM 372 N ALA A 25 0.587 5.398 2.995 1.00 42.34 N ATOM 373 CA ALA A 25 -0.086 6.547 3.562 1.00 61.05 C ATOM 374 C ALA A 25 -1.446 6.715 2.911 1.00 53.12 C ATOM 375 O ALA A 25 -1.539 7.015 1.717 1.00 53.30 O ATOM 376 CB ALA A 25 0.752 7.802 3.377 1.00 31.24 C ATOM 0 H ALA A 25 0.576 5.371 1.975 1.00 42.34 H new ATOM 0 HA ALA A 25 -0.222 6.386 4.631 1.00 61.05 H new ATOM 0 HB1 ALA A 25 0.230 8.655 3.810 1.00 31.24 H new ATOM 0 HB2 ALA A 25 1.713 7.674 3.875 1.00 31.24 H new ATOM 0 HB3 ALA A 25 0.915 7.977 2.314 1.00 31.24 H new ATOM 382 N PHE A 26 -2.494 6.503 3.689 1.00 12.30 N ATOM 383 CA PHE A 26 -3.849 6.632 3.182 1.00 42.00 C ATOM 384 C PHE A 26 -4.290 8.087 3.245 1.00 55.50 C ATOM 385 O PHE A 26 -4.608 8.616 4.316 1.00 71.44 O ATOM 386 CB PHE A 26 -4.817 5.736 3.963 1.00 62.33 C ATOM 387 CG PHE A 26 -4.600 4.264 3.731 1.00 60.20 C ATOM 388 CD1 PHE A 26 -3.695 3.551 4.500 1.00 64.24 C ATOM 389 CD2 PHE A 26 -5.305 3.593 2.742 1.00 14.32 C ATOM 390 CE1 PHE A 26 -3.495 2.201 4.288 1.00 2.55 C ATOM 391 CE2 PHE A 26 -5.110 2.243 2.525 1.00 42.53 C ATOM 392 CZ PHE A 26 -4.203 1.546 3.299 1.00 31.40 C ATOM 0 H PHE A 26 -2.432 6.241 4.673 1.00 12.30 H new ATOM 0 HA PHE A 26 -3.862 6.305 2.142 1.00 42.00 H new ATOM 0 HB2 PHE A 26 -4.714 5.946 5.028 1.00 62.33 H new ATOM 0 HB3 PHE A 26 -5.839 5.992 3.685 1.00 62.33 H new ATOM 0 HD1 PHE A 26 -3.139 4.057 5.275 1.00 64.24 H new ATOM 0 HD2 PHE A 26 -6.015 4.133 2.134 1.00 14.32 H new ATOM 0 HE1 PHE A 26 -2.786 1.658 4.895 1.00 2.55 H new ATOM 0 HE2 PHE A 26 -5.666 1.733 1.752 1.00 42.53 H new ATOM 0 HZ PHE A 26 -4.047 0.490 3.131 1.00 31.40 H new ATOM 402 N VAL A 27 -4.274 8.733 2.094 1.00 23.14 N ATOM 403 CA VAL A 27 -4.590 10.145 1.998 1.00 51.21 C ATOM 404 C VAL A 27 -5.908 10.368 1.260 1.00 52.20 C ATOM 405 O VAL A 27 -6.151 9.804 0.192 1.00 2.13 O ATOM 406 CB VAL A 27 -3.435 10.923 1.316 1.00 23.43 C ATOM 407 CG1 VAL A 27 -2.997 10.246 0.030 1.00 55.35 C ATOM 408 CG2 VAL A 27 -3.829 12.362 1.037 1.00 10.35 C ATOM 0 H VAL A 27 -4.042 8.295 1.202 1.00 23.14 H new ATOM 0 HA VAL A 27 -4.708 10.530 3.011 1.00 51.21 H new ATOM 0 HB VAL A 27 -2.595 10.923 2.010 1.00 23.43 H new ATOM 0 HG11 VAL A 27 -2.186 10.816 -0.423 1.00 55.35 H new ATOM 0 HG12 VAL A 27 -2.651 9.236 0.250 1.00 55.35 H new ATOM 0 HG13 VAL A 27 -3.838 10.199 -0.661 1.00 55.35 H new ATOM 0 HG21 VAL A 27 -2.998 12.881 0.559 1.00 10.35 H new ATOM 0 HG22 VAL A 27 -4.696 12.380 0.377 1.00 10.35 H new ATOM 0 HG23 VAL A 27 -4.076 12.860 1.975 1.00 10.35 H new ATOM 418 N LYS A 28 -6.764 11.177 1.864 1.00 45.20 N ATOM 419 CA LYS A 28 -8.057 11.519 1.294 1.00 32.35 C ATOM 420 C LYS A 28 -8.233 13.026 1.344 1.00 74.25 C ATOM 421 O LYS A 28 -7.896 13.648 2.352 1.00 52.31 O ATOM 422 CB LYS A 28 -9.183 10.835 2.077 1.00 22.34 C ATOM 423 CG LYS A 28 -9.311 9.342 1.812 1.00 64.53 C ATOM 424 CD LYS A 28 -10.029 8.633 2.953 1.00 41.44 C ATOM 425 CE LYS A 28 -11.376 9.268 3.276 1.00 20.23 C ATOM 426 NZ LYS A 28 -12.386 9.048 2.207 1.00 24.00 N ATOM 0 H LYS A 28 -6.581 11.616 2.766 1.00 45.20 H new ATOM 0 HA LYS A 28 -8.100 11.175 0.260 1.00 32.35 H new ATOM 0 HB2 LYS A 28 -9.015 10.990 3.143 1.00 22.34 H new ATOM 0 HB3 LYS A 28 -10.128 11.319 1.829 1.00 22.34 H new ATOM 0 HG2 LYS A 28 -9.856 9.182 0.882 1.00 64.53 H new ATOM 0 HG3 LYS A 28 -8.320 8.909 1.679 1.00 64.53 H new ATOM 0 HD2 LYS A 28 -10.178 7.586 2.690 1.00 41.44 H new ATOM 0 HD3 LYS A 28 -9.399 8.652 3.842 1.00 41.44 H new ATOM 0 HE2 LYS A 28 -11.751 8.858 4.214 1.00 20.23 H new ATOM 0 HE3 LYS A 28 -11.241 10.339 3.428 1.00 20.23 H new ATOM 0 HZ1 LYS A 28 -13.282 9.500 2.478 1.00 24.00 H new ATOM 0 HZ2 LYS A 28 -12.045 9.462 1.316 1.00 24.00 H new ATOM 0 HZ3 LYS A 28 -12.538 8.027 2.078 1.00 24.00 H new ATOM 440 N ASP A 29 -8.715 13.612 0.248 1.00 51.44 N ATOM 441 CA ASP A 29 -8.939 15.062 0.177 1.00 63.34 C ATOM 442 C ASP A 29 -7.602 15.816 0.172 1.00 4.23 C ATOM 443 O ASP A 29 -7.548 17.043 0.251 1.00 71.31 O ATOM 444 CB ASP A 29 -9.822 15.510 1.357 1.00 21.02 C ATOM 445 CG ASP A 29 -10.131 16.992 1.361 1.00 35.42 C ATOM 446 OD1 ASP A 29 -11.004 17.420 0.581 1.00 73.20 O ATOM 447 OD2 ASP A 29 -9.511 17.734 2.154 1.00 51.24 O ATOM 0 H ASP A 29 -8.959 13.108 -0.604 1.00 51.44 H new ATOM 0 HA ASP A 29 -9.456 15.297 -0.754 1.00 63.34 H new ATOM 0 HB2 ASP A 29 -10.759 14.953 1.330 1.00 21.02 H new ATOM 0 HB3 ASP A 29 -9.324 15.250 2.291 1.00 21.02 H new ATOM 452 N GLY A 30 -6.516 15.071 0.039 1.00 55.30 N ATOM 453 CA GLY A 30 -5.198 15.664 0.122 1.00 72.30 C ATOM 454 C GLY A 30 -4.677 15.662 1.542 1.00 2.24 C ATOM 455 O GLY A 30 -3.562 16.112 1.810 1.00 42.42 O ATOM 0 H GLY A 30 -6.524 14.064 -0.125 1.00 55.30 H new ATOM 0 HA2 GLY A 30 -4.510 15.114 -0.520 1.00 72.30 H new ATOM 0 HA3 GLY A 30 -5.234 16.687 -0.252 1.00 72.30 H new ATOM 459 N LYS A 31 -5.498 15.157 2.453 1.00 71.10 N ATOM 460 CA LYS A 31 -5.123 15.040 3.850 1.00 73.21 C ATOM 461 C LYS A 31 -4.784 13.592 4.167 1.00 24.50 C ATOM 462 O LYS A 31 -5.573 12.686 3.893 1.00 62.05 O ATOM 463 CB LYS A 31 -6.267 15.490 4.758 1.00 54.33 C ATOM 464 CG LYS A 31 -6.949 16.776 4.320 1.00 13.15 C ATOM 465 CD LYS A 31 -5.983 17.946 4.291 1.00 74.43 C ATOM 466 CE LYS A 31 -6.697 19.251 3.989 1.00 24.03 C ATOM 467 NZ LYS A 31 -7.373 19.238 2.662 1.00 4.21 N ATOM 0 H LYS A 31 -6.437 14.819 2.243 1.00 71.10 H new ATOM 0 HA LYS A 31 -4.257 15.678 4.027 1.00 73.21 H new ATOM 0 HB2 LYS A 31 -7.012 14.696 4.804 1.00 54.33 H new ATOM 0 HB3 LYS A 31 -5.881 15.624 5.769 1.00 54.33 H new ATOM 0 HG2 LYS A 31 -7.382 16.638 3.329 1.00 13.15 H new ATOM 0 HG3 LYS A 31 -7.771 17.001 4.999 1.00 13.15 H new ATOM 0 HD2 LYS A 31 -5.474 18.023 5.252 1.00 74.43 H new ATOM 0 HD3 LYS A 31 -5.216 17.767 3.537 1.00 74.43 H new ATOM 0 HE2 LYS A 31 -7.435 19.446 4.767 1.00 24.03 H new ATOM 0 HE3 LYS A 31 -5.978 20.070 4.019 1.00 24.03 H new ATOM 0 HZ1 LYS A 31 -7.517 20.215 2.336 1.00 4.21 H new ATOM 0 HZ2 LYS A 31 -6.781 18.728 1.976 1.00 4.21 H new ATOM 0 HZ3 LYS A 31 -8.294 18.762 2.746 1.00 4.21 H new ATOM 481 N VAL A 32 -3.619 13.372 4.736 1.00 4.12 N ATOM 482 CA VAL A 32 -3.211 12.028 5.108 1.00 45.32 C ATOM 483 C VAL A 32 -3.845 11.656 6.439 1.00 11.02 C ATOM 484 O VAL A 32 -3.596 12.304 7.454 1.00 64.45 O ATOM 485 CB VAL A 32 -1.674 11.898 5.204 1.00 24.21 C ATOM 486 CG1 VAL A 32 -1.270 10.487 5.609 1.00 42.21 C ATOM 487 CG2 VAL A 32 -1.019 12.278 3.884 1.00 14.23 C ATOM 0 H VAL A 32 -2.938 14.100 4.952 1.00 4.12 H new ATOM 0 HA VAL A 32 -3.550 11.346 4.328 1.00 45.32 H new ATOM 0 HB VAL A 32 -1.327 12.587 5.975 1.00 24.21 H new ATOM 0 HG11 VAL A 32 -0.184 10.423 5.669 1.00 42.21 H new ATOM 0 HG12 VAL A 32 -1.702 10.250 6.581 1.00 42.21 H new ATOM 0 HG13 VAL A 32 -1.635 9.777 4.867 1.00 42.21 H new ATOM 0 HG21 VAL A 32 0.063 12.180 3.973 1.00 14.23 H new ATOM 0 HG22 VAL A 32 -1.380 11.618 3.095 1.00 14.23 H new ATOM 0 HG23 VAL A 32 -1.270 13.309 3.637 1.00 14.23 H new ATOM 497 N HIS A 33 -4.674 10.621 6.433 1.00 71.32 N ATOM 498 CA HIS A 33 -5.360 10.203 7.647 1.00 32.14 C ATOM 499 C HIS A 33 -4.369 9.556 8.603 1.00 43.34 C ATOM 500 O HIS A 33 -4.418 9.783 9.811 1.00 71.44 O ATOM 501 CB HIS A 33 -6.501 9.234 7.317 1.00 31.34 C ATOM 502 CG HIS A 33 -7.278 8.785 8.517 1.00 11.23 C ATOM 503 ND1 HIS A 33 -8.144 9.606 9.202 1.00 14.32 N ATOM 504 CD2 HIS A 33 -7.311 7.591 9.154 1.00 0.52 C ATOM 505 CE1 HIS A 33 -8.676 8.939 10.207 1.00 30.51 C ATOM 506 NE2 HIS A 33 -8.188 7.711 10.201 1.00 11.43 N ATOM 0 H HIS A 33 -4.886 10.060 5.608 1.00 71.32 H new ATOM 0 HA HIS A 33 -5.791 11.081 8.127 1.00 32.14 H new ATOM 0 HB2 HIS A 33 -7.181 9.714 6.614 1.00 31.34 H new ATOM 0 HB3 HIS A 33 -6.089 8.359 6.814 1.00 31.34 H new ATOM 0 HD2 HIS A 33 -6.750 6.707 8.887 1.00 0.52 H new ATOM 0 HE1 HIS A 33 -9.391 9.330 10.916 1.00 30.51 H new ATOM 0 HE2 HIS A 33 -8.425 6.974 10.865 1.00 11.43 H new ATOM 515 N TYR A 34 -3.469 8.758 8.045 1.00 34.04 N ATOM 516 CA TYR A 34 -2.392 8.151 8.809 1.00 74.52 C ATOM 517 C TYR A 34 -1.427 7.463 7.853 1.00 15.50 C ATOM 518 O TYR A 34 -1.782 7.176 6.705 1.00 50.30 O ATOM 519 CB TYR A 34 -2.932 7.135 9.829 1.00 73.42 C ATOM 520 CG TYR A 34 -3.198 5.758 9.256 1.00 71.22 C ATOM 521 CD1 TYR A 34 -4.280 5.521 8.416 1.00 32.14 C ATOM 522 CD2 TYR A 34 -2.352 4.695 9.553 1.00 41.11 C ATOM 523 CE1 TYR A 34 -4.509 4.264 7.891 1.00 45.45 C ATOM 524 CE2 TYR A 34 -2.574 3.438 9.029 1.00 20.13 C ATOM 525 CZ TYR A 34 -3.654 3.228 8.200 1.00 24.15 C ATOM 526 OH TYR A 34 -3.876 1.979 7.672 1.00 73.33 O ATOM 0 H TYR A 34 -3.466 8.515 7.054 1.00 34.04 H new ATOM 0 HA TYR A 34 -1.875 8.935 9.362 1.00 74.52 H new ATOM 0 HB2 TYR A 34 -2.217 7.044 10.647 1.00 73.42 H new ATOM 0 HB3 TYR A 34 -3.857 7.523 10.256 1.00 73.42 H new ATOM 0 HD1 TYR A 34 -4.951 6.331 8.170 1.00 32.14 H new ATOM 0 HD2 TYR A 34 -1.506 4.856 10.205 1.00 41.11 H new ATOM 0 HE1 TYR A 34 -5.355 4.094 7.241 1.00 45.45 H new ATOM 0 HE2 TYR A 34 -1.905 2.624 9.267 1.00 20.13 H new ATOM 0 HH TYR A 34 -3.800 1.306 8.380 1.00 73.33 H new ATOM 536 N GLU A 35 -0.218 7.212 8.320 1.00 63.21 N ATOM 537 CA GLU A 35 0.761 6.471 7.545 1.00 24.32 C ATOM 538 C GLU A 35 1.564 5.549 8.448 1.00 54.23 C ATOM 539 O GLU A 35 1.589 5.729 9.669 1.00 12.21 O ATOM 540 CB GLU A 35 1.686 7.417 6.758 1.00 73.44 C ATOM 541 CG GLU A 35 2.137 8.663 7.512 1.00 23.41 C ATOM 542 CD GLU A 35 3.024 8.369 8.705 1.00 51.51 C ATOM 543 OE1 GLU A 35 4.127 7.819 8.514 1.00 54.43 O ATOM 544 OE2 GLU A 35 2.628 8.716 9.842 1.00 2.22 O ATOM 0 H GLU A 35 0.111 7.512 9.238 1.00 63.21 H new ATOM 0 HA GLU A 35 0.225 5.860 6.818 1.00 24.32 H new ATOM 0 HB2 GLU A 35 2.570 6.860 6.449 1.00 73.44 H new ATOM 0 HB3 GLU A 35 1.171 7.729 5.849 1.00 73.44 H new ATOM 0 HG2 GLU A 35 2.673 9.318 6.825 1.00 23.41 H new ATOM 0 HG3 GLU A 35 1.257 9.209 7.851 1.00 23.41 H new ATOM 551 N ASP A 36 2.186 4.550 7.847 1.00 50.44 N ATOM 552 CA ASP A 36 3.034 3.623 8.576 1.00 52.31 C ATOM 553 C ASP A 36 3.927 2.887 7.586 1.00 70.31 C ATOM 554 O ASP A 36 3.692 2.944 6.374 1.00 24.33 O ATOM 555 CB ASP A 36 2.186 2.631 9.381 1.00 71.52 C ATOM 556 CG ASP A 36 2.926 2.086 10.587 1.00 42.22 C ATOM 557 OD1 ASP A 36 3.770 1.185 10.420 1.00 13.44 O ATOM 558 OD2 ASP A 36 2.672 2.563 11.714 1.00 45.54 O ATOM 0 H ASP A 36 2.119 4.359 6.847 1.00 50.44 H new ATOM 0 HA ASP A 36 3.653 4.177 9.282 1.00 52.31 H new ATOM 0 HB2 ASP A 36 1.271 3.123 9.711 1.00 71.52 H new ATOM 0 HB3 ASP A 36 1.888 1.804 8.736 1.00 71.52 H new ATOM 563 N ALA A 37 4.941 2.204 8.094 1.00 13.42 N ATOM 564 CA ALA A 37 5.920 1.539 7.248 1.00 23.31 C ATOM 565 C ALA A 37 6.756 0.562 8.057 1.00 12.21 C ATOM 566 O ALA A 37 7.148 0.858 9.187 1.00 2.33 O ATOM 567 CB ALA A 37 6.821 2.563 6.582 1.00 54.51 C ATOM 0 H ALA A 37 5.108 2.095 9.094 1.00 13.42 H new ATOM 0 HA ALA A 37 5.384 0.983 6.479 1.00 23.31 H new ATOM 0 HB1 ALA A 37 7.549 2.052 5.952 1.00 54.51 H new ATOM 0 HB2 ALA A 37 6.219 3.234 5.970 1.00 54.51 H new ATOM 0 HB3 ALA A 37 7.343 3.139 7.346 1.00 54.51 H new ATOM 573 N ASP A 38 7.033 -0.594 7.475 1.00 12.14 N ATOM 574 CA ASP A 38 7.833 -1.612 8.142 1.00 65.32 C ATOM 575 C ASP A 38 8.351 -2.610 7.111 1.00 72.32 C ATOM 576 O ASP A 38 7.993 -2.538 5.933 1.00 65.42 O ATOM 577 CB ASP A 38 7.005 -2.326 9.220 1.00 70.14 C ATOM 578 CG ASP A 38 7.856 -2.984 10.299 1.00 21.31 C ATOM 579 OD1 ASP A 38 9.090 -3.074 10.133 1.00 65.41 O ATOM 580 OD2 ASP A 38 7.285 -3.419 11.324 1.00 14.40 O ATOM 0 H ASP A 38 6.716 -0.852 6.541 1.00 12.14 H new ATOM 0 HA ASP A 38 8.682 -1.135 8.632 1.00 65.32 H new ATOM 0 HB2 ASP A 38 6.332 -1.607 9.687 1.00 70.14 H new ATOM 0 HB3 ASP A 38 6.382 -3.084 8.746 1.00 70.14 H new ATOM 585 N VAL A 39 9.202 -3.521 7.547 1.00 62.03 N ATOM 586 CA VAL A 39 9.762 -4.535 6.674 1.00 75.41 C ATOM 587 C VAL A 39 8.956 -5.826 6.753 1.00 73.15 C ATOM 588 O VAL A 39 8.273 -6.082 7.746 1.00 15.04 O ATOM 589 CB VAL A 39 11.232 -4.831 7.032 1.00 2.32 C ATOM 590 CG1 VAL A 39 12.094 -3.603 6.812 1.00 70.14 C ATOM 591 CG2 VAL A 39 11.361 -5.316 8.471 1.00 73.15 C ATOM 0 H VAL A 39 9.523 -3.578 8.513 1.00 62.03 H new ATOM 0 HA VAL A 39 9.718 -4.145 5.657 1.00 75.41 H new ATOM 0 HB VAL A 39 11.581 -5.626 6.373 1.00 2.32 H new ATOM 0 HG11 VAL A 39 13.128 -3.833 7.070 1.00 70.14 H new ATOM 0 HG12 VAL A 39 12.040 -3.303 5.765 1.00 70.14 H new ATOM 0 HG13 VAL A 39 11.735 -2.789 7.442 1.00 70.14 H new ATOM 0 HG21 VAL A 39 12.409 -5.517 8.695 1.00 73.15 H new ATOM 0 HG22 VAL A 39 10.986 -4.549 9.148 1.00 73.15 H new ATOM 0 HG23 VAL A 39 10.781 -6.230 8.600 1.00 73.15 H new ATOM 601 N GLY A 40 9.039 -6.638 5.707 1.00 4.51 N ATOM 602 CA GLY A 40 8.316 -7.895 5.687 1.00 73.02 C ATOM 603 C GLY A 40 6.861 -7.712 5.317 1.00 4.24 C ATOM 604 O GLY A 40 6.014 -7.458 6.177 1.00 12.54 O ATOM 0 H GLY A 40 9.594 -6.449 4.872 1.00 4.51 H new ATOM 0 HA2 GLY A 40 8.788 -8.572 4.975 1.00 73.02 H new ATOM 0 HA3 GLY A 40 8.383 -8.366 6.668 1.00 73.02 H new ATOM 608 N LYS A 41 6.565 -7.831 4.036 1.00 15.33 N ATOM 609 CA LYS A 41 5.207 -7.666 3.552 1.00 24.33 C ATOM 610 C LYS A 41 4.572 -9.032 3.315 1.00 62.11 C ATOM 611 O LYS A 41 4.682 -9.600 2.230 1.00 63.14 O ATOM 612 CB LYS A 41 5.198 -6.837 2.264 1.00 64.11 C ATOM 613 CG LYS A 41 3.807 -6.483 1.765 1.00 23.11 C ATOM 614 CD LYS A 41 3.873 -5.685 0.472 1.00 75.41 C ATOM 615 CE LYS A 41 2.493 -5.476 -0.131 1.00 24.54 C ATOM 616 NZ LYS A 41 2.538 -4.601 -1.332 1.00 74.31 N ATOM 0 H LYS A 41 7.249 -8.042 3.310 1.00 15.33 H new ATOM 0 HA LYS A 41 4.624 -7.134 4.304 1.00 24.33 H new ATOM 0 HB2 LYS A 41 5.757 -5.917 2.433 1.00 64.11 H new ATOM 0 HB3 LYS A 41 5.722 -7.390 1.485 1.00 64.11 H new ATOM 0 HG2 LYS A 41 3.233 -7.395 1.603 1.00 23.11 H new ATOM 0 HG3 LYS A 41 3.281 -5.906 2.525 1.00 23.11 H new ATOM 0 HD2 LYS A 41 4.336 -4.717 0.665 1.00 75.41 H new ATOM 0 HD3 LYS A 41 4.508 -6.205 -0.245 1.00 75.41 H new ATOM 0 HE2 LYS A 41 2.065 -6.441 -0.401 1.00 24.54 H new ATOM 0 HE3 LYS A 41 1.834 -5.033 0.616 1.00 24.54 H new ATOM 0 HZ1 LYS A 41 1.804 -4.899 -2.006 1.00 74.31 H new ATOM 0 HZ2 LYS A 41 2.369 -3.615 -1.049 1.00 74.31 H new ATOM 0 HZ3 LYS A 41 3.473 -4.677 -1.782 1.00 74.31 H new ATOM 630 N ASN A 42 3.942 -9.566 4.352 1.00 53.44 N ATOM 631 CA ASN A 42 3.301 -10.875 4.282 1.00 30.41 C ATOM 632 C ASN A 42 1.944 -10.827 4.976 1.00 14.31 C ATOM 633 O ASN A 42 1.749 -10.039 5.902 1.00 72.31 O ATOM 634 CB ASN A 42 4.181 -11.951 4.939 1.00 23.15 C ATOM 635 CG ASN A 42 5.478 -12.200 4.188 1.00 2.33 C ATOM 636 OD1 ASN A 42 6.491 -11.549 4.442 1.00 53.01 O ATOM 637 ND2 ASN A 42 5.461 -13.153 3.267 1.00 54.54 N ATOM 0 H ASN A 42 3.860 -9.109 5.260 1.00 53.44 H new ATOM 0 HA ASN A 42 3.164 -11.133 3.232 1.00 30.41 H new ATOM 0 HB2 ASN A 42 4.412 -11.649 5.961 1.00 23.15 H new ATOM 0 HB3 ASN A 42 3.619 -12.883 5.001 1.00 23.15 H new ATOM 0 HD21 ASN A 42 6.308 -13.368 2.740 1.00 54.54 H new ATOM 0 HD22 ASN A 42 4.601 -13.671 3.085 1.00 54.54 H new ATOM 644 N PRO A 43 0.984 -11.656 4.536 1.00 73.14 N ATOM 645 CA PRO A 43 -0.358 -11.705 5.129 1.00 35.34 C ATOM 646 C PRO A 43 -0.335 -12.067 6.613 1.00 21.22 C ATOM 647 O PRO A 43 -1.116 -11.537 7.401 1.00 20.34 O ATOM 648 CB PRO A 43 -1.070 -12.803 4.330 1.00 75.21 C ATOM 649 CG PRO A 43 -0.302 -12.913 3.059 1.00 71.50 C ATOM 650 CD PRO A 43 1.121 -12.599 3.415 1.00 63.52 C ATOM 0 HA PRO A 43 -0.849 -10.733 5.080 1.00 35.34 H new ATOM 0 HB2 PRO A 43 -1.072 -13.748 4.873 1.00 75.21 H new ATOM 0 HB3 PRO A 43 -2.111 -12.542 4.141 1.00 75.21 H new ATOM 0 HG2 PRO A 43 -0.388 -13.914 2.635 1.00 71.50 H new ATOM 0 HG3 PRO A 43 -0.681 -12.217 2.311 1.00 71.50 H new ATOM 0 HD2 PRO A 43 1.671 -13.494 3.706 1.00 63.52 H new ATOM 0 HD3 PRO A 43 1.657 -12.154 2.577 1.00 63.52 H new ATOM 658 N ALA A 44 0.579 -12.956 6.992 1.00 70.52 N ATOM 659 CA ALA A 44 0.661 -13.431 8.372 1.00 22.22 C ATOM 660 C ALA A 44 1.271 -12.384 9.307 1.00 74.33 C ATOM 661 O ALA A 44 1.289 -12.564 10.527 1.00 22.41 O ATOM 662 CB ALA A 44 1.461 -14.723 8.433 1.00 4.52 C ATOM 0 H ALA A 44 1.273 -13.362 6.364 1.00 70.52 H new ATOM 0 HA ALA A 44 -0.356 -13.618 8.715 1.00 22.22 H new ATOM 0 HB1 ALA A 44 1.516 -15.068 9.465 1.00 4.52 H new ATOM 0 HB2 ALA A 44 0.973 -15.482 7.822 1.00 4.52 H new ATOM 0 HB3 ALA A 44 2.468 -14.546 8.056 1.00 4.52 H new ATOM 668 N ALA A 45 1.741 -11.282 8.739 1.00 62.12 N ATOM 669 CA ALA A 45 2.376 -10.229 9.523 1.00 15.41 C ATOM 670 C ALA A 45 1.350 -9.436 10.326 1.00 71.21 C ATOM 671 O ALA A 45 1.711 -8.600 11.160 1.00 41.13 O ATOM 672 CB ALA A 45 3.167 -9.305 8.614 1.00 71.42 C ATOM 0 H ALA A 45 1.695 -11.093 7.738 1.00 62.12 H new ATOM 0 HA ALA A 45 3.058 -10.701 10.231 1.00 15.41 H new ATOM 0 HB1 ALA A 45 3.637 -8.523 9.210 1.00 71.42 H new ATOM 0 HB2 ALA A 45 3.936 -9.877 8.095 1.00 71.42 H new ATOM 0 HB3 ALA A 45 2.497 -8.852 7.884 1.00 71.42 H new ATOM 678 N ALA A 46 0.072 -9.717 10.085 1.00 51.15 N ATOM 679 CA ALA A 46 -1.017 -9.046 10.787 1.00 20.42 C ATOM 680 C ALA A 46 -0.972 -9.346 12.281 1.00 71.31 C ATOM 681 O ALA A 46 -1.522 -8.600 13.088 1.00 1.12 O ATOM 682 CB ALA A 46 -2.358 -9.461 10.204 1.00 55.32 C ATOM 0 H ALA A 46 -0.236 -10.411 9.403 1.00 51.15 H new ATOM 0 HA ALA A 46 -0.894 -7.971 10.654 1.00 20.42 H new ATOM 0 HB1 ALA A 46 -3.160 -8.952 10.738 1.00 55.32 H new ATOM 0 HB2 ALA A 46 -2.396 -9.190 9.149 1.00 55.32 H new ATOM 0 HB3 ALA A 46 -2.481 -10.539 10.306 1.00 55.32 H new ATOM 688 N THR A 47 -0.304 -10.440 12.637 1.00 61.41 N ATOM 689 CA THR A 47 -0.121 -10.823 14.031 1.00 41.25 C ATOM 690 C THR A 47 0.601 -9.719 14.813 1.00 62.04 C ATOM 691 O THR A 47 0.391 -9.546 16.018 1.00 24.12 O ATOM 692 CB THR A 47 0.687 -12.132 14.121 1.00 21.45 C ATOM 693 OG1 THR A 47 0.214 -13.058 13.132 1.00 21.41 O ATOM 694 CG2 THR A 47 0.564 -12.757 15.504 1.00 24.44 C ATOM 0 H THR A 47 0.123 -11.082 11.970 1.00 61.41 H new ATOM 0 HA THR A 47 -1.107 -10.974 14.471 1.00 41.25 H new ATOM 0 HB THR A 47 1.737 -11.900 13.941 1.00 21.45 H new ATOM 0 HG1 THR A 47 0.695 -12.912 12.291 1.00 21.41 H new ATOM 0 HG21 THR A 47 1.144 -13.679 15.539 1.00 24.44 H new ATOM 0 HG22 THR A 47 0.943 -12.061 16.253 1.00 24.44 H new ATOM 0 HG23 THR A 47 -0.483 -12.979 15.711 1.00 24.44 H new ATOM 702 N MET A 48 1.448 -8.968 14.115 1.00 73.34 N ATOM 703 CA MET A 48 2.183 -7.869 14.726 1.00 22.22 C ATOM 704 C MET A 48 1.631 -6.534 14.250 1.00 71.31 C ATOM 705 O MET A 48 1.394 -5.624 15.043 1.00 0.43 O ATOM 706 CB MET A 48 3.673 -7.953 14.380 1.00 44.03 C ATOM 707 CG MET A 48 4.358 -9.210 14.888 1.00 1.12 C ATOM 708 SD MET A 48 6.124 -9.243 14.512 1.00 64.12 S ATOM 709 CE MET A 48 6.099 -9.231 12.722 1.00 10.21 C ATOM 0 H MET A 48 1.642 -9.103 13.123 1.00 73.34 H new ATOM 0 HA MET A 48 2.065 -7.946 15.807 1.00 22.22 H new ATOM 0 HB2 MET A 48 3.787 -7.902 13.297 1.00 44.03 H new ATOM 0 HB3 MET A 48 4.181 -7.082 14.795 1.00 44.03 H new ATOM 0 HG2 MET A 48 4.219 -9.284 15.967 1.00 1.12 H new ATOM 0 HG3 MET A 48 3.880 -10.084 14.445 1.00 1.12 H new ATOM 0 HE1 MET A 48 7.058 -9.582 12.342 1.00 10.21 H new ATOM 0 HE2 MET A 48 5.305 -9.887 12.365 1.00 10.21 H new ATOM 0 HE3 MET A 48 5.918 -8.216 12.367 1.00 10.21 H new ATOM 719 N ARG A 49 1.425 -6.430 12.947 1.00 55.51 N ATOM 720 CA ARG A 49 0.970 -5.193 12.342 1.00 2.31 C ATOM 721 C ARG A 49 -0.454 -5.354 11.827 1.00 51.55 C ATOM 722 O ARG A 49 -0.687 -5.991 10.802 1.00 21.34 O ATOM 723 CB ARG A 49 1.923 -4.791 11.215 1.00 2.43 C ATOM 724 CG ARG A 49 3.340 -4.529 11.704 1.00 54.42 C ATOM 725 CD ARG A 49 4.329 -4.401 10.557 1.00 24.40 C ATOM 726 NE ARG A 49 4.514 -5.665 9.840 1.00 51.43 N ATOM 727 CZ ARG A 49 5.673 -6.328 9.790 1.00 53.13 C ATOM 728 NH1 ARG A 49 6.740 -5.864 10.425 1.00 42.40 N ATOM 729 NH2 ARG A 49 5.768 -7.454 9.090 1.00 32.10 N ATOM 0 H ARG A 49 1.567 -7.194 12.286 1.00 55.51 H new ATOM 0 HA ARG A 49 0.968 -4.401 13.091 1.00 2.31 H new ATOM 0 HB2 ARG A 49 1.943 -5.581 10.464 1.00 2.43 H new ATOM 0 HB3 ARG A 49 1.541 -3.895 10.725 1.00 2.43 H new ATOM 0 HG2 ARG A 49 3.354 -3.615 12.298 1.00 54.42 H new ATOM 0 HG3 ARG A 49 3.652 -5.341 12.361 1.00 54.42 H new ATOM 0 HD2 ARG A 49 3.978 -3.639 9.861 1.00 24.40 H new ATOM 0 HD3 ARG A 49 5.290 -4.061 10.944 1.00 24.40 H new ATOM 0 HE ARG A 49 3.712 -6.062 9.351 1.00 51.43 H new ATOM 0 HH11 ARG A 49 6.680 -4.995 10.956 1.00 42.40 H new ATOM 0 HH12 ARG A 49 7.621 -6.376 10.382 1.00 42.40 H new ATOM 0 HH21 ARG A 49 4.955 -7.814 8.590 1.00 32.10 H new ATOM 0 HH22 ARG A 49 6.654 -7.958 9.053 1.00 32.10 H new ATOM 743 N ASN A 50 -1.401 -4.759 12.541 1.00 63.12 N ATOM 744 CA ASN A 50 -2.822 -4.945 12.255 1.00 1.53 C ATOM 745 C ASN A 50 -3.280 -4.033 11.121 1.00 71.10 C ATOM 746 O ASN A 50 -4.478 -3.918 10.849 1.00 42.22 O ATOM 747 CB ASN A 50 -3.658 -4.672 13.511 1.00 64.34 C ATOM 748 CG ASN A 50 -3.201 -5.486 14.709 1.00 0.33 C ATOM 749 OD1 ASN A 50 -2.350 -5.043 15.485 1.00 43.20 O ATOM 750 ND2 ASN A 50 -3.757 -6.676 14.877 1.00 3.51 N ATOM 0 H ASN A 50 -1.211 -4.139 13.328 1.00 63.12 H new ATOM 0 HA ASN A 50 -2.967 -5.980 11.944 1.00 1.53 H new ATOM 0 HB2 ASN A 50 -3.603 -3.611 13.756 1.00 64.34 H new ATOM 0 HB3 ASN A 50 -4.704 -4.897 13.302 1.00 64.34 H new ATOM 0 HD21 ASN A 50 -3.485 -7.259 15.668 1.00 3.51 H new ATOM 0 HD22 ASN A 50 -4.458 -7.010 14.215 1.00 3.51 H new ATOM 757 N VAL A 51 -2.308 -3.401 10.461 1.00 52.22 N ATOM 758 CA VAL A 51 -2.552 -2.509 9.325 1.00 63.51 C ATOM 759 C VAL A 51 -3.378 -3.206 8.246 1.00 44.04 C ATOM 760 O VAL A 51 -4.130 -2.569 7.506 1.00 21.23 O ATOM 761 CB VAL A 51 -1.220 -2.023 8.704 1.00 42.15 C ATOM 762 CG1 VAL A 51 -1.462 -0.947 7.656 1.00 61.14 C ATOM 763 CG2 VAL A 51 -0.275 -1.515 9.782 1.00 60.34 C ATOM 0 H VAL A 51 -1.321 -3.494 10.701 1.00 52.22 H new ATOM 0 HA VAL A 51 -3.107 -1.651 9.704 1.00 63.51 H new ATOM 0 HB VAL A 51 -0.753 -2.875 8.210 1.00 42.15 H new ATOM 0 HG11 VAL A 51 -0.508 -0.625 7.238 1.00 61.14 H new ATOM 0 HG12 VAL A 51 -2.090 -1.348 6.861 1.00 61.14 H new ATOM 0 HG13 VAL A 51 -1.961 -0.095 8.118 1.00 61.14 H new ATOM 0 HG21 VAL A 51 0.654 -1.179 9.322 1.00 60.34 H new ATOM 0 HG22 VAL A 51 -0.740 -0.683 10.311 1.00 60.34 H new ATOM 0 HG23 VAL A 51 -0.061 -2.319 10.487 1.00 60.34 H new ATOM 773 N ALA A 52 -3.225 -4.525 8.167 1.00 13.50 N ATOM 774 CA ALA A 52 -3.957 -5.343 7.206 1.00 51.34 C ATOM 775 C ALA A 52 -5.468 -5.128 7.313 1.00 13.10 C ATOM 776 O ALA A 52 -6.198 -5.364 6.352 1.00 21.31 O ATOM 777 CB ALA A 52 -3.622 -6.813 7.407 1.00 74.33 C ATOM 0 H ALA A 52 -2.592 -5.055 8.766 1.00 13.50 H new ATOM 0 HA ALA A 52 -3.649 -5.035 6.207 1.00 51.34 H new ATOM 0 HB1 ALA A 52 -4.174 -7.414 6.684 1.00 74.33 H new ATOM 0 HB2 ALA A 52 -2.552 -6.965 7.264 1.00 74.33 H new ATOM 0 HB3 ALA A 52 -3.899 -7.115 8.417 1.00 74.33 H new ATOM 783 N GLY A 53 -5.928 -4.675 8.480 1.00 13.34 N ATOM 784 CA GLY A 53 -7.341 -4.402 8.670 1.00 45.22 C ATOM 785 C GLY A 53 -7.830 -3.289 7.763 1.00 23.44 C ATOM 786 O GLY A 53 -8.835 -3.442 7.062 1.00 74.44 O ATOM 0 H GLY A 53 -5.344 -4.493 9.296 1.00 13.34 H new ATOM 0 HA2 GLY A 53 -7.915 -5.308 8.475 1.00 45.22 H new ATOM 0 HA3 GLY A 53 -7.521 -4.128 9.710 1.00 45.22 H new ATOM 790 N GLU A 54 -7.111 -2.172 7.765 1.00 62.14 N ATOM 791 CA GLU A 54 -7.447 -1.044 6.906 1.00 35.44 C ATOM 792 C GLU A 54 -7.257 -1.425 5.445 1.00 64.55 C ATOM 793 O GLU A 54 -8.049 -1.045 4.585 1.00 62.22 O ATOM 794 CB GLU A 54 -6.587 0.182 7.230 1.00 52.12 C ATOM 795 CG GLU A 54 -6.631 0.611 8.689 1.00 1.51 C ATOM 796 CD GLU A 54 -5.614 -0.115 9.546 1.00 21.24 C ATOM 797 OE1 GLU A 54 -5.910 -1.232 10.017 1.00 64.11 O ATOM 798 OE2 GLU A 54 -4.514 0.437 9.761 1.00 54.54 O ATOM 0 H GLU A 54 -6.291 -2.024 8.353 1.00 62.14 H new ATOM 0 HA GLU A 54 -8.491 -0.788 7.087 1.00 35.44 H new ATOM 0 HB2 GLU A 54 -5.553 -0.032 6.958 1.00 52.12 H new ATOM 0 HB3 GLU A 54 -6.915 1.015 6.609 1.00 52.12 H new ATOM 0 HG2 GLU A 54 -6.453 1.684 8.753 1.00 1.51 H new ATOM 0 HG3 GLU A 54 -7.630 0.430 9.086 1.00 1.51 H new ATOM 805 N ILE A 55 -6.208 -2.194 5.179 1.00 55.53 N ATOM 806 CA ILE A 55 -5.907 -2.649 3.827 1.00 72.11 C ATOM 807 C ILE A 55 -7.017 -3.568 3.305 1.00 32.14 C ATOM 808 O ILE A 55 -7.298 -3.610 2.103 1.00 4.44 O ATOM 809 CB ILE A 55 -4.544 -3.379 3.779 1.00 21.14 C ATOM 810 CG1 ILE A 55 -3.430 -2.450 4.271 1.00 3.35 C ATOM 811 CG2 ILE A 55 -4.241 -3.866 2.368 1.00 43.42 C ATOM 812 CD1 ILE A 55 -2.070 -3.113 4.346 1.00 35.10 C ATOM 0 H ILE A 55 -5.548 -2.517 5.886 1.00 55.53 H new ATOM 0 HA ILE A 55 -5.850 -1.771 3.184 1.00 72.11 H new ATOM 0 HB ILE A 55 -4.596 -4.247 4.436 1.00 21.14 H new ATOM 0 HG12 ILE A 55 -3.368 -1.589 3.606 1.00 3.35 H new ATOM 0 HG13 ILE A 55 -3.695 -2.072 5.258 1.00 3.35 H new ATOM 0 HG21 ILE A 55 -3.278 -4.376 2.358 1.00 43.42 H new ATOM 0 HG22 ILE A 55 -5.021 -4.556 2.046 1.00 43.42 H new ATOM 0 HG23 ILE A 55 -4.207 -3.014 1.689 1.00 43.42 H new ATOM 0 HD11 ILE A 55 -1.333 -2.393 4.702 1.00 35.10 H new ATOM 0 HD12 ILE A 55 -2.114 -3.957 5.034 1.00 35.10 H new ATOM 0 HD13 ILE A 55 -1.782 -3.466 3.356 1.00 35.10 H new ATOM 824 N ALA A 56 -7.653 -4.294 4.215 1.00 21.13 N ATOM 825 CA ALA A 56 -8.769 -5.158 3.857 1.00 34.04 C ATOM 826 C ALA A 56 -9.999 -4.329 3.505 1.00 54.43 C ATOM 827 O ALA A 56 -10.726 -4.649 2.567 1.00 2.23 O ATOM 828 CB ALA A 56 -9.082 -6.121 4.991 1.00 12.12 C ATOM 0 H ALA A 56 -7.415 -4.301 5.207 1.00 21.13 H new ATOM 0 HA ALA A 56 -8.485 -5.739 2.980 1.00 34.04 H new ATOM 0 HB1 ALA A 56 -9.919 -6.759 4.706 1.00 12.12 H new ATOM 0 HB2 ALA A 56 -8.208 -6.739 5.195 1.00 12.12 H new ATOM 0 HB3 ALA A 56 -9.345 -5.556 5.886 1.00 12.12 H new ATOM 834 N ALA A 57 -10.222 -3.257 4.253 1.00 15.24 N ATOM 835 CA ALA A 57 -11.336 -2.358 3.977 1.00 34.32 C ATOM 836 C ALA A 57 -11.064 -1.542 2.718 1.00 14.23 C ATOM 837 O ALA A 57 -11.988 -1.139 2.007 1.00 12.53 O ATOM 838 CB ALA A 57 -11.592 -1.444 5.163 1.00 22.14 C ATOM 0 H ALA A 57 -9.649 -2.989 5.053 1.00 15.24 H new ATOM 0 HA ALA A 57 -12.230 -2.959 3.810 1.00 34.32 H new ATOM 0 HB1 ALA A 57 -12.427 -0.781 4.938 1.00 22.14 H new ATOM 0 HB2 ALA A 57 -11.832 -2.045 6.040 1.00 22.14 H new ATOM 0 HB3 ALA A 57 -10.700 -0.850 5.364 1.00 22.14 H new ATOM 844 N ALA A 58 -9.785 -1.301 2.449 1.00 42.04 N ATOM 845 CA ALA A 58 -9.364 -0.624 1.231 1.00 41.40 C ATOM 846 C ALA A 58 -9.669 -1.481 0.007 1.00 1.22 C ATOM 847 O ALA A 58 -9.839 -0.966 -1.094 1.00 41.20 O ATOM 848 CB ALA A 58 -7.879 -0.294 1.296 1.00 34.55 C ATOM 0 H ALA A 58 -9.017 -1.568 3.065 1.00 42.04 H new ATOM 0 HA ALA A 58 -9.923 0.308 1.143 1.00 41.40 H new ATOM 0 HB1 ALA A 58 -7.578 0.212 0.379 1.00 34.55 H new ATOM 0 HB2 ALA A 58 -7.688 0.357 2.149 1.00 34.55 H new ATOM 0 HB3 ALA A 58 -7.306 -1.215 1.407 1.00 34.55 H new ATOM 854 N LEU A 59 -9.750 -2.791 0.211 1.00 25.55 N ATOM 855 CA LEU A 59 -10.110 -3.712 -0.860 1.00 44.25 C ATOM 856 C LEU A 59 -11.539 -3.424 -1.316 1.00 12.30 C ATOM 857 O LEU A 59 -11.841 -3.450 -2.511 1.00 33.15 O ATOM 858 CB LEU A 59 -9.960 -5.167 -0.379 1.00 2.35 C ATOM 859 CG LEU A 59 -10.094 -6.260 -1.449 1.00 61.04 C ATOM 860 CD1 LEU A 59 -9.364 -7.519 -1.003 1.00 63.24 C ATOM 861 CD2 LEU A 59 -11.558 -6.586 -1.723 1.00 72.15 C ATOM 0 H LEU A 59 -9.571 -3.239 1.110 1.00 25.55 H new ATOM 0 HA LEU A 59 -9.440 -3.571 -1.708 1.00 44.25 H new ATOM 0 HB2 LEU A 59 -8.984 -5.271 0.094 1.00 2.35 H new ATOM 0 HB3 LEU A 59 -10.709 -5.350 0.392 1.00 2.35 H new ATOM 0 HG LEU A 59 -9.647 -5.886 -2.370 1.00 61.04 H new ATOM 0 HD11 LEU A 59 -9.465 -8.288 -1.768 1.00 63.24 H new ATOM 0 HD12 LEU A 59 -8.308 -7.293 -0.852 1.00 63.24 H new ATOM 0 HD13 LEU A 59 -9.795 -7.878 -0.069 1.00 63.24 H new ATOM 0 HD21 LEU A 59 -11.621 -7.363 -2.485 1.00 72.15 H new ATOM 0 HD22 LEU A 59 -12.030 -6.938 -0.806 1.00 72.15 H new ATOM 0 HD23 LEU A 59 -12.070 -5.691 -2.075 1.00 72.15 H new ATOM 873 N TYR A 60 -12.405 -3.126 -0.354 1.00 33.22 N ATOM 874 CA TYR A 60 -13.782 -2.759 -0.654 1.00 42.10 C ATOM 875 C TYR A 60 -13.827 -1.406 -1.346 1.00 72.30 C ATOM 876 O TYR A 60 -14.673 -1.167 -2.203 1.00 32.31 O ATOM 877 CB TYR A 60 -14.624 -2.719 0.622 1.00 3.11 C ATOM 878 CG TYR A 60 -14.804 -4.067 1.281 1.00 43.24 C ATOM 879 CD1 TYR A 60 -15.795 -4.944 0.853 1.00 34.41 C ATOM 880 CD2 TYR A 60 -13.988 -4.463 2.331 1.00 22.14 C ATOM 881 CE1 TYR A 60 -15.965 -6.176 1.452 1.00 23.00 C ATOM 882 CE2 TYR A 60 -14.152 -5.694 2.934 1.00 72.53 C ATOM 883 CZ TYR A 60 -15.141 -6.546 2.492 1.00 45.20 C ATOM 884 OH TYR A 60 -15.306 -7.772 3.093 1.00 42.21 O ATOM 0 H TYR A 60 -12.177 -3.132 0.640 1.00 33.22 H new ATOM 0 HA TYR A 60 -14.198 -3.515 -1.320 1.00 42.10 H new ATOM 0 HB2 TYR A 60 -14.156 -2.038 1.333 1.00 3.11 H new ATOM 0 HB3 TYR A 60 -15.605 -2.308 0.385 1.00 3.11 H new ATOM 0 HD1 TYR A 60 -16.443 -4.656 0.038 1.00 34.41 H new ATOM 0 HD2 TYR A 60 -13.213 -3.798 2.682 1.00 22.14 H new ATOM 0 HE1 TYR A 60 -16.739 -6.846 1.107 1.00 23.00 H new ATOM 0 HE2 TYR A 60 -13.508 -5.988 3.749 1.00 72.53 H new ATOM 0 HH TYR A 60 -14.644 -7.878 3.808 1.00 42.21 H new ATOM 894 N ALA A 61 -12.902 -0.529 -0.977 1.00 60.32 N ATOM 895 CA ALA A 61 -12.796 0.779 -1.609 1.00 61.23 C ATOM 896 C ALA A 61 -12.396 0.629 -3.073 1.00 11.21 C ATOM 897 O ALA A 61 -12.898 1.344 -3.939 1.00 74.10 O ATOM 898 CB ALA A 61 -11.797 1.650 -0.863 1.00 22.13 C ATOM 0 H ALA A 61 -12.215 -0.700 -0.243 1.00 60.32 H new ATOM 0 HA ALA A 61 -13.770 1.267 -1.568 1.00 61.23 H new ATOM 0 HB1 ALA A 61 -11.730 2.624 -1.348 1.00 22.13 H new ATOM 0 HB2 ALA A 61 -12.126 1.780 0.168 1.00 22.13 H new ATOM 0 HB3 ALA A 61 -10.818 1.171 -0.873 1.00 22.13 H new ATOM 904 N VAL A 62 -11.497 -0.316 -3.338 1.00 32.34 N ATOM 905 CA VAL A 62 -11.098 -0.640 -4.706 1.00 2.14 C ATOM 906 C VAL A 62 -12.294 -1.172 -5.494 1.00 62.12 C ATOM 907 O VAL A 62 -12.526 -0.782 -6.637 1.00 1.41 O ATOM 908 CB VAL A 62 -9.957 -1.687 -4.733 1.00 71.21 C ATOM 909 CG1 VAL A 62 -9.621 -2.100 -6.159 1.00 61.31 C ATOM 910 CG2 VAL A 62 -8.718 -1.144 -4.040 1.00 34.44 C ATOM 0 H VAL A 62 -11.030 -0.872 -2.622 1.00 32.34 H new ATOM 0 HA VAL A 62 -10.733 0.278 -5.167 1.00 2.14 H new ATOM 0 HB VAL A 62 -10.304 -2.570 -4.196 1.00 71.21 H new ATOM 0 HG11 VAL A 62 -8.817 -2.836 -6.145 1.00 61.31 H new ATOM 0 HG12 VAL A 62 -10.503 -2.535 -6.629 1.00 61.31 H new ATOM 0 HG13 VAL A 62 -9.303 -1.225 -6.726 1.00 61.31 H new ATOM 0 HG21 VAL A 62 -7.927 -1.893 -4.069 1.00 34.44 H new ATOM 0 HG22 VAL A 62 -8.382 -0.242 -4.550 1.00 34.44 H new ATOM 0 HG23 VAL A 62 -8.956 -0.907 -3.003 1.00 34.44 H new ATOM 920 N LYS A 63 -13.062 -2.052 -4.865 1.00 21.50 N ATOM 921 CA LYS A 63 -14.236 -2.632 -5.503 1.00 0.21 C ATOM 922 C LYS A 63 -15.297 -1.555 -5.738 1.00 43.22 C ATOM 923 O LYS A 63 -15.955 -1.531 -6.779 1.00 64.44 O ATOM 924 CB LYS A 63 -14.806 -3.757 -4.635 1.00 23.04 C ATOM 925 CG LYS A 63 -15.844 -4.608 -5.346 1.00 30.31 C ATOM 926 CD LYS A 63 -16.389 -5.694 -4.436 1.00 31.40 C ATOM 927 CE LYS A 63 -17.274 -6.668 -5.198 1.00 34.34 C ATOM 928 NZ LYS A 63 -17.864 -7.697 -4.304 1.00 14.22 N ATOM 0 H LYS A 63 -12.893 -2.380 -3.914 1.00 21.50 H new ATOM 0 HA LYS A 63 -13.942 -3.048 -6.467 1.00 0.21 H new ATOM 0 HB2 LYS A 63 -13.989 -4.398 -4.303 1.00 23.04 H new ATOM 0 HB3 LYS A 63 -15.255 -3.323 -3.741 1.00 23.04 H new ATOM 0 HG2 LYS A 63 -16.662 -3.975 -5.690 1.00 30.31 H new ATOM 0 HG3 LYS A 63 -15.399 -5.063 -6.231 1.00 30.31 H new ATOM 0 HD2 LYS A 63 -15.561 -6.235 -3.978 1.00 31.40 H new ATOM 0 HD3 LYS A 63 -16.960 -5.239 -3.626 1.00 31.40 H new ATOM 0 HE2 LYS A 63 -18.073 -6.119 -5.696 1.00 34.34 H new ATOM 0 HE3 LYS A 63 -16.689 -7.157 -5.977 1.00 34.34 H new ATOM 0 HZ1 LYS A 63 -18.808 -7.960 -4.653 1.00 14.22 H new ATOM 0 HZ2 LYS A 63 -17.253 -8.538 -4.292 1.00 14.22 H new ATOM 0 HZ3 LYS A 63 -17.945 -7.314 -3.340 1.00 14.22 H new ATOM 942 N LYS A 64 -15.435 -0.662 -4.768 1.00 55.50 N ATOM 943 CA LYS A 64 -16.387 0.441 -4.848 1.00 53.54 C ATOM 944 C LYS A 64 -16.000 1.420 -5.953 1.00 71.22 C ATOM 945 O LYS A 64 -16.861 1.986 -6.624 1.00 51.12 O ATOM 946 CB LYS A 64 -16.437 1.185 -3.513 1.00 15.50 C ATOM 947 CG LYS A 64 -17.532 2.240 -3.430 1.00 64.41 C ATOM 948 CD LYS A 64 -17.315 3.187 -2.259 1.00 4.10 C ATOM 949 CE LYS A 64 -17.110 2.438 -0.953 1.00 62.44 C ATOM 950 NZ LYS A 64 -16.940 3.367 0.194 1.00 2.41 N ATOM 0 H LYS A 64 -14.892 -0.680 -3.905 1.00 55.50 H new ATOM 0 HA LYS A 64 -17.367 0.023 -5.077 1.00 53.54 H new ATOM 0 HB2 LYS A 64 -16.583 0.461 -2.711 1.00 15.50 H new ATOM 0 HB3 LYS A 64 -15.473 1.663 -3.339 1.00 15.50 H new ATOM 0 HG2 LYS A 64 -17.559 2.810 -4.359 1.00 64.41 H new ATOM 0 HG3 LYS A 64 -18.501 1.751 -3.328 1.00 64.41 H new ATOM 0 HD2 LYS A 64 -16.447 3.815 -2.457 1.00 4.10 H new ATOM 0 HD3 LYS A 64 -18.174 3.851 -2.165 1.00 4.10 H new ATOM 0 HE2 LYS A 64 -17.964 1.786 -0.770 1.00 62.44 H new ATOM 0 HE3 LYS A 64 -16.232 1.797 -1.035 1.00 62.44 H new ATOM 0 HZ1 LYS A 64 -16.803 2.819 1.067 1.00 2.41 H new ATOM 0 HZ2 LYS A 64 -16.110 3.972 0.031 1.00 2.41 H new ATOM 0 HZ3 LYS A 64 -17.788 3.961 0.288 1.00 2.41 H new ATOM 964 N ALA A 65 -14.699 1.615 -6.134 1.00 13.21 N ATOM 965 CA ALA A 65 -14.188 2.551 -7.128 1.00 55.11 C ATOM 966 C ALA A 65 -14.690 2.205 -8.526 1.00 22.23 C ATOM 967 O ALA A 65 -14.928 3.096 -9.346 1.00 30.11 O ATOM 968 CB ALA A 65 -12.670 2.575 -7.094 1.00 32.32 C ATOM 0 H ALA A 65 -13.975 1.134 -5.601 1.00 13.21 H new ATOM 0 HA ALA A 65 -14.561 3.545 -6.881 1.00 55.11 H new ATOM 0 HB1 ALA A 65 -12.300 3.278 -7.841 1.00 32.32 H new ATOM 0 HB2 ALA A 65 -12.333 2.886 -6.105 1.00 32.32 H new ATOM 0 HB3 ALA A 65 -12.285 1.579 -7.312 1.00 32.32 H new ATOM 974 N SER A 66 -14.870 0.910 -8.780 1.00 41.24 N ATOM 975 CA SER A 66 -15.400 0.432 -10.053 1.00 42.30 C ATOM 976 C SER A 66 -16.757 1.070 -10.344 1.00 23.21 C ATOM 977 O SER A 66 -17.057 1.436 -11.482 1.00 3.33 O ATOM 978 CB SER A 66 -15.559 -1.087 -10.012 1.00 63.31 C ATOM 979 OG SER A 66 -14.579 -1.677 -9.176 1.00 4.45 O ATOM 0 H SER A 66 -14.654 0.168 -8.114 1.00 41.24 H new ATOM 0 HA SER A 66 -14.700 0.709 -10.841 1.00 42.30 H new ATOM 0 HB2 SER A 66 -16.554 -1.342 -9.648 1.00 63.31 H new ATOM 0 HB3 SER A 66 -15.474 -1.493 -11.020 1.00 63.31 H new ATOM 0 HG SER A 66 -14.922 -1.735 -8.260 1.00 4.45 H new ATOM 985 N GLN A 67 -17.558 1.215 -9.293 1.00 70.43 N ATOM 986 CA GLN A 67 -18.902 1.748 -9.401 1.00 62.42 C ATOM 987 C GLN A 67 -18.876 3.243 -9.703 1.00 52.23 C ATOM 988 O GLN A 67 -19.749 3.763 -10.397 1.00 53.12 O ATOM 989 CB GLN A 67 -19.650 1.495 -8.095 1.00 11.12 C ATOM 990 CG GLN A 67 -19.702 0.028 -7.695 1.00 41.11 C ATOM 991 CD GLN A 67 -20.310 -0.178 -6.322 1.00 12.04 C ATOM 992 OE1 GLN A 67 -19.609 -0.194 -5.311 1.00 14.53 O ATOM 993 NE2 GLN A 67 -21.623 -0.326 -6.274 1.00 64.42 N ATOM 0 H GLN A 67 -17.288 0.964 -8.342 1.00 70.43 H new ATOM 0 HA GLN A 67 -19.412 1.246 -10.223 1.00 62.42 H new ATOM 0 HB2 GLN A 67 -19.172 2.063 -7.297 1.00 11.12 H new ATOM 0 HB3 GLN A 67 -20.668 1.873 -8.190 1.00 11.12 H new ATOM 0 HG2 GLN A 67 -20.282 -0.526 -8.433 1.00 41.11 H new ATOM 0 HG3 GLN A 67 -18.693 -0.385 -7.708 1.00 41.11 H new ATOM 0 HE21 GLN A 67 -22.170 -0.307 -7.135 1.00 64.42 H new ATOM 0 HE22 GLN A 67 -22.089 -0.459 -5.376 1.00 64.42 H new ATOM 1002 N LEU A 68 -17.871 3.928 -9.179 1.00 22.10 N ATOM 1003 CA LEU A 68 -17.740 5.368 -9.383 1.00 22.04 C ATOM 1004 C LEU A 68 -17.067 5.672 -10.717 1.00 12.31 C ATOM 1005 O LEU A 68 -17.253 6.749 -11.286 1.00 34.20 O ATOM 1006 CB LEU A 68 -16.949 6.022 -8.242 1.00 22.53 C ATOM 1007 CG LEU A 68 -17.726 6.274 -6.942 1.00 31.40 C ATOM 1008 CD1 LEU A 68 -18.079 4.970 -6.243 1.00 54.32 C ATOM 1009 CD2 LEU A 68 -16.924 7.174 -6.018 1.00 72.04 C ATOM 0 H LEU A 68 -17.133 3.513 -8.609 1.00 22.10 H new ATOM 0 HA LEU A 68 -18.746 5.787 -9.393 1.00 22.04 H new ATOM 0 HB2 LEU A 68 -16.091 5.390 -8.012 1.00 22.53 H new ATOM 0 HB3 LEU A 68 -16.557 6.975 -8.598 1.00 22.53 H new ATOM 0 HG LEU A 68 -18.660 6.773 -7.200 1.00 31.40 H new ATOM 0 HD11 LEU A 68 -18.628 5.186 -5.327 1.00 54.32 H new ATOM 0 HD12 LEU A 68 -18.697 4.360 -6.902 1.00 54.32 H new ATOM 0 HD13 LEU A 68 -17.165 4.429 -5.999 1.00 54.32 H new ATOM 0 HD21 LEU A 68 -17.485 7.345 -5.100 1.00 72.04 H new ATOM 0 HD22 LEU A 68 -15.974 6.696 -5.779 1.00 72.04 H new ATOM 0 HD23 LEU A 68 -16.736 8.127 -6.512 1.00 72.04 H new ATOM 1021 N GLY A 69 -16.285 4.724 -11.210 1.00 73.43 N ATOM 1022 CA GLY A 69 -15.607 4.905 -12.481 1.00 12.04 C ATOM 1023 C GLY A 69 -14.189 5.403 -12.304 1.00 61.33 C ATOM 1024 O GLY A 69 -13.552 5.856 -13.255 1.00 74.30 O ATOM 0 H GLY A 69 -16.106 3.830 -10.753 1.00 73.43 H new ATOM 0 HA2 GLY A 69 -15.594 3.959 -13.022 1.00 12.04 H new ATOM 0 HA3 GLY A 69 -16.166 5.614 -13.092 1.00 12.04 H new ATOM 1028 N VAL A 70 -13.692 5.315 -11.080 1.00 75.43 N ATOM 1029 CA VAL A 70 -12.343 5.761 -10.766 1.00 33.43 C ATOM 1030 C VAL A 70 -11.487 4.579 -10.332 1.00 35.10 C ATOM 1031 O VAL A 70 -11.998 3.475 -10.152 1.00 41.55 O ATOM 1032 CB VAL A 70 -12.335 6.836 -9.654 1.00 55.34 C ATOM 1033 CG1 VAL A 70 -13.048 8.096 -10.119 1.00 71.41 C ATOM 1034 CG2 VAL A 70 -12.971 6.302 -8.376 1.00 61.32 C ATOM 0 H VAL A 70 -14.206 4.937 -10.284 1.00 75.43 H new ATOM 0 HA VAL A 70 -11.930 6.206 -11.671 1.00 33.43 H new ATOM 0 HB VAL A 70 -11.297 7.088 -9.437 1.00 55.34 H new ATOM 0 HG11 VAL A 70 -13.031 8.839 -9.322 1.00 71.41 H new ATOM 0 HG12 VAL A 70 -12.544 8.496 -10.999 1.00 71.41 H new ATOM 0 HG13 VAL A 70 -14.081 7.858 -10.370 1.00 71.41 H new ATOM 0 HG21 VAL A 70 -12.953 7.077 -7.609 1.00 61.32 H new ATOM 0 HG22 VAL A 70 -14.003 6.013 -8.576 1.00 61.32 H new ATOM 0 HG23 VAL A 70 -12.412 5.433 -8.027 1.00 61.32 H new ATOM 1044 N LYS A 71 -10.194 4.807 -10.172 1.00 35.05 N ATOM 1045 CA LYS A 71 -9.286 3.759 -9.743 1.00 13.43 C ATOM 1046 C LYS A 71 -8.080 4.350 -9.032 1.00 54.20 C ATOM 1047 O LYS A 71 -7.960 5.571 -8.912 1.00 72.13 O ATOM 1048 CB LYS A 71 -8.836 2.923 -10.924 1.00 21.22 C ATOM 1049 CG LYS A 71 -7.911 3.663 -11.834 1.00 53.44 C ATOM 1050 CD LYS A 71 -7.065 2.715 -12.636 1.00 62.32 C ATOM 1051 CE LYS A 71 -5.910 3.473 -13.202 1.00 43.14 C ATOM 1052 NZ LYS A 71 -5.151 2.687 -14.209 1.00 45.02 N ATOM 0 H LYS A 71 -9.750 5.711 -10.333 1.00 35.05 H new ATOM 0 HA LYS A 71 -9.821 3.116 -9.045 1.00 13.43 H new ATOM 0 HB2 LYS A 71 -8.339 2.024 -10.559 1.00 21.22 H new ATOM 0 HB3 LYS A 71 -9.710 2.597 -11.488 1.00 21.22 H new ATOM 0 HG2 LYS A 71 -8.488 4.297 -12.507 1.00 53.44 H new ATOM 0 HG3 LYS A 71 -7.269 4.321 -11.248 1.00 53.44 H new ATOM 0 HD2 LYS A 71 -6.710 1.899 -12.007 1.00 62.32 H new ATOM 0 HD3 LYS A 71 -7.653 2.267 -13.437 1.00 62.32 H new ATOM 0 HE2 LYS A 71 -6.273 4.392 -13.662 1.00 43.14 H new ATOM 0 HE3 LYS A 71 -5.240 3.765 -12.393 1.00 43.14 H new ATOM 0 HZ1 LYS A 71 -4.774 3.327 -14.937 1.00 45.02 H new ATOM 0 HZ2 LYS A 71 -4.364 2.192 -13.742 1.00 45.02 H new ATOM 0 HZ3 LYS A 71 -5.783 1.991 -14.654 1.00 45.02 H new ATOM 1066 N ILE A 72 -7.194 3.484 -8.559 1.00 11.51 N ATOM 1067 CA ILE A 72 -5.967 3.921 -7.910 1.00 3.42 C ATOM 1068 C ILE A 72 -4.757 3.297 -8.598 1.00 40.34 C ATOM 1069 O ILE A 72 -4.899 2.365 -9.392 1.00 4.34 O ATOM 1070 CB ILE A 72 -5.954 3.587 -6.393 1.00 1.42 C ATOM 1071 CG1 ILE A 72 -6.166 2.089 -6.133 1.00 72.34 C ATOM 1072 CG2 ILE A 72 -7.010 4.398 -5.661 1.00 44.30 C ATOM 1073 CD1 ILE A 72 -4.890 1.272 -6.144 1.00 52.40 C ATOM 0 H ILE A 72 -7.304 2.471 -8.613 1.00 11.51 H new ATOM 0 HA ILE A 72 -5.918 5.006 -8.003 1.00 3.42 H new ATOM 0 HB ILE A 72 -4.968 3.853 -6.012 1.00 1.42 H new ATOM 0 HG12 ILE A 72 -6.656 1.965 -5.167 1.00 72.34 H new ATOM 0 HG13 ILE A 72 -6.845 1.693 -6.888 1.00 72.34 H new ATOM 0 HG21 ILE A 72 -6.987 4.152 -4.599 1.00 44.30 H new ATOM 0 HG22 ILE A 72 -6.807 5.461 -5.791 1.00 44.30 H new ATOM 0 HG23 ILE A 72 -7.994 4.164 -6.067 1.00 44.30 H new ATOM 0 HD11 ILE A 72 -5.126 0.225 -5.953 1.00 52.40 H new ATOM 0 HD12 ILE A 72 -4.408 1.363 -7.117 1.00 52.40 H new ATOM 0 HD13 ILE A 72 -4.216 1.639 -5.370 1.00 52.40 H new ATOM 1085 N ARG A 73 -3.575 3.809 -8.298 1.00 15.34 N ATOM 1086 CA ARG A 73 -2.351 3.299 -8.893 1.00 10.40 C ATOM 1087 C ARG A 73 -1.276 3.139 -7.832 1.00 73.13 C ATOM 1088 O ARG A 73 -1.178 3.953 -6.913 1.00 74.02 O ATOM 1089 CB ARG A 73 -1.858 4.235 -9.999 1.00 43.25 C ATOM 1090 CG ARG A 73 -1.507 5.636 -9.518 1.00 52.22 C ATOM 1091 CD ARG A 73 -0.887 6.466 -10.628 1.00 43.52 C ATOM 1092 NE ARG A 73 -0.444 7.779 -10.146 1.00 24.45 N ATOM 1093 CZ ARG A 73 0.362 8.595 -10.828 1.00 74.14 C ATOM 1094 NH1 ARG A 73 0.804 8.241 -12.030 1.00 11.53 N ATOM 1095 NH2 ARG A 73 0.725 9.766 -10.306 1.00 44.21 N ATOM 0 H ARG A 73 -3.437 4.580 -7.644 1.00 15.34 H new ATOM 0 HA ARG A 73 -2.565 2.324 -9.331 1.00 10.40 H new ATOM 0 HB2 ARG A 73 -0.979 3.793 -10.469 1.00 43.25 H new ATOM 0 HB3 ARG A 73 -2.627 4.309 -10.768 1.00 43.25 H new ATOM 0 HG2 ARG A 73 -2.406 6.131 -9.150 1.00 52.22 H new ATOM 0 HG3 ARG A 73 -0.813 5.571 -8.680 1.00 52.22 H new ATOM 0 HD2 ARG A 73 -0.038 5.929 -11.052 1.00 43.52 H new ATOM 0 HD3 ARG A 73 -1.613 6.600 -11.430 1.00 43.52 H new ATOM 0 HE ARG A 73 -0.773 8.088 -9.231 1.00 24.45 H new ATOM 0 HH11 ARG A 73 0.527 7.345 -12.432 1.00 11.53 H new ATOM 0 HH12 ARG A 73 1.420 8.865 -12.551 1.00 11.53 H new ATOM 0 HH21 ARG A 73 0.387 10.040 -9.384 1.00 44.21 H new ATOM 0 HH22 ARG A 73 1.341 10.388 -10.829 1.00 44.21 H new ATOM 1109 N ILE A 74 -0.492 2.081 -7.939 1.00 63.33 N ATOM 1110 CA ILE A 74 0.632 1.894 -7.041 1.00 52.44 C ATOM 1111 C ILE A 74 1.930 2.200 -7.783 1.00 24.31 C ATOM 1112 O ILE A 74 2.074 1.871 -8.961 1.00 12.12 O ATOM 1113 CB ILE A 74 0.662 0.470 -6.430 1.00 51.50 C ATOM 1114 CG1 ILE A 74 1.712 0.396 -5.317 1.00 33.55 C ATOM 1115 CG2 ILE A 74 0.934 -0.580 -7.503 1.00 35.45 C ATOM 1116 CD1 ILE A 74 1.625 -0.860 -4.479 1.00 42.23 C ATOM 0 H ILE A 74 -0.612 1.344 -8.633 1.00 63.33 H new ATOM 0 HA ILE A 74 0.520 2.586 -6.206 1.00 52.44 H new ATOM 0 HB ILE A 74 -0.317 0.259 -6.000 1.00 51.50 H new ATOM 0 HG12 ILE A 74 2.705 0.456 -5.762 1.00 33.55 H new ATOM 0 HG13 ILE A 74 1.601 1.264 -4.667 1.00 33.55 H new ATOM 0 HG21 ILE A 74 0.950 -1.570 -7.047 1.00 35.45 H new ATOM 0 HG22 ILE A 74 0.149 -0.540 -8.258 1.00 35.45 H new ATOM 0 HG23 ILE A 74 1.898 -0.381 -7.971 1.00 35.45 H new ATOM 0 HD11 ILE A 74 2.400 -0.840 -3.713 1.00 42.23 H new ATOM 0 HD12 ILE A 74 0.646 -0.913 -4.004 1.00 42.23 H new ATOM 0 HD13 ILE A 74 1.767 -1.733 -5.116 1.00 42.23 H new ATOM 1128 N LEU A 75 2.856 2.869 -7.110 1.00 23.23 N ATOM 1129 CA LEU A 75 4.064 3.348 -7.766 1.00 42.54 C ATOM 1130 C LEU A 75 5.324 2.757 -7.140 1.00 63.34 C ATOM 1131 O LEU A 75 6.401 3.341 -7.249 1.00 42.21 O ATOM 1132 CB LEU A 75 4.144 4.882 -7.700 1.00 65.42 C ATOM 1133 CG LEU A 75 3.003 5.652 -8.381 1.00 71.32 C ATOM 1134 CD1 LEU A 75 1.778 5.732 -7.481 1.00 75.31 C ATOM 1135 CD2 LEU A 75 3.462 7.047 -8.770 1.00 73.15 C ATOM 0 H LEU A 75 2.795 3.091 -6.116 1.00 23.23 H new ATOM 0 HA LEU A 75 4.009 3.024 -8.805 1.00 42.54 H new ATOM 0 HB2 LEU A 75 4.179 5.178 -6.652 1.00 65.42 H new ATOM 0 HB3 LEU A 75 5.085 5.195 -8.151 1.00 65.42 H new ATOM 0 HG LEU A 75 2.724 5.108 -9.283 1.00 71.32 H new ATOM 0 HD11 LEU A 75 0.987 6.283 -7.991 1.00 75.31 H new ATOM 0 HD12 LEU A 75 1.429 4.725 -7.251 1.00 75.31 H new ATOM 0 HD13 LEU A 75 2.039 6.245 -6.556 1.00 75.31 H new ATOM 0 HD21 LEU A 75 2.641 7.579 -9.251 1.00 73.15 H new ATOM 0 HD22 LEU A 75 3.772 7.590 -7.877 1.00 73.15 H new ATOM 0 HD23 LEU A 75 4.302 6.974 -9.461 1.00 73.15 H new ATOM 1147 N HIS A 76 5.214 1.598 -6.498 1.00 22.32 N ATOM 1148 CA HIS A 76 6.385 1.011 -5.859 1.00 42.52 C ATOM 1149 C HIS A 76 6.412 -0.509 -5.999 1.00 43.30 C ATOM 1150 O HIS A 76 7.108 -1.038 -6.860 1.00 50.43 O ATOM 1151 CB HIS A 76 6.459 1.412 -4.386 1.00 54.13 C ATOM 1152 CG HIS A 76 7.862 1.608 -3.905 1.00 75.32 C ATOM 1153 ND1 HIS A 76 8.482 0.772 -2.999 1.00 54.24 N ATOM 1154 CD2 HIS A 76 8.770 2.561 -4.217 1.00 53.44 C ATOM 1155 CE1 HIS A 76 9.709 1.209 -2.773 1.00 42.13 C ATOM 1156 NE2 HIS A 76 9.908 2.292 -3.500 1.00 41.54 N ATOM 0 H HIS A 76 4.352 1.060 -6.407 1.00 22.32 H new ATOM 0 HA HIS A 76 7.261 1.404 -6.374 1.00 42.52 H new ATOM 0 HB2 HIS A 76 5.897 2.334 -4.237 1.00 54.13 H new ATOM 0 HB3 HIS A 76 5.977 0.644 -3.781 1.00 54.13 H new ATOM 0 HD2 HIS A 76 8.626 3.382 -4.904 1.00 53.44 H new ATOM 0 HE1 HIS A 76 10.427 0.756 -2.106 1.00 42.13 H new ATOM 0 HE2 HIS A 76 10.768 2.840 -3.525 1.00 41.54 H new ATOM 1165 N ASP A 77 5.655 -1.208 -5.159 1.00 61.12 N ATOM 1166 CA ASP A 77 5.682 -2.670 -5.164 1.00 42.44 C ATOM 1167 C ASP A 77 4.595 -3.245 -6.050 1.00 11.31 C ATOM 1168 O ASP A 77 3.411 -2.965 -5.870 1.00 10.55 O ATOM 1169 CB ASP A 77 5.546 -3.241 -3.749 1.00 11.45 C ATOM 1170 CG ASP A 77 5.315 -4.748 -3.750 1.00 21.55 C ATOM 1171 OD1 ASP A 77 6.040 -5.472 -4.473 1.00 42.52 O ATOM 1172 OD2 ASP A 77 4.408 -5.209 -3.023 1.00 64.10 O ATOM 0 H ASP A 77 5.023 -0.794 -4.474 1.00 61.12 H new ATOM 0 HA ASP A 77 6.652 -2.961 -5.567 1.00 42.44 H new ATOM 0 HB2 ASP A 77 6.448 -3.015 -3.181 1.00 11.45 H new ATOM 0 HB3 ASP A 77 4.717 -2.749 -3.240 1.00 11.45 H new ATOM 1177 N TYR A 78 5.016 -4.042 -7.010 1.00 42.21 N ATOM 1178 CA TYR A 78 4.101 -4.768 -7.868 1.00 72.31 C ATOM 1179 C TYR A 78 4.634 -6.185 -8.061 1.00 61.11 C ATOM 1180 O TYR A 78 4.040 -7.009 -8.755 1.00 64.13 O ATOM 1181 CB TYR A 78 3.965 -4.040 -9.210 1.00 4.40 C ATOM 1182 CG TYR A 78 2.788 -4.488 -10.049 1.00 41.22 C ATOM 1183 CD1 TYR A 78 1.493 -4.132 -9.700 1.00 12.45 C ATOM 1184 CD2 TYR A 78 2.973 -5.257 -11.192 1.00 32.31 C ATOM 1185 CE1 TYR A 78 0.415 -4.530 -10.465 1.00 40.21 C ATOM 1186 CE2 TYR A 78 1.899 -5.657 -11.963 1.00 4.11 C ATOM 1187 CZ TYR A 78 0.623 -5.292 -11.593 1.00 14.43 C ATOM 1188 OH TYR A 78 -0.449 -5.683 -12.359 1.00 0.45 O ATOM 0 H TYR A 78 6.001 -4.205 -7.218 1.00 42.21 H new ATOM 0 HA TYR A 78 3.112 -4.821 -7.413 1.00 72.31 H new ATOM 0 HB2 TYR A 78 3.875 -2.970 -9.021 1.00 4.40 H new ATOM 0 HB3 TYR A 78 4.881 -4.186 -9.783 1.00 4.40 H new ATOM 0 HD1 TYR A 78 1.326 -3.534 -8.816 1.00 12.45 H new ATOM 0 HD2 TYR A 78 3.972 -5.546 -11.482 1.00 32.31 H new ATOM 0 HE1 TYR A 78 -0.587 -4.245 -10.180 1.00 40.21 H new ATOM 0 HE2 TYR A 78 2.058 -6.252 -12.850 1.00 4.11 H new ATOM 0 HH TYR A 78 -0.132 -6.214 -13.119 1.00 0.45 H new ATOM 1198 N ALA A 79 5.758 -6.457 -7.408 1.00 70.12 N ATOM 1199 CA ALA A 79 6.460 -7.718 -7.573 1.00 25.43 C ATOM 1200 C ALA A 79 6.059 -8.726 -6.502 1.00 2.03 C ATOM 1201 O ALA A 79 5.739 -9.875 -6.811 1.00 63.02 O ATOM 1202 CB ALA A 79 7.964 -7.491 -7.544 1.00 11.15 C ATOM 0 H ALA A 79 6.203 -5.813 -6.754 1.00 70.12 H new ATOM 0 HA ALA A 79 6.179 -8.131 -8.542 1.00 25.43 H new ATOM 0 HB1 ALA A 79 8.478 -8.444 -7.669 1.00 11.15 H new ATOM 0 HB2 ALA A 79 8.246 -6.818 -8.354 1.00 11.15 H new ATOM 0 HB3 ALA A 79 8.247 -7.048 -6.589 1.00 11.15 H new ATOM 1208 N GLY A 80 6.074 -8.292 -5.244 1.00 72.40 N ATOM 1209 CA GLY A 80 5.810 -9.199 -4.139 1.00 52.24 C ATOM 1210 C GLY A 80 4.383 -9.707 -4.137 1.00 25.15 C ATOM 1211 O GLY A 80 4.103 -10.814 -3.675 1.00 34.50 O ATOM 0 H GLY A 80 6.264 -7.328 -4.970 1.00 72.40 H new ATOM 0 HA2 GLY A 80 6.494 -10.046 -4.196 1.00 52.24 H new ATOM 0 HA3 GLY A 80 6.012 -8.689 -3.197 1.00 52.24 H new ATOM 1215 N ILE A 81 3.488 -8.895 -4.676 1.00 42.25 N ATOM 1216 CA ILE A 81 2.071 -9.221 -4.733 1.00 53.11 C ATOM 1217 C ILE A 81 1.818 -10.434 -5.634 1.00 75.25 C ATOM 1218 O ILE A 81 0.862 -11.183 -5.436 1.00 0.30 O ATOM 1219 CB ILE A 81 1.262 -8.009 -5.248 1.00 2.14 C ATOM 1220 CG1 ILE A 81 1.578 -6.771 -4.401 1.00 64.41 C ATOM 1221 CG2 ILE A 81 -0.229 -8.307 -5.220 1.00 41.14 C ATOM 1222 CD1 ILE A 81 0.915 -5.504 -4.893 1.00 62.34 C ATOM 0 H ILE A 81 3.723 -7.991 -5.086 1.00 42.25 H new ATOM 0 HA ILE A 81 1.744 -9.469 -3.723 1.00 53.11 H new ATOM 0 HB ILE A 81 1.549 -7.812 -6.281 1.00 2.14 H new ATOM 0 HG12 ILE A 81 1.266 -6.957 -3.373 1.00 64.41 H new ATOM 0 HG13 ILE A 81 2.657 -6.621 -4.384 1.00 64.41 H new ATOM 0 HG21 ILE A 81 -0.780 -7.441 -5.586 1.00 41.14 H new ATOM 0 HG22 ILE A 81 -0.440 -9.167 -5.856 1.00 41.14 H new ATOM 0 HG23 ILE A 81 -0.537 -8.527 -4.198 1.00 41.14 H new ATOM 0 HD11 ILE A 81 1.188 -4.674 -4.241 1.00 62.34 H new ATOM 0 HD12 ILE A 81 1.246 -5.291 -5.909 1.00 62.34 H new ATOM 0 HD13 ILE A 81 -0.167 -5.632 -4.883 1.00 62.34 H new ATOM 1234 N ALA A 82 2.706 -10.647 -6.599 1.00 51.34 N ATOM 1235 CA ALA A 82 2.524 -11.707 -7.585 1.00 63.00 C ATOM 1236 C ALA A 82 2.810 -13.089 -7.003 1.00 21.41 C ATOM 1237 O ALA A 82 2.526 -14.106 -7.636 1.00 44.22 O ATOM 1238 CB ALA A 82 3.411 -11.450 -8.793 1.00 13.42 C ATOM 0 H ALA A 82 3.559 -10.100 -6.720 1.00 51.34 H new ATOM 0 HA ALA A 82 1.478 -11.696 -7.892 1.00 63.00 H new ATOM 0 HB1 ALA A 82 3.269 -12.246 -9.524 1.00 13.42 H new ATOM 0 HB2 ALA A 82 3.146 -10.493 -9.242 1.00 13.42 H new ATOM 0 HB3 ALA A 82 4.455 -11.427 -8.480 1.00 13.42 H new ATOM 1244 N PHE A 83 3.364 -13.124 -5.799 1.00 61.13 N ATOM 1245 CA PHE A 83 3.730 -14.386 -5.165 1.00 22.24 C ATOM 1246 C PHE A 83 2.492 -15.162 -4.712 1.00 31.22 C ATOM 1247 O PHE A 83 2.363 -16.357 -4.980 1.00 53.21 O ATOM 1248 CB PHE A 83 4.660 -14.130 -3.973 1.00 31.31 C ATOM 1249 CG PHE A 83 5.035 -15.375 -3.217 1.00 12.35 C ATOM 1250 CD1 PHE A 83 5.957 -16.270 -3.738 1.00 4.03 C ATOM 1251 CD2 PHE A 83 4.468 -15.647 -1.983 1.00 21.31 C ATOM 1252 CE1 PHE A 83 6.304 -17.412 -3.043 1.00 62.20 C ATOM 1253 CE2 PHE A 83 4.812 -16.789 -1.284 1.00 74.51 C ATOM 1254 CZ PHE A 83 5.731 -17.672 -1.815 1.00 34.25 C ATOM 0 H PHE A 83 3.570 -12.295 -5.241 1.00 61.13 H new ATOM 0 HA PHE A 83 4.254 -14.992 -5.904 1.00 22.24 H new ATOM 0 HB2 PHE A 83 5.569 -13.646 -4.331 1.00 31.31 H new ATOM 0 HB3 PHE A 83 4.175 -13.433 -3.289 1.00 31.31 H new ATOM 0 HD1 PHE A 83 6.409 -16.072 -4.699 1.00 4.03 H new ATOM 0 HD2 PHE A 83 3.749 -14.959 -1.562 1.00 21.31 H new ATOM 0 HE1 PHE A 83 7.023 -18.101 -3.460 1.00 62.20 H new ATOM 0 HE2 PHE A 83 4.362 -16.990 -0.323 1.00 74.51 H new ATOM 0 HZ PHE A 83 6.001 -18.565 -1.270 1.00 34.25 H new ATOM 1264 N TRP A 84 1.573 -14.473 -4.049 1.00 44.31 N ATOM 1265 CA TRP A 84 0.418 -15.127 -3.441 1.00 61.14 C ATOM 1266 C TRP A 84 -0.600 -15.572 -4.490 1.00 60.33 C ATOM 1267 O TRP A 84 -1.441 -16.432 -4.224 1.00 34.44 O ATOM 1268 CB TRP A 84 -0.233 -14.194 -2.422 1.00 23.32 C ATOM 1269 CG TRP A 84 0.725 -13.725 -1.374 1.00 52.44 C ATOM 1270 CD1 TRP A 84 1.320 -14.489 -0.414 1.00 1.14 C ATOM 1271 CD2 TRP A 84 1.202 -12.390 -1.182 1.00 63.24 C ATOM 1272 NE1 TRP A 84 2.144 -13.713 0.363 1.00 54.24 N ATOM 1273 CE2 TRP A 84 2.086 -12.418 -0.087 1.00 63.43 C ATOM 1274 CE3 TRP A 84 0.968 -11.175 -1.828 1.00 43.04 C ATOM 1275 CZ2 TRP A 84 2.737 -11.276 0.373 1.00 11.44 C ATOM 1276 CZ3 TRP A 84 1.614 -10.042 -1.370 1.00 53.11 C ATOM 1277 CH2 TRP A 84 2.489 -10.100 -0.279 1.00 54.25 C ATOM 0 H TRP A 84 1.603 -13.462 -3.918 1.00 44.31 H new ATOM 0 HA TRP A 84 0.770 -16.024 -2.932 1.00 61.14 H new ATOM 0 HB2 TRP A 84 -0.649 -13.330 -2.940 1.00 23.32 H new ATOM 0 HB3 TRP A 84 -1.065 -14.710 -1.943 1.00 23.32 H new ATOM 0 HD1 TRP A 84 1.166 -15.550 -0.284 1.00 1.14 H new ATOM 0 HE1 TRP A 84 2.707 -14.045 1.146 1.00 54.24 H new ATOM 0 HE3 TRP A 84 0.294 -11.121 -2.670 1.00 43.04 H new ATOM 0 HZ2 TRP A 84 3.413 -11.318 1.214 1.00 11.44 H new ATOM 0 HZ3 TRP A 84 1.441 -9.096 -1.862 1.00 53.11 H new ATOM 0 HH2 TRP A 84 2.978 -9.197 0.055 1.00 54.25 H new ATOM 1288 N ALA A 85 -0.501 -15.003 -5.688 1.00 42.14 N ATOM 1289 CA ALA A 85 -1.413 -15.339 -6.779 1.00 22.31 C ATOM 1290 C ALA A 85 -1.217 -16.779 -7.245 1.00 24.41 C ATOM 1291 O ALA A 85 -2.109 -17.374 -7.850 1.00 12.02 O ATOM 1292 CB ALA A 85 -1.217 -14.380 -7.943 1.00 31.44 C ATOM 0 H ALA A 85 0.203 -14.305 -5.929 1.00 42.14 H new ATOM 0 HA ALA A 85 -2.432 -15.243 -6.404 1.00 22.31 H new ATOM 0 HB1 ALA A 85 -1.902 -14.641 -8.749 1.00 31.44 H new ATOM 0 HB2 ALA A 85 -1.417 -13.361 -7.612 1.00 31.44 H new ATOM 0 HB3 ALA A 85 -0.190 -14.450 -8.303 1.00 31.44 H new ATOM 1298 N THR A 86 -0.050 -17.335 -6.955 1.00 21.13 N ATOM 1299 CA THR A 86 0.275 -18.685 -7.379 1.00 32.15 C ATOM 1300 C THR A 86 0.552 -19.575 -6.163 1.00 32.40 C ATOM 1301 O THR A 86 1.280 -20.569 -6.252 1.00 62.43 O ATOM 1302 CB THR A 86 1.488 -18.674 -8.341 1.00 15.12 C ATOM 1303 OG1 THR A 86 1.735 -19.988 -8.860 1.00 1.42 O ATOM 1304 CG2 THR A 86 2.740 -18.152 -7.649 1.00 35.33 C ATOM 0 H THR A 86 0.688 -16.869 -6.427 1.00 21.13 H new ATOM 0 HA THR A 86 -0.580 -19.096 -7.915 1.00 32.15 H new ATOM 0 HB THR A 86 1.244 -18.004 -9.165 1.00 15.12 H new ATOM 0 HG1 THR A 86 1.728 -20.637 -8.125 1.00 1.42 H new ATOM 0 HG21 THR A 86 3.573 -18.157 -8.352 1.00 35.33 H new ATOM 0 HG22 THR A 86 2.566 -17.134 -7.301 1.00 35.33 H new ATOM 0 HG23 THR A 86 2.979 -18.791 -6.799 1.00 35.33 H new ATOM 1312 N GLY A 87 -0.065 -19.216 -5.036 1.00 64.10 N ATOM 1313 CA GLY A 87 0.102 -19.967 -3.801 1.00 51.50 C ATOM 1314 C GLY A 87 -0.233 -21.440 -3.956 1.00 33.34 C ATOM 1315 O GLY A 87 0.662 -22.288 -3.953 1.00 14.12 O ATOM 0 H GLY A 87 -0.684 -18.409 -4.958 1.00 64.10 H new ATOM 0 HA2 GLY A 87 1.132 -19.868 -3.458 1.00 51.50 H new ATOM 0 HA3 GLY A 87 -0.534 -19.534 -3.029 1.00 51.50 H new ATOM 1319 N GLU A 88 -1.518 -21.747 -4.082 1.00 41.42 N ATOM 1320 CA GLU A 88 -1.953 -23.119 -4.298 1.00 21.54 C ATOM 1321 C GLU A 88 -2.163 -23.379 -5.781 1.00 31.11 C ATOM 1322 O GLU A 88 -1.528 -24.247 -6.380 1.00 42.32 O ATOM 1323 CB GLU A 88 -3.277 -23.394 -3.590 1.00 13.24 C ATOM 1324 CG GLU A 88 -3.275 -23.166 -2.093 1.00 74.32 C ATOM 1325 CD GLU A 88 -4.585 -23.609 -1.477 1.00 62.14 C ATOM 1326 OE1 GLU A 88 -5.630 -22.998 -1.789 1.00 21.13 O ATOM 1327 OE2 GLU A 88 -4.583 -24.596 -0.715 1.00 23.50 O ATOM 0 H GLU A 88 -2.275 -21.065 -4.038 1.00 41.42 H new ATOM 0 HA GLU A 88 -1.175 -23.770 -3.898 1.00 21.54 H new ATOM 0 HB2 GLU A 88 -4.045 -22.762 -4.035 1.00 13.24 H new ATOM 0 HB3 GLU A 88 -3.564 -24.428 -3.782 1.00 13.24 H new ATOM 0 HG2 GLU A 88 -2.451 -23.716 -1.639 1.00 74.32 H new ATOM 0 HG3 GLU A 88 -3.108 -22.110 -1.882 1.00 74.32 H new ATOM 1334 N TRP A 89 -3.065 -22.593 -6.351 1.00 55.04 N ATOM 1335 CA TRP A 89 -3.540 -22.772 -7.711 1.00 32.14 C ATOM 1336 C TRP A 89 -4.455 -21.588 -8.034 1.00 65.15 C ATOM 1337 O TRP A 89 -4.427 -20.590 -7.314 1.00 61.12 O ATOM 1338 CB TRP A 89 -4.282 -24.118 -7.839 1.00 24.05 C ATOM 1339 CG TRP A 89 -4.629 -24.494 -9.250 1.00 2.23 C ATOM 1340 CD1 TRP A 89 -3.815 -24.418 -10.340 1.00 73.24 C ATOM 1341 CD2 TRP A 89 -5.882 -25.010 -9.718 1.00 2.44 C ATOM 1342 NE1 TRP A 89 -4.491 -24.832 -11.461 1.00 32.22 N ATOM 1343 CE2 TRP A 89 -5.757 -25.208 -11.105 1.00 32.51 C ATOM 1344 CE3 TRP A 89 -7.097 -25.319 -9.100 1.00 61.45 C ATOM 1345 CZ2 TRP A 89 -6.801 -25.701 -11.884 1.00 12.24 C ATOM 1346 CZ3 TRP A 89 -8.131 -25.812 -9.875 1.00 50.40 C ATOM 1347 CH2 TRP A 89 -7.977 -25.998 -11.254 1.00 63.14 C ATOM 0 H TRP A 89 -3.493 -21.801 -5.872 1.00 55.04 H new ATOM 0 HA TRP A 89 -2.712 -22.798 -8.419 1.00 32.14 H new ATOM 0 HB2 TRP A 89 -3.663 -24.904 -7.406 1.00 24.05 H new ATOM 0 HB3 TRP A 89 -5.198 -24.073 -7.250 1.00 24.05 H new ATOM 0 HD1 TRP A 89 -2.789 -24.082 -10.324 1.00 73.24 H new ATOM 0 HE1 TRP A 89 -4.110 -24.855 -12.407 1.00 32.22 H new ATOM 0 HE3 TRP A 89 -7.226 -25.175 -8.037 1.00 61.45 H new ATOM 0 HZ2 TRP A 89 -6.685 -25.844 -12.948 1.00 12.24 H new ATOM 0 HZ3 TRP A 89 -9.073 -26.058 -9.408 1.00 50.40 H new ATOM 0 HH2 TRP A 89 -8.804 -26.384 -11.832 1.00 63.14 H new ATOM 1358 N LYS A 90 -5.247 -21.691 -9.096 1.00 33.34 N ATOM 1359 CA LYS A 90 -6.152 -20.626 -9.498 1.00 31.02 C ATOM 1360 C LYS A 90 -7.068 -20.209 -8.352 1.00 25.12 C ATOM 1361 O LYS A 90 -7.622 -21.055 -7.634 1.00 52.10 O ATOM 1362 CB LYS A 90 -6.997 -21.088 -10.686 1.00 53.24 C ATOM 1363 CG LYS A 90 -6.906 -20.160 -11.879 1.00 72.52 C ATOM 1364 CD LYS A 90 -5.487 -20.090 -12.410 1.00 10.21 C ATOM 1365 CE LYS A 90 -5.356 -19.023 -13.475 1.00 31.41 C ATOM 1366 NZ LYS A 90 -6.219 -19.303 -14.652 1.00 73.34 N ATOM 0 H LYS A 90 -5.278 -22.513 -9.699 1.00 33.34 H new ATOM 0 HA LYS A 90 -5.550 -19.763 -9.783 1.00 31.02 H new ATOM 0 HB2 LYS A 90 -6.677 -22.086 -10.985 1.00 53.24 H new ATOM 0 HB3 LYS A 90 -8.038 -21.167 -10.374 1.00 53.24 H new ATOM 0 HG2 LYS A 90 -7.575 -20.508 -12.666 1.00 72.52 H new ATOM 0 HG3 LYS A 90 -7.240 -19.163 -11.594 1.00 72.52 H new ATOM 0 HD2 LYS A 90 -4.799 -19.878 -11.592 1.00 10.21 H new ATOM 0 HD3 LYS A 90 -5.202 -21.058 -12.823 1.00 10.21 H new ATOM 0 HE2 LYS A 90 -5.622 -18.054 -13.052 1.00 31.41 H new ATOM 0 HE3 LYS A 90 -4.316 -18.956 -13.795 1.00 31.41 H new ATOM 0 HZ1 LYS A 90 -6.025 -18.606 -15.399 1.00 73.34 H new ATOM 0 HZ2 LYS A 90 -6.019 -20.259 -15.010 1.00 73.34 H new ATOM 0 HZ3 LYS A 90 -7.219 -19.241 -14.372 1.00 73.34 H new ATOM 1380 N ALA A 91 -7.189 -18.900 -8.179 1.00 64.10 N ATOM 1381 CA ALA A 91 -8.012 -18.319 -7.130 1.00 73.05 C ATOM 1382 C ALA A 91 -9.492 -18.603 -7.357 1.00 41.53 C ATOM 1383 O ALA A 91 -10.088 -18.134 -8.323 1.00 72.42 O ATOM 1384 CB ALA A 91 -7.762 -16.822 -7.044 1.00 54.41 C ATOM 0 H ALA A 91 -6.718 -18.210 -8.764 1.00 64.10 H new ATOM 0 HA ALA A 91 -7.732 -18.783 -6.184 1.00 73.05 H new ATOM 0 HB1 ALA A 91 -8.382 -16.394 -6.256 1.00 54.41 H new ATOM 0 HB2 ALA A 91 -6.711 -16.641 -6.817 1.00 54.41 H new ATOM 0 HB3 ALA A 91 -8.013 -16.356 -7.997 1.00 54.41 H new ATOM 1390 N LYS A 92 -10.071 -19.375 -6.455 1.00 12.43 N ATOM 1391 CA LYS A 92 -11.477 -19.739 -6.537 1.00 50.14 C ATOM 1392 C LYS A 92 -12.286 -18.854 -5.601 1.00 42.42 C ATOM 1393 O LYS A 92 -12.009 -18.821 -4.399 1.00 44.40 O ATOM 1394 CB LYS A 92 -11.652 -21.203 -6.139 1.00 55.23 C ATOM 1395 CG LYS A 92 -10.597 -22.120 -6.737 1.00 41.41 C ATOM 1396 CD LYS A 92 -10.563 -23.466 -6.037 1.00 75.45 C ATOM 1397 CE LYS A 92 -9.259 -24.194 -6.316 1.00 1.42 C ATOM 1398 NZ LYS A 92 -8.078 -23.388 -5.898 1.00 71.11 N ATOM 0 H LYS A 92 -9.584 -19.766 -5.649 1.00 12.43 H new ATOM 0 HA LYS A 92 -11.828 -19.600 -7.560 1.00 50.14 H new ATOM 0 HB2 LYS A 92 -11.619 -21.283 -5.052 1.00 55.23 H new ATOM 0 HB3 LYS A 92 -12.639 -21.542 -6.454 1.00 55.23 H new ATOM 0 HG2 LYS A 92 -10.801 -22.266 -7.798 1.00 41.41 H new ATOM 0 HG3 LYS A 92 -9.618 -21.646 -6.663 1.00 41.41 H new ATOM 0 HD2 LYS A 92 -10.681 -23.324 -4.963 1.00 75.45 H new ATOM 0 HD3 LYS A 92 -11.402 -24.075 -6.372 1.00 75.45 H new ATOM 0 HE2 LYS A 92 -9.254 -25.147 -5.788 1.00 1.42 H new ATOM 0 HE3 LYS A 92 -9.188 -24.419 -7.380 1.00 1.42 H new ATOM 0 HZ1 LYS A 92 -7.278 -24.022 -5.699 1.00 71.11 H new ATOM 0 HZ2 LYS A 92 -7.818 -22.732 -6.662 1.00 71.11 H new ATOM 0 HZ3 LYS A 92 -8.313 -22.847 -5.041 1.00 71.11 H new ATOM 1412 N ASN A 93 -13.260 -18.130 -6.151 1.00 33.31 N ATOM 1413 CA ASN A 93 -14.102 -17.220 -5.367 1.00 64.14 C ATOM 1414 C ASN A 93 -13.291 -15.990 -4.934 1.00 61.31 C ATOM 1415 O ASN A 93 -12.057 -16.024 -4.900 1.00 22.44 O ATOM 1416 CB ASN A 93 -14.696 -17.951 -4.144 1.00 72.15 C ATOM 1417 CG ASN A 93 -15.675 -17.110 -3.345 1.00 24.41 C ATOM 1418 OD1 ASN A 93 -15.280 -16.353 -2.457 1.00 4.45 O ATOM 1419 ND2 ASN A 93 -16.960 -17.252 -3.638 1.00 0.41 N ATOM 0 H ASN A 93 -13.489 -18.155 -7.145 1.00 33.31 H new ATOM 0 HA ASN A 93 -14.930 -16.882 -5.990 1.00 64.14 H new ATOM 0 HB2 ASN A 93 -15.201 -18.856 -4.483 1.00 72.15 H new ATOM 0 HB3 ASN A 93 -13.883 -18.265 -3.490 1.00 72.15 H new ATOM 0 HD21 ASN A 93 -17.662 -16.724 -3.120 1.00 0.41 H new ATOM 0 HD22 ASN A 93 -17.246 -17.889 -4.381 1.00 0.41 H new ATOM 1426 N GLU A 94 -13.980 -14.896 -4.628 1.00 2.11 N ATOM 1427 CA GLU A 94 -13.321 -13.663 -4.200 1.00 31.44 C ATOM 1428 C GLU A 94 -12.493 -13.881 -2.935 1.00 12.31 C ATOM 1429 O GLU A 94 -11.551 -13.135 -2.673 1.00 31.31 O ATOM 1430 CB GLU A 94 -14.348 -12.553 -3.968 1.00 1.35 C ATOM 1431 CG GLU A 94 -14.970 -12.021 -5.249 1.00 75.54 C ATOM 1432 CD GLU A 94 -16.051 -10.990 -4.987 1.00 3.02 C ATOM 1433 OE1 GLU A 94 -15.711 -9.823 -4.708 1.00 53.54 O ATOM 1434 OE2 GLU A 94 -17.248 -11.344 -5.064 1.00 63.15 O ATOM 0 H GLU A 94 -14.997 -14.836 -4.668 1.00 2.11 H new ATOM 0 HA GLU A 94 -12.646 -13.360 -5.000 1.00 31.44 H new ATOM 0 HB2 GLU A 94 -15.139 -12.931 -3.320 1.00 1.35 H new ATOM 0 HB3 GLU A 94 -13.868 -11.730 -3.438 1.00 1.35 H new ATOM 0 HG2 GLU A 94 -14.192 -11.577 -5.869 1.00 75.54 H new ATOM 0 HG3 GLU A 94 -15.394 -12.851 -5.815 1.00 75.54 H new ATOM 1441 N PHE A 95 -12.843 -14.904 -2.163 1.00 63.20 N ATOM 1442 CA PHE A 95 -12.091 -15.251 -0.963 1.00 2.22 C ATOM 1443 C PHE A 95 -10.646 -15.608 -1.316 1.00 2.42 C ATOM 1444 O PHE A 95 -9.704 -15.015 -0.790 1.00 30.42 O ATOM 1445 CB PHE A 95 -12.764 -16.417 -0.232 1.00 2.31 C ATOM 1446 CG PHE A 95 -12.065 -16.820 1.034 1.00 3.21 C ATOM 1447 CD1 PHE A 95 -12.094 -16.001 2.149 1.00 2.35 C ATOM 1448 CD2 PHE A 95 -11.376 -18.020 1.103 1.00 15.24 C ATOM 1449 CE1 PHE A 95 -11.447 -16.371 3.312 1.00 34.31 C ATOM 1450 CE2 PHE A 95 -10.728 -18.395 2.261 1.00 51.42 C ATOM 1451 CZ PHE A 95 -10.763 -17.571 3.369 1.00 74.42 C ATOM 0 H PHE A 95 -13.644 -15.508 -2.347 1.00 63.20 H new ATOM 0 HA PHE A 95 -12.079 -14.384 -0.302 1.00 2.22 H new ATOM 0 HB2 PHE A 95 -13.792 -16.142 0.003 1.00 2.31 H new ATOM 0 HB3 PHE A 95 -12.809 -17.276 -0.901 1.00 2.31 H new ATOM 0 HD1 PHE A 95 -12.628 -15.063 2.110 1.00 2.35 H new ATOM 0 HD2 PHE A 95 -11.346 -18.669 0.240 1.00 15.24 H new ATOM 0 HE1 PHE A 95 -11.475 -15.723 4.176 1.00 34.31 H new ATOM 0 HE2 PHE A 95 -10.193 -19.333 2.302 1.00 51.42 H new ATOM 0 HZ PHE A 95 -10.257 -17.863 4.277 1.00 74.42 H new ATOM 1461 N THR A 96 -10.471 -16.563 -2.222 1.00 32.42 N ATOM 1462 CA THR A 96 -9.138 -16.969 -2.637 1.00 70.12 C ATOM 1463 C THR A 96 -8.486 -15.879 -3.489 1.00 12.25 C ATOM 1464 O THR A 96 -7.266 -15.732 -3.499 1.00 31.24 O ATOM 1465 CB THR A 96 -9.170 -18.294 -3.420 1.00 11.44 C ATOM 1466 OG1 THR A 96 -10.009 -19.235 -2.742 1.00 25.02 O ATOM 1467 CG2 THR A 96 -7.771 -18.879 -3.562 1.00 24.50 C ATOM 0 H THR A 96 -11.231 -17.066 -2.679 1.00 32.42 H new ATOM 0 HA THR A 96 -8.546 -17.121 -1.734 1.00 70.12 H new ATOM 0 HB THR A 96 -9.565 -18.092 -4.415 1.00 11.44 H new ATOM 0 HG1 THR A 96 -10.875 -19.288 -3.197 1.00 25.02 H new ATOM 0 HG21 THR A 96 -7.823 -19.815 -4.119 1.00 24.50 H new ATOM 0 HG22 THR A 96 -7.134 -18.174 -4.096 1.00 24.50 H new ATOM 0 HG23 THR A 96 -7.354 -19.068 -2.573 1.00 24.50 H new ATOM 1475 N GLN A 97 -9.310 -15.109 -4.197 1.00 54.43 N ATOM 1476 CA GLN A 97 -8.821 -13.988 -4.978 1.00 75.13 C ATOM 1477 C GLN A 97 -8.199 -12.921 -4.081 1.00 0.22 C ATOM 1478 O GLN A 97 -7.245 -12.251 -4.475 1.00 20.22 O ATOM 1479 CB GLN A 97 -9.955 -13.390 -5.804 1.00 64.33 C ATOM 1480 CG GLN A 97 -10.298 -14.196 -7.045 1.00 41.42 C ATOM 1481 CD GLN A 97 -11.319 -13.504 -7.925 1.00 33.43 C ATOM 1482 OE1 GLN A 97 -10.966 -12.708 -8.792 1.00 30.21 O ATOM 1483 NE2 GLN A 97 -12.590 -13.801 -7.713 1.00 62.54 N ATOM 0 H GLN A 97 -10.320 -15.246 -4.242 1.00 54.43 H new ATOM 0 HA GLN A 97 -8.046 -14.355 -5.651 1.00 75.13 H new ATOM 0 HB2 GLN A 97 -10.844 -13.307 -5.178 1.00 64.33 H new ATOM 0 HB3 GLN A 97 -9.680 -12.378 -6.103 1.00 64.33 H new ATOM 0 HG2 GLN A 97 -9.390 -14.375 -7.620 1.00 41.42 H new ATOM 0 HG3 GLN A 97 -10.683 -15.171 -6.746 1.00 41.42 H new ATOM 0 HE21 GLN A 97 -12.843 -14.467 -6.983 1.00 62.54 H new ATOM 0 HE22 GLN A 97 -13.317 -13.364 -8.279 1.00 62.54 H new ATOM 1492 N ALA A 98 -8.742 -12.766 -2.879 1.00 60.24 N ATOM 1493 CA ALA A 98 -8.188 -11.834 -1.904 1.00 4.05 C ATOM 1494 C ALA A 98 -6.862 -12.357 -1.366 1.00 11.44 C ATOM 1495 O ALA A 98 -5.946 -11.584 -1.085 1.00 11.44 O ATOM 1496 CB ALA A 98 -9.172 -11.600 -0.767 1.00 14.55 C ATOM 0 H ALA A 98 -9.566 -13.274 -2.556 1.00 60.24 H new ATOM 0 HA ALA A 98 -8.008 -10.881 -2.401 1.00 4.05 H new ATOM 0 HB1 ALA A 98 -8.740 -10.902 -0.050 1.00 14.55 H new ATOM 0 HB2 ALA A 98 -10.097 -11.184 -1.166 1.00 14.55 H new ATOM 0 HB3 ALA A 98 -9.385 -12.546 -0.269 1.00 14.55 H new ATOM 1502 N TYR A 99 -6.774 -13.677 -1.234 1.00 13.04 N ATOM 1503 CA TYR A 99 -5.544 -14.331 -0.802 1.00 1.12 C ATOM 1504 C TYR A 99 -4.468 -14.193 -1.874 1.00 14.53 C ATOM 1505 O TYR A 99 -3.295 -13.994 -1.568 1.00 10.51 O ATOM 1506 CB TYR A 99 -5.812 -15.812 -0.506 1.00 64.30 C ATOM 1507 CG TYR A 99 -4.582 -16.597 -0.097 1.00 64.02 C ATOM 1508 CD1 TYR A 99 -4.063 -16.487 1.185 1.00 74.31 C ATOM 1509 CD2 TYR A 99 -3.943 -17.448 -0.993 1.00 11.20 C ATOM 1510 CE1 TYR A 99 -2.943 -17.200 1.566 1.00 15.33 C ATOM 1511 CE2 TYR A 99 -2.822 -18.166 -0.618 1.00 32.43 C ATOM 1512 CZ TYR A 99 -2.326 -18.039 0.663 1.00 22.01 C ATOM 1513 OH TYR A 99 -1.210 -18.752 1.044 1.00 44.24 O ATOM 0 H TYR A 99 -7.545 -14.318 -1.421 1.00 13.04 H new ATOM 0 HA TYR A 99 -5.191 -13.849 0.109 1.00 1.12 H new ATOM 0 HB2 TYR A 99 -6.555 -15.883 0.288 1.00 64.30 H new ATOM 0 HB3 TYR A 99 -6.247 -16.275 -1.392 1.00 64.30 H new ATOM 0 HD1 TYR A 99 -4.543 -15.832 1.897 1.00 74.31 H new ATOM 0 HD2 TYR A 99 -4.328 -17.550 -1.997 1.00 11.20 H new ATOM 0 HE1 TYR A 99 -2.552 -17.100 2.568 1.00 15.33 H new ATOM 0 HE2 TYR A 99 -2.337 -18.823 -1.325 1.00 32.43 H new ATOM 0 HH TYR A 99 -0.897 -19.297 0.292 1.00 44.24 H new ATOM 1523 N ALA A 100 -4.883 -14.310 -3.130 1.00 71.21 N ATOM 1524 CA ALA A 100 -3.975 -14.155 -4.256 1.00 0.10 C ATOM 1525 C ALA A 100 -3.535 -12.704 -4.397 1.00 5.01 C ATOM 1526 O ALA A 100 -2.361 -12.424 -4.633 1.00 3.00 O ATOM 1527 CB ALA A 100 -4.638 -14.639 -5.537 1.00 61.12 C ATOM 0 H ALA A 100 -5.847 -14.513 -3.393 1.00 71.21 H new ATOM 0 HA ALA A 100 -3.089 -14.762 -4.071 1.00 0.10 H new ATOM 0 HB1 ALA A 100 -3.948 -14.518 -6.372 1.00 61.12 H new ATOM 0 HB2 ALA A 100 -4.902 -15.692 -5.435 1.00 61.12 H new ATOM 0 HB3 ALA A 100 -5.539 -14.055 -5.723 1.00 61.12 H new ATOM 1533 N LYS A 101 -4.505 -11.797 -4.265 1.00 23.34 N ATOM 1534 CA LYS A 101 -4.278 -10.348 -4.306 1.00 72.53 C ATOM 1535 C LYS A 101 -3.896 -9.868 -5.712 1.00 50.33 C ATOM 1536 O LYS A 101 -4.538 -8.971 -6.260 1.00 4.22 O ATOM 1537 CB LYS A 101 -3.217 -9.925 -3.279 1.00 43.43 C ATOM 1538 CG LYS A 101 -3.094 -8.417 -3.105 1.00 43.11 C ATOM 1539 CD LYS A 101 -4.408 -7.790 -2.658 1.00 34.13 C ATOM 1540 CE LYS A 101 -4.285 -6.281 -2.527 1.00 75.44 C ATOM 1541 NZ LYS A 101 -5.567 -5.647 -2.120 1.00 24.23 N ATOM 0 H LYS A 101 -5.483 -12.050 -4.125 1.00 23.34 H new ATOM 0 HA LYS A 101 -5.221 -9.869 -4.042 1.00 72.53 H new ATOM 0 HB2 LYS A 101 -3.459 -10.374 -2.315 1.00 43.43 H new ATOM 0 HB3 LYS A 101 -2.250 -10.326 -3.584 1.00 43.43 H new ATOM 0 HG2 LYS A 101 -2.319 -8.198 -2.371 1.00 43.11 H new ATOM 0 HG3 LYS A 101 -2.778 -7.967 -4.046 1.00 43.11 H new ATOM 0 HD2 LYS A 101 -5.191 -8.032 -3.376 1.00 34.13 H new ATOM 0 HD3 LYS A 101 -4.710 -8.217 -1.701 1.00 34.13 H new ATOM 0 HE2 LYS A 101 -3.515 -6.043 -1.793 1.00 75.44 H new ATOM 0 HE3 LYS A 101 -3.960 -5.861 -3.479 1.00 75.44 H new ATOM 0 HZ1 LYS A 101 -5.436 -4.618 -2.043 1.00 24.23 H new ATOM 0 HZ2 LYS A 101 -6.297 -5.851 -2.832 1.00 24.23 H new ATOM 0 HZ3 LYS A 101 -5.866 -6.028 -1.200 1.00 24.23 H new ATOM 1555 N LEU A 102 -2.866 -10.472 -6.296 1.00 4.35 N ATOM 1556 CA LEU A 102 -2.411 -10.116 -7.640 1.00 45.44 C ATOM 1557 C LEU A 102 -3.496 -10.439 -8.667 1.00 3.33 C ATOM 1558 O LEU A 102 -3.519 -9.877 -9.758 1.00 31.14 O ATOM 1559 CB LEU A 102 -1.103 -10.863 -7.957 1.00 72.44 C ATOM 1560 CG LEU A 102 -0.273 -10.343 -9.147 1.00 32.01 C ATOM 1561 CD1 LEU A 102 -0.800 -10.871 -10.473 1.00 41.05 C ATOM 1562 CD2 LEU A 102 -0.242 -8.821 -9.154 1.00 40.13 C ATOM 0 H LEU A 102 -2.325 -11.217 -5.857 1.00 4.35 H new ATOM 0 HA LEU A 102 -2.216 -9.045 -7.687 1.00 45.44 H new ATOM 0 HB2 LEU A 102 -0.474 -10.837 -7.067 1.00 72.44 H new ATOM 0 HB3 LEU A 102 -1.347 -11.909 -8.145 1.00 72.44 H new ATOM 0 HG LEU A 102 0.745 -10.714 -9.025 1.00 32.01 H new ATOM 0 HD11 LEU A 102 -0.189 -10.483 -11.288 1.00 41.05 H new ATOM 0 HD12 LEU A 102 -0.756 -11.960 -10.474 1.00 41.05 H new ATOM 0 HD13 LEU A 102 -1.833 -10.549 -10.608 1.00 41.05 H new ATOM 0 HD21 LEU A 102 0.349 -8.473 -10.001 1.00 40.13 H new ATOM 0 HD22 LEU A 102 -1.259 -8.437 -9.238 1.00 40.13 H new ATOM 0 HD23 LEU A 102 0.206 -8.462 -8.228 1.00 40.13 H new ATOM 1574 N MET A 103 -4.415 -11.327 -8.289 1.00 0.31 N ATOM 1575 CA MET A 103 -5.543 -11.699 -9.144 1.00 54.44 C ATOM 1576 C MET A 103 -6.330 -10.457 -9.573 1.00 53.34 C ATOM 1577 O MET A 103 -6.942 -10.432 -10.634 1.00 62.33 O ATOM 1578 CB MET A 103 -6.464 -12.678 -8.408 1.00 55.13 C ATOM 1579 CG MET A 103 -7.539 -13.289 -9.291 1.00 12.33 C ATOM 1580 SD MET A 103 -6.850 -14.260 -10.647 1.00 74.13 S ATOM 1581 CE MET A 103 -8.350 -14.859 -11.420 1.00 62.01 C ATOM 0 H MET A 103 -4.400 -11.806 -7.389 1.00 0.31 H new ATOM 0 HA MET A 103 -5.151 -12.185 -10.038 1.00 54.44 H new ATOM 0 HB2 MET A 103 -5.860 -13.478 -7.980 1.00 55.13 H new ATOM 0 HB3 MET A 103 -6.941 -12.159 -7.577 1.00 55.13 H new ATOM 0 HG2 MET A 103 -8.185 -13.924 -8.685 1.00 12.33 H new ATOM 0 HG3 MET A 103 -8.165 -12.495 -9.698 1.00 12.33 H new ATOM 0 HE1 MET A 103 -8.094 -15.479 -12.279 1.00 62.01 H new ATOM 0 HE2 MET A 103 -8.918 -15.451 -10.702 1.00 62.01 H new ATOM 0 HE3 MET A 103 -8.952 -14.013 -11.750 1.00 62.01 H new ATOM 1591 N ASN A 104 -6.279 -9.424 -8.734 1.00 32.12 N ATOM 1592 CA ASN A 104 -6.927 -8.133 -8.995 1.00 64.25 C ATOM 1593 C ASN A 104 -6.479 -7.532 -10.329 1.00 23.55 C ATOM 1594 O ASN A 104 -7.114 -6.620 -10.840 1.00 35.54 O ATOM 1595 CB ASN A 104 -6.604 -7.152 -7.868 1.00 4.34 C ATOM 1596 CG ASN A 104 -7.695 -6.115 -7.658 1.00 24.34 C ATOM 1597 OD1 ASN A 104 -8.601 -6.309 -6.843 1.00 13.54 O ATOM 1598 ND2 ASN A 104 -7.628 -5.017 -8.392 1.00 31.11 N ATOM 0 H ASN A 104 -5.782 -9.457 -7.844 1.00 32.12 H new ATOM 0 HA ASN A 104 -8.002 -8.309 -9.044 1.00 64.25 H new ATOM 0 HB2 ASN A 104 -6.453 -7.707 -6.942 1.00 4.34 H new ATOM 0 HB3 ASN A 104 -5.666 -6.645 -8.092 1.00 4.34 H new ATOM 0 HD21 ASN A 104 -8.341 -4.294 -8.295 1.00 31.11 H new ATOM 0 HD22 ASN A 104 -6.863 -4.893 -9.055 1.00 31.11 H new ATOM 1605 N GLN A 105 -5.362 -8.027 -10.853 1.00 64.52 N ATOM 1606 CA GLN A 105 -4.752 -7.519 -12.081 1.00 64.25 C ATOM 1607 C GLN A 105 -5.757 -7.352 -13.231 1.00 64.32 C ATOM 1608 O GLN A 105 -5.683 -6.373 -13.973 1.00 74.44 O ATOM 1609 CB GLN A 105 -3.646 -8.485 -12.509 1.00 25.20 C ATOM 1610 CG GLN A 105 -2.577 -7.865 -13.387 1.00 60.32 C ATOM 1611 CD GLN A 105 -2.630 -8.346 -14.828 1.00 2.43 C ATOM 1612 OE1 GLN A 105 -1.602 -8.453 -15.497 1.00 51.31 O ATOM 1613 NE2 GLN A 105 -3.823 -8.632 -15.321 1.00 53.30 N ATOM 0 H GLN A 105 -4.848 -8.801 -10.433 1.00 64.52 H new ATOM 0 HA GLN A 105 -4.355 -6.527 -11.866 1.00 64.25 H new ATOM 0 HB2 GLN A 105 -3.173 -8.895 -11.617 1.00 25.20 H new ATOM 0 HB3 GLN A 105 -4.097 -9.321 -13.043 1.00 25.20 H new ATOM 0 HG2 GLN A 105 -2.685 -6.781 -13.369 1.00 60.32 H new ATOM 0 HG3 GLN A 105 -1.596 -8.094 -12.970 1.00 60.32 H new ATOM 0 HE21 GLN A 105 -4.653 -8.532 -14.737 1.00 53.30 H new ATOM 0 HE22 GLN A 105 -3.913 -8.953 -16.285 1.00 53.30 H new ATOM 1622 N TYR A 106 -6.690 -8.293 -13.390 1.00 65.15 N ATOM 1623 CA TYR A 106 -7.651 -8.211 -14.496 1.00 10.15 C ATOM 1624 C TYR A 106 -8.649 -7.079 -14.251 1.00 24.43 C ATOM 1625 O TYR A 106 -9.277 -6.571 -15.179 1.00 60.31 O ATOM 1626 CB TYR A 106 -8.391 -9.546 -14.705 1.00 23.45 C ATOM 1627 CG TYR A 106 -9.453 -9.859 -13.666 1.00 42.43 C ATOM 1628 CD1 TYR A 106 -9.132 -10.526 -12.493 1.00 74.11 C ATOM 1629 CD2 TYR A 106 -10.778 -9.481 -13.861 1.00 34.15 C ATOM 1630 CE1 TYR A 106 -10.096 -10.808 -11.543 1.00 3.21 C ATOM 1631 CE2 TYR A 106 -11.745 -9.756 -12.915 1.00 10.45 C ATOM 1632 CZ TYR A 106 -11.398 -10.419 -11.759 1.00 54.25 C ATOM 1633 OH TYR A 106 -12.357 -10.683 -10.810 1.00 12.52 O ATOM 0 H TYR A 106 -6.802 -9.105 -12.782 1.00 65.15 H new ATOM 0 HA TYR A 106 -7.091 -7.998 -15.407 1.00 10.15 H new ATOM 0 HB2 TYR A 106 -8.859 -9.535 -15.689 1.00 23.45 H new ATOM 0 HB3 TYR A 106 -7.659 -10.353 -14.709 1.00 23.45 H new ATOM 0 HD1 TYR A 106 -8.111 -10.831 -12.319 1.00 74.11 H new ATOM 0 HD2 TYR A 106 -11.054 -8.964 -14.768 1.00 34.15 H new ATOM 0 HE1 TYR A 106 -9.829 -11.331 -10.636 1.00 3.21 H new ATOM 0 HE2 TYR A 106 -12.768 -9.453 -13.081 1.00 10.45 H new ATOM 0 HH TYR A 106 -12.008 -11.333 -10.165 1.00 12.52 H new ATOM 1643 N ARG A 107 -8.780 -6.693 -12.992 1.00 4.32 N ATOM 1644 CA ARG A 107 -9.678 -5.625 -12.592 1.00 45.31 C ATOM 1645 C ARG A 107 -9.027 -4.273 -12.871 1.00 4.55 C ATOM 1646 O ARG A 107 -7.988 -3.951 -12.293 1.00 1.42 O ATOM 1647 CB ARG A 107 -10.008 -5.773 -11.105 1.00 74.03 C ATOM 1648 CG ARG A 107 -10.639 -7.110 -10.763 1.00 61.22 C ATOM 1649 CD ARG A 107 -10.840 -7.269 -9.267 1.00 33.41 C ATOM 1650 NE ARG A 107 -11.359 -8.594 -8.922 1.00 61.20 N ATOM 1651 CZ ARG A 107 -11.538 -9.024 -7.674 1.00 71.10 C ATOM 1652 NH1 ARG A 107 -11.220 -8.244 -6.644 1.00 71.31 N ATOM 1653 NH2 ARG A 107 -12.019 -10.244 -7.458 1.00 22.11 N ATOM 0 H ARG A 107 -8.265 -7.113 -12.218 1.00 4.32 H new ATOM 0 HA ARG A 107 -10.604 -5.685 -13.165 1.00 45.31 H new ATOM 0 HB2 ARG A 107 -9.095 -5.650 -10.523 1.00 74.03 H new ATOM 0 HB3 ARG A 107 -10.685 -4.972 -10.808 1.00 74.03 H new ATOM 0 HG2 ARG A 107 -11.599 -7.200 -11.271 1.00 61.22 H new ATOM 0 HG3 ARG A 107 -10.006 -7.917 -11.133 1.00 61.22 H new ATOM 0 HD2 ARG A 107 -9.892 -7.106 -8.754 1.00 33.41 H new ATOM 0 HD3 ARG A 107 -11.531 -6.505 -8.911 1.00 33.41 H new ATOM 0 HE ARG A 107 -11.598 -9.227 -9.685 1.00 61.20 H new ATOM 0 HH11 ARG A 107 -10.838 -7.313 -6.808 1.00 71.31 H new ATOM 0 HH12 ARG A 107 -11.359 -8.577 -5.690 1.00 71.31 H new ATOM 0 HH21 ARG A 107 -12.250 -10.848 -8.247 1.00 22.11 H new ATOM 0 HH22 ARG A 107 -12.157 -10.576 -6.504 1.00 22.11 H new ATOM 1667 N GLY A 108 -9.651 -3.479 -13.737 1.00 34.01 N ATOM 1668 CA GLY A 108 -9.040 -2.243 -14.209 1.00 65.21 C ATOM 1669 C GLY A 108 -9.056 -1.116 -13.190 1.00 45.44 C ATOM 1670 O GLY A 108 -8.896 0.051 -13.549 1.00 4.40 O ATOM 0 H GLY A 108 -10.575 -3.669 -14.124 1.00 34.01 H new ATOM 0 HA2 GLY A 108 -8.008 -2.446 -14.494 1.00 65.21 H new ATOM 0 HA3 GLY A 108 -9.560 -1.913 -15.108 1.00 65.21 H new ATOM 1674 N ILE A 109 -9.238 -1.461 -11.925 1.00 65.24 N ATOM 1675 CA ILE A 109 -9.245 -0.477 -10.854 1.00 45.21 C ATOM 1676 C ILE A 109 -7.864 -0.426 -10.204 1.00 62.43 C ATOM 1677 O ILE A 109 -7.546 0.478 -9.429 1.00 13.41 O ATOM 1678 CB ILE A 109 -10.319 -0.791 -9.778 1.00 34.54 C ATOM 1679 CG1 ILE A 109 -11.695 -1.021 -10.414 1.00 23.35 C ATOM 1680 CG2 ILE A 109 -10.412 0.340 -8.765 1.00 3.11 C ATOM 1681 CD1 ILE A 109 -11.912 -2.428 -10.934 1.00 64.54 C ATOM 0 H ILE A 109 -9.384 -2.421 -11.614 1.00 65.24 H new ATOM 0 HA ILE A 109 -9.493 0.490 -11.291 1.00 45.21 H new ATOM 0 HB ILE A 109 -10.012 -1.705 -9.270 1.00 34.54 H new ATOM 0 HG12 ILE A 109 -12.466 -0.795 -9.677 1.00 23.35 H new ATOM 0 HG13 ILE A 109 -11.825 -0.318 -11.237 1.00 23.35 H new ATOM 0 HG21 ILE A 109 -11.170 0.100 -8.020 1.00 3.11 H new ATOM 0 HG22 ILE A 109 -9.448 0.468 -8.273 1.00 3.11 H new ATOM 0 HG23 ILE A 109 -10.685 1.264 -9.275 1.00 3.11 H new ATOM 0 HD11 ILE A 109 -12.909 -2.506 -11.368 1.00 64.54 H new ATOM 0 HD12 ILE A 109 -11.166 -2.653 -11.696 1.00 64.54 H new ATOM 0 HD13 ILE A 109 -11.817 -3.138 -10.113 1.00 64.54 H new ATOM 1693 N TYR A 110 -7.037 -1.398 -10.546 1.00 15.22 N ATOM 1694 CA TYR A 110 -5.690 -1.467 -10.016 1.00 21.20 C ATOM 1695 C TYR A 110 -4.700 -1.558 -11.167 1.00 11.21 C ATOM 1696 O TYR A 110 -4.983 -2.198 -12.182 1.00 72.13 O ATOM 1697 CB TYR A 110 -5.568 -2.692 -9.104 1.00 31.31 C ATOM 1698 CG TYR A 110 -4.287 -2.771 -8.303 1.00 22.21 C ATOM 1699 CD1 TYR A 110 -4.106 -1.979 -7.176 1.00 30.40 C ATOM 1700 CD2 TYR A 110 -3.269 -3.647 -8.661 1.00 71.40 C ATOM 1701 CE1 TYR A 110 -2.947 -2.056 -6.429 1.00 51.30 C ATOM 1702 CE2 TYR A 110 -2.109 -3.733 -7.916 1.00 14.20 C ATOM 1703 CZ TYR A 110 -1.952 -2.934 -6.802 1.00 54.14 C ATOM 1704 OH TYR A 110 -0.801 -3.019 -6.055 1.00 34.41 O ATOM 0 H TYR A 110 -7.277 -2.152 -11.190 1.00 15.22 H new ATOM 0 HA TYR A 110 -5.471 -0.572 -9.434 1.00 21.20 H new ATOM 0 HB2 TYR A 110 -6.411 -2.697 -8.413 1.00 31.31 H new ATOM 0 HB3 TYR A 110 -5.652 -3.591 -9.715 1.00 31.31 H new ATOM 0 HD1 TYR A 110 -4.884 -1.292 -6.879 1.00 30.40 H new ATOM 0 HD2 TYR A 110 -3.387 -4.270 -9.535 1.00 71.40 H new ATOM 0 HE1 TYR A 110 -2.821 -1.431 -5.557 1.00 51.30 H new ATOM 0 HE2 TYR A 110 -1.329 -4.422 -8.204 1.00 14.20 H new ATOM 0 HH TYR A 110 -0.964 -3.575 -5.265 1.00 34.41 H new ATOM 1714 N SER A 111 -3.547 -0.933 -11.005 1.00 52.40 N ATOM 1715 CA SER A 111 -2.515 -0.950 -12.026 1.00 3.42 C ATOM 1716 C SER A 111 -1.219 -0.388 -11.463 1.00 4.02 C ATOM 1717 O SER A 111 -1.191 0.136 -10.343 1.00 72.24 O ATOM 1718 CB SER A 111 -2.953 -0.142 -13.259 1.00 71.10 C ATOM 1719 OG SER A 111 -3.193 1.220 -12.933 1.00 72.14 O ATOM 0 H SER A 111 -3.301 -0.403 -10.169 1.00 52.40 H new ATOM 0 HA SER A 111 -2.352 -1.982 -12.335 1.00 3.42 H new ATOM 0 HB2 SER A 111 -2.182 -0.203 -14.027 1.00 71.10 H new ATOM 0 HB3 SER A 111 -3.858 -0.581 -13.680 1.00 71.10 H new ATOM 0 HG SER A 111 -2.477 1.776 -13.305 1.00 72.14 H new ATOM 1725 N PHE A 112 -0.151 -0.507 -12.229 1.00 35.12 N ATOM 1726 CA PHE A 112 1.129 0.046 -11.835 1.00 65.32 C ATOM 1727 C PHE A 112 1.606 1.026 -12.894 1.00 75.10 C ATOM 1728 O PHE A 112 1.541 0.737 -14.089 1.00 42.34 O ATOM 1729 CB PHE A 112 2.146 -1.091 -11.655 1.00 14.33 C ATOM 1730 CG PHE A 112 3.523 -0.643 -11.240 1.00 31.02 C ATOM 1731 CD1 PHE A 112 3.824 -0.439 -9.903 1.00 30.14 C ATOM 1732 CD2 PHE A 112 4.518 -0.435 -12.184 1.00 23.11 C ATOM 1733 CE1 PHE A 112 5.086 -0.034 -9.515 1.00 14.24 C ATOM 1734 CE2 PHE A 112 5.782 -0.030 -11.801 1.00 73.20 C ATOM 1735 CZ PHE A 112 6.066 0.172 -10.465 1.00 71.34 C ATOM 0 H PHE A 112 -0.146 -0.984 -13.131 1.00 35.12 H new ATOM 0 HA PHE A 112 1.026 0.576 -10.888 1.00 65.32 H new ATOM 0 HB2 PHE A 112 1.764 -1.787 -10.908 1.00 14.33 H new ATOM 0 HB3 PHE A 112 2.225 -1.642 -12.592 1.00 14.33 H new ATOM 0 HD1 PHE A 112 3.062 -0.599 -9.155 1.00 30.14 H new ATOM 0 HD2 PHE A 112 4.302 -0.592 -13.231 1.00 23.11 H new ATOM 0 HE1 PHE A 112 5.306 0.121 -8.469 1.00 14.24 H new ATOM 0 HE2 PHE A 112 6.548 0.129 -12.546 1.00 73.20 H new ATOM 0 HZ PHE A 112 7.053 0.491 -10.164 1.00 71.34 H new ATOM 1745 N GLU A 113 2.093 2.171 -12.452 1.00 2.21 N ATOM 1746 CA GLU A 113 2.647 3.169 -13.350 1.00 73.01 C ATOM 1747 C GLU A 113 4.023 3.579 -12.859 1.00 52.25 C ATOM 1748 O GLU A 113 4.185 3.993 -11.712 1.00 72.13 O ATOM 1749 CB GLU A 113 1.742 4.405 -13.461 1.00 22.12 C ATOM 1750 CG GLU A 113 0.572 4.254 -14.428 1.00 51.52 C ATOM 1751 CD GLU A 113 -0.638 3.566 -13.825 1.00 42.21 C ATOM 1752 OE1 GLU A 113 -1.364 4.216 -13.052 1.00 2.00 O ATOM 1753 OE2 GLU A 113 -0.894 2.388 -14.158 1.00 40.22 O ATOM 0 H GLU A 113 2.116 2.435 -11.467 1.00 2.21 H new ATOM 0 HA GLU A 113 2.720 2.726 -14.343 1.00 73.01 H new ATOM 0 HB2 GLU A 113 1.350 4.641 -12.472 1.00 22.12 H new ATOM 0 HB3 GLU A 113 2.348 5.255 -13.775 1.00 22.12 H new ATOM 0 HG2 GLU A 113 0.277 5.241 -14.783 1.00 51.52 H new ATOM 0 HG3 GLU A 113 0.903 3.688 -15.299 1.00 51.52 H new ATOM 1760 N LYS A 114 5.014 3.455 -13.724 1.00 44.20 N ATOM 1761 CA LYS A 114 6.380 3.747 -13.344 1.00 11.50 C ATOM 1762 C LYS A 114 6.856 5.042 -13.983 1.00 1.50 C ATOM 1763 O LYS A 114 7.035 5.127 -15.199 1.00 43.02 O ATOM 1764 CB LYS A 114 7.314 2.594 -13.722 1.00 42.01 C ATOM 1765 CG LYS A 114 8.736 2.786 -13.219 1.00 3.31 C ATOM 1766 CD LYS A 114 8.763 2.996 -11.714 1.00 53.34 C ATOM 1767 CE LYS A 114 10.168 3.290 -11.214 1.00 64.45 C ATOM 1768 NZ LYS A 114 10.728 4.541 -11.801 1.00 32.21 N ATOM 0 H LYS A 114 4.896 3.155 -14.692 1.00 44.20 H new ATOM 0 HA LYS A 114 6.404 3.867 -12.261 1.00 11.50 H new ATOM 0 HB2 LYS A 114 6.915 1.664 -13.317 1.00 42.01 H new ATOM 0 HB3 LYS A 114 7.330 2.489 -14.807 1.00 42.01 H new ATOM 0 HG2 LYS A 114 9.337 1.914 -13.478 1.00 3.31 H new ATOM 0 HG3 LYS A 114 9.188 3.644 -13.717 1.00 3.31 H new ATOM 0 HD2 LYS A 114 8.102 3.822 -11.450 1.00 53.34 H new ATOM 0 HD3 LYS A 114 8.378 2.107 -11.215 1.00 53.34 H new ATOM 0 HE2 LYS A 114 10.154 3.376 -10.127 1.00 64.45 H new ATOM 0 HE3 LYS A 114 10.821 2.452 -11.459 1.00 64.45 H new ATOM 0 HZ1 LYS A 114 11.572 4.828 -11.265 1.00 32.21 H new ATOM 0 HZ2 LYS A 114 10.989 4.372 -12.794 1.00 32.21 H new ATOM 0 HZ3 LYS A 114 10.014 5.296 -11.754 1.00 32.21 H new ATOM 1782 N VAL A 115 7.042 6.047 -13.152 1.00 20.44 N ATOM 1783 CA VAL A 115 7.562 7.329 -13.593 1.00 42.35 C ATOM 1784 C VAL A 115 8.846 7.651 -12.842 1.00 3.23 C ATOM 1785 O VAL A 115 9.146 7.027 -11.819 1.00 63.14 O ATOM 1786 CB VAL A 115 6.539 8.468 -13.379 1.00 62.22 C ATOM 1787 CG1 VAL A 115 5.300 8.248 -14.234 1.00 64.21 C ATOM 1788 CG2 VAL A 115 6.157 8.583 -11.911 1.00 72.30 C ATOM 0 H VAL A 115 6.838 6.000 -12.154 1.00 20.44 H new ATOM 0 HA VAL A 115 7.763 7.254 -14.662 1.00 42.35 H new ATOM 0 HB VAL A 115 7.007 9.403 -13.686 1.00 62.22 H new ATOM 0 HG11 VAL A 115 4.594 9.061 -14.067 1.00 64.21 H new ATOM 0 HG12 VAL A 115 5.584 8.224 -15.286 1.00 64.21 H new ATOM 0 HG13 VAL A 115 4.834 7.301 -13.962 1.00 64.21 H new ATOM 0 HG21 VAL A 115 5.436 9.391 -11.785 1.00 72.30 H new ATOM 0 HG22 VAL A 115 5.713 7.645 -11.576 1.00 72.30 H new ATOM 0 HG23 VAL A 115 7.047 8.795 -11.319 1.00 72.30 H new ATOM 1798 N LYS A 116 9.621 8.581 -13.369 1.00 72.01 N ATOM 1799 CA LYS A 116 10.817 9.035 -12.685 1.00 54.41 C ATOM 1800 C LYS A 116 10.626 10.468 -12.216 1.00 41.10 C ATOM 1801 O LYS A 116 10.703 11.409 -13.008 1.00 41.24 O ATOM 1802 CB LYS A 116 12.046 8.933 -13.591 1.00 1.12 C ATOM 1803 CG LYS A 116 13.345 9.304 -12.890 1.00 51.20 C ATOM 1804 CD LYS A 116 13.606 8.405 -11.692 1.00 31.32 C ATOM 1805 CE LYS A 116 14.867 8.811 -10.951 1.00 12.14 C ATOM 1806 NZ LYS A 116 15.139 7.923 -9.789 1.00 75.11 N ATOM 0 H LYS A 116 9.445 9.035 -14.265 1.00 72.01 H new ATOM 0 HA LYS A 116 10.985 8.391 -11.822 1.00 54.41 H new ATOM 0 HB2 LYS A 116 12.125 7.914 -13.971 1.00 1.12 H new ATOM 0 HB3 LYS A 116 11.908 9.585 -14.453 1.00 1.12 H new ATOM 0 HG2 LYS A 116 14.174 9.226 -13.593 1.00 51.20 H new ATOM 0 HG3 LYS A 116 13.300 10.343 -12.564 1.00 51.20 H new ATOM 0 HD2 LYS A 116 12.755 8.448 -11.013 1.00 31.32 H new ATOM 0 HD3 LYS A 116 13.696 7.371 -12.025 1.00 31.32 H new ATOM 0 HE2 LYS A 116 15.715 8.783 -11.635 1.00 12.14 H new ATOM 0 HE3 LYS A 116 14.770 9.840 -10.606 1.00 12.14 H new ATOM 0 HZ1 LYS A 116 16.008 8.234 -9.310 1.00 75.11 H new ATOM 0 HZ2 LYS A 116 14.342 7.969 -9.123 1.00 75.11 H new ATOM 0 HZ3 LYS A 116 15.258 6.944 -10.120 1.00 75.11 H new ATOM 1820 N ALA A 117 10.348 10.625 -10.935 1.00 3.15 N ATOM 1821 CA ALA A 117 10.124 11.937 -10.363 1.00 12.34 C ATOM 1822 C ALA A 117 10.715 12.027 -8.965 1.00 3.32 C ATOM 1823 O ALA A 117 10.304 11.305 -8.058 1.00 73.34 O ATOM 1824 CB ALA A 117 8.637 12.255 -10.328 1.00 23.32 C ATOM 0 H ALA A 117 10.272 9.856 -10.270 1.00 3.15 H new ATOM 0 HA ALA A 117 10.624 12.671 -10.994 1.00 12.34 H new ATOM 0 HB1 ALA A 117 8.487 13.244 -9.895 1.00 23.32 H new ATOM 0 HB2 ALA A 117 8.237 12.238 -11.342 1.00 23.32 H new ATOM 0 HB3 ALA A 117 8.120 11.511 -9.722 1.00 23.32 H new ATOM 1830 N HIS A 118 11.690 12.907 -8.795 1.00 33.51 N ATOM 1831 CA HIS A 118 12.268 13.149 -7.476 1.00 13.30 C ATOM 1832 C HIS A 118 11.583 14.347 -6.827 1.00 35.20 C ATOM 1833 O HIS A 118 12.029 14.866 -5.807 1.00 40.33 O ATOM 1834 CB HIS A 118 13.792 13.357 -7.554 1.00 70.24 C ATOM 1835 CG HIS A 118 14.234 14.533 -8.379 1.00 5.45 C ATOM 1836 ND1 HIS A 118 14.525 15.770 -7.844 1.00 33.42 N ATOM 1837 CD2 HIS A 118 14.456 14.643 -9.709 1.00 1.11 C ATOM 1838 CE1 HIS A 118 14.905 16.587 -8.810 1.00 63.54 C ATOM 1839 NE2 HIS A 118 14.870 15.925 -9.950 1.00 14.32 N ATOM 0 H HIS A 118 12.097 13.464 -9.546 1.00 33.51 H new ATOM 0 HA HIS A 118 12.099 12.267 -6.859 1.00 13.30 H new ATOM 0 HB2 HIS A 118 14.179 13.477 -6.542 1.00 70.24 H new ATOM 0 HB3 HIS A 118 14.246 12.455 -7.964 1.00 70.24 H new ATOM 0 HD2 HIS A 118 14.330 13.863 -10.445 1.00 1.11 H new ATOM 0 HE1 HIS A 118 15.195 17.620 -8.687 1.00 63.54 H new ATOM 0 HE2 HIS A 118 15.112 16.307 -10.864 1.00 14.32 H new ATOM 1848 N SER A 119 10.476 14.754 -7.428 1.00 30.14 N ATOM 1849 CA SER A 119 9.676 15.867 -6.941 1.00 20.45 C ATOM 1850 C SER A 119 8.646 15.375 -5.920 1.00 52.22 C ATOM 1851 O SER A 119 7.513 15.866 -5.874 1.00 24.32 O ATOM 1852 CB SER A 119 8.977 16.530 -8.129 1.00 20.22 C ATOM 1853 OG SER A 119 9.896 16.770 -9.183 1.00 11.44 O ATOM 0 H SER A 119 10.105 14.319 -8.273 1.00 30.14 H new ATOM 0 HA SER A 119 10.321 16.593 -6.446 1.00 20.45 H new ATOM 0 HB2 SER A 119 8.168 15.891 -8.484 1.00 20.22 H new ATOM 0 HB3 SER A 119 8.525 17.470 -7.813 1.00 20.22 H new ATOM 0 HG SER A 119 9.429 17.193 -9.934 1.00 11.44 H new ATOM 1859 N GLY A 120 9.056 14.395 -5.115 1.00 65.02 N ATOM 1860 CA GLY A 120 8.178 13.780 -4.145 1.00 20.03 C ATOM 1861 C GLY A 120 7.548 14.776 -3.200 1.00 42.15 C ATOM 1862 O GLY A 120 8.240 15.497 -2.475 1.00 22.10 O ATOM 0 H GLY A 120 10.002 14.014 -5.124 1.00 65.02 H new ATOM 0 HA2 GLY A 120 7.391 13.237 -4.669 1.00 20.03 H new ATOM 0 HA3 GLY A 120 8.741 13.047 -3.568 1.00 20.03 H new ATOM 1866 N ASN A 121 6.227 14.822 -3.243 1.00 42.24 N ATOM 1867 CA ASN A 121 5.430 15.656 -2.346 1.00 12.54 C ATOM 1868 C ASN A 121 5.788 15.353 -0.889 1.00 43.55 C ATOM 1869 O ASN A 121 6.091 14.208 -0.550 1.00 63.34 O ATOM 1870 CB ASN A 121 3.935 15.408 -2.601 1.00 42.13 C ATOM 1871 CG ASN A 121 3.027 16.278 -1.750 1.00 25.42 C ATOM 1872 OD1 ASN A 121 3.392 17.384 -1.352 1.00 62.40 O ATOM 1873 ND2 ASN A 121 1.830 15.788 -1.473 1.00 31.52 N ATOM 0 H ASN A 121 5.670 14.280 -3.904 1.00 42.24 H new ATOM 0 HA ASN A 121 5.649 16.706 -2.540 1.00 12.54 H new ATOM 0 HB2 ASN A 121 3.718 15.590 -3.654 1.00 42.13 H new ATOM 0 HB3 ASN A 121 3.709 14.360 -2.406 1.00 42.13 H new ATOM 0 HD21 ASN A 121 1.174 16.331 -0.912 1.00 31.52 H new ATOM 0 HD22 ASN A 121 1.563 14.867 -1.821 1.00 31.52 H new ATOM 1880 N GLU A 122 5.745 16.379 -0.039 1.00 25.44 N ATOM 1881 CA GLU A 122 6.199 16.267 1.350 1.00 34.11 C ATOM 1882 C GLU A 122 5.522 15.108 2.081 1.00 22.10 C ATOM 1883 O GLU A 122 6.132 14.454 2.924 1.00 52.43 O ATOM 1884 CB GLU A 122 5.937 17.573 2.105 1.00 42.01 C ATOM 1885 CG GLU A 122 6.610 17.626 3.465 1.00 43.14 C ATOM 1886 CD GLU A 122 6.237 18.856 4.260 1.00 63.34 C ATOM 1887 OE1 GLU A 122 6.195 19.960 3.677 1.00 73.12 O ATOM 1888 OE2 GLU A 122 6.004 18.727 5.479 1.00 51.41 O ATOM 0 H GLU A 122 5.398 17.305 -0.290 1.00 25.44 H new ATOM 0 HA GLU A 122 7.270 16.069 1.323 1.00 34.11 H new ATOM 0 HB2 GLU A 122 6.287 18.410 1.501 1.00 42.01 H new ATOM 0 HB3 GLU A 122 4.862 17.701 2.234 1.00 42.01 H new ATOM 0 HG2 GLU A 122 6.339 16.736 4.034 1.00 43.14 H new ATOM 0 HG3 GLU A 122 7.691 17.601 3.331 1.00 43.14 H new ATOM 1895 N PHE A 123 4.270 14.846 1.738 1.00 15.01 N ATOM 1896 CA PHE A 123 3.509 13.782 2.381 1.00 11.44 C ATOM 1897 C PHE A 123 4.131 12.411 2.116 1.00 4.22 C ATOM 1898 O PHE A 123 4.049 11.515 2.955 1.00 74.41 O ATOM 1899 CB PHE A 123 2.053 13.809 1.916 1.00 33.12 C ATOM 1900 CG PHE A 123 1.300 15.026 2.380 1.00 54.01 C ATOM 1901 CD1 PHE A 123 0.956 15.177 3.714 1.00 45.13 C ATOM 1902 CD2 PHE A 123 0.936 16.018 1.484 1.00 64.40 C ATOM 1903 CE1 PHE A 123 0.263 16.293 4.144 1.00 65.41 C ATOM 1904 CE2 PHE A 123 0.243 17.135 1.908 1.00 50.40 C ATOM 1905 CZ PHE A 123 -0.095 17.272 3.239 1.00 13.33 C ATOM 0 H PHE A 123 3.758 15.355 1.018 1.00 15.01 H new ATOM 0 HA PHE A 123 3.536 13.957 3.457 1.00 11.44 H new ATOM 0 HB2 PHE A 123 2.026 13.768 0.827 1.00 33.12 H new ATOM 0 HB3 PHE A 123 1.546 12.916 2.281 1.00 33.12 H new ATOM 0 HD1 PHE A 123 1.233 14.414 4.426 1.00 45.13 H new ATOM 0 HD2 PHE A 123 1.197 15.917 0.441 1.00 64.40 H new ATOM 0 HE1 PHE A 123 0.002 16.399 5.187 1.00 65.41 H new ATOM 0 HE2 PHE A 123 -0.034 17.901 1.198 1.00 50.40 H new ATOM 0 HZ PHE A 123 -0.639 18.144 3.572 1.00 13.33 H new ATOM 1915 N ASN A 124 4.766 12.252 0.960 1.00 12.22 N ATOM 1916 CA ASN A 124 5.424 10.992 0.628 1.00 54.32 C ATOM 1917 C ASN A 124 6.756 10.890 1.360 1.00 62.33 C ATOM 1918 O ASN A 124 7.145 9.818 1.808 1.00 15.00 O ATOM 1919 CB ASN A 124 5.639 10.858 -0.885 1.00 50.03 C ATOM 1920 CG ASN A 124 6.216 9.504 -1.275 1.00 52.25 C ATOM 1921 OD1 ASN A 124 5.478 8.538 -1.487 1.00 51.11 O ATOM 1922 ND2 ASN A 124 7.533 9.429 -1.391 1.00 23.34 N ATOM 0 H ASN A 124 4.839 12.973 0.242 1.00 12.22 H new ATOM 0 HA ASN A 124 4.775 10.177 0.948 1.00 54.32 H new ATOM 0 HB2 ASN A 124 4.689 11.006 -1.398 1.00 50.03 H new ATOM 0 HB3 ASN A 124 6.310 11.647 -1.224 1.00 50.03 H new ATOM 0 HD21 ASN A 124 7.972 8.550 -1.664 1.00 23.34 H new ATOM 0 HD22 ASN A 124 8.109 10.251 -1.207 1.00 23.34 H new ATOM 1929 N ASP A 125 7.440 12.022 1.494 1.00 61.15 N ATOM 1930 CA ASP A 125 8.702 12.075 2.230 1.00 25.12 C ATOM 1931 C ASP A 125 8.474 11.686 3.686 1.00 54.34 C ATOM 1932 O ASP A 125 9.324 11.056 4.322 1.00 45.23 O ATOM 1933 CB ASP A 125 9.305 13.483 2.148 1.00 23.30 C ATOM 1934 CG ASP A 125 10.647 13.599 2.852 1.00 63.13 C ATOM 1935 OD1 ASP A 125 11.670 13.199 2.255 1.00 15.54 O ATOM 1936 OD2 ASP A 125 10.690 14.109 3.994 1.00 65.42 O ATOM 0 H ASP A 125 7.143 12.916 1.103 1.00 61.15 H new ATOM 0 HA ASP A 125 9.401 11.369 1.781 1.00 25.12 H new ATOM 0 HB2 ASP A 125 9.426 13.760 1.101 1.00 23.30 H new ATOM 0 HB3 ASP A 125 8.608 14.196 2.588 1.00 23.30 H new ATOM 1941 N TYR A 126 7.299 12.049 4.190 1.00 64.41 N ATOM 1942 CA TYR A 126 6.903 11.738 5.557 1.00 5.24 C ATOM 1943 C TYR A 126 6.870 10.224 5.780 1.00 72.11 C ATOM 1944 O TYR A 126 7.387 9.723 6.777 1.00 45.23 O ATOM 1945 CB TYR A 126 5.523 12.346 5.844 1.00 24.42 C ATOM 1946 CG TYR A 126 5.192 12.493 7.317 1.00 23.22 C ATOM 1947 CD1 TYR A 126 4.823 11.398 8.086 1.00 42.34 C ATOM 1948 CD2 TYR A 126 5.238 13.739 7.933 1.00 43.14 C ATOM 1949 CE1 TYR A 126 4.510 11.538 9.426 1.00 54.33 C ATOM 1950 CE2 TYR A 126 4.928 13.886 9.273 1.00 53.51 C ATOM 1951 CZ TYR A 126 4.564 12.784 10.014 1.00 42.13 C ATOM 1952 OH TYR A 126 4.252 12.925 11.350 1.00 70.44 O ATOM 0 H TYR A 126 6.596 12.566 3.662 1.00 64.41 H new ATOM 0 HA TYR A 126 7.636 12.167 6.241 1.00 5.24 H new ATOM 0 HB2 TYR A 126 5.468 13.327 5.373 1.00 24.42 H new ATOM 0 HB3 TYR A 126 4.761 11.724 5.374 1.00 24.42 H new ATOM 0 HD1 TYR A 126 4.780 10.420 7.630 1.00 42.34 H new ATOM 0 HD2 TYR A 126 5.521 14.607 7.355 1.00 43.14 H new ATOM 0 HE1 TYR A 126 4.225 10.675 10.009 1.00 54.33 H new ATOM 0 HE2 TYR A 126 4.971 14.861 9.736 1.00 53.51 H new ATOM 0 HH TYR A 126 4.340 13.866 11.609 1.00 70.44 H new ATOM 1962 N VAL A 127 6.257 9.497 4.851 1.00 52.20 N ATOM 1963 CA VAL A 127 6.167 8.047 4.969 1.00 12.34 C ATOM 1964 C VAL A 127 7.492 7.383 4.569 1.00 41.42 C ATOM 1965 O VAL A 127 7.822 6.297 5.051 1.00 3.43 O ATOM 1966 CB VAL A 127 4.993 7.466 4.138 1.00 70.32 C ATOM 1967 CG1 VAL A 127 5.272 7.525 2.643 1.00 43.44 C ATOM 1968 CG2 VAL A 127 4.678 6.044 4.578 1.00 4.41 C ATOM 0 H VAL A 127 5.819 9.884 4.015 1.00 52.20 H new ATOM 0 HA VAL A 127 5.966 7.823 6.017 1.00 12.34 H new ATOM 0 HB VAL A 127 4.118 8.088 4.326 1.00 70.32 H new ATOM 0 HG11 VAL A 127 4.425 7.108 2.098 1.00 43.44 H new ATOM 0 HG12 VAL A 127 5.423 8.562 2.342 1.00 43.44 H new ATOM 0 HG13 VAL A 127 6.168 6.947 2.417 1.00 43.44 H new ATOM 0 HG21 VAL A 127 3.852 5.654 3.984 1.00 4.41 H new ATOM 0 HG22 VAL A 127 5.557 5.416 4.434 1.00 4.41 H new ATOM 0 HG23 VAL A 127 4.399 6.043 5.632 1.00 4.41 H new ATOM 1978 N ASP A 128 8.261 8.052 3.709 1.00 31.32 N ATOM 1979 CA ASP A 128 9.564 7.542 3.277 1.00 75.31 C ATOM 1980 C ASP A 128 10.512 7.426 4.465 1.00 11.03 C ATOM 1981 O ASP A 128 11.132 6.384 4.676 1.00 74.14 O ATOM 1982 CB ASP A 128 10.178 8.450 2.204 1.00 14.24 C ATOM 1983 CG ASP A 128 11.549 7.978 1.741 1.00 52.51 C ATOM 1984 OD1 ASP A 128 12.564 8.383 2.348 1.00 52.43 O ATOM 1985 OD2 ASP A 128 11.626 7.215 0.754 1.00 72.21 O ATOM 0 H ASP A 128 8.004 8.949 3.297 1.00 31.32 H new ATOM 0 HA ASP A 128 9.412 6.552 2.847 1.00 75.31 H new ATOM 0 HB2 ASP A 128 9.507 8.496 1.347 1.00 14.24 H new ATOM 0 HB3 ASP A 128 10.262 9.463 2.597 1.00 14.24 H new ATOM 1990 N MET A 129 10.608 8.494 5.251 1.00 52.10 N ATOM 1991 CA MET A 129 11.455 8.491 6.440 1.00 72.03 C ATOM 1992 C MET A 129 10.947 7.463 7.450 1.00 74.53 C ATOM 1993 O MET A 129 11.730 6.868 8.192 1.00 40.11 O ATOM 1994 CB MET A 129 11.530 9.885 7.080 1.00 13.53 C ATOM 1995 CG MET A 129 10.209 10.391 7.635 1.00 61.51 C ATOM 1996 SD MET A 129 10.361 11.995 8.446 1.00 54.22 S ATOM 1997 CE MET A 129 11.562 11.619 9.723 1.00 14.11 C ATOM 0 H MET A 129 10.112 9.370 5.087 1.00 52.10 H new ATOM 0 HA MET A 129 12.464 8.214 6.133 1.00 72.03 H new ATOM 0 HB2 MET A 129 12.264 9.863 7.885 1.00 13.53 H new ATOM 0 HB3 MET A 129 11.894 10.594 6.336 1.00 13.53 H new ATOM 0 HG2 MET A 129 9.484 10.466 6.824 1.00 61.51 H new ATOM 0 HG3 MET A 129 9.817 9.665 8.347 1.00 61.51 H new ATOM 0 HE1 MET A 129 11.467 12.339 10.536 1.00 14.11 H new ATOM 0 HE2 MET A 129 11.384 10.614 10.106 1.00 14.11 H new ATOM 0 HE3 MET A 129 12.567 11.675 9.305 1.00 14.11 H new ATOM 2007 N LYS A 130 9.632 7.253 7.466 1.00 30.12 N ATOM 2008 CA LYS A 130 9.024 6.251 8.336 1.00 5.13 C ATOM 2009 C LYS A 130 9.509 4.850 7.957 1.00 5.50 C ATOM 2010 O LYS A 130 9.722 3.998 8.821 1.00 2.13 O ATOM 2011 CB LYS A 130 7.492 6.332 8.248 1.00 20.23 C ATOM 2012 CG LYS A 130 6.766 5.305 9.105 1.00 13.13 C ATOM 2013 CD LYS A 130 6.985 5.546 10.590 1.00 51.12 C ATOM 2014 CE LYS A 130 5.822 6.301 11.225 1.00 13.45 C ATOM 2015 NZ LYS A 130 5.627 7.658 10.643 1.00 4.31 N ATOM 0 H LYS A 130 8.967 7.765 6.885 1.00 30.12 H new ATOM 0 HA LYS A 130 9.325 6.452 9.364 1.00 5.13 H new ATOM 0 HB2 LYS A 130 7.174 7.330 8.548 1.00 20.23 H new ATOM 0 HB3 LYS A 130 7.191 6.200 7.209 1.00 20.23 H new ATOM 0 HG2 LYS A 130 5.699 5.339 8.886 1.00 13.13 H new ATOM 0 HG3 LYS A 130 7.113 4.305 8.845 1.00 13.13 H new ATOM 0 HD2 LYS A 130 7.116 4.590 11.097 1.00 51.12 H new ATOM 0 HD3 LYS A 130 7.906 6.112 10.733 1.00 51.12 H new ATOM 0 HE2 LYS A 130 4.907 5.722 11.099 1.00 13.45 H new ATOM 0 HE3 LYS A 130 5.996 6.392 12.297 1.00 13.45 H new ATOM 0 HZ1 LYS A 130 5.064 8.239 11.297 1.00 4.31 H new ATOM 0 HZ2 LYS A 130 6.553 8.107 10.491 1.00 4.31 H new ATOM 0 HZ3 LYS A 130 5.128 7.578 9.734 1.00 4.31 H new ATOM 2029 N ALA A 131 9.700 4.626 6.658 1.00 31.33 N ATOM 2030 CA ALA A 131 10.195 3.348 6.160 1.00 52.53 C ATOM 2031 C ALA A 131 11.636 3.120 6.600 1.00 54.02 C ATOM 2032 O ALA A 131 12.020 2.006 6.950 1.00 23.43 O ATOM 2033 CB ALA A 131 10.088 3.286 4.644 1.00 33.33 C ATOM 0 H ALA A 131 9.518 5.317 5.930 1.00 31.33 H new ATOM 0 HA ALA A 131 9.577 2.556 6.583 1.00 52.53 H new ATOM 0 HB1 ALA A 131 10.462 2.325 4.292 1.00 33.33 H new ATOM 0 HB2 ALA A 131 9.045 3.400 4.348 1.00 33.33 H new ATOM 0 HB3 ALA A 131 10.680 4.089 4.204 1.00 33.33 H new ATOM 2039 N LYS A 132 12.428 4.188 6.594 1.00 13.42 N ATOM 2040 CA LYS A 132 13.820 4.118 7.037 1.00 63.50 C ATOM 2041 C LYS A 132 13.893 3.732 8.509 1.00 23.22 C ATOM 2042 O LYS A 132 14.802 3.016 8.936 1.00 74.04 O ATOM 2043 CB LYS A 132 14.529 5.459 6.806 1.00 4.12 C ATOM 2044 CG LYS A 132 15.092 5.635 5.402 1.00 42.34 C ATOM 2045 CD LYS A 132 14.040 5.395 4.335 1.00 63.13 C ATOM 2046 CE LYS A 132 14.600 5.583 2.941 1.00 61.54 C ATOM 2047 NZ LYS A 132 14.863 7.010 2.629 1.00 62.44 N ATOM 0 H LYS A 132 12.131 5.114 6.287 1.00 13.42 H new ATOM 0 HA LYS A 132 14.326 3.352 6.450 1.00 63.50 H new ATOM 0 HB2 LYS A 132 13.827 6.268 7.007 1.00 4.12 H new ATOM 0 HB3 LYS A 132 15.342 5.556 7.526 1.00 4.12 H new ATOM 0 HG2 LYS A 132 15.493 6.643 5.296 1.00 42.34 H new ATOM 0 HG3 LYS A 132 15.922 4.944 5.255 1.00 42.34 H new ATOM 0 HD2 LYS A 132 13.645 4.384 4.435 1.00 63.13 H new ATOM 0 HD3 LYS A 132 13.205 6.080 4.487 1.00 63.13 H new ATOM 0 HE2 LYS A 132 15.525 5.015 2.844 1.00 61.54 H new ATOM 0 HE3 LYS A 132 13.899 5.177 2.212 1.00 61.54 H new ATOM 0 HZ1 LYS A 132 14.931 7.133 1.599 1.00 62.44 H new ATOM 0 HZ2 LYS A 132 14.086 7.595 2.997 1.00 62.44 H new ATOM 0 HZ3 LYS A 132 15.757 7.303 3.073 1.00 62.44 H new ATOM 2061 N SER A 133 12.912 4.194 9.271 1.00 73.35 N ATOM 2062 CA SER A 133 12.817 3.881 10.687 1.00 14.23 C ATOM 2063 C SER A 133 12.693 2.369 10.895 1.00 62.23 C ATOM 2064 O SER A 133 13.240 1.814 11.849 1.00 45.23 O ATOM 2065 CB SER A 133 11.612 4.612 11.294 1.00 3.45 C ATOM 2066 OG SER A 133 11.547 4.438 12.698 1.00 25.24 O ATOM 0 H SER A 133 12.163 4.794 8.926 1.00 73.35 H new ATOM 0 HA SER A 133 13.725 4.216 11.189 1.00 14.23 H new ATOM 0 HB2 SER A 133 11.676 5.675 11.062 1.00 3.45 H new ATOM 0 HB3 SER A 133 10.694 4.241 10.838 1.00 3.45 H new ATOM 0 HG SER A 133 10.769 4.918 13.051 1.00 25.24 H new ATOM 2072 N ALA A 134 12.011 1.702 9.969 1.00 22.11 N ATOM 2073 CA ALA A 134 11.779 0.265 10.069 1.00 52.42 C ATOM 2074 C ALA A 134 13.054 -0.533 9.798 1.00 41.52 C ATOM 2075 O ALA A 134 13.210 -1.658 10.276 1.00 74.21 O ATOM 2076 CB ALA A 134 10.683 -0.153 9.106 1.00 31.12 C ATOM 0 H ALA A 134 11.608 2.135 9.138 1.00 22.11 H new ATOM 0 HA ALA A 134 11.465 0.048 11.090 1.00 52.42 H new ATOM 0 HB1 ALA A 134 10.517 -1.227 9.188 1.00 31.12 H new ATOM 0 HB2 ALA A 134 9.762 0.376 9.351 1.00 31.12 H new ATOM 0 HB3 ALA A 134 10.982 0.091 8.087 1.00 31.12 H new ATOM 2082 N LEU A 135 13.970 0.054 9.037 1.00 72.52 N ATOM 2083 CA LEU A 135 15.232 -0.602 8.723 1.00 60.41 C ATOM 2084 C LEU A 135 16.237 -0.349 9.832 1.00 73.23 C ATOM 2085 O LEU A 135 17.310 -0.951 9.867 1.00 33.21 O ATOM 2086 CB LEU A 135 15.801 -0.110 7.386 1.00 70.20 C ATOM 2087 CG LEU A 135 15.294 -0.833 6.131 1.00 23.52 C ATOM 2088 CD1 LEU A 135 15.561 -2.330 6.226 1.00 34.31 C ATOM 2089 CD2 LEU A 135 13.815 -0.563 5.903 1.00 70.13 C ATOM 0 H LEU A 135 13.862 0.982 8.627 1.00 72.52 H new ATOM 0 HA LEU A 135 15.042 -1.672 8.638 1.00 60.41 H new ATOM 0 HB2 LEU A 135 15.574 0.951 7.286 1.00 70.20 H new ATOM 0 HB3 LEU A 135 16.887 -0.202 7.420 1.00 70.20 H new ATOM 0 HG LEU A 135 15.842 -0.441 5.274 1.00 23.52 H new ATOM 0 HD11 LEU A 135 15.194 -2.823 5.326 1.00 34.31 H new ATOM 0 HD12 LEU A 135 16.633 -2.503 6.323 1.00 34.31 H new ATOM 0 HD13 LEU A 135 15.048 -2.737 7.097 1.00 34.31 H new ATOM 0 HD21 LEU A 135 13.483 -1.088 5.007 1.00 70.13 H new ATOM 0 HD22 LEU A 135 13.244 -0.915 6.762 1.00 70.13 H new ATOM 0 HD23 LEU A 135 13.656 0.508 5.776 1.00 70.13 H new ATOM 2101 N GLY A 136 15.878 0.546 10.737 1.00 51.11 N ATOM 2102 CA GLY A 136 16.750 0.862 11.842 1.00 45.30 C ATOM 2103 C GLY A 136 17.568 2.110 11.590 1.00 33.21 C ATOM 2104 O GLY A 136 18.609 2.315 12.215 1.00 12.05 O ATOM 0 H GLY A 136 14.997 1.059 10.724 1.00 51.11 H new ATOM 0 HA2 GLY A 136 16.154 0.997 12.745 1.00 45.30 H new ATOM 0 HA3 GLY A 136 17.420 0.022 12.025 1.00 45.30 H new ATOM 2108 N ILE A 137 17.107 2.942 10.667 1.00 73.34 N ATOM 2109 CA ILE A 137 17.779 4.198 10.379 1.00 42.11 C ATOM 2110 C ILE A 137 17.282 5.294 11.313 1.00 72.05 C ATOM 2111 O ILE A 137 16.118 5.696 11.269 1.00 50.41 O ATOM 2112 CB ILE A 137 17.608 4.645 8.897 1.00 24.33 C ATOM 2113 CG1 ILE A 137 18.507 3.824 7.959 1.00 14.20 C ATOM 2114 CG2 ILE A 137 17.916 6.130 8.734 1.00 65.43 C ATOM 2115 CD1 ILE A 137 18.117 2.369 7.826 1.00 3.41 C ATOM 0 H ILE A 137 16.272 2.769 10.107 1.00 73.34 H new ATOM 0 HA ILE A 137 18.843 4.030 10.545 1.00 42.11 H new ATOM 0 HB ILE A 137 16.567 4.468 8.625 1.00 24.33 H new ATOM 0 HG12 ILE A 137 18.492 4.282 6.970 1.00 14.20 H new ATOM 0 HG13 ILE A 137 19.534 3.880 8.321 1.00 14.20 H new ATOM 0 HG21 ILE A 137 17.789 6.415 7.690 1.00 65.43 H new ATOM 0 HG22 ILE A 137 17.236 6.713 9.355 1.00 65.43 H new ATOM 0 HG23 ILE A 137 18.944 6.324 9.041 1.00 65.43 H new ATOM 0 HD11 ILE A 137 18.806 1.868 7.146 1.00 3.41 H new ATOM 0 HD12 ILE A 137 18.161 1.890 8.804 1.00 3.41 H new ATOM 0 HD13 ILE A 137 17.103 2.299 7.432 1.00 3.41 H new ATOM 2127 N ARG A 138 18.168 5.724 12.192 1.00 52.31 N ATOM 2128 CA ARG A 138 17.929 6.883 13.035 1.00 34.34 C ATOM 2129 C ARG A 138 18.916 7.972 12.659 1.00 71.32 C ATOM 2130 O ARG A 138 19.684 7.815 11.708 1.00 74.01 O ATOM 2131 CB ARG A 138 18.105 6.530 14.520 1.00 24.51 C ATOM 2132 CG ARG A 138 16.810 6.275 15.272 1.00 1.31 C ATOM 2133 CD ARG A 138 16.115 5.007 14.807 1.00 53.01 C ATOM 2134 NE ARG A 138 14.911 4.733 15.592 1.00 40.43 N ATOM 2135 CZ ARG A 138 13.909 3.961 15.181 1.00 13.44 C ATOM 2136 NH1 ARG A 138 13.970 3.362 14.002 1.00 1.32 N ATOM 2137 NH2 ARG A 138 12.850 3.787 15.955 1.00 53.33 N ATOM 0 H ARG A 138 19.074 5.280 12.342 1.00 52.31 H new ATOM 0 HA ARG A 138 16.905 7.224 12.883 1.00 34.34 H new ATOM 0 HB2 ARG A 138 18.734 5.643 14.596 1.00 24.51 H new ATOM 0 HB3 ARG A 138 18.640 7.343 15.011 1.00 24.51 H new ATOM 0 HG2 ARG A 138 17.020 6.201 16.339 1.00 1.31 H new ATOM 0 HG3 ARG A 138 16.140 7.124 15.137 1.00 1.31 H new ATOM 0 HD2 ARG A 138 15.850 5.102 13.754 1.00 53.01 H new ATOM 0 HD3 ARG A 138 16.802 4.165 14.888 1.00 53.01 H new ATOM 0 HE ARG A 138 14.835 5.162 16.514 1.00 40.43 H new ATOM 0 HH11 ARG A 138 14.787 3.492 13.406 1.00 1.32 H new ATOM 0 HH12 ARG A 138 13.200 2.771 13.690 1.00 1.32 H new ATOM 0 HH21 ARG A 138 12.803 4.245 16.865 1.00 53.33 H new ATOM 0 HH22 ARG A 138 12.081 3.195 15.641 1.00 53.33 H new ATOM 2151 N ASP A 139 18.891 9.074 13.387 1.00 11.15 N ATOM 2152 CA ASP A 139 19.947 10.062 13.277 1.00 71.31 C ATOM 2153 C ASP A 139 21.248 9.405 13.709 1.00 53.11 C ATOM 2154 O ASP A 139 21.258 8.667 14.689 1.00 31.55 O ATOM 2155 CB ASP A 139 19.648 11.275 14.163 1.00 0.20 C ATOM 2156 CG ASP A 139 18.353 11.969 13.792 1.00 61.03 C ATOM 2157 OD1 ASP A 139 17.273 11.464 14.166 1.00 74.11 O ATOM 2158 OD2 ASP A 139 18.407 13.030 13.135 1.00 11.22 O ATOM 0 H ASP A 139 18.157 9.306 14.056 1.00 11.15 H new ATOM 0 HA ASP A 139 20.021 10.414 12.248 1.00 71.31 H new ATOM 0 HB2 ASP A 139 19.598 10.955 15.204 1.00 0.20 H new ATOM 0 HB3 ASP A 139 20.471 11.986 14.087 1.00 0.20 H new ATOM 2163 N LEU A 140 22.335 9.661 12.994 1.00 0.33 N ATOM 2164 CA LEU A 140 23.600 8.972 13.258 1.00 25.14 C ATOM 2165 C LEU A 140 24.161 9.340 14.632 1.00 31.52 C ATOM 2166 O LEU A 140 25.046 8.665 15.161 1.00 73.21 O ATOM 2167 CB LEU A 140 24.622 9.282 12.163 1.00 74.04 C ATOM 2168 CG LEU A 140 24.221 8.831 10.755 1.00 14.52 C ATOM 2169 CD1 LEU A 140 25.321 9.160 9.760 1.00 23.34 C ATOM 2170 CD2 LEU A 140 23.919 7.340 10.735 1.00 63.41 C ATOM 0 H LEU A 140 22.371 10.336 12.230 1.00 0.33 H new ATOM 0 HA LEU A 140 23.399 7.901 13.255 1.00 25.14 H new ATOM 0 HB2 LEU A 140 24.799 10.357 12.147 1.00 74.04 H new ATOM 0 HB3 LEU A 140 25.567 8.807 12.425 1.00 74.04 H new ATOM 0 HG LEU A 140 23.318 9.369 10.467 1.00 14.52 H new ATOM 0 HD11 LEU A 140 25.021 8.833 8.764 1.00 23.34 H new ATOM 0 HD12 LEU A 140 25.494 10.236 9.752 1.00 23.34 H new ATOM 0 HD13 LEU A 140 26.238 8.647 10.049 1.00 23.34 H new ATOM 0 HD21 LEU A 140 23.636 7.040 9.726 1.00 63.41 H new ATOM 0 HD22 LEU A 140 24.805 6.785 11.044 1.00 63.41 H new ATOM 0 HD23 LEU A 140 23.099 7.126 11.421 1.00 63.41 H new ATOM 2182 N GLU A 141 23.628 10.409 15.204 1.00 34.02 N ATOM 2183 CA GLU A 141 23.981 10.828 16.553 1.00 42.25 C ATOM 2184 C GLU A 141 23.205 10.015 17.592 1.00 55.01 C ATOM 2185 O GLU A 141 23.408 10.165 18.796 1.00 43.42 O ATOM 2186 CB GLU A 141 23.685 12.319 16.718 1.00 21.22 C ATOM 2187 CG GLU A 141 22.273 12.697 16.301 1.00 51.25 C ATOM 2188 CD GLU A 141 21.996 14.174 16.457 1.00 71.11 C ATOM 2189 OE1 GLU A 141 21.540 14.579 17.543 1.00 15.34 O ATOM 2190 OE2 GLU A 141 22.227 14.934 15.498 1.00 4.21 O ATOM 0 H GLU A 141 22.941 11.009 14.748 1.00 34.02 H new ATOM 0 HA GLU A 141 25.045 10.652 16.711 1.00 42.25 H new ATOM 0 HB2 GLU A 141 23.837 12.600 17.760 1.00 21.22 H new ATOM 0 HB3 GLU A 141 24.398 12.892 16.126 1.00 21.22 H new ATOM 0 HG2 GLU A 141 22.116 12.410 15.261 1.00 51.25 H new ATOM 0 HG3 GLU A 141 21.558 12.132 16.899 1.00 51.25 H new ATOM 2197 N HIS A 142 22.315 9.155 17.118 1.00 52.43 N ATOM 2198 CA HIS A 142 21.528 8.291 17.988 1.00 54.15 C ATOM 2199 C HIS A 142 21.685 6.839 17.566 1.00 0.22 C ATOM 2200 O HIS A 142 21.930 6.549 16.397 1.00 74.21 O ATOM 2201 CB HIS A 142 20.048 8.677 17.949 1.00 44.31 C ATOM 2202 CG HIS A 142 19.705 9.863 18.796 1.00 51.11 C ATOM 2203 ND1 HIS A 142 19.513 11.128 18.286 1.00 40.24 N ATOM 2204 CD2 HIS A 142 19.491 9.963 20.129 1.00 14.33 C ATOM 2205 CE1 HIS A 142 19.200 11.952 19.267 1.00 31.54 C ATOM 2206 NE2 HIS A 142 19.176 11.271 20.397 1.00 74.34 N ATOM 0 H HIS A 142 22.118 9.036 16.124 1.00 52.43 H new ATOM 0 HA HIS A 142 21.895 8.415 19.007 1.00 54.15 H new ATOM 0 HB2 HIS A 142 19.765 8.886 16.917 1.00 44.31 H new ATOM 0 HB3 HIS A 142 19.452 7.825 18.277 1.00 44.31 H new ATOM 0 HD2 HIS A 142 19.556 9.161 20.849 1.00 14.33 H new ATOM 0 HE1 HIS A 142 18.997 13.008 19.163 1.00 31.54 H new ATOM 0 HE2 HIS A 142 18.959 11.654 21.317 1.00 74.34 H new ATOM 2215 N HIS A 143 21.556 5.931 18.517 1.00 34.31 N ATOM 2216 CA HIS A 143 21.664 4.506 18.231 1.00 33.24 C ATOM 2217 C HIS A 143 20.651 3.736 19.058 1.00 61.05 C ATOM 2218 O HIS A 143 20.273 4.174 20.145 1.00 21.30 O ATOM 2219 CB HIS A 143 23.079 3.995 18.523 1.00 15.41 C ATOM 2220 CG HIS A 143 24.125 4.585 17.628 1.00 50.41 C ATOM 2221 ND1 HIS A 143 25.121 5.427 18.075 1.00 43.10 N ATOM 2222 CD2 HIS A 143 24.316 4.457 16.295 1.00 14.25 C ATOM 2223 CE1 HIS A 143 25.875 5.795 17.054 1.00 15.32 C ATOM 2224 NE2 HIS A 143 25.407 5.219 15.963 1.00 11.21 N ATOM 0 H HIS A 143 21.376 6.153 19.496 1.00 34.31 H new ATOM 0 HA HIS A 143 21.458 4.350 17.172 1.00 33.24 H new ATOM 0 HB2 HIS A 143 23.331 4.219 19.560 1.00 15.41 H new ATOM 0 HB3 HIS A 143 23.093 2.910 18.419 1.00 15.41 H new ATOM 0 HD2 HIS A 143 23.720 3.864 15.617 1.00 14.25 H new ATOM 0 HE1 HIS A 143 26.729 6.455 17.104 1.00 15.32 H new ATOM 0 HE2 HIS A 143 25.794 5.323 15.025 1.00 11.21 H new ATOM 2233 N HIS A 144 20.197 2.604 18.544 1.00 31.43 N ATOM 2234 CA HIS A 144 19.223 1.792 19.258 1.00 10.23 C ATOM 2235 C HIS A 144 19.557 0.311 19.125 1.00 14.31 C ATOM 2236 O HIS A 144 19.287 -0.311 18.099 1.00 34.21 O ATOM 2237 CB HIS A 144 17.810 2.073 18.737 1.00 75.21 C ATOM 2238 CG HIS A 144 16.731 1.429 19.552 1.00 11.51 C ATOM 2239 ND1 HIS A 144 15.852 0.499 19.042 1.00 42.34 N ATOM 2240 CD2 HIS A 144 16.391 1.594 20.851 1.00 4.35 C ATOM 2241 CE1 HIS A 144 15.018 0.121 19.993 1.00 2.05 C ATOM 2242 NE2 HIS A 144 15.323 0.770 21.100 1.00 71.44 N ATOM 0 H HIS A 144 20.485 2.228 17.641 1.00 31.43 H new ATOM 0 HA HIS A 144 19.262 2.057 20.315 1.00 10.23 H new ATOM 0 HB2 HIS A 144 17.646 3.150 18.719 1.00 75.21 H new ATOM 0 HB3 HIS A 144 17.735 1.722 17.708 1.00 75.21 H new ATOM 0 HD2 HIS A 144 16.871 2.252 21.560 1.00 4.35 H new ATOM 0 HE1 HIS A 144 14.220 -0.599 19.883 1.00 2.05 H new ATOM 0 HE2 HIS A 144 14.843 0.675 21.995 1.00 71.44 H new ATOM 2251 N HIS A 145 20.166 -0.239 20.162 1.00 3.52 N ATOM 2252 CA HIS A 145 20.524 -1.651 20.195 1.00 1.10 C ATOM 2253 C HIS A 145 20.334 -2.215 21.593 1.00 44.32 C ATOM 2254 O HIS A 145 20.104 -1.471 22.548 1.00 52.13 O ATOM 2255 CB HIS A 145 21.981 -1.857 19.769 1.00 41.53 C ATOM 2256 CG HIS A 145 22.190 -1.914 18.288 1.00 2.43 C ATOM 2257 ND1 HIS A 145 22.940 -0.993 17.592 1.00 0.51 N ATOM 2258 CD2 HIS A 145 21.773 -2.821 17.376 1.00 25.32 C ATOM 2259 CE1 HIS A 145 22.970 -1.330 16.315 1.00 52.21 C ATOM 2260 NE2 HIS A 145 22.272 -2.439 16.156 1.00 64.41 N ATOM 0 H HIS A 145 20.426 0.277 21.003 1.00 3.52 H new ATOM 0 HA HIS A 145 19.870 -2.173 19.497 1.00 1.10 H new ATOM 0 HB2 HIS A 145 22.584 -1.047 20.178 1.00 41.53 H new ATOM 0 HB3 HIS A 145 22.349 -2.783 20.211 1.00 41.53 H new ATOM 0 HD2 HIS A 145 21.159 -3.688 17.572 1.00 25.32 H new ATOM 0 HE1 HIS A 145 23.480 -0.789 15.532 1.00 52.21 H new ATOM 0 HE2 HIS A 145 22.128 -2.930 15.274 1.00 64.41 H new ATOM 2269 N HIS A 146 20.429 -3.529 21.705 1.00 22.21 N ATOM 2270 CA HIS A 146 20.393 -4.193 22.998 1.00 64.30 C ATOM 2271 C HIS A 146 21.475 -5.263 23.040 1.00 72.44 C ATOM 2272 O HIS A 146 21.952 -5.710 21.995 1.00 74.12 O ATOM 2273 CB HIS A 146 19.010 -4.815 23.271 1.00 0.30 C ATOM 2274 CG HIS A 146 18.724 -6.077 22.504 1.00 2.01 C ATOM 2275 ND1 HIS A 146 18.910 -7.337 23.038 1.00 31.11 N ATOM 2276 CD2 HIS A 146 18.254 -6.271 21.249 1.00 63.33 C ATOM 2277 CE1 HIS A 146 18.570 -8.247 22.145 1.00 25.11 C ATOM 2278 NE2 HIS A 146 18.169 -7.628 21.052 1.00 0.32 N ATOM 0 H HIS A 146 20.532 -4.161 20.911 1.00 22.21 H new ATOM 0 HA HIS A 146 20.577 -3.453 23.777 1.00 64.30 H new ATOM 0 HB2 HIS A 146 18.927 -5.027 24.337 1.00 0.30 H new ATOM 0 HB3 HIS A 146 18.242 -4.079 23.032 1.00 0.30 H new ATOM 0 HD2 HIS A 146 17.994 -5.502 20.536 1.00 63.33 H new ATOM 0 HE1 HIS A 146 18.613 -9.317 22.285 1.00 25.11 H new ATOM 0 HE2 HIS A 146 17.847 -8.083 20.198 1.00 0.32 H new ATOM 2287 N HIS A 147 21.864 -5.669 24.233 1.00 32.23 N ATOM 2288 CA HIS A 147 22.877 -6.698 24.383 1.00 32.21 C ATOM 2289 C HIS A 147 22.213 -8.068 24.434 1.00 64.13 C ATOM 2290 O HIS A 147 21.849 -8.512 25.541 1.00 38.94 O ATOM 2291 CB HIS A 147 23.705 -6.454 25.650 1.00 22.30 C ATOM 2292 CG HIS A 147 24.855 -7.403 25.816 1.00 51.12 C ATOM 2293 ND1 HIS A 147 24.735 -8.630 26.430 1.00 4.31 N ATOM 2294 CD2 HIS A 147 26.154 -7.299 25.446 1.00 44.42 C ATOM 2295 CE1 HIS A 147 25.905 -9.237 26.433 1.00 63.23 C ATOM 2296 NE2 HIS A 147 26.780 -8.453 25.841 1.00 34.44 N ATOM 2297 OXT HIS A 147 22.035 -8.683 23.364 1.00 38.94 O ATOM 0 H HIS A 147 21.496 -5.304 25.111 1.00 32.23 H new ATOM 0 HA HIS A 147 23.549 -6.662 23.526 1.00 32.21 H new ATOM 0 HB2 HIS A 147 24.088 -5.434 25.631 1.00 22.30 H new ATOM 0 HB3 HIS A 147 23.053 -6.533 26.520 1.00 22.30 H new ATOM 0 HD2 HIS A 147 26.611 -6.464 24.936 1.00 44.42 H new ATOM 0 HE1 HIS A 147 26.110 -10.212 26.850 1.00 63.23 H new ATOM 0 HE2 HIS A 147 27.767 -8.669 25.699 1.00 34.44 H new TER 2306 HIS A 147