USER MOD reduce.3.24.130724 H: found=0, std=0, add=1349, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1349 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 143 THR OG1 : rot -96:sc= -0.223 USER MOD Set 1.2: A 144 THR OG1 : rot 180:sc= 0.00861 USER MOD Set 2.1: A 103 GLN : amide:sc= -1.14 K(o=-3.1,f=-4!) USER MOD Set 2.2: A 117 GLN : amide:sc= -1.99 K(o=-3.1,f=-4!) USER MOD Set 3.1: A 53 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 54 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 44 THR OG1 : rot 140:sc= -1.6 USER MOD Set 4.2: A 48 SER OG : rot -163:sc= -2.45! USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.257 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= -0.231 K(o=-0.23,f=-0.99) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -0.167 K(o=-0.17,f=-0.75) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= -2.49 K(o=-2.5,f=-6.4!) USER MOD Single : A 50 MET CE :methyl 138:sc= -5.54! (180deg=-7.25!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -0.212 X(o=-0.21,f=0) USER MOD Single : A 62 ASN : amide:sc= -1.17! C(o=-1.2!,f=-1.2!) USER MOD Single : A 64 ASN : amide:sc= -1.1 K(o=-1.1,f=-4.3!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl 161:sc= -3.02 (180deg=-3.6) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.0865 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= -1.63 USER MOD Single : A 98 TYR OH : rot 180:sc= -3.52! USER MOD Single : A 101 TYR OH : rot 128:sc= -3.67! USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 SER OG : rot 149:sc= 0.00121 USER MOD Single : A 109 SER OG : rot -35:sc= 0.53 USER MOD Single : A 112 GLN : amide:sc= -0.756 K(o=-0.76,f=-2.9!) USER MOD Single : A 118 MET CE :methyl 176:sc= 0 (180deg=-0.0268) USER MOD Single : A 119 SER OG : rot 111:sc= 0.602 USER MOD Single : A 120 THR OG1 : rot -8:sc= -3.75! USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 GLN : amide:sc= -0.424 X(o=-0.42,f=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ -168:sc= -2.49! (180deg=-2.82!) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 ASN : amide:sc= -0.0274 K(o=-0.027,f=-2.1!) USER MOD Single : A 138 THR OG1 : rot 180:sc=-0.00329 USER MOD Single : A 139 THR OG1 : rot -167:sc= -7.15! USER MOD Single : A 145 ASN : amide:sc= -7.22! C(o=-7.2!,f=-4.1!) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 151 LYS NZ :NH3+ -160:sc= -0.0125 (180deg=-0.298) USER MOD Single : A 153 GLN : amide:sc= -0.195 K(o=-0.19,f=-1.1) USER MOD Single : A 155 GLN : amide:sc= -0.117 K(o=-0.12,f=-0.65) USER MOD Single : A 156 ASN : amide:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 157 GLN : amide:sc= -0.471 X(o=-0.47,f=0) USER MOD Single : A 160 GLN : amide:sc= -1.23 K(o=-1.2,f=-5!) USER MOD Single : A 162 MET CE :methyl 142:sc= -10.4! (180deg=-14.2!) USER MOD Single : A 163 THR OG1 : rot 64:sc= 0.307 USER MOD Single : A 164 THR OG1 : rot 180:sc= 0 USER MOD Single : A 165 HIS : no HE2:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 170 SER OG : rot 180:sc= -0.0872 USER MOD Single : A 172 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 177 SER OG : rot -130:sc= 0.163 USER MOD Single : A 178 SER OG : rot -90:sc= -0.525 USER MOD Single : A 184 GLN : amide:sc= -0.112 K(o=-0.11,f=-2.3!) USER MOD Single : A 185 MET CE :methyl 167:sc= -0.116 (180deg=-0.597) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 20 20.820 14.771 1.425 1.00 1.45 N ATOM 2 CA LEU A 20 19.684 13.858 1.111 1.00 0.98 C ATOM 3 C LEU A 20 20.138 12.811 0.090 1.00 0.96 C ATOM 4 O LEU A 20 20.831 13.113 -0.861 1.00 1.16 O ATOM 5 CB LEU A 20 18.523 14.672 0.534 1.00 1.12 C ATOM 6 CG LEU A 20 17.200 14.123 1.070 1.00 0.78 C ATOM 7 CD1 LEU A 20 16.509 15.191 1.920 1.00 0.67 C ATOM 8 CD2 LEU A 20 16.293 13.742 -0.102 1.00 1.58 C ATOM 0 HA LEU A 20 19.356 13.355 2.021 1.00 0.98 H new ATOM 0 HB2 LEU A 20 18.630 15.722 0.806 1.00 1.12 H new ATOM 0 HB3 LEU A 20 18.535 14.622 -0.555 1.00 1.12 H new ATOM 0 HG LEU A 20 17.396 13.242 1.681 1.00 0.78 H new ATOM 0 HD11 LEU A 20 15.566 14.799 2.301 1.00 0.67 H new ATOM 0 HD12 LEU A 20 17.153 15.464 2.756 1.00 0.67 H new ATOM 0 HD13 LEU A 20 16.314 16.073 1.309 1.00 0.67 H new ATOM 0 HD21 LEU A 20 15.350 13.351 0.280 1.00 1.58 H new ATOM 0 HD22 LEU A 20 16.099 14.623 -0.713 1.00 1.58 H new ATOM 0 HD23 LEU A 20 16.783 12.980 -0.708 1.00 1.58 H new ATOM 20 N THR A 21 19.753 11.577 0.282 1.00 0.77 N ATOM 21 CA THR A 21 20.164 10.508 -0.673 1.00 0.76 C ATOM 22 C THR A 21 18.920 9.808 -1.228 1.00 0.69 C ATOM 23 O THR A 21 17.808 10.082 -0.823 1.00 0.68 O ATOM 24 CB THR A 21 21.040 9.486 0.057 1.00 0.69 C ATOM 25 OG1 THR A 21 21.423 8.458 -0.845 1.00 0.99 O ATOM 26 CG2 THR A 21 20.257 8.880 1.223 1.00 0.73 C ATOM 0 H THR A 21 19.172 11.264 1.059 1.00 0.77 H new ATOM 0 HA THR A 21 20.726 10.952 -1.495 1.00 0.76 H new ATOM 0 HB THR A 21 21.932 9.982 0.440 1.00 0.69 H new ATOM 0 HG1 THR A 21 21.985 7.805 -0.378 1.00 0.99 H new ATOM 0 HG21 THR A 21 20.882 8.153 1.742 1.00 0.73 H new ATOM 0 HG22 THR A 21 19.967 9.670 1.916 1.00 0.73 H new ATOM 0 HG23 THR A 21 19.363 8.385 0.843 1.00 0.73 H new ATOM 34 N SER A 22 19.103 8.906 -2.156 1.00 0.68 N ATOM 35 CA SER A 22 17.937 8.184 -2.745 1.00 0.71 C ATOM 36 C SER A 22 17.066 7.597 -1.630 1.00 0.59 C ATOM 37 O SER A 22 15.855 7.684 -1.668 1.00 0.56 O ATOM 38 CB SER A 22 18.447 7.053 -3.640 1.00 0.72 C ATOM 39 OG SER A 22 19.346 7.586 -4.604 1.00 0.79 O ATOM 0 H SER A 22 20.012 8.638 -2.532 1.00 0.68 H new ATOM 0 HA SER A 22 17.340 8.882 -3.332 1.00 0.71 H new ATOM 0 HB2 SER A 22 18.949 6.295 -3.038 1.00 0.72 H new ATOM 0 HB3 SER A 22 17.611 6.562 -4.138 1.00 0.72 H new ATOM 0 HG SER A 22 19.676 6.864 -5.178 1.00 0.79 H new ATOM 45 N SER A 23 17.670 6.997 -0.640 1.00 0.55 N ATOM 46 CA SER A 23 16.868 6.407 0.470 1.00 0.48 C ATOM 47 C SER A 23 16.003 7.495 1.105 1.00 0.50 C ATOM 48 O SER A 23 14.848 7.280 1.419 1.00 0.55 O ATOM 49 CB SER A 23 17.808 5.816 1.522 1.00 0.36 C ATOM 50 OG SER A 23 17.801 4.398 1.415 1.00 1.17 O ATOM 0 H SER A 23 18.681 6.890 -0.552 1.00 0.55 H new ATOM 0 HA SER A 23 16.227 5.618 0.077 1.00 0.48 H new ATOM 0 HB2 SER A 23 18.819 6.198 1.379 1.00 0.36 H new ATOM 0 HB3 SER A 23 17.491 6.118 2.520 1.00 0.36 H new ATOM 0 HG SER A 23 18.404 4.016 2.087 1.00 1.17 H new ATOM 56 N GLU A 24 16.543 8.667 1.291 1.00 0.55 N ATOM 57 CA GLU A 24 15.737 9.762 1.892 1.00 0.64 C ATOM 58 C GLU A 24 14.592 10.104 0.939 1.00 0.79 C ATOM 59 O GLU A 24 13.522 10.504 1.350 1.00 0.83 O ATOM 60 CB GLU A 24 16.618 10.994 2.099 1.00 0.71 C ATOM 61 CG GLU A 24 17.480 10.801 3.346 1.00 1.01 C ATOM 62 CD GLU A 24 17.176 11.909 4.355 1.00 0.38 C ATOM 63 OE1 GLU A 24 16.064 11.938 4.856 1.00 0.88 O ATOM 64 OE2 GLU A 24 18.059 12.713 4.607 1.00 1.54 O ATOM 0 H GLU A 24 17.504 8.912 1.053 1.00 0.55 H new ATOM 0 HA GLU A 24 15.338 9.445 2.856 1.00 0.64 H new ATOM 0 HB2 GLU A 24 17.252 11.151 1.227 1.00 0.71 H new ATOM 0 HB3 GLU A 24 15.998 11.884 2.207 1.00 0.71 H new ATOM 0 HG2 GLU A 24 17.281 9.826 3.790 1.00 1.01 H new ATOM 0 HG3 GLU A 24 18.536 10.820 3.077 1.00 1.01 H new ATOM 71 N ARG A 25 14.812 9.935 -0.337 1.00 0.88 N ATOM 72 CA ARG A 25 13.741 10.231 -1.328 1.00 1.05 C ATOM 73 C ARG A 25 12.705 9.103 -1.298 1.00 1.06 C ATOM 74 O ARG A 25 11.573 9.277 -1.699 1.00 1.29 O ATOM 75 CB ARG A 25 14.358 10.331 -2.728 1.00 1.13 C ATOM 76 CG ARG A 25 14.421 11.798 -3.159 1.00 1.12 C ATOM 77 CD ARG A 25 15.235 11.916 -4.450 1.00 1.55 C ATOM 78 NE ARG A 25 15.270 13.340 -4.888 1.00 0.97 N ATOM 79 CZ ARG A 25 16.065 14.188 -4.293 1.00 0.51 C ATOM 80 NH1 ARG A 25 15.726 14.703 -3.142 1.00 1.62 N ATOM 81 NH2 ARG A 25 17.196 14.525 -4.852 1.00 1.30 N ATOM 0 H ARG A 25 15.690 9.604 -0.736 1.00 0.88 H new ATOM 0 HA ARG A 25 13.257 11.176 -1.080 1.00 1.05 H new ATOM 0 HB2 ARG A 25 15.359 9.899 -2.727 1.00 1.13 H new ATOM 0 HB3 ARG A 25 13.764 9.758 -3.440 1.00 1.13 H new ATOM 0 HG2 ARG A 25 13.414 12.186 -3.314 1.00 1.12 H new ATOM 0 HG3 ARG A 25 14.877 12.400 -2.373 1.00 1.12 H new ATOM 0 HD2 ARG A 25 16.249 11.549 -4.288 1.00 1.55 H new ATOM 0 HD3 ARG A 25 14.792 11.296 -5.229 1.00 1.55 H new ATOM 0 HE ARG A 25 14.672 13.653 -5.653 1.00 0.97 H new ATOM 0 HH11 ARG A 25 14.840 14.443 -2.708 1.00 1.62 H new ATOM 0 HH12 ARG A 25 16.347 15.365 -2.677 1.00 1.62 H new ATOM 0 HH21 ARG A 25 17.458 14.126 -5.753 1.00 1.30 H new ATOM 0 HH22 ARG A 25 17.817 15.187 -4.387 1.00 1.30 H new ATOM 95 N ILE A 26 13.083 7.947 -0.815 1.00 0.84 N ATOM 96 CA ILE A 26 12.120 6.811 -0.743 1.00 0.88 C ATOM 97 C ILE A 26 11.103 7.097 0.372 1.00 0.80 C ATOM 98 O ILE A 26 9.906 7.085 0.161 1.00 0.72 O ATOM 99 CB ILE A 26 12.885 5.517 -0.420 1.00 0.80 C ATOM 100 CG1 ILE A 26 13.809 5.154 -1.598 1.00 0.99 C ATOM 101 CG2 ILE A 26 11.896 4.372 -0.153 1.00 0.88 C ATOM 102 CD1 ILE A 26 12.992 4.624 -2.785 1.00 0.48 C ATOM 0 H ILE A 26 14.020 7.742 -0.467 1.00 0.84 H new ATOM 0 HA ILE A 26 11.603 6.697 -1.696 1.00 0.88 H new ATOM 0 HB ILE A 26 13.489 5.672 0.474 1.00 0.80 H new ATOM 0 HG12 ILE A 26 14.378 6.032 -1.905 1.00 0.99 H new ATOM 0 HG13 ILE A 26 14.531 4.401 -1.282 1.00 0.99 H new ATOM 0 HG21 ILE A 26 12.448 3.460 0.075 1.00 0.88 H new ATOM 0 HG22 ILE A 26 11.259 4.631 0.693 1.00 0.88 H new ATOM 0 HG23 ILE A 26 11.278 4.211 -1.037 1.00 0.88 H new ATOM 0 HD11 ILE A 26 13.664 4.374 -3.606 1.00 0.48 H new ATOM 0 HD12 ILE A 26 12.444 3.733 -2.480 1.00 0.48 H new ATOM 0 HD13 ILE A 26 12.288 5.389 -3.113 1.00 0.48 H new ATOM 114 N ASP A 27 11.586 7.352 1.559 1.00 0.86 N ATOM 115 CA ASP A 27 10.675 7.637 2.707 1.00 0.79 C ATOM 116 C ASP A 27 9.885 8.921 2.442 1.00 0.67 C ATOM 117 O ASP A 27 8.712 9.013 2.748 1.00 0.50 O ATOM 118 CB ASP A 27 11.521 7.812 3.975 1.00 0.90 C ATOM 119 CG ASP A 27 10.631 8.204 5.161 1.00 0.90 C ATOM 120 OD1 ASP A 27 9.962 9.220 5.071 1.00 0.65 O ATOM 121 OD2 ASP A 27 10.644 7.486 6.147 1.00 1.50 O ATOM 0 H ASP A 27 12.580 7.375 1.784 1.00 0.86 H new ATOM 0 HA ASP A 27 9.975 6.811 2.832 1.00 0.79 H new ATOM 0 HB2 ASP A 27 12.049 6.885 4.199 1.00 0.90 H new ATOM 0 HB3 ASP A 27 12.279 8.578 3.812 1.00 0.90 H new ATOM 126 N LYS A 28 10.521 9.919 1.900 1.00 0.78 N ATOM 127 CA LYS A 28 9.811 11.202 1.644 1.00 0.74 C ATOM 128 C LYS A 28 8.713 11.004 0.601 1.00 0.58 C ATOM 129 O LYS A 28 7.630 11.541 0.721 1.00 0.50 O ATOM 130 CB LYS A 28 10.812 12.246 1.143 1.00 0.93 C ATOM 131 CG LYS A 28 10.232 13.649 1.339 1.00 0.10 C ATOM 132 CD LYS A 28 9.911 13.860 2.818 1.00 1.70 C ATOM 133 CE LYS A 28 10.359 15.258 3.248 1.00 2.30 C ATOM 134 NZ LYS A 28 11.694 15.172 3.906 1.00 3.96 N ATOM 0 H LYS A 28 11.502 9.903 1.623 1.00 0.78 H new ATOM 0 HA LYS A 28 9.355 11.545 2.573 1.00 0.74 H new ATOM 0 HB2 LYS A 28 11.753 12.152 1.685 1.00 0.93 H new ATOM 0 HB3 LYS A 28 11.033 12.077 0.089 1.00 0.93 H new ATOM 0 HG2 LYS A 28 10.945 14.400 0.999 1.00 0.10 H new ATOM 0 HG3 LYS A 28 9.330 13.770 0.738 1.00 0.10 H new ATOM 0 HD2 LYS A 28 8.841 13.742 2.988 1.00 1.70 H new ATOM 0 HD3 LYS A 28 10.415 13.105 3.421 1.00 1.70 H new ATOM 0 HE2 LYS A 28 10.411 15.917 2.382 1.00 2.30 H new ATOM 0 HE3 LYS A 28 9.631 15.690 3.934 1.00 2.30 H new ATOM 0 HZ1 LYS A 28 11.999 16.122 4.198 1.00 3.96 H new ATOM 0 HZ2 LYS A 28 11.630 14.556 4.742 1.00 3.96 H new ATOM 0 HZ3 LYS A 28 12.386 14.777 3.237 1.00 3.96 H new ATOM 148 N GLN A 29 8.977 10.246 -0.421 1.00 0.58 N ATOM 149 CA GLN A 29 7.939 10.030 -1.463 1.00 0.47 C ATOM 150 C GLN A 29 6.763 9.261 -0.855 1.00 0.43 C ATOM 151 O GLN A 29 5.624 9.444 -1.244 1.00 0.41 O ATOM 152 CB GLN A 29 8.538 9.242 -2.629 1.00 0.55 C ATOM 153 CG GLN A 29 9.558 10.117 -3.359 1.00 0.70 C ATOM 154 CD GLN A 29 8.824 11.115 -4.257 1.00 0.59 C ATOM 155 OE1 GLN A 29 8.167 10.731 -5.203 1.00 1.27 O ATOM 156 NE2 GLN A 29 8.909 12.393 -3.999 1.00 1.18 N ATOM 0 H GLN A 29 9.863 9.767 -0.581 1.00 0.58 H new ATOM 0 HA GLN A 29 7.584 10.992 -1.833 1.00 0.47 H new ATOM 0 HB2 GLN A 29 9.017 8.334 -2.262 1.00 0.55 H new ATOM 0 HB3 GLN A 29 7.751 8.931 -3.316 1.00 0.55 H new ATOM 0 HG2 GLN A 29 10.179 10.649 -2.638 1.00 0.70 H new ATOM 0 HG3 GLN A 29 10.225 9.495 -3.957 1.00 0.70 H new ATOM 0 HE21 GLN A 29 9.461 12.717 -3.205 1.00 1.18 H new ATOM 0 HE22 GLN A 29 8.424 13.066 -4.592 1.00 1.18 H new ATOM 165 N ILE A 30 7.015 8.418 0.115 1.00 0.41 N ATOM 166 CA ILE A 30 5.881 7.679 0.739 1.00 0.37 C ATOM 167 C ILE A 30 5.090 8.664 1.589 1.00 0.33 C ATOM 168 O ILE A 30 3.901 8.522 1.771 1.00 0.21 O ATOM 169 CB ILE A 30 6.380 6.521 1.607 1.00 0.46 C ATOM 170 CG1 ILE A 30 7.105 5.502 0.719 1.00 0.69 C ATOM 171 CG2 ILE A 30 5.182 5.850 2.284 1.00 0.34 C ATOM 172 CD1 ILE A 30 7.458 4.252 1.532 1.00 0.55 C ATOM 0 H ILE A 30 7.939 8.213 0.495 1.00 0.41 H new ATOM 0 HA ILE A 30 5.253 7.252 -0.043 1.00 0.37 H new ATOM 0 HB ILE A 30 7.066 6.895 2.367 1.00 0.46 H new ATOM 0 HG12 ILE A 30 6.473 5.229 -0.126 1.00 0.69 H new ATOM 0 HG13 ILE A 30 8.012 5.946 0.308 1.00 0.69 H new ATOM 0 HG21 ILE A 30 5.530 5.024 2.904 1.00 0.34 H new ATOM 0 HG22 ILE A 30 4.662 6.577 2.907 1.00 0.34 H new ATOM 0 HG23 ILE A 30 4.500 5.470 1.523 1.00 0.34 H new ATOM 0 HD11 ILE A 30 7.972 3.535 0.892 1.00 0.55 H new ATOM 0 HD12 ILE A 30 8.108 4.529 2.362 1.00 0.55 H new ATOM 0 HD13 ILE A 30 6.545 3.801 1.921 1.00 0.55 H new ATOM 184 N ARG A 31 5.737 9.682 2.094 1.00 0.45 N ATOM 185 CA ARG A 31 5.008 10.692 2.907 1.00 0.46 C ATOM 186 C ARG A 31 3.848 11.228 2.063 1.00 0.34 C ATOM 187 O ARG A 31 2.790 11.561 2.563 1.00 0.29 O ATOM 188 CB ARG A 31 5.964 11.831 3.273 1.00 0.62 C ATOM 189 CG ARG A 31 5.284 12.761 4.276 1.00 0.73 C ATOM 190 CD ARG A 31 5.968 14.130 4.249 1.00 1.44 C ATOM 191 NE ARG A 31 5.309 15.034 5.234 1.00 1.11 N ATOM 192 CZ ARG A 31 5.941 15.384 6.321 1.00 1.01 C ATOM 193 NH1 ARG A 31 6.815 16.352 6.284 1.00 1.89 N ATOM 194 NH2 ARG A 31 5.695 14.767 7.446 1.00 1.23 N ATOM 0 H ARG A 31 6.735 9.855 1.977 1.00 0.45 H new ATOM 0 HA ARG A 31 4.626 10.248 3.826 1.00 0.46 H new ATOM 0 HB2 ARG A 31 6.882 11.427 3.699 1.00 0.62 H new ATOM 0 HB3 ARG A 31 6.245 12.386 2.378 1.00 0.62 H new ATOM 0 HG2 ARG A 31 4.227 12.866 4.032 1.00 0.73 H new ATOM 0 HG3 ARG A 31 5.339 12.335 5.278 1.00 0.73 H new ATOM 0 HD2 ARG A 31 7.026 14.024 4.487 1.00 1.44 H new ATOM 0 HD3 ARG A 31 5.908 14.559 3.249 1.00 1.44 H new ATOM 0 HE ARG A 31 4.365 15.379 5.059 1.00 1.11 H new ATOM 0 HH11 ARG A 31 7.004 16.835 5.406 1.00 1.89 H new ATOM 0 HH12 ARG A 31 7.309 16.626 7.133 1.00 1.89 H new ATOM 0 HH21 ARG A 31 5.009 14.012 7.474 1.00 1.23 H new ATOM 0 HH22 ARG A 31 6.189 15.040 8.296 1.00 1.23 H new ATOM 208 N TYR A 32 4.041 11.273 0.771 1.00 0.33 N ATOM 209 CA TYR A 32 2.965 11.742 -0.140 1.00 0.26 C ATOM 210 C TYR A 32 1.970 10.600 -0.316 1.00 0.19 C ATOM 211 O TYR A 32 0.773 10.800 -0.387 1.00 0.15 O ATOM 212 CB TYR A 32 3.571 12.098 -1.499 1.00 0.35 C ATOM 213 CG TYR A 32 3.256 13.534 -1.842 1.00 0.21 C ATOM 214 CD1 TYR A 32 3.633 14.560 -0.968 1.00 1.57 C ATOM 215 CD2 TYR A 32 2.591 13.839 -3.035 1.00 1.06 C ATOM 216 CE1 TYR A 32 3.343 15.891 -1.287 1.00 1.92 C ATOM 217 CE2 TYR A 32 2.303 15.170 -3.355 1.00 0.74 C ATOM 218 CZ TYR A 32 2.679 16.197 -2.482 1.00 0.83 C ATOM 219 OH TYR A 32 2.396 17.510 -2.797 1.00 1.18 O ATOM 0 H TYR A 32 4.908 11.001 0.307 1.00 0.33 H new ATOM 0 HA TYR A 32 2.471 12.621 0.273 1.00 0.26 H new ATOM 0 HB2 TYR A 32 4.651 11.949 -1.476 1.00 0.35 H new ATOM 0 HB3 TYR A 32 3.174 11.436 -2.269 1.00 0.35 H new ATOM 0 HD1 TYR A 32 4.147 14.324 -0.048 1.00 1.57 H new ATOM 0 HD2 TYR A 32 2.300 13.047 -3.709 1.00 1.06 H new ATOM 0 HE1 TYR A 32 3.631 16.683 -0.612 1.00 1.92 H new ATOM 0 HE2 TYR A 32 1.790 15.405 -4.276 1.00 0.74 H new ATOM 0 HH TYR A 32 1.934 17.547 -3.660 1.00 1.18 H new ATOM 229 N ILE A 33 2.468 9.394 -0.385 1.00 0.22 N ATOM 230 CA ILE A 33 1.570 8.219 -0.554 1.00 0.19 C ATOM 231 C ILE A 33 0.488 8.234 0.532 1.00 0.18 C ATOM 232 O ILE A 33 -0.669 7.975 0.268 1.00 0.23 O ATOM 233 CB ILE A 33 2.394 6.932 -0.443 1.00 0.20 C ATOM 234 CG1 ILE A 33 3.411 6.886 -1.585 1.00 0.26 C ATOM 235 CG2 ILE A 33 1.469 5.717 -0.544 1.00 0.19 C ATOM 236 CD1 ILE A 33 4.240 5.605 -1.479 1.00 0.27 C ATOM 0 H ILE A 33 3.462 9.173 -0.331 1.00 0.22 H new ATOM 0 HA ILE A 33 1.093 8.264 -1.533 1.00 0.19 H new ATOM 0 HB ILE A 33 2.912 6.915 0.516 1.00 0.20 H new ATOM 0 HG12 ILE A 33 2.897 6.921 -2.546 1.00 0.26 H new ATOM 0 HG13 ILE A 33 4.063 7.758 -1.541 1.00 0.26 H new ATOM 0 HG21 ILE A 33 2.058 4.803 -0.465 1.00 0.19 H new ATOM 0 HG22 ILE A 33 0.738 5.748 0.264 1.00 0.19 H new ATOM 0 HG23 ILE A 33 0.951 5.733 -1.503 1.00 0.19 H new ATOM 0 HD11 ILE A 33 4.965 5.572 -2.293 1.00 0.27 H new ATOM 0 HD12 ILE A 33 4.766 5.590 -0.524 1.00 0.27 H new ATOM 0 HD13 ILE A 33 3.581 4.739 -1.545 1.00 0.27 H new ATOM 248 N LEU A 34 0.853 8.532 1.749 1.00 0.18 N ATOM 249 CA LEU A 34 -0.152 8.558 2.848 1.00 0.19 C ATOM 250 C LEU A 34 -1.031 9.802 2.716 1.00 0.16 C ATOM 251 O LEU A 34 -2.235 9.737 2.867 1.00 0.16 O ATOM 252 CB LEU A 34 0.570 8.583 4.197 1.00 0.23 C ATOM 253 CG LEU A 34 0.402 7.232 4.894 1.00 0.08 C ATOM 254 CD1 LEU A 34 1.612 6.346 4.591 1.00 0.21 C ATOM 255 CD2 LEU A 34 0.296 7.449 6.405 1.00 0.11 C ATOM 0 H LEU A 34 1.807 8.759 2.030 1.00 0.18 H new ATOM 0 HA LEU A 34 -0.778 7.668 2.785 1.00 0.19 H new ATOM 0 HB2 LEU A 34 1.628 8.799 4.050 1.00 0.23 H new ATOM 0 HB3 LEU A 34 0.166 9.379 4.822 1.00 0.23 H new ATOM 0 HG LEU A 34 -0.504 6.746 4.531 1.00 0.08 H new ATOM 0 HD11 LEU A 34 1.492 5.383 5.088 1.00 0.21 H new ATOM 0 HD12 LEU A 34 1.689 6.192 3.515 1.00 0.21 H new ATOM 0 HD13 LEU A 34 2.518 6.831 4.954 1.00 0.21 H new ATOM 0 HD21 LEU A 34 0.176 6.487 6.903 1.00 0.11 H new ATOM 0 HD22 LEU A 34 1.202 7.935 6.767 1.00 0.11 H new ATOM 0 HD23 LEU A 34 -0.566 8.080 6.622 1.00 0.11 H new ATOM 267 N ASP A 35 -0.448 10.939 2.425 1.00 0.13 N ATOM 268 CA ASP A 35 -1.269 12.177 2.275 1.00 0.10 C ATOM 269 C ASP A 35 -2.385 11.902 1.271 1.00 0.09 C ATOM 270 O ASP A 35 -3.453 12.479 1.332 1.00 0.09 O ATOM 271 CB ASP A 35 -0.391 13.325 1.770 1.00 0.07 C ATOM 272 CG ASP A 35 0.075 14.172 2.956 1.00 0.76 C ATOM 273 OD1 ASP A 35 0.237 13.615 4.030 1.00 1.73 O ATOM 274 OD2 ASP A 35 0.259 15.364 2.771 1.00 0.46 O ATOM 0 H ASP A 35 0.555 11.062 2.286 1.00 0.13 H new ATOM 0 HA ASP A 35 -1.695 12.459 3.238 1.00 0.10 H new ATOM 0 HB2 ASP A 35 0.470 12.929 1.232 1.00 0.07 H new ATOM 0 HB3 ASP A 35 -0.950 13.942 1.066 1.00 0.07 H new ATOM 279 N GLY A 36 -2.148 10.999 0.361 1.00 0.09 N ATOM 280 CA GLY A 36 -3.191 10.653 -0.635 1.00 0.10 C ATOM 281 C GLY A 36 -4.230 9.766 0.050 1.00 0.11 C ATOM 282 O GLY A 36 -5.416 9.981 -0.059 1.00 0.13 O ATOM 0 H GLY A 36 -1.272 10.485 0.267 1.00 0.09 H new ATOM 0 HA2 GLY A 36 -3.660 11.557 -1.024 1.00 0.10 H new ATOM 0 HA3 GLY A 36 -2.748 10.133 -1.484 1.00 0.10 H new ATOM 286 N ILE A 37 -3.779 8.768 0.761 1.00 0.12 N ATOM 287 CA ILE A 37 -4.719 7.850 1.466 1.00 0.14 C ATOM 288 C ILE A 37 -5.679 8.650 2.353 1.00 0.12 C ATOM 289 O ILE A 37 -6.767 8.200 2.660 1.00 0.11 O ATOM 290 CB ILE A 37 -3.923 6.878 2.337 1.00 0.15 C ATOM 291 CG1 ILE A 37 -2.965 6.073 1.454 1.00 0.14 C ATOM 292 CG2 ILE A 37 -4.892 5.926 3.049 1.00 0.21 C ATOM 293 CD1 ILE A 37 -3.763 5.225 0.464 1.00 0.22 C ATOM 0 H ILE A 37 -2.791 8.548 0.884 1.00 0.12 H new ATOM 0 HA ILE A 37 -5.296 7.298 0.723 1.00 0.14 H new ATOM 0 HB ILE A 37 -3.350 7.433 3.079 1.00 0.15 H new ATOM 0 HG12 ILE A 37 -2.299 6.747 0.915 1.00 0.14 H new ATOM 0 HG13 ILE A 37 -2.337 5.432 2.073 1.00 0.14 H new ATOM 0 HG21 ILE A 37 -4.328 5.231 3.671 1.00 0.21 H new ATOM 0 HG22 ILE A 37 -5.574 6.502 3.675 1.00 0.21 H new ATOM 0 HG23 ILE A 37 -5.464 5.367 2.308 1.00 0.21 H new ATOM 0 HD11 ILE A 37 -3.077 4.654 -0.162 1.00 0.22 H new ATOM 0 HD12 ILE A 37 -4.410 4.540 1.011 1.00 0.22 H new ATOM 0 HD13 ILE A 37 -4.372 5.875 -0.164 1.00 0.22 H new ATOM 305 N SER A 38 -5.306 9.834 2.756 1.00 0.12 N ATOM 306 CA SER A 38 -6.220 10.642 3.602 1.00 0.12 C ATOM 307 C SER A 38 -7.428 10.988 2.751 1.00 0.11 C ATOM 308 O SER A 38 -8.566 10.839 3.157 1.00 0.13 O ATOM 309 CB SER A 38 -5.509 11.920 4.057 1.00 0.12 C ATOM 310 OG SER A 38 -6.466 12.955 4.250 1.00 1.37 O ATOM 0 H SER A 38 -4.412 10.272 2.536 1.00 0.12 H new ATOM 0 HA SER A 38 -6.523 10.089 4.491 1.00 0.12 H new ATOM 0 HB2 SER A 38 -4.966 11.736 4.984 1.00 0.12 H new ATOM 0 HB3 SER A 38 -4.774 12.225 3.312 1.00 0.12 H new ATOM 0 HG SER A 38 -6.010 13.772 4.543 1.00 1.37 H new ATOM 316 N ALA A 39 -7.180 11.418 1.550 1.00 0.10 N ATOM 317 CA ALA A 39 -8.298 11.743 0.645 1.00 0.11 C ATOM 318 C ALA A 39 -8.905 10.438 0.126 1.00 0.16 C ATOM 319 O ALA A 39 -9.989 10.423 -0.420 1.00 0.17 O ATOM 320 CB ALA A 39 -7.788 12.575 -0.534 1.00 0.12 C ATOM 0 H ALA A 39 -6.248 11.557 1.160 1.00 0.10 H new ATOM 0 HA ALA A 39 -9.052 12.318 1.183 1.00 0.11 H new ATOM 0 HB1 ALA A 39 -8.619 12.812 -1.199 1.00 0.12 H new ATOM 0 HB2 ALA A 39 -7.346 13.499 -0.163 1.00 0.12 H new ATOM 0 HB3 ALA A 39 -7.036 12.007 -1.082 1.00 0.12 H new ATOM 326 N LEU A 40 -8.211 9.338 0.291 1.00 0.18 N ATOM 327 CA LEU A 40 -8.751 8.044 -0.197 1.00 0.23 C ATOM 328 C LEU A 40 -9.386 7.265 0.956 1.00 0.26 C ATOM 329 O LEU A 40 -9.865 6.165 0.774 1.00 0.38 O ATOM 330 CB LEU A 40 -7.630 7.214 -0.820 1.00 0.20 C ATOM 331 CG LEU A 40 -6.859 8.069 -1.823 1.00 0.18 C ATOM 332 CD1 LEU A 40 -5.463 7.483 -2.030 1.00 0.47 C ATOM 333 CD2 LEU A 40 -7.607 8.083 -3.153 1.00 0.39 C ATOM 0 H LEU A 40 -7.297 9.287 0.742 1.00 0.18 H new ATOM 0 HA LEU A 40 -9.513 8.246 -0.950 1.00 0.23 H new ATOM 0 HB2 LEU A 40 -6.957 6.851 -0.043 1.00 0.20 H new ATOM 0 HB3 LEU A 40 -8.045 6.337 -1.317 1.00 0.20 H new ATOM 0 HG LEU A 40 -6.770 9.086 -1.442 1.00 0.18 H new ATOM 0 HD11 LEU A 40 -4.914 8.095 -2.746 1.00 0.47 H new ATOM 0 HD12 LEU A 40 -4.929 7.470 -1.080 1.00 0.47 H new ATOM 0 HD13 LEU A 40 -5.548 6.466 -2.412 1.00 0.47 H new ATOM 0 HD21 LEU A 40 -7.060 8.693 -3.872 1.00 0.39 H new ATOM 0 HD22 LEU A 40 -7.694 7.065 -3.532 1.00 0.39 H new ATOM 0 HD23 LEU A 40 -8.603 8.502 -3.006 1.00 0.39 H new ATOM 345 N ARG A 41 -9.404 7.815 2.138 1.00 0.20 N ATOM 346 CA ARG A 41 -10.032 7.090 3.276 1.00 0.22 C ATOM 347 C ARG A 41 -11.017 8.012 4.004 1.00 0.17 C ATOM 348 O ARG A 41 -11.706 7.594 4.913 1.00 0.17 O ATOM 349 CB ARG A 41 -8.959 6.617 4.253 1.00 0.29 C ATOM 350 CG ARG A 41 -9.555 5.542 5.166 1.00 0.33 C ATOM 351 CD ARG A 41 -8.542 5.164 6.248 1.00 0.59 C ATOM 352 NE ARG A 41 -9.228 5.102 7.569 1.00 0.76 N ATOM 353 CZ ARG A 41 -9.136 4.026 8.304 1.00 1.14 C ATOM 354 NH1 ARG A 41 -7.969 3.621 8.724 1.00 1.64 N ATOM 355 NH2 ARG A 41 -10.212 3.358 8.619 1.00 2.39 N ATOM 0 H ARG A 41 -9.013 8.730 2.364 1.00 0.20 H new ATOM 0 HA ARG A 41 -10.568 6.225 2.887 1.00 0.22 H new ATOM 0 HB2 ARG A 41 -8.104 6.217 3.708 1.00 0.29 H new ATOM 0 HB3 ARG A 41 -8.594 7.455 4.847 1.00 0.29 H new ATOM 0 HG2 ARG A 41 -10.472 5.910 5.626 1.00 0.33 H new ATOM 0 HG3 ARG A 41 -9.822 4.662 4.581 1.00 0.33 H new ATOM 0 HD2 ARG A 41 -8.088 4.200 6.016 1.00 0.59 H new ATOM 0 HD3 ARG A 41 -7.736 5.897 6.279 1.00 0.59 H new ATOM 0 HE ARG A 41 -9.770 5.900 7.900 1.00 0.76 H new ATOM 0 HH11 ARG A 41 -7.129 4.145 8.478 1.00 1.64 H new ATOM 0 HH12 ARG A 41 -7.897 2.781 9.298 1.00 1.64 H new ATOM 0 HH21 ARG A 41 -11.124 3.676 8.291 1.00 2.39 H new ATOM 0 HH22 ARG A 41 -10.141 2.518 9.193 1.00 2.39 H new ATOM 369 N LYS A 42 -11.108 9.257 3.608 1.00 0.14 N ATOM 370 CA LYS A 42 -12.061 10.177 4.275 1.00 0.12 C ATOM 371 C LYS A 42 -13.441 9.965 3.661 1.00 0.07 C ATOM 372 O LYS A 42 -14.434 9.833 4.352 1.00 0.17 O ATOM 373 CB LYS A 42 -11.617 11.622 4.038 1.00 0.12 C ATOM 374 CG LYS A 42 -12.595 12.579 4.724 1.00 0.67 C ATOM 375 CD LYS A 42 -12.860 13.778 3.812 1.00 1.61 C ATOM 376 CE LYS A 42 -13.433 14.932 4.637 1.00 2.09 C ATOM 377 NZ LYS A 42 -14.422 15.688 3.818 1.00 3.50 N ATOM 0 H LYS A 42 -10.562 9.670 2.852 1.00 0.14 H new ATOM 0 HA LYS A 42 -12.091 9.980 5.347 1.00 0.12 H new ATOM 0 HB2 LYS A 42 -10.611 11.773 4.429 1.00 0.12 H new ATOM 0 HB3 LYS A 42 -11.578 11.830 2.969 1.00 0.12 H new ATOM 0 HG2 LYS A 42 -13.530 12.064 4.946 1.00 0.67 H new ATOM 0 HG3 LYS A 42 -12.184 12.916 5.675 1.00 0.67 H new ATOM 0 HD2 LYS A 42 -11.936 14.089 3.325 1.00 1.61 H new ATOM 0 HD3 LYS A 42 -13.558 13.500 3.022 1.00 1.61 H new ATOM 0 HE2 LYS A 42 -13.910 14.547 5.538 1.00 2.09 H new ATOM 0 HE3 LYS A 42 -12.631 15.595 4.960 1.00 2.09 H new ATOM 0 HZ1 LYS A 42 -14.811 16.472 4.380 1.00 3.50 H new ATOM 0 HZ2 LYS A 42 -13.953 16.068 2.971 1.00 3.50 H new ATOM 0 HZ3 LYS A 42 -15.193 15.052 3.531 1.00 3.50 H new ATOM 391 N GLU A 43 -13.504 9.918 2.359 1.00 0.08 N ATOM 392 CA GLU A 43 -14.805 9.704 1.685 1.00 0.14 C ATOM 393 C GLU A 43 -15.159 8.225 1.773 1.00 0.14 C ATOM 394 O GLU A 43 -16.304 7.854 1.965 1.00 0.35 O ATOM 395 CB GLU A 43 -14.692 10.120 0.217 1.00 0.19 C ATOM 396 CG GLU A 43 -16.090 10.241 -0.391 1.00 0.70 C ATOM 397 CD GLU A 43 -16.271 9.168 -1.464 1.00 1.97 C ATOM 398 OE1 GLU A 43 -16.459 8.018 -1.101 1.00 2.97 O ATOM 399 OE2 GLU A 43 -16.220 9.512 -2.634 1.00 2.34 O ATOM 0 H GLU A 43 -12.704 10.020 1.734 1.00 0.08 H new ATOM 0 HA GLU A 43 -15.580 10.301 2.166 1.00 0.14 H new ATOM 0 HB2 GLU A 43 -14.166 11.072 0.138 1.00 0.19 H new ATOM 0 HB3 GLU A 43 -14.106 9.385 -0.336 1.00 0.19 H new ATOM 0 HG2 GLU A 43 -16.847 10.127 0.385 1.00 0.70 H new ATOM 0 HG3 GLU A 43 -16.225 11.232 -0.825 1.00 0.70 H new ATOM 406 N THR A 44 -14.179 7.373 1.643 1.00 0.24 N ATOM 407 CA THR A 44 -14.458 5.919 1.725 1.00 0.29 C ATOM 408 C THR A 44 -14.908 5.592 3.148 1.00 0.66 C ATOM 409 O THR A 44 -15.995 5.116 3.352 1.00 2.25 O ATOM 410 CB THR A 44 -13.213 5.094 1.356 1.00 1.07 C ATOM 411 OG1 THR A 44 -12.374 4.949 2.490 1.00 2.83 O ATOM 412 CG2 THR A 44 -12.439 5.779 0.233 1.00 0.67 C ATOM 0 H THR A 44 -13.203 7.623 1.484 1.00 0.24 H new ATOM 0 HA THR A 44 -15.243 5.662 1.014 1.00 0.29 H new ATOM 0 HB THR A 44 -13.536 4.110 1.017 1.00 1.07 H new ATOM 0 HG1 THR A 44 -12.011 4.039 2.514 1.00 2.83 H new ATOM 0 HG21 THR A 44 -11.560 5.185 -0.018 1.00 0.67 H new ATOM 0 HG22 THR A 44 -13.078 5.872 -0.645 1.00 0.67 H new ATOM 0 HG23 THR A 44 -12.125 6.770 0.560 1.00 0.67 H new ATOM 420 N CYS A 45 -14.089 5.868 4.135 1.00 0.66 N ATOM 421 CA CYS A 45 -14.481 5.590 5.555 1.00 0.35 C ATOM 422 C CYS A 45 -15.897 6.122 5.803 1.00 0.56 C ATOM 423 O CYS A 45 -16.709 5.471 6.428 1.00 0.83 O ATOM 424 CB CYS A 45 -13.491 6.278 6.504 1.00 1.11 C ATOM 425 SG CYS A 45 -13.984 6.004 8.230 1.00 2.52 S ATOM 0 H CYS A 45 -13.161 6.276 4.018 1.00 0.66 H new ATOM 0 HA CYS A 45 -14.462 4.516 5.738 1.00 0.35 H new ATOM 0 HB2 CYS A 45 -12.487 5.888 6.339 1.00 1.11 H new ATOM 0 HB3 CYS A 45 -13.457 7.347 6.293 1.00 1.11 H new ATOM 430 N ASN A 46 -16.217 7.286 5.293 1.00 0.93 N ATOM 431 CA ASN A 46 -17.600 7.819 5.486 1.00 1.71 C ATOM 432 C ASN A 46 -18.588 6.746 5.018 1.00 1.83 C ATOM 433 O ASN A 46 -19.147 6.014 5.809 1.00 1.98 O ATOM 434 CB ASN A 46 -17.782 9.093 4.654 1.00 2.54 C ATOM 435 CG ASN A 46 -18.115 10.266 5.579 1.00 2.73 C ATOM 436 OD1 ASN A 46 -18.859 10.114 6.529 1.00 2.91 O ATOM 437 ND2 ASN A 46 -17.593 11.439 5.341 1.00 2.94 N ATOM 0 H ASN A 46 -15.588 7.884 4.757 1.00 0.93 H new ATOM 0 HA ASN A 46 -17.773 8.061 6.535 1.00 1.71 H new ATOM 0 HB2 ASN A 46 -16.872 9.306 4.093 1.00 2.54 H new ATOM 0 HB3 ASN A 46 -18.581 8.953 3.926 1.00 2.54 H new ATOM 0 HD21 ASN A 46 -17.809 12.227 5.952 1.00 2.94 H new ATOM 0 HD22 ASN A 46 -16.969 11.567 4.544 1.00 2.94 H new ATOM 444 N LYS A 47 -18.772 6.622 3.731 1.00 1.99 N ATOM 445 CA LYS A 47 -19.681 5.565 3.207 1.00 2.49 C ATOM 446 C LYS A 47 -18.836 4.315 2.935 1.00 2.33 C ATOM 447 O LYS A 47 -18.870 3.745 1.862 1.00 3.00 O ATOM 448 CB LYS A 47 -20.336 6.049 1.910 1.00 2.96 C ATOM 449 CG LYS A 47 -21.855 6.116 2.093 1.00 3.82 C ATOM 450 CD LYS A 47 -22.427 4.698 2.145 1.00 5.52 C ATOM 451 CE LYS A 47 -23.021 4.439 3.531 1.00 6.06 C ATOM 452 NZ LYS A 47 -24.029 3.344 3.444 1.00 7.77 N ATOM 0 H LYS A 47 -18.332 7.207 3.021 1.00 1.99 H new ATOM 0 HA LYS A 47 -20.467 5.340 3.927 1.00 2.49 H new ATOM 0 HB2 LYS A 47 -19.949 7.032 1.640 1.00 2.96 H new ATOM 0 HB3 LYS A 47 -20.088 5.373 1.092 1.00 2.96 H new ATOM 0 HG2 LYS A 47 -22.098 6.651 3.011 1.00 3.82 H new ATOM 0 HG3 LYS A 47 -22.307 6.672 1.271 1.00 3.82 H new ATOM 0 HD2 LYS A 47 -23.194 4.575 1.380 1.00 5.52 H new ATOM 0 HD3 LYS A 47 -21.644 3.970 1.931 1.00 5.52 H new ATOM 0 HE2 LYS A 47 -22.232 4.166 4.231 1.00 6.06 H new ATOM 0 HE3 LYS A 47 -23.487 5.347 3.914 1.00 6.06 H new ATOM 0 HZ1 LYS A 47 -24.433 3.168 4.386 1.00 7.77 H new ATOM 0 HZ2 LYS A 47 -24.787 3.622 2.789 1.00 7.77 H new ATOM 0 HZ3 LYS A 47 -23.571 2.477 3.096 1.00 7.77 H new ATOM 466 N SER A 48 -18.047 3.912 3.894 1.00 1.71 N ATOM 467 CA SER A 48 -17.157 2.731 3.697 1.00 1.94 C ATOM 468 C SER A 48 -17.905 1.431 3.983 1.00 2.20 C ATOM 469 O SER A 48 -17.363 0.355 3.839 1.00 2.53 O ATOM 470 CB SER A 48 -15.975 2.828 4.665 1.00 1.86 C ATOM 471 OG SER A 48 -14.777 3.030 3.927 1.00 2.38 O ATOM 0 H SER A 48 -17.980 4.353 4.811 1.00 1.71 H new ATOM 0 HA SER A 48 -16.815 2.727 2.662 1.00 1.94 H new ATOM 0 HB2 SER A 48 -16.129 3.651 5.363 1.00 1.86 H new ATOM 0 HB3 SER A 48 -15.901 1.917 5.258 1.00 1.86 H new ATOM 0 HG SER A 48 -14.005 2.826 4.495 1.00 2.38 H new ATOM 477 N ASN A 49 -19.120 1.506 4.444 1.00 2.23 N ATOM 478 CA ASN A 49 -19.856 0.253 4.783 1.00 2.77 C ATOM 479 C ASN A 49 -19.027 -0.568 5.793 1.00 2.05 C ATOM 480 O ASN A 49 -19.304 -1.725 6.039 1.00 2.48 O ATOM 481 CB ASN A 49 -20.076 -0.569 3.511 1.00 3.77 C ATOM 482 CG ASN A 49 -20.957 0.220 2.540 1.00 4.65 C ATOM 483 OD1 ASN A 49 -20.716 1.385 2.293 1.00 4.89 O ATOM 484 ND2 ASN A 49 -21.973 -0.370 1.975 1.00 5.44 N ATOM 0 H ASN A 49 -19.635 2.373 4.601 1.00 2.23 H new ATOM 0 HA ASN A 49 -20.822 0.503 5.223 1.00 2.77 H new ATOM 0 HB2 ASN A 49 -19.118 -0.800 3.044 1.00 3.77 H new ATOM 0 HB3 ASN A 49 -20.548 -1.520 3.757 1.00 3.77 H new ATOM 0 HD21 ASN A 49 -22.566 0.146 1.325 1.00 5.44 H new ATOM 0 HD22 ASN A 49 -22.175 -1.348 2.183 1.00 5.44 H new ATOM 491 N MET A 50 -18.014 0.030 6.379 1.00 1.15 N ATOM 492 CA MET A 50 -17.165 -0.692 7.366 1.00 1.13 C ATOM 493 C MET A 50 -16.451 0.341 8.249 1.00 1.33 C ATOM 494 O MET A 50 -15.405 0.082 8.809 1.00 2.00 O ATOM 495 CB MET A 50 -16.121 -1.530 6.624 1.00 1.88 C ATOM 496 CG MET A 50 -16.764 -2.827 6.126 1.00 1.72 C ATOM 497 SD MET A 50 -17.185 -2.657 4.374 1.00 1.26 S ATOM 498 CE MET A 50 -18.629 -3.748 4.378 1.00 0.81 C ATOM 0 H MET A 50 -17.742 0.998 6.209 1.00 1.15 H new ATOM 0 HA MET A 50 -17.784 -1.347 7.980 1.00 1.13 H new ATOM 0 HB2 MET A 50 -15.718 -0.966 5.783 1.00 1.88 H new ATOM 0 HB3 MET A 50 -15.285 -1.757 7.286 1.00 1.88 H new ATOM 0 HG2 MET A 50 -16.079 -3.663 6.267 1.00 1.72 H new ATOM 0 HG3 MET A 50 -17.660 -3.048 6.707 1.00 1.72 H new ATOM 0 HE1 MET A 50 -19.425 -3.300 3.783 1.00 0.81 H new ATOM 0 HE2 MET A 50 -18.357 -4.714 3.952 1.00 0.81 H new ATOM 0 HE3 MET A 50 -18.977 -3.888 5.402 1.00 0.81 H new ATOM 508 N CYS A 51 -17.020 1.511 8.371 1.00 1.15 N ATOM 509 CA CYS A 51 -16.403 2.579 9.207 1.00 1.87 C ATOM 510 C CYS A 51 -17.461 3.076 10.191 1.00 2.32 C ATOM 511 O CYS A 51 -17.468 2.720 11.354 1.00 3.06 O ATOM 512 CB CYS A 51 -15.975 3.736 8.299 1.00 2.27 C ATOM 513 SG CYS A 51 -14.187 3.999 8.410 1.00 1.71 S ATOM 0 H CYS A 51 -17.897 1.774 7.921 1.00 1.15 H new ATOM 0 HA CYS A 51 -15.534 2.197 9.743 1.00 1.87 H new ATOM 0 HB2 CYS A 51 -16.254 3.519 7.268 1.00 2.27 H new ATOM 0 HB3 CYS A 51 -16.501 4.646 8.587 1.00 2.27 H new ATOM 518 N GLU A 52 -18.372 3.876 9.714 1.00 2.20 N ATOM 519 CA GLU A 52 -19.464 4.389 10.583 1.00 2.68 C ATOM 520 C GLU A 52 -20.801 3.923 10.000 1.00 2.72 C ATOM 521 O GLU A 52 -21.832 4.525 10.224 1.00 3.38 O ATOM 522 CB GLU A 52 -19.424 5.917 10.612 1.00 3.43 C ATOM 523 CG GLU A 52 -19.054 6.393 12.017 1.00 3.90 C ATOM 524 CD GLU A 52 -18.329 7.739 11.933 1.00 3.84 C ATOM 525 OE1 GLU A 52 -18.411 8.370 10.892 1.00 3.90 O ATOM 526 OE2 GLU A 52 -17.706 8.114 12.911 1.00 4.13 O ATOM 0 H GLU A 52 -18.406 4.200 8.747 1.00 2.20 H new ATOM 0 HA GLU A 52 -19.343 4.013 11.599 1.00 2.68 H new ATOM 0 HB2 GLU A 52 -18.697 6.286 9.889 1.00 3.43 H new ATOM 0 HB3 GLU A 52 -20.394 6.322 10.323 1.00 3.43 H new ATOM 0 HG2 GLU A 52 -19.952 6.491 12.626 1.00 3.90 H new ATOM 0 HG3 GLU A 52 -18.416 5.656 12.505 1.00 3.90 H new ATOM 533 N SER A 53 -20.783 2.856 9.241 1.00 2.45 N ATOM 534 CA SER A 53 -22.043 2.347 8.630 1.00 3.32 C ATOM 535 C SER A 53 -23.034 1.978 9.734 1.00 4.13 C ATOM 536 O SER A 53 -24.142 2.476 9.777 1.00 4.93 O ATOM 537 CB SER A 53 -21.733 1.109 7.787 1.00 3.46 C ATOM 538 OG SER A 53 -22.951 0.531 7.335 1.00 4.40 O ATOM 0 H SER A 53 -19.947 2.316 9.019 1.00 2.45 H new ATOM 0 HA SER A 53 -22.479 3.120 7.997 1.00 3.32 H new ATOM 0 HB2 SER A 53 -21.109 1.381 6.936 1.00 3.46 H new ATOM 0 HB3 SER A 53 -21.170 0.385 8.376 1.00 3.46 H new ATOM 0 HG SER A 53 -22.756 -0.262 6.793 1.00 4.40 H new ATOM 544 N SER A 54 -22.648 1.106 10.626 1.00 4.05 N ATOM 545 CA SER A 54 -23.572 0.706 11.723 1.00 4.81 C ATOM 546 C SER A 54 -22.763 0.264 12.943 1.00 4.18 C ATOM 547 O SER A 54 -23.217 -0.530 13.744 1.00 5.12 O ATOM 548 CB SER A 54 -24.454 -0.451 11.255 1.00 6.11 C ATOM 549 OG SER A 54 -23.893 -1.025 10.081 1.00 6.78 O ATOM 0 H SER A 54 -21.734 0.654 10.642 1.00 4.05 H new ATOM 0 HA SER A 54 -24.198 1.557 11.991 1.00 4.81 H new ATOM 0 HB2 SER A 54 -24.533 -1.204 12.040 1.00 6.11 H new ATOM 0 HB3 SER A 54 -25.464 -0.095 11.052 1.00 6.11 H new ATOM 0 HG SER A 54 -24.456 -1.768 9.779 1.00 6.78 H new ATOM 555 N LYS A 55 -21.569 0.771 13.094 1.00 2.69 N ATOM 556 CA LYS A 55 -20.736 0.380 14.267 1.00 2.29 C ATOM 557 C LYS A 55 -20.353 -1.098 14.158 1.00 2.70 C ATOM 558 O LYS A 55 -20.128 -1.763 15.149 1.00 3.29 O ATOM 559 CB LYS A 55 -21.531 0.610 15.556 1.00 2.97 C ATOM 560 CG LYS A 55 -20.925 1.781 16.331 1.00 3.47 C ATOM 561 CD LYS A 55 -21.084 3.068 15.517 1.00 3.12 C ATOM 562 CE LYS A 55 -22.572 3.387 15.352 1.00 2.74 C ATOM 563 NZ LYS A 55 -22.727 4.760 14.794 1.00 2.92 N ATOM 0 H LYS A 55 -21.135 1.438 12.456 1.00 2.69 H new ATOM 0 HA LYS A 55 -19.830 0.986 14.285 1.00 2.29 H new ATOM 0 HB2 LYS A 55 -22.574 0.819 15.319 1.00 2.97 H new ATOM 0 HB3 LYS A 55 -21.517 -0.291 16.169 1.00 2.97 H new ATOM 0 HG2 LYS A 55 -21.418 1.886 17.297 1.00 3.47 H new ATOM 0 HG3 LYS A 55 -19.870 1.592 16.531 1.00 3.47 H new ATOM 0 HD2 LYS A 55 -20.578 3.893 16.018 1.00 3.12 H new ATOM 0 HD3 LYS A 55 -20.615 2.953 14.540 1.00 3.12 H new ATOM 0 HE2 LYS A 55 -23.040 2.659 14.689 1.00 2.74 H new ATOM 0 HE3 LYS A 55 -23.079 3.315 16.314 1.00 2.74 H new ATOM 0 HZ1 LYS A 55 -23.738 4.977 14.682 1.00 2.92 H new ATOM 0 HZ2 LYS A 55 -22.295 5.449 15.442 1.00 2.92 H new ATOM 0 HZ3 LYS A 55 -22.257 4.814 13.868 1.00 2.92 H new ATOM 577 N GLU A 56 -20.277 -1.620 12.963 1.00 2.63 N ATOM 578 CA GLU A 56 -19.907 -3.059 12.805 1.00 3.15 C ATOM 579 C GLU A 56 -19.818 -3.417 11.327 1.00 3.42 C ATOM 580 O GLU A 56 -18.748 -3.488 10.756 1.00 3.57 O ATOM 581 CB GLU A 56 -20.955 -3.977 13.454 1.00 3.81 C ATOM 582 CG GLU A 56 -22.303 -3.256 13.585 1.00 3.96 C ATOM 583 CD GLU A 56 -23.422 -4.286 13.757 1.00 4.96 C ATOM 584 OE1 GLU A 56 -23.573 -5.120 12.880 1.00 5.58 O ATOM 585 OE2 GLU A 56 -24.109 -4.222 14.764 1.00 5.33 O ATOM 0 H GLU A 56 -20.454 -1.117 12.093 1.00 2.63 H new ATOM 0 HA GLU A 56 -18.944 -3.204 13.294 1.00 3.15 H new ATOM 0 HB2 GLU A 56 -21.077 -4.879 12.854 1.00 3.81 H new ATOM 0 HB3 GLU A 56 -20.609 -4.293 14.438 1.00 3.81 H new ATOM 0 HG2 GLU A 56 -22.283 -2.579 14.439 1.00 3.96 H new ATOM 0 HG3 GLU A 56 -22.489 -2.647 12.700 1.00 3.96 H new ATOM 592 N ALA A 57 -20.938 -3.680 10.709 1.00 4.01 N ATOM 593 CA ALA A 57 -20.930 -4.074 9.282 1.00 4.48 C ATOM 594 C ALA A 57 -20.369 -5.492 9.201 1.00 5.05 C ATOM 595 O ALA A 57 -19.183 -5.712 9.347 1.00 4.95 O ATOM 596 CB ALA A 57 -20.066 -3.105 8.468 1.00 4.03 C ATOM 0 H ALA A 57 -21.862 -3.637 11.140 1.00 4.01 H new ATOM 0 HA ALA A 57 -21.938 -4.041 8.869 1.00 4.48 H new ATOM 0 HB1 ALA A 57 -20.069 -3.407 7.421 1.00 4.03 H new ATOM 0 HB2 ALA A 57 -20.469 -2.096 8.556 1.00 4.03 H new ATOM 0 HB3 ALA A 57 -19.044 -3.122 8.847 1.00 4.03 H new ATOM 602 N LEU A 58 -21.220 -6.457 9.008 1.00 5.68 N ATOM 603 CA LEU A 58 -20.751 -7.867 8.959 1.00 6.26 C ATOM 604 C LEU A 58 -19.706 -8.029 7.858 1.00 5.90 C ATOM 605 O LEU A 58 -20.029 -8.233 6.704 1.00 6.37 O ATOM 606 CB LEU A 58 -21.941 -8.780 8.673 1.00 6.98 C ATOM 607 CG LEU A 58 -22.374 -9.477 9.963 1.00 7.02 C ATOM 608 CD1 LEU A 58 -23.887 -9.710 9.938 1.00 7.39 C ATOM 609 CD2 LEU A 58 -21.655 -10.823 10.082 1.00 7.48 C ATOM 0 H LEU A 58 -22.224 -6.330 8.882 1.00 5.68 H new ATOM 0 HA LEU A 58 -20.303 -8.134 9.916 1.00 6.26 H new ATOM 0 HB2 LEU A 58 -22.769 -8.199 8.266 1.00 6.98 H new ATOM 0 HB3 LEU A 58 -21.671 -9.521 7.920 1.00 6.98 H new ATOM 0 HG LEU A 58 -22.117 -8.849 10.816 1.00 7.02 H new ATOM 0 HD11 LEU A 58 -24.194 -10.207 10.858 1.00 7.39 H new ATOM 0 HD12 LEU A 58 -24.401 -8.753 9.854 1.00 7.39 H new ATOM 0 HD13 LEU A 58 -24.145 -10.337 9.084 1.00 7.39 H new ATOM 0 HD21 LEU A 58 -21.963 -11.320 11.002 1.00 7.48 H new ATOM 0 HD22 LEU A 58 -21.911 -11.449 9.227 1.00 7.48 H new ATOM 0 HD23 LEU A 58 -20.578 -10.659 10.102 1.00 7.48 H new ATOM 621 N ALA A 59 -18.452 -7.942 8.208 1.00 5.10 N ATOM 622 CA ALA A 59 -17.383 -8.096 7.182 1.00 4.73 C ATOM 623 C ALA A 59 -16.116 -8.653 7.837 1.00 3.81 C ATOM 624 O ALA A 59 -15.365 -7.936 8.468 1.00 3.32 O ATOM 625 CB ALA A 59 -17.078 -6.735 6.554 1.00 4.87 C ATOM 0 H ALA A 59 -18.122 -7.771 9.158 1.00 5.10 H new ATOM 0 HA ALA A 59 -17.722 -8.785 6.409 1.00 4.73 H new ATOM 0 HB1 ALA A 59 -16.296 -6.848 5.803 1.00 4.87 H new ATOM 0 HB2 ALA A 59 -17.979 -6.341 6.083 1.00 4.87 H new ATOM 0 HB3 ALA A 59 -16.742 -6.045 7.327 1.00 4.87 H new ATOM 631 N GLU A 60 -15.874 -9.929 7.693 1.00 3.67 N ATOM 632 CA GLU A 60 -14.659 -10.532 8.305 1.00 2.87 C ATOM 633 C GLU A 60 -13.890 -11.317 7.240 1.00 2.69 C ATOM 634 O GLU A 60 -13.386 -12.394 7.490 1.00 2.67 O ATOM 635 CB GLU A 60 -15.085 -11.477 9.430 1.00 3.09 C ATOM 636 CG GLU A 60 -13.960 -11.586 10.459 1.00 2.46 C ATOM 637 CD GLU A 60 -14.281 -12.704 11.452 1.00 2.80 C ATOM 638 OE1 GLU A 60 -14.971 -13.634 11.066 1.00 3.44 O ATOM 639 OE2 GLU A 60 -13.833 -12.611 12.583 1.00 2.74 O ATOM 0 H GLU A 60 -16.467 -10.579 7.177 1.00 3.67 H new ATOM 0 HA GLU A 60 -14.018 -9.747 8.707 1.00 2.87 H new ATOM 0 HB2 GLU A 60 -15.993 -11.106 9.906 1.00 3.09 H new ATOM 0 HB3 GLU A 60 -15.317 -12.461 9.024 1.00 3.09 H new ATOM 0 HG2 GLU A 60 -13.014 -11.791 9.958 1.00 2.46 H new ATOM 0 HG3 GLU A 60 -13.843 -10.639 10.987 1.00 2.46 H new ATOM 646 N ASN A 61 -13.801 -10.787 6.049 1.00 2.60 N ATOM 647 CA ASN A 61 -13.073 -11.501 4.961 1.00 2.46 C ATOM 648 C ASN A 61 -11.563 -11.411 5.198 1.00 2.11 C ATOM 649 O ASN A 61 -10.901 -12.407 5.411 1.00 2.41 O ATOM 650 CB ASN A 61 -13.418 -10.852 3.616 1.00 2.38 C ATOM 651 CG ASN A 61 -12.603 -11.510 2.498 1.00 2.94 C ATOM 652 OD1 ASN A 61 -13.016 -12.503 1.931 1.00 3.70 O ATOM 653 ND2 ASN A 61 -11.454 -10.993 2.155 1.00 3.33 N ATOM 0 H ASN A 61 -14.202 -9.888 5.783 1.00 2.60 H new ATOM 0 HA ASN A 61 -13.371 -12.550 4.953 1.00 2.46 H new ATOM 0 HB2 ASN A 61 -14.484 -10.959 3.413 1.00 2.38 H new ATOM 0 HB3 ASN A 61 -13.206 -9.783 3.652 1.00 2.38 H new ATOM 0 HD21 ASN A 61 -10.903 -11.422 1.412 1.00 3.33 H new ATOM 0 HD22 ASN A 61 -11.107 -10.160 2.631 1.00 3.33 H new ATOM 660 N ASN A 62 -11.015 -10.223 5.149 1.00 1.61 N ATOM 661 CA ASN A 62 -9.544 -10.053 5.357 1.00 1.30 C ATOM 662 C ASN A 62 -8.802 -10.510 4.101 1.00 1.25 C ATOM 663 O ASN A 62 -8.622 -11.689 3.866 1.00 1.72 O ATOM 664 CB ASN A 62 -9.068 -10.879 6.563 1.00 1.42 C ATOM 665 CG ASN A 62 -10.110 -10.814 7.683 1.00 2.11 C ATOM 666 OD1 ASN A 62 -10.510 -11.829 8.217 1.00 3.35 O ATOM 667 ND2 ASN A 62 -10.569 -9.653 8.063 1.00 1.94 N ATOM 0 H ASN A 62 -11.526 -9.358 4.973 1.00 1.61 H new ATOM 0 HA ASN A 62 -9.335 -9.001 5.552 1.00 1.30 H new ATOM 0 HB2 ASN A 62 -8.906 -11.915 6.264 1.00 1.42 H new ATOM 0 HB3 ASN A 62 -8.112 -10.498 6.921 1.00 1.42 H new ATOM 0 HD21 ASN A 62 -11.263 -9.598 8.808 1.00 1.94 H new ATOM 0 HD22 ASN A 62 -10.233 -8.800 7.615 1.00 1.94 H new ATOM 674 N LEU A 63 -8.375 -9.583 3.289 1.00 0.73 N ATOM 675 CA LEU A 63 -7.649 -9.951 2.042 1.00 0.77 C ATOM 676 C LEU A 63 -6.354 -10.684 2.402 1.00 0.76 C ATOM 677 O LEU A 63 -6.161 -11.103 3.526 1.00 0.68 O ATOM 678 CB LEU A 63 -7.322 -8.678 1.260 1.00 0.72 C ATOM 679 CG LEU A 63 -8.340 -8.500 0.136 1.00 1.28 C ATOM 680 CD1 LEU A 63 -8.300 -7.055 -0.363 1.00 1.15 C ATOM 681 CD2 LEU A 63 -7.999 -9.448 -1.016 1.00 1.84 C ATOM 0 H LEU A 63 -8.499 -8.581 3.437 1.00 0.73 H new ATOM 0 HA LEU A 63 -8.272 -10.605 1.431 1.00 0.77 H new ATOM 0 HB2 LEU A 63 -7.342 -7.814 1.924 1.00 0.72 H new ATOM 0 HB3 LEU A 63 -6.315 -8.740 0.848 1.00 0.72 H new ATOM 0 HG LEU A 63 -9.338 -8.728 0.510 1.00 1.28 H new ATOM 0 HD11 LEU A 63 -9.026 -6.927 -1.165 1.00 1.15 H new ATOM 0 HD12 LEU A 63 -8.543 -6.380 0.458 1.00 1.15 H new ATOM 0 HD13 LEU A 63 -7.302 -6.827 -0.737 1.00 1.15 H new ATOM 0 HD21 LEU A 63 -8.725 -9.321 -1.819 1.00 1.84 H new ATOM 0 HD22 LEU A 63 -7.001 -9.221 -1.391 1.00 1.84 H new ATOM 0 HD23 LEU A 63 -8.027 -10.478 -0.660 1.00 1.84 H new ATOM 693 N ASN A 64 -5.460 -10.841 1.461 1.00 0.91 N ATOM 694 CA ASN A 64 -4.184 -11.544 1.767 1.00 1.01 C ATOM 695 C ASN A 64 -3.021 -10.680 1.293 1.00 0.92 C ATOM 696 O ASN A 64 -1.985 -11.169 0.891 1.00 1.25 O ATOM 697 CB ASN A 64 -4.154 -12.894 1.048 1.00 1.33 C ATOM 698 CG ASN A 64 -4.418 -12.686 -0.444 1.00 0.73 C ATOM 699 OD1 ASN A 64 -3.891 -11.770 -1.043 1.00 2.03 O ATOM 700 ND2 ASN A 64 -5.216 -13.504 -1.074 1.00 0.43 N ATOM 0 H ASN A 64 -5.559 -10.514 0.500 1.00 0.91 H new ATOM 0 HA ASN A 64 -4.103 -11.714 2.841 1.00 1.01 H new ATOM 0 HB2 ASN A 64 -3.186 -13.373 1.193 1.00 1.33 H new ATOM 0 HB3 ASN A 64 -4.906 -13.560 1.471 1.00 1.33 H new ATOM 0 HD21 ASN A 64 -5.397 -13.374 -2.069 1.00 0.43 H new ATOM 0 HD22 ASN A 64 -5.659 -14.273 -0.571 1.00 0.43 H new ATOM 707 N LEU A 65 -3.199 -9.393 1.333 1.00 0.47 N ATOM 708 CA LEU A 65 -2.125 -8.472 0.887 1.00 0.32 C ATOM 709 C LEU A 65 -1.150 -8.067 2.029 1.00 0.26 C ATOM 710 O LEU A 65 -0.064 -7.614 1.727 1.00 0.79 O ATOM 711 CB LEU A 65 -2.773 -7.218 0.284 1.00 0.33 C ATOM 712 CG LEU A 65 -3.375 -6.340 1.386 1.00 0.24 C ATOM 713 CD1 LEU A 65 -2.803 -4.933 1.279 1.00 0.24 C ATOM 714 CD2 LEU A 65 -4.892 -6.277 1.221 1.00 0.28 C ATOM 0 H LEU A 65 -4.051 -8.936 1.659 1.00 0.47 H new ATOM 0 HA LEU A 65 -1.525 -8.999 0.145 1.00 0.32 H new ATOM 0 HB2 LEU A 65 -2.029 -6.650 -0.275 1.00 0.33 H new ATOM 0 HB3 LEU A 65 -3.550 -7.508 -0.423 1.00 0.33 H new ATOM 0 HG LEU A 65 -3.131 -6.766 2.359 1.00 0.24 H new ATOM 0 HD11 LEU A 65 -3.230 -4.306 2.062 1.00 0.24 H new ATOM 0 HD12 LEU A 65 -1.720 -4.971 1.395 1.00 0.24 H new ATOM 0 HD13 LEU A 65 -3.049 -4.513 0.304 1.00 0.24 H new ATOM 0 HD21 LEU A 65 -5.318 -5.652 2.006 1.00 0.28 H new ATOM 0 HD22 LEU A 65 -5.135 -5.852 0.247 1.00 0.28 H new ATOM 0 HD23 LEU A 65 -5.308 -7.282 1.292 1.00 0.28 H new ATOM 726 N PRO A 66 -1.522 -8.204 3.301 1.00 1.17 N ATOM 727 CA PRO A 66 -0.617 -7.806 4.394 1.00 1.35 C ATOM 728 C PRO A 66 0.443 -8.881 4.636 1.00 1.24 C ATOM 729 O PRO A 66 0.259 -10.036 4.307 1.00 1.98 O ATOM 730 CB PRO A 66 -1.538 -7.673 5.608 1.00 2.64 C ATOM 731 CG PRO A 66 -2.784 -8.536 5.307 1.00 3.17 C ATOM 732 CD PRO A 66 -2.817 -8.748 3.782 1.00 2.25 C ATOM 0 HA PRO A 66 -0.074 -6.886 4.176 1.00 1.35 H new ATOM 0 HB2 PRO A 66 -1.038 -8.015 6.514 1.00 2.64 H new ATOM 0 HB3 PRO A 66 -1.817 -6.632 5.772 1.00 2.64 H new ATOM 0 HG2 PRO A 66 -2.729 -9.491 5.829 1.00 3.17 H new ATOM 0 HG3 PRO A 66 -3.691 -8.038 5.648 1.00 3.17 H new ATOM 0 HD2 PRO A 66 -2.922 -9.803 3.531 1.00 2.25 H new ATOM 0 HD3 PRO A 66 -3.659 -8.227 3.327 1.00 2.25 H new ATOM 740 N LYS A 67 1.549 -8.505 5.215 1.00 0.92 N ATOM 741 CA LYS A 67 2.627 -9.495 5.490 1.00 1.55 C ATOM 742 C LYS A 67 3.779 -8.790 6.202 1.00 1.20 C ATOM 743 O LYS A 67 4.930 -8.935 5.841 1.00 1.38 O ATOM 744 CB LYS A 67 3.130 -10.094 4.174 1.00 2.05 C ATOM 745 CG LYS A 67 3.231 -11.615 4.309 1.00 2.86 C ATOM 746 CD LYS A 67 4.703 -12.031 4.332 1.00 3.76 C ATOM 747 CE LYS A 67 4.826 -13.445 4.902 1.00 4.47 C ATOM 748 NZ LYS A 67 4.646 -14.442 3.809 1.00 4.75 N ATOM 0 H LYS A 67 1.753 -7.550 5.511 1.00 0.92 H new ATOM 0 HA LYS A 67 2.236 -10.295 6.119 1.00 1.55 H new ATOM 0 HB2 LYS A 67 2.451 -9.835 3.362 1.00 2.05 H new ATOM 0 HB3 LYS A 67 4.104 -9.676 3.921 1.00 2.05 H new ATOM 0 HG2 LYS A 67 2.736 -11.943 5.223 1.00 2.86 H new ATOM 0 HG3 LYS A 67 2.719 -12.099 3.477 1.00 2.86 H new ATOM 0 HD2 LYS A 67 5.117 -11.997 3.324 1.00 3.76 H new ATOM 0 HD3 LYS A 67 5.280 -11.332 4.938 1.00 3.76 H new ATOM 0 HE2 LYS A 67 5.802 -13.576 5.370 1.00 4.47 H new ATOM 0 HE3 LYS A 67 4.077 -13.602 5.678 1.00 4.47 H new ATOM 0 HZ1 LYS A 67 4.730 -15.403 4.198 1.00 4.75 H new ATOM 0 HZ2 LYS A 67 3.705 -14.323 3.382 1.00 4.75 H new ATOM 0 HZ3 LYS A 67 5.377 -14.297 3.083 1.00 4.75 H new ATOM 762 N MET A 68 3.474 -8.024 7.210 1.00 0.78 N ATOM 763 CA MET A 68 4.544 -7.302 7.951 1.00 0.43 C ATOM 764 C MET A 68 4.124 -7.133 9.410 1.00 0.73 C ATOM 765 O MET A 68 3.039 -6.676 9.708 1.00 1.44 O ATOM 766 CB MET A 68 4.766 -5.927 7.314 1.00 0.49 C ATOM 767 CG MET A 68 5.902 -5.203 8.038 1.00 0.66 C ATOM 768 SD MET A 68 6.719 -4.063 6.893 1.00 0.89 S ATOM 769 CE MET A 68 6.672 -2.597 7.955 1.00 0.83 C ATOM 0 H MET A 68 2.527 -7.866 7.554 1.00 0.78 H new ATOM 0 HA MET A 68 5.471 -7.874 7.906 1.00 0.43 H new ATOM 0 HB2 MET A 68 5.008 -6.040 6.257 1.00 0.49 H new ATOM 0 HB3 MET A 68 3.851 -5.337 7.370 1.00 0.49 H new ATOM 0 HG2 MET A 68 5.510 -4.655 8.895 1.00 0.66 H new ATOM 0 HG3 MET A 68 6.621 -5.926 8.423 1.00 0.66 H new ATOM 0 HE1 MET A 68 7.405 -1.870 7.605 1.00 0.83 H new ATOM 0 HE2 MET A 68 5.677 -2.154 7.920 1.00 0.83 H new ATOM 0 HE3 MET A 68 6.906 -2.883 8.980 1.00 0.83 H new ATOM 779 N ALA A 69 4.978 -7.505 10.321 1.00 0.63 N ATOM 780 CA ALA A 69 4.633 -7.376 11.762 1.00 1.17 C ATOM 781 C ALA A 69 5.918 -7.268 12.586 1.00 1.05 C ATOM 782 O ALA A 69 6.949 -6.853 12.093 1.00 0.79 O ATOM 783 CB ALA A 69 3.844 -8.609 12.198 1.00 1.80 C ATOM 0 H ALA A 69 5.901 -7.893 10.129 1.00 0.63 H new ATOM 0 HA ALA A 69 4.030 -6.482 11.919 1.00 1.17 H new ATOM 0 HB1 ALA A 69 3.587 -8.522 13.254 1.00 1.80 H new ATOM 0 HB2 ALA A 69 2.931 -8.684 11.607 1.00 1.80 H new ATOM 0 HB3 ALA A 69 4.450 -9.502 12.044 1.00 1.80 H new ATOM 789 N GLU A 70 5.869 -7.637 13.837 1.00 1.42 N ATOM 790 CA GLU A 70 7.090 -7.551 14.686 1.00 1.30 C ATOM 791 C GLU A 70 8.099 -8.621 14.257 1.00 1.18 C ATOM 792 O GLU A 70 9.267 -8.550 14.585 1.00 1.18 O ATOM 793 CB GLU A 70 6.710 -7.771 16.152 1.00 1.58 C ATOM 794 CG GLU A 70 7.811 -7.210 17.054 1.00 2.71 C ATOM 795 CD GLU A 70 7.256 -6.996 18.464 1.00 3.12 C ATOM 796 OE1 GLU A 70 6.428 -7.790 18.880 1.00 2.50 O ATOM 797 OE2 GLU A 70 7.668 -6.042 19.103 1.00 4.15 O ATOM 0 H GLU A 70 5.037 -7.994 14.307 1.00 1.42 H new ATOM 0 HA GLU A 70 7.539 -6.565 14.568 1.00 1.30 H new ATOM 0 HB2 GLU A 70 5.761 -7.281 16.370 1.00 1.58 H new ATOM 0 HB3 GLU A 70 6.572 -8.834 16.347 1.00 1.58 H new ATOM 0 HG2 GLU A 70 8.656 -7.898 17.085 1.00 2.71 H new ATOM 0 HG3 GLU A 70 8.181 -6.268 16.651 1.00 2.71 H new ATOM 804 N LYS A 71 7.665 -9.614 13.527 1.00 1.16 N ATOM 805 CA LYS A 71 8.609 -10.680 13.086 1.00 1.10 C ATOM 806 C LYS A 71 9.296 -10.249 11.789 1.00 0.95 C ATOM 807 O LYS A 71 10.419 -10.624 11.518 1.00 0.88 O ATOM 808 CB LYS A 71 7.839 -11.980 12.846 1.00 1.27 C ATOM 809 CG LYS A 71 8.533 -13.124 13.587 1.00 1.66 C ATOM 810 CD LYS A 71 7.526 -14.246 13.852 1.00 2.19 C ATOM 811 CE LYS A 71 6.655 -13.874 15.052 1.00 3.57 C ATOM 812 NZ LYS A 71 7.150 -14.585 16.265 1.00 4.76 N ATOM 0 H LYS A 71 6.700 -9.732 13.218 1.00 1.16 H new ATOM 0 HA LYS A 71 9.360 -10.841 13.860 1.00 1.10 H new ATOM 0 HB2 LYS A 71 6.811 -11.877 13.194 1.00 1.27 H new ATOM 0 HB3 LYS A 71 7.794 -12.197 11.779 1.00 1.27 H new ATOM 0 HG2 LYS A 71 9.367 -13.502 12.995 1.00 1.66 H new ATOM 0 HG3 LYS A 71 8.948 -12.763 14.528 1.00 1.66 H new ATOM 0 HD2 LYS A 71 6.903 -14.406 12.972 1.00 2.19 H new ATOM 0 HD3 LYS A 71 8.050 -15.182 14.045 1.00 2.19 H new ATOM 0 HE2 LYS A 71 6.681 -12.796 15.213 1.00 3.57 H new ATOM 0 HE3 LYS A 71 5.617 -14.143 14.858 1.00 3.57 H new ATOM 0 HZ1 LYS A 71 6.558 -14.332 17.082 1.00 4.76 H new ATOM 0 HZ2 LYS A 71 7.104 -15.612 16.108 1.00 4.76 H new ATOM 0 HZ3 LYS A 71 8.135 -14.308 16.452 1.00 4.76 H new ATOM 826 N ASP A 72 8.632 -9.464 10.985 1.00 0.90 N ATOM 827 CA ASP A 72 9.250 -9.010 9.704 1.00 0.79 C ATOM 828 C ASP A 72 10.635 -8.418 9.981 1.00 0.39 C ATOM 829 O ASP A 72 11.587 -8.680 9.271 1.00 0.36 O ATOM 830 CB ASP A 72 8.363 -7.944 9.058 1.00 1.09 C ATOM 831 CG ASP A 72 8.943 -7.550 7.698 1.00 1.40 C ATOM 832 OD1 ASP A 72 9.179 -8.439 6.898 1.00 1.35 O ATOM 833 OD2 ASP A 72 9.144 -6.366 7.482 1.00 2.29 O ATOM 0 H ASP A 72 7.689 -9.117 11.159 1.00 0.90 H new ATOM 0 HA ASP A 72 9.348 -9.861 9.030 1.00 0.79 H new ATOM 0 HB2 ASP A 72 7.349 -8.325 8.936 1.00 1.09 H new ATOM 0 HB3 ASP A 72 8.299 -7.069 9.705 1.00 1.09 H new ATOM 838 N GLY A 73 10.756 -7.629 11.012 1.00 0.47 N ATOM 839 CA GLY A 73 12.079 -7.027 11.341 1.00 0.74 C ATOM 840 C GLY A 73 12.041 -5.518 11.092 1.00 0.60 C ATOM 841 O GLY A 73 13.061 -4.885 10.905 1.00 0.80 O ATOM 0 H GLY A 73 9.995 -7.375 11.642 1.00 0.47 H new ATOM 0 HA2 GLY A 73 12.330 -7.226 12.383 1.00 0.74 H new ATOM 0 HA3 GLY A 73 12.858 -7.485 10.732 1.00 0.74 H new ATOM 845 N CYS A 74 10.874 -4.934 11.087 1.00 0.33 N ATOM 846 CA CYS A 74 10.777 -3.467 10.849 1.00 0.24 C ATOM 847 C CYS A 74 10.661 -2.738 12.191 1.00 0.54 C ATOM 848 O CYS A 74 10.073 -1.678 12.284 1.00 0.63 O ATOM 849 CB CYS A 74 9.542 -3.173 9.996 1.00 0.12 C ATOM 850 SG CYS A 74 9.848 -3.708 8.294 1.00 0.70 S ATOM 0 H CYS A 74 9.984 -5.409 11.237 1.00 0.33 H new ATOM 0 HA CYS A 74 11.669 -3.121 10.327 1.00 0.24 H new ATOM 0 HB2 CYS A 74 8.674 -3.692 10.402 1.00 0.12 H new ATOM 0 HB3 CYS A 74 9.316 -2.107 10.019 1.00 0.12 H new ATOM 855 N PHE A 75 11.221 -3.297 13.230 1.00 0.73 N ATOM 856 CA PHE A 75 11.147 -2.638 14.565 1.00 1.02 C ATOM 857 C PHE A 75 12.459 -2.865 15.319 1.00 1.17 C ATOM 858 O PHE A 75 13.289 -3.657 14.915 1.00 1.21 O ATOM 859 CB PHE A 75 9.988 -3.235 15.365 1.00 1.10 C ATOM 860 CG PHE A 75 8.679 -2.859 14.713 1.00 1.07 C ATOM 861 CD1 PHE A 75 8.220 -3.576 13.601 1.00 1.01 C ATOM 862 CD2 PHE A 75 7.921 -1.797 15.221 1.00 2.61 C ATOM 863 CE1 PHE A 75 7.006 -3.228 12.996 1.00 0.77 C ATOM 864 CE2 PHE A 75 6.707 -1.449 14.616 1.00 2.75 C ATOM 865 CZ PHE A 75 6.250 -2.166 13.504 1.00 1.22 C ATOM 0 H PHE A 75 11.727 -4.182 13.211 1.00 0.73 H new ATOM 0 HA PHE A 75 10.984 -1.568 14.434 1.00 1.02 H new ATOM 0 HB2 PHE A 75 10.085 -4.320 15.411 1.00 1.10 H new ATOM 0 HB3 PHE A 75 10.014 -2.869 16.391 1.00 1.10 H new ATOM 0 HD1 PHE A 75 8.802 -4.397 13.210 1.00 1.01 H new ATOM 0 HD2 PHE A 75 8.273 -1.246 16.080 1.00 2.61 H new ATOM 0 HE1 PHE A 75 6.653 -3.780 12.137 1.00 0.77 H new ATOM 0 HE2 PHE A 75 6.124 -0.628 15.007 1.00 2.75 H new ATOM 0 HZ PHE A 75 5.313 -1.899 13.038 1.00 1.22 H new ATOM 875 N GLN A 76 12.656 -2.172 16.407 1.00 1.44 N ATOM 876 CA GLN A 76 13.918 -2.341 17.186 1.00 1.58 C ATOM 877 C GLN A 76 14.040 -3.784 17.681 1.00 1.36 C ATOM 878 O GLN A 76 15.118 -4.340 17.740 1.00 1.31 O ATOM 879 CB GLN A 76 13.902 -1.396 18.389 1.00 1.96 C ATOM 880 CG GLN A 76 12.638 -1.637 19.217 1.00 0.95 C ATOM 881 CD GLN A 76 12.682 -0.773 20.479 1.00 1.29 C ATOM 882 OE1 GLN A 76 13.095 0.369 20.433 1.00 1.94 O ATOM 883 NE2 GLN A 76 12.271 -1.273 21.611 1.00 1.72 N ATOM 0 H GLN A 76 11.997 -1.495 16.792 1.00 1.44 H new ATOM 0 HA GLN A 76 14.767 -2.109 16.543 1.00 1.58 H new ATOM 0 HB2 GLN A 76 14.787 -1.559 19.003 1.00 1.96 H new ATOM 0 HB3 GLN A 76 13.935 -0.360 18.051 1.00 1.96 H new ATOM 0 HG2 GLN A 76 11.753 -1.395 18.628 1.00 0.95 H new ATOM 0 HG3 GLN A 76 12.563 -2.690 19.487 1.00 0.95 H new ATOM 0 HE21 GLN A 76 11.924 -2.232 21.649 1.00 1.72 H new ATOM 0 HE22 GLN A 76 12.296 -0.706 22.458 1.00 1.72 H new ATOM 892 N SER A 77 12.943 -4.392 18.041 1.00 1.29 N ATOM 893 CA SER A 77 12.991 -5.800 18.541 1.00 1.14 C ATOM 894 C SER A 77 13.815 -6.670 17.585 1.00 1.09 C ATOM 895 O SER A 77 14.509 -7.578 17.997 1.00 2.32 O ATOM 896 CB SER A 77 11.571 -6.355 18.633 1.00 1.09 C ATOM 897 OG SER A 77 11.619 -7.696 19.103 1.00 0.71 O ATOM 0 H SER A 77 12.012 -3.975 18.011 1.00 1.29 H new ATOM 0 HA SER A 77 13.457 -5.812 19.526 1.00 1.14 H new ATOM 0 HB2 SER A 77 10.972 -5.743 19.307 1.00 1.09 H new ATOM 0 HB3 SER A 77 11.090 -6.317 17.656 1.00 1.09 H new ATOM 0 HG SER A 77 10.709 -8.054 19.164 1.00 0.71 H new ATOM 903 N GLY A 78 13.744 -6.396 16.312 1.00 0.82 N ATOM 904 CA GLY A 78 14.523 -7.203 15.331 1.00 0.59 C ATOM 905 C GLY A 78 14.722 -6.384 14.057 1.00 0.51 C ATOM 906 O GLY A 78 14.362 -6.800 12.974 1.00 0.57 O ATOM 0 H GLY A 78 13.180 -5.648 15.908 1.00 0.82 H new ATOM 0 HA2 GLY A 78 15.488 -7.480 15.754 1.00 0.59 H new ATOM 0 HA3 GLY A 78 13.996 -8.130 15.104 1.00 0.59 H new ATOM 910 N PHE A 79 15.289 -5.216 14.179 1.00 0.57 N ATOM 911 CA PHE A 79 15.505 -4.363 12.979 1.00 0.66 C ATOM 912 C PHE A 79 16.694 -4.892 12.174 1.00 0.62 C ATOM 913 O PHE A 79 17.835 -4.599 12.470 1.00 0.92 O ATOM 914 CB PHE A 79 15.793 -2.930 13.430 1.00 0.74 C ATOM 915 CG PHE A 79 15.537 -1.979 12.287 1.00 0.67 C ATOM 916 CD1 PHE A 79 14.287 -1.964 11.656 1.00 0.53 C ATOM 917 CD2 PHE A 79 16.548 -1.110 11.859 1.00 0.86 C ATOM 918 CE1 PHE A 79 14.048 -1.082 10.598 1.00 0.60 C ATOM 919 CE2 PHE A 79 16.309 -0.228 10.799 1.00 0.80 C ATOM 920 CZ PHE A 79 15.058 -0.213 10.170 1.00 0.66 C ATOM 0 H PHE A 79 15.612 -4.816 15.060 1.00 0.57 H new ATOM 0 HA PHE A 79 14.613 -4.382 12.353 1.00 0.66 H new ATOM 0 HB2 PHE A 79 15.161 -2.672 14.280 1.00 0.74 H new ATOM 0 HB3 PHE A 79 16.827 -2.844 13.764 1.00 0.74 H new ATOM 0 HD1 PHE A 79 13.507 -2.634 11.987 1.00 0.53 H new ATOM 0 HD2 PHE A 79 17.512 -1.120 12.347 1.00 0.86 H new ATOM 0 HE1 PHE A 79 13.084 -1.071 10.111 1.00 0.60 H new ATOM 0 HE2 PHE A 79 17.089 0.441 10.466 1.00 0.80 H new ATOM 0 HZ PHE A 79 14.872 0.470 9.354 1.00 0.66 H new ATOM 930 N ASN A 80 16.438 -5.661 11.150 1.00 0.64 N ATOM 931 CA ASN A 80 17.559 -6.196 10.325 1.00 0.81 C ATOM 932 C ASN A 80 17.849 -5.248 9.160 1.00 0.99 C ATOM 933 O ASN A 80 18.678 -5.526 8.318 1.00 2.39 O ATOM 934 CB ASN A 80 17.188 -7.575 9.782 1.00 1.01 C ATOM 935 CG ASN A 80 17.822 -8.656 10.658 1.00 1.24 C ATOM 936 OD1 ASN A 80 17.360 -8.918 11.751 1.00 1.82 O ATOM 937 ND2 ASN A 80 18.869 -9.301 10.220 1.00 1.82 N ATOM 0 H ASN A 80 15.504 -5.941 10.850 1.00 0.64 H new ATOM 0 HA ASN A 80 18.449 -6.280 10.948 1.00 0.81 H new ATOM 0 HB2 ASN A 80 16.104 -7.693 9.768 1.00 1.01 H new ATOM 0 HB3 ASN A 80 17.533 -7.677 8.753 1.00 1.01 H new ATOM 0 HD21 ASN A 80 19.299 -10.025 10.795 1.00 1.82 H new ATOM 0 HD22 ASN A 80 19.257 -9.081 9.303 1.00 1.82 H new ATOM 944 N GLU A 81 17.186 -4.127 9.111 1.00 0.64 N ATOM 945 CA GLU A 81 17.430 -3.157 8.015 1.00 0.49 C ATOM 946 C GLU A 81 17.156 -3.803 6.649 1.00 0.51 C ATOM 947 O GLU A 81 16.061 -3.739 6.138 1.00 0.77 O ATOM 948 CB GLU A 81 18.881 -2.671 8.082 1.00 0.46 C ATOM 949 CG GLU A 81 19.013 -1.620 9.184 1.00 0.57 C ATOM 950 CD GLU A 81 20.294 -1.873 9.981 1.00 1.00 C ATOM 951 OE1 GLU A 81 21.361 -1.754 9.402 1.00 1.12 O ATOM 952 OE2 GLU A 81 20.185 -2.184 11.155 1.00 1.70 O ATOM 0 H GLU A 81 16.480 -3.842 9.790 1.00 0.64 H new ATOM 0 HA GLU A 81 16.754 -2.310 8.135 1.00 0.49 H new ATOM 0 HB2 GLU A 81 19.548 -3.509 8.282 1.00 0.46 H new ATOM 0 HB3 GLU A 81 19.179 -2.248 7.123 1.00 0.46 H new ATOM 0 HG2 GLU A 81 19.035 -0.621 8.748 1.00 0.57 H new ATOM 0 HG3 GLU A 81 18.147 -1.660 9.845 1.00 0.57 H new ATOM 959 N GLU A 82 18.146 -4.405 6.047 1.00 0.53 N ATOM 960 CA GLU A 82 17.948 -5.027 4.703 1.00 0.51 C ATOM 961 C GLU A 82 16.697 -5.917 4.679 1.00 0.52 C ATOM 962 O GLU A 82 16.117 -6.147 3.635 1.00 0.51 O ATOM 963 CB GLU A 82 19.175 -5.876 4.365 1.00 0.56 C ATOM 964 CG GLU A 82 19.002 -6.498 2.979 1.00 0.40 C ATOM 965 CD GLU A 82 18.852 -8.014 3.116 1.00 1.08 C ATOM 966 OE1 GLU A 82 17.740 -8.461 3.344 1.00 1.71 O ATOM 967 OE2 GLU A 82 19.852 -8.702 2.990 1.00 1.44 O ATOM 0 H GLU A 82 19.088 -4.494 6.429 1.00 0.53 H new ATOM 0 HA GLU A 82 17.815 -4.232 3.969 1.00 0.51 H new ATOM 0 HB2 GLU A 82 20.074 -5.260 4.389 1.00 0.56 H new ATOM 0 HB3 GLU A 82 19.305 -6.659 5.112 1.00 0.56 H new ATOM 0 HG2 GLU A 82 18.125 -6.078 2.487 1.00 0.40 H new ATOM 0 HG3 GLU A 82 19.862 -6.262 2.353 1.00 0.40 H new ATOM 974 N THR A 83 16.274 -6.427 5.804 1.00 0.54 N ATOM 975 CA THR A 83 15.071 -7.305 5.803 1.00 0.55 C ATOM 976 C THR A 83 13.814 -6.445 5.760 1.00 0.49 C ATOM 977 O THR A 83 12.865 -6.748 5.062 1.00 0.45 O ATOM 978 CB THR A 83 15.065 -8.170 7.067 1.00 0.58 C ATOM 979 OG1 THR A 83 16.239 -8.970 7.093 1.00 0.53 O ATOM 980 CG2 THR A 83 13.832 -9.074 7.064 1.00 0.64 C ATOM 0 H THR A 83 16.705 -6.275 6.716 1.00 0.54 H new ATOM 0 HA THR A 83 15.094 -7.952 4.926 1.00 0.55 H new ATOM 0 HB THR A 83 15.039 -7.528 7.948 1.00 0.58 H new ATOM 0 HG1 THR A 83 16.240 -9.524 7.901 1.00 0.53 H new ATOM 0 HG21 THR A 83 13.829 -9.689 7.964 1.00 0.64 H new ATOM 0 HG22 THR A 83 12.931 -8.461 7.041 1.00 0.64 H new ATOM 0 HG23 THR A 83 13.855 -9.718 6.185 1.00 0.64 H new ATOM 988 N CYS A 84 13.799 -5.369 6.492 1.00 0.51 N ATOM 989 CA CYS A 84 12.601 -4.494 6.480 1.00 0.46 C ATOM 990 C CYS A 84 12.450 -3.884 5.086 1.00 0.41 C ATOM 991 O CYS A 84 11.434 -4.033 4.436 1.00 0.38 O ATOM 992 CB CYS A 84 12.761 -3.381 7.518 1.00 0.43 C ATOM 993 SG CYS A 84 11.236 -2.409 7.605 1.00 0.92 S ATOM 0 H CYS A 84 14.561 -5.060 7.095 1.00 0.51 H new ATOM 0 HA CYS A 84 11.714 -5.079 6.726 1.00 0.46 H new ATOM 0 HB2 CYS A 84 12.987 -3.810 8.494 1.00 0.43 H new ATOM 0 HB3 CYS A 84 13.599 -2.738 7.250 1.00 0.43 H new ATOM 998 N LEU A 85 13.463 -3.204 4.621 1.00 0.48 N ATOM 999 CA LEU A 85 13.401 -2.581 3.270 1.00 0.43 C ATOM 1000 C LEU A 85 12.953 -3.615 2.232 1.00 0.45 C ATOM 1001 O LEU A 85 12.154 -3.324 1.365 1.00 0.44 O ATOM 1002 CB LEU A 85 14.787 -2.060 2.894 1.00 0.40 C ATOM 1003 CG LEU A 85 14.687 -1.234 1.612 1.00 0.24 C ATOM 1004 CD1 LEU A 85 13.749 -0.048 1.841 1.00 0.28 C ATOM 1005 CD2 LEU A 85 16.077 -0.723 1.229 1.00 0.36 C ATOM 0 H LEU A 85 14.337 -3.053 5.124 1.00 0.48 H new ATOM 0 HA LEU A 85 12.684 -1.760 3.288 1.00 0.43 H new ATOM 0 HB2 LEU A 85 15.190 -1.450 3.702 1.00 0.40 H new ATOM 0 HB3 LEU A 85 15.475 -2.894 2.750 1.00 0.40 H new ATOM 0 HG LEU A 85 14.294 -1.855 0.807 1.00 0.24 H new ATOM 0 HD11 LEU A 85 13.678 0.541 0.927 1.00 0.28 H new ATOM 0 HD12 LEU A 85 12.760 -0.414 2.115 1.00 0.28 H new ATOM 0 HD13 LEU A 85 14.140 0.576 2.645 1.00 0.28 H new ATOM 0 HD21 LEU A 85 16.009 -0.133 0.315 1.00 0.36 H new ATOM 0 HD22 LEU A 85 16.470 -0.101 2.033 1.00 0.36 H new ATOM 0 HD23 LEU A 85 16.744 -1.570 1.066 1.00 0.36 H new ATOM 1017 N VAL A 86 13.461 -4.817 2.303 1.00 0.46 N ATOM 1018 CA VAL A 86 13.050 -5.848 1.306 1.00 0.47 C ATOM 1019 C VAL A 86 11.526 -5.981 1.310 1.00 0.42 C ATOM 1020 O VAL A 86 10.900 -5.883 0.284 1.00 0.43 O ATOM 1021 CB VAL A 86 13.716 -7.193 1.656 1.00 0.53 C ATOM 1022 CG1 VAL A 86 13.018 -8.353 0.931 1.00 0.61 C ATOM 1023 CG2 VAL A 86 15.180 -7.150 1.219 1.00 0.47 C ATOM 0 H VAL A 86 14.136 -5.127 3.001 1.00 0.46 H new ATOM 0 HA VAL A 86 13.371 -5.549 0.308 1.00 0.47 H new ATOM 0 HB VAL A 86 13.638 -7.352 2.732 1.00 0.53 H new ATOM 0 HG11 VAL A 86 13.505 -9.292 1.193 1.00 0.61 H new ATOM 0 HG12 VAL A 86 11.971 -8.392 1.231 1.00 0.61 H new ATOM 0 HG13 VAL A 86 13.082 -8.200 -0.146 1.00 0.61 H new ATOM 0 HG21 VAL A 86 15.660 -8.098 1.462 1.00 0.47 H new ATOM 0 HG22 VAL A 86 15.234 -6.982 0.143 1.00 0.47 H new ATOM 0 HG23 VAL A 86 15.691 -6.340 1.739 1.00 0.47 H new ATOM 1033 N LYS A 87 10.923 -6.209 2.442 1.00 0.37 N ATOM 1034 CA LYS A 87 9.437 -6.349 2.467 1.00 0.29 C ATOM 1035 C LYS A 87 8.788 -5.078 1.908 1.00 0.27 C ATOM 1036 O LYS A 87 7.682 -5.108 1.407 1.00 0.24 O ATOM 1037 CB LYS A 87 8.967 -6.575 3.905 1.00 0.29 C ATOM 1038 CG LYS A 87 7.635 -7.326 3.894 1.00 1.18 C ATOM 1039 CD LYS A 87 7.831 -8.703 3.258 1.00 0.71 C ATOM 1040 CE LYS A 87 7.295 -9.782 4.200 1.00 0.96 C ATOM 1041 NZ LYS A 87 8.107 -11.023 4.047 1.00 0.18 N ATOM 0 H LYS A 87 11.388 -6.304 3.345 1.00 0.37 H new ATOM 0 HA LYS A 87 9.146 -7.201 1.853 1.00 0.29 H new ATOM 0 HB2 LYS A 87 9.714 -7.145 4.458 1.00 0.29 H new ATOM 0 HB3 LYS A 87 8.854 -5.619 4.416 1.00 0.29 H new ATOM 0 HG2 LYS A 87 7.258 -7.434 4.911 1.00 1.18 H new ATOM 0 HG3 LYS A 87 6.890 -6.759 3.336 1.00 1.18 H new ATOM 0 HD2 LYS A 87 7.312 -8.750 2.301 1.00 0.71 H new ATOM 0 HD3 LYS A 87 8.888 -8.875 3.056 1.00 0.71 H new ATOM 0 HE2 LYS A 87 7.336 -9.432 5.232 1.00 0.96 H new ATOM 0 HE3 LYS A 87 6.249 -9.989 3.975 1.00 0.96 H new ATOM 0 HZ1 LYS A 87 7.743 -11.757 4.687 1.00 0.18 H new ATOM 0 HZ2 LYS A 87 8.046 -11.359 3.065 1.00 0.18 H new ATOM 0 HZ3 LYS A 87 9.099 -10.820 4.282 1.00 0.18 H new ATOM 1055 N ILE A 88 9.463 -3.962 1.988 1.00 0.30 N ATOM 1056 CA ILE A 88 8.877 -2.696 1.456 1.00 0.31 C ATOM 1057 C ILE A 88 8.843 -2.759 -0.071 1.00 0.27 C ATOM 1058 O ILE A 88 7.908 -2.306 -0.697 1.00 0.24 O ATOM 1059 CB ILE A 88 9.730 -1.506 1.901 1.00 0.31 C ATOM 1060 CG1 ILE A 88 9.764 -1.446 3.431 1.00 0.51 C ATOM 1061 CG2 ILE A 88 9.133 -0.208 1.351 1.00 0.36 C ATOM 1062 CD1 ILE A 88 8.343 -1.271 3.974 1.00 0.30 C ATOM 0 H ILE A 88 10.393 -3.872 2.398 1.00 0.30 H new ATOM 0 HA ILE A 88 7.864 -2.574 1.840 1.00 0.31 H new ATOM 0 HB ILE A 88 10.744 -1.626 1.519 1.00 0.31 H new ATOM 0 HG12 ILE A 88 10.206 -2.359 3.830 1.00 0.51 H new ATOM 0 HG13 ILE A 88 10.393 -0.618 3.758 1.00 0.51 H new ATOM 0 HG21 ILE A 88 9.743 0.637 1.670 1.00 0.36 H new ATOM 0 HG22 ILE A 88 9.112 -0.250 0.262 1.00 0.36 H new ATOM 0 HG23 ILE A 88 8.118 -0.086 1.729 1.00 0.36 H new ATOM 0 HD11 ILE A 88 8.372 -1.229 5.063 1.00 0.30 H new ATOM 0 HD12 ILE A 88 7.917 -0.346 3.586 1.00 0.30 H new ATOM 0 HD13 ILE A 88 7.727 -2.114 3.660 1.00 0.30 H new ATOM 1074 N ILE A 89 9.844 -3.339 -0.673 1.00 0.27 N ATOM 1075 CA ILE A 89 9.852 -3.460 -2.159 1.00 0.23 C ATOM 1076 C ILE A 89 8.777 -4.468 -2.543 1.00 0.31 C ATOM 1077 O ILE A 89 7.939 -4.243 -3.396 1.00 0.27 O ATOM 1078 CB ILE A 89 11.209 -4.005 -2.605 1.00 0.21 C ATOM 1079 CG1 ILE A 89 12.330 -3.164 -1.984 1.00 0.36 C ATOM 1080 CG2 ILE A 89 11.309 -3.946 -4.132 1.00 0.25 C ATOM 1081 CD1 ILE A 89 13.688 -3.693 -2.449 1.00 0.92 C ATOM 0 H ILE A 89 10.657 -3.735 -0.201 1.00 0.27 H new ATOM 0 HA ILE A 89 9.670 -2.492 -2.627 1.00 0.23 H new ATOM 0 HB ILE A 89 11.309 -5.039 -2.276 1.00 0.21 H new ATOM 0 HG12 ILE A 89 12.217 -2.119 -2.273 1.00 0.36 H new ATOM 0 HG13 ILE A 89 12.267 -3.202 -0.896 1.00 0.36 H new ATOM 0 HG21 ILE A 89 12.277 -4.335 -4.449 1.00 0.25 H new ATOM 0 HG22 ILE A 89 10.514 -4.548 -4.572 1.00 0.25 H new ATOM 0 HG23 ILE A 89 11.207 -2.913 -4.464 1.00 0.25 H new ATOM 0 HD11 ILE A 89 14.483 -3.093 -2.006 1.00 0.92 H new ATOM 0 HD12 ILE A 89 13.800 -4.731 -2.137 1.00 0.92 H new ATOM 0 HD13 ILE A 89 13.750 -3.632 -3.536 1.00 0.92 H new ATOM 1093 N THR A 90 8.820 -5.581 -1.884 1.00 0.53 N ATOM 1094 CA THR A 90 7.847 -6.675 -2.120 1.00 0.68 C ATOM 1095 C THR A 90 6.462 -6.258 -1.606 1.00 0.65 C ATOM 1096 O THR A 90 5.474 -6.915 -1.864 1.00 0.92 O ATOM 1097 CB THR A 90 8.307 -7.926 -1.355 1.00 0.88 C ATOM 1098 OG1 THR A 90 9.473 -7.643 -0.592 1.00 2.14 O ATOM 1099 CG2 THR A 90 8.617 -9.048 -2.333 1.00 0.74 C ATOM 0 H THR A 90 9.514 -5.787 -1.165 1.00 0.53 H new ATOM 0 HA THR A 90 7.790 -6.885 -3.188 1.00 0.68 H new ATOM 0 HB THR A 90 7.503 -8.231 -0.685 1.00 0.88 H new ATOM 0 HG1 THR A 90 9.752 -8.449 -0.110 1.00 2.14 H new ATOM 0 HG21 THR A 90 8.942 -9.931 -1.783 1.00 0.74 H new ATOM 0 HG22 THR A 90 7.722 -9.288 -2.907 1.00 0.74 H new ATOM 0 HG23 THR A 90 9.409 -8.731 -3.011 1.00 0.74 H new ATOM 1107 N GLY A 91 6.382 -5.179 -0.871 1.00 0.45 N ATOM 1108 CA GLY A 91 5.064 -4.738 -0.334 1.00 0.40 C ATOM 1109 C GLY A 91 4.515 -3.587 -1.178 1.00 0.42 C ATOM 1110 O GLY A 91 3.328 -3.318 -1.180 1.00 0.53 O ATOM 0 H GLY A 91 7.173 -4.586 -0.621 1.00 0.45 H new ATOM 0 HA2 GLY A 91 4.362 -5.572 -0.340 1.00 0.40 H new ATOM 0 HA3 GLY A 91 5.172 -4.420 0.703 1.00 0.40 H new ATOM 1114 N LEU A 92 5.364 -2.899 -1.889 1.00 0.31 N ATOM 1115 CA LEU A 92 4.884 -1.760 -2.717 1.00 0.34 C ATOM 1116 C LEU A 92 4.447 -2.267 -4.096 1.00 0.35 C ATOM 1117 O LEU A 92 3.569 -1.703 -4.716 1.00 0.35 O ATOM 1118 CB LEU A 92 6.011 -0.736 -2.881 1.00 0.38 C ATOM 1119 CG LEU A 92 6.028 0.205 -1.674 1.00 0.41 C ATOM 1120 CD1 LEU A 92 7.471 0.592 -1.344 1.00 0.69 C ATOM 1121 CD2 LEU A 92 5.226 1.468 -2.000 1.00 0.62 C ATOM 0 H LEU A 92 6.368 -3.076 -1.932 1.00 0.31 H new ATOM 0 HA LEU A 92 4.034 -1.290 -2.222 1.00 0.34 H new ATOM 0 HB2 LEU A 92 6.970 -1.246 -2.971 1.00 0.38 H new ATOM 0 HB3 LEU A 92 5.867 -0.165 -3.798 1.00 0.38 H new ATOM 0 HG LEU A 92 5.583 -0.300 -0.817 1.00 0.41 H new ATOM 0 HD11 LEU A 92 7.480 1.262 -0.484 1.00 0.69 H new ATOM 0 HD12 LEU A 92 8.044 -0.305 -1.111 1.00 0.69 H new ATOM 0 HD13 LEU A 92 7.918 1.095 -2.201 1.00 0.69 H new ATOM 0 HD21 LEU A 92 5.238 2.138 -1.141 1.00 0.62 H new ATOM 0 HD22 LEU A 92 5.672 1.971 -2.858 1.00 0.62 H new ATOM 0 HD23 LEU A 92 4.197 1.195 -2.233 1.00 0.62 H new ATOM 1133 N LEU A 93 5.044 -3.325 -4.584 1.00 0.37 N ATOM 1134 CA LEU A 93 4.639 -3.856 -5.923 1.00 0.39 C ATOM 1135 C LEU A 93 3.228 -4.436 -5.804 1.00 0.35 C ATOM 1136 O LEU A 93 2.331 -4.121 -6.577 1.00 0.32 O ATOM 1137 CB LEU A 93 5.617 -4.949 -6.368 1.00 0.44 C ATOM 1138 CG LEU A 93 7.054 -4.440 -6.235 1.00 0.66 C ATOM 1139 CD1 LEU A 93 7.979 -5.605 -5.881 1.00 0.58 C ATOM 1140 CD2 LEU A 93 7.497 -3.824 -7.563 1.00 0.99 C ATOM 0 H LEU A 93 5.790 -3.842 -4.118 1.00 0.37 H new ATOM 0 HA LEU A 93 4.653 -3.056 -6.663 1.00 0.39 H new ATOM 0 HB2 LEU A 93 5.480 -5.843 -5.760 1.00 0.44 H new ATOM 0 HB3 LEU A 93 5.415 -5.232 -7.401 1.00 0.44 H new ATOM 0 HG LEU A 93 7.102 -3.688 -5.448 1.00 0.66 H new ATOM 0 HD11 LEU A 93 9.002 -5.241 -5.787 1.00 0.58 H new ATOM 0 HD12 LEU A 93 7.662 -6.047 -4.936 1.00 0.58 H new ATOM 0 HD13 LEU A 93 7.933 -6.358 -6.668 1.00 0.58 H new ATOM 0 HD21 LEU A 93 8.520 -3.460 -7.472 1.00 0.99 H new ATOM 0 HD22 LEU A 93 7.449 -4.578 -8.348 1.00 0.99 H new ATOM 0 HD23 LEU A 93 6.838 -2.994 -7.817 1.00 0.99 H new ATOM 1152 N GLU A 94 3.011 -5.257 -4.815 1.00 0.36 N ATOM 1153 CA GLU A 94 1.655 -5.822 -4.614 1.00 0.33 C ATOM 1154 C GLU A 94 0.731 -4.648 -4.307 1.00 0.29 C ATOM 1155 O GLU A 94 -0.362 -4.541 -4.823 1.00 0.29 O ATOM 1156 CB GLU A 94 1.673 -6.799 -3.436 1.00 0.32 C ATOM 1157 CG GLU A 94 1.747 -8.233 -3.962 1.00 0.17 C ATOM 1158 CD GLU A 94 0.357 -8.870 -3.910 1.00 0.80 C ATOM 1159 OE1 GLU A 94 -0.608 -8.153 -4.114 1.00 1.72 O ATOM 1160 OE2 GLU A 94 0.282 -10.063 -3.666 1.00 0.69 O ATOM 0 H GLU A 94 3.714 -5.559 -4.141 1.00 0.36 H new ATOM 0 HA GLU A 94 1.316 -6.364 -5.497 1.00 0.33 H new ATOM 0 HB2 GLU A 94 2.528 -6.592 -2.792 1.00 0.32 H new ATOM 0 HB3 GLU A 94 0.777 -6.669 -2.829 1.00 0.32 H new ATOM 0 HG2 GLU A 94 2.122 -8.237 -4.985 1.00 0.17 H new ATOM 0 HG3 GLU A 94 2.448 -8.815 -3.363 1.00 0.17 H new ATOM 1167 N PHE A 95 1.193 -3.742 -3.489 1.00 0.28 N ATOM 1168 CA PHE A 95 0.381 -2.542 -3.162 1.00 0.27 C ATOM 1169 C PHE A 95 0.055 -1.807 -4.458 1.00 0.32 C ATOM 1170 O PHE A 95 -0.932 -1.116 -4.557 1.00 0.38 O ATOM 1171 CB PHE A 95 1.197 -1.621 -2.257 1.00 0.29 C ATOM 1172 CG PHE A 95 0.920 -1.931 -0.805 1.00 0.24 C ATOM 1173 CD1 PHE A 95 0.651 -3.245 -0.399 1.00 0.63 C ATOM 1174 CD2 PHE A 95 0.932 -0.899 0.135 1.00 0.68 C ATOM 1175 CE1 PHE A 95 0.394 -3.522 0.944 1.00 0.63 C ATOM 1176 CE2 PHE A 95 0.675 -1.173 1.479 1.00 0.66 C ATOM 1177 CZ PHE A 95 0.405 -2.486 1.887 1.00 0.22 C ATOM 0 H PHE A 95 2.104 -3.784 -3.032 1.00 0.28 H new ATOM 0 HA PHE A 95 -0.539 -2.836 -2.656 1.00 0.27 H new ATOM 0 HB2 PHE A 95 2.260 -1.744 -2.466 1.00 0.29 H new ATOM 0 HB3 PHE A 95 0.949 -0.581 -2.467 1.00 0.29 H new ATOM 0 HD1 PHE A 95 0.643 -4.044 -1.126 1.00 0.63 H new ATOM 0 HD2 PHE A 95 1.141 0.113 -0.178 1.00 0.68 H new ATOM 0 HE1 PHE A 95 0.187 -4.535 1.257 1.00 0.63 H new ATOM 0 HE2 PHE A 95 0.684 -0.373 2.205 1.00 0.66 H new ATOM 0 HZ PHE A 95 0.206 -2.699 2.927 1.00 0.22 H new ATOM 1187 N GLU A 96 0.891 -1.957 -5.449 1.00 0.30 N ATOM 1188 CA GLU A 96 0.650 -1.276 -6.748 1.00 0.35 C ATOM 1189 C GLU A 96 -0.615 -1.841 -7.384 1.00 0.35 C ATOM 1190 O GLU A 96 -1.458 -1.104 -7.852 1.00 0.38 O ATOM 1191 CB GLU A 96 1.841 -1.505 -7.675 1.00 0.37 C ATOM 1192 CG GLU A 96 2.049 -0.270 -8.554 1.00 0.68 C ATOM 1193 CD GLU A 96 0.836 -0.082 -9.467 1.00 1.01 C ATOM 1194 OE1 GLU A 96 0.348 -1.074 -9.983 1.00 0.97 O ATOM 1195 OE2 GLU A 96 0.415 1.052 -9.635 1.00 1.74 O ATOM 0 H GLU A 96 1.736 -2.527 -5.412 1.00 0.30 H new ATOM 0 HA GLU A 96 0.527 -0.206 -6.583 1.00 0.35 H new ATOM 0 HB2 GLU A 96 2.739 -1.703 -7.089 1.00 0.37 H new ATOM 0 HB3 GLU A 96 1.667 -2.383 -8.298 1.00 0.37 H new ATOM 0 HG2 GLU A 96 2.189 0.613 -7.931 1.00 0.68 H new ATOM 0 HG3 GLU A 96 2.953 -0.384 -9.152 1.00 0.68 H new ATOM 1202 N VAL A 97 -0.767 -3.140 -7.403 1.00 0.33 N ATOM 1203 CA VAL A 97 -2.009 -3.710 -8.011 1.00 0.34 C ATOM 1204 C VAL A 97 -3.220 -3.244 -7.185 1.00 0.28 C ATOM 1205 O VAL A 97 -4.284 -2.975 -7.717 1.00 0.25 O ATOM 1206 CB VAL A 97 -1.937 -5.246 -8.060 1.00 0.35 C ATOM 1207 CG1 VAL A 97 -1.782 -5.832 -6.655 1.00 0.58 C ATOM 1208 CG2 VAL A 97 -3.218 -5.795 -8.693 1.00 0.33 C ATOM 0 H VAL A 97 -0.102 -3.819 -7.033 1.00 0.33 H new ATOM 0 HA VAL A 97 -2.110 -3.356 -9.037 1.00 0.34 H new ATOM 0 HB VAL A 97 -1.069 -5.531 -8.655 1.00 0.35 H new ATOM 0 HG11 VAL A 97 -1.734 -6.919 -6.718 1.00 0.58 H new ATOM 0 HG12 VAL A 97 -0.866 -5.453 -6.202 1.00 0.58 H new ATOM 0 HG13 VAL A 97 -2.636 -5.541 -6.043 1.00 0.58 H new ATOM 0 HG21 VAL A 97 -3.169 -6.883 -8.729 1.00 0.33 H new ATOM 0 HG22 VAL A 97 -4.078 -5.490 -8.097 1.00 0.33 H new ATOM 0 HG23 VAL A 97 -3.321 -5.403 -9.705 1.00 0.33 H new ATOM 1218 N TYR A 98 -3.062 -3.107 -5.893 1.00 0.28 N ATOM 1219 CA TYR A 98 -4.196 -2.622 -5.059 1.00 0.24 C ATOM 1220 C TYR A 98 -4.396 -1.137 -5.355 1.00 0.26 C ATOM 1221 O TYR A 98 -5.476 -0.595 -5.213 1.00 0.24 O ATOM 1222 CB TYR A 98 -3.874 -2.823 -3.576 1.00 0.22 C ATOM 1223 CG TYR A 98 -3.807 -4.301 -3.282 1.00 0.23 C ATOM 1224 CD1 TYR A 98 -4.982 -5.060 -3.233 1.00 0.22 C ATOM 1225 CD2 TYR A 98 -2.569 -4.915 -3.065 1.00 0.29 C ATOM 1226 CE1 TYR A 98 -4.916 -6.433 -2.970 1.00 0.26 C ATOM 1227 CE2 TYR A 98 -2.503 -6.287 -2.801 1.00 0.33 C ATOM 1228 CZ TYR A 98 -3.677 -7.045 -2.754 1.00 0.32 C ATOM 1229 OH TYR A 98 -3.612 -8.399 -2.495 1.00 0.38 O ATOM 0 H TYR A 98 -2.201 -3.309 -5.385 1.00 0.28 H new ATOM 0 HA TYR A 98 -5.104 -3.178 -5.291 1.00 0.24 H new ATOM 0 HB2 TYR A 98 -2.925 -2.347 -3.329 1.00 0.22 H new ATOM 0 HB3 TYR A 98 -4.638 -2.351 -2.958 1.00 0.22 H new ATOM 0 HD1 TYR A 98 -5.939 -4.587 -3.398 1.00 0.22 H new ATOM 0 HD2 TYR A 98 -1.663 -4.329 -3.101 1.00 0.29 H new ATOM 0 HE1 TYR A 98 -5.822 -7.020 -2.934 1.00 0.26 H new ATOM 0 HE2 TYR A 98 -1.547 -6.760 -2.634 1.00 0.33 H new ATOM 0 HH TYR A 98 -2.677 -8.664 -2.370 1.00 0.38 H new ATOM 1239 N LEU A 99 -3.360 -0.486 -5.813 1.00 0.30 N ATOM 1240 CA LEU A 99 -3.478 0.944 -6.170 1.00 0.34 C ATOM 1241 C LEU A 99 -4.246 1.008 -7.483 1.00 0.35 C ATOM 1242 O LEU A 99 -4.974 1.941 -7.749 1.00 0.37 O ATOM 1243 CB LEU A 99 -2.084 1.549 -6.331 1.00 0.41 C ATOM 1244 CG LEU A 99 -1.433 1.674 -4.954 1.00 0.40 C ATOM 1245 CD1 LEU A 99 0.088 1.616 -5.088 1.00 0.52 C ATOM 1246 CD2 LEU A 99 -1.833 3.007 -4.331 1.00 0.50 C ATOM 0 H LEU A 99 -2.435 -0.892 -5.953 1.00 0.30 H new ATOM 0 HA LEU A 99 -3.998 1.508 -5.396 1.00 0.34 H new ATOM 0 HB2 LEU A 99 -1.474 0.921 -6.980 1.00 0.41 H new ATOM 0 HB3 LEU A 99 -2.151 2.528 -6.806 1.00 0.41 H new ATOM 0 HG LEU A 99 -1.768 0.852 -4.322 1.00 0.40 H new ATOM 0 HD11 LEU A 99 0.544 1.706 -4.102 1.00 0.52 H new ATOM 0 HD12 LEU A 99 0.378 0.666 -5.537 1.00 0.52 H new ATOM 0 HD13 LEU A 99 0.429 2.435 -5.721 1.00 0.52 H new ATOM 0 HD21 LEU A 99 -1.372 3.102 -3.348 1.00 0.50 H new ATOM 0 HD22 LEU A 99 -1.496 3.823 -4.970 1.00 0.50 H new ATOM 0 HD23 LEU A 99 -2.917 3.050 -4.228 1.00 0.50 H new ATOM 1258 N GLU A 100 -4.133 -0.029 -8.279 1.00 0.35 N ATOM 1259 CA GLU A 100 -4.900 -0.086 -9.541 1.00 0.38 C ATOM 1260 C GLU A 100 -6.363 -0.092 -9.133 1.00 0.34 C ATOM 1261 O GLU A 100 -7.214 0.501 -9.767 1.00 0.38 O ATOM 1262 CB GLU A 100 -4.560 -1.382 -10.280 1.00 0.38 C ATOM 1263 CG GLU A 100 -4.599 -1.143 -11.788 1.00 0.49 C ATOM 1264 CD GLU A 100 -6.050 -1.160 -12.272 1.00 0.47 C ATOM 1265 OE1 GLU A 100 -6.849 -1.852 -11.664 1.00 1.16 O ATOM 1266 OE2 GLU A 100 -6.338 -0.481 -13.245 1.00 0.58 O ATOM 0 H GLU A 100 -3.537 -0.837 -8.099 1.00 0.35 H new ATOM 0 HA GLU A 100 -4.671 0.751 -10.200 1.00 0.38 H new ATOM 0 HB2 GLU A 100 -3.571 -1.732 -9.983 1.00 0.38 H new ATOM 0 HB3 GLU A 100 -5.269 -2.163 -10.008 1.00 0.38 H new ATOM 0 HG2 GLU A 100 -4.136 -0.185 -12.027 1.00 0.49 H new ATOM 0 HG3 GLU A 100 -4.024 -1.912 -12.303 1.00 0.49 H new ATOM 1273 N TYR A 101 -6.638 -0.746 -8.035 1.00 0.26 N ATOM 1274 CA TYR A 101 -8.019 -0.788 -7.511 1.00 0.22 C ATOM 1275 C TYR A 101 -8.494 0.636 -7.274 1.00 0.22 C ATOM 1276 O TYR A 101 -9.556 1.032 -7.706 1.00 0.23 O ATOM 1277 CB TYR A 101 -8.028 -1.546 -6.183 1.00 0.15 C ATOM 1278 CG TYR A 101 -9.188 -2.507 -6.158 1.00 0.14 C ATOM 1279 CD1 TYR A 101 -9.398 -3.370 -7.237 1.00 0.23 C ATOM 1280 CD2 TYR A 101 -10.048 -2.540 -5.056 1.00 0.10 C ATOM 1281 CE1 TYR A 101 -10.472 -4.264 -7.219 1.00 0.27 C ATOM 1282 CE2 TYR A 101 -11.123 -3.435 -5.037 1.00 0.13 C ATOM 1283 CZ TYR A 101 -11.334 -4.296 -6.118 1.00 0.22 C ATOM 1284 OH TYR A 101 -12.398 -5.173 -6.100 1.00 0.28 O ATOM 0 H TYR A 101 -5.952 -1.256 -7.479 1.00 0.26 H new ATOM 0 HA TYR A 101 -8.675 -1.288 -8.224 1.00 0.22 H new ATOM 0 HB2 TYR A 101 -7.091 -2.088 -6.056 1.00 0.15 H new ATOM 0 HB3 TYR A 101 -8.106 -0.844 -5.353 1.00 0.15 H new ATOM 0 HD1 TYR A 101 -8.730 -3.346 -8.085 1.00 0.23 H new ATOM 0 HD2 TYR A 101 -9.883 -1.876 -4.221 1.00 0.10 H new ATOM 0 HE1 TYR A 101 -10.636 -4.929 -8.054 1.00 0.27 H new ATOM 0 HE2 TYR A 101 -11.790 -3.461 -4.188 1.00 0.13 H new ATOM 0 HH TYR A 101 -12.379 -5.693 -5.270 1.00 0.28 H new ATOM 1294 N LEU A 102 -7.714 1.400 -6.572 1.00 0.23 N ATOM 1295 CA LEU A 102 -8.109 2.802 -6.270 1.00 0.24 C ATOM 1296 C LEU A 102 -7.580 3.755 -7.344 1.00 0.31 C ATOM 1297 O LEU A 102 -7.653 4.959 -7.198 1.00 0.32 O ATOM 1298 CB LEU A 102 -7.533 3.201 -4.911 1.00 0.24 C ATOM 1299 CG LEU A 102 -7.733 2.064 -3.908 1.00 0.19 C ATOM 1300 CD1 LEU A 102 -6.440 1.848 -3.126 1.00 0.22 C ATOM 1301 CD2 LEU A 102 -8.866 2.432 -2.958 1.00 0.16 C ATOM 0 H LEU A 102 -6.812 1.114 -6.190 1.00 0.23 H new ATOM 0 HA LEU A 102 -9.197 2.867 -6.252 1.00 0.24 H new ATOM 0 HB2 LEU A 102 -6.472 3.429 -5.009 1.00 0.24 H new ATOM 0 HB3 LEU A 102 -8.022 4.106 -4.550 1.00 0.24 H new ATOM 0 HG LEU A 102 -7.989 1.143 -4.432 1.00 0.19 H new ATOM 0 HD11 LEU A 102 -6.579 1.038 -2.410 1.00 0.22 H new ATOM 0 HD12 LEU A 102 -5.637 1.589 -3.816 1.00 0.22 H new ATOM 0 HD13 LEU A 102 -6.180 2.763 -2.593 1.00 0.22 H new ATOM 0 HD21 LEU A 102 -9.015 1.626 -2.240 1.00 0.16 H new ATOM 0 HD22 LEU A 102 -8.612 3.349 -2.427 1.00 0.16 H new ATOM 0 HD23 LEU A 102 -9.783 2.584 -3.527 1.00 0.16 H new ATOM 1313 N GLN A 103 -7.045 3.242 -8.417 1.00 0.36 N ATOM 1314 CA GLN A 103 -6.519 4.146 -9.474 1.00 0.43 C ATOM 1315 C GLN A 103 -7.661 4.562 -10.405 1.00 0.48 C ATOM 1316 O GLN A 103 -7.640 5.628 -10.989 1.00 0.75 O ATOM 1317 CB GLN A 103 -5.441 3.427 -10.285 1.00 0.43 C ATOM 1318 CG GLN A 103 -4.773 4.423 -11.235 1.00 0.50 C ATOM 1319 CD GLN A 103 -4.303 3.694 -12.494 1.00 0.44 C ATOM 1320 OE1 GLN A 103 -3.196 3.194 -12.543 1.00 1.35 O ATOM 1321 NE2 GLN A 103 -5.102 3.611 -13.522 1.00 0.83 N ATOM 0 H GLN A 103 -6.950 2.244 -8.606 1.00 0.36 H new ATOM 0 HA GLN A 103 -6.087 5.030 -9.005 1.00 0.43 H new ATOM 0 HB2 GLN A 103 -4.699 2.990 -9.617 1.00 0.43 H new ATOM 0 HB3 GLN A 103 -5.882 2.607 -10.851 1.00 0.43 H new ATOM 0 HG2 GLN A 103 -5.474 5.214 -11.501 1.00 0.50 H new ATOM 0 HG3 GLN A 103 -3.926 4.900 -10.741 1.00 0.50 H new ATOM 0 HE21 GLN A 103 -6.031 4.030 -13.481 1.00 0.83 H new ATOM 0 HE22 GLN A 103 -4.798 3.127 -14.367 1.00 0.83 H new ATOM 1330 N ASN A 104 -8.653 3.726 -10.558 1.00 0.32 N ATOM 1331 CA ASN A 104 -9.786 4.078 -11.463 1.00 0.35 C ATOM 1332 C ASN A 104 -11.116 4.028 -10.701 1.00 0.31 C ATOM 1333 O ASN A 104 -12.091 4.630 -11.108 1.00 0.27 O ATOM 1334 CB ASN A 104 -9.837 3.085 -12.626 1.00 0.38 C ATOM 1335 CG ASN A 104 -10.290 3.810 -13.894 1.00 0.42 C ATOM 1336 OD1 ASN A 104 -9.535 4.561 -14.479 1.00 1.23 O ATOM 1337 ND2 ASN A 104 -11.499 3.618 -14.345 1.00 0.97 N ATOM 0 H ASN A 104 -8.728 2.819 -10.098 1.00 0.32 H new ATOM 0 HA ASN A 104 -9.630 5.088 -11.841 1.00 0.35 H new ATOM 0 HB2 ASN A 104 -8.855 2.638 -12.781 1.00 0.38 H new ATOM 0 HB3 ASN A 104 -10.524 2.271 -12.394 1.00 0.38 H new ATOM 0 HD21 ASN A 104 -11.811 4.098 -15.189 1.00 0.97 H new ATOM 0 HD22 ASN A 104 -12.132 2.987 -13.854 1.00 0.97 H new ATOM 1344 N ARG A 105 -11.175 3.315 -9.609 1.00 0.34 N ATOM 1345 CA ARG A 105 -12.455 3.234 -8.848 1.00 0.29 C ATOM 1346 C ARG A 105 -12.814 4.607 -8.283 1.00 0.30 C ATOM 1347 O ARG A 105 -13.943 5.043 -8.368 1.00 0.43 O ATOM 1348 CB ARG A 105 -12.310 2.239 -7.699 1.00 0.19 C ATOM 1349 CG ARG A 105 -12.675 0.836 -8.189 1.00 0.98 C ATOM 1350 CD ARG A 105 -14.140 0.549 -7.855 1.00 0.82 C ATOM 1351 NE ARG A 105 -14.664 -0.508 -8.765 1.00 1.92 N ATOM 1352 CZ ARG A 105 -15.945 -0.748 -8.814 1.00 2.31 C ATOM 1353 NH1 ARG A 105 -16.581 -1.119 -7.736 1.00 2.28 N ATOM 1354 NH2 ARG A 105 -16.593 -0.616 -9.940 1.00 3.15 N ATOM 0 H ARG A 105 -10.397 2.788 -9.212 1.00 0.34 H new ATOM 0 HA ARG A 105 -13.245 2.902 -9.521 1.00 0.29 H new ATOM 0 HB2 ARG A 105 -11.287 2.249 -7.322 1.00 0.19 H new ATOM 0 HB3 ARG A 105 -12.958 2.527 -6.871 1.00 0.19 H new ATOM 0 HG2 ARG A 105 -12.514 0.760 -9.264 1.00 0.98 H new ATOM 0 HG3 ARG A 105 -12.030 0.094 -7.717 1.00 0.98 H new ATOM 0 HD2 ARG A 105 -14.230 0.227 -6.818 1.00 0.82 H new ATOM 0 HD3 ARG A 105 -14.732 1.458 -7.959 1.00 0.82 H new ATOM 0 HE ARG A 105 -14.022 -1.043 -9.349 1.00 1.92 H new ATOM 0 HH11 ARG A 105 -16.076 -1.221 -6.856 1.00 2.28 H new ATOM 0 HH12 ARG A 105 -17.583 -1.307 -7.774 1.00 2.28 H new ATOM 0 HH21 ARG A 105 -16.097 -0.325 -10.783 1.00 3.15 H new ATOM 0 HH22 ARG A 105 -17.595 -0.804 -9.977 1.00 3.15 H new ATOM 1368 N PHE A 106 -11.868 5.293 -7.704 1.00 0.57 N ATOM 1369 CA PHE A 106 -12.177 6.636 -7.135 1.00 0.64 C ATOM 1370 C PHE A 106 -12.718 7.539 -8.246 1.00 0.67 C ATOM 1371 O PHE A 106 -11.971 8.190 -8.946 1.00 0.56 O ATOM 1372 CB PHE A 106 -10.907 7.254 -6.551 1.00 0.57 C ATOM 1373 CG PHE A 106 -10.828 6.957 -5.071 1.00 0.65 C ATOM 1374 CD1 PHE A 106 -11.653 7.642 -4.168 1.00 0.96 C ATOM 1375 CD2 PHE A 106 -9.919 6.001 -4.598 1.00 0.94 C ATOM 1376 CE1 PHE A 106 -11.569 7.368 -2.799 1.00 0.97 C ATOM 1377 CE2 PHE A 106 -9.836 5.731 -3.230 1.00 1.07 C ATOM 1378 CZ PHE A 106 -10.660 6.414 -2.330 1.00 0.84 C ATOM 0 H PHE A 106 -10.901 4.985 -7.600 1.00 0.57 H new ATOM 0 HA PHE A 106 -12.922 6.534 -6.346 1.00 0.64 H new ATOM 0 HB2 PHE A 106 -10.030 6.854 -7.059 1.00 0.57 H new ATOM 0 HB3 PHE A 106 -10.907 8.331 -6.716 1.00 0.57 H new ATOM 0 HD1 PHE A 106 -12.353 8.381 -4.529 1.00 0.96 H new ATOM 0 HD2 PHE A 106 -9.282 5.473 -5.292 1.00 0.94 H new ATOM 0 HE1 PHE A 106 -12.207 7.893 -2.103 1.00 0.97 H new ATOM 0 HE2 PHE A 106 -9.135 4.994 -2.867 1.00 1.07 H new ATOM 0 HZ PHE A 106 -10.594 6.205 -1.272 1.00 0.84 H new ATOM 1388 N GLU A 107 -14.012 7.583 -8.412 1.00 0.85 N ATOM 1389 CA GLU A 107 -14.599 8.444 -9.479 1.00 0.92 C ATOM 1390 C GLU A 107 -15.049 9.780 -8.876 1.00 1.05 C ATOM 1391 O GLU A 107 -15.295 10.736 -9.582 1.00 1.16 O ATOM 1392 CB GLU A 107 -15.805 7.736 -10.100 1.00 0.92 C ATOM 1393 CG GLU A 107 -16.410 8.623 -11.188 1.00 0.92 C ATOM 1394 CD GLU A 107 -16.594 7.807 -12.469 1.00 1.42 C ATOM 1395 OE1 GLU A 107 -16.915 6.635 -12.361 1.00 1.04 O ATOM 1396 OE2 GLU A 107 -16.408 8.367 -13.538 1.00 2.80 O ATOM 0 H GLU A 107 -14.688 7.060 -7.855 1.00 0.85 H new ATOM 0 HA GLU A 107 -13.847 8.628 -10.247 1.00 0.92 H new ATOM 0 HB2 GLU A 107 -15.500 6.779 -10.523 1.00 0.92 H new ATOM 0 HB3 GLU A 107 -16.550 7.523 -9.333 1.00 0.92 H new ATOM 0 HG2 GLU A 107 -17.369 9.020 -10.856 1.00 0.92 H new ATOM 0 HG3 GLU A 107 -15.760 9.477 -11.379 1.00 0.92 H new ATOM 1403 N SER A 108 -15.150 9.854 -7.576 1.00 1.06 N ATOM 1404 CA SER A 108 -15.576 11.129 -6.934 1.00 1.19 C ATOM 1405 C SER A 108 -14.331 11.956 -6.630 1.00 1.10 C ATOM 1406 O SER A 108 -14.322 13.166 -6.754 1.00 1.32 O ATOM 1407 CB SER A 108 -16.319 10.823 -5.634 1.00 1.28 C ATOM 1408 OG SER A 108 -16.942 9.549 -5.737 1.00 1.83 O ATOM 0 H SER A 108 -14.956 9.087 -6.932 1.00 1.06 H new ATOM 0 HA SER A 108 -16.239 11.682 -7.600 1.00 1.19 H new ATOM 0 HB2 SER A 108 -15.625 10.834 -4.794 1.00 1.28 H new ATOM 0 HB3 SER A 108 -17.067 11.592 -5.440 1.00 1.28 H new ATOM 0 HG SER A 108 -16.980 9.131 -4.851 1.00 1.83 H new ATOM 1414 N SER A 109 -13.276 11.301 -6.246 1.00 0.81 N ATOM 1415 CA SER A 109 -12.009 12.016 -5.942 1.00 0.74 C ATOM 1416 C SER A 109 -10.887 11.357 -6.742 1.00 0.73 C ATOM 1417 O SER A 109 -9.783 11.190 -6.263 1.00 0.76 O ATOM 1418 CB SER A 109 -11.708 11.912 -4.446 1.00 0.78 C ATOM 1419 OG SER A 109 -10.381 12.360 -4.201 1.00 0.73 O ATOM 0 H SER A 109 -13.236 10.289 -6.128 1.00 0.81 H new ATOM 0 HA SER A 109 -12.094 13.069 -6.210 1.00 0.74 H new ATOM 0 HB2 SER A 109 -12.418 12.513 -3.878 1.00 0.78 H new ATOM 0 HB3 SER A 109 -11.824 10.881 -4.111 1.00 0.78 H new ATOM 0 HG SER A 109 -9.806 12.108 -4.954 1.00 0.73 H new ATOM 1425 N GLU A 110 -11.178 10.968 -7.958 1.00 0.74 N ATOM 1426 CA GLU A 110 -10.161 10.297 -8.815 1.00 0.73 C ATOM 1427 C GLU A 110 -8.817 11.031 -8.732 1.00 0.71 C ATOM 1428 O GLU A 110 -7.767 10.424 -8.675 1.00 0.63 O ATOM 1429 CB GLU A 110 -10.647 10.303 -10.265 1.00 0.73 C ATOM 1430 CG GLU A 110 -9.667 9.513 -11.131 1.00 0.73 C ATOM 1431 CD GLU A 110 -9.804 9.948 -12.593 1.00 0.98 C ATOM 1432 OE1 GLU A 110 -10.796 10.581 -12.914 1.00 0.95 O ATOM 1433 OE2 GLU A 110 -8.911 9.641 -13.366 1.00 1.62 O ATOM 0 H GLU A 110 -12.091 11.090 -8.397 1.00 0.74 H new ATOM 0 HA GLU A 110 -10.025 9.274 -8.465 1.00 0.73 H new ATOM 0 HB2 GLU A 110 -11.642 9.863 -10.329 1.00 0.73 H new ATOM 0 HB3 GLU A 110 -10.727 11.327 -10.629 1.00 0.73 H new ATOM 0 HG2 GLU A 110 -8.646 9.679 -10.786 1.00 0.73 H new ATOM 0 HG3 GLU A 110 -9.865 8.445 -11.039 1.00 0.73 H new ATOM 1440 N GLU A 111 -8.848 12.337 -8.730 1.00 0.81 N ATOM 1441 CA GLU A 111 -7.583 13.125 -8.656 1.00 0.83 C ATOM 1442 C GLU A 111 -6.686 12.591 -7.533 1.00 0.59 C ATOM 1443 O GLU A 111 -5.533 12.274 -7.747 1.00 0.38 O ATOM 1444 CB GLU A 111 -7.926 14.590 -8.381 1.00 1.09 C ATOM 1445 CG GLU A 111 -6.667 15.443 -8.523 1.00 1.69 C ATOM 1446 CD GLU A 111 -6.995 16.900 -8.191 1.00 2.24 C ATOM 1447 OE1 GLU A 111 -7.902 17.119 -7.405 1.00 2.64 O ATOM 1448 OE2 GLU A 111 -6.334 17.773 -8.729 1.00 2.42 O ATOM 0 H GLU A 111 -9.700 12.895 -8.777 1.00 0.81 H new ATOM 0 HA GLU A 111 -7.049 13.036 -9.602 1.00 0.83 H new ATOM 0 HB2 GLU A 111 -8.691 14.933 -9.078 1.00 1.09 H new ATOM 0 HB3 GLU A 111 -8.339 14.696 -7.378 1.00 1.09 H new ATOM 0 HG2 GLU A 111 -5.888 15.074 -7.856 1.00 1.69 H new ATOM 0 HG3 GLU A 111 -6.278 15.369 -9.539 1.00 1.69 H new ATOM 1455 N GLN A 112 -7.204 12.493 -6.338 1.00 0.67 N ATOM 1456 CA GLN A 112 -6.373 11.988 -5.205 1.00 0.57 C ATOM 1457 C GLN A 112 -5.983 10.531 -5.462 1.00 0.38 C ATOM 1458 O GLN A 112 -4.915 10.090 -5.088 1.00 0.30 O ATOM 1459 CB GLN A 112 -7.170 12.084 -3.905 1.00 0.83 C ATOM 1460 CG GLN A 112 -7.453 13.553 -3.592 1.00 1.05 C ATOM 1461 CD GLN A 112 -6.279 14.147 -2.813 1.00 1.41 C ATOM 1462 OE1 GLN A 112 -5.221 13.553 -2.740 1.00 2.19 O ATOM 1463 NE2 GLN A 112 -6.421 15.303 -2.225 1.00 1.37 N ATOM 0 H GLN A 112 -8.164 12.740 -6.097 1.00 0.67 H new ATOM 0 HA GLN A 112 -5.470 12.593 -5.122 1.00 0.57 H new ATOM 0 HB2 GLN A 112 -8.106 11.533 -3.998 1.00 0.83 H new ATOM 0 HB3 GLN A 112 -6.611 11.628 -3.088 1.00 0.83 H new ATOM 0 HG2 GLN A 112 -7.607 14.109 -4.517 1.00 1.05 H new ATOM 0 HG3 GLN A 112 -8.370 13.641 -3.010 1.00 1.05 H new ATOM 0 HE21 GLN A 112 -7.309 15.801 -2.287 1.00 1.37 H new ATOM 0 HE22 GLN A 112 -5.644 15.709 -1.704 1.00 1.37 H new ATOM 1472 N ALA A 113 -6.837 9.781 -6.100 1.00 0.35 N ATOM 1473 CA ALA A 113 -6.505 8.357 -6.386 1.00 0.23 C ATOM 1474 C ALA A 113 -5.193 8.299 -7.170 1.00 0.25 C ATOM 1475 O ALA A 113 -4.388 7.406 -6.992 1.00 0.15 O ATOM 1476 CB ALA A 113 -7.627 7.735 -7.217 1.00 0.35 C ATOM 0 H ALA A 113 -7.749 10.091 -6.435 1.00 0.35 H new ATOM 0 HA ALA A 113 -6.398 7.805 -5.452 1.00 0.23 H new ATOM 0 HB1 ALA A 113 -7.388 6.693 -7.429 1.00 0.35 H new ATOM 0 HB2 ALA A 113 -8.563 7.787 -6.661 1.00 0.35 H new ATOM 0 HB3 ALA A 113 -7.731 8.281 -8.155 1.00 0.35 H new ATOM 1482 N ARG A 114 -4.973 9.250 -8.037 1.00 0.44 N ATOM 1483 CA ARG A 114 -3.715 9.258 -8.835 1.00 0.48 C ATOM 1484 C ARG A 114 -2.575 9.839 -7.993 1.00 0.51 C ATOM 1485 O ARG A 114 -1.415 9.576 -8.238 1.00 0.54 O ATOM 1486 CB ARG A 114 -3.910 10.120 -10.086 1.00 0.53 C ATOM 1487 CG ARG A 114 -3.995 9.222 -11.322 1.00 0.63 C ATOM 1488 CD ARG A 114 -5.360 9.398 -11.989 1.00 1.57 C ATOM 1489 NE ARG A 114 -5.289 8.922 -13.400 1.00 2.04 N ATOM 1490 CZ ARG A 114 -4.934 9.744 -14.347 1.00 1.46 C ATOM 1491 NH1 ARG A 114 -5.603 10.848 -14.536 1.00 1.85 N ATOM 1492 NH2 ARG A 114 -3.909 9.463 -15.106 1.00 0.79 N ATOM 0 H ARG A 114 -5.611 10.022 -8.227 1.00 0.44 H new ATOM 0 HA ARG A 114 -3.467 8.238 -9.128 1.00 0.48 H new ATOM 0 HB2 ARG A 114 -4.819 10.714 -9.992 1.00 0.53 H new ATOM 0 HB3 ARG A 114 -3.081 10.821 -10.190 1.00 0.53 H new ATOM 0 HG2 ARG A 114 -3.200 9.475 -12.024 1.00 0.63 H new ATOM 0 HG3 ARG A 114 -3.849 8.180 -11.038 1.00 0.63 H new ATOM 0 HD2 ARG A 114 -6.119 8.837 -11.443 1.00 1.57 H new ATOM 0 HD3 ARG A 114 -5.657 10.446 -11.962 1.00 1.57 H new ATOM 0 HE ARG A 114 -5.518 7.954 -13.624 1.00 2.04 H new ATOM 0 HH11 ARG A 114 -6.403 11.067 -13.943 1.00 1.85 H new ATOM 0 HH12 ARG A 114 -5.326 11.492 -15.277 1.00 1.85 H new ATOM 0 HH21 ARG A 114 -3.386 8.600 -14.958 1.00 0.79 H new ATOM 0 HH22 ARG A 114 -3.632 10.107 -15.847 1.00 0.79 H new ATOM 1506 N ALA A 115 -2.891 10.630 -7.005 1.00 0.52 N ATOM 1507 CA ALA A 115 -1.817 11.223 -6.158 1.00 0.56 C ATOM 1508 C ALA A 115 -1.181 10.131 -5.294 1.00 0.46 C ATOM 1509 O ALA A 115 -0.022 10.209 -4.937 1.00 0.54 O ATOM 1510 CB ALA A 115 -2.414 12.309 -5.259 1.00 0.63 C ATOM 0 H ALA A 115 -3.843 10.891 -6.748 1.00 0.52 H new ATOM 0 HA ALA A 115 -1.054 11.664 -6.799 1.00 0.56 H new ATOM 0 HB1 ALA A 115 -1.628 12.742 -4.640 1.00 0.63 H new ATOM 0 HB2 ALA A 115 -2.860 13.088 -5.877 1.00 0.63 H new ATOM 0 HB3 ALA A 115 -3.180 11.871 -4.619 1.00 0.63 H new ATOM 1516 N VAL A 116 -1.922 9.111 -4.955 1.00 0.31 N ATOM 1517 CA VAL A 116 -1.341 8.023 -4.120 1.00 0.24 C ATOM 1518 C VAL A 116 -0.739 6.946 -5.036 1.00 0.09 C ATOM 1519 O VAL A 116 0.257 6.329 -4.718 1.00 0.12 O ATOM 1520 CB VAL A 116 -2.434 7.414 -3.220 1.00 0.31 C ATOM 1521 CG1 VAL A 116 -3.357 6.492 -4.029 1.00 0.19 C ATOM 1522 CG2 VAL A 116 -1.772 6.607 -2.100 1.00 0.77 C ATOM 0 H VAL A 116 -2.899 8.985 -5.219 1.00 0.31 H new ATOM 0 HA VAL A 116 -0.555 8.429 -3.484 1.00 0.24 H new ATOM 0 HB VAL A 116 -3.031 8.224 -2.801 1.00 0.31 H new ATOM 0 HG11 VAL A 116 -4.120 6.074 -3.372 1.00 0.19 H new ATOM 0 HG12 VAL A 116 -3.836 7.063 -4.824 1.00 0.19 H new ATOM 0 HG13 VAL A 116 -2.771 5.683 -4.466 1.00 0.19 H new ATOM 0 HG21 VAL A 116 -2.541 6.174 -1.460 1.00 0.77 H new ATOM 0 HG22 VAL A 116 -1.169 5.809 -2.534 1.00 0.77 H new ATOM 0 HG23 VAL A 116 -1.134 7.263 -1.507 1.00 0.77 H new ATOM 1532 N GLN A 117 -1.352 6.716 -6.169 1.00 0.14 N ATOM 1533 CA GLN A 117 -0.841 5.680 -7.112 1.00 0.22 C ATOM 1534 C GLN A 117 0.440 6.174 -7.789 1.00 0.25 C ATOM 1535 O GLN A 117 1.498 5.606 -7.620 1.00 0.25 O ATOM 1536 CB GLN A 117 -1.902 5.405 -8.181 1.00 0.38 C ATOM 1537 CG GLN A 117 -1.760 3.967 -8.687 1.00 0.54 C ATOM 1538 CD GLN A 117 -1.286 3.973 -10.142 1.00 0.17 C ATOM 1539 OE1 GLN A 117 -0.932 5.004 -10.678 1.00 0.89 O ATOM 1540 NE2 GLN A 117 -1.263 2.852 -10.810 1.00 0.96 N ATOM 0 H GLN A 117 -2.190 7.206 -6.482 1.00 0.14 H new ATOM 0 HA GLN A 117 -0.624 4.767 -6.558 1.00 0.22 H new ATOM 0 HB2 GLN A 117 -2.898 5.559 -7.767 1.00 0.38 H new ATOM 0 HB3 GLN A 117 -1.789 6.105 -9.009 1.00 0.38 H new ATOM 0 HG2 GLN A 117 -1.049 3.422 -8.066 1.00 0.54 H new ATOM 0 HG3 GLN A 117 -2.715 3.448 -8.608 1.00 0.54 H new ATOM 0 HE21 GLN A 117 -1.560 1.985 -10.362 1.00 0.96 H new ATOM 0 HE22 GLN A 117 -0.948 2.843 -11.780 1.00 0.96 H new ATOM 1549 N MET A 118 0.344 7.223 -8.564 1.00 0.35 N ATOM 1550 CA MET A 118 1.548 7.763 -9.269 1.00 0.41 C ATOM 1551 C MET A 118 2.732 7.861 -8.301 1.00 0.42 C ATOM 1552 O MET A 118 3.862 7.588 -8.656 1.00 0.51 O ATOM 1553 CB MET A 118 1.226 9.156 -9.817 1.00 0.44 C ATOM 1554 CG MET A 118 0.069 9.063 -10.814 1.00 0.50 C ATOM 1555 SD MET A 118 0.483 9.991 -12.312 1.00 1.01 S ATOM 1556 CE MET A 118 -0.464 11.482 -11.921 1.00 1.80 C ATOM 0 H MET A 118 -0.522 7.733 -8.741 1.00 0.35 H new ATOM 0 HA MET A 118 1.814 7.091 -10.085 1.00 0.41 H new ATOM 0 HB2 MET A 118 0.961 9.827 -9.000 1.00 0.44 H new ATOM 0 HB3 MET A 118 2.105 9.578 -10.304 1.00 0.44 H new ATOM 0 HG2 MET A 118 -0.127 8.020 -11.063 1.00 0.50 H new ATOM 0 HG3 MET A 118 -0.842 9.461 -10.367 1.00 0.50 H new ATOM 0 HE1 MET A 118 -0.294 12.234 -12.692 1.00 1.80 H new ATOM 0 HE2 MET A 118 -1.526 11.238 -11.880 1.00 1.80 H new ATOM 0 HE3 MET A 118 -0.144 11.874 -10.955 1.00 1.80 H new ATOM 1566 N SER A 119 2.483 8.248 -7.081 1.00 0.34 N ATOM 1567 CA SER A 119 3.595 8.361 -6.097 1.00 0.35 C ATOM 1568 C SER A 119 4.097 6.962 -5.732 1.00 0.38 C ATOM 1569 O SER A 119 5.285 6.722 -5.642 1.00 0.36 O ATOM 1570 CB SER A 119 3.089 9.067 -4.838 1.00 0.30 C ATOM 1571 OG SER A 119 2.864 10.440 -5.127 1.00 1.20 O ATOM 0 H SER A 119 1.559 8.491 -6.723 1.00 0.34 H new ATOM 0 HA SER A 119 4.411 8.936 -6.534 1.00 0.35 H new ATOM 0 HB2 SER A 119 2.167 8.601 -4.492 1.00 0.30 H new ATOM 0 HB3 SER A 119 3.818 8.968 -4.034 1.00 0.30 H new ATOM 0 HG SER A 119 1.902 10.625 -5.106 1.00 1.20 H new ATOM 1577 N THR A 120 3.202 6.037 -5.521 1.00 0.43 N ATOM 1578 CA THR A 120 3.626 4.655 -5.160 1.00 0.46 C ATOM 1579 C THR A 120 4.408 4.036 -6.322 1.00 0.50 C ATOM 1580 O THR A 120 5.171 3.109 -6.140 1.00 0.53 O ATOM 1581 CB THR A 120 2.395 3.806 -4.850 1.00 0.45 C ATOM 1582 OG1 THR A 120 1.503 3.841 -5.956 1.00 1.28 O ATOM 1583 CG2 THR A 120 1.694 4.360 -3.608 1.00 0.62 C ATOM 0 H THR A 120 2.194 6.179 -5.583 1.00 0.43 H new ATOM 0 HA THR A 120 4.266 4.691 -4.279 1.00 0.46 H new ATOM 0 HB THR A 120 2.701 2.776 -4.665 1.00 0.45 H new ATOM 0 HG1 THR A 120 1.816 4.503 -6.608 1.00 1.28 H new ATOM 0 HG21 THR A 120 0.815 3.755 -3.386 1.00 0.62 H new ATOM 0 HG22 THR A 120 2.379 4.331 -2.760 1.00 0.62 H new ATOM 0 HG23 THR A 120 1.388 5.390 -3.792 1.00 0.62 H new ATOM 1591 N LYS A 121 4.251 4.558 -7.509 1.00 0.50 N ATOM 1592 CA LYS A 121 5.017 4.014 -8.662 1.00 0.53 C ATOM 1593 C LYS A 121 6.398 4.642 -8.609 1.00 0.49 C ATOM 1594 O LYS A 121 7.392 4.033 -8.949 1.00 0.45 O ATOM 1595 CB LYS A 121 4.324 4.392 -9.975 1.00 0.55 C ATOM 1596 CG LYS A 121 3.170 3.423 -10.240 1.00 0.82 C ATOM 1597 CD LYS A 121 2.563 3.714 -11.614 1.00 1.95 C ATOM 1598 CE LYS A 121 3.524 3.243 -12.708 1.00 1.26 C ATOM 1599 NZ LYS A 121 2.797 3.168 -14.007 1.00 2.00 N ATOM 0 H LYS A 121 3.627 5.335 -7.727 1.00 0.50 H new ATOM 0 HA LYS A 121 5.078 2.927 -8.612 1.00 0.53 H new ATOM 0 HB2 LYS A 121 3.949 5.414 -9.920 1.00 0.55 H new ATOM 0 HB3 LYS A 121 5.038 4.358 -10.798 1.00 0.55 H new ATOM 0 HG2 LYS A 121 3.529 2.394 -10.200 1.00 0.82 H new ATOM 0 HG3 LYS A 121 2.410 3.526 -9.466 1.00 0.82 H new ATOM 0 HD2 LYS A 121 1.604 3.206 -11.714 1.00 1.95 H new ATOM 0 HD3 LYS A 121 2.371 4.782 -11.719 1.00 1.95 H new ATOM 0 HE2 LYS A 121 4.366 3.931 -12.789 1.00 1.26 H new ATOM 0 HE3 LYS A 121 3.934 2.266 -12.451 1.00 1.26 H new ATOM 0 HZ1 LYS A 121 3.449 2.848 -14.752 1.00 2.00 H new ATOM 0 HZ2 LYS A 121 2.008 2.495 -13.925 1.00 2.00 H new ATOM 0 HZ3 LYS A 121 2.426 4.108 -14.252 1.00 2.00 H new ATOM 1613 N VAL A 122 6.462 5.860 -8.151 1.00 0.47 N ATOM 1614 CA VAL A 122 7.770 6.541 -8.028 1.00 0.41 C ATOM 1615 C VAL A 122 8.576 5.843 -6.929 1.00 0.40 C ATOM 1616 O VAL A 122 9.786 5.894 -6.907 1.00 0.32 O ATOM 1617 CB VAL A 122 7.542 8.005 -7.663 1.00 0.39 C ATOM 1618 CG1 VAL A 122 8.880 8.736 -7.638 1.00 0.51 C ATOM 1619 CG2 VAL A 122 6.630 8.649 -8.707 1.00 0.37 C ATOM 0 H VAL A 122 5.657 6.413 -7.856 1.00 0.47 H new ATOM 0 HA VAL A 122 8.316 6.494 -8.970 1.00 0.41 H new ATOM 0 HB VAL A 122 7.075 8.069 -6.680 1.00 0.39 H new ATOM 0 HG11 VAL A 122 8.718 9.782 -7.377 1.00 0.51 H new ATOM 0 HG12 VAL A 122 9.533 8.274 -6.897 1.00 0.51 H new ATOM 0 HG13 VAL A 122 9.346 8.675 -8.621 1.00 0.51 H new ATOM 0 HG21 VAL A 122 6.465 9.695 -8.450 1.00 0.37 H new ATOM 0 HG22 VAL A 122 7.100 8.587 -9.689 1.00 0.37 H new ATOM 0 HG23 VAL A 122 5.674 8.125 -8.728 1.00 0.37 H new ATOM 1629 N LEU A 123 7.905 5.174 -6.026 1.00 0.50 N ATOM 1630 CA LEU A 123 8.625 4.449 -4.942 1.00 0.53 C ATOM 1631 C LEU A 123 9.157 3.135 -5.512 1.00 0.55 C ATOM 1632 O LEU A 123 10.203 2.653 -5.134 1.00 0.53 O ATOM 1633 CB LEU A 123 7.652 4.138 -3.799 1.00 0.73 C ATOM 1634 CG LEU A 123 7.860 5.128 -2.655 1.00 0.56 C ATOM 1635 CD1 LEU A 123 9.301 5.038 -2.150 1.00 1.07 C ATOM 1636 CD2 LEU A 123 7.581 6.545 -3.156 1.00 0.19 C ATOM 0 H LEU A 123 6.888 5.100 -5.995 1.00 0.50 H new ATOM 0 HA LEU A 123 9.444 5.062 -4.564 1.00 0.53 H new ATOM 0 HB2 LEU A 123 6.625 4.195 -4.159 1.00 0.73 H new ATOM 0 HB3 LEU A 123 7.809 3.120 -3.443 1.00 0.73 H new ATOM 0 HG LEU A 123 7.179 4.888 -1.839 1.00 0.56 H new ATOM 0 HD11 LEU A 123 9.445 5.746 -1.334 1.00 1.07 H new ATOM 0 HD12 LEU A 123 9.499 4.027 -1.793 1.00 1.07 H new ATOM 0 HD13 LEU A 123 9.987 5.277 -2.963 1.00 1.07 H new ATOM 0 HD21 LEU A 123 7.729 7.254 -2.342 1.00 0.19 H new ATOM 0 HD22 LEU A 123 8.263 6.783 -3.973 1.00 0.19 H new ATOM 0 HD23 LEU A 123 6.553 6.609 -3.511 1.00 0.19 H new ATOM 1648 N ILE A 124 8.421 2.557 -6.421 1.00 0.62 N ATOM 1649 CA ILE A 124 8.839 1.268 -7.039 1.00 0.70 C ATOM 1650 C ILE A 124 10.089 1.478 -7.895 1.00 0.63 C ATOM 1651 O ILE A 124 11.026 0.707 -7.840 1.00 0.61 O ATOM 1652 CB ILE A 124 7.695 0.755 -7.916 1.00 0.83 C ATOM 1653 CG1 ILE A 124 6.462 0.499 -7.044 1.00 0.82 C ATOM 1654 CG2 ILE A 124 8.109 -0.546 -8.599 1.00 0.79 C ATOM 1655 CD1 ILE A 124 5.214 0.459 -7.927 1.00 0.96 C ATOM 0 H ILE A 124 7.536 2.929 -6.766 1.00 0.62 H new ATOM 0 HA ILE A 124 9.068 0.542 -6.259 1.00 0.70 H new ATOM 0 HB ILE A 124 7.461 1.502 -8.675 1.00 0.83 H new ATOM 0 HG12 ILE A 124 6.572 -0.444 -6.508 1.00 0.82 H new ATOM 0 HG13 ILE A 124 6.365 1.283 -6.293 1.00 0.82 H new ATOM 0 HG21 ILE A 124 7.290 -0.906 -9.222 1.00 0.79 H new ATOM 0 HG22 ILE A 124 8.987 -0.367 -9.220 1.00 0.79 H new ATOM 0 HG23 ILE A 124 8.346 -1.294 -7.843 1.00 0.79 H new ATOM 0 HD11 ILE A 124 4.336 0.277 -7.308 1.00 0.96 H new ATOM 0 HD12 ILE A 124 5.103 1.413 -8.443 1.00 0.96 H new ATOM 0 HD13 ILE A 124 5.313 -0.341 -8.661 1.00 0.96 H new ATOM 1667 N GLN A 125 10.113 2.513 -8.688 1.00 0.61 N ATOM 1668 CA GLN A 125 11.294 2.769 -9.544 1.00 0.56 C ATOM 1669 C GLN A 125 12.444 3.289 -8.681 1.00 0.40 C ATOM 1670 O GLN A 125 13.560 2.816 -8.764 1.00 0.26 O ATOM 1671 CB GLN A 125 10.915 3.813 -10.590 1.00 0.58 C ATOM 1672 CG GLN A 125 10.336 3.110 -11.818 1.00 0.71 C ATOM 1673 CD GLN A 125 10.055 4.138 -12.915 1.00 1.07 C ATOM 1674 OE1 GLN A 125 8.948 4.622 -13.042 1.00 1.83 O ATOM 1675 NE2 GLN A 125 11.018 4.495 -13.721 1.00 1.42 N ATOM 0 H GLN A 125 9.359 3.194 -8.777 1.00 0.61 H new ATOM 0 HA GLN A 125 11.611 1.850 -10.037 1.00 0.56 H new ATOM 0 HB2 GLN A 125 10.185 4.510 -10.178 1.00 0.58 H new ATOM 0 HB3 GLN A 125 11.791 4.398 -10.871 1.00 0.58 H new ATOM 0 HG2 GLN A 125 11.036 2.357 -12.182 1.00 0.71 H new ATOM 0 HG3 GLN A 125 9.417 2.588 -11.551 1.00 0.71 H new ATOM 0 HE21 GLN A 125 11.948 4.089 -13.616 1.00 1.42 H new ATOM 0 HE22 GLN A 125 10.840 5.179 -14.456 1.00 1.42 H new ATOM 1684 N PHE A 126 12.177 4.256 -7.850 1.00 0.43 N ATOM 1685 CA PHE A 126 13.249 4.807 -6.977 1.00 0.29 C ATOM 1686 C PHE A 126 13.715 3.733 -5.987 1.00 0.32 C ATOM 1687 O PHE A 126 14.763 3.851 -5.387 1.00 0.47 O ATOM 1688 CB PHE A 126 12.709 6.014 -6.203 1.00 0.43 C ATOM 1689 CG PHE A 126 12.715 7.233 -7.096 1.00 0.52 C ATOM 1690 CD1 PHE A 126 11.892 7.276 -8.228 1.00 0.47 C ATOM 1691 CD2 PHE A 126 13.543 8.320 -6.792 1.00 0.85 C ATOM 1692 CE1 PHE A 126 11.896 8.405 -9.055 1.00 0.52 C ATOM 1693 CE2 PHE A 126 13.547 9.450 -7.619 1.00 0.98 C ATOM 1694 CZ PHE A 126 12.723 9.492 -8.751 1.00 0.75 C ATOM 0 H PHE A 126 11.261 4.690 -7.737 1.00 0.43 H new ATOM 0 HA PHE A 126 14.091 5.117 -7.595 1.00 0.29 H new ATOM 0 HB2 PHE A 126 11.696 5.811 -5.854 1.00 0.43 H new ATOM 0 HB3 PHE A 126 13.321 6.195 -5.319 1.00 0.43 H new ATOM 0 HD1 PHE A 126 11.254 6.437 -8.463 1.00 0.47 H new ATOM 0 HD2 PHE A 126 14.179 8.287 -5.920 1.00 0.85 H new ATOM 0 HE1 PHE A 126 11.261 8.437 -9.928 1.00 0.52 H new ATOM 0 HE2 PHE A 126 14.185 10.289 -7.384 1.00 0.98 H new ATOM 0 HZ PHE A 126 12.726 10.363 -9.389 1.00 0.75 H new ATOM 1704 N LEU A 127 12.950 2.687 -5.806 1.00 0.59 N ATOM 1705 CA LEU A 127 13.362 1.616 -4.854 1.00 0.67 C ATOM 1706 C LEU A 127 14.331 0.657 -5.546 1.00 0.36 C ATOM 1707 O LEU A 127 15.451 0.469 -5.112 1.00 0.35 O ATOM 1708 CB LEU A 127 12.130 0.835 -4.391 1.00 1.02 C ATOM 1709 CG LEU A 127 11.558 1.482 -3.131 1.00 1.38 C ATOM 1710 CD1 LEU A 127 10.219 0.831 -2.784 1.00 2.13 C ATOM 1711 CD2 LEU A 127 12.535 1.279 -1.973 1.00 1.19 C ATOM 0 H LEU A 127 12.059 2.530 -6.277 1.00 0.59 H new ATOM 0 HA LEU A 127 13.850 2.073 -3.994 1.00 0.67 H new ATOM 0 HB2 LEU A 127 11.377 0.822 -5.179 1.00 1.02 H new ATOM 0 HB3 LEU A 127 12.399 -0.202 -4.190 1.00 1.02 H new ATOM 0 HG LEU A 127 11.409 2.548 -3.304 1.00 1.38 H new ATOM 0 HD11 LEU A 127 9.812 1.293 -1.885 1.00 2.13 H new ATOM 0 HD12 LEU A 127 9.522 0.969 -3.611 1.00 2.13 H new ATOM 0 HD13 LEU A 127 10.367 -0.235 -2.609 1.00 2.13 H new ATOM 0 HD21 LEU A 127 12.131 1.739 -1.071 1.00 1.19 H new ATOM 0 HD22 LEU A 127 12.680 0.212 -1.802 1.00 1.19 H new ATOM 0 HD23 LEU A 127 13.491 1.741 -2.219 1.00 1.19 H new ATOM 1723 N GLN A 128 13.908 0.043 -6.616 1.00 0.33 N ATOM 1724 CA GLN A 128 14.803 -0.908 -7.332 1.00 0.21 C ATOM 1725 C GLN A 128 16.087 -0.183 -7.747 1.00 0.14 C ATOM 1726 O GLN A 128 17.144 -0.776 -7.836 1.00 0.31 O ATOM 1727 CB GLN A 128 14.097 -1.439 -8.581 1.00 0.52 C ATOM 1728 CG GLN A 128 13.045 -2.476 -8.178 1.00 0.55 C ATOM 1729 CD GLN A 128 12.090 -2.713 -9.349 1.00 0.47 C ATOM 1730 OE1 GLN A 128 10.923 -2.989 -9.152 1.00 1.77 O ATOM 1731 NE2 GLN A 128 12.539 -2.617 -10.571 1.00 0.94 N ATOM 0 H GLN A 128 12.981 0.159 -7.025 1.00 0.33 H new ATOM 0 HA GLN A 128 15.047 -1.740 -6.672 1.00 0.21 H new ATOM 0 HB2 GLN A 128 13.624 -0.618 -9.120 1.00 0.52 H new ATOM 0 HB3 GLN A 128 14.824 -1.888 -9.258 1.00 0.52 H new ATOM 0 HG2 GLN A 128 13.529 -3.410 -7.895 1.00 0.55 H new ATOM 0 HG3 GLN A 128 12.490 -2.128 -7.307 1.00 0.55 H new ATOM 0 HE21 GLN A 128 13.518 -2.385 -10.738 1.00 0.94 H new ATOM 0 HE22 GLN A 128 11.911 -2.774 -11.359 1.00 0.94 H new ATOM 1740 N LYS A 129 16.000 1.095 -8.005 1.00 0.19 N ATOM 1741 CA LYS A 129 17.211 1.858 -8.419 1.00 0.43 C ATOM 1742 C LYS A 129 18.040 2.218 -7.185 1.00 0.48 C ATOM 1743 O LYS A 129 19.252 2.132 -7.196 1.00 0.60 O ATOM 1744 CB LYS A 129 16.788 3.142 -9.136 1.00 0.59 C ATOM 1745 CG LYS A 129 16.788 2.908 -10.647 1.00 0.51 C ATOM 1746 CD LYS A 129 15.367 3.079 -11.187 1.00 0.68 C ATOM 1747 CE LYS A 129 15.360 2.828 -12.696 1.00 1.53 C ATOM 1748 NZ LYS A 129 14.842 1.458 -12.968 1.00 3.09 N ATOM 0 H LYS A 129 15.142 1.643 -7.947 1.00 0.19 H new ATOM 0 HA LYS A 129 17.809 1.244 -9.092 1.00 0.43 H new ATOM 0 HB2 LYS A 129 15.795 3.446 -8.805 1.00 0.59 H new ATOM 0 HB3 LYS A 129 17.470 3.954 -8.883 1.00 0.59 H new ATOM 0 HG2 LYS A 129 17.462 3.612 -11.135 1.00 0.51 H new ATOM 0 HG3 LYS A 129 17.156 1.907 -10.871 1.00 0.51 H new ATOM 0 HD2 LYS A 129 14.691 2.384 -10.689 1.00 0.68 H new ATOM 0 HD3 LYS A 129 15.004 4.084 -10.973 1.00 0.68 H new ATOM 0 HE2 LYS A 129 14.737 3.570 -13.196 1.00 1.53 H new ATOM 0 HE3 LYS A 129 16.368 2.934 -13.098 1.00 1.53 H new ATOM 0 HZ1 LYS A 129 14.837 1.286 -13.994 1.00 3.09 H new ATOM 0 HZ2 LYS A 129 15.453 0.757 -12.503 1.00 3.09 H new ATOM 0 HZ3 LYS A 129 13.874 1.373 -12.598 1.00 3.09 H new ATOM 1762 N LYS A 130 17.400 2.624 -6.122 1.00 0.51 N ATOM 1763 CA LYS A 130 18.166 2.987 -4.896 1.00 0.61 C ATOM 1764 C LYS A 130 18.560 1.722 -4.129 1.00 0.26 C ATOM 1765 O LYS A 130 19.179 1.793 -3.085 1.00 0.35 O ATOM 1766 CB LYS A 130 17.320 3.915 -4.003 1.00 1.01 C ATOM 1767 CG LYS A 130 16.229 3.123 -3.269 1.00 1.99 C ATOM 1768 CD LYS A 130 16.651 2.907 -1.814 1.00 2.08 C ATOM 1769 CE LYS A 130 15.912 1.696 -1.241 1.00 2.94 C ATOM 1770 NZ LYS A 130 16.473 0.448 -1.829 1.00 3.62 N ATOM 0 H LYS A 130 16.387 2.720 -6.049 1.00 0.51 H new ATOM 0 HA LYS A 130 19.075 3.514 -5.187 1.00 0.61 H new ATOM 0 HB2 LYS A 130 17.963 4.414 -3.278 1.00 1.01 H new ATOM 0 HB3 LYS A 130 16.862 4.694 -4.612 1.00 1.01 H new ATOM 0 HG2 LYS A 130 15.283 3.663 -3.309 1.00 1.99 H new ATOM 0 HG3 LYS A 130 16.069 2.163 -3.759 1.00 1.99 H new ATOM 0 HD2 LYS A 130 17.728 2.749 -1.756 1.00 2.08 H new ATOM 0 HD3 LYS A 130 16.427 3.796 -1.224 1.00 2.08 H new ATOM 0 HE2 LYS A 130 16.011 1.676 -0.156 1.00 2.94 H new ATOM 0 HE3 LYS A 130 14.847 1.768 -1.462 1.00 2.94 H new ATOM 0 HZ1 LYS A 130 15.849 -0.353 -1.603 1.00 3.62 H new ATOM 0 HZ2 LYS A 130 16.543 0.552 -2.861 1.00 3.62 H new ATOM 0 HZ3 LYS A 130 17.419 0.272 -1.433 1.00 3.62 H new ATOM 1784 N ALA A 131 18.224 0.564 -4.634 1.00 0.16 N ATOM 1785 CA ALA A 131 18.606 -0.682 -3.922 1.00 0.35 C ATOM 1786 C ALA A 131 19.999 -1.115 -4.385 1.00 0.73 C ATOM 1787 O ALA A 131 20.234 -2.269 -4.685 1.00 1.14 O ATOM 1788 CB ALA A 131 17.590 -1.788 -4.222 1.00 0.30 C ATOM 0 H ALA A 131 17.705 0.431 -5.502 1.00 0.16 H new ATOM 0 HA ALA A 131 18.617 -0.500 -2.847 1.00 0.35 H new ATOM 0 HB1 ALA A 131 17.877 -2.698 -3.696 1.00 0.30 H new ATOM 0 HB2 ALA A 131 16.601 -1.473 -3.889 1.00 0.30 H new ATOM 0 HB3 ALA A 131 17.568 -1.980 -5.295 1.00 0.30 H new ATOM 1794 N LYS A 132 20.933 -0.198 -4.440 1.00 0.64 N ATOM 1795 CA LYS A 132 22.308 -0.572 -4.866 1.00 1.06 C ATOM 1796 C LYS A 132 22.904 -1.481 -3.792 1.00 1.13 C ATOM 1797 O LYS A 132 22.677 -1.287 -2.614 1.00 1.21 O ATOM 1798 CB LYS A 132 23.163 0.689 -5.015 1.00 1.46 C ATOM 1799 CG LYS A 132 23.014 1.562 -3.767 1.00 1.36 C ATOM 1800 CD LYS A 132 24.402 1.928 -3.236 1.00 1.63 C ATOM 1801 CE LYS A 132 24.333 2.136 -1.722 1.00 1.62 C ATOM 1802 NZ LYS A 132 24.612 3.564 -1.403 1.00 1.98 N ATOM 0 H LYS A 132 20.800 0.787 -4.209 1.00 0.64 H new ATOM 0 HA LYS A 132 22.282 -1.089 -5.825 1.00 1.06 H new ATOM 0 HB2 LYS A 132 24.209 0.417 -5.158 1.00 1.46 H new ATOM 0 HB3 LYS A 132 22.855 1.246 -5.900 1.00 1.46 H new ATOM 0 HG2 LYS A 132 22.454 2.466 -4.006 1.00 1.36 H new ATOM 0 HG3 LYS A 132 22.448 1.030 -3.002 1.00 1.36 H new ATOM 0 HD2 LYS A 132 25.113 1.137 -3.473 1.00 1.63 H new ATOM 0 HD3 LYS A 132 24.761 2.835 -3.722 1.00 1.63 H new ATOM 0 HE2 LYS A 132 23.348 1.855 -1.350 1.00 1.62 H new ATOM 0 HE3 LYS A 132 25.057 1.493 -1.223 1.00 1.62 H new ATOM 0 HZ1 LYS A 132 24.565 3.705 -0.374 1.00 1.98 H new ATOM 0 HZ2 LYS A 132 25.561 3.817 -1.744 1.00 1.98 H new ATOM 0 HZ3 LYS A 132 23.905 4.168 -1.868 1.00 1.98 H new ATOM 1816 N ASN A 133 23.639 -2.485 -4.177 1.00 1.20 N ATOM 1817 CA ASN A 133 24.210 -3.411 -3.158 1.00 1.33 C ATOM 1818 C ASN A 133 23.057 -3.997 -2.346 1.00 1.12 C ATOM 1819 O ASN A 133 23.149 -4.206 -1.152 1.00 1.40 O ATOM 1820 CB ASN A 133 25.165 -2.646 -2.238 1.00 1.76 C ATOM 1821 CG ASN A 133 26.462 -2.343 -2.992 1.00 3.07 C ATOM 1822 OD1 ASN A 133 26.514 -2.451 -4.202 1.00 4.05 O ATOM 1823 ND2 ASN A 133 27.518 -1.964 -2.326 1.00 3.34 N ATOM 0 H ASN A 133 23.869 -2.705 -5.146 1.00 1.20 H new ATOM 0 HA ASN A 133 24.768 -4.211 -3.645 1.00 1.33 H new ATOM 0 HB2 ASN A 133 24.700 -1.718 -1.903 1.00 1.76 H new ATOM 0 HB3 ASN A 133 25.379 -3.235 -1.346 1.00 1.76 H new ATOM 0 HD21 ASN A 133 28.386 -1.759 -2.820 1.00 3.34 H new ATOM 0 HD22 ASN A 133 27.475 -1.873 -1.311 1.00 3.34 H new ATOM 1830 N LEU A 134 21.968 -4.256 -3.010 1.00 0.74 N ATOM 1831 CA LEU A 134 20.771 -4.824 -2.334 1.00 0.75 C ATOM 1832 C LEU A 134 20.297 -6.049 -3.115 1.00 0.99 C ATOM 1833 O LEU A 134 21.076 -6.717 -3.767 1.00 1.41 O ATOM 1834 CB LEU A 134 19.672 -3.756 -2.278 1.00 0.70 C ATOM 1835 CG LEU A 134 19.179 -3.591 -0.836 1.00 1.05 C ATOM 1836 CD1 LEU A 134 18.670 -4.928 -0.292 1.00 1.18 C ATOM 1837 CD2 LEU A 134 20.333 -3.095 0.039 1.00 3.15 C ATOM 0 H LEU A 134 21.855 -4.095 -4.011 1.00 0.74 H new ATOM 0 HA LEU A 134 21.014 -5.127 -1.316 1.00 0.75 H new ATOM 0 HB2 LEU A 134 20.056 -2.807 -2.651 1.00 0.70 H new ATOM 0 HB3 LEU A 134 18.842 -4.041 -2.925 1.00 0.70 H new ATOM 0 HG LEU A 134 18.363 -2.869 -0.821 1.00 1.05 H new ATOM 0 HD11 LEU A 134 18.323 -4.795 0.733 1.00 1.18 H new ATOM 0 HD12 LEU A 134 17.846 -5.283 -0.911 1.00 1.18 H new ATOM 0 HD13 LEU A 134 19.478 -5.659 -0.310 1.00 1.18 H new ATOM 0 HD21 LEU A 134 19.986 -2.976 1.066 1.00 3.15 H new ATOM 0 HD22 LEU A 134 21.147 -3.819 0.012 1.00 3.15 H new ATOM 0 HD23 LEU A 134 20.688 -2.136 -0.337 1.00 3.15 H new ATOM 1849 N ASP A 135 19.040 -6.366 -3.043 1.00 1.04 N ATOM 1850 CA ASP A 135 18.540 -7.565 -3.773 1.00 1.68 C ATOM 1851 C ASP A 135 17.608 -7.158 -4.899 1.00 0.98 C ATOM 1852 O ASP A 135 17.530 -7.814 -5.917 1.00 1.19 O ATOM 1853 CB ASP A 135 17.796 -8.485 -2.801 1.00 2.47 C ATOM 1854 CG ASP A 135 18.787 -9.444 -2.139 1.00 3.51 C ATOM 1855 OD1 ASP A 135 19.663 -9.932 -2.835 1.00 3.65 O ATOM 1856 OD2 ASP A 135 18.654 -9.674 -0.949 1.00 4.38 O ATOM 0 H ASP A 135 18.336 -5.852 -2.513 1.00 1.04 H new ATOM 0 HA ASP A 135 19.393 -8.092 -4.200 1.00 1.68 H new ATOM 0 HB2 ASP A 135 17.286 -7.892 -2.042 1.00 2.47 H new ATOM 0 HB3 ASP A 135 17.030 -9.049 -3.333 1.00 2.47 H new ATOM 1861 N ALA A 136 16.886 -6.099 -4.695 1.00 1.35 N ATOM 1862 CA ALA A 136 15.902 -5.597 -5.704 1.00 1.44 C ATOM 1863 C ALA A 136 14.552 -6.246 -5.441 1.00 1.13 C ATOM 1864 O ALA A 136 13.511 -5.692 -5.734 1.00 1.48 O ATOM 1865 CB ALA A 136 16.354 -5.875 -7.146 1.00 1.42 C ATOM 0 H ALA A 136 16.934 -5.538 -3.845 1.00 1.35 H new ATOM 0 HA ALA A 136 15.828 -4.515 -5.599 1.00 1.44 H new ATOM 0 HB1 ALA A 136 15.607 -5.492 -7.842 1.00 1.42 H new ATOM 0 HB2 ALA A 136 17.308 -5.381 -7.330 1.00 1.42 H new ATOM 0 HB3 ALA A 136 16.468 -6.949 -7.291 1.00 1.42 H new ATOM 1871 N ILE A 137 14.566 -7.396 -4.844 1.00 0.92 N ATOM 1872 CA ILE A 137 13.313 -8.083 -4.491 1.00 0.65 C ATOM 1873 C ILE A 137 12.459 -8.363 -5.740 1.00 0.73 C ATOM 1874 O ILE A 137 11.312 -8.752 -5.640 1.00 0.48 O ATOM 1875 CB ILE A 137 12.580 -7.199 -3.469 1.00 0.87 C ATOM 1876 CG1 ILE A 137 13.313 -7.279 -2.120 1.00 1.29 C ATOM 1877 CG2 ILE A 137 11.138 -7.668 -3.277 1.00 0.68 C ATOM 1878 CD1 ILE A 137 14.739 -6.725 -2.244 1.00 1.37 C ATOM 0 H ILE A 137 15.415 -7.897 -4.582 1.00 0.92 H new ATOM 0 HA ILE A 137 13.518 -9.059 -4.052 1.00 0.65 H new ATOM 0 HB ILE A 137 12.569 -6.174 -3.840 1.00 0.87 H new ATOM 0 HG12 ILE A 137 12.762 -6.715 -1.367 1.00 1.29 H new ATOM 0 HG13 ILE A 137 13.348 -8.314 -1.780 1.00 1.29 H new ATOM 0 HG21 ILE A 137 10.641 -7.027 -2.549 1.00 0.68 H new ATOM 0 HG22 ILE A 137 10.609 -7.616 -4.228 1.00 0.68 H new ATOM 0 HG23 ILE A 137 11.135 -8.697 -2.916 1.00 0.68 H new ATOM 0 HD11 ILE A 137 15.240 -6.791 -1.278 1.00 1.37 H new ATOM 0 HD12 ILE A 137 15.293 -7.307 -2.981 1.00 1.37 H new ATOM 0 HD13 ILE A 137 14.698 -5.683 -2.561 1.00 1.37 H new ATOM 1890 N THR A 138 13.015 -8.209 -6.916 1.00 1.40 N ATOM 1891 CA THR A 138 12.240 -8.496 -8.161 1.00 1.85 C ATOM 1892 C THR A 138 10.828 -7.900 -8.062 1.00 1.74 C ATOM 1893 O THR A 138 10.600 -6.938 -7.356 1.00 1.61 O ATOM 1894 CB THR A 138 12.149 -10.012 -8.354 1.00 2.07 C ATOM 1895 OG1 THR A 138 13.193 -10.644 -7.624 1.00 2.14 O ATOM 1896 CG2 THR A 138 12.285 -10.349 -9.840 1.00 2.62 C ATOM 0 H THR A 138 13.974 -7.896 -7.067 1.00 1.40 H new ATOM 0 HA THR A 138 12.748 -8.043 -9.013 1.00 1.85 H new ATOM 0 HB THR A 138 11.185 -10.368 -7.991 1.00 2.07 H new ATOM 0 HG1 THR A 138 13.135 -11.615 -7.745 1.00 2.14 H new ATOM 0 HG21 THR A 138 12.220 -11.429 -9.976 1.00 2.62 H new ATOM 0 HG22 THR A 138 11.484 -9.864 -10.398 1.00 2.62 H new ATOM 0 HG23 THR A 138 13.248 -9.995 -10.207 1.00 2.62 H new ATOM 1904 N THR A 139 9.878 -8.471 -8.750 1.00 1.80 N ATOM 1905 CA THR A 139 8.488 -7.944 -8.678 1.00 1.71 C ATOM 1906 C THR A 139 7.515 -9.036 -9.157 1.00 1.71 C ATOM 1907 O THR A 139 7.866 -9.829 -10.007 1.00 1.87 O ATOM 1908 CB THR A 139 8.378 -6.686 -9.557 1.00 1.86 C ATOM 1909 OG1 THR A 139 7.187 -5.984 -9.235 1.00 1.74 O ATOM 1910 CG2 THR A 139 8.360 -7.064 -11.042 1.00 2.02 C ATOM 0 H THR A 139 10.005 -9.280 -9.359 1.00 1.80 H new ATOM 0 HA THR A 139 8.234 -7.673 -7.653 1.00 1.71 H new ATOM 0 HB THR A 139 9.244 -6.053 -9.367 1.00 1.86 H new ATOM 0 HG1 THR A 139 7.010 -5.307 -9.922 1.00 1.74 H new ATOM 0 HG21 THR A 139 8.282 -6.160 -11.647 1.00 2.02 H new ATOM 0 HG22 THR A 139 9.280 -7.591 -11.294 1.00 2.02 H new ATOM 0 HG23 THR A 139 7.505 -7.710 -11.243 1.00 2.02 H new ATOM 1918 N PRO A 140 6.321 -9.056 -8.601 1.00 1.58 N ATOM 1919 CA PRO A 140 5.306 -10.057 -8.974 1.00 1.58 C ATOM 1920 C PRO A 140 4.710 -9.736 -10.341 1.00 1.92 C ATOM 1921 O PRO A 140 4.128 -8.691 -10.555 1.00 2.23 O ATOM 1922 CB PRO A 140 4.257 -9.949 -7.865 1.00 1.43 C ATOM 1923 CG PRO A 140 4.431 -8.548 -7.237 1.00 1.48 C ATOM 1924 CD PRO A 140 5.866 -8.097 -7.566 1.00 1.47 C ATOM 0 HA PRO A 140 5.712 -11.065 -9.060 1.00 1.58 H new ATOM 0 HB2 PRO A 140 3.252 -10.072 -8.268 1.00 1.43 H new ATOM 0 HB3 PRO A 140 4.399 -10.730 -7.118 1.00 1.43 H new ATOM 0 HG2 PRO A 140 3.701 -7.847 -7.643 1.00 1.48 H new ATOM 0 HG3 PRO A 140 4.273 -8.584 -6.159 1.00 1.48 H new ATOM 0 HD2 PRO A 140 5.886 -7.072 -7.937 1.00 1.47 H new ATOM 0 HD3 PRO A 140 6.506 -8.130 -6.684 1.00 1.47 H new ATOM 1932 N ASP A 141 4.856 -10.645 -11.266 1.00 1.92 N ATOM 1933 CA ASP A 141 4.312 -10.442 -12.638 1.00 2.30 C ATOM 1934 C ASP A 141 2.868 -9.915 -12.559 1.00 1.67 C ATOM 1935 O ASP A 141 2.146 -10.258 -11.644 1.00 1.32 O ATOM 1936 CB ASP A 141 4.319 -11.793 -13.356 1.00 2.78 C ATOM 1937 CG ASP A 141 4.745 -11.610 -14.813 1.00 3.56 C ATOM 1938 OD1 ASP A 141 5.914 -11.343 -15.038 1.00 3.95 O ATOM 1939 OD2 ASP A 141 3.896 -11.740 -15.679 1.00 3.86 O ATOM 0 H ASP A 141 5.337 -11.534 -11.126 1.00 1.92 H new ATOM 0 HA ASP A 141 4.921 -9.717 -13.177 1.00 2.30 H new ATOM 0 HB2 ASP A 141 5.001 -12.478 -12.853 1.00 2.78 H new ATOM 0 HB3 ASP A 141 3.327 -12.242 -13.312 1.00 2.78 H new ATOM 1944 N PRO A 142 2.477 -9.104 -13.519 1.00 1.70 N ATOM 1945 CA PRO A 142 1.116 -8.543 -13.554 1.00 1.32 C ATOM 1946 C PRO A 142 0.109 -9.618 -13.981 1.00 1.11 C ATOM 1947 O PRO A 142 -1.084 -9.462 -13.810 1.00 0.90 O ATOM 1948 CB PRO A 142 1.210 -7.414 -14.584 1.00 1.87 C ATOM 1949 CG PRO A 142 2.433 -7.736 -15.473 1.00 2.41 C ATOM 1950 CD PRO A 142 3.335 -8.673 -14.650 1.00 2.32 C ATOM 0 HA PRO A 142 0.772 -8.183 -12.584 1.00 1.32 H new ATOM 0 HB2 PRO A 142 0.300 -7.356 -15.181 1.00 1.87 H new ATOM 0 HB3 PRO A 142 1.330 -6.449 -14.092 1.00 1.87 H new ATOM 0 HG2 PRO A 142 2.122 -8.214 -16.402 1.00 2.41 H new ATOM 0 HG3 PRO A 142 2.966 -6.825 -15.745 1.00 2.41 H new ATOM 0 HD2 PRO A 142 3.670 -9.524 -15.242 1.00 2.32 H new ATOM 0 HD3 PRO A 142 4.229 -8.158 -14.298 1.00 2.32 H new ATOM 1958 N THR A 143 0.577 -10.716 -14.518 1.00 1.19 N ATOM 1959 CA THR A 143 -0.362 -11.795 -14.927 1.00 1.01 C ATOM 1960 C THR A 143 -0.900 -12.470 -13.666 1.00 0.90 C ATOM 1961 O THR A 143 -2.083 -12.710 -13.533 1.00 0.76 O ATOM 1962 CB THR A 143 0.371 -12.826 -15.789 1.00 1.12 C ATOM 1963 OG1 THR A 143 1.309 -13.531 -14.987 1.00 0.97 O ATOM 1964 CG2 THR A 143 1.104 -12.117 -16.928 1.00 1.65 C ATOM 0 H THR A 143 1.564 -10.908 -14.689 1.00 1.19 H new ATOM 0 HA THR A 143 -1.182 -11.373 -15.508 1.00 1.01 H new ATOM 0 HB THR A 143 -0.351 -13.527 -16.207 1.00 1.12 H new ATOM 0 HG1 THR A 143 2.195 -13.124 -15.086 1.00 0.97 H new ATOM 0 HG21 THR A 143 1.625 -12.854 -17.540 1.00 1.65 H new ATOM 0 HG22 THR A 143 0.384 -11.578 -17.544 1.00 1.65 H new ATOM 0 HG23 THR A 143 1.826 -11.414 -16.514 1.00 1.65 H new ATOM 1972 N THR A 144 -0.036 -12.760 -12.729 1.00 1.00 N ATOM 1973 CA THR A 144 -0.494 -13.398 -11.465 1.00 0.99 C ATOM 1974 C THR A 144 -1.292 -12.367 -10.668 1.00 0.80 C ATOM 1975 O THR A 144 -2.322 -12.666 -10.083 1.00 0.76 O ATOM 1976 CB THR A 144 0.723 -13.850 -10.653 1.00 1.22 C ATOM 1977 OG1 THR A 144 1.697 -14.400 -11.529 1.00 1.51 O ATOM 1978 CG2 THR A 144 0.297 -14.906 -9.634 1.00 1.33 C ATOM 0 H THR A 144 0.967 -12.582 -12.787 1.00 1.00 H new ATOM 0 HA THR A 144 -1.117 -14.266 -11.682 1.00 0.99 H new ATOM 0 HB THR A 144 1.147 -12.994 -10.128 1.00 1.22 H new ATOM 0 HG1 THR A 144 2.477 -14.688 -11.011 1.00 1.51 H new ATOM 0 HG21 THR A 144 1.165 -15.226 -9.057 1.00 1.33 H new ATOM 0 HG22 THR A 144 -0.449 -14.483 -8.962 1.00 1.33 H new ATOM 0 HG23 THR A 144 -0.129 -15.764 -10.155 1.00 1.33 H new ATOM 1986 N ASN A 145 -0.837 -11.145 -10.661 1.00 0.72 N ATOM 1987 CA ASN A 145 -1.581 -10.087 -9.932 1.00 0.54 C ATOM 1988 C ASN A 145 -2.897 -9.822 -10.667 1.00 0.52 C ATOM 1989 O ASN A 145 -3.803 -9.218 -10.132 1.00 0.49 O ATOM 1990 CB ASN A 145 -0.746 -8.806 -9.879 1.00 0.51 C ATOM 1991 CG ASN A 145 -0.482 -8.434 -8.418 1.00 0.41 C ATOM 1992 OD1 ASN A 145 0.594 -7.985 -8.077 1.00 0.50 O ATOM 1993 ND2 ASN A 145 -1.430 -8.600 -7.532 1.00 0.30 N ATOM 0 H ASN A 145 0.016 -10.836 -11.128 1.00 0.72 H new ATOM 0 HA ASN A 145 -1.785 -10.411 -8.912 1.00 0.54 H new ATOM 0 HB2 ASN A 145 0.197 -8.951 -10.405 1.00 0.51 H new ATOM 0 HB3 ASN A 145 -1.271 -7.995 -10.384 1.00 0.51 H new ATOM 0 HD21 ASN A 145 -1.265 -8.353 -6.556 1.00 0.30 H new ATOM 0 HD22 ASN A 145 -2.334 -8.977 -7.817 1.00 0.30 H new ATOM 2000 N ALA A 146 -3.016 -10.286 -11.888 1.00 0.55 N ATOM 2001 CA ALA A 146 -4.281 -10.084 -12.643 1.00 0.54 C ATOM 2002 C ALA A 146 -5.330 -11.044 -12.090 1.00 0.51 C ATOM 2003 O ALA A 146 -6.514 -10.792 -12.160 1.00 0.46 O ATOM 2004 CB ALA A 146 -4.047 -10.370 -14.126 1.00 0.69 C ATOM 0 H ALA A 146 -2.288 -10.795 -12.390 1.00 0.55 H new ATOM 0 HA ALA A 146 -4.623 -9.055 -12.535 1.00 0.54 H new ATOM 0 HB1 ALA A 146 -4.976 -10.221 -14.676 1.00 0.69 H new ATOM 0 HB2 ALA A 146 -3.285 -9.693 -14.511 1.00 0.69 H new ATOM 0 HB3 ALA A 146 -3.713 -11.400 -14.250 1.00 0.69 H new ATOM 2010 N SER A 147 -4.897 -12.137 -11.525 1.00 0.56 N ATOM 2011 CA SER A 147 -5.862 -13.102 -10.942 1.00 0.58 C ATOM 2012 C SER A 147 -6.281 -12.582 -9.569 1.00 0.51 C ATOM 2013 O SER A 147 -7.440 -12.596 -9.217 1.00 0.53 O ATOM 2014 CB SER A 147 -5.202 -14.473 -10.797 1.00 0.68 C ATOM 2015 OG SER A 147 -6.210 -15.466 -10.660 1.00 0.37 O ATOM 0 H SER A 147 -3.915 -12.401 -11.443 1.00 0.56 H new ATOM 0 HA SER A 147 -6.733 -13.203 -11.590 1.00 0.58 H new ATOM 0 HB2 SER A 147 -4.582 -14.685 -11.668 1.00 0.68 H new ATOM 0 HB3 SER A 147 -4.545 -14.483 -9.928 1.00 0.68 H new ATOM 0 HG SER A 147 -5.791 -16.347 -10.568 1.00 0.37 H new ATOM 2021 N LEU A 148 -5.347 -12.095 -8.790 1.00 0.45 N ATOM 2022 CA LEU A 148 -5.727 -11.551 -7.453 1.00 0.41 C ATOM 2023 C LEU A 148 -6.764 -10.446 -7.667 1.00 0.33 C ATOM 2024 O LEU A 148 -7.810 -10.445 -7.063 1.00 0.42 O ATOM 2025 CB LEU A 148 -4.483 -10.976 -6.746 1.00 0.36 C ATOM 2026 CG LEU A 148 -4.893 -9.965 -5.655 1.00 0.26 C ATOM 2027 CD1 LEU A 148 -5.747 -10.650 -4.586 1.00 0.46 C ATOM 2028 CD2 LEU A 148 -3.649 -9.385 -5.001 1.00 0.38 C ATOM 0 H LEU A 148 -4.354 -12.051 -9.018 1.00 0.45 H new ATOM 0 HA LEU A 148 -6.142 -12.342 -6.828 1.00 0.41 H new ATOM 0 HB2 LEU A 148 -3.906 -11.786 -6.300 1.00 0.36 H new ATOM 0 HB3 LEU A 148 -3.837 -10.488 -7.476 1.00 0.36 H new ATOM 0 HG LEU A 148 -5.474 -9.169 -6.121 1.00 0.26 H new ATOM 0 HD11 LEU A 148 -6.028 -9.923 -3.824 1.00 0.46 H new ATOM 0 HD12 LEU A 148 -6.646 -11.059 -5.046 1.00 0.46 H new ATOM 0 HD13 LEU A 148 -5.176 -11.456 -4.126 1.00 0.46 H new ATOM 0 HD21 LEU A 148 -3.942 -8.671 -4.231 1.00 0.38 H new ATOM 0 HD22 LEU A 148 -3.067 -10.188 -4.549 1.00 0.38 H new ATOM 0 HD23 LEU A 148 -3.045 -8.879 -5.754 1.00 0.38 H new ATOM 2040 N LEU A 149 -6.454 -9.502 -8.514 1.00 0.29 N ATOM 2041 CA LEU A 149 -7.391 -8.375 -8.779 1.00 0.24 C ATOM 2042 C LEU A 149 -8.711 -8.916 -9.321 1.00 0.24 C ATOM 2043 O LEU A 149 -9.770 -8.490 -8.918 1.00 0.33 O ATOM 2044 CB LEU A 149 -6.760 -7.438 -9.814 1.00 0.23 C ATOM 2045 CG LEU A 149 -7.589 -6.161 -9.921 1.00 0.41 C ATOM 2046 CD1 LEU A 149 -7.594 -5.449 -8.569 1.00 0.59 C ATOM 2047 CD2 LEU A 149 -6.973 -5.242 -10.981 1.00 0.39 C ATOM 0 H LEU A 149 -5.581 -9.464 -9.039 1.00 0.29 H new ATOM 0 HA LEU A 149 -7.582 -7.833 -7.853 1.00 0.24 H new ATOM 0 HB2 LEU A 149 -5.737 -7.196 -9.525 1.00 0.23 H new ATOM 0 HB3 LEU A 149 -6.709 -7.933 -10.784 1.00 0.23 H new ATOM 0 HG LEU A 149 -8.611 -6.410 -10.206 1.00 0.41 H new ATOM 0 HD11 LEU A 149 -8.185 -4.536 -8.641 1.00 0.59 H new ATOM 0 HD12 LEU A 149 -8.029 -6.104 -7.814 1.00 0.59 H new ATOM 0 HD13 LEU A 149 -6.572 -5.198 -8.286 1.00 0.59 H new ATOM 0 HD21 LEU A 149 -7.564 -4.329 -11.059 1.00 0.39 H new ATOM 0 HD22 LEU A 149 -5.952 -4.990 -10.695 1.00 0.39 H new ATOM 0 HD23 LEU A 149 -6.965 -5.752 -11.944 1.00 0.39 H new ATOM 2059 N THR A 150 -8.667 -9.856 -10.223 1.00 0.31 N ATOM 2060 CA THR A 150 -9.939 -10.413 -10.764 1.00 0.34 C ATOM 2061 C THR A 150 -10.785 -10.927 -9.586 1.00 0.31 C ATOM 2062 O THR A 150 -11.995 -11.002 -9.652 1.00 0.36 O ATOM 2063 CB THR A 150 -9.618 -11.533 -11.788 1.00 0.34 C ATOM 2064 OG1 THR A 150 -10.642 -11.571 -12.771 1.00 0.21 O ATOM 2065 CG2 THR A 150 -9.510 -12.913 -11.123 1.00 0.56 C ATOM 0 H THR A 150 -7.813 -10.260 -10.607 1.00 0.31 H new ATOM 0 HA THR A 150 -10.511 -9.648 -11.289 1.00 0.34 H new ATOM 0 HB THR A 150 -8.653 -11.304 -12.239 1.00 0.34 H new ATOM 0 HG1 THR A 150 -10.444 -12.276 -13.422 1.00 0.21 H new ATOM 0 HG21 THR A 150 -9.284 -13.665 -11.879 1.00 0.56 H new ATOM 0 HG22 THR A 150 -8.714 -12.897 -10.379 1.00 0.56 H new ATOM 0 HG23 THR A 150 -10.455 -13.158 -10.638 1.00 0.56 H new ATOM 2073 N LYS A 151 -10.131 -11.278 -8.507 1.00 0.28 N ATOM 2074 CA LYS A 151 -10.850 -11.787 -7.307 1.00 0.26 C ATOM 2075 C LYS A 151 -11.255 -10.618 -6.393 1.00 0.31 C ATOM 2076 O LYS A 151 -12.255 -10.689 -5.705 1.00 0.33 O ATOM 2077 CB LYS A 151 -9.925 -12.739 -6.540 1.00 0.30 C ATOM 2078 CG LYS A 151 -10.608 -13.205 -5.251 1.00 0.17 C ATOM 2079 CD LYS A 151 -9.952 -12.519 -4.052 1.00 0.84 C ATOM 2080 CE LYS A 151 -8.531 -13.055 -3.871 1.00 1.47 C ATOM 2081 NZ LYS A 151 -8.590 -14.448 -3.348 1.00 2.26 N ATOM 0 H LYS A 151 -9.117 -11.232 -8.409 1.00 0.28 H new ATOM 0 HA LYS A 151 -11.751 -12.313 -7.623 1.00 0.26 H new ATOM 0 HB2 LYS A 151 -9.678 -13.599 -7.162 1.00 0.30 H new ATOM 0 HB3 LYS A 151 -8.987 -12.236 -6.304 1.00 0.30 H new ATOM 0 HG2 LYS A 151 -11.671 -12.967 -5.283 1.00 0.17 H new ATOM 0 HG3 LYS A 151 -10.526 -14.288 -5.154 1.00 0.17 H new ATOM 0 HD2 LYS A 151 -9.928 -11.440 -4.205 1.00 0.84 H new ATOM 0 HD3 LYS A 151 -10.538 -12.700 -3.151 1.00 0.84 H new ATOM 0 HE2 LYS A 151 -7.999 -13.034 -4.822 1.00 1.47 H new ATOM 0 HE3 LYS A 151 -7.976 -12.419 -3.181 1.00 1.47 H new ATOM 0 HZ1 LYS A 151 -7.679 -14.693 -2.911 1.00 2.26 H new ATOM 0 HZ2 LYS A 151 -9.346 -14.520 -2.637 1.00 2.26 H new ATOM 0 HZ3 LYS A 151 -8.786 -15.105 -4.130 1.00 2.26 H new ATOM 2095 N LEU A 152 -10.506 -9.539 -6.375 1.00 0.38 N ATOM 2096 CA LEU A 152 -10.894 -8.398 -5.500 1.00 0.46 C ATOM 2097 C LEU A 152 -12.193 -7.818 -6.039 1.00 0.38 C ATOM 2098 O LEU A 152 -13.079 -7.437 -5.301 1.00 0.49 O ATOM 2099 CB LEU A 152 -9.817 -7.304 -5.534 1.00 0.55 C ATOM 2100 CG LEU A 152 -8.441 -7.901 -5.242 1.00 0.48 C ATOM 2101 CD1 LEU A 152 -7.358 -6.871 -5.573 1.00 0.63 C ATOM 2102 CD2 LEU A 152 -8.350 -8.275 -3.764 1.00 0.33 C ATOM 0 H LEU A 152 -9.656 -9.405 -6.922 1.00 0.38 H new ATOM 0 HA LEU A 152 -11.009 -8.747 -4.474 1.00 0.46 H new ATOM 0 HB2 LEU A 152 -9.811 -6.821 -6.511 1.00 0.55 H new ATOM 0 HB3 LEU A 152 -10.049 -6.533 -4.799 1.00 0.55 H new ATOM 0 HG LEU A 152 -8.296 -8.792 -5.852 1.00 0.48 H new ATOM 0 HD11 LEU A 152 -6.376 -7.296 -5.365 1.00 0.63 H new ATOM 0 HD12 LEU A 152 -7.421 -6.603 -6.628 1.00 0.63 H new ATOM 0 HD13 LEU A 152 -7.504 -5.980 -4.962 1.00 0.63 H new ATOM 0 HD21 LEU A 152 -7.368 -8.701 -3.556 1.00 0.33 H new ATOM 0 HD22 LEU A 152 -8.496 -7.384 -3.154 1.00 0.33 H new ATOM 0 HD23 LEU A 152 -9.121 -9.008 -3.526 1.00 0.33 H new ATOM 2114 N GLN A 153 -12.297 -7.743 -7.333 1.00 0.26 N ATOM 2115 CA GLN A 153 -13.517 -7.180 -7.954 1.00 0.29 C ATOM 2116 C GLN A 153 -14.609 -8.251 -8.024 1.00 0.31 C ATOM 2117 O GLN A 153 -15.784 -7.959 -7.916 1.00 0.60 O ATOM 2118 CB GLN A 153 -13.179 -6.694 -9.364 1.00 0.30 C ATOM 2119 CG GLN A 153 -12.684 -5.248 -9.300 1.00 0.36 C ATOM 2120 CD GLN A 153 -13.577 -4.359 -10.169 1.00 0.70 C ATOM 2121 OE1 GLN A 153 -14.762 -4.601 -10.287 1.00 1.07 O ATOM 2122 NE2 GLN A 153 -13.055 -3.334 -10.783 1.00 0.99 N ATOM 0 H GLN A 153 -11.581 -8.051 -7.991 1.00 0.26 H new ATOM 0 HA GLN A 153 -13.880 -6.346 -7.354 1.00 0.29 H new ATOM 0 HB2 GLN A 153 -12.414 -7.332 -9.807 1.00 0.30 H new ATOM 0 HB3 GLN A 153 -14.059 -6.760 -10.004 1.00 0.30 H new ATOM 0 HG2 GLN A 153 -12.696 -4.895 -8.269 1.00 0.36 H new ATOM 0 HG3 GLN A 153 -11.652 -5.191 -9.645 1.00 0.36 H new ATOM 0 HE21 GLN A 153 -12.060 -3.132 -10.683 1.00 0.99 H new ATOM 0 HE22 GLN A 153 -13.641 -2.734 -11.363 1.00 0.99 H new ATOM 2131 N ALA A 154 -14.234 -9.487 -8.208 1.00 0.28 N ATOM 2132 CA ALA A 154 -15.253 -10.573 -8.288 1.00 0.26 C ATOM 2133 C ALA A 154 -16.074 -10.607 -6.999 1.00 0.34 C ATOM 2134 O ALA A 154 -17.177 -11.118 -6.967 1.00 0.85 O ATOM 2135 CB ALA A 154 -14.551 -11.918 -8.482 1.00 0.20 C ATOM 0 H ALA A 154 -13.266 -9.793 -8.307 1.00 0.28 H new ATOM 0 HA ALA A 154 -15.916 -10.383 -9.132 1.00 0.26 H new ATOM 0 HB1 ALA A 154 -15.296 -12.712 -8.540 1.00 0.20 H new ATOM 0 HB2 ALA A 154 -13.971 -11.896 -9.405 1.00 0.20 H new ATOM 0 HB3 ALA A 154 -13.886 -12.106 -7.639 1.00 0.20 H new ATOM 2141 N GLN A 155 -15.549 -10.070 -5.935 1.00 0.53 N ATOM 2142 CA GLN A 155 -16.300 -10.074 -4.651 1.00 0.49 C ATOM 2143 C GLN A 155 -17.650 -9.376 -4.839 1.00 0.49 C ATOM 2144 O GLN A 155 -17.810 -8.535 -5.701 1.00 0.62 O ATOM 2145 CB GLN A 155 -15.487 -9.327 -3.597 1.00 0.49 C ATOM 2146 CG GLN A 155 -14.075 -9.912 -3.535 1.00 0.50 C ATOM 2147 CD GLN A 155 -13.859 -10.583 -2.176 1.00 0.69 C ATOM 2148 OE1 GLN A 155 -14.591 -11.479 -1.805 1.00 0.69 O ATOM 2149 NE2 GLN A 155 -12.875 -10.188 -1.416 1.00 1.08 N ATOM 0 H GLN A 155 -14.631 -9.628 -5.899 1.00 0.53 H new ATOM 0 HA GLN A 155 -16.469 -11.102 -4.331 1.00 0.49 H new ATOM 0 HB2 GLN A 155 -15.442 -8.266 -3.841 1.00 0.49 H new ATOM 0 HB3 GLN A 155 -15.970 -9.410 -2.623 1.00 0.49 H new ATOM 0 HG2 GLN A 155 -13.935 -10.637 -4.337 1.00 0.50 H new ATOM 0 HG3 GLN A 155 -13.337 -9.124 -3.685 1.00 0.50 H new ATOM 0 HE21 GLN A 155 -12.260 -9.436 -1.727 1.00 1.08 H new ATOM 0 HE22 GLN A 155 -12.720 -10.631 -0.511 1.00 1.08 H new ATOM 2158 N ASN A 156 -18.619 -9.712 -4.031 1.00 0.40 N ATOM 2159 CA ASN A 156 -19.957 -9.065 -4.156 1.00 0.44 C ATOM 2160 C ASN A 156 -19.803 -7.555 -3.978 1.00 0.46 C ATOM 2161 O ASN A 156 -18.741 -7.066 -3.652 1.00 0.66 O ATOM 2162 CB ASN A 156 -20.889 -9.613 -3.073 1.00 0.40 C ATOM 2163 CG ASN A 156 -21.306 -11.040 -3.430 1.00 0.67 C ATOM 2164 OD1 ASN A 156 -21.979 -11.260 -4.418 1.00 1.03 O ATOM 2165 ND2 ASN A 156 -20.935 -12.026 -2.661 1.00 0.83 N ATOM 0 H ASN A 156 -18.542 -10.407 -3.289 1.00 0.40 H new ATOM 0 HA ASN A 156 -20.378 -9.277 -5.139 1.00 0.44 H new ATOM 0 HB2 ASN A 156 -20.386 -9.601 -2.106 1.00 0.40 H new ATOM 0 HB3 ASN A 156 -21.770 -8.978 -2.982 1.00 0.40 H new ATOM 0 HD21 ASN A 156 -21.210 -12.982 -2.889 1.00 0.83 H new ATOM 0 HD22 ASN A 156 -20.370 -11.841 -1.832 1.00 0.83 H new ATOM 2172 N GLN A 157 -20.855 -6.809 -4.183 1.00 0.36 N ATOM 2173 CA GLN A 157 -20.760 -5.333 -4.015 1.00 0.39 C ATOM 2174 C GLN A 157 -20.392 -5.027 -2.563 1.00 0.36 C ATOM 2175 O GLN A 157 -19.695 -4.076 -2.269 1.00 0.34 O ATOM 2176 CB GLN A 157 -22.107 -4.692 -4.350 1.00 0.50 C ATOM 2177 CG GLN A 157 -21.949 -3.172 -4.398 1.00 0.68 C ATOM 2178 CD GLN A 157 -21.846 -2.718 -5.855 1.00 1.35 C ATOM 2179 OE1 GLN A 157 -22.691 -1.992 -6.338 1.00 1.38 O ATOM 2180 NE2 GLN A 157 -20.837 -3.117 -6.580 1.00 2.52 N ATOM 0 H GLN A 157 -21.773 -7.158 -4.459 1.00 0.36 H new ATOM 0 HA GLN A 157 -19.999 -4.931 -4.683 1.00 0.39 H new ATOM 0 HB2 GLN A 157 -22.469 -5.061 -5.309 1.00 0.50 H new ATOM 0 HB3 GLN A 157 -22.850 -4.968 -3.601 1.00 0.50 H new ATOM 0 HG2 GLN A 157 -22.800 -2.691 -3.915 1.00 0.68 H new ATOM 0 HG3 GLN A 157 -21.058 -2.870 -3.848 1.00 0.68 H new ATOM 0 HE21 GLN A 157 -20.127 -3.727 -6.174 1.00 2.52 H new ATOM 0 HE22 GLN A 157 -20.758 -2.819 -7.552 1.00 2.52 H new ATOM 2189 N TRP A 158 -20.856 -5.840 -1.655 1.00 0.38 N ATOM 2190 CA TRP A 158 -20.539 -5.624 -0.216 1.00 0.39 C ATOM 2191 C TRP A 158 -19.036 -5.795 0.001 1.00 0.33 C ATOM 2192 O TRP A 158 -18.341 -4.878 0.397 1.00 0.34 O ATOM 2193 CB TRP A 158 -21.294 -6.660 0.619 1.00 0.42 C ATOM 2194 CG TRP A 158 -21.060 -6.405 2.074 1.00 0.45 C ATOM 2195 CD1 TRP A 158 -19.866 -6.517 2.699 1.00 0.44 C ATOM 2196 CD2 TRP A 158 -22.019 -6.002 3.093 1.00 0.62 C ATOM 2197 NE1 TRP A 158 -20.029 -6.205 4.037 1.00 0.47 N ATOM 2198 CE2 TRP A 158 -21.340 -5.882 4.329 1.00 0.60 C ATOM 2199 CE3 TRP A 158 -23.398 -5.731 3.065 1.00 0.87 C ATOM 2200 CZ2 TRP A 158 -22.006 -5.507 5.496 1.00 0.79 C ATOM 2201 CZ3 TRP A 158 -24.072 -5.353 4.239 1.00 1.08 C ATOM 2202 CH2 TRP A 158 -23.377 -5.243 5.451 1.00 1.04 C ATOM 0 H TRP A 158 -21.445 -6.650 -1.850 1.00 0.38 H new ATOM 0 HA TRP A 158 -20.837 -4.619 0.084 1.00 0.39 H new ATOM 0 HB2 TRP A 158 -22.360 -6.611 0.399 1.00 0.42 H new ATOM 0 HB3 TRP A 158 -20.960 -7.664 0.358 1.00 0.42 H new ATOM 0 HD1 TRP A 158 -18.936 -6.803 2.230 1.00 0.44 H new ATOM 0 HE1 TRP A 158 -19.274 -6.213 4.723 1.00 0.47 H new ATOM 0 HE3 TRP A 158 -23.943 -5.814 2.136 1.00 0.87 H new ATOM 0 HZ2 TRP A 158 -21.466 -5.421 6.427 1.00 0.79 H new ATOM 0 HZ3 TRP A 158 -25.132 -5.146 4.207 1.00 1.08 H new ATOM 0 HH2 TRP A 158 -23.901 -4.954 6.350 1.00 1.04 H new ATOM 2213 N LEU A 159 -18.529 -6.969 -0.259 1.00 0.27 N ATOM 2214 CA LEU A 159 -17.072 -7.213 -0.075 1.00 0.23 C ATOM 2215 C LEU A 159 -16.271 -6.249 -0.955 1.00 0.22 C ATOM 2216 O LEU A 159 -15.098 -6.029 -0.735 1.00 0.17 O ATOM 2217 CB LEU A 159 -16.748 -8.656 -0.460 1.00 0.21 C ATOM 2218 CG LEU A 159 -16.938 -9.556 0.761 1.00 0.08 C ATOM 2219 CD1 LEU A 159 -17.337 -10.961 0.308 1.00 0.35 C ATOM 2220 CD2 LEU A 159 -15.627 -9.628 1.545 1.00 0.57 C ATOM 0 H LEU A 159 -19.063 -7.771 -0.592 1.00 0.27 H new ATOM 0 HA LEU A 159 -16.804 -7.047 0.969 1.00 0.23 H new ATOM 0 HB2 LEU A 159 -17.397 -8.983 -1.272 1.00 0.21 H new ATOM 0 HB3 LEU A 159 -15.723 -8.727 -0.823 1.00 0.21 H new ATOM 0 HG LEU A 159 -17.723 -9.145 1.395 1.00 0.08 H new ATOM 0 HD11 LEU A 159 -17.472 -11.600 1.181 1.00 0.35 H new ATOM 0 HD12 LEU A 159 -18.270 -10.911 -0.253 1.00 0.35 H new ATOM 0 HD13 LEU A 159 -16.554 -11.375 -0.327 1.00 0.35 H new ATOM 0 HD21 LEU A 159 -15.759 -10.269 2.417 1.00 0.57 H new ATOM 0 HD22 LEU A 159 -14.844 -10.039 0.908 1.00 0.57 H new ATOM 0 HD23 LEU A 159 -15.342 -8.627 1.870 1.00 0.57 H new ATOM 2232 N GLN A 160 -16.895 -5.668 -1.945 1.00 0.28 N ATOM 2233 CA GLN A 160 -16.167 -4.714 -2.826 1.00 0.31 C ATOM 2234 C GLN A 160 -15.976 -3.397 -2.074 1.00 0.34 C ATOM 2235 O GLN A 160 -14.930 -2.782 -2.130 1.00 0.39 O ATOM 2236 CB GLN A 160 -16.981 -4.468 -4.099 1.00 0.33 C ATOM 2237 CG GLN A 160 -16.367 -5.258 -5.258 1.00 0.51 C ATOM 2238 CD GLN A 160 -17.391 -5.394 -6.387 1.00 1.20 C ATOM 2239 OE1 GLN A 160 -18.542 -5.696 -6.147 1.00 2.16 O ATOM 2240 NE2 GLN A 160 -17.015 -5.184 -7.621 1.00 1.53 N ATOM 0 H GLN A 160 -17.877 -5.814 -2.180 1.00 0.28 H new ATOM 0 HA GLN A 160 -15.196 -5.127 -3.099 1.00 0.31 H new ATOM 0 HB2 GLN A 160 -18.016 -4.772 -3.946 1.00 0.33 H new ATOM 0 HB3 GLN A 160 -16.993 -3.404 -4.336 1.00 0.33 H new ATOM 0 HG2 GLN A 160 -15.473 -4.752 -5.623 1.00 0.51 H new ATOM 0 HG3 GLN A 160 -16.056 -6.245 -4.914 1.00 0.51 H new ATOM 0 HE21 GLN A 160 -16.048 -4.930 -7.823 1.00 1.53 H new ATOM 0 HE22 GLN A 160 -17.689 -5.274 -8.382 1.00 1.53 H new ATOM 2249 N ASP A 161 -16.981 -2.964 -1.360 1.00 0.34 N ATOM 2250 CA ASP A 161 -16.855 -1.694 -0.594 1.00 0.40 C ATOM 2251 C ASP A 161 -15.834 -1.894 0.527 1.00 0.39 C ATOM 2252 O ASP A 161 -15.159 -0.971 0.939 1.00 0.51 O ATOM 2253 CB ASP A 161 -18.213 -1.323 0.010 1.00 0.40 C ATOM 2254 CG ASP A 161 -18.209 0.153 0.412 1.00 0.52 C ATOM 2255 OD1 ASP A 161 -17.139 0.668 0.696 1.00 0.42 O ATOM 2256 OD2 ASP A 161 -19.276 0.745 0.429 1.00 1.11 O ATOM 0 H ASP A 161 -17.882 -3.435 -1.275 1.00 0.34 H new ATOM 0 HA ASP A 161 -16.527 -0.893 -1.256 1.00 0.40 H new ATOM 0 HB2 ASP A 161 -19.007 -1.512 -0.712 1.00 0.40 H new ATOM 0 HB3 ASP A 161 -18.418 -1.947 0.880 1.00 0.40 H new ATOM 2261 N MET A 162 -15.709 -3.100 1.014 1.00 0.26 N ATOM 2262 CA MET A 162 -14.724 -3.368 2.099 1.00 0.24 C ATOM 2263 C MET A 162 -13.314 -3.392 1.504 1.00 0.25 C ATOM 2264 O MET A 162 -12.363 -2.954 2.118 1.00 0.25 O ATOM 2265 CB MET A 162 -15.030 -4.725 2.746 1.00 0.17 C ATOM 2266 CG MET A 162 -13.945 -5.068 3.774 1.00 0.94 C ATOM 2267 SD MET A 162 -12.810 -6.292 3.068 1.00 0.65 S ATOM 2268 CE MET A 162 -11.331 -5.247 3.022 1.00 0.30 C ATOM 0 H MET A 162 -16.247 -3.910 0.707 1.00 0.26 H new ATOM 0 HA MET A 162 -14.790 -2.585 2.855 1.00 0.24 H new ATOM 0 HB2 MET A 162 -16.006 -4.695 3.230 1.00 0.17 H new ATOM 0 HB3 MET A 162 -15.077 -5.500 1.981 1.00 0.17 H new ATOM 0 HG2 MET A 162 -13.398 -4.168 4.055 1.00 0.94 H new ATOM 0 HG3 MET A 162 -14.401 -5.461 4.683 1.00 0.94 H new ATOM 0 HE1 MET A 162 -10.456 -5.844 3.280 1.00 0.30 H new ATOM 0 HE2 MET A 162 -11.207 -4.835 2.020 1.00 0.30 H new ATOM 0 HE3 MET A 162 -11.439 -4.432 3.738 1.00 0.30 H new ATOM 2278 N THR A 163 -13.178 -3.911 0.310 1.00 0.27 N ATOM 2279 CA THR A 163 -11.834 -3.983 -0.338 1.00 0.28 C ATOM 2280 C THR A 163 -11.108 -2.641 -0.212 1.00 0.26 C ATOM 2281 O THR A 163 -10.017 -2.567 0.308 1.00 0.28 O ATOM 2282 CB THR A 163 -12.000 -4.326 -1.819 1.00 0.39 C ATOM 2283 OG1 THR A 163 -12.863 -5.448 -1.950 1.00 0.60 O ATOM 2284 CG2 THR A 163 -10.632 -4.657 -2.416 1.00 0.26 C ATOM 0 H THR A 163 -13.944 -4.290 -0.246 1.00 0.27 H new ATOM 0 HA THR A 163 -11.246 -4.754 0.160 1.00 0.28 H new ATOM 0 HB THR A 163 -12.431 -3.476 -2.348 1.00 0.39 H new ATOM 0 HG1 THR A 163 -13.755 -5.216 -1.616 1.00 0.60 H new ATOM 0 HG21 THR A 163 -10.746 -4.902 -3.472 1.00 0.26 H new ATOM 0 HG22 THR A 163 -9.972 -3.796 -2.312 1.00 0.26 H new ATOM 0 HG23 THR A 163 -10.202 -5.509 -1.890 1.00 0.26 H new ATOM 2292 N THR A 164 -11.703 -1.581 -0.683 1.00 0.25 N ATOM 2293 CA THR A 164 -11.039 -0.249 -0.590 1.00 0.25 C ATOM 2294 C THR A 164 -10.596 0.017 0.854 1.00 0.15 C ATOM 2295 O THR A 164 -9.467 0.371 1.109 1.00 0.27 O ATOM 2296 CB THR A 164 -12.023 0.839 -1.024 1.00 0.38 C ATOM 2297 OG1 THR A 164 -12.538 0.523 -2.309 1.00 0.63 O ATOM 2298 CG2 THR A 164 -11.303 2.187 -1.076 1.00 1.26 C ATOM 0 H THR A 164 -12.621 -1.578 -1.129 1.00 0.25 H new ATOM 0 HA THR A 164 -10.165 -0.240 -1.241 1.00 0.25 H new ATOM 0 HB THR A 164 -12.843 0.896 -0.309 1.00 0.38 H new ATOM 0 HG1 THR A 164 -13.170 1.218 -2.588 1.00 0.63 H new ATOM 0 HG21 THR A 164 -12.004 2.962 -1.385 1.00 1.26 H new ATOM 0 HG22 THR A 164 -10.909 2.427 -0.089 1.00 1.26 H new ATOM 0 HG23 THR A 164 -10.482 2.134 -1.791 1.00 1.26 H new ATOM 2306 N HIS A 165 -11.486 -0.140 1.792 1.00 0.32 N ATOM 2307 CA HIS A 165 -11.138 0.112 3.224 1.00 0.23 C ATOM 2308 C HIS A 165 -9.817 -0.583 3.601 1.00 0.13 C ATOM 2309 O HIS A 165 -8.853 0.061 3.966 1.00 0.12 O ATOM 2310 CB HIS A 165 -12.271 -0.428 4.107 1.00 0.21 C ATOM 2311 CG HIS A 165 -11.918 -0.260 5.561 1.00 0.36 C ATOM 2312 ND1 HIS A 165 -11.712 -1.345 6.399 1.00 0.47 N ATOM 2313 CD2 HIS A 165 -11.733 0.855 6.340 1.00 0.46 C ATOM 2314 CE1 HIS A 165 -11.416 -0.866 7.620 1.00 0.62 C ATOM 2315 NE2 HIS A 165 -11.416 0.471 7.640 1.00 0.62 N ATOM 0 H HIS A 165 -12.449 -0.435 1.630 1.00 0.32 H new ATOM 0 HA HIS A 165 -11.013 1.184 3.376 1.00 0.23 H new ATOM 0 HB2 HIS A 165 -13.198 0.101 3.886 1.00 0.21 H new ATOM 0 HB3 HIS A 165 -12.444 -1.481 3.886 1.00 0.21 H new ATOM 0 HD1 HIS A 165 -11.774 -2.329 6.137 1.00 0.47 H new ATOM 0 HD2 HIS A 165 -11.820 1.875 5.997 1.00 0.46 H new ATOM 0 HE1 HIS A 165 -11.204 -1.485 8.479 1.00 0.62 H new ATOM 2323 N LEU A 166 -9.775 -1.888 3.548 1.00 0.12 N ATOM 2324 CA LEU A 166 -8.528 -2.613 3.941 1.00 0.12 C ATOM 2325 C LEU A 166 -7.317 -2.098 3.153 1.00 0.11 C ATOM 2326 O LEU A 166 -6.230 -1.996 3.688 1.00 0.10 O ATOM 2327 CB LEU A 166 -8.713 -4.117 3.694 1.00 0.22 C ATOM 2328 CG LEU A 166 -7.407 -4.869 3.983 1.00 0.92 C ATOM 2329 CD1 LEU A 166 -6.941 -4.566 5.408 1.00 0.40 C ATOM 2330 CD2 LEU A 166 -7.643 -6.374 3.840 1.00 2.06 C ATOM 0 H LEU A 166 -10.548 -2.484 3.250 1.00 0.12 H new ATOM 0 HA LEU A 166 -8.342 -2.434 5.000 1.00 0.12 H new ATOM 0 HB2 LEU A 166 -9.510 -4.501 4.330 1.00 0.22 H new ATOM 0 HB3 LEU A 166 -9.018 -4.288 2.662 1.00 0.22 H new ATOM 0 HG LEU A 166 -6.643 -4.547 3.275 1.00 0.92 H new ATOM 0 HD11 LEU A 166 -6.013 -5.102 5.609 1.00 0.40 H new ATOM 0 HD12 LEU A 166 -6.772 -3.495 5.515 1.00 0.40 H new ATOM 0 HD13 LEU A 166 -7.705 -4.885 6.116 1.00 0.40 H new ATOM 0 HD21 LEU A 166 -6.716 -6.909 4.045 1.00 2.06 H new ATOM 0 HD22 LEU A 166 -8.409 -6.691 4.548 1.00 2.06 H new ATOM 0 HD23 LEU A 166 -7.973 -6.596 2.825 1.00 2.06 H new ATOM 2342 N ILE A 167 -7.474 -1.779 1.897 1.00 0.14 N ATOM 2343 CA ILE A 167 -6.299 -1.284 1.121 1.00 0.14 C ATOM 2344 C ILE A 167 -5.742 -0.037 1.805 1.00 0.05 C ATOM 2345 O ILE A 167 -4.575 0.039 2.117 1.00 0.04 O ATOM 2346 CB ILE A 167 -6.712 -0.946 -0.315 1.00 0.22 C ATOM 2347 CG1 ILE A 167 -7.174 -2.223 -1.021 1.00 0.30 C ATOM 2348 CG2 ILE A 167 -5.513 -0.350 -1.066 1.00 0.22 C ATOM 2349 CD1 ILE A 167 -7.628 -1.886 -2.442 1.00 0.35 C ATOM 0 H ILE A 167 -8.351 -1.838 1.380 1.00 0.14 H new ATOM 0 HA ILE A 167 -5.536 -2.062 1.088 1.00 0.14 H new ATOM 0 HB ILE A 167 -7.526 -0.221 -0.301 1.00 0.22 H new ATOM 0 HG12 ILE A 167 -6.362 -2.949 -1.050 1.00 0.30 H new ATOM 0 HG13 ILE A 167 -7.992 -2.682 -0.466 1.00 0.30 H new ATOM 0 HG21 ILE A 167 -5.807 -0.109 -2.088 1.00 0.22 H new ATOM 0 HG22 ILE A 167 -5.181 0.557 -0.561 1.00 0.22 H new ATOM 0 HG23 ILE A 167 -4.698 -1.074 -1.084 1.00 0.22 H new ATOM 0 HD11 ILE A 167 -7.957 -2.796 -2.944 1.00 0.35 H new ATOM 0 HD12 ILE A 167 -8.453 -1.175 -2.401 1.00 0.35 H new ATOM 0 HD13 ILE A 167 -6.798 -1.446 -2.995 1.00 0.35 H new ATOM 2361 N LEU A 168 -6.570 0.938 2.046 1.00 0.11 N ATOM 2362 CA LEU A 168 -6.091 2.175 2.719 1.00 0.15 C ATOM 2363 C LEU A 168 -5.626 1.828 4.134 1.00 0.15 C ATOM 2364 O LEU A 168 -4.878 2.561 4.749 1.00 0.25 O ATOM 2365 CB LEU A 168 -7.231 3.194 2.793 1.00 0.25 C ATOM 2366 CG LEU A 168 -7.899 3.326 1.421 1.00 0.15 C ATOM 2367 CD1 LEU A 168 -9.418 3.286 1.585 1.00 0.56 C ATOM 2368 CD2 LEU A 168 -7.493 4.655 0.786 1.00 0.40 C ATOM 0 H LEU A 168 -7.561 0.932 1.805 1.00 0.11 H new ATOM 0 HA LEU A 168 -5.263 2.602 2.153 1.00 0.15 H new ATOM 0 HB2 LEU A 168 -7.964 2.880 3.536 1.00 0.25 H new ATOM 0 HB3 LEU A 168 -6.846 4.162 3.115 1.00 0.25 H new ATOM 0 HG LEU A 168 -7.581 2.502 0.782 1.00 0.15 H new ATOM 0 HD11 LEU A 168 -9.892 3.380 0.608 1.00 0.56 H new ATOM 0 HD12 LEU A 168 -9.710 2.340 2.040 1.00 0.56 H new ATOM 0 HD13 LEU A 168 -9.737 4.110 2.224 1.00 0.56 H new ATOM 0 HD21 LEU A 168 -7.967 4.751 -0.191 1.00 0.40 H new ATOM 0 HD22 LEU A 168 -7.812 5.477 1.427 1.00 0.40 H new ATOM 0 HD23 LEU A 168 -6.410 4.686 0.668 1.00 0.40 H new ATOM 2380 N ARG A 169 -6.066 0.713 4.657 1.00 0.10 N ATOM 2381 CA ARG A 169 -5.649 0.319 6.031 1.00 0.20 C ATOM 2382 C ARG A 169 -4.196 -0.157 6.003 1.00 0.23 C ATOM 2383 O ARG A 169 -3.445 0.060 6.933 1.00 0.30 O ATOM 2384 CB ARG A 169 -6.548 -0.813 6.531 1.00 0.25 C ATOM 2385 CG ARG A 169 -6.397 -0.954 8.046 1.00 0.62 C ATOM 2386 CD ARG A 169 -7.309 -2.076 8.545 1.00 1.12 C ATOM 2387 NE ARG A 169 -6.488 -3.275 8.873 1.00 2.27 N ATOM 2388 CZ ARG A 169 -5.523 -3.189 9.748 1.00 2.39 C ATOM 2389 NH1 ARG A 169 -5.572 -2.288 10.692 1.00 1.51 N ATOM 2390 NH2 ARG A 169 -4.505 -4.002 9.678 1.00 3.85 N ATOM 0 H ARG A 169 -6.696 0.060 4.191 1.00 0.10 H new ATOM 0 HA ARG A 169 -5.739 1.175 6.700 1.00 0.20 H new ATOM 0 HB2 ARG A 169 -7.587 -0.606 6.276 1.00 0.25 H new ATOM 0 HB3 ARG A 169 -6.280 -1.748 6.040 1.00 0.25 H new ATOM 0 HG2 ARG A 169 -5.360 -1.173 8.300 1.00 0.62 H new ATOM 0 HG3 ARG A 169 -6.654 -0.016 8.537 1.00 0.62 H new ATOM 0 HD2 ARG A 169 -7.859 -1.747 9.426 1.00 1.12 H new ATOM 0 HD3 ARG A 169 -8.047 -2.325 7.783 1.00 1.12 H new ATOM 0 HE ARG A 169 -6.680 -4.165 8.413 1.00 2.27 H new ATOM 0 HH11 ARG A 169 -6.366 -1.649 10.747 1.00 1.51 H new ATOM 0 HH12 ARG A 169 -4.817 -2.223 11.374 1.00 1.51 H new ATOM 0 HH21 ARG A 169 -4.463 -4.705 8.940 1.00 3.85 H new ATOM 0 HH22 ARG A 169 -3.751 -3.935 10.362 1.00 3.85 H new ATOM 2404 N SER A 170 -3.784 -0.793 4.937 1.00 0.18 N ATOM 2405 CA SER A 170 -2.379 -1.260 4.855 1.00 0.22 C ATOM 2406 C SER A 170 -1.504 -0.062 4.509 1.00 0.18 C ATOM 2407 O SER A 170 -0.517 0.206 5.146 1.00 0.20 O ATOM 2408 CB SER A 170 -2.251 -2.327 3.766 1.00 0.23 C ATOM 2409 OG SER A 170 -1.519 -3.433 4.277 1.00 0.43 O ATOM 0 H SER A 170 -4.362 -1.006 4.124 1.00 0.18 H new ATOM 0 HA SER A 170 -2.068 -1.694 5.805 1.00 0.22 H new ATOM 0 HB2 SER A 170 -3.239 -2.650 3.439 1.00 0.23 H new ATOM 0 HB3 SER A 170 -1.746 -1.914 2.893 1.00 0.23 H new ATOM 0 HG SER A 170 -1.436 -4.119 3.582 1.00 0.43 H new ATOM 2415 N PHE A 171 -1.875 0.683 3.512 1.00 0.14 N ATOM 2416 CA PHE A 171 -1.068 1.875 3.145 1.00 0.12 C ATOM 2417 C PHE A 171 -0.855 2.737 4.392 1.00 0.17 C ATOM 2418 O PHE A 171 0.217 3.246 4.629 1.00 0.11 O ATOM 2419 CB PHE A 171 -1.804 2.673 2.072 1.00 0.10 C ATOM 2420 CG PHE A 171 -1.480 2.082 0.723 1.00 0.06 C ATOM 2421 CD1 PHE A 171 -1.876 0.775 0.415 1.00 0.41 C ATOM 2422 CD2 PHE A 171 -0.772 2.839 -0.214 1.00 0.47 C ATOM 2423 CE1 PHE A 171 -1.563 0.224 -0.832 1.00 0.40 C ATOM 2424 CE2 PHE A 171 -0.460 2.291 -1.461 1.00 0.48 C ATOM 2425 CZ PHE A 171 -0.853 0.984 -1.772 1.00 0.05 C ATOM 0 H PHE A 171 -2.700 0.520 2.935 1.00 0.14 H new ATOM 0 HA PHE A 171 -0.099 1.565 2.753 1.00 0.12 H new ATOM 0 HB2 PHE A 171 -2.879 2.643 2.249 1.00 0.10 H new ATOM 0 HB3 PHE A 171 -1.504 3.720 2.108 1.00 0.10 H new ATOM 0 HD1 PHE A 171 -2.423 0.192 1.141 1.00 0.41 H new ATOM 0 HD2 PHE A 171 -0.466 3.847 0.025 1.00 0.47 H new ATOM 0 HE1 PHE A 171 -1.868 -0.784 -1.070 1.00 0.40 H new ATOM 0 HE2 PHE A 171 0.085 2.877 -2.186 1.00 0.48 H new ATOM 0 HZ PHE A 171 -0.609 0.561 -2.736 1.00 0.05 H new ATOM 2435 N LYS A 172 -1.863 2.876 5.205 1.00 0.28 N ATOM 2436 CA LYS A 172 -1.709 3.683 6.446 1.00 0.35 C ATOM 2437 C LYS A 172 -0.624 3.052 7.325 1.00 0.35 C ATOM 2438 O LYS A 172 0.418 3.635 7.557 1.00 0.34 O ATOM 2439 CB LYS A 172 -3.038 3.702 7.205 1.00 0.43 C ATOM 2440 CG LYS A 172 -3.102 4.945 8.095 1.00 1.04 C ATOM 2441 CD LYS A 172 -3.497 6.157 7.250 1.00 0.69 C ATOM 2442 CE LYS A 172 -4.033 7.262 8.164 1.00 0.84 C ATOM 2443 NZ LYS A 172 -3.380 8.563 7.827 1.00 1.16 N ATOM 0 H LYS A 172 -2.786 2.466 5.064 1.00 0.28 H new ATOM 0 HA LYS A 172 -1.423 4.703 6.191 1.00 0.35 H new ATOM 0 HB2 LYS A 172 -3.870 3.703 6.501 1.00 0.43 H new ATOM 0 HB3 LYS A 172 -3.135 2.802 7.812 1.00 0.43 H new ATOM 0 HG2 LYS A 172 -3.826 4.795 8.896 1.00 1.04 H new ATOM 0 HG3 LYS A 172 -2.135 5.117 8.568 1.00 1.04 H new ATOM 0 HD2 LYS A 172 -2.635 6.520 6.690 1.00 0.69 H new ATOM 0 HD3 LYS A 172 -4.256 5.874 6.520 1.00 0.69 H new ATOM 0 HE2 LYS A 172 -5.114 7.348 8.050 1.00 0.84 H new ATOM 0 HE3 LYS A 172 -3.841 7.008 9.207 1.00 0.84 H new ATOM 0 HZ1 LYS A 172 -3.749 9.308 8.451 1.00 1.16 H new ATOM 0 HZ2 LYS A 172 -2.352 8.479 7.957 1.00 1.16 H new ATOM 0 HZ3 LYS A 172 -3.585 8.808 6.837 1.00 1.16 H new ATOM 2457 N GLU A 173 -0.859 1.864 7.814 1.00 0.39 N ATOM 2458 CA GLU A 173 0.156 1.193 8.677 1.00 0.42 C ATOM 2459 C GLU A 173 1.356 0.769 7.824 1.00 0.36 C ATOM 2460 O GLU A 173 2.436 1.294 7.963 1.00 0.33 O ATOM 2461 CB GLU A 173 -0.468 -0.044 9.329 1.00 0.49 C ATOM 2462 CG GLU A 173 -1.276 0.373 10.560 1.00 0.70 C ATOM 2463 CD GLU A 173 -0.338 0.970 11.611 1.00 1.00 C ATOM 2464 OE1 GLU A 173 0.721 0.402 11.822 1.00 1.77 O ATOM 2465 OE2 GLU A 173 -0.695 1.984 12.188 1.00 1.84 O ATOM 0 H GLU A 173 -1.712 1.328 7.653 1.00 0.39 H new ATOM 0 HA GLU A 173 0.488 1.885 9.451 1.00 0.42 H new ATOM 0 HB2 GLU A 173 -1.113 -0.557 8.615 1.00 0.49 H new ATOM 0 HB3 GLU A 173 0.313 -0.748 9.616 1.00 0.49 H new ATOM 0 HG2 GLU A 173 -2.035 1.103 10.279 1.00 0.70 H new ATOM 0 HG3 GLU A 173 -1.800 -0.489 10.973 1.00 0.70 H new ATOM 2472 N PHE A 174 1.162 -0.192 6.957 1.00 0.33 N ATOM 2473 CA PHE A 174 2.264 -0.703 6.072 1.00 0.30 C ATOM 2474 C PHE A 174 3.244 0.417 5.655 1.00 0.23 C ATOM 2475 O PHE A 174 4.424 0.342 5.942 1.00 0.27 O ATOM 2476 CB PHE A 174 1.641 -1.323 4.817 1.00 0.28 C ATOM 2477 CG PHE A 174 2.403 -2.564 4.429 1.00 0.36 C ATOM 2478 CD1 PHE A 174 3.740 -2.466 4.041 1.00 0.52 C ATOM 2479 CD2 PHE A 174 1.768 -3.813 4.455 1.00 1.08 C ATOM 2480 CE1 PHE A 174 4.451 -3.616 3.679 1.00 0.41 C ATOM 2481 CE2 PHE A 174 2.479 -4.965 4.093 1.00 1.30 C ATOM 2482 CZ PHE A 174 3.820 -4.866 3.704 1.00 0.74 C ATOM 0 H PHE A 174 0.265 -0.658 6.819 1.00 0.33 H new ATOM 0 HA PHE A 174 2.832 -1.444 6.634 1.00 0.30 H new ATOM 0 HB2 PHE A 174 0.596 -1.570 5.003 1.00 0.28 H new ATOM 0 HB3 PHE A 174 1.658 -0.604 3.998 1.00 0.28 H new ATOM 0 HD1 PHE A 174 4.226 -1.502 4.020 1.00 0.52 H new ATOM 0 HD2 PHE A 174 0.733 -3.888 4.753 1.00 1.08 H new ATOM 0 HE1 PHE A 174 5.486 -3.539 3.380 1.00 0.41 H new ATOM 0 HE2 PHE A 174 1.992 -5.929 4.114 1.00 1.30 H new ATOM 0 HZ PHE A 174 4.368 -5.753 3.423 1.00 0.74 H new ATOM 2492 N LEU A 175 2.785 1.447 4.983 1.00 0.14 N ATOM 2493 CA LEU A 175 3.736 2.529 4.572 1.00 0.10 C ATOM 2494 C LEU A 175 4.288 3.230 5.817 1.00 0.10 C ATOM 2495 O LEU A 175 5.442 3.604 5.865 1.00 0.08 O ATOM 2496 CB LEU A 175 3.031 3.564 3.686 1.00 0.11 C ATOM 2497 CG LEU A 175 2.632 2.935 2.346 1.00 0.13 C ATOM 2498 CD1 LEU A 175 1.465 3.713 1.742 1.00 0.14 C ATOM 2499 CD2 LEU A 175 3.810 2.996 1.372 1.00 0.12 C ATOM 0 H LEU A 175 1.813 1.584 4.706 1.00 0.14 H new ATOM 0 HA LEU A 175 4.550 2.074 4.007 1.00 0.10 H new ATOM 0 HB2 LEU A 175 2.145 3.945 4.195 1.00 0.11 H new ATOM 0 HB3 LEU A 175 3.690 4.415 3.514 1.00 0.11 H new ATOM 0 HG LEU A 175 2.344 1.898 2.517 1.00 0.13 H new ATOM 0 HD11 LEU A 175 1.183 3.264 0.790 1.00 0.14 H new ATOM 0 HD12 LEU A 175 0.615 3.682 2.424 1.00 0.14 H new ATOM 0 HD13 LEU A 175 1.763 4.749 1.581 1.00 0.14 H new ATOM 0 HD21 LEU A 175 3.520 2.547 0.422 1.00 0.12 H new ATOM 0 HD22 LEU A 175 4.095 4.036 1.211 1.00 0.12 H new ATOM 0 HD23 LEU A 175 4.655 2.448 1.789 1.00 0.12 H new ATOM 2511 N GLN A 176 3.476 3.416 6.825 1.00 0.19 N ATOM 2512 CA GLN A 176 3.961 4.101 8.061 1.00 0.23 C ATOM 2513 C GLN A 176 5.254 3.439 8.556 1.00 0.11 C ATOM 2514 O GLN A 176 6.276 4.082 8.695 1.00 0.14 O ATOM 2515 CB GLN A 176 2.892 3.999 9.152 1.00 0.35 C ATOM 2516 CG GLN A 176 2.175 5.343 9.299 1.00 0.48 C ATOM 2517 CD GLN A 176 1.157 5.255 10.439 1.00 1.19 C ATOM 2518 OE1 GLN A 176 -0.033 5.360 10.215 1.00 2.17 O ATOM 2519 NE2 GLN A 176 1.577 5.065 11.660 1.00 1.26 N ATOM 0 H GLN A 176 2.499 3.124 6.846 1.00 0.19 H new ATOM 0 HA GLN A 176 4.159 5.148 7.833 1.00 0.23 H new ATOM 0 HB2 GLN A 176 2.174 3.219 8.899 1.00 0.35 H new ATOM 0 HB3 GLN A 176 3.351 3.715 10.099 1.00 0.35 H new ATOM 0 HG2 GLN A 176 2.898 6.133 9.503 1.00 0.48 H new ATOM 0 HG3 GLN A 176 1.673 5.603 8.367 1.00 0.48 H new ATOM 0 HE21 GLN A 176 2.576 4.977 11.848 1.00 1.26 H new ATOM 0 HE22 GLN A 176 0.907 5.005 12.426 1.00 1.26 H new ATOM 2528 N SER A 177 5.216 2.163 8.829 1.00 0.24 N ATOM 2529 CA SER A 177 6.436 1.463 9.320 1.00 0.24 C ATOM 2530 C SER A 177 7.555 1.588 8.286 1.00 0.19 C ATOM 2531 O SER A 177 8.716 1.675 8.627 1.00 0.19 O ATOM 2532 CB SER A 177 6.118 -0.016 9.547 1.00 0.35 C ATOM 2533 OG SER A 177 5.560 -0.181 10.844 1.00 0.89 O ATOM 0 H SER A 177 4.389 1.574 8.733 1.00 0.24 H new ATOM 0 HA SER A 177 6.758 1.917 10.257 1.00 0.24 H new ATOM 0 HB2 SER A 177 5.419 -0.370 8.790 1.00 0.35 H new ATOM 0 HB3 SER A 177 7.024 -0.614 9.449 1.00 0.35 H new ATOM 0 HG SER A 177 6.034 -0.897 11.315 1.00 0.89 H new ATOM 2539 N SER A 178 7.217 1.593 7.026 1.00 0.23 N ATOM 2540 CA SER A 178 8.269 1.710 5.977 1.00 0.23 C ATOM 2541 C SER A 178 9.027 3.030 6.149 1.00 0.16 C ATOM 2542 O SER A 178 10.215 3.112 5.904 1.00 0.13 O ATOM 2543 CB SER A 178 7.613 1.678 4.596 1.00 0.31 C ATOM 2544 OG SER A 178 8.619 1.762 3.595 1.00 0.81 O ATOM 0 H SER A 178 6.261 1.521 6.678 1.00 0.23 H new ATOM 0 HA SER A 178 8.967 0.878 6.072 1.00 0.23 H new ATOM 0 HB2 SER A 178 7.039 0.759 4.475 1.00 0.31 H new ATOM 0 HB3 SER A 178 6.913 2.507 4.494 1.00 0.31 H new ATOM 0 HG SER A 178 8.783 2.703 3.374 1.00 0.81 H new ATOM 2550 N LEU A 179 8.351 4.067 6.563 1.00 0.16 N ATOM 2551 CA LEU A 179 9.031 5.380 6.743 1.00 0.13 C ATOM 2552 C LEU A 179 9.930 5.334 7.981 1.00 0.07 C ATOM 2553 O LEU A 179 11.097 5.667 7.928 1.00 0.14 O ATOM 2554 CB LEU A 179 7.981 6.478 6.924 1.00 0.16 C ATOM 2555 CG LEU A 179 7.623 7.078 5.563 1.00 0.40 C ATOM 2556 CD1 LEU A 179 6.341 6.428 5.036 1.00 0.92 C ATOM 2557 CD2 LEU A 179 7.403 8.585 5.714 1.00 0.29 C ATOM 0 H LEU A 179 7.355 4.061 6.785 1.00 0.16 H new ATOM 0 HA LEU A 179 9.638 5.592 5.862 1.00 0.13 H new ATOM 0 HB2 LEU A 179 7.089 6.067 7.397 1.00 0.16 H new ATOM 0 HB3 LEU A 179 8.364 7.255 7.586 1.00 0.16 H new ATOM 0 HG LEU A 179 8.437 6.895 4.861 1.00 0.40 H new ATOM 0 HD11 LEU A 179 6.088 6.857 4.066 1.00 0.92 H new ATOM 0 HD12 LEU A 179 6.495 5.354 4.929 1.00 0.92 H new ATOM 0 HD13 LEU A 179 5.526 6.610 5.737 1.00 0.92 H new ATOM 0 HD21 LEU A 179 7.148 9.014 4.745 1.00 0.29 H new ATOM 0 HD22 LEU A 179 6.589 8.765 6.416 1.00 0.29 H new ATOM 0 HD23 LEU A 179 8.315 9.050 6.088 1.00 0.29 H new ATOM 2569 N ARG A 180 9.390 4.934 9.097 1.00 0.17 N ATOM 2570 CA ARG A 180 10.202 4.874 10.344 1.00 0.25 C ATOM 2571 C ARG A 180 11.352 3.877 10.174 1.00 0.25 C ATOM 2572 O ARG A 180 12.334 3.921 10.890 1.00 0.28 O ATOM 2573 CB ARG A 180 9.309 4.430 11.502 1.00 0.32 C ATOM 2574 CG ARG A 180 9.564 5.324 12.714 1.00 0.72 C ATOM 2575 CD ARG A 180 8.310 6.149 13.012 1.00 1.28 C ATOM 2576 NE ARG A 180 8.159 6.310 14.486 1.00 1.38 N ATOM 2577 CZ ARG A 180 6.994 6.136 15.048 1.00 1.36 C ATOM 2578 NH1 ARG A 180 5.902 6.355 14.369 1.00 2.04 N ATOM 2579 NH2 ARG A 180 6.920 5.741 16.290 1.00 1.65 N ATOM 0 H ARG A 180 8.417 4.645 9.200 1.00 0.17 H new ATOM 0 HA ARG A 180 10.616 5.860 10.553 1.00 0.25 H new ATOM 0 HB2 ARG A 180 8.261 4.487 11.209 1.00 0.32 H new ATOM 0 HB3 ARG A 180 9.514 3.390 11.755 1.00 0.32 H new ATOM 0 HG2 ARG A 180 9.826 4.715 13.579 1.00 0.72 H new ATOM 0 HG3 ARG A 180 10.409 5.984 12.521 1.00 0.72 H new ATOM 0 HD2 ARG A 180 8.383 7.126 12.534 1.00 1.28 H new ATOM 0 HD3 ARG A 180 7.431 5.656 12.597 1.00 1.28 H new ATOM 0 HE ARG A 180 8.968 6.557 15.057 1.00 1.38 H new ATOM 0 HH11 ARG A 180 5.958 6.662 13.398 1.00 2.04 H new ATOM 0 HH12 ARG A 180 4.992 6.219 14.809 1.00 2.04 H new ATOM 0 HH21 ARG A 180 7.773 5.568 16.822 1.00 1.65 H new ATOM 0 HH22 ARG A 180 6.009 5.605 16.729 1.00 1.65 H new ATOM 2593 N ALA A 181 11.246 2.982 9.233 1.00 0.22 N ATOM 2594 CA ALA A 181 12.336 1.994 9.026 1.00 0.24 C ATOM 2595 C ALA A 181 13.445 2.650 8.211 1.00 0.23 C ATOM 2596 O ALA A 181 14.615 2.426 8.441 1.00 0.29 O ATOM 2597 CB ALA A 181 11.793 0.779 8.270 1.00 0.22 C ATOM 0 H ALA A 181 10.452 2.893 8.599 1.00 0.22 H new ATOM 0 HA ALA A 181 12.727 1.667 9.989 1.00 0.24 H new ATOM 0 HB1 ALA A 181 12.595 0.056 8.120 1.00 0.22 H new ATOM 0 HB2 ALA A 181 10.993 0.318 8.849 1.00 0.22 H new ATOM 0 HB3 ALA A 181 11.404 1.096 7.302 1.00 0.22 H new ATOM 2603 N LEU A 182 13.085 3.467 7.262 1.00 0.16 N ATOM 2604 CA LEU A 182 14.122 4.141 6.440 1.00 0.16 C ATOM 2605 C LEU A 182 14.938 5.081 7.328 1.00 0.16 C ATOM 2606 O LEU A 182 16.150 5.122 7.256 1.00 0.31 O ATOM 2607 CB LEU A 182 13.452 4.935 5.318 1.00 0.22 C ATOM 2608 CG LEU A 182 13.604 4.175 4.002 1.00 0.11 C ATOM 2609 CD1 LEU A 182 12.968 2.788 4.131 1.00 0.82 C ATOM 2610 CD2 LEU A 182 12.907 4.950 2.885 1.00 0.85 C ATOM 0 H LEU A 182 12.120 3.696 7.022 1.00 0.16 H new ATOM 0 HA LEU A 182 14.784 3.395 6.000 1.00 0.16 H new ATOM 0 HB2 LEU A 182 12.396 5.086 5.544 1.00 0.22 H new ATOM 0 HB3 LEU A 182 13.905 5.923 5.235 1.00 0.22 H new ATOM 0 HG LEU A 182 14.663 4.067 3.768 1.00 0.11 H new ATOM 0 HD11 LEU A 182 13.078 2.248 3.190 1.00 0.82 H new ATOM 0 HD12 LEU A 182 13.463 2.233 4.928 1.00 0.82 H new ATOM 0 HD13 LEU A 182 11.909 2.894 4.367 1.00 0.82 H new ATOM 0 HD21 LEU A 182 13.015 4.409 1.945 1.00 0.85 H new ATOM 0 HD22 LEU A 182 11.849 5.058 3.123 1.00 0.85 H new ATOM 0 HD23 LEU A 182 13.360 5.937 2.789 1.00 0.85 H new ATOM 2622 N ARG A 183 14.284 5.833 8.170 1.00 0.26 N ATOM 2623 CA ARG A 183 15.024 6.762 9.066 1.00 0.25 C ATOM 2624 C ARG A 183 15.695 5.959 10.182 1.00 0.17 C ATOM 2625 O ARG A 183 16.663 6.390 10.775 1.00 0.22 O ATOM 2626 CB ARG A 183 14.051 7.776 9.671 1.00 0.42 C ATOM 2627 CG ARG A 183 14.251 9.137 8.997 1.00 0.98 C ATOM 2628 CD ARG A 183 13.267 10.151 9.581 1.00 1.05 C ATOM 2629 NE ARG A 183 13.794 11.528 9.362 1.00 1.59 N ATOM 2630 CZ ARG A 183 12.972 12.540 9.277 1.00 2.32 C ATOM 2631 NH1 ARG A 183 12.078 12.736 10.209 1.00 2.29 N ATOM 2632 NH2 ARG A 183 13.045 13.356 8.262 1.00 3.51 N ATOM 0 H ARG A 183 13.270 5.843 8.275 1.00 0.26 H new ATOM 0 HA ARG A 183 15.784 7.294 8.494 1.00 0.25 H new ATOM 0 HB2 ARG A 183 13.024 7.437 9.534 1.00 0.42 H new ATOM 0 HB3 ARG A 183 14.218 7.861 10.745 1.00 0.42 H new ATOM 0 HG2 ARG A 183 15.274 9.481 9.147 1.00 0.98 H new ATOM 0 HG3 ARG A 183 14.099 9.047 7.921 1.00 0.98 H new ATOM 0 HD2 ARG A 183 12.291 10.043 9.108 1.00 1.05 H new ATOM 0 HD3 ARG A 183 13.127 9.968 10.646 1.00 1.05 H new ATOM 0 HE ARG A 183 14.799 11.681 9.278 1.00 1.59 H new ATOM 0 HH11 ARG A 183 12.021 12.099 11.004 1.00 2.29 H new ATOM 0 HH12 ARG A 183 11.436 13.526 10.142 1.00 2.29 H new ATOM 0 HH21 ARG A 183 13.744 13.204 7.535 1.00 3.51 H new ATOM 0 HH22 ARG A 183 12.403 14.146 8.196 1.00 3.51 H new ATOM 2646 N GLN A 184 15.195 4.786 10.467 1.00 0.18 N ATOM 2647 CA GLN A 184 15.808 3.954 11.531 1.00 0.27 C ATOM 2648 C GLN A 184 17.088 3.320 10.988 1.00 0.27 C ATOM 2649 O GLN A 184 17.981 2.960 11.730 1.00 0.39 O ATOM 2650 CB GLN A 184 14.815 2.860 11.936 1.00 0.37 C ATOM 2651 CG GLN A 184 15.466 1.909 12.939 1.00 1.37 C ATOM 2652 CD GLN A 184 15.609 2.609 14.291 1.00 0.86 C ATOM 2653 OE1 GLN A 184 15.020 3.647 14.516 1.00 0.37 O ATOM 2654 NE2 GLN A 184 16.373 2.081 15.208 1.00 1.77 N ATOM 0 H GLN A 184 14.386 4.371 10.005 1.00 0.18 H new ATOM 0 HA GLN A 184 16.049 4.565 12.401 1.00 0.27 H new ATOM 0 HB2 GLN A 184 13.924 3.310 12.374 1.00 0.37 H new ATOM 0 HB3 GLN A 184 14.492 2.306 11.054 1.00 0.37 H new ATOM 0 HG2 GLN A 184 14.862 1.008 13.047 1.00 1.37 H new ATOM 0 HG3 GLN A 184 16.444 1.595 12.575 1.00 1.37 H new ATOM 0 HE21 GLN A 184 16.868 1.209 15.020 1.00 1.77 H new ATOM 0 HE22 GLN A 184 16.475 2.540 16.113 1.00 1.77 H new ATOM 2663 N MET A 185 17.185 3.180 9.695 1.00 0.24 N ATOM 2664 CA MET A 185 18.403 2.571 9.105 1.00 0.35 C ATOM 2665 C MET A 185 19.596 3.506 9.310 1.00 0.76 C ATOM 2666 O MET A 185 19.381 4.705 9.351 1.00 1.30 O ATOM 2667 CB MET A 185 18.181 2.347 7.611 1.00 0.50 C ATOM 2668 CG MET A 185 17.221 1.174 7.408 1.00 0.32 C ATOM 2669 SD MET A 185 16.541 1.232 5.733 1.00 0.76 S ATOM 2670 CE MET A 185 15.144 0.118 6.018 1.00 0.35 C ATOM 2671 OXT MET A 185 20.702 3.006 9.425 1.00 1.28 O ATOM 0 H MET A 185 16.471 3.462 9.023 1.00 0.24 H new ATOM 0 HA MET A 185 18.606 1.617 9.592 1.00 0.35 H new ATOM 0 HB2 MET A 185 17.772 3.248 7.154 1.00 0.50 H new ATOM 0 HB3 MET A 185 19.131 2.142 7.118 1.00 0.50 H new ATOM 0 HG2 MET A 185 17.744 0.231 7.567 1.00 0.32 H new ATOM 0 HG3 MET A 185 16.415 1.219 8.141 1.00 0.32 H new ATOM 0 HE1 MET A 185 14.449 0.184 5.181 1.00 0.35 H new ATOM 0 HE2 MET A 185 15.507 -0.906 6.108 1.00 0.35 H new ATOM 0 HE3 MET A 185 14.633 0.404 6.937 1.00 0.35 H new TER 2681 MET A 185