USER MOD reduce.3.24.130724 H: found=0, std=0, add=1247, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1248 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 157 GLN : amide:sc= -0.904 K(o=-3.3,f=-8.2!) USER MOD Set 1.2: A 160 GLN : amide:sc= -2.45 K(o=-3.3,f=-6.6!) USER MOD Set 2.1: A 109 SER OG : rot 130:sc= -2.74! USER MOD Set 2.2: A 112 GLN : amide:sc= -8.74! C(o=-11!,f=-14!) USER MOD Set 3.1: A 90 THR OG1 : rot 87:sc= 0.122 USER MOD Set 3.2: A 138 THR OG1 : rot 180:sc= 0.091 USER MOD Set 4.1: A 64 ASN : amide:sc= -2.58! C(o=-4.8!,f=-9.5!) USER MOD Set 4.2: A 98 TYR OH : rot -15:sc= -2.23! USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.331 USER MOD Single : A 22 SER OG : rot 180:sc= 0.0499 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ -170:sc= -0.0147 (180deg=-0.236) USER MOD Single : A 29 GLN : amide:sc= -7.36! C(o=-7.4!,f=-10!) 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 44 THR OG1 : rot 150:sc= -1.51 USER MOD Single : A 45 CYS SG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 47 LYS NZ :NH3+ 154:sc= -0.048 (180deg=-0.427) USER MOD Single : A 48 SER OG : rot 57:sc= -0.51! USER MOD Single : A 49 ASN : amide:sc= -0.266 K(o=-0.27,f=-2.2!) USER MOD Single : A 50 MET CE :methyl -136:sc= -3.27! (180deg=-8.86!) USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl -179:sc= -0.127 (180deg=-0.13) 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) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -0.174 K(o=-0.17,f=-2.6!) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 TYR OH : rot -136:sc= -3.65 USER MOD Single : A 103 GLN : amide:sc= -0.219 K(o=-0.22,f=-1.7!) USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= -3.19 K(o=-3.2,f=-9.2!) USER MOD Single : A 118 MET CE :methyl -107:sc= -0.185 (180deg=-2.46!) USER MOD Single : A 119 SER OG : rot -100:sc= -1.54 USER MOD Single : A 120 THR OG1 : rot 33:sc= -3.64! 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= -0.768 K(o=-0.77,f=-2.4) USER MOD Single : A 129 LYS NZ :NH3+ -104:sc= -0.0701 (180deg=-0.454) USER MOD Single : A 130 LYS NZ :NH3+ -116:sc= 0.0832 (180deg=-2.05) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 THR OG1 : rot 180:sc= 0 USER MOD Single : A 145 ASN : amide:sc= -3.65! K(o=-3.7!,f=-1.5) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 GLN : amide:sc= -0.227 K(o=-0.23,f=-1.8!) USER MOD Single : A 155 GLN : amide:sc= -5.71! C(o=-5.7!,f=-2.8!) USER MOD Single : A 156 ASN : amide:sc= -1.23 K(o=-1.2,f=-9.5!) USER MOD Single : A 162 MET CE :methyl -162:sc= -7.21! (180deg=-10.4!) USER MOD Single : A 163 THR OG1 : rot 65:sc= 0.825 USER MOD Single : A 164 THR OG1 : rot 159:sc= 0.654 USER MOD Single : A 165 HIS : no HD1:sc= -0.251 K(o=-0.25,f=-1.1) USER MOD Single : A 170 SER OG : rot -170:sc= -0.017 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) USER MOD Single : A 177 SER OG : rot 180:sc= 0 USER MOD Single : A 178 SER OG : rot -169:sc= -3.43! USER MOD Single : A 184 GLN : amide:sc= -0.461 X(o=-0.46,f=0) USER MOD Single : A 185 MET CE :methyl -167:sc= -0.179 (180deg=-0.302) USER MOD ----------------------------------------------------------------- ATOM 20 N THR A 21 19.734 12.223 0.899 1.00 0.65 N ATOM 21 CA THR A 21 20.291 11.001 0.255 1.00 0.43 C ATOM 22 C THR A 21 19.159 10.222 -0.420 1.00 0.25 C ATOM 23 O THR A 21 17.998 10.556 -0.287 1.00 0.08 O ATOM 24 CB THR A 21 20.961 10.124 1.316 1.00 0.84 C ATOM 25 OG1 THR A 21 21.407 8.917 0.718 1.00 0.81 O ATOM 26 CG2 THR A 21 19.959 9.806 2.424 1.00 1.01 C ATOM 0 HA THR A 21 21.030 11.287 -0.494 1.00 0.43 H new ATOM 0 HB THR A 21 21.813 10.655 1.741 1.00 0.84 H new ATOM 0 HG1 THR A 21 21.838 8.356 1.396 1.00 0.81 H new ATOM 0 HG21 THR A 21 20.437 9.182 3.179 1.00 1.01 H new ATOM 0 HG22 THR A 21 19.618 10.734 2.883 1.00 1.01 H new ATOM 0 HG23 THR A 21 19.106 9.275 2.002 1.00 1.01 H new ATOM 34 N SER A 22 19.487 9.187 -1.146 1.00 0.50 N ATOM 35 CA SER A 22 18.432 8.389 -1.835 1.00 0.67 C ATOM 36 C SER A 22 17.371 7.945 -0.824 1.00 0.58 C ATOM 37 O SER A 22 16.190 8.160 -1.013 1.00 0.52 O ATOM 38 CB SER A 22 19.067 7.155 -2.476 1.00 1.09 C ATOM 39 OG SER A 22 20.362 7.487 -2.955 1.00 1.97 O ATOM 0 H SER A 22 20.442 8.859 -1.292 1.00 0.50 H new ATOM 0 HA SER A 22 17.962 9.003 -2.603 1.00 0.67 H new ATOM 0 HB2 SER A 22 19.133 6.346 -1.748 1.00 1.09 H new ATOM 0 HB3 SER A 22 18.445 6.796 -3.296 1.00 1.09 H new ATOM 0 HG SER A 22 20.772 6.697 -3.365 1.00 1.97 H new ATOM 45 N SER A 23 17.784 7.323 0.244 1.00 0.61 N ATOM 46 CA SER A 23 16.800 6.859 1.261 1.00 0.61 C ATOM 47 C SER A 23 15.936 8.035 1.719 1.00 0.36 C ATOM 48 O SER A 23 14.758 7.887 1.967 1.00 0.36 O ATOM 49 CB SER A 23 17.550 6.278 2.462 1.00 0.85 C ATOM 50 OG SER A 23 17.264 4.891 2.571 1.00 0.67 O ATOM 0 H SER A 23 18.760 7.116 0.457 1.00 0.61 H new ATOM 0 HA SER A 23 16.160 6.093 0.823 1.00 0.61 H new ATOM 0 HB2 SER A 23 18.623 6.431 2.344 1.00 0.85 H new ATOM 0 HB3 SER A 23 17.253 6.795 3.375 1.00 0.85 H new ATOM 0 HG SER A 23 17.745 4.517 3.339 1.00 0.67 H new ATOM 56 N GLU A 24 16.508 9.203 1.832 1.00 0.28 N ATOM 57 CA GLU A 24 15.705 10.380 2.272 1.00 0.43 C ATOM 58 C GLU A 24 14.552 10.600 1.293 1.00 0.36 C ATOM 59 O GLU A 24 13.439 10.893 1.686 1.00 0.45 O ATOM 60 CB GLU A 24 16.592 11.627 2.304 1.00 0.69 C ATOM 61 CG GLU A 24 15.844 12.771 2.993 1.00 1.92 C ATOM 62 CD GLU A 24 16.810 13.558 3.884 1.00 1.84 C ATOM 63 OE1 GLU A 24 18.004 13.322 3.789 1.00 1.79 O ATOM 64 OE2 GLU A 24 16.340 14.384 4.649 1.00 2.63 O ATOM 0 H GLU A 24 17.492 9.393 1.640 1.00 0.28 H new ATOM 0 HA GLU A 24 15.308 10.195 3.270 1.00 0.43 H new ATOM 0 HB2 GLU A 24 17.519 11.413 2.836 1.00 0.69 H new ATOM 0 HB3 GLU A 24 16.866 11.917 1.290 1.00 0.69 H new ATOM 0 HG2 GLU A 24 15.403 13.431 2.246 1.00 1.92 H new ATOM 0 HG3 GLU A 24 15.024 12.374 3.591 1.00 1.92 H new ATOM 71 N ARG A 25 14.805 10.456 0.019 1.00 0.33 N ATOM 72 CA ARG A 25 13.716 10.653 -0.979 1.00 0.53 C ATOM 73 C ARG A 25 12.706 9.511 -0.851 1.00 0.48 C ATOM 74 O ARG A 25 11.548 9.653 -1.186 1.00 0.69 O ATOM 75 CB ARG A 25 14.310 10.663 -2.391 1.00 0.68 C ATOM 76 CG ARG A 25 13.234 11.079 -3.397 1.00 2.32 C ATOM 77 CD ARG A 25 13.778 12.187 -4.304 1.00 1.90 C ATOM 78 NE ARG A 25 14.993 11.695 -5.017 1.00 2.05 N ATOM 79 CZ ARG A 25 15.578 12.433 -5.929 1.00 2.13 C ATOM 80 NH1 ARG A 25 14.970 13.475 -6.436 1.00 2.04 N ATOM 81 NH2 ARG A 25 16.777 12.122 -6.340 1.00 2.73 N ATOM 0 H ARG A 25 15.715 10.211 -0.371 1.00 0.33 H new ATOM 0 HA ARG A 25 13.216 11.604 -0.795 1.00 0.53 H new ATOM 0 HB2 ARG A 25 15.152 11.353 -2.437 1.00 0.68 H new ATOM 0 HB3 ARG A 25 14.694 9.674 -2.642 1.00 0.68 H new ATOM 0 HG2 ARG A 25 12.931 10.220 -3.997 1.00 2.32 H new ATOM 0 HG3 ARG A 25 12.346 11.429 -2.871 1.00 2.32 H new ATOM 0 HD2 ARG A 25 13.017 12.488 -5.024 1.00 1.90 H new ATOM 0 HD3 ARG A 25 14.023 13.069 -3.712 1.00 1.90 H new ATOM 0 HE ARG A 25 15.372 10.775 -4.792 1.00 2.05 H new ATOM 0 HH11 ARG A 25 14.031 13.720 -6.122 1.00 2.04 H new ATOM 0 HH12 ARG A 25 15.435 14.042 -7.145 1.00 2.04 H new ATOM 0 HH21 ARG A 25 17.254 11.308 -5.952 1.00 2.73 H new ATOM 0 HH22 ARG A 25 17.237 12.693 -7.049 1.00 2.73 H new ATOM 95 N ILE A 26 13.137 8.378 -0.361 1.00 0.36 N ATOM 96 CA ILE A 26 12.200 7.228 -0.204 1.00 0.54 C ATOM 97 C ILE A 26 11.242 7.515 0.955 1.00 0.43 C ATOM 98 O ILE A 26 10.081 7.160 0.917 1.00 0.63 O ATOM 99 CB ILE A 26 12.999 5.954 0.098 1.00 0.70 C ATOM 100 CG1 ILE A 26 13.901 5.622 -1.094 1.00 1.00 C ATOM 101 CG2 ILE A 26 12.037 4.788 0.349 1.00 0.57 C ATOM 102 CD1 ILE A 26 13.043 5.342 -2.330 1.00 0.39 C ATOM 0 H ILE A 26 14.096 8.200 -0.063 1.00 0.36 H new ATOM 0 HA ILE A 26 11.633 7.089 -1.124 1.00 0.54 H new ATOM 0 HB ILE A 26 13.611 6.115 0.985 1.00 0.70 H new ATOM 0 HG12 ILE A 26 14.579 6.452 -1.291 1.00 1.00 H new ATOM 0 HG13 ILE A 26 14.518 4.754 -0.864 1.00 1.00 H new ATOM 0 HG21 ILE A 26 12.608 3.885 0.563 1.00 0.57 H new ATOM 0 HG22 ILE A 26 11.396 5.022 1.199 1.00 0.57 H new ATOM 0 HG23 ILE A 26 11.422 4.627 -0.536 1.00 0.57 H new ATOM 0 HD11 ILE A 26 13.689 5.106 -3.176 1.00 0.39 H new ATOM 0 HD12 ILE A 26 12.383 4.498 -2.131 1.00 0.39 H new ATOM 0 HD13 ILE A 26 12.445 6.222 -2.565 1.00 0.39 H new ATOM 114 N ASP A 27 11.720 8.157 1.986 1.00 0.18 N ATOM 115 CA ASP A 27 10.841 8.468 3.147 1.00 0.18 C ATOM 116 C ASP A 27 9.838 9.548 2.746 1.00 0.08 C ATOM 117 O ASP A 27 8.646 9.403 2.936 1.00 0.13 O ATOM 118 CB ASP A 27 11.698 8.970 4.312 1.00 0.33 C ATOM 119 CG ASP A 27 10.829 9.111 5.564 1.00 0.31 C ATOM 120 OD1 ASP A 27 9.808 9.773 5.480 1.00 0.74 O ATOM 121 OD2 ASP A 27 11.199 8.553 6.583 1.00 0.68 O ATOM 0 H ASP A 27 12.684 8.480 2.074 1.00 0.18 H new ATOM 0 HA ASP A 27 10.304 7.570 3.453 1.00 0.18 H new ATOM 0 HB2 ASP A 27 12.516 8.275 4.501 1.00 0.33 H new ATOM 0 HB3 ASP A 27 12.148 9.930 4.059 1.00 0.33 H new ATOM 126 N LYS A 28 10.309 10.629 2.189 1.00 0.12 N ATOM 127 CA LYS A 28 9.380 11.716 1.772 1.00 0.29 C ATOM 128 C LYS A 28 8.462 11.202 0.659 1.00 0.36 C ATOM 129 O LYS A 28 7.383 11.717 0.446 1.00 0.52 O ATOM 130 CB LYS A 28 10.188 12.909 1.255 1.00 0.36 C ATOM 131 CG LYS A 28 11.145 12.439 0.157 1.00 2.02 C ATOM 132 CD LYS A 28 10.680 12.985 -1.194 1.00 2.75 C ATOM 133 CE LYS A 28 11.739 13.937 -1.753 1.00 3.74 C ATOM 134 NZ LYS A 28 11.489 14.160 -3.205 1.00 4.73 N ATOM 0 H LYS A 28 11.296 10.807 2.005 1.00 0.12 H new ATOM 0 HA LYS A 28 8.779 12.027 2.626 1.00 0.29 H new ATOM 0 HB2 LYS A 28 9.517 13.674 0.865 1.00 0.36 H new ATOM 0 HB3 LYS A 28 10.749 13.363 2.072 1.00 0.36 H new ATOM 0 HG2 LYS A 28 12.157 12.782 0.371 1.00 2.02 H new ATOM 0 HG3 LYS A 28 11.177 11.350 0.129 1.00 2.02 H new ATOM 0 HD2 LYS A 28 10.510 12.164 -1.891 1.00 2.75 H new ATOM 0 HD3 LYS A 28 9.730 13.508 -1.079 1.00 2.75 H new ATOM 0 HE2 LYS A 28 11.709 14.886 -1.218 1.00 3.74 H new ATOM 0 HE3 LYS A 28 12.734 13.519 -1.604 1.00 3.74 H new ATOM 0 HZ1 LYS A 28 12.296 14.665 -3.623 1.00 4.73 H new ATOM 0 HZ2 LYS A 28 11.370 13.243 -3.682 1.00 4.73 H new ATOM 0 HZ3 LYS A 28 10.626 14.727 -3.326 1.00 4.73 H new ATOM 148 N GLN A 29 8.880 10.189 -0.051 1.00 0.38 N ATOM 149 CA GLN A 29 8.027 9.647 -1.145 1.00 0.57 C ATOM 150 C GLN A 29 6.815 8.933 -0.537 1.00 0.45 C ATOM 151 O GLN A 29 5.685 9.144 -0.945 1.00 0.39 O ATOM 152 CB GLN A 29 8.845 8.673 -1.998 1.00 0.76 C ATOM 153 CG GLN A 29 9.583 9.455 -3.090 1.00 0.93 C ATOM 154 CD GLN A 29 8.594 9.854 -4.188 1.00 0.99 C ATOM 155 OE1 GLN A 29 7.603 9.185 -4.400 1.00 1.93 O ATOM 156 NE2 GLN A 29 8.822 10.925 -4.898 1.00 0.84 N ATOM 0 H GLN A 29 9.774 9.715 0.080 1.00 0.38 H new ATOM 0 HA GLN A 29 7.678 10.462 -1.779 1.00 0.57 H new ATOM 0 HB2 GLN A 29 9.559 8.136 -1.374 1.00 0.76 H new ATOM 0 HB3 GLN A 29 8.190 7.927 -2.448 1.00 0.76 H new ATOM 0 HG2 GLN A 29 10.048 10.344 -2.664 1.00 0.93 H new ATOM 0 HG3 GLN A 29 10.384 8.846 -3.510 1.00 0.93 H new ATOM 0 HE21 GLN A 29 9.654 11.487 -4.720 1.00 0.84 H new ATOM 0 HE22 GLN A 29 8.168 11.200 -5.631 1.00 0.84 H new ATOM 165 N ILE A 30 7.025 8.100 0.451 1.00 0.42 N ATOM 166 CA ILE A 30 5.863 7.411 1.076 1.00 0.31 C ATOM 167 C ILE A 30 5.023 8.454 1.804 1.00 0.23 C ATOM 168 O ILE A 30 3.834 8.300 1.962 1.00 0.21 O ATOM 169 CB ILE A 30 6.332 6.344 2.065 1.00 0.32 C ATOM 170 CG1 ILE A 30 7.141 5.278 1.315 1.00 0.55 C ATOM 171 CG2 ILE A 30 5.117 5.705 2.735 1.00 0.26 C ATOM 172 CD1 ILE A 30 7.461 4.106 2.248 1.00 1.21 C ATOM 0 H ILE A 30 7.938 7.872 0.845 1.00 0.42 H new ATOM 0 HA ILE A 30 5.274 6.918 0.302 1.00 0.31 H new ATOM 0 HB ILE A 30 6.962 6.799 2.829 1.00 0.32 H new ATOM 0 HG12 ILE A 30 6.577 4.923 0.452 1.00 0.55 H new ATOM 0 HG13 ILE A 30 8.065 5.713 0.935 1.00 0.55 H new ATOM 0 HG21 ILE A 30 5.449 4.944 3.441 1.00 0.26 H new ATOM 0 HG22 ILE A 30 4.550 6.470 3.266 1.00 0.26 H new ATOM 0 HG23 ILE A 30 4.483 5.245 1.977 1.00 0.26 H new ATOM 0 HD11 ILE A 30 8.035 3.355 1.705 1.00 1.21 H new ATOM 0 HD12 ILE A 30 8.043 4.465 3.097 1.00 1.21 H new ATOM 0 HD13 ILE A 30 6.532 3.663 2.607 1.00 1.21 H new ATOM 184 N ARG A 31 5.630 9.529 2.238 1.00 0.31 N ATOM 185 CA ARG A 31 4.844 10.585 2.935 1.00 0.37 C ATOM 186 C ARG A 31 3.713 11.027 2.008 1.00 0.39 C ATOM 187 O ARG A 31 2.647 11.413 2.444 1.00 0.36 O ATOM 188 CB ARG A 31 5.745 11.780 3.254 1.00 0.56 C ATOM 189 CG ARG A 31 5.117 12.597 4.385 1.00 0.52 C ATOM 190 CD ARG A 31 5.745 13.992 4.422 1.00 1.13 C ATOM 191 NE ARG A 31 5.908 14.425 5.838 1.00 0.98 N ATOM 192 CZ ARG A 31 6.977 15.078 6.202 1.00 1.89 C ATOM 193 NH1 ARG A 31 7.261 16.226 5.647 1.00 2.33 N ATOM 194 NH2 ARG A 31 7.764 14.585 7.117 1.00 2.90 N ATOM 0 H ARG A 31 6.627 9.718 2.140 1.00 0.31 H new ATOM 0 HA ARG A 31 4.439 10.196 3.869 1.00 0.37 H new ATOM 0 HB2 ARG A 31 6.737 11.435 3.546 1.00 0.56 H new ATOM 0 HB3 ARG A 31 5.872 12.402 2.368 1.00 0.56 H new ATOM 0 HG2 ARG A 31 4.040 12.676 4.235 1.00 0.52 H new ATOM 0 HG3 ARG A 31 5.270 12.093 5.339 1.00 0.52 H new ATOM 0 HD2 ARG A 31 6.713 13.980 3.920 1.00 1.13 H new ATOM 0 HD3 ARG A 31 5.115 14.701 3.884 1.00 1.13 H new ATOM 0 HE ARG A 31 5.183 14.211 6.523 1.00 0.98 H new ATOM 0 HH11 ARG A 31 6.647 16.611 4.929 1.00 2.33 H new ATOM 0 HH12 ARG A 31 8.097 16.737 5.931 1.00 2.33 H new ATOM 0 HH21 ARG A 31 7.544 13.688 7.549 1.00 2.90 H new ATOM 0 HH22 ARG A 31 8.600 15.097 7.401 1.00 2.90 H new ATOM 208 N TYR A 32 3.939 10.943 0.724 1.00 0.49 N ATOM 209 CA TYR A 32 2.883 11.324 -0.248 1.00 0.59 C ATOM 210 C TYR A 32 1.929 10.143 -0.404 1.00 0.59 C ATOM 211 O TYR A 32 0.740 10.312 -0.575 1.00 0.67 O ATOM 212 CB TYR A 32 3.514 11.651 -1.602 1.00 0.66 C ATOM 213 CG TYR A 32 3.388 13.130 -1.878 1.00 0.33 C ATOM 214 CD1 TYR A 32 3.849 14.059 -0.937 1.00 1.60 C ATOM 215 CD2 TYR A 32 2.812 13.573 -3.075 1.00 1.04 C ATOM 216 CE1 TYR A 32 3.734 15.431 -1.194 1.00 2.11 C ATOM 217 CE2 TYR A 32 2.697 14.944 -3.331 1.00 0.56 C ATOM 218 CZ TYR A 32 3.158 15.874 -2.391 1.00 1.11 C ATOM 219 OH TYR A 32 3.048 17.227 -2.644 1.00 1.62 O ATOM 0 H TYR A 32 4.815 10.625 0.309 1.00 0.49 H new ATOM 0 HA TYR A 32 2.346 12.203 0.110 1.00 0.59 H new ATOM 0 HB2 TYR A 32 4.564 11.359 -1.605 1.00 0.66 H new ATOM 0 HB3 TYR A 32 3.022 11.081 -2.390 1.00 0.66 H new ATOM 0 HD1 TYR A 32 4.293 13.718 -0.014 1.00 1.60 H new ATOM 0 HD2 TYR A 32 2.456 12.857 -3.801 1.00 1.04 H new ATOM 0 HE1 TYR A 32 4.090 16.148 -0.469 1.00 2.11 H new ATOM 0 HE2 TYR A 32 2.252 15.285 -4.254 1.00 0.56 H new ATOM 0 HH TYR A 32 2.627 17.363 -3.518 1.00 1.62 H new ATOM 229 N ILE A 33 2.441 8.940 -0.340 1.00 0.53 N ATOM 230 CA ILE A 33 1.550 7.751 -0.477 1.00 0.57 C ATOM 231 C ILE A 33 0.428 7.835 0.559 1.00 0.52 C ATOM 232 O ILE A 33 -0.734 7.670 0.246 1.00 0.52 O ATOM 233 CB ILE A 33 2.351 6.468 -0.262 1.00 0.54 C ATOM 234 CG1 ILE A 33 3.481 6.398 -1.292 1.00 0.58 C ATOM 235 CG2 ILE A 33 1.426 5.264 -0.445 1.00 0.59 C ATOM 236 CD1 ILE A 33 4.335 5.154 -1.038 1.00 0.71 C ATOM 0 H ILE A 33 3.430 8.732 -0.200 1.00 0.53 H new ATOM 0 HA ILE A 33 1.123 7.738 -1.480 1.00 0.57 H new ATOM 0 HB ILE A 33 2.772 6.461 0.743 1.00 0.54 H new ATOM 0 HG12 ILE A 33 3.066 6.366 -2.299 1.00 0.58 H new ATOM 0 HG13 ILE A 33 4.099 7.294 -1.230 1.00 0.58 H new ATOM 0 HG21 ILE A 33 1.991 4.344 -0.293 1.00 0.59 H new ATOM 0 HG22 ILE A 33 0.614 5.315 0.281 1.00 0.59 H new ATOM 0 HG23 ILE A 33 1.012 5.273 -1.453 1.00 0.59 H new ATOM 0 HD11 ILE A 33 5.138 5.108 -1.773 1.00 0.71 H new ATOM 0 HD12 ILE A 33 4.762 5.204 -0.036 1.00 0.71 H new ATOM 0 HD13 ILE A 33 3.714 4.263 -1.123 1.00 0.71 H new ATOM 248 N LEU A 34 0.768 8.100 1.788 1.00 0.47 N ATOM 249 CA LEU A 34 -0.268 8.205 2.848 1.00 0.41 C ATOM 250 C LEU A 34 -1.025 9.524 2.687 1.00 0.37 C ATOM 251 O LEU A 34 -2.220 9.593 2.893 1.00 0.26 O ATOM 252 CB LEU A 34 0.414 8.177 4.214 1.00 0.48 C ATOM 253 CG LEU A 34 0.618 6.729 4.660 1.00 0.68 C ATOM 254 CD1 LEU A 34 1.834 6.142 3.941 1.00 0.76 C ATOM 255 CD2 LEU A 34 0.854 6.690 6.171 1.00 0.88 C ATOM 0 H LEU A 34 1.726 8.249 2.105 1.00 0.47 H new ATOM 0 HA LEU A 34 -0.967 7.372 2.766 1.00 0.41 H new ATOM 0 HB2 LEU A 34 1.374 8.690 4.162 1.00 0.48 H new ATOM 0 HB3 LEU A 34 -0.193 8.710 4.945 1.00 0.48 H new ATOM 0 HG LEU A 34 -0.269 6.144 4.414 1.00 0.68 H new ATOM 0 HD11 LEU A 34 1.981 5.110 4.258 1.00 0.76 H new ATOM 0 HD12 LEU A 34 1.669 6.171 2.864 1.00 0.76 H new ATOM 0 HD13 LEU A 34 2.720 6.727 4.188 1.00 0.76 H new ATOM 0 HD21 LEU A 34 1.000 5.658 6.490 1.00 0.88 H new ATOM 0 HD22 LEU A 34 1.741 7.274 6.416 1.00 0.88 H new ATOM 0 HD23 LEU A 34 -0.010 7.110 6.685 1.00 0.88 H new ATOM 267 N ASP A 35 -0.341 10.574 2.310 1.00 0.49 N ATOM 268 CA ASP A 35 -1.029 11.886 2.128 1.00 0.50 C ATOM 269 C ASP A 35 -2.194 11.697 1.162 1.00 0.38 C ATOM 270 O ASP A 35 -3.198 12.377 1.236 1.00 0.37 O ATOM 271 CB ASP A 35 -0.045 12.908 1.555 1.00 0.64 C ATOM 272 CG ASP A 35 0.002 14.139 2.462 1.00 0.59 C ATOM 273 OD1 ASP A 35 0.486 14.012 3.575 1.00 1.55 O ATOM 274 OD2 ASP A 35 -0.445 15.188 2.028 1.00 0.67 O ATOM 0 H ASP A 35 0.661 10.579 2.121 1.00 0.49 H new ATOM 0 HA ASP A 35 -1.397 12.249 3.088 1.00 0.50 H new ATOM 0 HB2 ASP A 35 0.948 12.466 1.473 1.00 0.64 H new ATOM 0 HB3 ASP A 35 -0.349 13.196 0.549 1.00 0.64 H new ATOM 279 N GLY A 36 -2.070 10.759 0.269 1.00 0.35 N ATOM 280 CA GLY A 36 -3.168 10.496 -0.691 1.00 0.25 C ATOM 281 C GLY A 36 -4.230 9.655 0.011 1.00 0.20 C ATOM 282 O GLY A 36 -5.408 9.913 -0.095 1.00 0.17 O ATOM 0 H GLY A 36 -1.250 10.161 0.164 1.00 0.35 H new ATOM 0 HA2 GLY A 36 -3.598 11.434 -1.042 1.00 0.25 H new ATOM 0 HA3 GLY A 36 -2.788 9.972 -1.568 1.00 0.25 H new ATOM 286 N ILE A 37 -3.815 8.650 0.734 1.00 0.20 N ATOM 287 CA ILE A 37 -4.796 7.787 1.451 1.00 0.15 C ATOM 288 C ILE A 37 -5.673 8.643 2.368 1.00 0.14 C ATOM 289 O ILE A 37 -6.773 8.260 2.714 1.00 0.14 O ATOM 290 CB ILE A 37 -4.059 6.748 2.293 1.00 0.19 C ATOM 291 CG1 ILE A 37 -3.158 5.901 1.387 1.00 0.28 C ATOM 292 CG2 ILE A 37 -5.087 5.852 2.987 1.00 0.16 C ATOM 293 CD1 ILE A 37 -4.016 5.112 0.397 1.00 0.37 C ATOM 0 H ILE A 37 -2.837 8.389 0.859 1.00 0.20 H new ATOM 0 HA ILE A 37 -5.421 7.283 0.714 1.00 0.15 H new ATOM 0 HB ILE A 37 -3.443 7.246 3.042 1.00 0.19 H new ATOM 0 HG12 ILE A 37 -2.462 6.543 0.848 1.00 0.28 H new ATOM 0 HG13 ILE A 37 -2.560 5.217 1.990 1.00 0.28 H new ATOM 0 HG21 ILE A 37 -4.571 5.106 3.591 1.00 0.16 H new ATOM 0 HG22 ILE A 37 -5.725 6.460 3.628 1.00 0.16 H new ATOM 0 HG23 ILE A 37 -5.698 5.351 2.237 1.00 0.16 H new ATOM 0 HD11 ILE A 37 -3.372 4.511 -0.245 1.00 0.37 H new ATOM 0 HD12 ILE A 37 -4.694 4.458 0.944 1.00 0.37 H new ATOM 0 HD13 ILE A 37 -4.595 5.804 -0.215 1.00 0.37 H new ATOM 305 N SER A 38 -5.213 9.803 2.751 1.00 0.21 N ATOM 306 CA SER A 38 -6.047 10.667 3.623 1.00 0.28 C ATOM 307 C SER A 38 -7.230 11.123 2.790 1.00 0.31 C ATOM 308 O SER A 38 -8.366 11.109 3.223 1.00 0.37 O ATOM 309 CB SER A 38 -5.235 11.879 4.085 1.00 0.39 C ATOM 310 OG SER A 38 -5.597 12.206 5.420 1.00 0.54 O ATOM 0 H SER A 38 -4.302 10.185 2.498 1.00 0.21 H new ATOM 0 HA SER A 38 -6.379 10.125 4.509 1.00 0.28 H new ATOM 0 HB2 SER A 38 -4.169 11.660 4.029 1.00 0.39 H new ATOM 0 HB3 SER A 38 -5.421 12.728 3.427 1.00 0.39 H new ATOM 0 HG SER A 38 -5.077 12.981 5.719 1.00 0.54 H new ATOM 316 N ALA A 39 -6.962 11.498 1.573 1.00 0.30 N ATOM 317 CA ALA A 39 -8.055 11.927 0.676 1.00 0.32 C ATOM 318 C ALA A 39 -8.728 10.685 0.079 1.00 0.27 C ATOM 319 O ALA A 39 -9.766 10.775 -0.547 1.00 0.35 O ATOM 320 CB ALA A 39 -7.492 12.799 -0.446 1.00 0.36 C ATOM 0 H ALA A 39 -6.028 11.524 1.164 1.00 0.30 H new ATOM 0 HA ALA A 39 -8.786 12.506 1.240 1.00 0.32 H new ATOM 0 HB1 ALA A 39 -8.302 13.113 -1.104 1.00 0.36 H new ATOM 0 HB2 ALA A 39 -7.012 13.679 -0.017 1.00 0.36 H new ATOM 0 HB3 ALA A 39 -6.760 12.229 -1.018 1.00 0.36 H new ATOM 326 N LEU A 40 -8.154 9.520 0.270 1.00 0.19 N ATOM 327 CA LEU A 40 -8.779 8.290 -0.284 1.00 0.17 C ATOM 328 C LEU A 40 -9.493 7.519 0.827 1.00 0.18 C ATOM 329 O LEU A 40 -10.129 6.519 0.576 1.00 0.22 O ATOM 330 CB LEU A 40 -7.718 7.383 -0.917 1.00 0.11 C ATOM 331 CG LEU A 40 -6.877 8.175 -1.919 1.00 0.08 C ATOM 332 CD1 LEU A 40 -5.494 7.534 -2.037 1.00 0.47 C ATOM 333 CD2 LEU A 40 -7.555 8.148 -3.286 1.00 0.35 C ATOM 0 H LEU A 40 -7.285 9.374 0.783 1.00 0.19 H new ATOM 0 HA LEU A 40 -9.497 8.589 -1.047 1.00 0.17 H new ATOM 0 HB2 LEU A 40 -7.076 6.966 -0.141 1.00 0.11 H new ATOM 0 HB3 LEU A 40 -8.199 6.543 -1.418 1.00 0.11 H new ATOM 0 HG LEU A 40 -6.780 9.205 -1.576 1.00 0.08 H new ATOM 0 HD11 LEU A 40 -4.892 8.096 -2.751 1.00 0.47 H new ATOM 0 HD12 LEU A 40 -5.005 7.543 -1.063 1.00 0.47 H new ATOM 0 HD13 LEU A 40 -5.598 6.505 -2.381 1.00 0.47 H new ATOM 0 HD21 LEU A 40 -6.956 8.712 -4.001 1.00 0.35 H new ATOM 0 HD22 LEU A 40 -7.648 7.116 -3.626 1.00 0.35 H new ATOM 0 HD23 LEU A 40 -8.546 8.596 -3.210 1.00 0.35 H new ATOM 345 N ARG A 41 -9.397 7.962 2.052 1.00 0.17 N ATOM 346 CA ARG A 41 -10.087 7.234 3.156 1.00 0.19 C ATOM 347 C ARG A 41 -11.035 8.183 3.897 1.00 0.20 C ATOM 348 O ARG A 41 -11.856 7.762 4.686 1.00 0.33 O ATOM 349 CB ARG A 41 -9.051 6.682 4.138 1.00 0.23 C ATOM 350 CG ARG A 41 -9.748 5.775 5.153 1.00 0.47 C ATOM 351 CD ARG A 41 -8.765 5.392 6.262 1.00 0.77 C ATOM 352 NE ARG A 41 -9.135 6.098 7.522 1.00 1.28 N ATOM 353 CZ ARG A 41 -8.329 6.063 8.550 1.00 1.27 C ATOM 354 NH1 ARG A 41 -7.882 4.918 8.990 1.00 1.21 N ATOM 355 NH2 ARG A 41 -7.973 7.172 9.139 1.00 2.24 N ATOM 0 H ARG A 41 -8.874 8.791 2.335 1.00 0.17 H new ATOM 0 HA ARG A 41 -10.661 6.411 2.731 1.00 0.19 H new ATOM 0 HB2 ARG A 41 -8.285 6.123 3.600 1.00 0.23 H new ATOM 0 HB3 ARG A 41 -8.547 7.501 4.651 1.00 0.23 H new ATOM 0 HG2 ARG A 41 -10.611 6.286 5.579 1.00 0.47 H new ATOM 0 HG3 ARG A 41 -10.121 4.878 4.658 1.00 0.47 H new ATOM 0 HD2 ARG A 41 -8.780 4.314 6.419 1.00 0.77 H new ATOM 0 HD3 ARG A 41 -7.749 5.657 5.969 1.00 0.77 H new ATOM 0 HE ARG A 41 -10.016 6.608 7.582 1.00 1.28 H new ATOM 0 HH11 ARG A 41 -8.162 4.051 8.531 1.00 1.21 H new ATOM 0 HH12 ARG A 41 -7.253 4.890 9.792 1.00 1.21 H new ATOM 0 HH21 ARG A 41 -8.324 8.067 8.797 1.00 2.24 H new ATOM 0 HH22 ARG A 41 -7.344 7.144 9.941 1.00 2.24 H new ATOM 369 N LYS A 42 -10.941 9.462 3.651 1.00 0.31 N ATOM 370 CA LYS A 42 -11.840 10.413 4.344 1.00 0.31 C ATOM 371 C LYS A 42 -13.221 10.341 3.705 1.00 0.39 C ATOM 372 O LYS A 42 -14.230 10.366 4.379 1.00 0.44 O ATOM 373 CB LYS A 42 -11.278 11.826 4.197 1.00 0.40 C ATOM 374 CG LYS A 42 -11.928 12.747 5.232 1.00 0.37 C ATOM 375 CD LYS A 42 -12.066 14.152 4.647 1.00 0.83 C ATOM 376 CE LYS A 42 -10.686 14.811 4.570 1.00 1.81 C ATOM 377 NZ LYS A 42 -10.513 15.455 3.236 1.00 2.98 N ATOM 0 H LYS A 42 -10.279 9.884 3.000 1.00 0.31 H new ATOM 0 HA LYS A 42 -11.914 10.160 5.402 1.00 0.31 H new ATOM 0 HB2 LYS A 42 -10.197 11.814 4.334 1.00 0.40 H new ATOM 0 HB3 LYS A 42 -11.468 12.201 3.191 1.00 0.40 H new ATOM 0 HG2 LYS A 42 -12.908 12.361 5.514 1.00 0.37 H new ATOM 0 HG3 LYS A 42 -11.324 12.777 6.139 1.00 0.37 H new ATOM 0 HD2 LYS A 42 -12.513 14.102 3.654 1.00 0.83 H new ATOM 0 HD3 LYS A 42 -12.733 14.752 5.267 1.00 0.83 H new ATOM 0 HE2 LYS A 42 -10.582 15.555 5.360 1.00 1.81 H new ATOM 0 HE3 LYS A 42 -9.907 14.066 4.729 1.00 1.81 H new ATOM 0 HZ1 LYS A 42 -9.575 15.902 3.185 1.00 2.98 H new ATOM 0 HZ2 LYS A 42 -10.594 14.735 2.490 1.00 2.98 H new ATOM 0 HZ3 LYS A 42 -11.249 16.178 3.101 1.00 2.98 H new ATOM 391 N GLU A 43 -13.273 10.251 2.407 1.00 0.47 N ATOM 392 CA GLU A 43 -14.586 10.182 1.722 1.00 0.59 C ATOM 393 C GLU A 43 -15.117 8.749 1.766 1.00 0.58 C ATOM 394 O GLU A 43 -16.307 8.519 1.902 1.00 0.79 O ATOM 395 CB GLU A 43 -14.424 10.624 0.265 1.00 0.66 C ATOM 396 CG GLU A 43 -15.589 11.535 -0.128 1.00 0.83 C ATOM 397 CD GLU A 43 -15.510 11.850 -1.624 1.00 1.37 C ATOM 398 OE1 GLU A 43 -14.828 11.125 -2.329 1.00 1.73 O ATOM 399 OE2 GLU A 43 -16.135 12.812 -2.041 1.00 1.84 O ATOM 0 H GLU A 43 -12.460 10.222 1.792 1.00 0.47 H new ATOM 0 HA GLU A 43 -15.292 10.842 2.227 1.00 0.59 H new ATOM 0 HB2 GLU A 43 -13.478 11.151 0.137 1.00 0.66 H new ATOM 0 HB3 GLU A 43 -14.394 9.752 -0.389 1.00 0.66 H new ATOM 0 HG2 GLU A 43 -16.537 11.050 0.103 1.00 0.83 H new ATOM 0 HG3 GLU A 43 -15.554 12.458 0.451 1.00 0.83 H new ATOM 406 N THR A 44 -14.243 7.783 1.645 1.00 0.49 N ATOM 407 CA THR A 44 -14.689 6.360 1.665 1.00 0.51 C ATOM 408 C THR A 44 -15.596 6.110 2.869 1.00 1.45 C ATOM 409 O THR A 44 -16.673 5.562 2.739 1.00 3.02 O ATOM 410 CB THR A 44 -13.475 5.435 1.740 1.00 1.33 C ATOM 411 OG1 THR A 44 -12.718 5.737 2.904 1.00 3.30 O ATOM 412 CG2 THR A 44 -12.610 5.629 0.497 1.00 0.45 C ATOM 0 H THR A 44 -13.238 7.920 1.533 1.00 0.49 H new ATOM 0 HA THR A 44 -15.244 6.154 0.750 1.00 0.51 H new ATOM 0 HB THR A 44 -13.809 4.399 1.788 1.00 1.33 H new ATOM 0 HG1 THR A 44 -12.270 4.926 3.223 1.00 3.30 H new ATOM 0 HG21 THR A 44 -11.744 4.969 0.550 1.00 0.45 H new ATOM 0 HG22 THR A 44 -13.193 5.391 -0.393 1.00 0.45 H new ATOM 0 HG23 THR A 44 -12.275 6.665 0.445 1.00 0.45 H new ATOM 420 N CYS A 45 -15.178 6.505 4.040 1.00 0.78 N ATOM 421 CA CYS A 45 -16.035 6.282 5.235 1.00 1.74 C ATOM 422 C CYS A 45 -16.918 7.511 5.471 1.00 2.11 C ATOM 423 O CYS A 45 -17.885 7.445 6.204 1.00 2.69 O ATOM 424 CB CYS A 45 -15.168 6.010 6.465 1.00 2.20 C ATOM 425 SG CYS A 45 -15.061 4.218 6.749 1.00 2.31 S ATOM 0 H CYS A 45 -14.287 6.969 4.219 1.00 0.78 H new ATOM 0 HA CYS A 45 -16.670 5.414 5.061 1.00 1.74 H new ATOM 0 HB2 CYS A 45 -14.171 6.426 6.319 1.00 2.20 H new ATOM 0 HB3 CYS A 45 -15.594 6.502 7.339 1.00 2.20 H new ATOM 0 HG CYS A 45 -14.322 3.988 7.793 1.00 2.31 H new ATOM 430 N ASN A 46 -16.628 8.632 4.836 1.00 1.96 N ATOM 431 CA ASN A 46 -17.507 9.833 5.022 1.00 2.59 C ATOM 432 C ASN A 46 -18.939 9.391 4.729 1.00 2.41 C ATOM 433 O ASN A 46 -19.801 9.418 5.585 1.00 2.64 O ATOM 434 CB ASN A 46 -17.095 10.949 4.050 1.00 2.96 C ATOM 435 CG ASN A 46 -18.118 12.088 4.098 1.00 4.35 C ATOM 436 OD1 ASN A 46 -18.541 12.496 5.160 1.00 4.28 O ATOM 437 ND2 ASN A 46 -18.533 12.621 2.981 1.00 5.70 N ATOM 0 H ASN A 46 -15.834 8.762 4.209 1.00 1.96 H new ATOM 0 HA ASN A 46 -17.418 10.222 6.036 1.00 2.59 H new ATOM 0 HB2 ASN A 46 -16.106 11.325 4.313 1.00 2.96 H new ATOM 0 HB3 ASN A 46 -17.026 10.553 3.037 1.00 2.96 H new ATOM 0 HD21 ASN A 46 -19.213 13.381 3.000 1.00 5.70 H new ATOM 0 HD22 ASN A 46 -18.177 12.278 2.089 1.00 5.70 H new ATOM 444 N LYS A 47 -19.179 8.916 3.536 1.00 2.04 N ATOM 445 CA LYS A 47 -20.532 8.400 3.216 1.00 1.84 C ATOM 446 C LYS A 47 -20.604 6.936 3.675 1.00 1.40 C ATOM 447 O LYS A 47 -21.663 6.353 3.768 1.00 1.52 O ATOM 448 CB LYS A 47 -20.797 8.495 1.709 1.00 1.94 C ATOM 449 CG LYS A 47 -19.825 7.591 0.946 1.00 3.25 C ATOM 450 CD LYS A 47 -20.090 7.712 -0.557 1.00 4.41 C ATOM 451 CE LYS A 47 -21.165 6.705 -0.970 1.00 5.43 C ATOM 452 NZ LYS A 47 -22.480 7.399 -1.084 1.00 5.23 N ATOM 0 H LYS A 47 -18.499 8.865 2.777 1.00 2.04 H new ATOM 0 HA LYS A 47 -21.289 8.994 3.728 1.00 1.84 H new ATOM 0 HB2 LYS A 47 -21.824 8.201 1.493 1.00 1.94 H new ATOM 0 HB3 LYS A 47 -20.684 9.527 1.376 1.00 1.94 H new ATOM 0 HG2 LYS A 47 -18.796 7.875 1.169 1.00 3.25 H new ATOM 0 HG3 LYS A 47 -19.947 6.556 1.266 1.00 3.25 H new ATOM 0 HD2 LYS A 47 -20.413 8.724 -0.799 1.00 4.41 H new ATOM 0 HD3 LYS A 47 -19.172 7.528 -1.115 1.00 4.41 H new ATOM 0 HE2 LYS A 47 -20.901 6.245 -1.922 1.00 5.43 H new ATOM 0 HE3 LYS A 47 -21.228 5.902 -0.235 1.00 5.43 H new ATOM 0 HZ1 LYS A 47 -23.088 6.884 -1.753 1.00 5.23 H new ATOM 0 HZ2 LYS A 47 -22.939 7.428 -0.151 1.00 5.23 H new ATOM 0 HZ3 LYS A 47 -22.332 8.369 -1.428 1.00 5.23 H new ATOM 466 N SER A 48 -19.465 6.360 3.980 1.00 1.33 N ATOM 467 CA SER A 48 -19.397 4.951 4.460 1.00 1.34 C ATOM 468 C SER A 48 -20.125 4.002 3.523 1.00 1.91 C ATOM 469 O SER A 48 -19.526 3.357 2.691 1.00 2.45 O ATOM 470 CB SER A 48 -19.993 4.832 5.865 1.00 3.65 C ATOM 471 OG SER A 48 -21.017 5.802 6.040 1.00 5.45 O ATOM 0 H SER A 48 -18.559 6.824 3.913 1.00 1.33 H new ATOM 0 HA SER A 48 -18.344 4.671 4.484 1.00 1.34 H new ATOM 0 HB2 SER A 48 -20.399 3.831 6.014 1.00 3.65 H new ATOM 0 HB3 SER A 48 -19.213 4.974 6.613 1.00 3.65 H new ATOM 0 HG SER A 48 -21.701 5.684 5.348 1.00 5.45 H new ATOM 477 N ASN A 49 -21.399 3.839 3.701 1.00 2.61 N ATOM 478 CA ASN A 49 -22.136 2.863 2.856 1.00 4.13 C ATOM 479 C ASN A 49 -21.508 1.474 3.061 1.00 4.25 C ATOM 480 O ASN A 49 -21.776 0.547 2.324 1.00 5.38 O ATOM 481 CB ASN A 49 -22.018 3.272 1.385 1.00 4.87 C ATOM 482 CG ASN A 49 -23.131 2.605 0.574 1.00 5.93 C ATOM 483 OD1 ASN A 49 -24.175 2.283 1.106 1.00 5.90 O ATOM 484 ND2 ASN A 49 -22.951 2.386 -0.699 1.00 7.17 N ATOM 0 H ASN A 49 -21.963 4.335 4.391 1.00 2.61 H new ATOM 0 HA ASN A 49 -23.190 2.841 3.134 1.00 4.13 H new ATOM 0 HB2 ASN A 49 -22.087 4.356 1.292 1.00 4.87 H new ATOM 0 HB3 ASN A 49 -21.044 2.980 0.993 1.00 4.87 H new ATOM 0 HD21 ASN A 49 -23.687 1.944 -1.250 1.00 7.17 H new ATOM 0 HD22 ASN A 49 -22.074 2.657 -1.144 1.00 7.17 H new ATOM 491 N MET A 50 -20.668 1.335 4.061 1.00 3.20 N ATOM 492 CA MET A 50 -20.009 0.032 4.330 1.00 3.29 C ATOM 493 C MET A 50 -19.428 0.057 5.750 1.00 3.24 C ATOM 494 O MET A 50 -19.489 -0.917 6.473 1.00 4.08 O ATOM 495 CB MET A 50 -18.867 -0.170 3.331 1.00 2.65 C ATOM 496 CG MET A 50 -19.293 -1.131 2.212 1.00 3.52 C ATOM 497 SD MET A 50 -19.770 -2.736 2.910 1.00 2.18 S ATOM 498 CE MET A 50 -18.161 -3.178 3.605 1.00 0.44 C ATOM 0 H MET A 50 -20.413 2.083 4.706 1.00 3.20 H new ATOM 0 HA MET A 50 -20.732 -0.778 4.233 1.00 3.29 H new ATOM 0 HB2 MET A 50 -18.577 0.790 2.903 1.00 2.65 H new ATOM 0 HB3 MET A 50 -17.992 -0.567 3.846 1.00 2.65 H new ATOM 0 HG2 MET A 50 -20.129 -0.706 1.656 1.00 3.52 H new ATOM 0 HG3 MET A 50 -18.474 -1.263 1.505 1.00 3.52 H new ATOM 0 HE1 MET A 50 -17.942 -4.222 3.381 1.00 0.44 H new ATOM 0 HE2 MET A 50 -17.389 -2.544 3.168 1.00 0.44 H new ATOM 0 HE3 MET A 50 -18.180 -3.035 4.685 1.00 0.44 H new ATOM 660 N ASN A 62 -10.170 -8.086 6.690 1.00 1.30 N ATOM 661 CA ASN A 62 -8.730 -8.454 6.512 1.00 1.15 C ATOM 662 C ASN A 62 -8.488 -8.977 5.093 1.00 0.98 C ATOM 663 O ASN A 62 -8.889 -10.069 4.745 1.00 0.98 O ATOM 664 CB ASN A 62 -8.328 -9.543 7.518 1.00 1.12 C ATOM 665 CG ASN A 62 -9.012 -9.295 8.866 1.00 1.30 C ATOM 666 OD1 ASN A 62 -9.824 -10.086 9.303 1.00 2.09 O ATOM 667 ND2 ASN A 62 -8.717 -8.221 9.547 1.00 1.52 N ATOM 0 HA ASN A 62 -8.128 -7.561 6.681 1.00 1.15 H new ATOM 0 HB2 ASN A 62 -8.608 -10.524 7.135 1.00 1.12 H new ATOM 0 HB3 ASN A 62 -7.246 -9.548 7.646 1.00 1.12 H new ATOM 0 HD21 ASN A 62 -9.168 -8.047 10.445 1.00 1.52 H new ATOM 0 HD22 ASN A 62 -8.035 -7.556 9.181 1.00 1.52 H new ATOM 674 N LEU A 63 -7.817 -8.208 4.279 1.00 1.29 N ATOM 675 CA LEU A 63 -7.523 -8.660 2.889 1.00 1.11 C ATOM 676 C LEU A 63 -6.262 -9.528 2.913 1.00 1.06 C ATOM 677 O LEU A 63 -5.822 -9.961 3.960 1.00 1.27 O ATOM 678 CB LEU A 63 -7.297 -7.431 2.004 1.00 0.98 C ATOM 679 CG LEU A 63 -8.568 -7.139 1.207 1.00 0.58 C ATOM 680 CD1 LEU A 63 -8.392 -5.834 0.427 1.00 0.38 C ATOM 681 CD2 LEU A 63 -8.835 -8.285 0.228 1.00 0.67 C ATOM 0 H LEU A 63 -7.459 -7.283 4.518 1.00 1.29 H new ATOM 0 HA LEU A 63 -8.356 -9.240 2.491 1.00 1.11 H new ATOM 0 HB2 LEU A 63 -7.034 -6.570 2.619 1.00 0.98 H new ATOM 0 HB3 LEU A 63 -6.462 -7.606 1.326 1.00 0.98 H new ATOM 0 HG LEU A 63 -9.411 -7.044 1.892 1.00 0.58 H new ATOM 0 HD11 LEU A 63 -9.298 -5.625 -0.142 1.00 0.38 H new ATOM 0 HD12 LEU A 63 -8.204 -5.017 1.123 1.00 0.38 H new ATOM 0 HD13 LEU A 63 -7.548 -5.930 -0.257 1.00 0.38 H new ATOM 0 HD21 LEU A 63 -9.742 -8.075 -0.339 1.00 0.67 H new ATOM 0 HD22 LEU A 63 -7.993 -8.382 -0.457 1.00 0.67 H new ATOM 0 HD23 LEU A 63 -8.961 -9.215 0.782 1.00 0.67 H new ATOM 693 N ASN A 64 -5.671 -9.788 1.780 1.00 0.80 N ATOM 694 CA ASN A 64 -4.439 -10.625 1.767 1.00 0.75 C ATOM 695 C ASN A 64 -3.299 -9.811 1.165 1.00 0.62 C ATOM 696 O ASN A 64 -2.431 -10.329 0.490 1.00 0.58 O ATOM 697 CB ASN A 64 -4.680 -11.884 0.931 1.00 0.72 C ATOM 698 CG ASN A 64 -5.178 -11.484 -0.458 1.00 1.37 C ATOM 699 OD1 ASN A 64 -4.886 -10.404 -0.933 1.00 2.76 O ATOM 700 ND2 ASN A 64 -5.922 -12.314 -1.136 1.00 1.28 N ATOM 0 H ASN A 64 -5.986 -9.459 0.867 1.00 0.80 H new ATOM 0 HA ASN A 64 -4.181 -10.923 2.783 1.00 0.75 H new ATOM 0 HB2 ASN A 64 -3.758 -12.460 0.847 1.00 0.72 H new ATOM 0 HB3 ASN A 64 -5.413 -12.525 1.421 1.00 0.72 H new ATOM 0 HD21 ASN A 64 -6.258 -12.056 -2.064 1.00 1.28 H new ATOM 0 HD22 ASN A 64 -6.168 -13.221 -0.738 1.00 1.28 H new ATOM 707 N LEU A 65 -3.307 -8.532 1.405 1.00 0.62 N ATOM 708 CA LEU A 65 -2.244 -7.654 0.853 1.00 0.62 C ATOM 709 C LEU A 65 -1.069 -7.402 1.845 1.00 0.74 C ATOM 710 O LEU A 65 -0.028 -6.957 1.403 1.00 1.27 O ATOM 711 CB LEU A 65 -2.873 -6.315 0.457 1.00 0.65 C ATOM 712 CG LEU A 65 -3.319 -5.556 1.706 1.00 0.67 C ATOM 713 CD1 LEU A 65 -2.853 -4.105 1.612 1.00 0.73 C ATOM 714 CD2 LEU A 65 -4.845 -5.592 1.801 1.00 0.78 C ATOM 0 H LEU A 65 -4.012 -8.053 1.966 1.00 0.62 H new ATOM 0 HA LEU A 65 -1.816 -8.165 -0.009 1.00 0.62 H new ATOM 0 HB2 LEU A 65 -2.154 -5.718 -0.104 1.00 0.65 H new ATOM 0 HB3 LEU A 65 -3.727 -6.485 -0.199 1.00 0.65 H new ATOM 0 HG LEU A 65 -2.885 -6.022 2.591 1.00 0.67 H new ATOM 0 HD11 LEU A 65 -3.171 -3.562 2.502 1.00 0.73 H new ATOM 0 HD12 LEU A 65 -1.766 -4.076 1.538 1.00 0.73 H new ATOM 0 HD13 LEU A 65 -3.289 -3.639 0.728 1.00 0.73 H new ATOM 0 HD21 LEU A 65 -5.167 -5.051 2.691 1.00 0.78 H new ATOM 0 HD22 LEU A 65 -5.276 -5.123 0.916 1.00 0.78 H new ATOM 0 HD23 LEU A 65 -5.181 -6.627 1.864 1.00 0.78 H new ATOM 726 N PRO A 66 -1.221 -7.655 3.145 1.00 1.16 N ATOM 727 CA PRO A 66 -0.119 -7.401 4.096 1.00 1.19 C ATOM 728 C PRO A 66 0.942 -8.501 3.999 1.00 0.37 C ATOM 729 O PRO A 66 0.636 -9.676 3.992 1.00 1.41 O ATOM 730 CB PRO A 66 -0.799 -7.418 5.467 1.00 2.27 C ATOM 731 CG PRO A 66 -2.104 -8.224 5.296 1.00 2.83 C ATOM 732 CD PRO A 66 -2.440 -8.204 3.793 1.00 2.15 C ATOM 0 HA PRO A 66 0.399 -6.462 3.899 1.00 1.19 H new ATOM 0 HB2 PRO A 66 -0.153 -7.878 6.215 1.00 2.27 H new ATOM 0 HB3 PRO A 66 -1.010 -6.405 5.808 1.00 2.27 H new ATOM 0 HG2 PRO A 66 -1.977 -9.247 5.651 1.00 2.83 H new ATOM 0 HG3 PRO A 66 -2.912 -7.782 5.879 1.00 2.83 H new ATOM 0 HD2 PRO A 66 -2.669 -9.204 3.424 1.00 2.15 H new ATOM 0 HD3 PRO A 66 -3.312 -7.582 3.590 1.00 2.15 H new ATOM 740 N LYS A 67 2.189 -8.123 3.923 1.00 0.65 N ATOM 741 CA LYS A 67 3.272 -9.140 3.827 1.00 1.42 C ATOM 742 C LYS A 67 4.419 -8.759 4.762 1.00 1.47 C ATOM 743 O LYS A 67 5.547 -8.593 4.345 1.00 1.59 O ATOM 744 CB LYS A 67 3.790 -9.192 2.391 1.00 2.32 C ATOM 745 CG LYS A 67 4.156 -10.633 2.031 1.00 2.96 C ATOM 746 CD LYS A 67 2.899 -11.505 2.064 1.00 2.62 C ATOM 747 CE LYS A 67 2.987 -12.485 3.235 1.00 2.45 C ATOM 748 NZ LYS A 67 3.494 -13.799 2.747 1.00 3.64 N ATOM 0 H LYS A 67 2.504 -7.153 3.923 1.00 0.65 H new ATOM 0 HA LYS A 67 2.879 -10.115 4.113 1.00 1.42 H new ATOM 0 HB2 LYS A 67 3.030 -8.817 1.706 1.00 2.32 H new ATOM 0 HB3 LYS A 67 4.662 -8.547 2.284 1.00 2.32 H new ATOM 0 HG2 LYS A 67 4.609 -10.667 1.040 1.00 2.96 H new ATOM 0 HG3 LYS A 67 4.896 -11.017 2.733 1.00 2.96 H new ATOM 0 HD2 LYS A 67 2.012 -10.879 2.166 1.00 2.62 H new ATOM 0 HD3 LYS A 67 2.798 -12.051 1.126 1.00 2.62 H new ATOM 0 HE2 LYS A 67 3.651 -12.090 4.004 1.00 2.45 H new ATOM 0 HE3 LYS A 67 2.006 -12.609 3.693 1.00 2.45 H new ATOM 0 HZ1 LYS A 67 3.554 -14.465 3.543 1.00 3.64 H new ATOM 0 HZ2 LYS A 67 2.844 -14.176 2.028 1.00 3.64 H new ATOM 0 HZ3 LYS A 67 4.438 -13.673 2.329 1.00 3.64 H new ATOM 762 N MET A 68 4.136 -8.619 6.024 1.00 1.43 N ATOM 763 CA MET A 68 5.205 -8.249 6.992 1.00 1.48 C ATOM 764 C MET A 68 5.224 -9.260 8.141 1.00 2.05 C ATOM 765 O MET A 68 4.404 -10.156 8.205 1.00 2.65 O ATOM 766 CB MET A 68 4.929 -6.849 7.546 1.00 1.25 C ATOM 767 CG MET A 68 6.025 -5.886 7.078 1.00 1.11 C ATOM 768 SD MET A 68 6.739 -5.029 8.505 1.00 1.87 S ATOM 769 CE MET A 68 6.948 -3.411 7.722 1.00 0.96 C ATOM 0 H MET A 68 3.209 -8.745 6.429 1.00 1.43 H new ATOM 0 HA MET A 68 6.171 -8.255 6.488 1.00 1.48 H new ATOM 0 HB2 MET A 68 3.954 -6.499 7.207 1.00 1.25 H new ATOM 0 HB3 MET A 68 4.897 -6.878 8.635 1.00 1.25 H new ATOM 0 HG2 MET A 68 6.802 -6.435 6.546 1.00 1.11 H new ATOM 0 HG3 MET A 68 5.610 -5.161 6.377 1.00 1.11 H new ATOM 0 HE1 MET A 68 7.400 -2.719 8.432 1.00 0.96 H new ATOM 0 HE2 MET A 68 7.595 -3.510 6.850 1.00 0.96 H new ATOM 0 HE3 MET A 68 5.976 -3.029 7.411 1.00 0.96 H new ATOM 779 N ALA A 69 6.152 -9.128 9.050 1.00 1.87 N ATOM 780 CA ALA A 69 6.217 -10.085 10.190 1.00 2.41 C ATOM 781 C ALA A 69 7.366 -9.695 11.122 1.00 2.25 C ATOM 782 O ALA A 69 8.257 -8.955 10.753 1.00 2.39 O ATOM 783 CB ALA A 69 6.452 -11.499 9.657 1.00 2.93 C ATOM 0 H ALA A 69 6.866 -8.400 9.052 1.00 1.87 H new ATOM 0 HA ALA A 69 5.277 -10.055 10.741 1.00 2.41 H new ATOM 0 HB1 ALA A 69 6.500 -12.199 10.491 1.00 2.93 H new ATOM 0 HB2 ALA A 69 5.633 -11.779 8.995 1.00 2.93 H new ATOM 0 HB3 ALA A 69 7.391 -11.528 9.105 1.00 2.93 H new ATOM 789 N GLU A 70 7.352 -10.187 12.331 1.00 2.03 N ATOM 790 CA GLU A 70 8.441 -9.847 13.291 1.00 1.86 C ATOM 791 C GLU A 70 9.769 -10.430 12.799 1.00 1.85 C ATOM 792 O GLU A 70 10.831 -10.017 13.222 1.00 1.69 O ATOM 793 CB GLU A 70 8.109 -10.431 14.666 1.00 2.01 C ATOM 794 CG GLU A 70 8.001 -11.954 14.563 1.00 3.49 C ATOM 795 CD GLU A 70 7.196 -12.491 15.748 1.00 3.76 C ATOM 796 OE1 GLU A 70 7.283 -11.902 16.813 1.00 2.91 O ATOM 797 OE2 GLU A 70 6.506 -13.482 15.570 1.00 4.96 O ATOM 0 H GLU A 70 6.632 -10.811 12.696 1.00 2.03 H new ATOM 0 HA GLU A 70 8.529 -8.763 13.364 1.00 1.86 H new ATOM 0 HB2 GLU A 70 8.882 -10.159 15.385 1.00 2.01 H new ATOM 0 HB3 GLU A 70 7.171 -10.014 15.033 1.00 2.01 H new ATOM 0 HG2 GLU A 70 7.518 -12.232 13.626 1.00 3.49 H new ATOM 0 HG3 GLU A 70 8.996 -12.400 14.554 1.00 3.49 H new ATOM 804 N LYS A 71 9.721 -11.384 11.913 1.00 2.07 N ATOM 805 CA LYS A 71 10.980 -11.989 11.402 1.00 2.15 C ATOM 806 C LYS A 71 11.623 -11.052 10.378 1.00 1.93 C ATOM 807 O LYS A 71 12.830 -10.979 10.261 1.00 1.93 O ATOM 808 CB LYS A 71 10.662 -13.327 10.736 1.00 2.55 C ATOM 809 CG LYS A 71 10.476 -14.398 11.810 1.00 2.21 C ATOM 810 CD LYS A 71 10.497 -15.782 11.158 1.00 2.72 C ATOM 811 CE LYS A 71 9.096 -16.129 10.653 1.00 2.38 C ATOM 812 NZ LYS A 71 9.071 -16.054 9.165 1.00 3.11 N ATOM 0 H LYS A 71 8.863 -11.771 11.520 1.00 2.07 H new ATOM 0 HA LYS A 71 11.670 -12.145 12.231 1.00 2.15 H new ATOM 0 HB2 LYS A 71 9.758 -13.240 10.133 1.00 2.55 H new ATOM 0 HB3 LYS A 71 11.469 -13.610 10.060 1.00 2.55 H new ATOM 0 HG2 LYS A 71 11.268 -14.323 12.555 1.00 2.21 H new ATOM 0 HG3 LYS A 71 9.532 -14.244 12.332 1.00 2.21 H new ATOM 0 HD2 LYS A 71 11.207 -15.795 10.331 1.00 2.72 H new ATOM 0 HD3 LYS A 71 10.831 -16.530 11.877 1.00 2.72 H new ATOM 0 HE2 LYS A 71 8.817 -17.130 10.982 1.00 2.38 H new ATOM 0 HE3 LYS A 71 8.365 -15.439 11.075 1.00 2.38 H new ATOM 0 HZ1 LYS A 71 8.118 -16.290 8.821 1.00 3.11 H new ATOM 0 HZ2 LYS A 71 9.320 -15.091 8.862 1.00 3.11 H new ATOM 0 HZ3 LYS A 71 9.758 -16.729 8.772 1.00 3.11 H new ATOM 826 N ASP A 72 10.826 -10.334 9.634 1.00 1.83 N ATOM 827 CA ASP A 72 11.391 -9.401 8.614 1.00 1.64 C ATOM 828 C ASP A 72 12.448 -8.504 9.264 1.00 1.70 C ATOM 829 O ASP A 72 13.541 -8.346 8.756 1.00 2.06 O ATOM 830 CB ASP A 72 10.268 -8.533 8.042 1.00 1.33 C ATOM 831 CG ASP A 72 9.184 -9.430 7.442 1.00 0.70 C ATOM 832 OD1 ASP A 72 9.478 -10.583 7.170 1.00 1.33 O ATOM 833 OD2 ASP A 72 8.078 -8.949 7.266 1.00 0.82 O ATOM 0 H ASP A 72 9.808 -10.352 9.687 1.00 1.83 H new ATOM 0 HA ASP A 72 11.852 -9.978 7.812 1.00 1.64 H new ATOM 0 HB2 ASP A 72 9.843 -7.906 8.826 1.00 1.33 H new ATOM 0 HB3 ASP A 72 10.664 -7.864 7.279 1.00 1.33 H new ATOM 838 N GLY A 73 12.130 -7.917 10.385 1.00 1.44 N ATOM 839 CA GLY A 73 13.117 -7.035 11.071 1.00 1.61 C ATOM 840 C GLY A 73 12.591 -5.595 11.117 1.00 1.13 C ATOM 841 O GLY A 73 13.312 -4.677 11.454 1.00 1.27 O ATOM 0 H GLY A 73 11.230 -8.010 10.856 1.00 1.44 H new ATOM 0 HA2 GLY A 73 13.299 -7.397 12.083 1.00 1.61 H new ATOM 0 HA3 GLY A 73 14.071 -7.066 10.545 1.00 1.61 H new ATOM 845 N CYS A 74 11.345 -5.382 10.782 1.00 0.81 N ATOM 846 CA CYS A 74 10.797 -3.996 10.813 1.00 0.46 C ATOM 847 C CYS A 74 9.962 -3.812 12.084 1.00 0.80 C ATOM 848 O CYS A 74 8.835 -3.361 12.036 1.00 1.48 O ATOM 849 CB CYS A 74 9.911 -3.753 9.585 1.00 0.74 C ATOM 850 SG CYS A 74 10.701 -4.420 8.093 1.00 1.42 S ATOM 0 H CYS A 74 10.687 -6.105 10.490 1.00 0.81 H new ATOM 0 HA CYS A 74 11.622 -3.284 10.804 1.00 0.46 H new ATOM 0 HB2 CYS A 74 8.939 -4.224 9.731 1.00 0.74 H new ATOM 0 HB3 CYS A 74 9.732 -2.685 9.463 1.00 0.74 H new ATOM 855 N PHE A 75 10.504 -4.161 13.219 1.00 0.55 N ATOM 856 CA PHE A 75 9.739 -4.009 14.488 1.00 1.01 C ATOM 857 C PHE A 75 10.709 -3.840 15.655 1.00 0.88 C ATOM 858 O PHE A 75 10.697 -2.841 16.346 1.00 2.01 O ATOM 859 CB PHE A 75 8.878 -5.252 14.721 1.00 1.47 C ATOM 860 CG PHE A 75 7.874 -5.388 13.601 1.00 1.93 C ATOM 861 CD1 PHE A 75 6.634 -4.742 13.689 1.00 2.01 C ATOM 862 CD2 PHE A 75 8.183 -6.160 12.475 1.00 2.67 C ATOM 863 CE1 PHE A 75 5.703 -4.871 12.651 1.00 2.37 C ATOM 864 CE2 PHE A 75 7.253 -6.288 11.437 1.00 3.15 C ATOM 865 CZ PHE A 75 6.012 -5.644 11.525 1.00 2.85 C ATOM 0 H PHE A 75 11.443 -4.545 13.322 1.00 0.55 H new ATOM 0 HA PHE A 75 9.098 -3.130 14.417 1.00 1.01 H new ATOM 0 HB2 PHE A 75 9.508 -6.140 14.768 1.00 1.47 H new ATOM 0 HB3 PHE A 75 8.362 -5.176 15.678 1.00 1.47 H new ATOM 0 HD1 PHE A 75 6.396 -4.145 14.557 1.00 2.01 H new ATOM 0 HD2 PHE A 75 9.139 -6.657 12.407 1.00 2.67 H new ATOM 0 HE1 PHE A 75 4.746 -4.374 12.719 1.00 2.37 H new ATOM 0 HE2 PHE A 75 7.492 -6.883 10.568 1.00 3.15 H new ATOM 0 HZ PHE A 75 5.294 -5.744 10.725 1.00 2.85 H new ATOM 875 N GLN A 76 11.549 -4.811 15.879 1.00 1.80 N ATOM 876 CA GLN A 76 12.524 -4.721 17.002 1.00 1.50 C ATOM 877 C GLN A 76 13.224 -6.070 17.154 1.00 1.58 C ATOM 878 O GLN A 76 14.381 -6.145 17.517 1.00 1.25 O ATOM 879 CB GLN A 76 11.787 -4.381 18.302 1.00 1.87 C ATOM 880 CG GLN A 76 12.450 -3.172 18.967 1.00 1.23 C ATOM 881 CD GLN A 76 11.710 -2.835 20.262 1.00 1.95 C ATOM 882 OE1 GLN A 76 11.699 -3.619 21.191 1.00 2.89 O ATOM 883 NE2 GLN A 76 11.088 -1.693 20.365 1.00 2.09 N ATOM 0 H GLN A 76 11.603 -5.669 15.329 1.00 1.80 H new ATOM 0 HA GLN A 76 13.256 -3.941 16.792 1.00 1.50 H new ATOM 0 HB2 GLN A 76 10.740 -4.164 18.092 1.00 1.87 H new ATOM 0 HB3 GLN A 76 11.806 -5.236 18.977 1.00 1.87 H new ATOM 0 HG2 GLN A 76 13.497 -3.389 19.179 1.00 1.23 H new ATOM 0 HG3 GLN A 76 12.432 -2.316 18.292 1.00 1.23 H new ATOM 0 HE21 GLN A 76 11.097 -1.035 19.586 1.00 2.09 H new ATOM 0 HE22 GLN A 76 10.592 -1.458 21.225 1.00 2.09 H new ATOM 892 N SER A 77 12.530 -7.136 16.868 1.00 2.10 N ATOM 893 CA SER A 77 13.157 -8.483 16.985 1.00 2.35 C ATOM 894 C SER A 77 14.076 -8.708 15.783 1.00 2.18 C ATOM 895 O SER A 77 13.678 -9.269 14.782 1.00 2.44 O ATOM 896 CB SER A 77 12.068 -9.556 17.011 1.00 2.81 C ATOM 897 OG SER A 77 12.674 -10.842 16.961 1.00 4.28 O ATOM 0 H SER A 77 11.558 -7.134 16.559 1.00 2.10 H new ATOM 0 HA SER A 77 13.736 -8.543 17.907 1.00 2.35 H new ATOM 0 HB2 SER A 77 11.468 -9.459 17.916 1.00 2.81 H new ATOM 0 HB3 SER A 77 11.393 -9.426 16.165 1.00 2.81 H new ATOM 0 HG SER A 77 11.979 -11.532 16.979 1.00 4.28 H new ATOM 903 N GLY A 78 15.300 -8.264 15.868 1.00 1.88 N ATOM 904 CA GLY A 78 16.237 -8.443 14.723 1.00 1.82 C ATOM 905 C GLY A 78 16.061 -7.277 13.748 1.00 1.44 C ATOM 906 O GLY A 78 15.936 -7.465 12.554 1.00 1.48 O ATOM 0 H GLY A 78 15.691 -7.786 16.679 1.00 1.88 H new ATOM 0 HA2 GLY A 78 17.266 -8.482 15.081 1.00 1.82 H new ATOM 0 HA3 GLY A 78 16.039 -9.389 14.219 1.00 1.82 H new ATOM 910 N PHE A 79 16.040 -6.071 14.252 1.00 1.12 N ATOM 911 CA PHE A 79 15.860 -4.884 13.365 1.00 0.78 C ATOM 912 C PHE A 79 16.827 -4.954 12.181 1.00 0.72 C ATOM 913 O PHE A 79 17.980 -4.583 12.285 1.00 1.10 O ATOM 914 CB PHE A 79 16.131 -3.608 14.163 1.00 0.84 C ATOM 915 CG PHE A 79 15.818 -2.404 13.308 1.00 0.73 C ATOM 916 CD1 PHE A 79 14.536 -2.243 12.770 1.00 0.66 C ATOM 917 CD2 PHE A 79 16.810 -1.450 13.055 1.00 0.94 C ATOM 918 CE1 PHE A 79 14.246 -1.126 11.978 1.00 0.89 C ATOM 919 CE2 PHE A 79 16.519 -0.333 12.262 1.00 1.05 C ATOM 920 CZ PHE A 79 15.237 -0.171 11.723 1.00 1.06 C ATOM 0 H PHE A 79 16.140 -5.856 15.244 1.00 1.12 H new ATOM 0 HA PHE A 79 14.837 -4.877 12.988 1.00 0.78 H new ATOM 0 HB2 PHE A 79 15.521 -3.595 15.066 1.00 0.84 H new ATOM 0 HB3 PHE A 79 17.173 -3.580 14.482 1.00 0.84 H new ATOM 0 HD1 PHE A 79 13.771 -2.980 12.966 1.00 0.66 H new ATOM 0 HD2 PHE A 79 17.799 -1.575 13.471 1.00 0.94 H new ATOM 0 HE1 PHE A 79 13.257 -1.001 11.563 1.00 0.89 H new ATOM 0 HE2 PHE A 79 17.284 0.404 12.066 1.00 1.05 H new ATOM 0 HZ PHE A 79 15.013 0.690 11.111 1.00 1.06 H new ATOM 930 N ASN A 80 16.364 -5.418 11.054 1.00 0.50 N ATOM 931 CA ASN A 80 17.252 -5.500 9.861 1.00 0.58 C ATOM 932 C ASN A 80 17.176 -4.184 9.088 1.00 0.45 C ATOM 933 O ASN A 80 16.522 -3.247 9.505 1.00 0.98 O ATOM 934 CB ASN A 80 16.792 -6.647 8.961 1.00 0.76 C ATOM 935 CG ASN A 80 17.113 -7.983 9.633 1.00 0.33 C ATOM 936 OD1 ASN A 80 17.752 -8.018 10.665 1.00 0.55 O ATOM 937 ND2 ASN A 80 16.694 -9.092 9.087 1.00 1.08 N ATOM 0 H ASN A 80 15.409 -5.744 10.907 1.00 0.50 H new ATOM 0 HA ASN A 80 18.279 -5.680 10.179 1.00 0.58 H new ATOM 0 HB2 ASN A 80 15.721 -6.570 8.774 1.00 0.76 H new ATOM 0 HB3 ASN A 80 17.289 -6.586 7.993 1.00 0.76 H new ATOM 0 HD21 ASN A 80 16.903 -9.988 9.527 1.00 1.08 H new ATOM 0 HD22 ASN A 80 16.157 -9.063 8.220 1.00 1.08 H new ATOM 944 N GLU A 81 17.835 -4.100 7.966 1.00 0.86 N ATOM 945 CA GLU A 81 17.792 -2.838 7.177 1.00 0.68 C ATOM 946 C GLU A 81 17.551 -3.160 5.701 1.00 0.87 C ATOM 947 O GLU A 81 16.592 -2.709 5.106 1.00 0.84 O ATOM 948 CB GLU A 81 19.124 -2.099 7.323 1.00 0.81 C ATOM 949 CG GLU A 81 19.341 -1.722 8.789 1.00 0.47 C ATOM 950 CD GLU A 81 20.662 -0.963 8.933 1.00 0.83 C ATOM 951 OE1 GLU A 81 21.168 -0.495 7.926 1.00 1.31 O ATOM 952 OE2 GLU A 81 21.145 -0.862 10.048 1.00 0.80 O ATOM 0 H GLU A 81 18.399 -4.848 7.563 1.00 0.86 H new ATOM 0 HA GLU A 81 16.982 -2.210 7.548 1.00 0.68 H new ATOM 0 HB2 GLU A 81 19.942 -2.729 6.974 1.00 0.81 H new ATOM 0 HB3 GLU A 81 19.125 -1.203 6.702 1.00 0.81 H new ATOM 0 HG2 GLU A 81 18.515 -1.105 9.143 1.00 0.47 H new ATOM 0 HG3 GLU A 81 19.356 -2.619 9.408 1.00 0.47 H new ATOM 959 N GLU A 82 18.415 -3.933 5.107 1.00 1.06 N ATOM 960 CA GLU A 82 18.243 -4.281 3.672 1.00 1.24 C ATOM 961 C GLU A 82 17.077 -5.259 3.515 1.00 1.26 C ATOM 962 O GLU A 82 16.509 -5.392 2.448 1.00 1.32 O ATOM 963 CB GLU A 82 19.528 -4.932 3.167 1.00 1.46 C ATOM 964 CG GLU A 82 20.278 -3.957 2.260 1.00 2.65 C ATOM 965 CD GLU A 82 21.732 -4.412 2.118 1.00 3.79 C ATOM 966 OE1 GLU A 82 22.389 -4.552 3.136 1.00 4.61 O ATOM 967 OE2 GLU A 82 22.162 -4.613 0.995 1.00 3.97 O ATOM 0 H GLU A 82 19.236 -4.340 5.556 1.00 1.06 H new ATOM 0 HA GLU A 82 18.031 -3.380 3.096 1.00 1.24 H new ATOM 0 HB2 GLU A 82 20.158 -5.218 4.010 1.00 1.46 H new ATOM 0 HB3 GLU A 82 19.294 -5.845 2.620 1.00 1.46 H new ATOM 0 HG2 GLU A 82 19.801 -3.914 1.281 1.00 2.65 H new ATOM 0 HG3 GLU A 82 20.239 -2.951 2.678 1.00 2.65 H new ATOM 974 N THR A 83 16.714 -5.949 4.563 1.00 1.22 N ATOM 975 CA THR A 83 15.585 -6.915 4.458 1.00 1.27 C ATOM 976 C THR A 83 14.266 -6.182 4.700 1.00 0.99 C ATOM 977 O THR A 83 13.226 -6.586 4.223 1.00 0.83 O ATOM 978 CB THR A 83 15.751 -8.026 5.495 1.00 1.45 C ATOM 979 OG1 THR A 83 17.019 -8.644 5.327 1.00 1.70 O ATOM 980 CG2 THR A 83 14.643 -9.063 5.301 1.00 1.56 C ATOM 0 H THR A 83 17.149 -5.885 5.483 1.00 1.22 H new ATOM 0 HA THR A 83 15.581 -7.356 3.461 1.00 1.27 H new ATOM 0 HB THR A 83 15.686 -7.606 6.499 1.00 1.45 H new ATOM 0 HG1 THR A 83 17.127 -9.355 5.992 1.00 1.70 H new ATOM 0 HG21 THR A 83 14.756 -9.858 6.038 1.00 1.56 H new ATOM 0 HG22 THR A 83 13.671 -8.586 5.428 1.00 1.56 H new ATOM 0 HG23 THR A 83 14.711 -9.485 4.298 1.00 1.56 H new ATOM 988 N CYS A 84 14.300 -5.100 5.430 1.00 0.95 N ATOM 989 CA CYS A 84 13.046 -4.339 5.686 1.00 0.70 C ATOM 990 C CYS A 84 12.702 -3.540 4.433 1.00 0.57 C ATOM 991 O CYS A 84 11.550 -3.344 4.097 1.00 0.60 O ATOM 992 CB CYS A 84 13.259 -3.375 6.854 1.00 0.64 C ATOM 993 SG CYS A 84 12.683 -4.145 8.386 1.00 1.58 S ATOM 0 H CYS A 84 15.140 -4.712 5.859 1.00 0.95 H new ATOM 0 HA CYS A 84 12.237 -5.027 5.932 1.00 0.70 H new ATOM 0 HB2 CYS A 84 14.315 -3.117 6.939 1.00 0.64 H new ATOM 0 HB3 CYS A 84 12.718 -2.446 6.676 1.00 0.64 H new ATOM 998 N LEU A 85 13.704 -3.081 3.742 1.00 0.60 N ATOM 999 CA LEU A 85 13.472 -2.291 2.504 1.00 0.57 C ATOM 1000 C LEU A 85 13.025 -3.228 1.380 1.00 0.65 C ATOM 1001 O LEU A 85 12.046 -2.982 0.711 1.00 0.47 O ATOM 1002 CB LEU A 85 14.781 -1.603 2.113 1.00 0.73 C ATOM 1003 CG LEU A 85 14.514 -0.486 1.103 1.00 0.81 C ATOM 1004 CD1 LEU A 85 13.508 0.511 1.686 1.00 0.72 C ATOM 1005 CD2 LEU A 85 15.830 0.234 0.804 1.00 1.15 C ATOM 0 H LEU A 85 14.685 -3.221 3.985 1.00 0.60 H new ATOM 0 HA LEU A 85 12.697 -1.544 2.674 1.00 0.57 H new ATOM 0 HB2 LEU A 85 15.263 -1.192 3.000 1.00 0.73 H new ATOM 0 HB3 LEU A 85 15.469 -2.332 1.685 1.00 0.73 H new ATOM 0 HG LEU A 85 14.104 -0.910 0.186 1.00 0.81 H new ATOM 0 HD11 LEU A 85 13.321 1.305 0.963 1.00 0.72 H new ATOM 0 HD12 LEU A 85 12.573 -0.004 1.909 1.00 0.72 H new ATOM 0 HD13 LEU A 85 13.912 0.942 2.602 1.00 0.72 H new ATOM 0 HD21 LEU A 85 15.652 1.033 0.084 1.00 1.15 H new ATOM 0 HD22 LEU A 85 16.230 0.657 1.725 1.00 1.15 H new ATOM 0 HD23 LEU A 85 16.546 -0.475 0.389 1.00 1.15 H new ATOM 1017 N VAL A 86 13.739 -4.301 1.172 1.00 0.99 N ATOM 1018 CA VAL A 86 13.363 -5.264 0.094 1.00 1.08 C ATOM 1019 C VAL A 86 11.966 -5.827 0.365 1.00 0.81 C ATOM 1020 O VAL A 86 11.151 -5.936 -0.523 1.00 0.60 O ATOM 1021 CB VAL A 86 14.360 -6.418 0.089 1.00 1.51 C ATOM 1022 CG1 VAL A 86 14.034 -7.369 -1.065 1.00 1.98 C ATOM 1023 CG2 VAL A 86 15.772 -5.864 -0.086 1.00 1.67 C ATOM 0 H VAL A 86 14.571 -4.554 1.705 1.00 0.99 H new ATOM 0 HA VAL A 86 13.371 -4.749 -0.867 1.00 1.08 H new ATOM 0 HB VAL A 86 14.297 -6.961 1.032 1.00 1.51 H new ATOM 0 HG11 VAL A 86 14.746 -8.194 -1.069 1.00 1.98 H new ATOM 0 HG12 VAL A 86 13.025 -7.762 -0.939 1.00 1.98 H new ATOM 0 HG13 VAL A 86 14.098 -6.830 -2.010 1.00 1.98 H new ATOM 0 HG21 VAL A 86 16.488 -6.686 -0.090 1.00 1.67 H new ATOM 0 HG22 VAL A 86 15.836 -5.323 -1.030 1.00 1.67 H new ATOM 0 HG23 VAL A 86 16.002 -5.187 0.737 1.00 1.67 H new ATOM 1033 N LYS A 87 11.692 -6.203 1.585 1.00 0.93 N ATOM 1034 CA LYS A 87 10.353 -6.774 1.906 1.00 1.01 C ATOM 1035 C LYS A 87 9.260 -5.762 1.560 1.00 0.77 C ATOM 1036 O LYS A 87 8.269 -6.094 0.942 1.00 1.09 O ATOM 1037 CB LYS A 87 10.285 -7.111 3.398 1.00 1.32 C ATOM 1038 CG LYS A 87 10.810 -8.531 3.627 1.00 2.25 C ATOM 1039 CD LYS A 87 9.940 -9.531 2.860 1.00 1.71 C ATOM 1040 CE LYS A 87 9.629 -10.731 3.758 1.00 1.72 C ATOM 1041 NZ LYS A 87 8.618 -11.601 3.093 1.00 1.27 N ATOM 0 H LYS A 87 12.337 -6.139 2.373 1.00 0.93 H new ATOM 0 HA LYS A 87 10.200 -7.680 1.320 1.00 1.01 H new ATOM 0 HB2 LYS A 87 10.877 -6.397 3.970 1.00 1.32 H new ATOM 0 HB3 LYS A 87 9.258 -7.030 3.753 1.00 1.32 H new ATOM 0 HG2 LYS A 87 11.845 -8.605 3.294 1.00 2.25 H new ATOM 0 HG3 LYS A 87 10.800 -8.766 4.691 1.00 2.25 H new ATOM 0 HD2 LYS A 87 9.014 -9.053 2.540 1.00 1.71 H new ATOM 0 HD3 LYS A 87 10.456 -9.862 1.959 1.00 1.71 H new ATOM 0 HE2 LYS A 87 10.539 -11.298 3.954 1.00 1.72 H new ATOM 0 HE3 LYS A 87 9.252 -10.389 4.722 1.00 1.72 H new ATOM 0 HZ1 LYS A 87 8.407 -12.416 3.703 1.00 1.27 H new ATOM 0 HZ2 LYS A 87 7.747 -11.057 2.928 1.00 1.27 H new ATOM 0 HZ3 LYS A 87 8.994 -11.937 2.184 1.00 1.27 H new ATOM 1055 N ILE A 88 9.436 -4.528 1.944 1.00 0.49 N ATOM 1056 CA ILE A 88 8.408 -3.494 1.626 1.00 0.83 C ATOM 1057 C ILE A 88 8.505 -3.126 0.140 1.00 0.56 C ATOM 1058 O ILE A 88 7.609 -2.528 -0.420 1.00 0.58 O ATOM 1059 CB ILE A 88 8.651 -2.256 2.505 1.00 1.31 C ATOM 1060 CG1 ILE A 88 8.165 -2.555 3.924 1.00 1.77 C ATOM 1061 CG2 ILE A 88 7.891 -1.040 1.954 1.00 1.59 C ATOM 1062 CD1 ILE A 88 8.447 -1.353 4.824 1.00 1.10 C ATOM 0 H ILE A 88 10.246 -4.190 2.464 1.00 0.49 H new ATOM 0 HA ILE A 88 7.409 -3.881 1.828 1.00 0.83 H new ATOM 0 HB ILE A 88 9.717 -2.026 2.508 1.00 1.31 H new ATOM 0 HG12 ILE A 88 7.097 -2.774 3.915 1.00 1.77 H new ATOM 0 HG13 ILE A 88 8.668 -3.440 4.313 1.00 1.77 H new ATOM 0 HG21 ILE A 88 8.077 -0.175 2.591 1.00 1.59 H new ATOM 0 HG22 ILE A 88 8.233 -0.825 0.942 1.00 1.59 H new ATOM 0 HG23 ILE A 88 6.823 -1.255 1.938 1.00 1.59 H new ATOM 0 HD11 ILE A 88 8.101 -1.566 5.835 1.00 1.10 H new ATOM 0 HD12 ILE A 88 9.519 -1.155 4.842 1.00 1.10 H new ATOM 0 HD13 ILE A 88 7.923 -0.479 4.438 1.00 1.10 H new ATOM 1074 N ILE A 89 9.582 -3.480 -0.500 1.00 0.42 N ATOM 1075 CA ILE A 89 9.737 -3.160 -1.941 1.00 0.56 C ATOM 1076 C ILE A 89 8.796 -4.078 -2.734 1.00 0.41 C ATOM 1077 O ILE A 89 7.926 -3.621 -3.456 1.00 0.51 O ATOM 1078 CB ILE A 89 11.225 -3.357 -2.301 1.00 0.84 C ATOM 1079 CG1 ILE A 89 11.964 -2.039 -2.046 1.00 1.12 C ATOM 1080 CG2 ILE A 89 11.432 -3.758 -3.765 1.00 0.67 C ATOM 1081 CD1 ILE A 89 13.465 -2.238 -2.269 1.00 0.93 C ATOM 0 H ILE A 89 10.366 -3.981 -0.082 1.00 0.42 H new ATOM 0 HA ILE A 89 9.468 -2.132 -2.183 1.00 0.56 H new ATOM 0 HB ILE A 89 11.611 -4.166 -1.681 1.00 0.84 H new ATOM 0 HG12 ILE A 89 11.587 -1.264 -2.714 1.00 1.12 H new ATOM 0 HG13 ILE A 89 11.780 -1.699 -1.027 1.00 1.12 H new ATOM 0 HG21 ILE A 89 12.497 -3.883 -3.961 1.00 0.67 H new ATOM 0 HG22 ILE A 89 10.914 -4.697 -3.962 1.00 0.67 H new ATOM 0 HG23 ILE A 89 11.032 -2.980 -4.415 1.00 0.67 H new ATOM 0 HD11 ILE A 89 13.988 -1.299 -2.087 1.00 0.93 H new ATOM 0 HD12 ILE A 89 13.837 -2.999 -1.583 1.00 0.93 H new ATOM 0 HD13 ILE A 89 13.641 -2.558 -3.296 1.00 0.93 H new ATOM 1093 N THR A 90 8.934 -5.364 -2.582 1.00 0.39 N ATOM 1094 CA THR A 90 8.018 -6.284 -3.298 1.00 0.69 C ATOM 1095 C THR A 90 6.621 -6.102 -2.702 1.00 0.53 C ATOM 1096 O THR A 90 5.620 -6.295 -3.363 1.00 0.76 O ATOM 1097 CB THR A 90 8.490 -7.729 -3.130 1.00 1.04 C ATOM 1098 OG1 THR A 90 7.603 -8.595 -3.820 1.00 1.83 O ATOM 1099 CG2 THR A 90 8.520 -8.100 -1.646 1.00 0.57 C ATOM 0 H THR A 90 9.638 -5.813 -1.996 1.00 0.39 H new ATOM 0 HA THR A 90 8.004 -6.061 -4.365 1.00 0.69 H new ATOM 0 HB THR A 90 9.495 -7.830 -3.541 1.00 1.04 H new ATOM 0 HG1 THR A 90 7.886 -8.676 -4.755 1.00 1.83 H new ATOM 0 HG21 THR A 90 8.857 -9.131 -1.535 1.00 0.57 H new ATOM 0 HG22 THR A 90 9.205 -7.436 -1.119 1.00 0.57 H new ATOM 0 HG23 THR A 90 7.520 -7.998 -1.225 1.00 0.57 H new ATOM 1107 N GLY A 91 6.552 -5.688 -1.460 1.00 0.38 N ATOM 1108 CA GLY A 91 5.227 -5.445 -0.829 1.00 0.52 C ATOM 1109 C GLY A 91 4.599 -4.241 -1.524 1.00 0.40 C ATOM 1110 O GLY A 91 3.397 -4.118 -1.621 1.00 0.45 O ATOM 0 H GLY A 91 7.358 -5.509 -0.860 1.00 0.38 H new ATOM 0 HA2 GLY A 91 4.588 -6.322 -0.931 1.00 0.52 H new ATOM 0 HA3 GLY A 91 5.340 -5.255 0.238 1.00 0.52 H new ATOM 1114 N LEU A 92 5.422 -3.360 -2.032 1.00 0.31 N ATOM 1115 CA LEU A 92 4.902 -2.171 -2.756 1.00 0.30 C ATOM 1116 C LEU A 92 4.363 -2.642 -4.108 1.00 0.25 C ATOM 1117 O LEU A 92 3.422 -2.090 -4.640 1.00 0.34 O ATOM 1118 CB LEU A 92 6.037 -1.169 -2.975 1.00 0.33 C ATOM 1119 CG LEU A 92 5.917 -0.032 -1.959 1.00 0.09 C ATOM 1120 CD1 LEU A 92 7.315 0.446 -1.558 1.00 0.51 C ATOM 1121 CD2 LEU A 92 5.145 1.131 -2.587 1.00 0.59 C ATOM 0 H LEU A 92 6.439 -3.418 -1.974 1.00 0.31 H new ATOM 0 HA LEU A 92 4.113 -1.688 -2.180 1.00 0.30 H new ATOM 0 HB2 LEU A 92 7.001 -1.666 -2.868 1.00 0.33 H new ATOM 0 HB3 LEU A 92 5.994 -0.771 -3.989 1.00 0.33 H new ATOM 0 HG LEU A 92 5.387 -0.389 -1.076 1.00 0.09 H new ATOM 0 HD11 LEU A 92 7.229 1.256 -0.834 1.00 0.51 H new ATOM 0 HD12 LEU A 92 7.869 -0.381 -1.113 1.00 0.51 H new ATOM 0 HD13 LEU A 92 7.845 0.803 -2.441 1.00 0.51 H new ATOM 0 HD21 LEU A 92 5.058 1.942 -1.864 1.00 0.59 H new ATOM 0 HD22 LEU A 92 5.677 1.486 -3.470 1.00 0.59 H new ATOM 0 HD23 LEU A 92 4.149 0.794 -2.875 1.00 0.59 H new ATOM 1133 N LEU A 93 4.954 -3.675 -4.656 1.00 0.15 N ATOM 1134 CA LEU A 93 4.475 -4.210 -5.967 1.00 0.12 C ATOM 1135 C LEU A 93 3.041 -4.729 -5.787 1.00 0.15 C ATOM 1136 O LEU A 93 2.129 -4.384 -6.527 1.00 0.16 O ATOM 1137 CB LEU A 93 5.390 -5.358 -6.410 1.00 0.09 C ATOM 1138 CG LEU A 93 6.554 -4.796 -7.234 1.00 0.56 C ATOM 1139 CD1 LEU A 93 7.875 -5.407 -6.760 1.00 0.56 C ATOM 1140 CD2 LEU A 93 6.342 -5.144 -8.704 1.00 1.10 C ATOM 0 H LEU A 93 5.748 -4.171 -4.251 1.00 0.15 H new ATOM 0 HA LEU A 93 4.493 -3.427 -6.725 1.00 0.12 H new ATOM 0 HB2 LEU A 93 5.771 -5.890 -5.538 1.00 0.09 H new ATOM 0 HB3 LEU A 93 4.826 -6.079 -7.002 1.00 0.09 H new ATOM 0 HG LEU A 93 6.592 -3.714 -7.107 1.00 0.56 H new ATOM 0 HD11 LEU A 93 8.696 -5.002 -7.351 1.00 0.56 H new ATOM 0 HD12 LEU A 93 8.031 -5.165 -5.709 1.00 0.56 H new ATOM 0 HD13 LEU A 93 7.840 -6.490 -6.882 1.00 0.56 H new ATOM 0 HD21 LEU A 93 7.167 -4.746 -9.295 1.00 1.10 H new ATOM 0 HD22 LEU A 93 6.302 -6.227 -8.819 1.00 1.10 H new ATOM 0 HD23 LEU A 93 5.405 -4.707 -9.050 1.00 1.10 H new ATOM 1152 N GLU A 94 2.825 -5.540 -4.788 1.00 0.16 N ATOM 1153 CA GLU A 94 1.454 -6.048 -4.544 1.00 0.18 C ATOM 1154 C GLU A 94 0.577 -4.847 -4.189 1.00 0.23 C ATOM 1155 O GLU A 94 -0.591 -4.794 -4.510 1.00 0.38 O ATOM 1156 CB GLU A 94 1.472 -7.055 -3.388 1.00 0.16 C ATOM 1157 CG GLU A 94 1.995 -6.381 -2.119 1.00 2.53 C ATOM 1158 CD GLU A 94 1.771 -7.309 -0.924 1.00 3.07 C ATOM 1159 OE1 GLU A 94 0.894 -8.153 -1.012 1.00 2.16 O ATOM 1160 OE2 GLU A 94 2.480 -7.161 0.058 1.00 4.57 O ATOM 0 H GLU A 94 3.537 -5.869 -4.136 1.00 0.16 H new ATOM 0 HA GLU A 94 1.064 -6.555 -5.427 1.00 0.18 H new ATOM 0 HB2 GLU A 94 0.468 -7.443 -3.217 1.00 0.16 H new ATOM 0 HB3 GLU A 94 2.103 -7.906 -3.645 1.00 0.16 H new ATOM 0 HG2 GLU A 94 3.056 -6.155 -2.225 1.00 2.53 H new ATOM 0 HG3 GLU A 94 1.481 -5.433 -1.959 1.00 2.53 H new ATOM 1167 N PHE A 95 1.155 -3.867 -3.551 1.00 0.16 N ATOM 1168 CA PHE A 95 0.387 -2.645 -3.192 1.00 0.21 C ATOM 1169 C PHE A 95 -0.074 -1.977 -4.482 1.00 0.17 C ATOM 1170 O PHE A 95 -1.107 -1.343 -4.535 1.00 0.23 O ATOM 1171 CB PHE A 95 1.294 -1.689 -2.413 1.00 0.21 C ATOM 1172 CG PHE A 95 1.041 -1.815 -0.921 1.00 0.27 C ATOM 1173 CD1 PHE A 95 0.573 -3.020 -0.372 1.00 0.45 C ATOM 1174 CD2 PHE A 95 1.280 -0.717 -0.084 1.00 0.65 C ATOM 1175 CE1 PHE A 95 0.345 -3.123 1.004 1.00 0.41 C ATOM 1176 CE2 PHE A 95 1.052 -0.822 1.293 1.00 0.76 C ATOM 1177 CZ PHE A 95 0.584 -2.025 1.837 1.00 0.44 C ATOM 0 H PHE A 95 2.133 -3.862 -3.262 1.00 0.16 H new ATOM 0 HA PHE A 95 -0.473 -2.902 -2.574 1.00 0.21 H new ATOM 0 HB2 PHE A 95 2.339 -1.911 -2.631 1.00 0.21 H new ATOM 0 HB3 PHE A 95 1.112 -0.663 -2.734 1.00 0.21 H new ATOM 0 HD1 PHE A 95 0.389 -3.869 -1.014 1.00 0.45 H new ATOM 0 HD2 PHE A 95 1.641 0.211 -0.502 1.00 0.65 H new ATOM 0 HE1 PHE A 95 -0.016 -4.051 1.424 1.00 0.41 H new ATOM 0 HE2 PHE A 95 1.237 0.025 1.937 1.00 0.76 H new ATOM 0 HZ PHE A 95 0.408 -2.105 2.900 1.00 0.44 H new ATOM 1187 N GLU A 96 0.689 -2.129 -5.529 1.00 0.11 N ATOM 1188 CA GLU A 96 0.302 -1.522 -6.827 1.00 0.20 C ATOM 1189 C GLU A 96 -0.960 -2.214 -7.330 1.00 0.29 C ATOM 1190 O GLU A 96 -1.845 -1.576 -7.852 1.00 0.35 O ATOM 1191 CB GLU A 96 1.425 -1.692 -7.850 1.00 0.23 C ATOM 1192 CG GLU A 96 2.602 -0.789 -7.472 1.00 1.29 C ATOM 1193 CD GLU A 96 2.363 0.620 -8.021 1.00 2.12 C ATOM 1194 OE1 GLU A 96 1.767 0.729 -9.080 1.00 2.08 O ATOM 1195 OE2 GLU A 96 2.780 1.566 -7.373 1.00 3.14 O ATOM 0 H GLU A 96 1.566 -2.650 -5.538 1.00 0.11 H new ATOM 0 HA GLU A 96 0.119 -0.456 -6.691 1.00 0.20 H new ATOM 0 HB2 GLU A 96 1.747 -2.733 -7.882 1.00 0.23 H new ATOM 0 HB3 GLU A 96 1.064 -1.439 -8.847 1.00 0.23 H new ATOM 0 HG2 GLU A 96 2.714 -0.754 -6.388 1.00 1.29 H new ATOM 0 HG3 GLU A 96 3.530 -1.195 -7.875 1.00 1.29 H new ATOM 1202 N VAL A 97 -1.066 -3.513 -7.175 1.00 0.37 N ATOM 1203 CA VAL A 97 -2.314 -4.198 -7.649 1.00 0.50 C ATOM 1204 C VAL A 97 -3.518 -3.590 -6.901 1.00 0.43 C ATOM 1205 O VAL A 97 -4.504 -3.190 -7.496 1.00 0.34 O ATOM 1206 CB VAL A 97 -2.214 -5.735 -7.421 1.00 0.65 C ATOM 1207 CG1 VAL A 97 -2.873 -6.169 -6.101 1.00 0.78 C ATOM 1208 CG2 VAL A 97 -2.915 -6.457 -8.572 1.00 0.60 C ATOM 0 H VAL A 97 -0.362 -4.117 -6.752 1.00 0.37 H new ATOM 0 HA VAL A 97 -2.444 -4.044 -8.720 1.00 0.50 H new ATOM 0 HB VAL A 97 -1.156 -5.994 -7.375 1.00 0.65 H new ATOM 0 HG11 VAL A 97 -2.779 -7.249 -5.985 1.00 0.78 H new ATOM 0 HG12 VAL A 97 -2.380 -5.670 -5.267 1.00 0.78 H new ATOM 0 HG13 VAL A 97 -3.928 -5.896 -6.114 1.00 0.78 H new ATOM 0 HG21 VAL A 97 -2.849 -7.534 -8.420 1.00 0.60 H new ATOM 0 HG22 VAL A 97 -3.963 -6.158 -8.604 1.00 0.60 H new ATOM 0 HG23 VAL A 97 -2.433 -6.194 -9.514 1.00 0.60 H new ATOM 1218 N TYR A 98 -3.435 -3.500 -5.597 1.00 0.49 N ATOM 1219 CA TYR A 98 -4.560 -2.902 -4.824 1.00 0.43 C ATOM 1220 C TYR A 98 -4.668 -1.415 -5.178 1.00 0.40 C ATOM 1221 O TYR A 98 -5.700 -0.793 -5.005 1.00 0.41 O ATOM 1222 CB TYR A 98 -4.303 -3.057 -3.324 1.00 0.48 C ATOM 1223 CG TYR A 98 -3.970 -4.498 -3.014 1.00 0.37 C ATOM 1224 CD1 TYR A 98 -4.988 -5.455 -2.929 1.00 0.59 C ATOM 1225 CD2 TYR A 98 -2.640 -4.872 -2.808 1.00 0.35 C ATOM 1226 CE1 TYR A 98 -4.670 -6.788 -2.637 1.00 0.72 C ATOM 1227 CE2 TYR A 98 -2.321 -6.201 -2.519 1.00 0.57 C ATOM 1228 CZ TYR A 98 -3.334 -7.161 -2.433 1.00 0.72 C ATOM 1229 OH TYR A 98 -3.014 -8.470 -2.140 1.00 0.99 O ATOM 0 H TYR A 98 -2.641 -3.814 -5.039 1.00 0.49 H new ATOM 0 HA TYR A 98 -5.490 -3.412 -5.076 1.00 0.43 H new ATOM 0 HB2 TYR A 98 -3.482 -2.409 -3.016 1.00 0.48 H new ATOM 0 HB3 TYR A 98 -5.183 -2.747 -2.760 1.00 0.48 H new ATOM 0 HD1 TYR A 98 -6.017 -5.166 -3.088 1.00 0.59 H new ATOM 0 HD2 TYR A 98 -1.856 -4.132 -2.872 1.00 0.35 H new ATOM 0 HE1 TYR A 98 -5.454 -7.528 -2.569 1.00 0.72 H new ATOM 0 HE2 TYR A 98 -1.291 -6.487 -2.362 1.00 0.57 H new ATOM 0 HH TYR A 98 -3.824 -8.954 -1.876 1.00 0.99 H new ATOM 1239 N LEU A 99 -3.617 -0.847 -5.710 1.00 0.40 N ATOM 1240 CA LEU A 99 -3.667 0.583 -6.112 1.00 0.39 C ATOM 1241 C LEU A 99 -4.479 0.658 -7.393 1.00 0.37 C ATOM 1242 O LEU A 99 -5.188 1.611 -7.647 1.00 0.37 O ATOM 1243 CB LEU A 99 -2.251 1.102 -6.349 1.00 0.42 C ATOM 1244 CG LEU A 99 -1.640 1.498 -5.008 1.00 0.34 C ATOM 1245 CD1 LEU A 99 -0.134 1.700 -5.170 1.00 0.39 C ATOM 1246 CD2 LEU A 99 -2.283 2.799 -4.529 1.00 0.17 C ATOM 0 H LEU A 99 -2.727 -1.315 -5.882 1.00 0.40 H new ATOM 0 HA LEU A 99 -4.123 1.195 -5.334 1.00 0.39 H new ATOM 0 HB2 LEU A 99 -1.643 0.335 -6.828 1.00 0.42 H new ATOM 0 HB3 LEU A 99 -2.271 1.959 -7.022 1.00 0.42 H new ATOM 0 HG LEU A 99 -1.819 0.710 -4.277 1.00 0.34 H new ATOM 0 HD11 LEU A 99 0.300 1.983 -4.211 1.00 0.39 H new ATOM 0 HD12 LEU A 99 0.322 0.772 -5.516 1.00 0.39 H new ATOM 0 HD13 LEU A 99 0.051 2.489 -5.899 1.00 0.39 H new ATOM 0 HD21 LEU A 99 -1.851 3.087 -3.571 1.00 0.17 H new ATOM 0 HD22 LEU A 99 -2.101 3.586 -5.261 1.00 0.17 H new ATOM 0 HD23 LEU A 99 -3.357 2.653 -4.413 1.00 0.17 H new ATOM 1258 N GLU A 100 -4.424 -0.389 -8.168 1.00 0.38 N ATOM 1259 CA GLU A 100 -5.231 -0.454 -9.400 1.00 0.37 C ATOM 1260 C GLU A 100 -6.683 -0.426 -8.941 1.00 0.38 C ATOM 1261 O GLU A 100 -7.553 0.137 -9.576 1.00 0.38 O ATOM 1262 CB GLU A 100 -4.923 -1.773 -10.109 1.00 0.36 C ATOM 1263 CG GLU A 100 -4.774 -1.540 -11.611 1.00 0.27 C ATOM 1264 CD GLU A 100 -6.096 -1.034 -12.190 1.00 0.52 C ATOM 1265 OE1 GLU A 100 -7.113 -1.215 -11.541 1.00 1.32 O ATOM 1266 OE2 GLU A 100 -6.069 -0.476 -13.275 1.00 0.40 O ATOM 0 H GLU A 100 -3.844 -1.209 -7.991 1.00 0.38 H new ATOM 0 HA GLU A 100 -5.022 0.365 -10.089 1.00 0.37 H new ATOM 0 HB2 GLU A 100 -4.006 -2.205 -9.708 1.00 0.36 H new ATOM 0 HB3 GLU A 100 -5.722 -2.490 -9.922 1.00 0.36 H new ATOM 0 HG2 GLU A 100 -3.983 -0.814 -11.799 1.00 0.27 H new ATOM 0 HG3 GLU A 100 -4.481 -2.466 -12.105 1.00 0.27 H new ATOM 1273 N TYR A 101 -6.926 -1.018 -7.798 1.00 0.38 N ATOM 1274 CA TYR A 101 -8.288 -1.024 -7.219 1.00 0.39 C ATOM 1275 C TYR A 101 -8.722 0.412 -6.975 1.00 0.42 C ATOM 1276 O TYR A 101 -9.830 0.808 -7.282 1.00 0.52 O ATOM 1277 CB TYR A 101 -8.258 -1.767 -5.884 1.00 0.39 C ATOM 1278 CG TYR A 101 -9.435 -2.701 -5.806 1.00 0.36 C ATOM 1279 CD1 TYR A 101 -9.440 -3.876 -6.560 1.00 0.65 C ATOM 1280 CD2 TYR A 101 -10.519 -2.391 -4.981 1.00 0.41 C ATOM 1281 CE1 TYR A 101 -10.530 -4.746 -6.492 1.00 0.62 C ATOM 1282 CE2 TYR A 101 -11.612 -3.261 -4.910 1.00 0.43 C ATOM 1283 CZ TYR A 101 -11.618 -4.439 -5.666 1.00 0.33 C ATOM 1284 OH TYR A 101 -12.695 -5.297 -5.593 1.00 0.33 O ATOM 0 H TYR A 101 -6.223 -1.502 -7.240 1.00 0.38 H new ATOM 0 HA TYR A 101 -8.982 -1.515 -7.901 1.00 0.39 H new ATOM 0 HB2 TYR A 101 -7.328 -2.327 -5.788 1.00 0.39 H new ATOM 0 HB3 TYR A 101 -8.289 -1.056 -5.059 1.00 0.39 H new ATOM 0 HD1 TYR A 101 -8.600 -4.112 -7.196 1.00 0.65 H new ATOM 0 HD2 TYR A 101 -10.513 -1.481 -4.399 1.00 0.41 H new ATOM 0 HE1 TYR A 101 -10.534 -5.655 -7.076 1.00 0.62 H new ATOM 0 HE2 TYR A 101 -12.451 -3.024 -4.272 1.00 0.43 H new ATOM 0 HH TYR A 101 -13.527 -4.781 -5.628 1.00 0.33 H new ATOM 1294 N LEU A 102 -7.853 1.186 -6.404 1.00 0.34 N ATOM 1295 CA LEU A 102 -8.190 2.599 -6.104 1.00 0.37 C ATOM 1296 C LEU A 102 -7.786 3.504 -7.270 1.00 0.34 C ATOM 1297 O LEU A 102 -7.883 4.711 -7.188 1.00 0.33 O ATOM 1298 CB LEU A 102 -7.454 3.015 -4.835 1.00 0.35 C ATOM 1299 CG LEU A 102 -7.677 1.945 -3.762 1.00 0.35 C ATOM 1300 CD1 LEU A 102 -6.376 1.693 -3.007 1.00 0.37 C ATOM 1301 CD2 LEU A 102 -8.757 2.420 -2.797 1.00 0.33 C ATOM 0 H LEU A 102 -6.914 0.899 -6.129 1.00 0.34 H new ATOM 0 HA LEU A 102 -9.266 2.697 -5.958 1.00 0.37 H new ATOM 0 HB2 LEU A 102 -6.389 3.131 -5.037 1.00 0.35 H new ATOM 0 HB3 LEU A 102 -7.819 3.981 -4.486 1.00 0.35 H new ATOM 0 HG LEU A 102 -7.996 1.015 -4.233 1.00 0.35 H new ATOM 0 HD11 LEU A 102 -6.539 0.931 -2.245 1.00 0.37 H new ATOM 0 HD12 LEU A 102 -5.611 1.351 -3.704 1.00 0.37 H new ATOM 0 HD13 LEU A 102 -6.046 2.617 -2.532 1.00 0.37 H new ATOM 0 HD21 LEU A 102 -8.920 1.662 -2.031 1.00 0.33 H new ATOM 0 HD22 LEU A 102 -8.440 3.350 -2.325 1.00 0.33 H new ATOM 0 HD23 LEU A 102 -9.685 2.588 -3.344 1.00 0.33 H new ATOM 1313 N GLN A 103 -7.351 2.937 -8.366 1.00 0.34 N ATOM 1314 CA GLN A 103 -6.967 3.778 -9.532 1.00 0.36 C ATOM 1315 C GLN A 103 -8.181 3.949 -10.453 1.00 0.50 C ATOM 1316 O GLN A 103 -8.050 4.233 -11.627 1.00 0.89 O ATOM 1317 CB GLN A 103 -5.834 3.098 -10.303 1.00 0.31 C ATOM 1318 CG GLN A 103 -5.159 4.121 -11.218 1.00 0.36 C ATOM 1319 CD GLN A 103 -5.006 3.531 -12.622 1.00 0.47 C ATOM 1320 OE1 GLN A 103 -5.007 2.329 -12.792 1.00 0.88 O ATOM 1321 NE2 GLN A 103 -4.879 4.335 -13.642 1.00 1.18 N ATOM 0 H GLN A 103 -7.246 1.931 -8.501 1.00 0.34 H new ATOM 0 HA GLN A 103 -6.631 4.754 -9.183 1.00 0.36 H new ATOM 0 HB2 GLN A 103 -5.106 2.679 -9.608 1.00 0.31 H new ATOM 0 HB3 GLN A 103 -6.226 2.269 -10.892 1.00 0.31 H new ATOM 0 HG2 GLN A 103 -5.752 5.035 -11.259 1.00 0.36 H new ATOM 0 HG3 GLN A 103 -4.182 4.393 -10.818 1.00 0.36 H new ATOM 0 HE21 GLN A 103 -4.878 5.345 -13.498 1.00 1.18 H new ATOM 0 HE22 GLN A 103 -4.781 3.954 -14.583 1.00 1.18 H new ATOM 1330 N ASN A 104 -9.363 3.772 -9.924 1.00 0.87 N ATOM 1331 CA ASN A 104 -10.594 3.914 -10.746 1.00 0.96 C ATOM 1332 C ASN A 104 -11.812 3.853 -9.821 1.00 1.04 C ATOM 1333 O ASN A 104 -12.779 4.564 -10.000 1.00 1.19 O ATOM 1334 CB ASN A 104 -10.667 2.777 -11.766 1.00 1.04 C ATOM 1335 CG ASN A 104 -11.082 3.338 -13.127 1.00 0.97 C ATOM 1336 OD1 ASN A 104 -10.247 3.587 -13.974 1.00 0.48 O ATOM 1337 ND2 ASN A 104 -12.345 3.551 -13.374 1.00 2.11 N ATOM 0 H ASN A 104 -9.526 3.532 -8.946 1.00 0.87 H new ATOM 0 HA ASN A 104 -10.577 4.866 -11.277 1.00 0.96 H new ATOM 0 HB2 ASN A 104 -9.699 2.282 -11.845 1.00 1.04 H new ATOM 0 HB3 ASN A 104 -11.384 2.025 -11.437 1.00 1.04 H new ATOM 0 HD21 ASN A 104 -12.632 3.926 -14.278 1.00 2.11 H new ATOM 0 HD22 ASN A 104 -13.046 3.342 -12.663 1.00 2.11 H new ATOM 1344 N ARG A 105 -11.763 3.010 -8.819 1.00 0.96 N ATOM 1345 CA ARG A 105 -12.904 2.901 -7.867 1.00 1.08 C ATOM 1346 C ARG A 105 -13.255 4.296 -7.344 1.00 1.09 C ATOM 1347 O ARG A 105 -14.381 4.572 -6.979 1.00 1.21 O ATOM 1348 CB ARG A 105 -12.499 1.999 -6.699 1.00 1.03 C ATOM 1349 CG ARG A 105 -13.674 1.846 -5.733 1.00 2.00 C ATOM 1350 CD ARG A 105 -14.778 1.024 -6.399 1.00 1.07 C ATOM 1351 NE ARG A 105 -15.993 1.869 -6.566 1.00 1.84 N ATOM 1352 CZ ARG A 105 -16.834 2.006 -5.578 1.00 2.37 C ATOM 1353 NH1 ARG A 105 -16.578 2.847 -4.613 1.00 3.09 N ATOM 1354 NH2 ARG A 105 -17.930 1.299 -5.555 1.00 2.58 N ATOM 0 H ARG A 105 -10.977 2.391 -8.621 1.00 0.96 H new ATOM 0 HA ARG A 105 -13.771 2.474 -8.371 1.00 1.08 H new ATOM 0 HB2 ARG A 105 -12.193 1.022 -7.071 1.00 1.03 H new ATOM 0 HB3 ARG A 105 -11.641 2.425 -6.179 1.00 1.03 H new ATOM 0 HG2 ARG A 105 -13.344 1.356 -4.817 1.00 2.00 H new ATOM 0 HG3 ARG A 105 -14.056 2.827 -5.450 1.00 2.00 H new ATOM 0 HD2 ARG A 105 -14.440 0.659 -7.369 1.00 1.07 H new ATOM 0 HD3 ARG A 105 -15.011 0.149 -5.792 1.00 1.07 H new ATOM 0 HE ARG A 105 -16.168 2.341 -7.453 1.00 1.84 H new ATOM 0 HH11 ARG A 105 -15.720 3.398 -4.631 1.00 3.09 H new ATOM 0 HH12 ARG A 105 -17.236 2.953 -3.841 1.00 3.09 H new ATOM 0 HH21 ARG A 105 -18.128 0.641 -6.308 1.00 2.58 H new ATOM 0 HH22 ARG A 105 -18.589 1.405 -4.784 1.00 2.58 H new ATOM 1368 N PHE A 106 -12.295 5.182 -7.319 1.00 0.94 N ATOM 1369 CA PHE A 106 -12.565 6.566 -6.839 1.00 0.93 C ATOM 1370 C PHE A 106 -12.814 7.468 -8.052 1.00 0.86 C ATOM 1371 O PHE A 106 -12.133 8.453 -8.254 1.00 1.27 O ATOM 1372 CB PHE A 106 -11.356 7.091 -6.057 1.00 1.06 C ATOM 1373 CG PHE A 106 -11.283 6.426 -4.699 1.00 1.09 C ATOM 1374 CD1 PHE A 106 -11.168 5.033 -4.601 1.00 2.29 C ATOM 1375 CD2 PHE A 106 -11.317 7.206 -3.534 1.00 1.62 C ATOM 1376 CE1 PHE A 106 -11.087 4.422 -3.344 1.00 2.67 C ATOM 1377 CE2 PHE A 106 -11.238 6.594 -2.278 1.00 1.38 C ATOM 1378 CZ PHE A 106 -11.122 5.204 -2.183 1.00 1.53 C ATOM 0 H PHE A 106 -11.334 5.005 -7.611 1.00 0.94 H new ATOM 0 HA PHE A 106 -13.438 6.564 -6.186 1.00 0.93 H new ATOM 0 HB2 PHE A 106 -10.440 6.896 -6.615 1.00 1.06 H new ATOM 0 HB3 PHE A 106 -11.433 8.172 -5.937 1.00 1.06 H new ATOM 0 HD1 PHE A 106 -11.142 4.430 -5.496 1.00 2.29 H new ATOM 0 HD2 PHE A 106 -11.404 8.280 -3.606 1.00 1.62 H new ATOM 0 HE1 PHE A 106 -10.998 3.348 -3.270 1.00 2.67 H new ATOM 0 HE2 PHE A 106 -11.267 7.196 -1.382 1.00 1.38 H new ATOM 0 HZ PHE A 106 -11.059 4.733 -1.213 1.00 1.53 H new ATOM 1388 N GLU A 107 -13.779 7.130 -8.866 1.00 0.62 N ATOM 1389 CA GLU A 107 -14.067 7.961 -10.073 1.00 0.67 C ATOM 1390 C GLU A 107 -14.554 9.353 -9.657 1.00 0.57 C ATOM 1391 O GLU A 107 -14.621 10.260 -10.464 1.00 0.56 O ATOM 1392 CB GLU A 107 -15.142 7.277 -10.919 1.00 0.76 C ATOM 1393 CG GLU A 107 -15.363 8.079 -12.203 1.00 1.92 C ATOM 1394 CD GLU A 107 -15.775 7.134 -13.333 1.00 2.63 C ATOM 1395 OE1 GLU A 107 -16.797 6.483 -13.193 1.00 1.70 O ATOM 1396 OE2 GLU A 107 -15.060 7.079 -14.322 1.00 4.26 O ATOM 0 H GLU A 107 -14.380 6.315 -8.748 1.00 0.62 H new ATOM 0 HA GLU A 107 -13.152 8.066 -10.655 1.00 0.67 H new ATOM 0 HB2 GLU A 107 -14.837 6.259 -11.161 1.00 0.76 H new ATOM 0 HB3 GLU A 107 -16.073 7.206 -10.356 1.00 0.76 H new ATOM 0 HG2 GLU A 107 -16.135 8.832 -12.045 1.00 1.92 H new ATOM 0 HG3 GLU A 107 -14.450 8.610 -12.474 1.00 1.92 H new ATOM 1403 N SER A 108 -14.881 9.541 -8.407 1.00 0.49 N ATOM 1404 CA SER A 108 -15.346 10.883 -7.955 1.00 0.44 C ATOM 1405 C SER A 108 -14.121 11.696 -7.551 1.00 0.32 C ATOM 1406 O SER A 108 -14.025 12.878 -7.810 1.00 0.36 O ATOM 1407 CB SER A 108 -16.282 10.732 -6.755 1.00 0.44 C ATOM 1408 OG SER A 108 -17.581 11.182 -7.114 1.00 0.67 O ATOM 0 H SER A 108 -14.846 8.825 -7.681 1.00 0.49 H new ATOM 0 HA SER A 108 -15.887 11.384 -8.758 1.00 0.44 H new ATOM 0 HB2 SER A 108 -16.320 9.690 -6.438 1.00 0.44 H new ATOM 0 HB3 SER A 108 -15.905 11.309 -5.910 1.00 0.44 H new ATOM 0 HG SER A 108 -18.184 11.085 -6.348 1.00 0.67 H new ATOM 1414 N SER A 109 -13.176 11.048 -6.936 1.00 0.24 N ATOM 1415 CA SER A 109 -11.928 11.739 -6.523 1.00 0.16 C ATOM 1416 C SER A 109 -10.760 11.028 -7.202 1.00 0.26 C ATOM 1417 O SER A 109 -9.732 10.779 -6.606 1.00 0.32 O ATOM 1418 CB SER A 109 -11.775 11.657 -5.004 1.00 0.19 C ATOM 1419 OG SER A 109 -11.160 12.847 -4.529 1.00 0.38 O ATOM 0 H SER A 109 -13.216 10.057 -6.699 1.00 0.24 H new ATOM 0 HA SER A 109 -11.954 12.790 -6.812 1.00 0.16 H new ATOM 0 HB2 SER A 109 -12.750 11.526 -4.535 1.00 0.19 H new ATOM 0 HB3 SER A 109 -11.172 10.790 -4.734 1.00 0.19 H new ATOM 0 HG SER A 109 -11.683 13.211 -3.785 1.00 0.38 H new ATOM 1425 N GLU A 110 -10.934 10.676 -8.448 1.00 0.31 N ATOM 1426 CA GLU A 110 -9.870 9.954 -9.190 1.00 0.43 C ATOM 1427 C GLU A 110 -8.520 10.662 -9.023 1.00 0.42 C ATOM 1428 O GLU A 110 -7.518 10.044 -8.715 1.00 0.55 O ATOM 1429 CB GLU A 110 -10.235 9.911 -10.676 1.00 0.52 C ATOM 1430 CG GLU A 110 -9.489 8.758 -11.349 1.00 0.71 C ATOM 1431 CD GLU A 110 -10.345 8.174 -12.478 1.00 1.13 C ATOM 1432 OE1 GLU A 110 -11.345 8.784 -12.818 1.00 1.22 O ATOM 1433 OE2 GLU A 110 -9.981 7.125 -12.984 1.00 1.58 O ATOM 0 H GLU A 110 -11.780 10.862 -8.986 1.00 0.31 H new ATOM 0 HA GLU A 110 -9.788 8.943 -8.792 1.00 0.43 H new ATOM 0 HB2 GLU A 110 -11.311 9.781 -10.794 1.00 0.52 H new ATOM 0 HB3 GLU A 110 -9.974 10.855 -11.153 1.00 0.52 H new ATOM 0 HG2 GLU A 110 -8.538 9.111 -11.747 1.00 0.71 H new ATOM 0 HG3 GLU A 110 -9.260 7.984 -10.616 1.00 0.71 H new ATOM 1440 N GLU A 111 -8.481 11.952 -9.235 1.00 0.28 N ATOM 1441 CA GLU A 111 -7.193 12.700 -9.103 1.00 0.26 C ATOM 1442 C GLU A 111 -6.503 12.338 -7.784 1.00 0.29 C ATOM 1443 O GLU A 111 -5.299 12.181 -7.728 1.00 0.36 O ATOM 1444 CB GLU A 111 -7.469 14.204 -9.141 1.00 0.20 C ATOM 1445 CG GLU A 111 -8.444 14.574 -8.023 1.00 2.37 C ATOM 1446 CD GLU A 111 -9.238 15.817 -8.429 1.00 2.47 C ATOM 1447 OE1 GLU A 111 -9.885 15.770 -9.462 1.00 2.13 O ATOM 1448 OE2 GLU A 111 -9.184 16.795 -7.702 1.00 3.40 O ATOM 0 H GLU A 111 -9.286 12.522 -9.494 1.00 0.28 H new ATOM 0 HA GLU A 111 -6.538 12.427 -9.931 1.00 0.26 H new ATOM 0 HB2 GLU A 111 -6.538 14.758 -9.023 1.00 0.20 H new ATOM 0 HB3 GLU A 111 -7.886 14.483 -10.109 1.00 0.20 H new ATOM 0 HG2 GLU A 111 -9.123 13.744 -7.828 1.00 2.37 H new ATOM 0 HG3 GLU A 111 -7.899 14.764 -7.098 1.00 2.37 H new ATOM 1455 N GLN A 112 -7.251 12.205 -6.722 1.00 0.26 N ATOM 1456 CA GLN A 112 -6.626 11.850 -5.416 1.00 0.28 C ATOM 1457 C GLN A 112 -6.038 10.440 -5.502 1.00 0.31 C ATOM 1458 O GLN A 112 -4.954 10.178 -5.021 1.00 0.34 O ATOM 1459 CB GLN A 112 -7.684 11.897 -4.310 1.00 0.27 C ATOM 1460 CG GLN A 112 -8.319 13.288 -4.270 1.00 0.31 C ATOM 1461 CD GLN A 112 -9.088 13.462 -2.958 1.00 1.65 C ATOM 1462 OE1 GLN A 112 -9.565 12.501 -2.387 1.00 2.63 O ATOM 1463 NE2 GLN A 112 -9.232 14.656 -2.456 1.00 1.96 N ATOM 0 H GLN A 112 -8.264 12.326 -6.702 1.00 0.26 H new ATOM 0 HA GLN A 112 -5.834 12.562 -5.187 1.00 0.28 H new ATOM 0 HB2 GLN A 112 -8.449 11.142 -4.491 1.00 0.27 H new ATOM 0 HB3 GLN A 112 -7.229 11.665 -3.347 1.00 0.27 H new ATOM 0 HG2 GLN A 112 -7.548 14.054 -4.356 1.00 0.31 H new ATOM 0 HG3 GLN A 112 -8.992 13.417 -5.118 1.00 0.31 H new ATOM 0 HE21 GLN A 112 -8.832 15.462 -2.935 1.00 1.96 H new ATOM 0 HE22 GLN A 112 -9.745 14.784 -1.584 1.00 1.96 H new ATOM 1472 N ALA A 113 -6.743 9.531 -6.120 1.00 0.32 N ATOM 1473 CA ALA A 113 -6.224 8.139 -6.247 1.00 0.37 C ATOM 1474 C ALA A 113 -4.899 8.158 -7.016 1.00 0.44 C ATOM 1475 O ALA A 113 -4.085 7.265 -6.892 1.00 0.31 O ATOM 1476 CB ALA A 113 -7.241 7.292 -7.012 1.00 0.40 C ATOM 0 H ALA A 113 -7.657 9.693 -6.543 1.00 0.32 H new ATOM 0 HA ALA A 113 -6.063 7.715 -5.256 1.00 0.37 H new ATOM 0 HB1 ALA A 113 -6.867 6.273 -7.108 1.00 0.40 H new ATOM 0 HB2 ALA A 113 -8.187 7.282 -6.470 1.00 0.40 H new ATOM 0 HB3 ALA A 113 -7.396 7.717 -8.004 1.00 0.40 H new ATOM 1482 N ARG A 114 -4.682 9.170 -7.815 1.00 0.68 N ATOM 1483 CA ARG A 114 -3.415 9.250 -8.600 1.00 0.78 C ATOM 1484 C ARG A 114 -2.281 9.761 -7.709 1.00 0.82 C ATOM 1485 O ARG A 114 -1.128 9.450 -7.920 1.00 0.85 O ATOM 1486 CB ARG A 114 -3.606 10.212 -9.775 1.00 0.93 C ATOM 1487 CG ARG A 114 -2.607 9.872 -10.882 1.00 1.25 C ATOM 1488 CD ARG A 114 -3.240 10.158 -12.246 1.00 1.04 C ATOM 1489 NE ARG A 114 -2.168 10.463 -13.235 1.00 1.69 N ATOM 1490 CZ ARG A 114 -2.410 10.360 -14.514 1.00 1.44 C ATOM 1491 NH1 ARG A 114 -2.948 11.357 -15.160 1.00 1.87 N ATOM 1492 NH2 ARG A 114 -2.109 9.258 -15.146 1.00 1.12 N ATOM 0 H ARG A 114 -5.329 9.946 -7.958 1.00 0.68 H new ATOM 0 HA ARG A 114 -3.161 8.257 -8.972 1.00 0.78 H new ATOM 0 HB2 ARG A 114 -4.625 10.140 -10.156 1.00 0.93 H new ATOM 0 HB3 ARG A 114 -3.462 11.240 -9.444 1.00 0.93 H new ATOM 0 HG2 ARG A 114 -1.698 10.461 -10.760 1.00 1.25 H new ATOM 0 HG3 ARG A 114 -2.318 8.823 -10.816 1.00 1.25 H new ATOM 0 HD2 ARG A 114 -3.821 9.297 -12.577 1.00 1.04 H new ATOM 0 HD3 ARG A 114 -3.930 10.999 -12.170 1.00 1.04 H new ATOM 0 HE ARG A 114 -1.245 10.752 -12.913 1.00 1.69 H new ATOM 0 HH11 ARG A 114 -3.180 12.219 -14.666 1.00 1.87 H new ATOM 0 HH12 ARG A 114 -3.136 11.275 -16.159 1.00 1.87 H new ATOM 0 HH21 ARG A 114 -1.686 8.480 -14.641 1.00 1.12 H new ATOM 0 HH22 ARG A 114 -2.297 9.175 -16.145 1.00 1.12 H new ATOM 1506 N ALA A 115 -2.592 10.547 -6.717 1.00 0.85 N ATOM 1507 CA ALA A 115 -1.520 11.071 -5.825 1.00 0.92 C ATOM 1508 C ALA A 115 -0.968 9.929 -4.969 1.00 0.81 C ATOM 1509 O ALA A 115 0.168 9.958 -4.537 1.00 0.93 O ATOM 1510 CB ALA A 115 -2.098 12.158 -4.917 1.00 1.02 C ATOM 0 H ALA A 115 -3.538 10.849 -6.485 1.00 0.85 H new ATOM 0 HA ALA A 115 -0.717 11.493 -6.429 1.00 0.92 H new ATOM 0 HB1 ALA A 115 -1.314 12.542 -4.264 1.00 1.02 H new ATOM 0 HB2 ALA A 115 -2.492 12.971 -5.527 1.00 1.02 H new ATOM 0 HB3 ALA A 115 -2.901 11.737 -4.311 1.00 1.02 H new ATOM 1516 N VAL A 116 -1.762 8.925 -4.716 1.00 0.61 N ATOM 1517 CA VAL A 116 -1.283 7.786 -3.884 1.00 0.55 C ATOM 1518 C VAL A 116 -0.655 6.711 -4.782 1.00 0.43 C ATOM 1519 O VAL A 116 0.244 6.000 -4.380 1.00 0.54 O ATOM 1520 CB VAL A 116 -2.466 7.193 -3.103 1.00 0.49 C ATOM 1521 CG1 VAL A 116 -3.432 6.484 -4.059 1.00 0.27 C ATOM 1522 CG2 VAL A 116 -1.943 6.187 -2.074 1.00 1.02 C ATOM 0 H VAL A 116 -2.722 8.844 -5.050 1.00 0.61 H new ATOM 0 HA VAL A 116 -0.529 8.141 -3.182 1.00 0.55 H new ATOM 0 HB VAL A 116 -2.996 8.000 -2.597 1.00 0.49 H new ATOM 0 HG11 VAL A 116 -4.265 6.069 -3.492 1.00 0.27 H new ATOM 0 HG12 VAL A 116 -3.811 7.199 -4.790 1.00 0.27 H new ATOM 0 HG13 VAL A 116 -2.908 5.680 -4.576 1.00 0.27 H new ATOM 0 HG21 VAL A 116 -2.781 5.765 -1.519 1.00 1.02 H new ATOM 0 HG22 VAL A 116 -1.408 5.387 -2.586 1.00 1.02 H new ATOM 0 HG23 VAL A 116 -1.267 6.691 -1.383 1.00 1.02 H new ATOM 1532 N GLN A 117 -1.133 6.580 -5.991 1.00 0.30 N ATOM 1533 CA GLN A 117 -0.580 5.546 -6.908 1.00 0.18 C ATOM 1534 C GLN A 117 0.771 6.003 -7.463 1.00 0.28 C ATOM 1535 O GLN A 117 1.774 5.341 -7.302 1.00 0.35 O ATOM 1536 CB GLN A 117 -1.558 5.333 -8.062 1.00 0.27 C ATOM 1537 CG GLN A 117 -1.025 4.238 -8.981 1.00 0.30 C ATOM 1538 CD GLN A 117 -2.189 3.382 -9.483 1.00 1.33 C ATOM 1539 OE1 GLN A 117 -3.139 3.146 -8.765 1.00 2.62 O ATOM 1540 NE2 GLN A 117 -2.153 2.903 -10.696 1.00 1.42 N ATOM 0 H GLN A 117 -1.885 7.147 -6.382 1.00 0.30 H new ATOM 0 HA GLN A 117 -0.439 4.614 -6.360 1.00 0.18 H new ATOM 0 HB2 GLN A 117 -2.538 5.054 -7.676 1.00 0.27 H new ATOM 0 HB3 GLN A 117 -1.687 6.260 -8.620 1.00 0.27 H new ATOM 0 HG2 GLN A 117 -0.496 4.682 -9.824 1.00 0.30 H new ATOM 0 HG3 GLN A 117 -0.307 3.617 -8.446 1.00 0.30 H new ATOM 0 HE21 GLN A 117 -1.355 3.101 -11.299 1.00 1.42 H new ATOM 0 HE22 GLN A 117 -2.923 2.330 -11.041 1.00 1.42 H new ATOM 1549 N MET A 118 0.805 7.127 -8.125 1.00 0.30 N ATOM 1550 CA MET A 118 2.091 7.626 -8.699 1.00 0.40 C ATOM 1551 C MET A 118 3.192 7.579 -7.636 1.00 0.44 C ATOM 1552 O MET A 118 4.305 7.171 -7.899 1.00 0.47 O ATOM 1553 CB MET A 118 1.911 9.069 -9.174 1.00 0.52 C ATOM 1554 CG MET A 118 0.917 9.105 -10.336 1.00 0.53 C ATOM 1555 SD MET A 118 1.467 10.319 -11.561 1.00 1.16 S ATOM 1556 CE MET A 118 0.713 11.771 -10.788 1.00 2.14 C ATOM 0 H MET A 118 -0.004 7.725 -8.295 1.00 0.30 H new ATOM 0 HA MET A 118 2.375 6.993 -9.540 1.00 0.40 H new ATOM 0 HB2 MET A 118 1.551 9.690 -8.354 1.00 0.52 H new ATOM 0 HB3 MET A 118 2.870 9.481 -9.489 1.00 0.52 H new ATOM 0 HG2 MET A 118 0.840 8.119 -10.794 1.00 0.53 H new ATOM 0 HG3 MET A 118 -0.077 9.365 -9.971 1.00 0.53 H new ATOM 0 HE1 MET A 118 -0.152 12.085 -11.371 1.00 2.14 H new ATOM 0 HE2 MET A 118 0.397 11.521 -9.775 1.00 2.14 H new ATOM 0 HE3 MET A 118 1.440 12.582 -10.751 1.00 2.14 H new ATOM 1566 N SER A 119 2.891 7.993 -6.435 1.00 0.47 N ATOM 1567 CA SER A 119 3.921 7.971 -5.361 1.00 0.57 C ATOM 1568 C SER A 119 4.318 6.523 -5.063 1.00 0.52 C ATOM 1569 O SER A 119 5.483 6.202 -4.944 1.00 0.59 O ATOM 1570 CB SER A 119 3.354 8.614 -4.095 1.00 0.65 C ATOM 1571 OG SER A 119 3.986 9.870 -3.887 1.00 0.62 O ATOM 0 H SER A 119 1.976 8.345 -6.153 1.00 0.47 H new ATOM 0 HA SER A 119 4.798 8.528 -5.690 1.00 0.57 H new ATOM 0 HB2 SER A 119 2.276 8.747 -4.191 1.00 0.65 H new ATOM 0 HB3 SER A 119 3.520 7.963 -3.236 1.00 0.65 H new ATOM 0 HG SER A 119 4.688 9.775 -3.210 1.00 0.62 H new ATOM 1577 N THR A 120 3.360 5.646 -4.944 1.00 0.44 N ATOM 1578 CA THR A 120 3.692 4.221 -4.655 1.00 0.46 C ATOM 1579 C THR A 120 4.498 3.634 -5.817 1.00 0.39 C ATOM 1580 O THR A 120 5.180 2.639 -5.669 1.00 0.46 O ATOM 1581 CB THR A 120 2.402 3.424 -4.469 1.00 0.46 C ATOM 1582 OG1 THR A 120 1.470 3.800 -5.470 1.00 0.86 O ATOM 1583 CG2 THR A 120 1.816 3.715 -3.088 1.00 0.73 C ATOM 0 H THR A 120 2.365 5.852 -5.034 1.00 0.44 H new ATOM 0 HA THR A 120 4.286 4.166 -3.743 1.00 0.46 H new ATOM 0 HB THR A 120 2.616 2.358 -4.552 1.00 0.46 H new ATOM 0 HG1 THR A 120 1.949 4.025 -6.295 1.00 0.86 H new ATOM 0 HG21 THR A 120 0.896 3.146 -2.956 1.00 0.73 H new ATOM 0 HG22 THR A 120 2.534 3.427 -2.320 1.00 0.73 H new ATOM 0 HG23 THR A 120 1.600 4.780 -3.002 1.00 0.73 H new ATOM 1591 N LYS A 121 4.448 4.254 -6.965 1.00 0.27 N ATOM 1592 CA LYS A 121 5.232 3.744 -8.122 1.00 0.21 C ATOM 1593 C LYS A 121 6.621 4.370 -8.064 1.00 0.23 C ATOM 1594 O LYS A 121 7.574 3.837 -8.586 1.00 0.16 O ATOM 1595 CB LYS A 121 4.546 4.141 -9.431 1.00 0.15 C ATOM 1596 CG LYS A 121 3.189 3.442 -9.531 1.00 0.93 C ATOM 1597 CD LYS A 121 2.459 3.916 -10.791 1.00 2.02 C ATOM 1598 CE LYS A 121 2.790 2.985 -11.959 1.00 1.35 C ATOM 1599 NZ LYS A 121 1.724 3.090 -12.995 1.00 2.36 N ATOM 0 H LYS A 121 3.897 5.092 -7.150 1.00 0.27 H new ATOM 0 HA LYS A 121 5.301 2.657 -8.079 1.00 0.21 H new ATOM 0 HB2 LYS A 121 4.413 5.222 -9.471 1.00 0.15 H new ATOM 0 HB3 LYS A 121 5.172 3.865 -10.280 1.00 0.15 H new ATOM 0 HG2 LYS A 121 3.327 2.361 -9.563 1.00 0.93 H new ATOM 0 HG3 LYS A 121 2.590 3.661 -8.647 1.00 0.93 H new ATOM 0 HD2 LYS A 121 1.383 3.928 -10.617 1.00 2.02 H new ATOM 0 HD3 LYS A 121 2.755 4.937 -11.032 1.00 2.02 H new ATOM 0 HE2 LYS A 121 3.756 3.251 -12.388 1.00 1.35 H new ATOM 0 HE3 LYS A 121 2.870 1.957 -11.607 1.00 1.35 H new ATOM 0 HZ1 LYS A 121 1.948 2.457 -13.789 1.00 2.36 H new ATOM 0 HZ2 LYS A 121 0.810 2.816 -12.582 1.00 2.36 H new ATOM 0 HZ3 LYS A 121 1.669 4.070 -13.338 1.00 2.36 H new ATOM 1613 N VAL A 122 6.737 5.500 -7.422 1.00 0.42 N ATOM 1614 CA VAL A 122 8.059 6.164 -7.311 1.00 0.48 C ATOM 1615 C VAL A 122 8.940 5.374 -6.341 1.00 0.53 C ATOM 1616 O VAL A 122 10.138 5.313 -6.499 1.00 0.59 O ATOM 1617 CB VAL A 122 7.863 7.588 -6.793 1.00 0.64 C ATOM 1618 CG1 VAL A 122 9.222 8.256 -6.595 1.00 0.71 C ATOM 1619 CG2 VAL A 122 7.050 8.385 -7.814 1.00 0.66 C ATOM 0 H VAL A 122 5.967 5.992 -6.969 1.00 0.42 H new ATOM 0 HA VAL A 122 8.541 6.199 -8.288 1.00 0.48 H new ATOM 0 HB VAL A 122 7.334 7.559 -5.840 1.00 0.64 H new ATOM 0 HG11 VAL A 122 9.078 9.271 -6.226 1.00 0.71 H new ATOM 0 HG12 VAL A 122 9.806 7.686 -5.872 1.00 0.71 H new ATOM 0 HG13 VAL A 122 9.754 8.288 -7.546 1.00 0.71 H new ATOM 0 HG21 VAL A 122 6.906 9.402 -7.450 1.00 0.66 H new ATOM 0 HG22 VAL A 122 7.584 8.411 -8.764 1.00 0.66 H new ATOM 0 HG23 VAL A 122 6.079 7.910 -7.957 1.00 0.66 H new ATOM 1629 N LEU A 123 8.358 4.763 -5.340 1.00 0.55 N ATOM 1630 CA LEU A 123 9.186 3.972 -4.378 1.00 0.65 C ATOM 1631 C LEU A 123 9.618 2.664 -5.047 1.00 0.57 C ATOM 1632 O LEU A 123 10.629 2.083 -4.709 1.00 0.63 O ATOM 1633 CB LEU A 123 8.367 3.632 -3.122 1.00 0.83 C ATOM 1634 CG LEU A 123 8.155 4.875 -2.241 1.00 0.79 C ATOM 1635 CD1 LEU A 123 9.475 5.627 -2.038 1.00 0.61 C ATOM 1636 CD2 LEU A 123 7.137 5.800 -2.904 1.00 0.84 C ATOM 0 H LEU A 123 7.356 4.776 -5.148 1.00 0.55 H new ATOM 0 HA LEU A 123 10.056 4.563 -4.093 1.00 0.65 H new ATOM 0 HB2 LEU A 123 7.401 3.222 -3.415 1.00 0.83 H new ATOM 0 HB3 LEU A 123 8.880 2.860 -2.548 1.00 0.83 H new ATOM 0 HG LEU A 123 7.785 4.554 -1.267 1.00 0.79 H new ATOM 0 HD11 LEU A 123 9.302 6.503 -1.412 1.00 0.61 H new ATOM 0 HD12 LEU A 123 10.197 4.970 -1.552 1.00 0.61 H new ATOM 0 HD13 LEU A 123 9.866 5.944 -3.005 1.00 0.61 H new ATOM 0 HD21 LEU A 123 6.986 6.681 -2.281 1.00 0.84 H new ATOM 0 HD22 LEU A 123 7.507 6.107 -3.882 1.00 0.84 H new ATOM 0 HD23 LEU A 123 6.190 5.273 -3.023 1.00 0.84 H new ATOM 1648 N ILE A 124 8.845 2.195 -5.986 1.00 0.49 N ATOM 1649 CA ILE A 124 9.186 0.918 -6.680 1.00 0.53 C ATOM 1650 C ILE A 124 10.304 1.158 -7.698 1.00 0.49 C ATOM 1651 O ILE A 124 11.296 0.459 -7.721 1.00 0.54 O ATOM 1652 CB ILE A 124 7.931 0.389 -7.389 1.00 0.47 C ATOM 1653 CG1 ILE A 124 6.880 0.017 -6.342 1.00 0.27 C ATOM 1654 CG2 ILE A 124 8.274 -0.846 -8.221 1.00 0.71 C ATOM 1655 CD1 ILE A 124 5.514 -0.119 -7.015 1.00 0.38 C ATOM 0 H ILE A 124 7.986 2.643 -6.306 1.00 0.49 H new ATOM 0 HA ILE A 124 9.533 0.184 -5.953 1.00 0.53 H new ATOM 0 HB ILE A 124 7.542 1.164 -8.049 1.00 0.47 H new ATOM 0 HG12 ILE A 124 7.152 -0.920 -5.855 1.00 0.27 H new ATOM 0 HG13 ILE A 124 6.840 0.780 -5.565 1.00 0.27 H new ATOM 0 HG21 ILE A 124 7.375 -1.211 -8.718 1.00 0.71 H new ATOM 0 HG22 ILE A 124 9.022 -0.584 -8.969 1.00 0.71 H new ATOM 0 HG23 ILE A 124 8.670 -1.625 -7.570 1.00 0.71 H new ATOM 0 HD11 ILE A 124 4.765 -0.384 -6.268 1.00 0.38 H new ATOM 0 HD12 ILE A 124 5.242 0.828 -7.481 1.00 0.38 H new ATOM 0 HD13 ILE A 124 5.559 -0.898 -7.776 1.00 0.38 H new ATOM 1667 N GLN A 125 10.148 2.134 -8.538 1.00 0.47 N ATOM 1668 CA GLN A 125 11.182 2.423 -9.556 1.00 0.52 C ATOM 1669 C GLN A 125 12.440 2.961 -8.877 1.00 0.58 C ATOM 1670 O GLN A 125 13.545 2.739 -9.326 1.00 0.81 O ATOM 1671 CB GLN A 125 10.627 3.472 -10.506 1.00 0.39 C ATOM 1672 CG GLN A 125 9.986 2.773 -11.701 1.00 0.55 C ATOM 1673 CD GLN A 125 9.773 3.781 -12.833 1.00 1.02 C ATOM 1674 OE1 GLN A 125 8.872 4.593 -12.777 1.00 1.89 O ATOM 1675 NE2 GLN A 125 10.572 3.762 -13.865 1.00 0.82 N ATOM 0 H GLN A 125 9.337 2.752 -8.562 1.00 0.47 H new ATOM 0 HA GLN A 125 11.440 1.515 -10.100 1.00 0.52 H new ATOM 0 HB2 GLN A 125 9.891 4.092 -9.994 1.00 0.39 H new ATOM 0 HB3 GLN A 125 11.424 4.135 -10.841 1.00 0.39 H new ATOM 0 HG2 GLN A 125 10.623 1.957 -12.042 1.00 0.55 H new ATOM 0 HG3 GLN A 125 9.033 2.332 -11.409 1.00 0.55 H new ATOM 0 HE21 GLN A 125 11.329 3.080 -13.912 1.00 0.82 H new ATOM 0 HE22 GLN A 125 10.440 4.429 -14.625 1.00 0.82 H new ATOM 1684 N PHE A 126 12.272 3.678 -7.808 1.00 0.52 N ATOM 1685 CA PHE A 126 13.447 4.247 -7.091 1.00 0.60 C ATOM 1686 C PHE A 126 14.193 3.133 -6.353 1.00 0.76 C ATOM 1687 O PHE A 126 15.336 2.840 -6.635 1.00 1.34 O ATOM 1688 CB PHE A 126 12.965 5.280 -6.066 1.00 0.62 C ATOM 1689 CG PHE A 126 12.701 6.617 -6.732 1.00 0.50 C ATOM 1690 CD1 PHE A 126 12.226 6.682 -8.052 1.00 0.48 C ATOM 1691 CD2 PHE A 126 12.935 7.800 -6.019 1.00 0.52 C ATOM 1692 CE1 PHE A 126 11.989 7.925 -8.650 1.00 0.42 C ATOM 1693 CE2 PHE A 126 12.697 9.042 -6.619 1.00 0.60 C ATOM 1694 CZ PHE A 126 12.226 9.104 -7.934 1.00 0.53 C ATOM 0 H PHE A 126 11.366 3.898 -7.394 1.00 0.52 H new ATOM 0 HA PHE A 126 14.112 4.718 -7.814 1.00 0.60 H new ATOM 0 HB2 PHE A 126 12.055 4.923 -5.584 1.00 0.62 H new ATOM 0 HB3 PHE A 126 13.715 5.400 -5.284 1.00 0.62 H new ATOM 0 HD1 PHE A 126 12.044 5.773 -8.606 1.00 0.48 H new ATOM 0 HD2 PHE A 126 13.300 7.754 -5.004 1.00 0.52 H new ATOM 0 HE1 PHE A 126 11.623 7.974 -9.665 1.00 0.42 H new ATOM 0 HE2 PHE A 126 12.877 9.952 -6.066 1.00 0.60 H new ATOM 0 HZ PHE A 126 12.045 10.062 -8.398 1.00 0.53 H new ATOM 1704 N LEU A 127 13.552 2.526 -5.393 1.00 0.34 N ATOM 1705 CA LEU A 127 14.212 1.445 -4.607 1.00 0.42 C ATOM 1706 C LEU A 127 14.570 0.259 -5.509 1.00 0.43 C ATOM 1707 O LEU A 127 15.322 -0.612 -5.123 1.00 0.89 O ATOM 1708 CB LEU A 127 13.261 0.973 -3.501 1.00 0.48 C ATOM 1709 CG LEU A 127 12.962 2.137 -2.556 1.00 0.73 C ATOM 1710 CD1 LEU A 127 11.685 1.835 -1.769 1.00 1.08 C ATOM 1711 CD2 LEU A 127 14.129 2.315 -1.583 1.00 0.87 C ATOM 0 H LEU A 127 12.592 2.734 -5.117 1.00 0.34 H new ATOM 0 HA LEU A 127 15.130 1.839 -4.171 1.00 0.42 H new ATOM 0 HB2 LEU A 127 12.335 0.598 -3.938 1.00 0.48 H new ATOM 0 HB3 LEU A 127 13.710 0.148 -2.948 1.00 0.48 H new ATOM 0 HG LEU A 127 12.828 3.051 -3.134 1.00 0.73 H new ATOM 0 HD11 LEU A 127 11.469 2.663 -1.094 1.00 1.08 H new ATOM 0 HD12 LEU A 127 10.853 1.705 -2.461 1.00 1.08 H new ATOM 0 HD13 LEU A 127 11.822 0.922 -1.190 1.00 1.08 H new ATOM 0 HD21 LEU A 127 13.917 3.145 -0.909 1.00 0.87 H new ATOM 0 HD22 LEU A 127 14.262 1.401 -1.004 1.00 0.87 H new ATOM 0 HD23 LEU A 127 15.040 2.526 -2.143 1.00 0.87 H new ATOM 1723 N GLN A 128 14.046 0.208 -6.702 1.00 0.33 N ATOM 1724 CA GLN A 128 14.377 -0.934 -7.602 1.00 0.49 C ATOM 1725 C GLN A 128 15.642 -0.600 -8.393 1.00 0.80 C ATOM 1726 O GLN A 128 16.531 -1.415 -8.541 1.00 0.93 O ATOM 1727 CB GLN A 128 13.220 -1.180 -8.574 1.00 0.57 C ATOM 1728 CG GLN A 128 13.576 -2.334 -9.515 1.00 1.32 C ATOM 1729 CD GLN A 128 14.038 -1.772 -10.861 1.00 2.25 C ATOM 1730 OE1 GLN A 128 15.219 -1.600 -11.088 1.00 3.15 O ATOM 1731 NE2 GLN A 128 13.148 -1.475 -11.769 1.00 2.64 N ATOM 0 H GLN A 128 13.407 0.902 -7.091 1.00 0.33 H new ATOM 0 HA GLN A 128 14.541 -1.831 -7.004 1.00 0.49 H new ATOM 0 HB2 GLN A 128 12.311 -1.416 -8.021 1.00 0.57 H new ATOM 0 HB3 GLN A 128 13.017 -0.277 -9.150 1.00 0.57 H new ATOM 0 HG2 GLN A 128 14.363 -2.946 -9.075 1.00 1.32 H new ATOM 0 HG3 GLN A 128 12.711 -2.981 -9.657 1.00 1.32 H new ATOM 0 HE21 GLN A 128 12.157 -1.620 -11.578 1.00 2.64 H new ATOM 0 HE22 GLN A 128 13.444 -1.098 -12.669 1.00 2.64 H new ATOM 1740 N LYS A 129 15.727 0.597 -8.903 1.00 0.94 N ATOM 1741 CA LYS A 129 16.929 0.992 -9.686 1.00 1.26 C ATOM 1742 C LYS A 129 17.970 1.622 -8.758 1.00 1.35 C ATOM 1743 O LYS A 129 19.063 1.114 -8.603 1.00 1.30 O ATOM 1744 CB LYS A 129 16.524 2.001 -10.762 1.00 1.60 C ATOM 1745 CG LYS A 129 15.300 1.476 -11.516 1.00 1.99 C ATOM 1746 CD LYS A 129 14.712 2.594 -12.378 1.00 2.07 C ATOM 1747 CE LYS A 129 15.742 3.027 -13.422 1.00 1.90 C ATOM 1748 NZ LYS A 129 16.418 4.273 -12.964 1.00 1.03 N ATOM 0 H LYS A 129 15.013 1.320 -8.811 1.00 0.94 H new ATOM 0 HA LYS A 129 17.359 0.108 -10.157 1.00 1.26 H new ATOM 0 HB2 LYS A 129 16.298 2.965 -10.306 1.00 1.60 H new ATOM 0 HB3 LYS A 129 17.350 2.162 -11.455 1.00 1.60 H new ATOM 0 HG2 LYS A 129 15.581 0.629 -12.142 1.00 1.99 H new ATOM 0 HG3 LYS A 129 14.552 1.115 -10.810 1.00 1.99 H new ATOM 0 HD2 LYS A 129 13.803 2.249 -12.870 1.00 2.07 H new ATOM 0 HD3 LYS A 129 14.434 3.442 -11.752 1.00 2.07 H new ATOM 0 HE2 LYS A 129 16.477 2.236 -13.574 1.00 1.90 H new ATOM 0 HE3 LYS A 129 15.254 3.197 -14.382 1.00 1.90 H new ATOM 0 HZ1 LYS A 129 16.043 5.086 -13.493 1.00 1.03 H new ATOM 0 HZ2 LYS A 129 16.242 4.410 -11.948 1.00 1.03 H new ATOM 0 HZ3 LYS A 129 17.442 4.194 -13.130 1.00 1.03 H new ATOM 1762 N LYS A 130 17.644 2.728 -8.144 1.00 1.67 N ATOM 1763 CA LYS A 130 18.624 3.386 -7.238 1.00 1.94 C ATOM 1764 C LYS A 130 18.457 2.862 -5.812 1.00 1.82 C ATOM 1765 O LYS A 130 18.403 3.620 -4.865 1.00 2.34 O ATOM 1766 CB LYS A 130 18.416 4.904 -7.258 1.00 2.68 C ATOM 1767 CG LYS A 130 17.047 5.265 -6.675 1.00 3.06 C ATOM 1768 CD LYS A 130 17.187 6.519 -5.811 1.00 3.82 C ATOM 1769 CE LYS A 130 15.922 6.703 -4.974 1.00 4.66 C ATOM 1770 NZ LYS A 130 16.008 7.977 -4.202 1.00 5.80 N ATOM 0 H LYS A 130 16.745 3.201 -8.231 1.00 1.67 H new ATOM 0 HA LYS A 130 19.632 3.157 -7.585 1.00 1.94 H new ATOM 0 HB2 LYS A 130 19.203 5.392 -6.683 1.00 2.68 H new ATOM 0 HB3 LYS A 130 18.492 5.274 -8.281 1.00 2.68 H new ATOM 0 HG2 LYS A 130 16.330 5.439 -7.478 1.00 3.06 H new ATOM 0 HG3 LYS A 130 16.662 4.438 -6.078 1.00 3.06 H new ATOM 0 HD2 LYS A 130 18.057 6.430 -5.160 1.00 3.82 H new ATOM 0 HD3 LYS A 130 17.349 7.393 -6.442 1.00 3.82 H new ATOM 0 HE2 LYS A 130 15.045 6.718 -5.622 1.00 4.66 H new ATOM 0 HE3 LYS A 130 15.800 5.861 -4.292 1.00 4.66 H new ATOM 0 HZ1 LYS A 130 16.021 7.766 -3.184 1.00 5.80 H new ATOM 0 HZ2 LYS A 130 16.879 8.482 -4.462 1.00 5.80 H new ATOM 0 HZ3 LYS A 130 15.184 8.572 -4.422 1.00 5.80 H new ATOM 1784 N ALA A 131 18.384 1.571 -5.646 1.00 1.35 N ATOM 1785 CA ALA A 131 18.233 1.011 -4.275 1.00 1.58 C ATOM 1786 C ALA A 131 19.545 1.168 -3.495 1.00 2.11 C ATOM 1787 O ALA A 131 19.600 0.865 -2.325 1.00 3.13 O ATOM 1788 CB ALA A 131 17.873 -0.473 -4.365 1.00 1.19 C ATOM 0 H ALA A 131 18.422 0.882 -6.397 1.00 1.35 H new ATOM 0 HA ALA A 131 17.441 1.551 -3.757 1.00 1.58 H new ATOM 0 HB1 ALA A 131 17.763 -0.882 -3.361 1.00 1.19 H new ATOM 0 HB2 ALA A 131 16.935 -0.588 -4.909 1.00 1.19 H new ATOM 0 HB3 ALA A 131 18.664 -1.008 -4.890 1.00 1.19 H new ATOM 1794 N LYS A 132 20.593 1.644 -4.138 1.00 1.82 N ATOM 1795 CA LYS A 132 21.918 1.834 -3.471 1.00 2.42 C ATOM 1796 C LYS A 132 22.248 0.670 -2.542 1.00 2.27 C ATOM 1797 O LYS A 132 21.718 0.530 -1.458 1.00 2.08 O ATOM 1798 CB LYS A 132 21.940 3.141 -2.696 1.00 2.88 C ATOM 1799 CG LYS A 132 20.683 3.276 -1.834 1.00 2.87 C ATOM 1800 CD LYS A 132 20.787 4.542 -0.983 1.00 3.93 C ATOM 1801 CE LYS A 132 21.859 4.348 0.093 1.00 2.90 C ATOM 1802 NZ LYS A 132 21.217 4.312 1.438 1.00 3.31 N ATOM 0 H LYS A 132 20.578 1.914 -5.122 1.00 1.82 H new ATOM 0 HA LYS A 132 22.678 1.869 -4.252 1.00 2.42 H new ATOM 0 HB2 LYS A 132 22.827 3.181 -2.064 1.00 2.88 H new ATOM 0 HB3 LYS A 132 22.005 3.980 -3.389 1.00 2.88 H new ATOM 0 HG2 LYS A 132 19.797 3.322 -2.467 1.00 2.87 H new ATOM 0 HG3 LYS A 132 20.572 2.401 -1.193 1.00 2.87 H new ATOM 0 HD2 LYS A 132 21.038 5.396 -1.612 1.00 3.93 H new ATOM 0 HD3 LYS A 132 19.826 4.760 -0.518 1.00 3.93 H new ATOM 0 HE2 LYS A 132 22.404 3.421 -0.086 1.00 2.90 H new ATOM 0 HE3 LYS A 132 22.585 5.159 0.047 1.00 2.90 H new ATOM 0 HZ1 LYS A 132 21.946 4.180 2.167 1.00 3.31 H new ATOM 0 HZ2 LYS A 132 20.716 5.207 1.607 1.00 3.31 H new ATOM 0 HZ3 LYS A 132 20.540 3.523 1.479 1.00 3.31 H new ATOM 1816 N ASN A 133 23.142 -0.163 -2.968 1.00 2.39 N ATOM 1817 CA ASN A 133 23.527 -1.333 -2.137 1.00 2.27 C ATOM 1818 C ASN A 133 22.299 -2.224 -1.965 1.00 2.02 C ATOM 1819 O ASN A 133 22.010 -2.708 -0.888 1.00 1.86 O ATOM 1820 CB ASN A 133 24.019 -0.856 -0.768 1.00 2.17 C ATOM 1821 CG ASN A 133 25.328 -1.566 -0.417 1.00 2.03 C ATOM 1822 OD1 ASN A 133 25.320 -2.598 0.224 1.00 1.52 O ATOM 1823 ND2 ASN A 133 26.462 -1.051 -0.810 1.00 2.88 N ATOM 0 H ASN A 133 23.628 -0.087 -3.861 1.00 2.39 H new ATOM 0 HA ASN A 133 24.329 -1.890 -2.621 1.00 2.27 H new ATOM 0 HB2 ASN A 133 24.171 0.223 -0.781 1.00 2.17 H new ATOM 0 HB3 ASN A 133 23.266 -1.063 -0.007 1.00 2.17 H new ATOM 0 HD21 ASN A 133 27.340 -1.515 -0.579 1.00 2.88 H new ATOM 0 HD22 ASN A 133 26.469 -0.185 -1.348 1.00 2.88 H new ATOM 1830 N LEU A 134 21.571 -2.435 -3.026 1.00 2.01 N ATOM 1831 CA LEU A 134 20.352 -3.286 -2.942 1.00 1.81 C ATOM 1832 C LEU A 134 19.909 -3.698 -4.349 1.00 2.04 C ATOM 1833 O LEU A 134 20.433 -3.223 -5.337 1.00 2.68 O ATOM 1834 CB LEU A 134 19.230 -2.497 -2.265 1.00 1.55 C ATOM 1835 CG LEU A 134 19.058 -2.994 -0.830 1.00 1.51 C ATOM 1836 CD1 LEU A 134 19.295 -1.838 0.143 1.00 2.18 C ATOM 1837 CD2 LEU A 134 17.638 -3.534 -0.645 1.00 0.83 C ATOM 0 H LEU A 134 21.769 -2.053 -3.951 1.00 2.01 H new ATOM 0 HA LEU A 134 20.575 -4.180 -2.360 1.00 1.81 H new ATOM 0 HB2 LEU A 134 19.465 -1.433 -2.268 1.00 1.55 H new ATOM 0 HB3 LEU A 134 18.299 -2.619 -2.818 1.00 1.55 H new ATOM 0 HG LEU A 134 19.778 -3.788 -0.632 1.00 1.51 H new ATOM 0 HD11 LEU A 134 19.172 -2.193 1.166 1.00 2.18 H new ATOM 0 HD12 LEU A 134 20.306 -1.453 0.011 1.00 2.18 H new ATOM 0 HD13 LEU A 134 18.576 -1.043 -0.054 1.00 2.18 H new ATOM 0 HD21 LEU A 134 17.514 -3.889 0.378 1.00 0.83 H new ATOM 0 HD22 LEU A 134 16.918 -2.740 -0.843 1.00 0.83 H new ATOM 0 HD23 LEU A 134 17.469 -4.358 -1.338 1.00 0.83 H new ATOM 1849 N ASP A 135 18.945 -4.582 -4.436 1.00 1.59 N ATOM 1850 CA ASP A 135 18.440 -5.059 -5.762 1.00 1.79 C ATOM 1851 C ASP A 135 17.688 -6.373 -5.544 1.00 0.78 C ATOM 1852 O ASP A 135 18.115 -7.423 -5.984 1.00 1.30 O ATOM 1853 CB ASP A 135 19.609 -5.307 -6.724 1.00 3.07 C ATOM 1854 CG ASP A 135 19.694 -4.164 -7.738 1.00 4.41 C ATOM 1855 OD1 ASP A 135 19.066 -3.143 -7.507 1.00 4.87 O ATOM 1856 OD2 ASP A 135 20.387 -4.328 -8.728 1.00 5.36 O ATOM 0 H ASP A 135 18.479 -5.000 -3.631 1.00 1.59 H new ATOM 0 HA ASP A 135 17.785 -4.302 -6.194 1.00 1.79 H new ATOM 0 HB2 ASP A 135 20.542 -5.381 -6.166 1.00 3.07 H new ATOM 0 HB3 ASP A 135 19.471 -6.256 -7.242 1.00 3.07 H new ATOM 1861 N ALA A 136 16.577 -6.329 -4.859 1.00 0.99 N ATOM 1862 CA ALA A 136 15.813 -7.571 -4.606 1.00 1.99 C ATOM 1863 C ALA A 136 14.334 -7.305 -4.752 1.00 1.10 C ATOM 1864 O ALA A 136 13.537 -7.659 -3.906 1.00 1.97 O ATOM 1865 CB ALA A 136 16.087 -8.073 -3.194 1.00 4.00 C ATOM 0 H ALA A 136 16.169 -5.481 -4.465 1.00 0.99 H new ATOM 0 HA ALA A 136 16.124 -8.324 -5.330 1.00 1.99 H new ATOM 0 HB1 ALA A 136 15.521 -8.987 -3.017 1.00 4.00 H new ATOM 0 HB2 ALA A 136 17.152 -8.278 -3.081 1.00 4.00 H new ATOM 0 HB3 ALA A 136 15.785 -7.313 -2.473 1.00 4.00 H new ATOM 1871 N ILE A 137 13.961 -6.692 -5.821 1.00 1.03 N ATOM 1872 CA ILE A 137 12.528 -6.409 -6.030 1.00 2.06 C ATOM 1873 C ILE A 137 11.861 -7.674 -6.565 1.00 1.35 C ATOM 1874 O ILE A 137 11.657 -7.822 -7.754 1.00 2.39 O ATOM 1875 CB ILE A 137 12.360 -5.270 -7.044 1.00 3.32 C ATOM 1876 CG1 ILE A 137 12.842 -3.900 -6.490 1.00 4.30 C ATOM 1877 CG2 ILE A 137 10.880 -5.162 -7.388 1.00 4.17 C ATOM 1878 CD1 ILE A 137 13.917 -4.043 -5.388 1.00 2.93 C ATOM 0 H ILE A 137 14.584 -6.373 -6.562 1.00 1.03 H new ATOM 0 HA ILE A 137 12.068 -6.108 -5.089 1.00 2.06 H new ATOM 0 HB ILE A 137 12.969 -5.502 -7.918 1.00 3.32 H new ATOM 0 HG12 ILE A 137 13.245 -3.304 -7.309 1.00 4.30 H new ATOM 0 HG13 ILE A 137 11.988 -3.355 -6.089 1.00 4.30 H new ATOM 0 HG21 ILE A 137 10.732 -4.358 -8.109 1.00 4.17 H new ATOM 0 HG22 ILE A 137 10.537 -6.103 -7.818 1.00 4.17 H new ATOM 0 HG23 ILE A 137 10.311 -4.948 -6.483 1.00 4.17 H new ATOM 0 HD11 ILE A 137 14.215 -3.054 -5.040 1.00 2.93 H new ATOM 0 HD12 ILE A 137 13.509 -4.614 -4.554 1.00 2.93 H new ATOM 0 HD13 ILE A 137 14.786 -4.562 -5.793 1.00 2.93 H new ATOM 1890 N THR A 138 11.514 -8.581 -5.703 1.00 1.01 N ATOM 1891 CA THR A 138 10.856 -9.821 -6.181 1.00 1.23 C ATOM 1892 C THR A 138 9.510 -9.467 -6.807 1.00 0.79 C ATOM 1893 O THR A 138 8.997 -8.379 -6.641 1.00 0.72 O ATOM 1894 CB THR A 138 10.614 -10.781 -5.017 1.00 1.99 C ATOM 1895 OG1 THR A 138 10.661 -10.072 -3.786 1.00 2.75 O ATOM 1896 CG2 THR A 138 11.680 -11.878 -5.024 1.00 3.02 C ATOM 0 H THR A 138 11.656 -8.519 -4.695 1.00 1.01 H new ATOM 0 HA THR A 138 11.505 -10.300 -6.914 1.00 1.23 H new ATOM 0 HB THR A 138 9.629 -11.235 -5.128 1.00 1.99 H new ATOM 0 HG1 THR A 138 10.503 -10.693 -3.045 1.00 2.75 H new ATOM 0 HG21 THR A 138 11.505 -12.561 -4.193 1.00 3.02 H new ATOM 0 HG22 THR A 138 11.629 -12.429 -5.963 1.00 3.02 H new ATOM 0 HG23 THR A 138 12.667 -11.427 -4.921 1.00 3.02 H new ATOM 1904 N THR A 139 8.931 -10.392 -7.511 1.00 0.87 N ATOM 1905 CA THR A 139 7.609 -10.144 -8.141 1.00 0.90 C ATOM 1906 C THR A 139 6.727 -11.368 -7.860 1.00 1.27 C ATOM 1907 O THR A 139 6.465 -12.157 -8.747 1.00 1.24 O ATOM 1908 CB THR A 139 7.800 -9.952 -9.646 1.00 1.76 C ATOM 1909 OG1 THR A 139 8.508 -8.742 -9.877 1.00 2.38 O ATOM 1910 CG2 THR A 139 6.440 -9.891 -10.345 1.00 1.54 C ATOM 0 H THR A 139 9.321 -11.320 -7.679 1.00 0.87 H new ATOM 0 HA THR A 139 7.138 -9.247 -7.738 1.00 0.90 H new ATOM 0 HB THR A 139 8.366 -10.793 -10.047 1.00 1.76 H new ATOM 0 HG1 THR A 139 8.634 -8.616 -10.841 1.00 2.38 H new ATOM 0 HG21 THR A 139 6.587 -9.754 -11.416 1.00 1.54 H new ATOM 0 HG22 THR A 139 5.898 -10.820 -10.169 1.00 1.54 H new ATOM 0 HG23 THR A 139 5.864 -9.055 -9.948 1.00 1.54 H new ATOM 1958 N THR A 143 1.085 -12.912 -12.163 1.00 2.15 N ATOM 1959 CA THR A 143 -0.146 -13.268 -12.913 1.00 1.59 C ATOM 1960 C THR A 143 -1.197 -13.683 -11.886 1.00 1.34 C ATOM 1961 O THR A 143 -2.383 -13.552 -12.107 1.00 1.03 O ATOM 1962 CB THR A 143 0.142 -14.418 -13.892 1.00 1.43 C ATOM 1963 OG1 THR A 143 -0.983 -14.611 -14.740 1.00 1.81 O ATOM 1964 CG2 THR A 143 0.425 -15.708 -13.120 1.00 3.69 C ATOM 0 HA THR A 143 -0.502 -12.421 -13.500 1.00 1.59 H new ATOM 0 HB THR A 143 1.016 -14.164 -14.492 1.00 1.43 H new ATOM 0 HG1 THR A 143 -0.800 -15.343 -15.365 1.00 1.81 H new ATOM 0 HG21 THR A 143 0.628 -16.516 -13.823 1.00 3.69 H new ATOM 0 HG22 THR A 143 1.291 -15.563 -12.474 1.00 3.69 H new ATOM 0 HG23 THR A 143 -0.442 -15.966 -12.512 1.00 3.69 H new ATOM 1972 N THR A 144 -0.761 -14.154 -10.742 1.00 1.57 N ATOM 1973 CA THR A 144 -1.732 -14.533 -9.692 1.00 1.48 C ATOM 1974 C THR A 144 -2.357 -13.240 -9.170 1.00 1.27 C ATOM 1975 O THR A 144 -3.501 -13.211 -8.775 1.00 1.11 O ATOM 1976 CB THR A 144 -1.014 -15.276 -8.564 1.00 1.86 C ATOM 1977 OG1 THR A 144 -0.332 -16.401 -9.100 1.00 2.25 O ATOM 1978 CG2 THR A 144 -2.036 -15.745 -7.526 1.00 1.94 C ATOM 0 H THR A 144 0.221 -14.288 -10.500 1.00 1.57 H new ATOM 0 HA THR A 144 -2.502 -15.195 -10.089 1.00 1.48 H new ATOM 0 HB THR A 144 -0.297 -14.607 -8.088 1.00 1.86 H new ATOM 0 HG1 THR A 144 0.130 -16.877 -8.379 1.00 2.25 H new ATOM 0 HG21 THR A 144 -1.523 -16.274 -6.723 1.00 1.94 H new ATOM 0 HG22 THR A 144 -2.559 -14.882 -7.115 1.00 1.94 H new ATOM 0 HG23 THR A 144 -2.755 -16.414 -8.000 1.00 1.94 H new ATOM 1986 N ASN A 145 -1.614 -12.156 -9.207 1.00 1.31 N ATOM 1987 CA ASN A 145 -2.171 -10.847 -8.760 1.00 1.11 C ATOM 1988 C ASN A 145 -3.342 -10.497 -9.674 1.00 0.93 C ATOM 1989 O ASN A 145 -4.230 -9.761 -9.308 1.00 0.79 O ATOM 1990 CB ASN A 145 -1.110 -9.750 -8.872 1.00 1.15 C ATOM 1991 CG ASN A 145 -0.671 -9.324 -7.470 1.00 1.23 C ATOM 1992 OD1 ASN A 145 0.507 -9.204 -7.197 1.00 1.42 O ATOM 1993 ND2 ASN A 145 -1.579 -9.087 -6.563 1.00 1.14 N ATOM 0 H ASN A 145 -0.646 -12.127 -9.528 1.00 1.31 H new ATOM 0 HA ASN A 145 -2.491 -10.920 -7.721 1.00 1.11 H new ATOM 0 HB2 ASN A 145 -0.253 -10.114 -9.439 1.00 1.15 H new ATOM 0 HB3 ASN A 145 -1.511 -8.894 -9.415 1.00 1.15 H new ATOM 0 HD21 ASN A 145 -1.300 -8.801 -5.625 1.00 1.14 H new ATOM 0 HD22 ASN A 145 -2.568 -9.188 -6.793 1.00 1.14 H new ATOM 2000 N ALA A 146 -3.343 -11.033 -10.867 1.00 0.91 N ATOM 2001 CA ALA A 146 -4.452 -10.759 -11.816 1.00 0.74 C ATOM 2002 C ALA A 146 -5.722 -11.401 -11.269 1.00 0.60 C ATOM 2003 O ALA A 146 -6.805 -10.862 -11.380 1.00 0.54 O ATOM 2004 CB ALA A 146 -4.105 -11.372 -13.175 1.00 0.89 C ATOM 0 H ALA A 146 -2.615 -11.653 -11.223 1.00 0.91 H new ATOM 0 HA ALA A 146 -4.602 -9.686 -11.933 1.00 0.74 H new ATOM 0 HB1 ALA A 146 -4.913 -11.176 -13.879 1.00 0.89 H new ATOM 0 HB2 ALA A 146 -3.182 -10.929 -13.549 1.00 0.89 H new ATOM 0 HB3 ALA A 146 -3.972 -12.448 -13.065 1.00 0.89 H new ATOM 2010 N SER A 147 -5.591 -12.551 -10.669 1.00 0.68 N ATOM 2011 CA SER A 147 -6.788 -13.231 -10.099 1.00 0.70 C ATOM 2012 C SER A 147 -7.136 -12.590 -8.751 1.00 0.69 C ATOM 2013 O SER A 147 -8.281 -12.554 -8.348 1.00 0.70 O ATOM 2014 CB SER A 147 -6.488 -14.718 -9.898 1.00 0.91 C ATOM 2015 OG SER A 147 -7.146 -15.471 -10.908 1.00 0.65 O ATOM 0 H SER A 147 -4.709 -13.049 -10.549 1.00 0.68 H new ATOM 0 HA SER A 147 -7.630 -13.125 -10.784 1.00 0.70 H new ATOM 0 HB2 SER A 147 -5.413 -14.893 -9.940 1.00 0.91 H new ATOM 0 HB3 SER A 147 -6.824 -15.039 -8.912 1.00 0.91 H new ATOM 0 HG SER A 147 -6.954 -16.424 -10.783 1.00 0.65 H new ATOM 2021 N LEU A 148 -6.162 -12.059 -8.060 1.00 0.67 N ATOM 2022 CA LEU A 148 -6.461 -11.400 -6.761 1.00 0.66 C ATOM 2023 C LEU A 148 -7.254 -10.136 -7.070 1.00 0.56 C ATOM 2024 O LEU A 148 -8.123 -9.744 -6.332 1.00 0.69 O ATOM 2025 CB LEU A 148 -5.151 -11.046 -6.035 1.00 0.70 C ATOM 2026 CG LEU A 148 -5.377 -9.901 -5.031 1.00 0.58 C ATOM 2027 CD1 LEU A 148 -6.443 -10.296 -4.007 1.00 0.64 C ATOM 2028 CD2 LEU A 148 -4.075 -9.601 -4.308 1.00 0.56 C ATOM 0 H LEU A 148 -5.181 -12.054 -8.338 1.00 0.67 H new ATOM 0 HA LEU A 148 -7.033 -12.062 -6.111 1.00 0.66 H new ATOM 0 HB2 LEU A 148 -4.770 -11.924 -5.513 1.00 0.70 H new ATOM 0 HB3 LEU A 148 -4.394 -10.754 -6.763 1.00 0.70 H new ATOM 0 HG LEU A 148 -5.714 -9.017 -5.573 1.00 0.58 H new ATOM 0 HD11 LEU A 148 -6.593 -9.477 -3.303 1.00 0.64 H new ATOM 0 HD12 LEU A 148 -7.380 -10.509 -4.521 1.00 0.64 H new ATOM 0 HD13 LEU A 148 -6.116 -11.184 -3.466 1.00 0.64 H new ATOM 0 HD21 LEU A 148 -4.232 -8.790 -3.596 1.00 0.56 H new ATOM 0 HD22 LEU A 148 -3.741 -10.492 -3.776 1.00 0.56 H new ATOM 0 HD23 LEU A 148 -3.316 -9.305 -5.033 1.00 0.56 H new ATOM 2040 N LEU A 149 -6.961 -9.509 -8.169 1.00 0.43 N ATOM 2041 CA LEU A 149 -7.706 -8.286 -8.538 1.00 0.35 C ATOM 2042 C LEU A 149 -9.079 -8.735 -9.021 1.00 0.39 C ATOM 2043 O LEU A 149 -10.086 -8.105 -8.766 1.00 0.39 O ATOM 2044 CB LEU A 149 -6.953 -7.546 -9.653 1.00 0.31 C ATOM 2045 CG LEU A 149 -7.828 -6.442 -10.255 1.00 0.19 C ATOM 2046 CD1 LEU A 149 -8.365 -5.539 -9.141 1.00 0.43 C ATOM 2047 CD2 LEU A 149 -6.985 -5.609 -11.222 1.00 0.20 C ATOM 0 H LEU A 149 -6.236 -9.793 -8.828 1.00 0.43 H new ATOM 0 HA LEU A 149 -7.805 -7.605 -7.693 1.00 0.35 H new ATOM 0 HB2 LEU A 149 -6.036 -7.113 -9.254 1.00 0.31 H new ATOM 0 HB3 LEU A 149 -6.661 -8.251 -10.431 1.00 0.31 H new ATOM 0 HG LEU A 149 -8.667 -6.892 -10.786 1.00 0.19 H new ATOM 0 HD11 LEU A 149 -8.986 -4.756 -9.575 1.00 0.43 H new ATOM 0 HD12 LEU A 149 -8.961 -6.132 -8.447 1.00 0.43 H new ATOM 0 HD13 LEU A 149 -7.530 -5.085 -8.606 1.00 0.43 H new ATOM 0 HD21 LEU A 149 -7.601 -4.821 -11.655 1.00 0.20 H new ATOM 0 HD22 LEU A 149 -6.149 -5.162 -10.684 1.00 0.20 H new ATOM 0 HD23 LEU A 149 -6.604 -6.250 -12.017 1.00 0.20 H new ATOM 2059 N THR A 150 -9.120 -9.856 -9.688 1.00 0.44 N ATOM 2060 CA THR A 150 -10.416 -10.396 -10.159 1.00 0.47 C ATOM 2061 C THR A 150 -11.100 -11.116 -8.979 1.00 0.42 C ATOM 2062 O THR A 150 -12.193 -11.631 -9.103 1.00 0.53 O ATOM 2063 CB THR A 150 -10.159 -11.343 -11.360 1.00 0.44 C ATOM 2064 OG1 THR A 150 -11.208 -11.193 -12.305 1.00 0.75 O ATOM 2065 CG2 THR A 150 -10.077 -12.817 -10.933 1.00 0.29 C ATOM 0 H THR A 150 -8.304 -10.420 -9.926 1.00 0.44 H new ATOM 0 HA THR A 150 -11.080 -9.603 -10.502 1.00 0.47 H new ATOM 0 HB THR A 150 -9.198 -11.069 -11.796 1.00 0.44 H new ATOM 0 HG1 THR A 150 -11.049 -11.788 -13.067 1.00 0.75 H new ATOM 0 HG21 THR A 150 -9.896 -13.440 -11.809 1.00 0.29 H new ATOM 0 HG22 THR A 150 -9.261 -12.945 -10.222 1.00 0.29 H new ATOM 0 HG23 THR A 150 -11.016 -13.113 -10.465 1.00 0.29 H new ATOM 2073 N LYS A 151 -10.455 -11.152 -7.831 1.00 0.51 N ATOM 2074 CA LYS A 151 -11.053 -11.827 -6.649 1.00 0.44 C ATOM 2075 C LYS A 151 -11.644 -10.776 -5.707 1.00 0.56 C ATOM 2076 O LYS A 151 -12.684 -10.983 -5.117 1.00 0.60 O ATOM 2077 CB LYS A 151 -9.968 -12.618 -5.913 1.00 0.35 C ATOM 2078 CG LYS A 151 -10.609 -13.489 -4.830 1.00 0.35 C ATOM 2079 CD LYS A 151 -9.538 -13.924 -3.828 1.00 0.65 C ATOM 2080 CE LYS A 151 -9.740 -13.183 -2.504 1.00 0.72 C ATOM 2081 NZ LYS A 151 -9.872 -14.171 -1.396 1.00 1.14 N ATOM 0 H LYS A 151 -9.537 -10.738 -7.671 1.00 0.51 H new ATOM 0 HA LYS A 151 -11.841 -12.506 -6.976 1.00 0.44 H new ATOM 0 HB2 LYS A 151 -9.419 -13.243 -6.618 1.00 0.35 H new ATOM 0 HB3 LYS A 151 -9.247 -11.934 -5.464 1.00 0.35 H new ATOM 0 HG2 LYS A 151 -11.396 -12.934 -4.320 1.00 0.35 H new ATOM 0 HG3 LYS A 151 -11.077 -14.364 -5.281 1.00 0.35 H new ATOM 0 HD2 LYS A 151 -9.594 -15.000 -3.666 1.00 0.65 H new ATOM 0 HD3 LYS A 151 -8.546 -13.713 -4.227 1.00 0.65 H new ATOM 0 HE2 LYS A 151 -8.897 -12.519 -2.315 1.00 0.72 H new ATOM 0 HE3 LYS A 151 -10.632 -12.559 -2.557 1.00 0.72 H new ATOM 0 HZ1 LYS A 151 -10.009 -13.667 -0.496 1.00 1.14 H new ATOM 0 HZ2 LYS A 151 -10.690 -14.787 -1.576 1.00 1.14 H new ATOM 0 HZ3 LYS A 151 -9.009 -14.749 -1.341 1.00 1.14 H new ATOM 2095 N LEU A 152 -11.005 -9.639 -5.565 1.00 0.63 N ATOM 2096 CA LEU A 152 -11.566 -8.593 -4.668 1.00 0.76 C ATOM 2097 C LEU A 152 -12.771 -7.981 -5.374 1.00 0.73 C ATOM 2098 O LEU A 152 -13.728 -7.563 -4.752 1.00 0.74 O ATOM 2099 CB LEU A 152 -10.538 -7.479 -4.384 1.00 0.94 C ATOM 2100 CG LEU A 152 -9.111 -8.036 -4.284 1.00 0.97 C ATOM 2101 CD1 LEU A 152 -8.201 -7.256 -5.236 1.00 0.62 C ATOM 2102 CD2 LEU A 152 -8.583 -7.868 -2.857 1.00 1.17 C ATOM 0 H LEU A 152 -10.129 -9.396 -6.028 1.00 0.63 H new ATOM 0 HA LEU A 152 -11.840 -9.047 -3.716 1.00 0.76 H new ATOM 0 HB2 LEU A 152 -10.582 -6.732 -5.177 1.00 0.94 H new ATOM 0 HB3 LEU A 152 -10.797 -6.973 -3.454 1.00 0.94 H new ATOM 0 HG LEU A 152 -9.122 -9.094 -4.548 1.00 0.97 H new ATOM 0 HD11 LEU A 152 -7.185 -7.646 -5.170 1.00 0.62 H new ATOM 0 HD12 LEU A 152 -8.566 -7.364 -6.258 1.00 0.62 H new ATOM 0 HD13 LEU A 152 -8.203 -6.202 -4.959 1.00 0.62 H new ATOM 0 HD21 LEU A 152 -7.570 -8.266 -2.795 1.00 1.17 H new ATOM 0 HD22 LEU A 152 -8.574 -6.810 -2.594 1.00 1.17 H new ATOM 0 HD23 LEU A 152 -9.228 -8.408 -2.164 1.00 1.17 H new ATOM 2114 N GLN A 153 -12.726 -7.929 -6.679 1.00 0.71 N ATOM 2115 CA GLN A 153 -13.861 -7.348 -7.445 1.00 0.70 C ATOM 2116 C GLN A 153 -14.919 -8.427 -7.701 1.00 0.56 C ATOM 2117 O GLN A 153 -16.098 -8.144 -7.797 1.00 0.72 O ATOM 2118 CB GLN A 153 -13.353 -6.813 -8.788 1.00 0.75 C ATOM 2119 CG GLN A 153 -12.817 -5.389 -8.608 1.00 0.91 C ATOM 2120 CD GLN A 153 -13.292 -4.510 -9.765 1.00 0.86 C ATOM 2121 OE1 GLN A 153 -13.680 -5.008 -10.804 1.00 0.36 O ATOM 2122 NE2 GLN A 153 -13.278 -3.213 -9.628 1.00 1.88 N ATOM 0 H GLN A 153 -11.948 -8.266 -7.247 1.00 0.71 H new ATOM 0 HA GLN A 153 -14.302 -6.535 -6.868 1.00 0.70 H new ATOM 0 HB2 GLN A 153 -12.567 -7.461 -9.175 1.00 0.75 H new ATOM 0 HB3 GLN A 153 -14.160 -6.818 -9.521 1.00 0.75 H new ATOM 0 HG2 GLN A 153 -13.163 -4.977 -7.660 1.00 0.91 H new ATOM 0 HG3 GLN A 153 -11.728 -5.402 -8.572 1.00 0.91 H new ATOM 0 HE21 GLN A 153 -12.952 -2.796 -8.756 1.00 1.88 H new ATOM 0 HE22 GLN A 153 -13.593 -2.616 -10.393 1.00 1.88 H new ATOM 2131 N ALA A 154 -14.508 -9.662 -7.826 1.00 0.26 N ATOM 2132 CA ALA A 154 -15.488 -10.757 -8.090 1.00 0.12 C ATOM 2133 C ALA A 154 -16.377 -10.985 -6.868 1.00 0.26 C ATOM 2134 O ALA A 154 -17.400 -11.636 -6.951 1.00 0.74 O ATOM 2135 CB ALA A 154 -14.737 -12.048 -8.417 1.00 0.09 C ATOM 0 H ALA A 154 -13.535 -9.960 -7.757 1.00 0.26 H new ATOM 0 HA ALA A 154 -16.114 -10.469 -8.934 1.00 0.12 H new ATOM 0 HB1 ALA A 154 -15.453 -12.847 -8.610 1.00 0.09 H new ATOM 0 HB2 ALA A 154 -14.118 -11.895 -9.301 1.00 0.09 H new ATOM 0 HB3 ALA A 154 -14.104 -12.324 -7.574 1.00 0.09 H new ATOM 2141 N GLN A 155 -16.004 -10.464 -5.736 1.00 0.46 N ATOM 2142 CA GLN A 155 -16.839 -10.665 -4.525 1.00 0.52 C ATOM 2143 C GLN A 155 -18.120 -9.837 -4.642 1.00 0.36 C ATOM 2144 O GLN A 155 -18.252 -8.997 -5.510 1.00 0.30 O ATOM 2145 CB GLN A 155 -16.059 -10.219 -3.296 1.00 0.79 C ATOM 2146 CG GLN A 155 -14.653 -10.818 -3.332 1.00 0.84 C ATOM 2147 CD GLN A 155 -14.302 -11.377 -1.952 1.00 0.80 C ATOM 2148 OE1 GLN A 155 -14.597 -12.517 -1.651 1.00 1.22 O ATOM 2149 NE2 GLN A 155 -13.676 -10.617 -1.096 1.00 0.81 N ATOM 0 H GLN A 155 -15.159 -9.909 -5.597 1.00 0.46 H new ATOM 0 HA GLN A 155 -17.097 -11.720 -4.433 1.00 0.52 H new ATOM 0 HB2 GLN A 155 -16.000 -9.131 -3.266 1.00 0.79 H new ATOM 0 HB3 GLN A 155 -16.576 -10.536 -2.390 1.00 0.79 H new ATOM 0 HG2 GLN A 155 -14.602 -11.609 -4.080 1.00 0.84 H new ATOM 0 HG3 GLN A 155 -13.929 -10.057 -3.623 1.00 0.84 H new ATOM 0 HE21 GLN A 155 -13.429 -9.660 -1.349 1.00 0.81 H new ATOM 0 HE22 GLN A 155 -13.434 -10.980 -0.174 1.00 0.81 H new ATOM 2158 N ASN A 156 -19.066 -10.066 -3.773 1.00 0.37 N ATOM 2159 CA ASN A 156 -20.340 -9.288 -3.841 1.00 0.22 C ATOM 2160 C ASN A 156 -20.034 -7.795 -3.709 1.00 0.24 C ATOM 2161 O ASN A 156 -18.896 -7.395 -3.608 1.00 0.55 O ATOM 2162 CB ASN A 156 -21.298 -9.726 -2.724 1.00 0.16 C ATOM 2163 CG ASN A 156 -20.524 -10.008 -1.434 1.00 1.99 C ATOM 2164 OD1 ASN A 156 -19.391 -9.600 -1.289 1.00 3.59 O ATOM 2165 ND2 ASN A 156 -21.094 -10.699 -0.485 1.00 2.18 N ATOM 0 H ASN A 156 -19.015 -10.754 -3.022 1.00 0.37 H new ATOM 0 HA ASN A 156 -20.819 -9.478 -4.801 1.00 0.22 H new ATOM 0 HB2 ASN A 156 -22.040 -8.947 -2.547 1.00 0.16 H new ATOM 0 HB3 ASN A 156 -21.841 -10.620 -3.032 1.00 0.16 H new ATOM 0 HD21 ASN A 156 -20.587 -10.896 0.378 1.00 2.18 H new ATOM 0 HD22 ASN A 156 -22.047 -11.042 -0.606 1.00 2.18 H new ATOM 2172 N GLN A 157 -21.042 -6.969 -3.721 1.00 0.23 N ATOM 2173 CA GLN A 157 -20.808 -5.500 -3.607 1.00 0.15 C ATOM 2174 C GLN A 157 -20.206 -5.182 -2.237 1.00 0.18 C ATOM 2175 O GLN A 157 -19.491 -4.214 -2.067 1.00 0.21 O ATOM 2176 CB GLN A 157 -22.143 -4.771 -3.751 1.00 0.13 C ATOM 2177 CG GLN A 157 -21.913 -3.260 -3.711 1.00 0.39 C ATOM 2178 CD GLN A 157 -21.793 -2.723 -5.138 1.00 0.99 C ATOM 2179 OE1 GLN A 157 -20.707 -2.629 -5.674 1.00 2.39 O ATOM 2180 NE2 GLN A 157 -22.871 -2.364 -5.779 1.00 0.64 N ATOM 0 H GLN A 157 -22.020 -7.247 -3.805 1.00 0.23 H new ATOM 0 HA GLN A 157 -20.121 -5.177 -4.389 1.00 0.15 H new ATOM 0 HB2 GLN A 157 -22.622 -5.051 -4.689 1.00 0.13 H new ATOM 0 HB3 GLN A 157 -22.818 -5.067 -2.948 1.00 0.13 H new ATOM 0 HG2 GLN A 157 -22.738 -2.770 -3.195 1.00 0.39 H new ATOM 0 HG3 GLN A 157 -21.007 -3.034 -3.149 1.00 0.39 H new ATOM 0 HE21 GLN A 157 -23.783 -2.443 -5.328 1.00 0.64 H new ATOM 0 HE22 GLN A 157 -22.802 -2.004 -6.731 1.00 0.64 H new ATOM 2189 N TRP A 158 -20.505 -5.987 -1.261 1.00 0.26 N ATOM 2190 CA TRP A 158 -19.977 -5.746 0.112 1.00 0.37 C ATOM 2191 C TRP A 158 -18.454 -5.928 0.145 1.00 0.40 C ATOM 2192 O TRP A 158 -17.731 -5.104 0.669 1.00 0.40 O ATOM 2193 CB TRP A 158 -20.622 -6.755 1.061 1.00 0.46 C ATOM 2194 CG TRP A 158 -20.251 -6.425 2.471 1.00 0.53 C ATOM 2195 CD1 TRP A 158 -19.073 -6.741 3.058 1.00 0.68 C ATOM 2196 CD2 TRP A 158 -21.034 -5.723 3.479 1.00 0.56 C ATOM 2197 NE1 TRP A 158 -19.085 -6.278 4.362 1.00 0.73 N ATOM 2198 CE2 TRP A 158 -20.272 -5.643 4.668 1.00 0.68 C ATOM 2199 CE3 TRP A 158 -22.321 -5.154 3.476 1.00 0.58 C ATOM 2200 CZ2 TRP A 158 -20.767 -5.018 5.814 1.00 0.79 C ATOM 2201 CZ3 TRP A 158 -22.823 -4.525 4.628 1.00 0.76 C ATOM 2202 CH2 TRP A 158 -22.048 -4.458 5.795 1.00 0.85 C ATOM 0 H TRP A 158 -21.099 -6.811 -1.354 1.00 0.26 H new ATOM 0 HA TRP A 158 -20.212 -4.725 0.414 1.00 0.37 H new ATOM 0 HB2 TRP A 158 -21.706 -6.737 0.946 1.00 0.46 H new ATOM 0 HB3 TRP A 158 -20.292 -7.764 0.814 1.00 0.46 H new ATOM 0 HD1 TRP A 158 -18.257 -7.268 2.586 1.00 0.68 H new ATOM 0 HE1 TRP A 158 -18.311 -6.392 5.017 1.00 0.73 H new ATOM 0 HE3 TRP A 158 -22.927 -5.201 2.583 1.00 0.58 H new ATOM 0 HZ2 TRP A 158 -20.165 -4.967 6.709 1.00 0.79 H new ATOM 0 HZ3 TRP A 158 -23.812 -4.091 4.615 1.00 0.76 H new ATOM 0 HH2 TRP A 158 -22.440 -3.975 6.678 1.00 0.85 H new ATOM 2213 N LEU A 159 -17.971 -7.012 -0.389 1.00 0.52 N ATOM 2214 CA LEU A 159 -16.503 -7.277 -0.376 1.00 0.59 C ATOM 2215 C LEU A 159 -15.777 -6.345 -1.348 1.00 0.59 C ATOM 2216 O LEU A 159 -14.776 -5.749 -1.015 1.00 0.55 O ATOM 2217 CB LEU A 159 -16.258 -8.725 -0.795 1.00 0.62 C ATOM 2218 CG LEU A 159 -15.952 -9.579 0.436 1.00 1.04 C ATOM 2219 CD1 LEU A 159 -14.662 -9.085 1.087 1.00 3.05 C ATOM 2220 CD2 LEU A 159 -17.103 -9.471 1.439 1.00 1.08 C ATOM 0 H LEU A 159 -18.534 -7.734 -0.839 1.00 0.52 H new ATOM 0 HA LEU A 159 -16.121 -7.100 0.629 1.00 0.59 H new ATOM 0 HB2 LEU A 159 -17.135 -9.117 -1.311 1.00 0.62 H new ATOM 0 HB3 LEU A 159 -15.426 -8.773 -1.498 1.00 0.62 H new ATOM 0 HG LEU A 159 -15.835 -10.620 0.134 1.00 1.04 H new ATOM 0 HD11 LEU A 159 -14.442 -9.692 1.965 1.00 3.05 H new ATOM 0 HD12 LEU A 159 -13.841 -9.166 0.375 1.00 3.05 H new ATOM 0 HD13 LEU A 159 -14.781 -8.044 1.387 1.00 3.05 H new ATOM 0 HD21 LEU A 159 -16.881 -10.081 2.315 1.00 1.08 H new ATOM 0 HD22 LEU A 159 -17.225 -8.431 1.742 1.00 1.08 H new ATOM 0 HD23 LEU A 159 -18.024 -9.824 0.975 1.00 1.08 H new ATOM 2232 N GLN A 160 -16.258 -6.233 -2.553 1.00 0.89 N ATOM 2233 CA GLN A 160 -15.584 -5.356 -3.553 1.00 0.93 C ATOM 2234 C GLN A 160 -15.649 -3.895 -3.095 1.00 0.98 C ATOM 2235 O GLN A 160 -14.849 -3.072 -3.497 1.00 1.22 O ATOM 2236 CB GLN A 160 -16.280 -5.515 -4.915 1.00 1.28 C ATOM 2237 CG GLN A 160 -17.679 -4.888 -4.873 1.00 1.09 C ATOM 2238 CD GLN A 160 -17.644 -3.520 -5.557 1.00 1.22 C ATOM 2239 OE1 GLN A 160 -16.976 -2.616 -5.097 1.00 2.05 O ATOM 2240 NE2 GLN A 160 -18.338 -3.328 -6.646 1.00 1.49 N ATOM 0 H GLN A 160 -17.092 -6.712 -2.891 1.00 0.89 H new ATOM 0 HA GLN A 160 -14.537 -5.645 -3.646 1.00 0.93 H new ATOM 0 HB2 GLN A 160 -15.684 -5.039 -5.694 1.00 1.28 H new ATOM 0 HB3 GLN A 160 -16.355 -6.572 -5.172 1.00 1.28 H new ATOM 0 HG2 GLN A 160 -18.396 -5.539 -5.373 1.00 1.09 H new ATOM 0 HG3 GLN A 160 -18.011 -4.782 -3.840 1.00 1.09 H new ATOM 0 HE21 GLN A 160 -18.899 -4.086 -7.033 1.00 1.49 H new ATOM 0 HE22 GLN A 160 -18.319 -2.420 -7.109 1.00 1.49 H new ATOM 2249 N ASP A 161 -16.595 -3.566 -2.262 1.00 0.94 N ATOM 2250 CA ASP A 161 -16.708 -2.160 -1.786 1.00 1.12 C ATOM 2251 C ASP A 161 -15.861 -1.975 -0.527 1.00 1.00 C ATOM 2252 O ASP A 161 -15.435 -0.881 -0.210 1.00 1.19 O ATOM 2253 CB ASP A 161 -18.171 -1.849 -1.466 1.00 1.44 C ATOM 2254 CG ASP A 161 -18.309 -0.370 -1.100 1.00 1.60 C ATOM 2255 OD1 ASP A 161 -17.424 0.394 -1.451 1.00 1.78 O ATOM 2256 OD2 ASP A 161 -19.298 -0.026 -0.474 1.00 1.67 O ATOM 0 H ASP A 161 -17.294 -4.209 -1.890 1.00 0.94 H new ATOM 0 HA ASP A 161 -16.352 -1.484 -2.563 1.00 1.12 H new ATOM 0 HB2 ASP A 161 -18.800 -2.082 -2.325 1.00 1.44 H new ATOM 0 HB3 ASP A 161 -18.515 -2.473 -0.641 1.00 1.44 H new ATOM 2261 N MET A 162 -15.614 -3.031 0.198 1.00 0.83 N ATOM 2262 CA MET A 162 -14.796 -2.904 1.436 1.00 0.91 C ATOM 2263 C MET A 162 -13.307 -3.000 1.085 1.00 0.70 C ATOM 2264 O MET A 162 -12.458 -2.542 1.817 1.00 0.68 O ATOM 2265 CB MET A 162 -15.201 -4.009 2.436 1.00 0.92 C ATOM 2266 CG MET A 162 -14.540 -5.357 2.090 1.00 1.23 C ATOM 2267 SD MET A 162 -13.366 -5.811 3.395 1.00 0.75 S ATOM 2268 CE MET A 162 -11.844 -5.371 2.520 1.00 0.77 C ATOM 0 H MET A 162 -15.942 -3.973 -0.013 1.00 0.83 H new ATOM 0 HA MET A 162 -14.976 -1.934 1.900 1.00 0.91 H new ATOM 0 HB2 MET A 162 -14.914 -3.711 3.444 1.00 0.92 H new ATOM 0 HB3 MET A 162 -16.285 -4.123 2.433 1.00 0.92 H new ATOM 0 HG2 MET A 162 -15.301 -6.131 1.986 1.00 1.23 H new ATOM 0 HG3 MET A 162 -14.025 -5.286 1.132 1.00 1.23 H new ATOM 0 HE1 MET A 162 -10.995 -5.856 3.001 1.00 0.77 H new ATOM 0 HE2 MET A 162 -11.912 -5.701 1.483 1.00 0.77 H new ATOM 0 HE3 MET A 162 -11.708 -4.290 2.548 1.00 0.77 H new ATOM 2278 N THR A 163 -12.992 -3.599 -0.030 1.00 0.60 N ATOM 2279 CA THR A 163 -11.564 -3.741 -0.430 1.00 0.46 C ATOM 2280 C THR A 163 -10.880 -2.372 -0.421 1.00 0.47 C ATOM 2281 O THR A 163 -9.701 -2.267 -0.163 1.00 0.54 O ATOM 2282 CB THR A 163 -11.490 -4.360 -1.830 1.00 0.42 C ATOM 2283 OG1 THR A 163 -12.055 -5.663 -1.795 1.00 0.47 O ATOM 2284 CG2 THR A 163 -10.030 -4.451 -2.279 1.00 0.55 C ATOM 0 H THR A 163 -13.665 -3.998 -0.684 1.00 0.60 H new ATOM 0 HA THR A 163 -11.050 -4.391 0.279 1.00 0.46 H new ATOM 0 HB THR A 163 -12.043 -3.736 -2.532 1.00 0.42 H new ATOM 0 HG1 THR A 163 -13.012 -5.599 -1.594 1.00 0.47 H new ATOM 0 HG21 THR A 163 -9.982 -4.892 -3.275 1.00 0.55 H new ATOM 0 HG22 THR A 163 -9.594 -3.452 -2.303 1.00 0.55 H new ATOM 0 HG23 THR A 163 -9.472 -5.074 -1.580 1.00 0.55 H new ATOM 2292 N THR A 164 -11.603 -1.321 -0.687 1.00 0.48 N ATOM 2293 CA THR A 164 -10.968 0.028 -0.676 1.00 0.48 C ATOM 2294 C THR A 164 -10.620 0.407 0.766 1.00 0.47 C ATOM 2295 O THR A 164 -9.604 1.015 1.031 1.00 0.46 O ATOM 2296 CB THR A 164 -11.938 1.057 -1.261 1.00 0.49 C ATOM 2297 OG1 THR A 164 -11.318 2.335 -1.275 1.00 1.97 O ATOM 2298 CG2 THR A 164 -13.203 1.113 -0.404 1.00 1.60 C ATOM 0 H THR A 164 -12.598 -1.335 -0.910 1.00 0.48 H new ATOM 0 HA THR A 164 -10.060 0.011 -1.278 1.00 0.48 H new ATOM 0 HB THR A 164 -12.203 0.769 -2.278 1.00 0.49 H new ATOM 0 HG1 THR A 164 -11.771 2.911 -1.925 1.00 1.97 H new ATOM 0 HG21 THR A 164 -13.893 1.846 -0.821 1.00 1.60 H new ATOM 0 HG22 THR A 164 -13.679 0.132 -0.393 1.00 1.60 H new ATOM 0 HG23 THR A 164 -12.940 1.401 0.614 1.00 1.60 H new ATOM 2306 N HIS A 165 -11.465 0.051 1.695 1.00 0.48 N ATOM 2307 CA HIS A 165 -11.215 0.383 3.129 1.00 0.47 C ATOM 2308 C HIS A 165 -10.004 -0.407 3.664 1.00 0.38 C ATOM 2309 O HIS A 165 -9.076 0.161 4.205 1.00 0.44 O ATOM 2310 CB HIS A 165 -12.486 0.038 3.932 1.00 0.67 C ATOM 2311 CG HIS A 165 -12.179 -0.114 5.403 1.00 0.42 C ATOM 2312 ND1 HIS A 165 -11.813 -1.331 5.950 1.00 0.24 N ATOM 2313 CD2 HIS A 165 -12.177 0.781 6.444 1.00 0.56 C ATOM 2314 CE1 HIS A 165 -11.607 -1.141 7.264 1.00 0.14 C ATOM 2315 NE2 HIS A 165 -11.815 0.130 7.620 1.00 0.44 N ATOM 0 H HIS A 165 -12.329 -0.462 1.520 1.00 0.48 H new ATOM 0 HA HIS A 165 -10.987 1.444 3.232 1.00 0.47 H new ATOM 0 HB2 HIS A 165 -13.231 0.821 3.792 1.00 0.67 H new ATOM 0 HB3 HIS A 165 -12.920 -0.886 3.551 1.00 0.67 H new ATOM 0 HD2 HIS A 165 -12.419 1.830 6.363 1.00 0.56 H new ATOM 0 HE1 HIS A 165 -11.309 -1.921 7.949 1.00 0.14 H new ATOM 0 HE2 HIS A 165 -11.727 0.535 8.552 1.00 0.44 H new ATOM 2323 N LEU A 166 -10.021 -1.705 3.553 1.00 0.42 N ATOM 2324 CA LEU A 166 -8.884 -2.511 4.091 1.00 0.47 C ATOM 2325 C LEU A 166 -7.577 -2.151 3.378 1.00 0.37 C ATOM 2326 O LEU A 166 -6.547 -1.998 4.004 1.00 0.45 O ATOM 2327 CB LEU A 166 -9.178 -4.000 3.897 1.00 0.64 C ATOM 2328 CG LEU A 166 -8.535 -4.804 5.029 1.00 0.68 C ATOM 2329 CD1 LEU A 166 -7.027 -4.547 5.047 1.00 0.50 C ATOM 2330 CD2 LEU A 166 -9.142 -4.375 6.367 1.00 1.65 C ATOM 0 H LEU A 166 -10.768 -2.244 3.115 1.00 0.42 H new ATOM 0 HA LEU A 166 -8.773 -2.290 5.152 1.00 0.47 H new ATOM 0 HB2 LEU A 166 -10.255 -4.169 3.884 1.00 0.64 H new ATOM 0 HB3 LEU A 166 -8.791 -4.335 2.935 1.00 0.64 H new ATOM 0 HG LEU A 166 -8.719 -5.866 4.870 1.00 0.68 H new ATOM 0 HD11 LEU A 166 -6.570 -5.120 5.854 1.00 0.50 H new ATOM 0 HD12 LEU A 166 -6.594 -4.853 4.094 1.00 0.50 H new ATOM 0 HD13 LEU A 166 -6.841 -3.485 5.206 1.00 0.50 H new ATOM 0 HD21 LEU A 166 -8.685 -4.947 7.174 1.00 1.65 H new ATOM 0 HD22 LEU A 166 -8.958 -3.312 6.526 1.00 1.65 H new ATOM 0 HD23 LEU A 166 -10.216 -4.559 6.355 1.00 1.65 H new ATOM 2342 N ILE A 167 -7.597 -2.023 2.078 1.00 0.28 N ATOM 2343 CA ILE A 167 -6.336 -1.687 1.356 1.00 0.37 C ATOM 2344 C ILE A 167 -5.750 -0.393 1.928 1.00 0.34 C ATOM 2345 O ILE A 167 -4.640 -0.374 2.417 1.00 0.56 O ATOM 2346 CB ILE A 167 -6.610 -1.512 -0.145 1.00 0.40 C ATOM 2347 CG1 ILE A 167 -7.061 -2.847 -0.741 1.00 0.43 C ATOM 2348 CG2 ILE A 167 -5.327 -1.065 -0.857 1.00 0.55 C ATOM 2349 CD1 ILE A 167 -7.650 -2.608 -2.133 1.00 0.44 C ATOM 0 H ILE A 167 -8.423 -2.135 1.490 1.00 0.28 H new ATOM 0 HA ILE A 167 -5.624 -2.502 1.489 1.00 0.37 H new ATOM 0 HB ILE A 167 -7.388 -0.761 -0.279 1.00 0.40 H new ATOM 0 HG12 ILE A 167 -6.217 -3.534 -0.804 1.00 0.43 H new ATOM 0 HG13 ILE A 167 -7.804 -3.314 -0.095 1.00 0.43 H new ATOM 0 HG21 ILE A 167 -5.526 -0.942 -1.922 1.00 0.55 H new ATOM 0 HG22 ILE A 167 -4.990 -0.116 -0.439 1.00 0.55 H new ATOM 0 HG23 ILE A 167 -4.552 -1.819 -0.717 1.00 0.55 H new ATOM 0 HD11 ILE A 167 -7.972 -3.558 -2.560 1.00 0.44 H new ATOM 0 HD12 ILE A 167 -8.505 -1.936 -2.056 1.00 0.44 H new ATOM 0 HD13 ILE A 167 -6.893 -2.159 -2.776 1.00 0.44 H new ATOM 2361 N LEU A 168 -6.480 0.690 1.871 1.00 0.24 N ATOM 2362 CA LEU A 168 -5.944 1.970 2.417 1.00 0.35 C ATOM 2363 C LEU A 168 -5.621 1.800 3.905 1.00 0.20 C ATOM 2364 O LEU A 168 -4.880 2.572 4.481 1.00 0.24 O ATOM 2365 CB LEU A 168 -6.969 3.095 2.232 1.00 0.54 C ATOM 2366 CG LEU A 168 -8.309 2.696 2.853 1.00 1.75 C ATOM 2367 CD1 LEU A 168 -8.322 3.075 4.335 1.00 3.19 C ATOM 2368 CD2 LEU A 168 -9.437 3.439 2.131 1.00 2.61 C ATOM 0 H LEU A 168 -7.418 0.743 1.473 1.00 0.24 H new ATOM 0 HA LEU A 168 -5.034 2.232 1.878 1.00 0.35 H new ATOM 0 HB2 LEU A 168 -6.603 4.011 2.697 1.00 0.54 H new ATOM 0 HB3 LEU A 168 -7.100 3.306 1.171 1.00 0.54 H new ATOM 0 HG LEU A 168 -8.451 1.620 2.754 1.00 1.75 H new ATOM 0 HD11 LEU A 168 -9.278 2.790 4.775 1.00 3.19 H new ATOM 0 HD12 LEU A 168 -7.515 2.554 4.851 1.00 3.19 H new ATOM 0 HD13 LEU A 168 -8.183 4.151 4.437 1.00 3.19 H new ATOM 0 HD21 LEU A 168 -10.395 3.159 2.569 1.00 2.61 H new ATOM 0 HD22 LEU A 168 -9.290 4.514 2.236 1.00 2.61 H new ATOM 0 HD23 LEU A 168 -9.429 3.173 1.074 1.00 2.61 H new ATOM 2380 N ARG A 169 -6.165 0.792 4.536 1.00 0.11 N ATOM 2381 CA ARG A 169 -5.877 0.576 5.981 1.00 0.22 C ATOM 2382 C ARG A 169 -4.423 0.122 6.137 1.00 0.24 C ATOM 2383 O ARG A 169 -3.724 0.528 7.049 1.00 0.32 O ATOM 2384 CB ARG A 169 -6.816 -0.503 6.527 1.00 0.29 C ATOM 2385 CG ARG A 169 -6.754 -0.521 8.058 1.00 0.13 C ATOM 2386 CD ARG A 169 -6.823 -1.966 8.554 1.00 0.91 C ATOM 2387 NE ARG A 169 -7.744 -2.051 9.724 1.00 1.26 N ATOM 2388 CZ ARG A 169 -7.276 -1.923 10.935 1.00 0.63 C ATOM 2389 NH1 ARG A 169 -6.915 -0.749 11.375 1.00 1.04 N ATOM 2390 NH2 ARG A 169 -7.166 -2.970 11.708 1.00 1.52 N ATOM 0 H ARG A 169 -6.795 0.111 4.112 1.00 0.11 H new ATOM 0 HA ARG A 169 -6.032 1.502 6.535 1.00 0.22 H new ATOM 0 HB2 ARG A 169 -7.837 -0.310 6.198 1.00 0.29 H new ATOM 0 HB3 ARG A 169 -6.533 -1.478 6.131 1.00 0.29 H new ATOM 0 HG2 ARG A 169 -5.832 -0.051 8.401 1.00 0.13 H new ATOM 0 HG3 ARG A 169 -7.580 0.057 8.473 1.00 0.13 H new ATOM 0 HD2 ARG A 169 -7.173 -2.619 7.755 1.00 0.91 H new ATOM 0 HD3 ARG A 169 -5.829 -2.312 8.836 1.00 0.91 H new ATOM 0 HE ARG A 169 -8.741 -2.209 9.577 1.00 1.26 H new ATOM 0 HH11 ARG A 169 -6.999 0.069 10.772 1.00 1.04 H new ATOM 0 HH12 ARG A 169 -6.549 -0.650 12.322 1.00 1.04 H new ATOM 0 HH21 ARG A 169 -7.446 -3.889 11.365 1.00 1.52 H new ATOM 0 HH22 ARG A 169 -6.800 -2.869 12.655 1.00 1.52 H new ATOM 2404 N SER A 170 -3.957 -0.709 5.241 1.00 0.29 N ATOM 2405 CA SER A 170 -2.555 -1.181 5.323 1.00 0.40 C ATOM 2406 C SER A 170 -1.642 -0.064 4.833 1.00 0.33 C ATOM 2407 O SER A 170 -0.590 0.175 5.371 1.00 0.30 O ATOM 2408 CB SER A 170 -2.382 -2.416 4.437 1.00 0.55 C ATOM 2409 OG SER A 170 -3.110 -3.503 4.996 1.00 1.44 O ATOM 0 H SER A 170 -4.494 -1.079 4.456 1.00 0.29 H new ATOM 0 HA SER A 170 -2.304 -1.444 6.351 1.00 0.40 H new ATOM 0 HB2 SER A 170 -2.737 -2.206 3.428 1.00 0.55 H new ATOM 0 HB3 SER A 170 -1.326 -2.674 4.356 1.00 0.55 H new ATOM 0 HG SER A 170 -2.877 -4.330 4.524 1.00 1.44 H new ATOM 2415 N PHE A 171 -2.041 0.641 3.818 1.00 0.33 N ATOM 2416 CA PHE A 171 -1.186 1.747 3.318 1.00 0.31 C ATOM 2417 C PHE A 171 -0.870 2.692 4.473 1.00 0.24 C ATOM 2418 O PHE A 171 0.266 3.028 4.714 1.00 0.35 O ATOM 2419 CB PHE A 171 -1.916 2.496 2.210 1.00 0.30 C ATOM 2420 CG PHE A 171 -1.574 1.840 0.903 1.00 0.34 C ATOM 2421 CD1 PHE A 171 -1.886 0.491 0.704 1.00 0.68 C ATOM 2422 CD2 PHE A 171 -0.926 2.567 -0.098 1.00 0.32 C ATOM 2423 CE1 PHE A 171 -1.549 -0.133 -0.499 1.00 0.72 C ATOM 2424 CE2 PHE A 171 -0.591 1.945 -1.304 1.00 0.35 C ATOM 2425 CZ PHE A 171 -0.901 0.595 -1.506 1.00 0.43 C ATOM 0 H PHE A 171 -2.917 0.501 3.315 1.00 0.33 H new ATOM 0 HA PHE A 171 -0.256 1.345 2.916 1.00 0.31 H new ATOM 0 HB2 PHE A 171 -2.993 2.471 2.379 1.00 0.30 H new ATOM 0 HB3 PHE A 171 -1.619 3.545 2.199 1.00 0.30 H new ATOM 0 HD1 PHE A 171 -2.387 -0.068 1.480 1.00 0.68 H new ATOM 0 HD2 PHE A 171 -0.684 3.608 0.059 1.00 0.32 H new ATOM 0 HE1 PHE A 171 -1.787 -1.175 -0.653 1.00 0.72 H new ATOM 0 HE2 PHE A 171 -0.093 2.506 -2.081 1.00 0.35 H new ATOM 0 HZ PHE A 171 -0.641 0.115 -2.438 1.00 0.43 H new ATOM 2435 N LYS A 172 -1.863 3.106 5.200 1.00 0.09 N ATOM 2436 CA LYS A 172 -1.607 4.018 6.344 1.00 0.11 C ATOM 2437 C LYS A 172 -0.630 3.358 7.326 1.00 0.10 C ATOM 2438 O LYS A 172 0.457 3.854 7.565 1.00 0.17 O ATOM 2439 CB LYS A 172 -2.925 4.319 7.060 1.00 0.23 C ATOM 2440 CG LYS A 172 -2.913 5.762 7.570 1.00 0.81 C ATOM 2441 CD LYS A 172 -3.455 6.695 6.485 1.00 0.52 C ATOM 2442 CE LYS A 172 -3.915 8.008 7.123 1.00 0.83 C ATOM 2443 NZ LYS A 172 -3.250 9.154 6.440 1.00 1.85 N ATOM 0 H LYS A 172 -2.840 2.854 5.053 1.00 0.09 H new ATOM 0 HA LYS A 172 -1.172 4.946 5.974 1.00 0.11 H new ATOM 0 HB2 LYS A 172 -3.763 4.170 6.379 1.00 0.23 H new ATOM 0 HB3 LYS A 172 -3.064 3.629 7.892 1.00 0.23 H new ATOM 0 HG2 LYS A 172 -3.520 5.845 8.471 1.00 0.81 H new ATOM 0 HG3 LYS A 172 -1.898 6.054 7.841 1.00 0.81 H new ATOM 0 HD2 LYS A 172 -2.683 6.891 5.740 1.00 0.52 H new ATOM 0 HD3 LYS A 172 -4.287 6.220 5.965 1.00 0.52 H new ATOM 0 HE2 LYS A 172 -4.998 8.103 7.044 1.00 0.83 H new ATOM 0 HE3 LYS A 172 -3.671 8.013 8.185 1.00 0.83 H new ATOM 0 HZ1 LYS A 172 -3.563 10.046 6.874 1.00 1.85 H new ATOM 0 HZ2 LYS A 172 -2.218 9.065 6.537 1.00 1.85 H new ATOM 0 HZ3 LYS A 172 -3.504 9.152 5.432 1.00 1.85 H new ATOM 2457 N GLU A 173 -1.007 2.245 7.905 1.00 0.14 N ATOM 2458 CA GLU A 173 -0.098 1.572 8.884 1.00 0.25 C ATOM 2459 C GLU A 173 1.108 0.961 8.164 1.00 0.34 C ATOM 2460 O GLU A 173 2.224 1.400 8.336 1.00 0.39 O ATOM 2461 CB GLU A 173 -0.864 0.470 9.617 1.00 0.34 C ATOM 2462 CG GLU A 173 -0.065 0.020 10.842 1.00 0.79 C ATOM 2463 CD GLU A 173 -0.090 1.118 11.910 1.00 1.32 C ATOM 2464 OE1 GLU A 173 -0.798 2.094 11.718 1.00 2.47 O ATOM 2465 OE2 GLU A 173 0.599 0.961 12.906 1.00 1.85 O ATOM 0 H GLU A 173 -1.898 1.776 7.744 1.00 0.14 H new ATOM 0 HA GLU A 173 0.258 2.314 9.599 1.00 0.25 H new ATOM 0 HB2 GLU A 173 -1.844 0.836 9.923 1.00 0.34 H new ATOM 0 HB3 GLU A 173 -1.034 -0.375 8.950 1.00 0.34 H new ATOM 0 HG2 GLU A 173 -0.487 -0.901 11.244 1.00 0.79 H new ATOM 0 HG3 GLU A 173 0.964 -0.199 10.556 1.00 0.79 H new ATOM 2472 N PHE A 174 0.886 -0.063 7.382 1.00 0.39 N ATOM 2473 CA PHE A 174 2.002 -0.749 6.645 1.00 0.51 C ATOM 2474 C PHE A 174 3.058 0.251 6.137 1.00 0.51 C ATOM 2475 O PHE A 174 4.212 0.185 6.519 1.00 0.56 O ATOM 2476 CB PHE A 174 1.415 -1.510 5.454 1.00 0.58 C ATOM 2477 CG PHE A 174 2.215 -2.761 5.207 1.00 0.91 C ATOM 2478 CD1 PHE A 174 3.369 -2.705 4.424 1.00 0.37 C ATOM 2479 CD2 PHE A 174 1.799 -3.977 5.762 1.00 1.85 C ATOM 2480 CE1 PHE A 174 4.116 -3.866 4.192 1.00 0.63 C ATOM 2481 CE2 PHE A 174 2.546 -5.139 5.531 1.00 2.16 C ATOM 2482 CZ PHE A 174 3.704 -5.083 4.746 1.00 1.52 C ATOM 0 H PHE A 174 -0.037 -0.464 7.217 1.00 0.39 H new ATOM 0 HA PHE A 174 2.496 -1.431 7.337 1.00 0.51 H new ATOM 0 HB2 PHE A 174 0.374 -1.766 5.651 1.00 0.58 H new ATOM 0 HB3 PHE A 174 1.426 -0.879 4.566 1.00 0.58 H new ATOM 0 HD1 PHE A 174 3.686 -1.765 3.997 1.00 0.37 H new ATOM 0 HD2 PHE A 174 0.905 -4.019 6.366 1.00 1.85 H new ATOM 0 HE1 PHE A 174 5.009 -3.822 3.586 1.00 0.63 H new ATOM 0 HE2 PHE A 174 2.229 -6.079 5.959 1.00 2.16 H new ATOM 0 HZ PHE A 174 4.279 -5.979 4.568 1.00 1.52 H new ATOM 2492 N LEU A 175 2.693 1.171 5.275 1.00 0.47 N ATOM 2493 CA LEU A 175 3.718 2.134 4.770 1.00 0.53 C ATOM 2494 C LEU A 175 4.330 2.888 5.949 1.00 0.46 C ATOM 2495 O LEU A 175 5.506 3.172 5.960 1.00 0.47 O ATOM 2496 CB LEU A 175 3.092 3.146 3.811 1.00 0.54 C ATOM 2497 CG LEU A 175 2.703 2.470 2.494 1.00 0.60 C ATOM 2498 CD1 LEU A 175 1.530 3.221 1.874 1.00 0.63 C ATOM 2499 CD2 LEU A 175 3.883 2.519 1.522 1.00 0.59 C ATOM 0 H LEU A 175 1.750 1.294 4.907 1.00 0.47 H new ATOM 0 HA LEU A 175 4.484 1.570 4.238 1.00 0.53 H new ATOM 0 HB2 LEU A 175 2.211 3.594 4.270 1.00 0.54 H new ATOM 0 HB3 LEU A 175 3.796 3.955 3.617 1.00 0.54 H new ATOM 0 HG LEU A 175 2.428 1.433 2.689 1.00 0.60 H new ATOM 0 HD11 LEU A 175 1.248 2.744 0.935 1.00 0.63 H new ATOM 0 HD12 LEU A 175 0.683 3.202 2.559 1.00 0.63 H new ATOM 0 HD13 LEU A 175 1.819 4.254 1.683 1.00 0.63 H new ATOM 0 HD21 LEU A 175 3.603 2.037 0.585 1.00 0.59 H new ATOM 0 HD22 LEU A 175 4.153 3.557 1.329 1.00 0.59 H new ATOM 0 HD23 LEU A 175 4.735 1.998 1.958 1.00 0.59 H new ATOM 2511 N GLN A 176 3.549 3.226 6.940 1.00 0.40 N ATOM 2512 CA GLN A 176 4.121 3.964 8.105 1.00 0.34 C ATOM 2513 C GLN A 176 5.273 3.152 8.699 1.00 0.42 C ATOM 2514 O GLN A 176 6.265 3.699 9.136 1.00 0.51 O ATOM 2515 CB GLN A 176 3.039 4.179 9.165 1.00 0.16 C ATOM 2516 CG GLN A 176 2.456 5.585 9.022 1.00 0.24 C ATOM 2517 CD GLN A 176 1.983 6.086 10.387 1.00 0.22 C ATOM 2518 OE1 GLN A 176 2.517 7.039 10.917 1.00 1.21 O ATOM 2519 NE2 GLN A 176 0.994 5.477 10.983 1.00 1.24 N ATOM 0 H GLN A 176 2.550 3.026 6.994 1.00 0.40 H new ATOM 0 HA GLN A 176 4.491 4.935 7.775 1.00 0.34 H new ATOM 0 HB2 GLN A 176 2.251 3.434 9.052 1.00 0.16 H new ATOM 0 HB3 GLN A 176 3.461 4.048 10.162 1.00 0.16 H new ATOM 0 HG2 GLN A 176 3.208 6.262 8.616 1.00 0.24 H new ATOM 0 HG3 GLN A 176 1.623 5.574 8.319 1.00 0.24 H new ATOM 0 HE21 GLN A 176 0.545 4.676 10.538 1.00 1.24 H new ATOM 0 HE22 GLN A 176 0.670 5.802 11.894 1.00 1.24 H new ATOM 2528 N SER A 177 5.165 1.849 8.698 1.00 0.41 N ATOM 2529 CA SER A 177 6.276 1.020 9.240 1.00 0.48 C ATOM 2530 C SER A 177 7.467 1.172 8.305 1.00 0.48 C ATOM 2531 O SER A 177 8.605 1.160 8.720 1.00 0.51 O ATOM 2532 CB SER A 177 5.858 -0.448 9.298 1.00 0.47 C ATOM 2533 OG SER A 177 4.545 -0.544 9.831 1.00 0.73 O ATOM 0 H SER A 177 4.361 1.328 8.348 1.00 0.41 H new ATOM 0 HA SER A 177 6.531 1.346 10.248 1.00 0.48 H new ATOM 0 HB2 SER A 177 5.890 -0.886 8.301 1.00 0.47 H new ATOM 0 HB3 SER A 177 6.556 -1.012 9.917 1.00 0.47 H new ATOM 0 HG SER A 177 4.275 -1.485 9.867 1.00 0.73 H new ATOM 2539 N SER A 178 7.201 1.324 7.037 1.00 0.45 N ATOM 2540 CA SER A 178 8.304 1.494 6.050 1.00 0.44 C ATOM 2541 C SER A 178 9.074 2.780 6.363 1.00 0.47 C ATOM 2542 O SER A 178 10.234 2.749 6.709 1.00 0.95 O ATOM 2543 CB SER A 178 7.710 1.600 4.644 1.00 0.39 C ATOM 2544 OG SER A 178 6.579 0.746 4.542 1.00 1.85 O ATOM 0 H SER A 178 6.261 1.338 6.640 1.00 0.45 H new ATOM 0 HA SER A 178 8.977 0.639 6.106 1.00 0.44 H new ATOM 0 HB2 SER A 178 7.421 2.630 4.436 1.00 0.39 H new ATOM 0 HB3 SER A 178 8.457 1.322 3.900 1.00 0.39 H new ATOM 0 HG SER A 178 6.304 0.679 3.604 1.00 1.85 H new ATOM 2550 N LEU A 179 8.432 3.908 6.228 1.00 0.39 N ATOM 2551 CA LEU A 179 9.107 5.211 6.497 1.00 0.38 C ATOM 2552 C LEU A 179 9.729 5.218 7.899 1.00 0.31 C ATOM 2553 O LEU A 179 10.720 5.880 8.144 1.00 0.44 O ATOM 2554 CB LEU A 179 8.071 6.337 6.387 1.00 0.65 C ATOM 2555 CG LEU A 179 6.885 6.051 7.307 1.00 1.81 C ATOM 2556 CD1 LEU A 179 7.206 6.532 8.723 1.00 2.97 C ATOM 2557 CD2 LEU A 179 5.657 6.802 6.785 1.00 2.55 C ATOM 0 H LEU A 179 7.457 3.984 5.939 1.00 0.39 H new ATOM 0 HA LEU A 179 9.903 5.360 5.767 1.00 0.38 H new ATOM 0 HB2 LEU A 179 8.528 7.290 6.655 1.00 0.65 H new ATOM 0 HB3 LEU A 179 7.728 6.427 5.356 1.00 0.65 H new ATOM 0 HG LEU A 179 6.686 4.979 7.326 1.00 1.81 H new ATOM 0 HD11 LEU A 179 6.359 6.327 9.378 1.00 2.97 H new ATOM 0 HD12 LEU A 179 8.087 6.008 9.094 1.00 2.97 H new ATOM 0 HD13 LEU A 179 7.402 7.604 8.707 1.00 2.97 H new ATOM 0 HD21 LEU A 179 4.805 6.604 7.436 1.00 2.55 H new ATOM 0 HD22 LEU A 179 5.863 7.872 6.773 1.00 2.55 H new ATOM 0 HD23 LEU A 179 5.427 6.465 5.774 1.00 2.55 H new ATOM 2569 N ARG A 180 9.158 4.495 8.823 1.00 0.48 N ATOM 2570 CA ARG A 180 9.719 4.474 10.206 1.00 0.56 C ATOM 2571 C ARG A 180 11.014 3.657 10.233 1.00 0.40 C ATOM 2572 O ARG A 180 11.948 3.970 10.949 1.00 0.54 O ATOM 2573 CB ARG A 180 8.699 3.838 11.155 1.00 0.76 C ATOM 2574 CG ARG A 180 9.109 4.110 12.603 1.00 0.87 C ATOM 2575 CD ARG A 180 8.193 3.330 13.547 1.00 1.62 C ATOM 2576 NE ARG A 180 8.979 2.271 14.241 1.00 2.90 N ATOM 2577 CZ ARG A 180 8.786 2.041 15.510 1.00 3.36 C ATOM 2578 NH1 ARG A 180 7.586 1.774 15.949 1.00 3.53 N ATOM 2579 NH2 ARG A 180 9.793 2.080 16.341 1.00 3.98 N ATOM 0 H ARG A 180 8.329 3.918 8.682 1.00 0.48 H new ATOM 0 HA ARG A 180 9.933 5.495 10.522 1.00 0.56 H new ATOM 0 HB2 ARG A 180 7.706 4.245 10.965 1.00 0.76 H new ATOM 0 HB3 ARG A 180 8.642 2.764 10.978 1.00 0.76 H new ATOM 0 HG2 ARG A 180 10.147 3.815 12.760 1.00 0.87 H new ATOM 0 HG3 ARG A 180 9.045 5.177 12.816 1.00 0.87 H new ATOM 0 HD2 ARG A 180 7.747 4.005 14.278 1.00 1.62 H new ATOM 0 HD3 ARG A 180 7.373 2.881 12.986 1.00 1.62 H new ATOM 0 HE ARG A 180 9.668 1.726 13.723 1.00 2.90 H new ATOM 0 HH11 ARG A 180 6.800 1.745 15.300 1.00 3.53 H new ATOM 0 HH12 ARG A 180 7.434 1.594 16.941 1.00 3.53 H new ATOM 0 HH21 ARG A 180 10.730 2.290 15.997 1.00 3.98 H new ATOM 0 HH22 ARG A 180 9.642 1.900 17.334 1.00 3.98 H new ATOM 2593 N ALA A 181 11.081 2.616 9.453 1.00 0.41 N ATOM 2594 CA ALA A 181 12.308 1.784 9.430 1.00 0.54 C ATOM 2595 C ALA A 181 13.395 2.546 8.683 1.00 0.62 C ATOM 2596 O ALA A 181 14.565 2.413 8.966 1.00 0.75 O ATOM 2597 CB ALA A 181 12.005 0.462 8.720 1.00 0.65 C ATOM 0 H ALA A 181 10.335 2.307 8.830 1.00 0.41 H new ATOM 0 HA ALA A 181 12.645 1.570 10.444 1.00 0.54 H new ATOM 0 HB1 ALA A 181 12.904 -0.154 8.700 1.00 0.65 H new ATOM 0 HB2 ALA A 181 11.215 -0.065 9.255 1.00 0.65 H new ATOM 0 HB3 ALA A 181 11.680 0.663 7.699 1.00 0.65 H new ATOM 2603 N LEU A 182 13.013 3.358 7.739 1.00 0.56 N ATOM 2604 CA LEU A 182 14.018 4.138 6.980 1.00 0.64 C ATOM 2605 C LEU A 182 14.630 5.191 7.903 1.00 0.74 C ATOM 2606 O LEU A 182 15.800 5.507 7.814 1.00 0.86 O ATOM 2607 CB LEU A 182 13.344 4.829 5.793 1.00 0.59 C ATOM 2608 CG LEU A 182 13.582 4.010 4.523 1.00 0.50 C ATOM 2609 CD1 LEU A 182 12.301 3.261 4.148 1.00 0.74 C ATOM 2610 CD2 LEU A 182 13.977 4.949 3.381 1.00 0.70 C ATOM 0 H LEU A 182 12.044 3.513 7.462 1.00 0.56 H new ATOM 0 HA LEU A 182 14.797 3.472 6.611 1.00 0.64 H new ATOM 0 HB2 LEU A 182 12.275 4.931 5.977 1.00 0.59 H new ATOM 0 HB3 LEU A 182 13.744 5.836 5.670 1.00 0.59 H new ATOM 0 HG LEU A 182 14.382 3.291 4.699 1.00 0.50 H new ATOM 0 HD11 LEU A 182 12.472 2.678 3.243 1.00 0.74 H new ATOM 0 HD12 LEU A 182 12.018 2.593 4.962 1.00 0.74 H new ATOM 0 HD13 LEU A 182 11.499 3.978 3.972 1.00 0.74 H new ATOM 0 HD21 LEU A 182 14.147 4.368 2.475 1.00 0.70 H new ATOM 0 HD22 LEU A 182 13.176 5.667 3.207 1.00 0.70 H new ATOM 0 HD23 LEU A 182 14.890 5.482 3.647 1.00 0.70 H new ATOM 2622 N ARG A 183 13.845 5.733 8.792 1.00 0.73 N ATOM 2623 CA ARG A 183 14.376 6.763 9.727 1.00 0.86 C ATOM 2624 C ARG A 183 15.216 6.081 10.810 1.00 0.90 C ATOM 2625 O ARG A 183 16.078 6.689 11.412 1.00 1.11 O ATOM 2626 CB ARG A 183 13.211 7.509 10.378 1.00 0.89 C ATOM 2627 CG ARG A 183 13.647 8.932 10.730 1.00 1.08 C ATOM 2628 CD ARG A 183 12.975 9.365 12.036 1.00 1.97 C ATOM 2629 NE ARG A 183 13.916 10.214 12.821 1.00 2.40 N ATOM 2630 CZ ARG A 183 13.590 10.608 14.022 1.00 3.14 C ATOM 2631 NH1 ARG A 183 12.624 11.470 14.186 1.00 3.17 N ATOM 2632 NH2 ARG A 183 14.230 10.141 15.058 1.00 4.19 N ATOM 0 H ARG A 183 12.858 5.507 8.911 1.00 0.73 H new ATOM 0 HA ARG A 183 14.997 7.470 9.177 1.00 0.86 H new ATOM 0 HB2 ARG A 183 12.359 7.536 9.699 1.00 0.89 H new ATOM 0 HB3 ARG A 183 12.886 6.984 11.277 1.00 0.89 H new ATOM 0 HG2 ARG A 183 14.731 8.976 10.835 1.00 1.08 H new ATOM 0 HG3 ARG A 183 13.376 9.616 9.926 1.00 1.08 H new ATOM 0 HD2 ARG A 183 12.061 9.919 11.821 1.00 1.97 H new ATOM 0 HD3 ARG A 183 12.687 8.489 12.617 1.00 1.97 H new ATOM 0 HE ARG A 183 14.813 10.487 12.420 1.00 2.40 H new ATOM 0 HH11 ARG A 183 12.124 11.836 13.376 1.00 3.17 H new ATOM 0 HH12 ARG A 183 12.369 11.778 15.124 1.00 3.17 H new ATOM 0 HH21 ARG A 183 14.985 9.468 14.930 1.00 4.19 H new ATOM 0 HH22 ARG A 183 13.975 10.449 15.996 1.00 4.19 H new ATOM 2646 N GLN A 184 14.973 4.823 11.064 1.00 0.71 N ATOM 2647 CA GLN A 184 15.762 4.115 12.109 1.00 0.75 C ATOM 2648 C GLN A 184 17.034 3.530 11.492 1.00 0.79 C ATOM 2649 O GLN A 184 17.995 3.250 12.181 1.00 0.86 O ATOM 2650 CB GLN A 184 14.921 2.985 12.708 1.00 0.72 C ATOM 2651 CG GLN A 184 14.063 3.540 13.846 1.00 1.14 C ATOM 2652 CD GLN A 184 14.744 3.251 15.186 1.00 1.00 C ATOM 2653 OE1 GLN A 184 14.139 2.690 16.078 1.00 2.03 O ATOM 2654 NE2 GLN A 184 15.985 3.611 15.365 1.00 1.12 N ATOM 0 H GLN A 184 14.265 4.258 10.594 1.00 0.71 H new ATOM 0 HA GLN A 184 16.034 4.823 12.892 1.00 0.75 H new ATOM 0 HB2 GLN A 184 14.285 2.543 11.940 1.00 0.72 H new ATOM 0 HB3 GLN A 184 15.569 2.192 13.080 1.00 0.72 H new ATOM 0 HG2 GLN A 184 13.924 4.614 13.721 1.00 1.14 H new ATOM 0 HG3 GLN A 184 13.072 3.086 13.824 1.00 1.14 H new ATOM 0 HE21 GLN A 184 16.493 4.082 14.616 1.00 1.12 H new ATOM 0 HE22 GLN A 184 16.448 3.422 16.254 1.00 1.12 H new ATOM 2663 N MET A 185 17.056 3.341 10.199 1.00 0.76 N ATOM 2664 CA MET A 185 18.276 2.774 9.559 1.00 0.84 C ATOM 2665 C MET A 185 18.700 3.649 8.376 1.00 0.84 C ATOM 2666 O MET A 185 18.036 4.642 8.131 1.00 1.93 O ATOM 2667 CB MET A 185 17.995 1.343 9.079 1.00 1.57 C ATOM 2668 CG MET A 185 16.986 1.357 7.926 1.00 0.78 C ATOM 2669 SD MET A 185 15.803 0.003 8.150 1.00 2.35 S ATOM 2670 CE MET A 185 14.897 0.226 6.600 1.00 0.68 C ATOM 2671 OXT MET A 185 19.682 3.310 7.736 1.00 0.82 O ATOM 0 H MET A 185 16.287 3.553 9.563 1.00 0.76 H new ATOM 0 HA MET A 185 19.084 2.752 10.290 1.00 0.84 H new ATOM 0 HB2 MET A 185 18.923 0.873 8.753 1.00 1.57 H new ATOM 0 HB3 MET A 185 17.607 0.745 9.904 1.00 1.57 H new ATOM 0 HG2 MET A 185 16.462 2.312 7.898 1.00 0.78 H new ATOM 0 HG3 MET A 185 17.504 1.249 6.973 1.00 0.78 H new ATOM 0 HE1 MET A 185 13.975 -0.355 6.631 1.00 0.68 H new ATOM 0 HE2 MET A 185 14.657 1.281 6.467 1.00 0.68 H new ATOM 0 HE3 MET A 185 15.512 -0.114 5.767 1.00 0.68 H new