USER MOD reduce.3.24.130724 H: found=0, std=0, add=1118, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1120 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 28 CYS SG : rot -119:sc= 0.286! USER MOD Set 1.2: A 121 GLN :FLIP amide:sc= -0.111! F(o=-2.9,f=0.17!) USER MOD Set 2.1: A 18 TYR OH : rot 30:sc= -0.345 USER MOD Set 2.2: A 75 ASN : amide:sc= -5.15! C(o=-12!,f=-19!) USER MOD Set 2.3: A 76 HIS : no HE2:sc= -6.01 K(o=-12,f=-13!) USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= -1.17 USER MOD Single : A 10 HIS : no HE2:sc= -0.0914 K(o=-0.091,f=-0.93) USER MOD Single : A 13 MET CE :methyl -126:sc= -2.88 (180deg=-8.17!) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00439) USER MOD Single : A 34 LYS NZ :NH3+ -129:sc= 1.06 (180deg=-0.36) USER MOD Single : A 35 MET CE :methyl -149:sc= -3.97 (180deg=-9.28!) USER MOD Single : A 74 MET CE :methyl 143:sc= -0.188 (180deg=-0.307) USER MOD Single : A 77 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 79 GLN : amide:sc= -1.49 K(o=-1.5,f=-2.3!) USER MOD Single : A 81 THR OG1 : rot 180:sc= -0.386 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot -137:sc= -0.279 USER MOD Single : A 89 LYS NZ :NH3+ -142:sc= -2.64! (180deg=-3.84!) USER MOD Single : A 90 LYS NZ :NH3+ -160:sc= -0.0641 (180deg=-0.357) USER MOD Single : A 91 TYR OH : rot 150:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 TYR OH : rot -85:sc= 0.443 USER MOD Single : A 96 MET CE :methyl -144:sc= -1.53 (180deg=-3.48!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 120:sc= 0.00397 USER MOD Single : A 100 LYS NZ :NH3+ 147:sc= 0 (180deg=-0.27) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN :FLIP amide:sc= -0.0294 F(o=-0.65,f=-0.029) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 MET CE :methyl -125:sc= -0.13 (180deg=-0.695) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 145:sc= 0.346 (180deg=-1.48) USER MOD Single : A 124 HIS :FLIP no HD1:sc= -0.315 F(o=-1,f=-0.31) USER MOD Single : A 128 ASN : amide:sc= -0.0432 X(o=-0.043,f=-0.18) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 ASN : amide:sc= -0.126 X(o=-0.13,f=-0.025) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 GLN :FLIP amide:sc= -0.501 F(o=-2.6,f=-0.5) USER MOD Single : A 139 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 140 MET CE :methyl 157:sc= -1.37 (180deg=-3.86) USER MOD Single : A 141 ASN :FLIP amide:sc= -3.58! F(o=-4.3,f=-3.6!) USER MOD Single : A 145 MET CE :methyl 164:sc= -4.42 (180deg=-5.75!) USER MOD Single : A 151 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 THR OG1 : rot 180:sc= 0 USER MOD Single : A 159 TYR OH : rot 180:sc= 0 USER MOD Single : A 160 MET CE :methyl -134:sc= -7.5! (180deg=-13.5!) USER MOD Single : A 164 LYS NZ :NH3+ -169:sc= 1.11 (180deg=0.841) USER MOD Single : A 169 MET CE :methyl 164:sc=-0.00658 (180deg=-0.138) USER MOD ----------------------------------------------------------------- ATOM 20 N ILE A 2 -0.579 -19.879 -2.513 1.00 0.00 N ATOM 21 CA ILE A 2 0.730 -20.214 -1.970 1.00 0.00 C ATOM 22 C ILE A 2 1.308 -19.047 -1.174 1.00 0.00 C ATOM 23 O ILE A 2 1.180 -17.889 -1.568 1.00 0.00 O ATOM 24 CB ILE A 2 1.717 -20.616 -3.089 1.00 0.00 C ATOM 25 CG1 ILE A 2 2.972 -21.248 -2.486 1.00 0.00 C ATOM 26 CG2 ILE A 2 2.084 -19.417 -3.953 1.00 0.00 C ATOM 27 CD1 ILE A 2 3.565 -22.344 -3.344 1.00 0.00 C ATOM 0 HA ILE A 2 0.593 -21.065 -1.303 1.00 0.00 H new ATOM 0 HB ILE A 2 1.227 -21.351 -3.728 1.00 0.00 H new ATOM 0 HG12 ILE A 2 3.722 -20.472 -2.331 1.00 0.00 H new ATOM 0 HG13 ILE A 2 2.729 -21.656 -1.505 1.00 0.00 H new ATOM 0 HG21 ILE A 2 2.780 -19.729 -4.732 1.00 0.00 H new ATOM 0 HG22 ILE A 2 1.183 -19.010 -4.413 1.00 0.00 H new ATOM 0 HG23 ILE A 2 2.552 -18.652 -3.334 1.00 0.00 H new ATOM 0 HD11 ILE A 2 4.452 -22.748 -2.856 1.00 0.00 H new ATOM 0 HD12 ILE A 2 2.831 -23.139 -3.478 1.00 0.00 H new ATOM 0 HD13 ILE A 2 3.840 -21.936 -4.317 1.00 0.00 H new ATOM 39 N ILE A 3 1.936 -19.363 -0.048 1.00 0.00 N ATOM 40 CA ILE A 3 2.528 -18.342 0.808 1.00 0.00 C ATOM 41 C ILE A 3 4.036 -18.255 0.605 1.00 0.00 C ATOM 42 O ILE A 3 4.672 -19.221 0.188 1.00 0.00 O ATOM 43 CB ILE A 3 2.242 -18.622 2.296 1.00 0.00 C ATOM 44 CG1 ILE A 3 0.772 -18.997 2.497 1.00 0.00 C ATOM 45 CG2 ILE A 3 2.604 -17.410 3.142 1.00 0.00 C ATOM 46 CD1 ILE A 3 -0.194 -17.944 2.000 1.00 0.00 C ATOM 0 H ILE A 3 2.049 -20.317 0.294 1.00 0.00 H new ATOM 0 HA ILE A 3 2.071 -17.394 0.526 1.00 0.00 H new ATOM 0 HB ILE A 3 2.858 -19.463 2.615 1.00 0.00 H new ATOM 0 HG12 ILE A 3 0.571 -19.936 1.980 1.00 0.00 H new ATOM 0 HG13 ILE A 3 0.592 -19.172 3.558 1.00 0.00 H new ATOM 0 HG21 ILE A 3 2.396 -17.623 4.191 1.00 0.00 H new ATOM 0 HG22 ILE A 3 3.664 -17.185 3.020 1.00 0.00 H new ATOM 0 HG23 ILE A 3 2.012 -16.553 2.822 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -1.217 -18.277 2.175 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -0.020 -17.010 2.534 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.042 -17.785 0.932 1.00 0.00 H new ATOM 58 N TYR A 4 4.603 -17.090 0.907 1.00 0.00 N ATOM 59 CA TYR A 4 6.038 -16.875 0.761 1.00 0.00 C ATOM 60 C TYR A 4 6.651 -16.445 2.093 1.00 0.00 C ATOM 61 O TYR A 4 6.466 -15.311 2.533 1.00 0.00 O ATOM 62 CB TYR A 4 6.310 -15.811 -0.306 1.00 0.00 C ATOM 63 CG TYR A 4 5.903 -16.226 -1.704 1.00 0.00 C ATOM 64 CD1 TYR A 4 4.592 -16.586 -1.994 1.00 0.00 C ATOM 65 CD2 TYR A 4 6.832 -16.252 -2.738 1.00 0.00 C ATOM 66 CE1 TYR A 4 4.219 -16.959 -3.270 1.00 0.00 C ATOM 67 CE2 TYR A 4 6.465 -16.625 -4.018 1.00 0.00 C ATOM 68 CZ TYR A 4 5.159 -16.977 -4.278 1.00 0.00 C ATOM 69 OH TYR A 4 4.791 -17.348 -5.551 1.00 0.00 O ATOM 0 H TYR A 4 4.089 -16.280 1.255 1.00 0.00 H new ATOM 0 HA TYR A 4 6.497 -17.813 0.450 1.00 0.00 H new ATOM 0 HB2 TYR A 4 5.777 -14.898 -0.039 1.00 0.00 H new ATOM 0 HB3 TYR A 4 7.373 -15.572 -0.304 1.00 0.00 H new ATOM 0 HD1 TYR A 4 3.852 -16.574 -1.207 1.00 0.00 H new ATOM 0 HD2 TYR A 4 7.857 -15.976 -2.538 1.00 0.00 H new ATOM 0 HE1 TYR A 4 3.196 -17.235 -3.477 1.00 0.00 H new ATOM 0 HE2 TYR A 4 7.199 -16.640 -4.810 1.00 0.00 H new ATOM 0 HH TYR A 4 5.571 -17.306 -6.142 1.00 0.00 H new ATOM 79 N ARG A 5 7.375 -17.360 2.734 1.00 0.00 N ATOM 80 CA ARG A 5 8.005 -17.070 4.019 1.00 0.00 C ATOM 81 C ARG A 5 9.519 -17.246 3.951 1.00 0.00 C ATOM 82 O ARG A 5 10.027 -18.063 3.184 1.00 0.00 O ATOM 83 CB ARG A 5 7.428 -17.979 5.107 1.00 0.00 C ATOM 84 CG ARG A 5 7.375 -19.445 4.710 1.00 0.00 C ATOM 85 CD ARG A 5 7.238 -20.347 5.926 1.00 0.00 C ATOM 86 NE ARG A 5 6.824 -21.700 5.562 1.00 0.00 N ATOM 87 CZ ARG A 5 6.908 -22.748 6.379 1.00 0.00 C ATOM 88 NH1 ARG A 5 7.390 -22.603 7.607 1.00 0.00 N ATOM 89 NH2 ARG A 5 6.511 -23.944 5.967 1.00 0.00 N ATOM 0 H ARG A 5 7.539 -18.305 2.386 1.00 0.00 H new ATOM 0 HA ARG A 5 7.794 -16.029 4.264 1.00 0.00 H new ATOM 0 HB2 ARG A 5 8.029 -17.877 6.010 1.00 0.00 H new ATOM 0 HB3 ARG A 5 6.422 -17.642 5.355 1.00 0.00 H new ATOM 0 HG2 ARG A 5 6.534 -19.610 4.036 1.00 0.00 H new ATOM 0 HG3 ARG A 5 8.279 -19.707 4.161 1.00 0.00 H new ATOM 0 HD2 ARG A 5 8.190 -20.389 6.455 1.00 0.00 H new ATOM 0 HD3 ARG A 5 6.510 -19.918 6.615 1.00 0.00 H new ATOM 0 HE ARG A 5 6.448 -21.851 4.626 1.00 0.00 H new ATOM 0 HH11 ARG A 5 7.698 -21.685 7.929 1.00 0.00 H new ATOM 0 HH12 ARG A 5 7.452 -23.409 8.229 1.00 0.00 H new ATOM 0 HH21 ARG A 5 6.141 -24.062 5.024 1.00 0.00 H new ATOM 0 HH22 ARG A 5 6.576 -24.747 6.593 1.00 0.00 H new ATOM 103 N ASP A 6 10.231 -16.476 4.768 1.00 0.00 N ATOM 104 CA ASP A 6 11.688 -16.544 4.814 1.00 0.00 C ATOM 105 C ASP A 6 12.147 -17.927 5.263 1.00 0.00 C ATOM 106 O ASP A 6 11.434 -18.623 5.983 1.00 0.00 O ATOM 107 CB ASP A 6 12.237 -15.477 5.763 1.00 0.00 C ATOM 108 CG ASP A 6 13.753 -15.462 5.807 1.00 0.00 C ATOM 109 OD1 ASP A 6 14.379 -15.889 4.814 1.00 0.00 O ATOM 110 OD2 ASP A 6 14.312 -15.022 6.832 1.00 0.00 O ATOM 0 H ASP A 6 9.822 -15.796 5.409 1.00 0.00 H new ATOM 0 HA ASP A 6 12.072 -16.359 3.811 1.00 0.00 H new ATOM 0 HB2 ASP A 6 11.876 -14.497 5.450 1.00 0.00 H new ATOM 0 HB3 ASP A 6 11.850 -15.654 6.766 1.00 0.00 H new ATOM 115 N LEU A 7 13.336 -18.326 4.828 1.00 0.00 N ATOM 116 CA LEU A 7 13.879 -19.632 5.185 1.00 0.00 C ATOM 117 C LEU A 7 14.513 -19.611 6.575 1.00 0.00 C ATOM 118 O LEU A 7 14.655 -20.653 7.215 1.00 0.00 O ATOM 119 CB LEU A 7 14.913 -20.076 4.148 1.00 0.00 C ATOM 120 CG LEU A 7 15.526 -21.455 4.394 1.00 0.00 C ATOM 121 CD1 LEU A 7 14.464 -22.538 4.287 1.00 0.00 C ATOM 122 CD2 LEU A 7 16.658 -21.716 3.412 1.00 0.00 C ATOM 0 H LEU A 7 13.942 -17.766 4.229 1.00 0.00 H new ATOM 0 HA LEU A 7 13.053 -20.343 5.200 1.00 0.00 H new ATOM 0 HB2 LEU A 7 14.443 -20.075 3.165 1.00 0.00 H new ATOM 0 HB3 LEU A 7 15.715 -19.339 4.119 1.00 0.00 H new ATOM 0 HG LEU A 7 15.935 -21.476 5.404 1.00 0.00 H new ATOM 0 HD11 LEU A 7 14.919 -23.512 4.465 1.00 0.00 H new ATOM 0 HD12 LEU A 7 13.686 -22.359 5.029 1.00 0.00 H new ATOM 0 HD13 LEU A 7 14.025 -22.519 3.290 1.00 0.00 H new ATOM 0 HD21 LEU A 7 17.083 -22.702 3.601 1.00 0.00 H new ATOM 0 HD22 LEU A 7 16.272 -21.676 2.393 1.00 0.00 H new ATOM 0 HD23 LEU A 7 17.431 -20.957 3.537 1.00 0.00 H new ATOM 134 N ILE A 8 14.901 -18.424 7.034 1.00 0.00 N ATOM 135 CA ILE A 8 15.529 -18.281 8.345 1.00 0.00 C ATOM 136 C ILE A 8 14.502 -18.006 9.441 1.00 0.00 C ATOM 137 O ILE A 8 14.555 -18.606 10.514 1.00 0.00 O ATOM 138 CB ILE A 8 16.573 -17.149 8.344 1.00 0.00 C ATOM 139 CG1 ILE A 8 17.540 -17.317 7.171 1.00 0.00 C ATOM 140 CG2 ILE A 8 17.333 -17.124 9.662 1.00 0.00 C ATOM 141 CD1 ILE A 8 17.128 -16.545 5.937 1.00 0.00 C ATOM 0 H ILE A 8 14.792 -17.550 6.520 1.00 0.00 H new ATOM 0 HA ILE A 8 16.022 -19.230 8.555 1.00 0.00 H new ATOM 0 HB ILE A 8 16.052 -16.198 8.229 1.00 0.00 H new ATOM 0 HG12 ILE A 8 18.533 -16.991 7.479 1.00 0.00 H new ATOM 0 HG13 ILE A 8 17.615 -18.375 6.920 1.00 0.00 H new ATOM 0 HG21 ILE A 8 18.067 -16.318 9.644 1.00 0.00 H new ATOM 0 HG22 ILE A 8 16.634 -16.960 10.482 1.00 0.00 H new ATOM 0 HG23 ILE A 8 17.844 -18.076 9.806 1.00 0.00 H new ATOM 0 HD11 ILE A 8 17.858 -16.709 5.144 1.00 0.00 H new ATOM 0 HD12 ILE A 8 16.148 -16.887 5.604 1.00 0.00 H new ATOM 0 HD13 ILE A 8 17.081 -15.482 6.172 1.00 0.00 H new ATOM 153 N SER A 9 13.580 -17.087 9.173 1.00 0.00 N ATOM 154 CA SER A 9 12.557 -16.726 10.150 1.00 0.00 C ATOM 155 C SER A 9 11.281 -17.542 9.956 1.00 0.00 C ATOM 156 O SER A 9 10.473 -17.667 10.876 1.00 0.00 O ATOM 157 CB SER A 9 12.239 -15.233 10.059 1.00 0.00 C ATOM 158 OG SER A 9 11.613 -14.917 8.828 1.00 0.00 O ATOM 0 H SER A 9 13.519 -16.580 8.290 1.00 0.00 H new ATOM 0 HA SER A 9 12.954 -16.951 11.140 1.00 0.00 H new ATOM 0 HB2 SER A 9 11.588 -14.946 10.885 1.00 0.00 H new ATOM 0 HB3 SER A 9 13.158 -14.656 10.162 1.00 0.00 H new ATOM 0 HG SER A 9 11.419 -13.957 8.797 1.00 0.00 H new ATOM 164 N HIS A 10 11.098 -18.087 8.758 1.00 0.00 N ATOM 165 CA HIS A 10 9.913 -18.883 8.457 1.00 0.00 C ATOM 166 C HIS A 10 8.648 -18.040 8.582 1.00 0.00 C ATOM 167 O HIS A 10 7.578 -18.552 8.909 1.00 0.00 O ATOM 168 CB HIS A 10 9.830 -20.092 9.390 1.00 0.00 C ATOM 169 CG HIS A 10 10.692 -21.240 8.961 1.00 0.00 C ATOM 170 ND1 HIS A 10 11.527 -21.185 7.865 1.00 0.00 N ATOM 171 CD2 HIS A 10 10.845 -22.478 9.487 1.00 0.00 C ATOM 172 CE1 HIS A 10 12.157 -22.341 7.736 1.00 0.00 C ATOM 173 NE2 HIS A 10 11.761 -23.141 8.708 1.00 0.00 N ATOM 0 H HIS A 10 11.753 -17.993 7.982 1.00 0.00 H new ATOM 0 HA HIS A 10 9.995 -19.235 7.429 1.00 0.00 H new ATOM 0 HB2 HIS A 10 10.121 -19.786 10.395 1.00 0.00 H new ATOM 0 HB3 HIS A 10 8.794 -20.427 9.446 1.00 0.00 H new ATOM 0 HD1 HIS A 10 11.641 -20.379 7.250 1.00 0.00 H new ATOM 0 HD2 HIS A 10 10.341 -22.871 10.357 1.00 0.00 H new ATOM 0 HE1 HIS A 10 12.873 -22.588 6.966 1.00 0.00 H new ATOM 182 N ASP A 11 8.780 -16.742 8.319 1.00 0.00 N ATOM 183 CA ASP A 11 7.648 -15.826 8.401 1.00 0.00 C ATOM 184 C ASP A 11 7.175 -15.424 7.009 1.00 0.00 C ATOM 185 O ASP A 11 7.956 -14.927 6.197 1.00 0.00 O ATOM 186 CB ASP A 11 8.030 -14.581 9.203 1.00 0.00 C ATOM 187 CG ASP A 11 6.837 -13.690 9.493 1.00 0.00 C ATOM 188 OD1 ASP A 11 5.707 -14.217 9.565 1.00 0.00 O ATOM 189 OD2 ASP A 11 7.034 -12.466 9.647 1.00 0.00 O ATOM 0 H ASP A 11 9.659 -16.302 8.048 1.00 0.00 H new ATOM 0 HA ASP A 11 6.831 -16.339 8.909 1.00 0.00 H new ATOM 0 HB2 ASP A 11 8.490 -14.885 10.143 1.00 0.00 H new ATOM 0 HB3 ASP A 11 8.779 -14.013 8.651 1.00 0.00 H new ATOM 194 N GLU A 12 5.893 -15.644 6.738 1.00 0.00 N ATOM 195 CA GLU A 12 5.316 -15.306 5.442 1.00 0.00 C ATOM 196 C GLU A 12 5.483 -13.822 5.134 1.00 0.00 C ATOM 197 O GLU A 12 4.651 -13.001 5.517 1.00 0.00 O ATOM 198 CB GLU A 12 3.833 -15.680 5.402 1.00 0.00 C ATOM 199 CG GLU A 12 3.077 -15.323 6.670 1.00 0.00 C ATOM 200 CD GLU A 12 2.868 -16.517 7.580 1.00 0.00 C ATOM 201 OE1 GLU A 12 3.864 -17.011 8.151 1.00 0.00 O ATOM 202 OE2 GLU A 12 1.709 -16.959 7.723 1.00 0.00 O ATOM 0 H GLU A 12 5.234 -16.055 7.399 1.00 0.00 H new ATOM 0 HA GLU A 12 5.850 -15.877 4.683 1.00 0.00 H new ATOM 0 HB2 GLU A 12 3.364 -15.177 4.556 1.00 0.00 H new ATOM 0 HB3 GLU A 12 3.743 -16.752 5.226 1.00 0.00 H new ATOM 0 HG2 GLU A 12 3.625 -14.551 7.210 1.00 0.00 H new ATOM 0 HG3 GLU A 12 2.108 -14.900 6.404 1.00 0.00 H new ATOM 209 N MET A 13 6.561 -13.487 4.432 1.00 0.00 N ATOM 210 CA MET A 13 6.832 -12.104 4.065 1.00 0.00 C ATOM 211 C MET A 13 5.836 -11.615 3.015 1.00 0.00 C ATOM 212 O MET A 13 5.666 -10.411 2.821 1.00 0.00 O ATOM 213 CB MET A 13 8.262 -11.966 3.536 1.00 0.00 C ATOM 214 CG MET A 13 9.324 -12.381 4.542 1.00 0.00 C ATOM 215 SD MET A 13 10.947 -12.598 3.787 1.00 0.00 S ATOM 216 CE MET A 13 11.988 -11.746 4.968 1.00 0.00 C ATOM 0 H MET A 13 7.260 -14.155 4.107 1.00 0.00 H new ATOM 0 HA MET A 13 6.722 -11.488 4.957 1.00 0.00 H new ATOM 0 HB2 MET A 13 8.368 -12.573 2.637 1.00 0.00 H new ATOM 0 HB3 MET A 13 8.434 -10.930 3.244 1.00 0.00 H new ATOM 0 HG2 MET A 13 9.390 -11.627 5.327 1.00 0.00 H new ATOM 0 HG3 MET A 13 9.022 -13.313 5.020 1.00 0.00 H new ATOM 0 HE1 MET A 13 12.584 -10.993 4.451 1.00 0.00 H new ATOM 0 HE2 MET A 13 11.365 -11.262 5.720 1.00 0.00 H new ATOM 0 HE3 MET A 13 12.650 -12.463 5.453 1.00 0.00 H new ATOM 226 N PHE A 14 5.174 -12.556 2.343 1.00 0.00 N ATOM 227 CA PHE A 14 4.192 -12.217 1.320 1.00 0.00 C ATOM 228 C PHE A 14 3.539 -13.475 0.754 1.00 0.00 C ATOM 229 O PHE A 14 3.891 -14.592 1.131 1.00 0.00 O ATOM 230 CB PHE A 14 4.842 -11.412 0.194 1.00 0.00 C ATOM 231 CG PHE A 14 5.920 -12.155 -0.542 1.00 0.00 C ATOM 232 CD1 PHE A 14 7.146 -12.399 0.057 1.00 0.00 C ATOM 233 CD2 PHE A 14 5.708 -12.606 -1.835 1.00 0.00 C ATOM 234 CE1 PHE A 14 8.140 -13.079 -0.622 1.00 0.00 C ATOM 235 CE2 PHE A 14 6.699 -13.285 -2.517 1.00 0.00 C ATOM 236 CZ PHE A 14 7.916 -13.523 -1.911 1.00 0.00 C ATOM 0 H PHE A 14 5.301 -13.557 2.490 1.00 0.00 H new ATOM 0 HA PHE A 14 3.419 -11.606 1.787 1.00 0.00 H new ATOM 0 HB2 PHE A 14 4.072 -11.112 -0.516 1.00 0.00 H new ATOM 0 HB3 PHE A 14 5.264 -10.498 0.611 1.00 0.00 H new ATOM 0 HD1 PHE A 14 7.327 -12.054 1.064 1.00 0.00 H new ATOM 0 HD2 PHE A 14 4.758 -12.425 -2.315 1.00 0.00 H new ATOM 0 HE1 PHE A 14 9.091 -13.263 -0.145 1.00 0.00 H new ATOM 0 HE2 PHE A 14 6.521 -13.630 -3.525 1.00 0.00 H new ATOM 0 HZ PHE A 14 8.691 -14.055 -2.443 1.00 0.00 H new ATOM 246 N SER A 15 2.584 -13.283 -0.151 1.00 0.00 N ATOM 247 CA SER A 15 1.879 -14.402 -0.766 1.00 0.00 C ATOM 248 C SER A 15 1.718 -14.187 -2.268 1.00 0.00 C ATOM 249 O SER A 15 2.313 -13.275 -2.842 1.00 0.00 O ATOM 250 CB SER A 15 0.506 -14.585 -0.115 1.00 0.00 C ATOM 251 OG SER A 15 0.536 -14.215 1.253 1.00 0.00 O ATOM 0 H SER A 15 2.281 -12.364 -0.474 1.00 0.00 H new ATOM 0 HA SER A 15 2.472 -15.303 -0.609 1.00 0.00 H new ATOM 0 HB2 SER A 15 -0.233 -13.981 -0.642 1.00 0.00 H new ATOM 0 HB3 SER A 15 0.192 -15.625 -0.207 1.00 0.00 H new ATOM 0 HG SER A 15 -0.353 -14.340 1.645 1.00 0.00 H new ATOM 257 N ASP A 16 0.912 -15.037 -2.899 1.00 0.00 N ATOM 258 CA ASP A 16 0.672 -14.950 -4.329 1.00 0.00 C ATOM 259 C ASP A 16 -0.488 -14.007 -4.649 1.00 0.00 C ATOM 260 O ASP A 16 -0.997 -13.997 -5.770 1.00 0.00 O ATOM 261 CB ASP A 16 0.375 -16.339 -4.881 1.00 0.00 C ATOM 262 CG ASP A 16 -0.796 -17.003 -4.183 1.00 0.00 C ATOM 263 OD1 ASP A 16 -1.188 -16.527 -3.097 1.00 0.00 O ATOM 264 OD2 ASP A 16 -1.320 -18.000 -4.721 1.00 0.00 O ATOM 0 H ASP A 16 0.413 -15.797 -2.436 1.00 0.00 H new ATOM 0 HA ASP A 16 1.569 -14.547 -4.799 1.00 0.00 H new ATOM 0 HB2 ASP A 16 0.163 -16.265 -5.948 1.00 0.00 H new ATOM 0 HB3 ASP A 16 1.260 -16.966 -4.774 1.00 0.00 H new ATOM 269 N ILE A 17 -0.900 -13.212 -3.666 1.00 0.00 N ATOM 270 CA ILE A 17 -1.994 -12.268 -3.857 1.00 0.00 C ATOM 271 C ILE A 17 -1.520 -11.018 -4.596 1.00 0.00 C ATOM 272 O ILE A 17 -2.318 -10.143 -4.931 1.00 0.00 O ATOM 273 CB ILE A 17 -2.618 -11.850 -2.512 1.00 0.00 C ATOM 274 CG1 ILE A 17 -1.560 -11.214 -1.608 1.00 0.00 C ATOM 275 CG2 ILE A 17 -3.255 -13.050 -1.828 1.00 0.00 C ATOM 276 CD1 ILE A 17 -2.132 -10.602 -0.348 1.00 0.00 C ATOM 0 H ILE A 17 -0.493 -13.203 -2.731 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.749 -12.777 -4.456 1.00 0.00 H new ATOM 0 HB ILE A 17 -3.395 -11.111 -2.704 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -0.825 -11.971 -1.334 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -1.030 -10.444 -2.168 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -3.692 -12.739 -0.879 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -4.035 -13.462 -2.468 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -2.496 -13.810 -1.646 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -1.326 -10.170 0.245 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -2.845 -9.822 -0.614 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -2.637 -11.373 0.234 1.00 0.00 H new ATOM 288 N TYR A 18 -0.215 -10.941 -4.846 1.00 0.00 N ATOM 289 CA TYR A 18 0.367 -9.801 -5.542 1.00 0.00 C ATOM 290 C TYR A 18 1.046 -10.246 -6.833 1.00 0.00 C ATOM 291 O TYR A 18 1.042 -11.429 -7.172 1.00 0.00 O ATOM 292 CB TYR A 18 1.375 -9.099 -4.636 1.00 0.00 C ATOM 293 CG TYR A 18 0.742 -8.438 -3.434 1.00 0.00 C ATOM 294 CD1 TYR A 18 -0.116 -7.356 -3.585 1.00 0.00 C ATOM 295 CD2 TYR A 18 1.000 -8.899 -2.150 1.00 0.00 C ATOM 296 CE1 TYR A 18 -0.700 -6.753 -2.488 1.00 0.00 C ATOM 297 CE2 TYR A 18 0.421 -8.301 -1.049 1.00 0.00 C ATOM 298 CZ TYR A 18 -0.429 -7.228 -1.223 1.00 0.00 C ATOM 299 OH TYR A 18 -1.010 -6.630 -0.129 1.00 0.00 O ATOM 0 H TYR A 18 0.459 -11.657 -4.575 1.00 0.00 H new ATOM 0 HA TYR A 18 -0.433 -9.105 -5.796 1.00 0.00 H new ATOM 0 HB2 TYR A 18 2.114 -9.825 -4.295 1.00 0.00 H new ATOM 0 HB3 TYR A 18 1.911 -8.347 -5.215 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -0.330 -6.981 -4.575 1.00 0.00 H new ATOM 0 HD2 TYR A 18 1.664 -9.739 -2.011 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -1.366 -5.913 -2.621 1.00 0.00 H new ATOM 0 HE2 TYR A 18 0.632 -8.671 -0.057 1.00 0.00 H new ATOM 0 HH TYR A 18 -1.881 -6.260 -0.383 1.00 0.00 H new ATOM 309 N LYS A 19 1.632 -9.292 -7.547 1.00 0.00 N ATOM 310 CA LYS A 19 2.319 -9.590 -8.797 1.00 0.00 C ATOM 311 C LYS A 19 3.795 -9.876 -8.547 1.00 0.00 C ATOM 312 O LYS A 19 4.629 -8.971 -8.591 1.00 0.00 O ATOM 313 CB LYS A 19 2.169 -8.424 -9.778 1.00 0.00 C ATOM 314 CG LYS A 19 0.777 -8.307 -10.375 1.00 0.00 C ATOM 315 CD LYS A 19 0.347 -9.601 -11.047 1.00 0.00 C ATOM 316 CE LYS A 19 -0.929 -9.413 -11.852 1.00 0.00 C ATOM 317 NZ LYS A 19 -2.093 -9.086 -10.983 1.00 0.00 N ATOM 0 H LYS A 19 1.645 -8.307 -7.282 1.00 0.00 H new ATOM 0 HA LYS A 19 1.863 -10.479 -9.232 1.00 0.00 H new ATOM 0 HB2 LYS A 19 2.414 -7.494 -9.265 1.00 0.00 H new ATOM 0 HB3 LYS A 19 2.892 -8.543 -10.585 1.00 0.00 H new ATOM 0 HG2 LYS A 19 0.065 -8.049 -9.591 1.00 0.00 H new ATOM 0 HG3 LYS A 19 0.759 -7.495 -11.102 1.00 0.00 H new ATOM 0 HD2 LYS A 19 1.143 -9.954 -11.702 1.00 0.00 H new ATOM 0 HD3 LYS A 19 0.192 -10.371 -10.291 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -0.784 -8.615 -12.580 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -1.140 -10.323 -12.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -2.949 -8.999 -11.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -2.227 -9.843 -10.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -1.917 -8.187 -10.491 1.00 0.00 H new ATOM 331 N ILE A 20 4.111 -11.139 -8.285 1.00 0.00 N ATOM 332 CA ILE A 20 5.486 -11.545 -8.027 1.00 0.00 C ATOM 333 C ILE A 20 6.206 -11.887 -9.327 1.00 0.00 C ATOM 334 O ILE A 20 5.755 -12.737 -10.095 1.00 0.00 O ATOM 335 CB ILE A 20 5.538 -12.763 -7.082 1.00 0.00 C ATOM 336 CG1 ILE A 20 4.792 -12.459 -5.781 1.00 0.00 C ATOM 337 CG2 ILE A 20 6.981 -13.160 -6.793 1.00 0.00 C ATOM 338 CD1 ILE A 20 3.397 -13.041 -5.736 1.00 0.00 C ATOM 0 H ILE A 20 3.432 -11.900 -8.246 1.00 0.00 H new ATOM 0 HA ILE A 20 5.988 -10.703 -7.550 1.00 0.00 H new ATOM 0 HB ILE A 20 5.047 -13.602 -7.575 1.00 0.00 H new ATOM 0 HG12 ILE A 20 5.367 -12.850 -4.942 1.00 0.00 H new ATOM 0 HG13 ILE A 20 4.731 -11.379 -5.650 1.00 0.00 H new ATOM 0 HG21 ILE A 20 6.995 -14.021 -6.125 1.00 0.00 H new ATOM 0 HG22 ILE A 20 7.482 -13.417 -7.726 1.00 0.00 H new ATOM 0 HG23 ILE A 20 7.500 -12.326 -6.321 1.00 0.00 H new ATOM 0 HD11 ILE A 20 2.927 -12.787 -4.786 1.00 0.00 H new ATOM 0 HD12 ILE A 20 2.805 -12.631 -6.555 1.00 0.00 H new ATOM 0 HD13 ILE A 20 3.452 -14.125 -5.835 1.00 0.00 H new ATOM 350 N ARG A 21 7.329 -11.219 -9.567 1.00 0.00 N ATOM 351 CA ARG A 21 8.113 -11.451 -10.775 1.00 0.00 C ATOM 352 C ARG A 21 9.478 -12.041 -10.434 1.00 0.00 C ATOM 353 O ARG A 21 10.147 -11.590 -9.504 1.00 0.00 O ATOM 354 CB ARG A 21 8.290 -10.146 -11.552 1.00 0.00 C ATOM 355 CG ARG A 21 6.976 -9.453 -11.881 1.00 0.00 C ATOM 356 CD ARG A 21 6.955 -8.947 -13.315 1.00 0.00 C ATOM 357 NE ARG A 21 5.651 -8.401 -13.684 1.00 0.00 N ATOM 358 CZ ARG A 21 5.444 -7.633 -14.752 1.00 0.00 C ATOM 359 NH1 ARG A 21 6.452 -7.319 -15.556 1.00 0.00 N ATOM 360 NH2 ARG A 21 4.227 -7.179 -15.015 1.00 0.00 N ATOM 0 H ARG A 21 7.717 -10.513 -8.941 1.00 0.00 H new ATOM 0 HA ARG A 21 7.573 -12.166 -11.396 1.00 0.00 H new ATOM 0 HB2 ARG A 21 8.914 -9.468 -10.970 1.00 0.00 H new ATOM 0 HB3 ARG A 21 8.824 -10.354 -12.479 1.00 0.00 H new ATOM 0 HG2 ARG A 21 6.149 -10.147 -11.727 1.00 0.00 H new ATOM 0 HG3 ARG A 21 6.823 -8.618 -11.197 1.00 0.00 H new ATOM 0 HD2 ARG A 21 7.718 -8.179 -13.439 1.00 0.00 H new ATOM 0 HD3 ARG A 21 7.211 -9.763 -13.991 1.00 0.00 H new ATOM 0 HE ARG A 21 4.852 -8.621 -13.089 1.00 0.00 H new ATOM 0 HH11 ARG A 21 7.390 -7.666 -15.357 1.00 0.00 H new ATOM 0 HH12 ARG A 21 6.289 -6.730 -16.373 1.00 0.00 H new ATOM 0 HH21 ARG A 21 3.450 -7.418 -14.399 1.00 0.00 H new ATOM 0 HH22 ARG A 21 4.068 -6.591 -15.833 1.00 0.00 H new ATOM 374 N GLU A 22 9.885 -13.052 -11.195 1.00 0.00 N ATOM 375 CA GLU A 22 11.171 -13.704 -10.976 1.00 0.00 C ATOM 376 C GLU A 22 12.301 -12.906 -11.618 1.00 0.00 C ATOM 377 O GLU A 22 12.362 -12.770 -12.839 1.00 0.00 O ATOM 378 CB GLU A 22 11.150 -15.124 -11.543 1.00 0.00 C ATOM 379 CG GLU A 22 10.321 -16.097 -10.719 1.00 0.00 C ATOM 380 CD GLU A 22 9.018 -16.472 -11.397 1.00 0.00 C ATOM 381 OE1 GLU A 22 9.041 -16.747 -12.616 1.00 0.00 O ATOM 382 OE2 GLU A 22 7.976 -16.491 -10.710 1.00 0.00 O ATOM 0 H GLU A 22 9.343 -13.437 -11.968 1.00 0.00 H new ATOM 0 HA GLU A 22 11.347 -13.752 -9.901 1.00 0.00 H new ATOM 0 HB2 GLU A 22 10.757 -15.095 -12.559 1.00 0.00 H new ATOM 0 HB3 GLU A 22 12.173 -15.495 -11.608 1.00 0.00 H new ATOM 0 HG2 GLU A 22 10.904 -17.000 -10.535 1.00 0.00 H new ATOM 0 HG3 GLU A 22 10.106 -15.653 -9.747 1.00 0.00 H new ATOM 389 N ILE A 23 13.193 -12.380 -10.785 1.00 0.00 N ATOM 390 CA ILE A 23 14.321 -11.596 -11.272 1.00 0.00 C ATOM 391 C ILE A 23 15.634 -12.342 -11.080 1.00 0.00 C ATOM 392 O ILE A 23 15.713 -13.292 -10.300 1.00 0.00 O ATOM 393 CB ILE A 23 14.411 -10.235 -10.556 1.00 0.00 C ATOM 394 CG1 ILE A 23 14.288 -10.422 -9.042 1.00 0.00 C ATOM 395 CG2 ILE A 23 13.334 -9.294 -11.069 1.00 0.00 C ATOM 396 CD1 ILE A 23 15.071 -9.404 -8.242 1.00 0.00 C ATOM 0 H ILE A 23 13.156 -12.483 -9.771 1.00 0.00 H new ATOM 0 HA ILE A 23 14.152 -11.430 -12.336 1.00 0.00 H new ATOM 0 HB ILE A 23 15.383 -9.792 -10.770 1.00 0.00 H new ATOM 0 HG12 ILE A 23 13.237 -10.362 -8.761 1.00 0.00 H new ATOM 0 HG13 ILE A 23 14.632 -11.422 -8.778 1.00 0.00 H new ATOM 0 HG21 ILE A 23 13.411 -8.337 -10.553 1.00 0.00 H new ATOM 0 HG22 ILE A 23 13.465 -9.140 -12.140 1.00 0.00 H new ATOM 0 HG23 ILE A 23 12.352 -9.729 -10.882 1.00 0.00 H new ATOM 0 HD11 ILE A 23 14.938 -9.597 -7.178 1.00 0.00 H new ATOM 0 HD12 ILE A 23 16.129 -9.478 -8.495 1.00 0.00 H new ATOM 0 HD13 ILE A 23 14.711 -8.402 -8.477 1.00 0.00 H new ATOM 408 N ALA A 24 16.666 -11.904 -11.792 1.00 0.00 N ATOM 409 CA ALA A 24 17.979 -12.528 -11.698 1.00 0.00 C ATOM 410 C ALA A 24 17.922 -13.999 -12.098 1.00 0.00 C ATOM 411 O ALA A 24 18.704 -14.815 -11.611 1.00 0.00 O ATOM 412 CB ALA A 24 18.528 -12.380 -10.288 1.00 0.00 C ATOM 0 H ALA A 24 16.618 -11.119 -12.441 1.00 0.00 H new ATOM 0 HA ALA A 24 18.648 -12.020 -12.393 1.00 0.00 H new ATOM 0 HB1 ALA A 24 19.510 -12.850 -10.229 1.00 0.00 H new ATOM 0 HB2 ALA A 24 18.617 -11.322 -10.041 1.00 0.00 H new ATOM 0 HB3 ALA A 24 17.852 -12.862 -9.582 1.00 0.00 H new ATOM 418 N ASP A 25 16.994 -14.328 -12.992 1.00 0.00 N ATOM 419 CA ASP A 25 16.833 -15.699 -13.468 1.00 0.00 C ATOM 420 C ASP A 25 16.402 -16.635 -12.339 1.00 0.00 C ATOM 421 O ASP A 25 16.999 -17.692 -12.133 1.00 0.00 O ATOM 422 CB ASP A 25 18.135 -16.201 -14.097 1.00 0.00 C ATOM 423 CG ASP A 25 18.462 -15.488 -15.395 1.00 0.00 C ATOM 424 OD1 ASP A 25 18.053 -14.317 -15.548 1.00 0.00 O ATOM 425 OD2 ASP A 25 19.127 -16.100 -16.257 1.00 0.00 O ATOM 0 H ASP A 25 16.340 -13.662 -13.403 1.00 0.00 H new ATOM 0 HA ASP A 25 16.048 -15.697 -14.224 1.00 0.00 H new ATOM 0 HB2 ASP A 25 18.954 -16.060 -13.392 1.00 0.00 H new ATOM 0 HB3 ASP A 25 18.056 -17.272 -14.284 1.00 0.00 H new ATOM 430 N GLY A 26 15.355 -16.244 -11.618 1.00 0.00 N ATOM 431 CA GLY A 26 14.854 -17.066 -10.531 1.00 0.00 C ATOM 432 C GLY A 26 15.635 -16.900 -9.238 1.00 0.00 C ATOM 433 O GLY A 26 15.272 -17.479 -8.214 1.00 0.00 O ATOM 0 H GLY A 26 14.845 -15.373 -11.767 1.00 0.00 H new ATOM 0 HA2 GLY A 26 13.808 -16.817 -10.350 1.00 0.00 H new ATOM 0 HA3 GLY A 26 14.885 -18.113 -10.833 1.00 0.00 H new ATOM 437 N LEU A 27 16.707 -16.114 -9.276 1.00 0.00 N ATOM 438 CA LEU A 27 17.525 -15.891 -8.090 1.00 0.00 C ATOM 439 C LEU A 27 16.749 -15.117 -7.028 1.00 0.00 C ATOM 440 O LEU A 27 16.994 -15.273 -5.832 1.00 0.00 O ATOM 441 CB LEU A 27 18.799 -15.131 -8.460 1.00 0.00 C ATOM 442 CG LEU A 27 20.037 -15.503 -7.644 1.00 0.00 C ATOM 443 CD1 LEU A 27 19.838 -15.147 -6.179 1.00 0.00 C ATOM 444 CD2 LEU A 27 20.353 -16.982 -7.799 1.00 0.00 C ATOM 0 H LEU A 27 17.028 -15.624 -10.111 1.00 0.00 H new ATOM 0 HA LEU A 27 17.795 -16.864 -7.679 1.00 0.00 H new ATOM 0 HB2 LEU A 27 19.013 -15.304 -9.515 1.00 0.00 H new ATOM 0 HB3 LEU A 27 18.613 -14.063 -8.343 1.00 0.00 H new ATOM 0 HG LEU A 27 20.884 -14.931 -8.023 1.00 0.00 H new ATOM 0 HD11 LEU A 27 20.730 -15.419 -5.614 1.00 0.00 H new ATOM 0 HD12 LEU A 27 19.662 -14.075 -6.086 1.00 0.00 H new ATOM 0 HD13 LEU A 27 18.979 -15.691 -5.786 1.00 0.00 H new ATOM 0 HD21 LEU A 27 21.237 -17.229 -7.211 1.00 0.00 H new ATOM 0 HD22 LEU A 27 19.507 -17.573 -7.448 1.00 0.00 H new ATOM 0 HD23 LEU A 27 20.541 -17.206 -8.849 1.00 0.00 H new ATOM 456 N CYS A 28 15.814 -14.283 -7.473 1.00 0.00 N ATOM 457 CA CYS A 28 15.006 -13.485 -6.557 1.00 0.00 C ATOM 458 C CYS A 28 13.603 -13.264 -7.112 1.00 0.00 C ATOM 459 O CYS A 28 13.318 -13.597 -8.262 1.00 0.00 O ATOM 460 CB CYS A 28 15.680 -12.140 -6.291 1.00 0.00 C ATOM 461 SG CYS A 28 17.240 -12.263 -5.386 1.00 0.00 S ATOM 0 H CYS A 28 15.597 -14.142 -8.460 1.00 0.00 H new ATOM 0 HA CYS A 28 14.920 -14.034 -5.619 1.00 0.00 H new ATOM 0 HB2 CYS A 28 15.863 -11.643 -7.244 1.00 0.00 H new ATOM 0 HB3 CYS A 28 14.994 -11.507 -5.728 1.00 0.00 H new ATOM 0 HG CYS A 28 17.140 -11.621 -4.260 1.00 0.00 H new ATOM 467 N LEU A 29 12.729 -12.700 -6.284 1.00 0.00 N ATOM 468 CA LEU A 29 11.352 -12.432 -6.685 1.00 0.00 C ATOM 469 C LEU A 29 10.925 -11.030 -6.260 1.00 0.00 C ATOM 470 O LEU A 29 11.094 -10.645 -5.103 1.00 0.00 O ATOM 471 CB LEU A 29 10.409 -13.469 -6.069 1.00 0.00 C ATOM 472 CG LEU A 29 10.873 -14.924 -6.189 1.00 0.00 C ATOM 473 CD1 LEU A 29 10.736 -15.642 -4.855 1.00 0.00 C ATOM 474 CD2 LEU A 29 10.083 -15.648 -7.269 1.00 0.00 C ATOM 0 H LEU A 29 12.951 -12.419 -5.329 1.00 0.00 H new ATOM 0 HA LEU A 29 11.297 -12.498 -7.772 1.00 0.00 H new ATOM 0 HB2 LEU A 29 10.275 -13.233 -5.013 1.00 0.00 H new ATOM 0 HB3 LEU A 29 9.432 -13.375 -6.543 1.00 0.00 H new ATOM 0 HG LEU A 29 11.926 -14.926 -6.472 1.00 0.00 H new ATOM 0 HD11 LEU A 29 11.071 -16.674 -4.961 1.00 0.00 H new ATOM 0 HD12 LEU A 29 11.347 -15.138 -4.106 1.00 0.00 H new ATOM 0 HD13 LEU A 29 9.692 -15.630 -4.541 1.00 0.00 H new ATOM 0 HD21 LEU A 29 10.426 -16.680 -7.340 1.00 0.00 H new ATOM 0 HD22 LEU A 29 9.023 -15.634 -7.015 1.00 0.00 H new ATOM 0 HD23 LEU A 29 10.233 -15.149 -8.226 1.00 0.00 H new ATOM 486 N GLU A 30 10.373 -10.271 -7.201 1.00 0.00 N ATOM 487 CA GLU A 30 9.924 -8.912 -6.919 1.00 0.00 C ATOM 488 C GLU A 30 8.425 -8.874 -6.640 1.00 0.00 C ATOM 489 O GLU A 30 7.614 -9.177 -7.515 1.00 0.00 O ATOM 490 CB GLU A 30 10.254 -7.987 -8.093 1.00 0.00 C ATOM 491 CG GLU A 30 11.739 -7.888 -8.389 1.00 0.00 C ATOM 492 CD GLU A 30 12.092 -6.671 -9.223 1.00 0.00 C ATOM 493 OE1 GLU A 30 11.172 -6.076 -9.822 1.00 0.00 O ATOM 494 OE2 GLU A 30 13.288 -6.317 -9.278 1.00 0.00 O ATOM 0 H GLU A 30 10.226 -10.573 -8.164 1.00 0.00 H new ATOM 0 HA GLU A 30 10.450 -8.566 -6.029 1.00 0.00 H new ATOM 0 HB2 GLU A 30 9.738 -8.345 -8.983 1.00 0.00 H new ATOM 0 HB3 GLU A 30 9.867 -6.991 -7.880 1.00 0.00 H new ATOM 0 HG2 GLU A 30 12.290 -7.851 -7.450 1.00 0.00 H new ATOM 0 HG3 GLU A 30 12.061 -8.788 -8.913 1.00 0.00 H new ATOM 501 N VAL A 31 8.062 -8.489 -5.421 1.00 0.00 N ATOM 502 CA VAL A 31 6.658 -8.403 -5.036 1.00 0.00 C ATOM 503 C VAL A 31 6.118 -6.998 -5.278 1.00 0.00 C ATOM 504 O VAL A 31 6.516 -6.047 -4.607 1.00 0.00 O ATOM 505 CB VAL A 31 6.450 -8.774 -3.556 1.00 0.00 C ATOM 506 CG1 VAL A 31 4.966 -8.861 -3.230 1.00 0.00 C ATOM 507 CG2 VAL A 31 7.154 -10.082 -3.230 1.00 0.00 C ATOM 0 H VAL A 31 8.719 -8.232 -4.684 1.00 0.00 H new ATOM 0 HA VAL A 31 6.114 -9.117 -5.654 1.00 0.00 H new ATOM 0 HB VAL A 31 6.887 -7.990 -2.938 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.839 -9.124 -2.180 1.00 0.00 H new ATOM 0 HG12 VAL A 31 4.494 -7.897 -3.422 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.500 -9.624 -3.854 1.00 0.00 H new ATOM 0 HG21 VAL A 31 6.996 -10.328 -2.180 1.00 0.00 H new ATOM 0 HG22 VAL A 31 6.749 -10.878 -3.854 1.00 0.00 H new ATOM 0 HG23 VAL A 31 8.222 -9.978 -3.422 1.00 0.00 H new ATOM 517 N GLU A 32 5.213 -6.877 -6.242 1.00 0.00 N ATOM 518 CA GLU A 32 4.622 -5.587 -6.577 1.00 0.00 C ATOM 519 C GLU A 32 3.464 -5.252 -5.642 1.00 0.00 C ATOM 520 O GLU A 32 2.450 -5.949 -5.618 1.00 0.00 O ATOM 521 CB GLU A 32 4.138 -5.588 -8.028 1.00 0.00 C ATOM 522 CG GLU A 32 5.176 -5.077 -9.015 1.00 0.00 C ATOM 523 CD GLU A 32 4.938 -5.581 -10.424 1.00 0.00 C ATOM 524 OE1 GLU A 32 4.644 -6.785 -10.581 1.00 0.00 O ATOM 525 OE2 GLU A 32 5.046 -4.773 -11.370 1.00 0.00 O ATOM 0 H GLU A 32 4.872 -7.656 -6.805 1.00 0.00 H new ATOM 0 HA GLU A 32 5.390 -4.823 -6.455 1.00 0.00 H new ATOM 0 HB2 GLU A 32 3.852 -6.602 -8.306 1.00 0.00 H new ATOM 0 HB3 GLU A 32 3.242 -4.972 -8.104 1.00 0.00 H new ATOM 0 HG2 GLU A 32 5.165 -3.987 -9.016 1.00 0.00 H new ATOM 0 HG3 GLU A 32 6.168 -5.385 -8.685 1.00 0.00 H new ATOM 532 N GLY A 33 3.624 -4.177 -4.880 1.00 0.00 N ATOM 533 CA GLY A 33 2.585 -3.760 -3.956 1.00 0.00 C ATOM 534 C GLY A 33 1.748 -2.622 -4.510 1.00 0.00 C ATOM 535 O GLY A 33 1.491 -2.562 -5.712 1.00 0.00 O ATOM 0 H GLY A 33 4.455 -3.586 -4.885 1.00 0.00 H new ATOM 0 HA2 GLY A 33 1.939 -4.609 -3.732 1.00 0.00 H new ATOM 0 HA3 GLY A 33 3.041 -3.449 -3.016 1.00 0.00 H new ATOM 539 N LYS A 34 1.325 -1.717 -3.633 1.00 0.00 N ATOM 540 CA LYS A 34 0.516 -0.576 -4.046 1.00 0.00 C ATOM 541 C LYS A 34 0.278 0.377 -2.879 1.00 0.00 C ATOM 542 O LYS A 34 -0.198 -0.030 -1.819 1.00 0.00 O ATOM 543 CB LYS A 34 -0.823 -1.052 -4.614 1.00 0.00 C ATOM 544 CG LYS A 34 -1.648 -1.866 -3.631 1.00 0.00 C ATOM 545 CD LYS A 34 -2.988 -2.265 -4.227 1.00 0.00 C ATOM 546 CE LYS A 34 -4.105 -2.168 -3.200 1.00 0.00 C ATOM 547 NZ LYS A 34 -4.402 -3.489 -2.576 1.00 0.00 N ATOM 0 H LYS A 34 1.529 -1.751 -2.634 1.00 0.00 H new ATOM 0 HA LYS A 34 1.062 -0.039 -4.822 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -1.402 -0.185 -4.930 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -0.637 -1.653 -5.504 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -1.095 -2.760 -3.343 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -1.811 -1.286 -2.723 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -3.216 -1.621 -5.076 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -2.929 -3.285 -4.607 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -3.825 -1.455 -2.425 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -5.005 -1.782 -3.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -5.423 -3.677 -2.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -3.885 -4.236 -3.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -4.105 -3.477 -1.579 1.00 0.00 H new ATOM 561 N MET A 35 0.613 1.646 -3.081 1.00 0.00 N ATOM 562 CA MET A 35 0.432 2.657 -2.045 1.00 0.00 C ATOM 563 C MET A 35 -1.049 2.945 -1.823 1.00 0.00 C ATOM 564 O MET A 35 -1.760 3.332 -2.751 1.00 0.00 O ATOM 565 CB MET A 35 1.165 3.945 -2.426 1.00 0.00 C ATOM 566 CG MET A 35 2.679 3.808 -2.423 1.00 0.00 C ATOM 567 SD MET A 35 3.510 5.269 -3.072 1.00 0.00 S ATOM 568 CE MET A 35 4.747 4.518 -4.127 1.00 0.00 C ATOM 0 H MET A 35 1.011 1.999 -3.951 1.00 0.00 H new ATOM 0 HA MET A 35 0.852 2.272 -1.116 1.00 0.00 H new ATOM 0 HB2 MET A 35 0.839 4.259 -3.418 1.00 0.00 H new ATOM 0 HB3 MET A 35 0.879 4.735 -1.732 1.00 0.00 H new ATOM 0 HG2 MET A 35 3.021 3.623 -1.405 1.00 0.00 H new ATOM 0 HG3 MET A 35 2.962 2.940 -3.018 1.00 0.00 H new ATOM 0 HE1 MET A 35 5.633 5.152 -4.157 1.00 0.00 H new ATOM 0 HE2 MET A 35 5.016 3.538 -3.732 1.00 0.00 H new ATOM 0 HE3 MET A 35 4.346 4.406 -5.134 1.00 0.00 H new ATOM 578 N VAL A 36 -1.509 2.752 -0.591 1.00 0.00 N ATOM 579 CA VAL A 36 -2.908 2.988 -0.254 1.00 0.00 C ATOM 580 C VAL A 36 -3.039 3.927 0.940 1.00 0.00 C ATOM 581 O VAL A 36 -2.224 3.894 1.861 1.00 0.00 O ATOM 582 CB VAL A 36 -3.642 1.671 0.062 1.00 0.00 C ATOM 583 CG1 VAL A 36 -3.845 0.854 -1.205 1.00 0.00 C ATOM 584 CG2 VAL A 36 -2.874 0.871 1.103 1.00 0.00 C ATOM 0 H VAL A 36 -0.934 2.433 0.189 1.00 0.00 H new ATOM 0 HA VAL A 36 -3.366 3.451 -1.128 1.00 0.00 H new ATOM 0 HB VAL A 36 -4.623 1.912 0.471 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -4.365 -0.072 -0.961 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -4.439 1.427 -1.916 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -2.876 0.621 -1.647 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -3.406 -0.056 1.315 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -1.879 0.640 0.723 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -2.786 1.456 2.019 1.00 0.00 H new ATOM 1013 N GLY A 69 0.826 4.259 2.731 1.00 0.00 N ATOM 1014 CA GLY A 69 2.072 3.543 2.527 1.00 0.00 C ATOM 1015 C GLY A 69 1.892 2.305 1.672 1.00 0.00 C ATOM 1016 O GLY A 69 0.827 2.094 1.092 1.00 0.00 O ATOM 0 HA2 GLY A 69 2.796 4.206 2.054 1.00 0.00 H new ATOM 0 HA3 GLY A 69 2.486 3.257 3.494 1.00 0.00 H new ATOM 1020 N VAL A 70 2.932 1.482 1.595 1.00 0.00 N ATOM 1021 CA VAL A 70 2.879 0.262 0.806 1.00 0.00 C ATOM 1022 C VAL A 70 1.928 -0.752 1.440 1.00 0.00 C ATOM 1023 O VAL A 70 2.069 -1.105 2.610 1.00 0.00 O ATOM 1024 CB VAL A 70 4.282 -0.358 0.661 1.00 0.00 C ATOM 1025 CG1 VAL A 70 4.240 -1.595 -0.223 1.00 0.00 C ATOM 1026 CG2 VAL A 70 5.257 0.667 0.104 1.00 0.00 C ATOM 0 H VAL A 70 3.821 1.640 2.070 1.00 0.00 H new ATOM 0 HA VAL A 70 2.507 0.522 -0.185 1.00 0.00 H new ATOM 0 HB VAL A 70 4.626 -0.663 1.649 1.00 0.00 H new ATOM 0 HG11 VAL A 70 5.242 -2.014 -0.310 1.00 0.00 H new ATOM 0 HG12 VAL A 70 3.574 -2.336 0.219 1.00 0.00 H new ATOM 0 HG13 VAL A 70 3.874 -1.323 -1.213 1.00 0.00 H new ATOM 0 HG21 VAL A 70 6.244 0.215 0.007 1.00 0.00 H new ATOM 0 HG22 VAL A 70 4.913 1.002 -0.875 1.00 0.00 H new ATOM 0 HG23 VAL A 70 5.314 1.520 0.780 1.00 0.00 H new ATOM 1036 N ASP A 71 0.949 -1.201 0.659 1.00 0.00 N ATOM 1037 CA ASP A 71 -0.044 -2.160 1.136 1.00 0.00 C ATOM 1038 C ASP A 71 0.609 -3.411 1.719 1.00 0.00 C ATOM 1039 O ASP A 71 0.367 -3.766 2.873 1.00 0.00 O ATOM 1040 CB ASP A 71 -0.989 -2.553 -0.001 1.00 0.00 C ATOM 1041 CG ASP A 71 -2.376 -2.906 0.497 1.00 0.00 C ATOM 1042 OD1 ASP A 71 -2.481 -3.518 1.581 1.00 0.00 O ATOM 1043 OD2 ASP A 71 -3.359 -2.573 -0.198 1.00 0.00 O ATOM 0 H ASP A 71 0.822 -0.914 -0.312 1.00 0.00 H new ATOM 0 HA ASP A 71 -0.610 -1.675 1.931 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -1.060 -1.730 -0.712 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.572 -3.404 -0.539 1.00 0.00 H new ATOM 1048 N ILE A 72 1.425 -4.084 0.914 1.00 0.00 N ATOM 1049 CA ILE A 72 2.098 -5.305 1.352 1.00 0.00 C ATOM 1050 C ILE A 72 2.872 -5.079 2.649 1.00 0.00 C ATOM 1051 O ILE A 72 2.967 -5.970 3.489 1.00 0.00 O ATOM 1052 CB ILE A 72 3.052 -5.848 0.264 1.00 0.00 C ATOM 1053 CG1 ILE A 72 4.338 -5.017 0.207 1.00 0.00 C ATOM 1054 CG2 ILE A 72 2.355 -5.857 -1.091 1.00 0.00 C ATOM 1055 CD1 ILE A 72 5.243 -5.370 -0.955 1.00 0.00 C ATOM 0 H ILE A 72 1.637 -3.806 -0.044 1.00 0.00 H new ATOM 0 HA ILE A 72 1.320 -6.046 1.533 1.00 0.00 H new ATOM 0 HB ILE A 72 3.323 -6.872 0.521 1.00 0.00 H new ATOM 0 HG12 ILE A 72 4.075 -3.961 0.143 1.00 0.00 H new ATOM 0 HG13 ILE A 72 4.888 -5.152 1.138 1.00 0.00 H new ATOM 0 HG21 ILE A 72 3.038 -6.242 -1.849 1.00 0.00 H new ATOM 0 HG22 ILE A 72 1.472 -6.494 -1.042 1.00 0.00 H new ATOM 0 HG23 ILE A 72 2.056 -4.842 -1.353 1.00 0.00 H new ATOM 0 HD11 ILE A 72 6.132 -4.740 -0.928 1.00 0.00 H new ATOM 0 HD12 ILE A 72 5.538 -6.417 -0.882 1.00 0.00 H new ATOM 0 HD13 ILE A 72 4.711 -5.207 -1.893 1.00 0.00 H new ATOM 1067 N VAL A 73 3.417 -3.880 2.803 1.00 0.00 N ATOM 1068 CA VAL A 73 4.179 -3.533 3.996 1.00 0.00 C ATOM 1069 C VAL A 73 3.256 -3.326 5.196 1.00 0.00 C ATOM 1070 O VAL A 73 3.647 -3.560 6.340 1.00 0.00 O ATOM 1071 CB VAL A 73 5.017 -2.256 3.769 1.00 0.00 C ATOM 1072 CG1 VAL A 73 5.750 -1.845 5.041 1.00 0.00 C ATOM 1073 CG2 VAL A 73 5.997 -2.464 2.624 1.00 0.00 C ATOM 0 H VAL A 73 3.346 -3.130 2.116 1.00 0.00 H new ATOM 0 HA VAL A 73 4.851 -4.366 4.203 1.00 0.00 H new ATOM 0 HB VAL A 73 4.338 -1.446 3.502 1.00 0.00 H new ATOM 0 HG11 VAL A 73 6.332 -0.943 4.851 1.00 0.00 H new ATOM 0 HG12 VAL A 73 5.025 -1.649 5.831 1.00 0.00 H new ATOM 0 HG13 VAL A 73 6.418 -2.648 5.352 1.00 0.00 H new ATOM 0 HG21 VAL A 73 6.581 -1.556 2.475 1.00 0.00 H new ATOM 0 HG22 VAL A 73 6.666 -3.290 2.863 1.00 0.00 H new ATOM 0 HG23 VAL A 73 5.447 -2.695 1.712 1.00 0.00 H new ATOM 1083 N MET A 74 2.035 -2.879 4.927 1.00 0.00 N ATOM 1084 CA MET A 74 1.061 -2.629 5.985 1.00 0.00 C ATOM 1085 C MET A 74 0.421 -3.923 6.485 1.00 0.00 C ATOM 1086 O MET A 74 0.228 -4.101 7.688 1.00 0.00 O ATOM 1087 CB MET A 74 -0.024 -1.674 5.486 1.00 0.00 C ATOM 1088 CG MET A 74 0.402 -0.215 5.486 1.00 0.00 C ATOM 1089 SD MET A 74 -0.957 0.906 5.869 1.00 0.00 S ATOM 1090 CE MET A 74 -0.925 1.978 4.436 1.00 0.00 C ATOM 0 H MET A 74 1.695 -2.682 3.986 1.00 0.00 H new ATOM 0 HA MET A 74 1.593 -2.175 6.821 1.00 0.00 H new ATOM 0 HB2 MET A 74 -0.311 -1.960 4.474 1.00 0.00 H new ATOM 0 HB3 MET A 74 -0.910 -1.785 6.112 1.00 0.00 H new ATOM 0 HG2 MET A 74 1.200 -0.074 6.214 1.00 0.00 H new ATOM 0 HG3 MET A 74 0.813 0.039 4.509 1.00 0.00 H new ATOM 0 HE1 MET A 74 -1.945 2.243 4.157 1.00 0.00 H new ATOM 0 HE2 MET A 74 -0.366 2.884 4.671 1.00 0.00 H new ATOM 0 HE3 MET A 74 -0.445 1.461 3.605 1.00 0.00 H new ATOM 1100 N ASN A 75 0.078 -4.818 5.562 1.00 0.00 N ATOM 1101 CA ASN A 75 -0.557 -6.081 5.930 1.00 0.00 C ATOM 1102 C ASN A 75 0.469 -7.121 6.376 1.00 0.00 C ATOM 1103 O ASN A 75 0.166 -7.981 7.203 1.00 0.00 O ATOM 1104 CB ASN A 75 -1.394 -6.620 4.769 1.00 0.00 C ATOM 1105 CG ASN A 75 -0.555 -7.033 3.577 1.00 0.00 C ATOM 1106 OD1 ASN A 75 0.343 -7.866 3.695 1.00 0.00 O ATOM 1107 ND2 ASN A 75 -0.843 -6.449 2.422 1.00 0.00 N ATOM 0 H ASN A 75 0.228 -4.694 4.561 1.00 0.00 H new ATOM 0 HA ASN A 75 -1.215 -5.883 6.776 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -1.973 -7.477 5.113 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -2.107 -5.857 4.458 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -0.311 -6.685 1.584 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -1.597 -5.764 2.371 1.00 0.00 H new ATOM 1114 N HIS A 76 1.683 -7.039 5.838 1.00 0.00 N ATOM 1115 CA HIS A 76 2.737 -7.978 6.209 1.00 0.00 C ATOM 1116 C HIS A 76 3.518 -7.461 7.416 1.00 0.00 C ATOM 1117 O HIS A 76 4.385 -8.152 7.950 1.00 0.00 O ATOM 1118 CB HIS A 76 3.693 -8.216 5.039 1.00 0.00 C ATOM 1119 CG HIS A 76 3.031 -8.819 3.837 1.00 0.00 C ATOM 1120 ND1 HIS A 76 3.227 -8.351 2.555 1.00 0.00 N ATOM 1121 CD2 HIS A 76 2.174 -9.861 3.728 1.00 0.00 C ATOM 1122 CE1 HIS A 76 2.517 -9.078 1.710 1.00 0.00 C ATOM 1123 NE2 HIS A 76 1.870 -10.001 2.396 1.00 0.00 N ATOM 0 H HIS A 76 1.960 -6.339 5.150 1.00 0.00 H new ATOM 0 HA HIS A 76 2.263 -8.924 6.471 1.00 0.00 H new ATOM 0 HB2 HIS A 76 4.149 -7.268 4.755 1.00 0.00 H new ATOM 0 HB3 HIS A 76 4.499 -8.872 5.367 1.00 0.00 H new ATOM 0 HD1 HIS A 76 3.826 -7.566 2.299 1.00 0.00 H new ATOM 0 HD2 HIS A 76 1.799 -10.469 4.538 1.00 0.00 H new ATOM 0 HE1 HIS A 76 2.474 -8.940 0.640 1.00 0.00 H new ATOM 1132 N HIS A 77 3.199 -6.242 7.839 1.00 0.00 N ATOM 1133 CA HIS A 77 3.860 -5.626 8.978 1.00 0.00 C ATOM 1134 C HIS A 77 5.353 -5.460 8.720 1.00 0.00 C ATOM 1135 O HIS A 77 6.161 -5.494 9.647 1.00 0.00 O ATOM 1136 CB HIS A 77 3.637 -6.458 10.241 1.00 0.00 C ATOM 1137 CG HIS A 77 2.195 -6.753 10.516 1.00 0.00 C ATOM 1138 ND1 HIS A 77 1.364 -5.883 11.190 1.00 0.00 N ATOM 1139 CD2 HIS A 77 1.435 -7.831 10.206 1.00 0.00 C ATOM 1140 CE1 HIS A 77 0.157 -6.413 11.284 1.00 0.00 C ATOM 1141 NE2 HIS A 77 0.174 -7.593 10.694 1.00 0.00 N ATOM 0 H HIS A 77 2.482 -5.660 7.405 1.00 0.00 H new ATOM 0 HA HIS A 77 3.424 -4.638 9.124 1.00 0.00 H new ATOM 0 HB2 HIS A 77 4.180 -7.398 10.148 1.00 0.00 H new ATOM 0 HB3 HIS A 77 4.060 -5.929 11.095 1.00 0.00 H new ATOM 0 HD2 HIS A 77 1.760 -8.713 9.674 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -0.698 -5.958 11.762 1.00 0.00 H new ATOM 0 HE2 HIS A 77 -0.621 -8.226 10.613 1.00 0.00 H new ATOM 1150 N LEU A 78 5.713 -5.276 7.454 1.00 0.00 N ATOM 1151 CA LEU A 78 7.106 -5.099 7.074 1.00 0.00 C ATOM 1152 C LEU A 78 7.706 -3.894 7.791 1.00 0.00 C ATOM 1153 O LEU A 78 7.005 -2.926 8.087 1.00 0.00 O ATOM 1154 CB LEU A 78 7.215 -4.927 5.560 1.00 0.00 C ATOM 1155 CG LEU A 78 7.024 -6.209 4.749 1.00 0.00 C ATOM 1156 CD1 LEU A 78 6.842 -5.888 3.274 1.00 0.00 C ATOM 1157 CD2 LEU A 78 8.205 -7.146 4.953 1.00 0.00 C ATOM 0 H LEU A 78 5.056 -5.246 6.674 1.00 0.00 H new ATOM 0 HA LEU A 78 7.666 -5.986 7.369 1.00 0.00 H new ATOM 0 HB2 LEU A 78 6.472 -4.197 5.238 1.00 0.00 H new ATOM 0 HB3 LEU A 78 8.194 -4.510 5.326 1.00 0.00 H new ATOM 0 HG LEU A 78 6.122 -6.709 5.102 1.00 0.00 H new ATOM 0 HD11 LEU A 78 6.708 -6.814 2.714 1.00 0.00 H new ATOM 0 HD12 LEU A 78 5.964 -5.255 3.145 1.00 0.00 H new ATOM 0 HD13 LEU A 78 7.724 -5.365 2.904 1.00 0.00 H new ATOM 0 HD21 LEU A 78 8.054 -8.054 4.369 1.00 0.00 H new ATOM 0 HD22 LEU A 78 9.121 -6.653 4.627 1.00 0.00 H new ATOM 0 HD23 LEU A 78 8.287 -7.403 6.009 1.00 0.00 H new ATOM 1169 N GLN A 79 9.001 -3.961 8.077 1.00 0.00 N ATOM 1170 CA GLN A 79 9.682 -2.875 8.771 1.00 0.00 C ATOM 1171 C GLN A 79 10.980 -2.500 8.064 1.00 0.00 C ATOM 1172 O GLN A 79 11.745 -3.369 7.646 1.00 0.00 O ATOM 1173 CB GLN A 79 9.964 -3.273 10.221 1.00 0.00 C ATOM 1174 CG GLN A 79 8.707 -3.387 11.069 1.00 0.00 C ATOM 1175 CD GLN A 79 8.978 -3.962 12.446 1.00 0.00 C ATOM 1176 OE1 GLN A 79 9.757 -3.407 13.221 1.00 0.00 O ATOM 1177 NE2 GLN A 79 8.332 -5.078 12.758 1.00 0.00 N ATOM 0 H GLN A 79 9.599 -4.753 7.840 1.00 0.00 H new ATOM 0 HA GLN A 79 9.029 -2.002 8.762 1.00 0.00 H new ATOM 0 HB2 GLN A 79 10.490 -4.228 10.233 1.00 0.00 H new ATOM 0 HB3 GLN A 79 10.631 -2.537 10.669 1.00 0.00 H new ATOM 0 HG2 GLN A 79 8.255 -2.401 11.174 1.00 0.00 H new ATOM 0 HG3 GLN A 79 7.982 -4.017 10.553 1.00 0.00 H new ATOM 0 HE21 GLN A 79 7.695 -5.504 12.085 1.00 0.00 H new ATOM 0 HE22 GLN A 79 8.472 -5.510 13.671 1.00 0.00 H new ATOM 1186 N GLU A 80 11.219 -1.200 7.932 1.00 0.00 N ATOM 1187 CA GLU A 80 12.420 -0.705 7.273 1.00 0.00 C ATOM 1188 C GLU A 80 13.558 -0.522 8.271 1.00 0.00 C ATOM 1189 O GLU A 80 13.364 0.016 9.361 1.00 0.00 O ATOM 1190 CB GLU A 80 12.128 0.620 6.568 1.00 0.00 C ATOM 1191 CG GLU A 80 13.272 1.112 5.697 1.00 0.00 C ATOM 1192 CD GLU A 80 13.957 2.337 6.271 1.00 0.00 C ATOM 1193 OE1 GLU A 80 13.294 3.389 6.385 1.00 0.00 O ATOM 1194 OE2 GLU A 80 15.157 2.243 6.608 1.00 0.00 O ATOM 0 H GLU A 80 10.595 -0.469 8.274 1.00 0.00 H new ATOM 0 HA GLU A 80 12.728 -1.445 6.534 1.00 0.00 H new ATOM 0 HB2 GLU A 80 11.237 0.505 5.951 1.00 0.00 H new ATOM 0 HB3 GLU A 80 11.901 1.378 7.317 1.00 0.00 H new ATOM 0 HG2 GLU A 80 14.004 0.313 5.579 1.00 0.00 H new ATOM 0 HG3 GLU A 80 12.892 1.345 4.702 1.00 0.00 H new ATOM 1201 N THR A 81 14.746 -0.974 7.887 1.00 0.00 N ATOM 1202 CA THR A 81 15.924 -0.862 8.741 1.00 0.00 C ATOM 1203 C THR A 81 17.013 -0.044 8.054 1.00 0.00 C ATOM 1204 O THR A 81 16.897 0.296 6.877 1.00 0.00 O ATOM 1205 CB THR A 81 16.457 -2.253 9.094 1.00 0.00 C ATOM 1206 OG1 THR A 81 17.651 -2.157 9.855 1.00 0.00 O ATOM 1207 CG2 THR A 81 16.748 -3.108 7.880 1.00 0.00 C ATOM 0 H THR A 81 14.920 -1.423 6.988 1.00 0.00 H new ATOM 0 HA THR A 81 15.634 -0.350 9.658 1.00 0.00 H new ATOM 0 HB THR A 81 15.663 -2.729 9.669 1.00 0.00 H new ATOM 0 HG1 THR A 81 17.974 -3.057 10.071 1.00 0.00 H new ATOM 0 HG21 THR A 81 17.122 -4.080 8.201 1.00 0.00 H new ATOM 0 HG22 THR A 81 15.833 -3.244 7.303 1.00 0.00 H new ATOM 0 HG23 THR A 81 17.498 -2.617 7.260 1.00 0.00 H new ATOM 1215 N SER A 82 18.071 0.271 8.796 1.00 0.00 N ATOM 1216 CA SER A 82 19.181 1.050 8.256 1.00 0.00 C ATOM 1217 C SER A 82 20.458 0.218 8.205 1.00 0.00 C ATOM 1218 O SER A 82 20.573 -0.805 8.881 1.00 0.00 O ATOM 1219 CB SER A 82 19.408 2.305 9.101 1.00 0.00 C ATOM 1220 OG SER A 82 18.227 3.081 9.191 1.00 0.00 O ATOM 0 H SER A 82 18.183 -0.001 9.773 1.00 0.00 H new ATOM 0 HA SER A 82 18.923 1.346 7.239 1.00 0.00 H new ATOM 0 HB2 SER A 82 19.736 2.019 10.101 1.00 0.00 H new ATOM 0 HB3 SER A 82 20.207 2.903 8.662 1.00 0.00 H new ATOM 0 HG SER A 82 18.399 3.876 9.738 1.00 0.00 H new ATOM 1226 N PHE A 83 21.416 0.663 7.398 1.00 0.00 N ATOM 1227 CA PHE A 83 22.686 -0.043 7.257 1.00 0.00 C ATOM 1228 C PHE A 83 23.680 0.776 6.440 1.00 0.00 C ATOM 1229 O PHE A 83 23.294 1.674 5.693 1.00 0.00 O ATOM 1230 CB PHE A 83 22.463 -1.405 6.597 1.00 0.00 C ATOM 1231 CG PHE A 83 22.658 -2.564 7.531 1.00 0.00 C ATOM 1232 CD1 PHE A 83 23.780 -2.637 8.340 1.00 0.00 C ATOM 1233 CD2 PHE A 83 21.719 -3.579 7.599 1.00 0.00 C ATOM 1234 CE1 PHE A 83 23.960 -3.702 9.202 1.00 0.00 C ATOM 1235 CE2 PHE A 83 21.894 -4.646 8.457 1.00 0.00 C ATOM 1236 CZ PHE A 83 23.015 -4.708 9.260 1.00 0.00 C ATOM 0 H PHE A 83 21.338 1.508 6.832 1.00 0.00 H new ATOM 0 HA PHE A 83 23.103 -0.192 8.253 1.00 0.00 H new ATOM 0 HB2 PHE A 83 21.452 -1.442 6.192 1.00 0.00 H new ATOM 0 HB3 PHE A 83 23.148 -1.508 5.755 1.00 0.00 H new ATOM 0 HD1 PHE A 83 24.522 -1.853 8.297 1.00 0.00 H new ATOM 0 HD2 PHE A 83 20.840 -3.535 6.974 1.00 0.00 H new ATOM 0 HE1 PHE A 83 24.838 -3.748 9.829 1.00 0.00 H new ATOM 0 HE2 PHE A 83 21.154 -5.432 8.500 1.00 0.00 H new ATOM 0 HZ PHE A 83 23.153 -5.542 9.933 1.00 0.00 H new ATOM 1246 N THR A 84 24.962 0.456 6.587 1.00 0.00 N ATOM 1247 CA THR A 84 26.015 1.157 5.862 1.00 0.00 C ATOM 1248 C THR A 84 26.493 0.334 4.671 1.00 0.00 C ATOM 1249 O THR A 84 26.250 -0.871 4.600 1.00 0.00 O ATOM 1250 CB THR A 84 27.190 1.458 6.793 1.00 0.00 C ATOM 1251 OG1 THR A 84 26.732 1.988 8.024 1.00 0.00 O ATOM 1252 CG2 THR A 84 28.180 2.442 6.210 1.00 0.00 C ATOM 0 H THR A 84 25.296 -0.285 7.203 1.00 0.00 H new ATOM 0 HA THR A 84 25.605 2.096 5.491 1.00 0.00 H new ATOM 0 HB THR A 84 27.695 0.503 6.937 1.00 0.00 H new ATOM 0 HG1 THR A 84 27.498 2.172 8.606 1.00 0.00 H new ATOM 0 HG21 THR A 84 28.988 2.610 6.922 1.00 0.00 H new ATOM 0 HG22 THR A 84 28.591 2.040 5.284 1.00 0.00 H new ATOM 0 HG23 THR A 84 27.676 3.386 6.003 1.00 0.00 H new ATOM 1260 N LYS A 85 27.172 0.990 3.735 1.00 0.00 N ATOM 1261 CA LYS A 85 27.683 0.316 2.547 1.00 0.00 C ATOM 1262 C LYS A 85 28.624 -0.823 2.924 1.00 0.00 C ATOM 1263 O LYS A 85 28.459 -1.955 2.471 1.00 0.00 O ATOM 1264 CB LYS A 85 28.408 1.314 1.641 1.00 0.00 C ATOM 1265 CG LYS A 85 27.495 2.378 1.055 1.00 0.00 C ATOM 1266 CD LYS A 85 28.277 3.610 0.625 1.00 0.00 C ATOM 1267 CE LYS A 85 28.380 3.705 -0.889 1.00 0.00 C ATOM 1268 NZ LYS A 85 28.736 5.080 -1.337 1.00 0.00 N ATOM 0 H LYS A 85 27.381 1.988 3.776 1.00 0.00 H new ATOM 0 HA LYS A 85 26.834 -0.105 2.008 1.00 0.00 H new ATOM 0 HB2 LYS A 85 29.200 1.800 2.211 1.00 0.00 H new ATOM 0 HB3 LYS A 85 28.888 0.771 0.827 1.00 0.00 H new ATOM 0 HG2 LYS A 85 26.960 1.968 0.198 1.00 0.00 H new ATOM 0 HG3 LYS A 85 26.745 2.662 1.793 1.00 0.00 H new ATOM 0 HD2 LYS A 85 27.791 4.505 1.014 1.00 0.00 H new ATOM 0 HD3 LYS A 85 29.277 3.577 1.057 1.00 0.00 H new ATOM 0 HE2 LYS A 85 29.131 3.001 -1.246 1.00 0.00 H new ATOM 0 HE3 LYS A 85 27.430 3.412 -1.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 28.796 5.102 -2.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 28.006 5.749 -1.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 29.655 5.350 -0.931 1.00 0.00 H new ATOM 1282 N GLU A 86 29.613 -0.515 3.758 1.00 0.00 N ATOM 1283 CA GLU A 86 30.581 -1.513 4.196 1.00 0.00 C ATOM 1284 C GLU A 86 29.907 -2.587 5.046 1.00 0.00 C ATOM 1285 O GLU A 86 30.129 -3.782 4.846 1.00 0.00 O ATOM 1286 CB GLU A 86 31.706 -0.849 4.992 1.00 0.00 C ATOM 1287 CG GLU A 86 33.071 -1.469 4.746 1.00 0.00 C ATOM 1288 CD GLU A 86 33.670 -1.056 3.416 1.00 0.00 C ATOM 1289 OE1 GLU A 86 34.056 0.123 3.280 1.00 0.00 O ATOM 1290 OE2 GLU A 86 33.750 -1.912 2.510 1.00 0.00 O ATOM 0 H GLU A 86 29.764 0.417 4.143 1.00 0.00 H new ATOM 0 HA GLU A 86 31.003 -1.987 3.310 1.00 0.00 H new ATOM 0 HB2 GLU A 86 31.745 0.210 4.736 1.00 0.00 H new ATOM 0 HB3 GLU A 86 31.474 -0.911 6.055 1.00 0.00 H new ATOM 0 HG2 GLU A 86 33.747 -1.179 5.550 1.00 0.00 H new ATOM 0 HG3 GLU A 86 32.984 -2.555 4.779 1.00 0.00 H new ATOM 1297 N ALA A 87 29.083 -2.153 5.994 1.00 0.00 N ATOM 1298 CA ALA A 87 28.377 -3.076 6.873 1.00 0.00 C ATOM 1299 C ALA A 87 27.507 -4.040 6.075 1.00 0.00 C ATOM 1300 O ALA A 87 27.376 -5.211 6.430 1.00 0.00 O ATOM 1301 CB ALA A 87 27.530 -2.305 7.875 1.00 0.00 C ATOM 0 H ALA A 87 28.888 -1.168 6.173 1.00 0.00 H new ATOM 0 HA ALA A 87 29.120 -3.662 7.414 1.00 0.00 H new ATOM 0 HB1 ALA A 87 27.008 -3.006 8.526 1.00 0.00 H new ATOM 0 HB2 ALA A 87 28.173 -1.662 8.476 1.00 0.00 H new ATOM 0 HB3 ALA A 87 26.802 -1.694 7.342 1.00 0.00 H new ATOM 1307 N TYR A 88 26.916 -3.542 4.993 1.00 0.00 N ATOM 1308 CA TYR A 88 26.061 -4.366 4.146 1.00 0.00 C ATOM 1309 C TYR A 88 26.854 -5.511 3.527 1.00 0.00 C ATOM 1310 O TYR A 88 26.350 -6.626 3.394 1.00 0.00 O ATOM 1311 CB TYR A 88 25.419 -3.518 3.045 1.00 0.00 C ATOM 1312 CG TYR A 88 24.023 -3.965 2.675 1.00 0.00 C ATOM 1313 CD1 TYR A 88 23.075 -4.229 3.656 1.00 0.00 C ATOM 1314 CD2 TYR A 88 23.653 -4.124 1.345 1.00 0.00 C ATOM 1315 CE1 TYR A 88 21.798 -4.638 3.322 1.00 0.00 C ATOM 1316 CE2 TYR A 88 22.378 -4.532 1.004 1.00 0.00 C ATOM 1317 CZ TYR A 88 21.455 -4.789 1.996 1.00 0.00 C ATOM 1318 OH TYR A 88 20.184 -5.197 1.659 1.00 0.00 O ATOM 0 H TYR A 88 27.013 -2.575 4.683 1.00 0.00 H new ATOM 0 HA TYR A 88 25.273 -4.787 4.770 1.00 0.00 H new ATOM 0 HB2 TYR A 88 25.384 -2.479 3.372 1.00 0.00 H new ATOM 0 HB3 TYR A 88 26.050 -3.552 2.157 1.00 0.00 H new ATOM 0 HD1 TYR A 88 23.341 -4.113 4.696 1.00 0.00 H new ATOM 0 HD2 TYR A 88 24.374 -3.925 0.566 1.00 0.00 H new ATOM 0 HE1 TYR A 88 21.072 -4.838 4.096 1.00 0.00 H new ATOM 0 HE2 TYR A 88 22.105 -4.649 -0.034 1.00 0.00 H new ATOM 0 HH TYR A 88 20.234 -5.865 0.943 1.00 0.00 H new ATOM 1328 N LYS A 89 28.097 -5.228 3.153 1.00 0.00 N ATOM 1329 CA LYS A 89 28.965 -6.234 2.550 1.00 0.00 C ATOM 1330 C LYS A 89 29.144 -7.421 3.488 1.00 0.00 C ATOM 1331 O LYS A 89 29.050 -8.577 3.074 1.00 0.00 O ATOM 1332 CB LYS A 89 30.324 -5.626 2.203 1.00 0.00 C ATOM 1333 CG LYS A 89 30.220 -4.261 1.543 1.00 0.00 C ATOM 1334 CD LYS A 89 31.407 -3.988 0.634 1.00 0.00 C ATOM 1335 CE LYS A 89 31.348 -2.586 0.050 1.00 0.00 C ATOM 1336 NZ LYS A 89 30.166 -2.400 -0.835 1.00 0.00 N ATOM 0 H LYS A 89 28.527 -4.309 3.257 1.00 0.00 H new ATOM 0 HA LYS A 89 28.494 -6.586 1.632 1.00 0.00 H new ATOM 0 HB2 LYS A 89 30.918 -5.538 3.113 1.00 0.00 H new ATOM 0 HB3 LYS A 89 30.859 -6.304 1.538 1.00 0.00 H new ATOM 0 HG2 LYS A 89 29.298 -4.205 0.965 1.00 0.00 H new ATOM 0 HG3 LYS A 89 30.163 -3.489 2.310 1.00 0.00 H new ATOM 0 HD2 LYS A 89 32.333 -4.111 1.196 1.00 0.00 H new ATOM 0 HD3 LYS A 89 31.424 -4.720 -0.174 1.00 0.00 H new ATOM 0 HE2 LYS A 89 31.313 -1.857 0.860 1.00 0.00 H new ATOM 0 HE3 LYS A 89 32.259 -2.390 -0.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 30.432 -1.811 -1.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 29.835 -3.327 -1.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 29.404 -1.932 -0.303 1.00 0.00 H new ATOM 1350 N LYS A 90 29.384 -7.125 4.758 1.00 0.00 N ATOM 1351 CA LYS A 90 29.552 -8.167 5.761 1.00 0.00 C ATOM 1352 C LYS A 90 28.190 -8.719 6.159 1.00 0.00 C ATOM 1353 O LYS A 90 28.063 -9.877 6.555 1.00 0.00 O ATOM 1354 CB LYS A 90 30.279 -7.619 6.990 1.00 0.00 C ATOM 1355 CG LYS A 90 30.846 -8.703 7.894 1.00 0.00 C ATOM 1356 CD LYS A 90 32.225 -8.332 8.413 1.00 0.00 C ATOM 1357 CE LYS A 90 32.579 -9.121 9.664 1.00 0.00 C ATOM 1358 NZ LYS A 90 31.749 -8.714 10.833 1.00 0.00 N ATOM 0 H LYS A 90 29.467 -6.174 5.117 1.00 0.00 H new ATOM 0 HA LYS A 90 30.155 -8.970 5.337 1.00 0.00 H new ATOM 0 HB2 LYS A 90 31.091 -6.969 6.662 1.00 0.00 H new ATOM 0 HB3 LYS A 90 29.589 -7.002 7.565 1.00 0.00 H new ATOM 0 HG2 LYS A 90 30.172 -8.866 8.735 1.00 0.00 H new ATOM 0 HG3 LYS A 90 30.904 -9.643 7.345 1.00 0.00 H new ATOM 0 HD2 LYS A 90 32.969 -8.521 7.639 1.00 0.00 H new ATOM 0 HD3 LYS A 90 32.258 -7.265 8.633 1.00 0.00 H new ATOM 0 HE2 LYS A 90 32.440 -10.185 9.473 1.00 0.00 H new ATOM 0 HE3 LYS A 90 33.633 -8.975 9.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 32.222 -9.004 11.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 31.628 -7.681 10.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 30.817 -9.172 10.774 1.00 0.00 H new ATOM 1372 N TYR A 91 27.174 -7.872 6.038 1.00 0.00 N ATOM 1373 CA TYR A 91 25.810 -8.248 6.368 1.00 0.00 C ATOM 1374 C TYR A 91 25.291 -9.302 5.396 1.00 0.00 C ATOM 1375 O TYR A 91 24.706 -10.304 5.807 1.00 0.00 O ATOM 1376 CB TYR A 91 24.912 -7.013 6.328 1.00 0.00 C ATOM 1377 CG TYR A 91 23.493 -7.271 6.781 1.00 0.00 C ATOM 1378 CD1 TYR A 91 23.228 -8.082 7.877 1.00 0.00 C ATOM 1379 CD2 TYR A 91 22.418 -6.701 6.109 1.00 0.00 C ATOM 1380 CE1 TYR A 91 21.930 -8.318 8.291 1.00 0.00 C ATOM 1381 CE2 TYR A 91 21.119 -6.932 6.517 1.00 0.00 C ATOM 1382 CZ TYR A 91 20.880 -7.741 7.607 1.00 0.00 C ATOM 1383 OH TYR A 91 19.588 -7.973 8.016 1.00 0.00 O ATOM 0 H TYR A 91 27.274 -6.911 5.710 1.00 0.00 H new ATOM 0 HA TYR A 91 25.798 -8.672 7.372 1.00 0.00 H new ATOM 0 HB2 TYR A 91 25.349 -6.238 6.958 1.00 0.00 H new ATOM 0 HB3 TYR A 91 24.893 -6.623 5.310 1.00 0.00 H new ATOM 0 HD1 TYR A 91 24.048 -8.535 8.414 1.00 0.00 H new ATOM 0 HD2 TYR A 91 22.602 -6.067 5.254 1.00 0.00 H new ATOM 0 HE1 TYR A 91 21.739 -8.951 9.145 1.00 0.00 H new ATOM 0 HE2 TYR A 91 20.295 -6.481 5.985 1.00 0.00 H new ATOM 0 HH TYR A 91 19.032 -7.196 7.798 1.00 0.00 H new ATOM 1393 N ILE A 92 25.510 -9.069 4.105 1.00 0.00 N ATOM 1394 CA ILE A 92 25.063 -10.003 3.078 1.00 0.00 C ATOM 1395 C ILE A 92 25.734 -11.359 3.241 1.00 0.00 C ATOM 1396 O ILE A 92 25.090 -12.400 3.116 1.00 0.00 O ATOM 1397 CB ILE A 92 25.337 -9.465 1.658 1.00 0.00 C ATOM 1398 CG1 ILE A 92 24.923 -10.493 0.600 1.00 0.00 C ATOM 1399 CG2 ILE A 92 26.805 -9.100 1.495 1.00 0.00 C ATOM 1400 CD1 ILE A 92 23.446 -10.818 0.612 1.00 0.00 C ATOM 0 H ILE A 92 25.992 -8.245 3.747 1.00 0.00 H new ATOM 0 HA ILE A 92 23.986 -10.117 3.205 1.00 0.00 H new ATOM 0 HB ILE A 92 24.740 -8.564 1.516 1.00 0.00 H new ATOM 0 HG12 ILE A 92 25.195 -10.116 -0.386 1.00 0.00 H new ATOM 0 HG13 ILE A 92 25.489 -11.411 0.757 1.00 0.00 H new ATOM 0 HG21 ILE A 92 26.976 -8.723 0.487 1.00 0.00 H new ATOM 0 HG22 ILE A 92 27.071 -8.331 2.220 1.00 0.00 H new ATOM 0 HG23 ILE A 92 27.420 -9.984 1.661 1.00 0.00 H new ATOM 0 HD11 ILE A 92 23.229 -11.552 -0.164 1.00 0.00 H new ATOM 0 HD12 ILE A 92 23.171 -11.226 1.585 1.00 0.00 H new ATOM 0 HD13 ILE A 92 22.872 -9.911 0.424 1.00 0.00 H new ATOM 1412 N LYS A 93 27.029 -11.339 3.521 1.00 0.00 N ATOM 1413 CA LYS A 93 27.784 -12.570 3.700 1.00 0.00 C ATOM 1414 C LYS A 93 27.247 -13.371 4.880 1.00 0.00 C ATOM 1415 O LYS A 93 27.071 -14.583 4.789 1.00 0.00 O ATOM 1416 CB LYS A 93 29.266 -12.256 3.912 1.00 0.00 C ATOM 1417 CG LYS A 93 30.122 -13.492 4.140 1.00 0.00 C ATOM 1418 CD LYS A 93 31.404 -13.442 3.325 1.00 0.00 C ATOM 1419 CE LYS A 93 32.394 -12.445 3.905 1.00 0.00 C ATOM 1420 NZ LYS A 93 33.102 -12.992 5.094 1.00 0.00 N ATOM 0 H LYS A 93 27.578 -10.486 3.629 1.00 0.00 H new ATOM 0 HA LYS A 93 27.672 -13.171 2.797 1.00 0.00 H new ATOM 0 HB2 LYS A 93 29.643 -11.718 3.042 1.00 0.00 H new ATOM 0 HB3 LYS A 93 29.369 -11.590 4.768 1.00 0.00 H new ATOM 0 HG2 LYS A 93 30.366 -13.576 5.199 1.00 0.00 H new ATOM 0 HG3 LYS A 93 29.554 -14.383 3.872 1.00 0.00 H new ATOM 0 HD2 LYS A 93 31.858 -14.433 3.297 1.00 0.00 H new ATOM 0 HD3 LYS A 93 31.172 -13.169 2.296 1.00 0.00 H new ATOM 0 HE2 LYS A 93 33.123 -12.172 3.142 1.00 0.00 H new ATOM 0 HE3 LYS A 93 31.868 -11.532 4.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 33.768 -12.281 5.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 32.409 -13.229 5.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 33.625 -13.849 4.823 1.00 0.00 H new ATOM 1434 N ASP A 94 26.998 -12.686 5.985 1.00 0.00 N ATOM 1435 CA ASP A 94 26.496 -13.328 7.193 1.00 0.00 C ATOM 1436 C ASP A 94 25.049 -13.789 7.035 1.00 0.00 C ATOM 1437 O ASP A 94 24.671 -14.847 7.538 1.00 0.00 O ATOM 1438 CB ASP A 94 26.603 -12.364 8.372 1.00 0.00 C ATOM 1439 CG ASP A 94 26.218 -13.008 9.690 1.00 0.00 C ATOM 1440 OD1 ASP A 94 25.919 -14.220 9.695 1.00 0.00 O ATOM 1441 OD2 ASP A 94 26.217 -12.298 10.718 1.00 0.00 O ATOM 0 H ASP A 94 27.136 -11.679 6.072 1.00 0.00 H new ATOM 0 HA ASP A 94 27.108 -14.211 7.377 1.00 0.00 H new ATOM 0 HB2 ASP A 94 27.625 -11.991 8.439 1.00 0.00 H new ATOM 0 HB3 ASP A 94 25.960 -11.503 8.191 1.00 0.00 H new ATOM 1446 N TYR A 95 24.239 -12.991 6.348 1.00 0.00 N ATOM 1447 CA TYR A 95 22.834 -13.330 6.147 1.00 0.00 C ATOM 1448 C TYR A 95 22.680 -14.378 5.047 1.00 0.00 C ATOM 1449 O TYR A 95 21.928 -15.343 5.203 1.00 0.00 O ATOM 1450 CB TYR A 95 22.012 -12.055 5.867 1.00 0.00 C ATOM 1451 CG TYR A 95 21.305 -11.997 4.525 1.00 0.00 C ATOM 1452 CD1 TYR A 95 20.336 -12.929 4.176 1.00 0.00 C ATOM 1453 CD2 TYR A 95 21.601 -10.990 3.616 1.00 0.00 C ATOM 1454 CE1 TYR A 95 19.686 -12.859 2.957 1.00 0.00 C ATOM 1455 CE2 TYR A 95 20.957 -10.914 2.398 1.00 0.00 C ATOM 1456 CZ TYR A 95 20.001 -11.852 2.072 1.00 0.00 C ATOM 1457 OH TYR A 95 19.355 -11.777 0.861 1.00 0.00 O ATOM 0 H TYR A 95 24.528 -12.110 5.923 1.00 0.00 H new ATOM 0 HA TYR A 95 22.440 -13.775 7.061 1.00 0.00 H new ATOM 0 HB2 TYR A 95 21.265 -11.949 6.653 1.00 0.00 H new ATOM 0 HB3 TYR A 95 22.677 -11.195 5.942 1.00 0.00 H new ATOM 0 HD1 TYR A 95 20.086 -13.720 4.867 1.00 0.00 H new ATOM 0 HD2 TYR A 95 22.349 -10.253 3.867 1.00 0.00 H new ATOM 0 HE1 TYR A 95 18.935 -13.591 2.700 1.00 0.00 H new ATOM 0 HE2 TYR A 95 21.201 -10.124 1.704 1.00 0.00 H new ATOM 0 HH TYR A 95 19.807 -12.356 0.213 1.00 0.00 H new ATOM 1467 N MET A 96 23.408 -14.209 3.948 1.00 0.00 N ATOM 1468 CA MET A 96 23.348 -15.171 2.856 1.00 0.00 C ATOM 1469 C MET A 96 23.829 -16.534 3.343 1.00 0.00 C ATOM 1470 O MET A 96 23.359 -17.574 2.881 1.00 0.00 O ATOM 1471 CB MET A 96 24.184 -14.699 1.660 1.00 0.00 C ATOM 1472 CG MET A 96 25.687 -14.772 1.886 1.00 0.00 C ATOM 1473 SD MET A 96 26.498 -15.970 0.809 1.00 0.00 S ATOM 1474 CE MET A 96 28.180 -15.354 0.822 1.00 0.00 C ATOM 0 H MET A 96 24.040 -13.424 3.791 1.00 0.00 H new ATOM 0 HA MET A 96 22.313 -15.257 2.524 1.00 0.00 H new ATOM 0 HB2 MET A 96 23.928 -15.304 0.790 1.00 0.00 H new ATOM 0 HB3 MET A 96 23.912 -13.670 1.424 1.00 0.00 H new ATOM 0 HG2 MET A 96 26.123 -13.787 1.720 1.00 0.00 H new ATOM 0 HG3 MET A 96 25.881 -15.035 2.926 1.00 0.00 H new ATOM 0 HE1 MET A 96 28.628 -15.499 -0.161 1.00 0.00 H new ATOM 0 HE2 MET A 96 28.177 -14.292 1.066 1.00 0.00 H new ATOM 0 HE3 MET A 96 28.760 -15.896 1.569 1.00 0.00 H new ATOM 1484 N LYS A 97 24.764 -16.518 4.294 1.00 0.00 N ATOM 1485 CA LYS A 97 25.299 -17.749 4.860 1.00 0.00 C ATOM 1486 C LYS A 97 24.215 -18.495 5.624 1.00 0.00 C ATOM 1487 O LYS A 97 24.097 -19.715 5.527 1.00 0.00 O ATOM 1488 CB LYS A 97 26.476 -17.446 5.790 1.00 0.00 C ATOM 1489 CG LYS A 97 27.759 -17.098 5.056 1.00 0.00 C ATOM 1490 CD LYS A 97 28.700 -18.289 4.975 1.00 0.00 C ATOM 1491 CE LYS A 97 29.798 -18.205 6.023 1.00 0.00 C ATOM 1492 NZ LYS A 97 29.327 -18.662 7.359 1.00 0.00 N ATOM 0 H LYS A 97 25.164 -15.665 4.686 1.00 0.00 H new ATOM 0 HA LYS A 97 25.652 -18.376 4.041 1.00 0.00 H new ATOM 0 HB2 LYS A 97 26.206 -16.618 6.445 1.00 0.00 H new ATOM 0 HB3 LYS A 97 26.656 -18.311 6.428 1.00 0.00 H new ATOM 0 HG2 LYS A 97 27.521 -16.753 4.050 1.00 0.00 H new ATOM 0 HG3 LYS A 97 28.258 -16.274 5.566 1.00 0.00 H new ATOM 0 HD2 LYS A 97 28.134 -19.211 5.112 1.00 0.00 H new ATOM 0 HD3 LYS A 97 29.147 -18.334 3.982 1.00 0.00 H new ATOM 0 HE2 LYS A 97 30.646 -18.814 5.710 1.00 0.00 H new ATOM 0 HE3 LYS A 97 30.153 -17.177 6.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 30.105 -18.589 8.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 28.534 -18.065 7.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 29.012 -19.651 7.296 1.00 0.00 H new ATOM 1506 N SER A 98 23.417 -17.744 6.378 1.00 0.00 N ATOM 1507 CA SER A 98 22.328 -18.323 7.155 1.00 0.00 C ATOM 1508 C SER A 98 21.441 -19.178 6.259 1.00 0.00 C ATOM 1509 O SER A 98 21.000 -20.260 6.647 1.00 0.00 O ATOM 1510 CB SER A 98 21.498 -17.219 7.811 1.00 0.00 C ATOM 1511 OG SER A 98 21.997 -16.901 9.099 1.00 0.00 O ATOM 0 H SER A 98 23.505 -16.732 6.467 1.00 0.00 H new ATOM 0 HA SER A 98 22.754 -18.953 7.936 1.00 0.00 H new ATOM 0 HB2 SER A 98 21.511 -16.328 7.183 1.00 0.00 H new ATOM 0 HB3 SER A 98 20.459 -17.539 7.889 1.00 0.00 H new ATOM 0 HG SER A 98 22.262 -15.958 9.123 1.00 0.00 H new ATOM 1517 N ILE A 99 21.199 -18.683 5.051 1.00 0.00 N ATOM 1518 CA ILE A 99 20.381 -19.396 4.083 1.00 0.00 C ATOM 1519 C ILE A 99 21.193 -20.488 3.403 1.00 0.00 C ATOM 1520 O ILE A 99 20.716 -21.608 3.214 1.00 0.00 O ATOM 1521 CB ILE A 99 19.817 -18.437 3.015 1.00 0.00 C ATOM 1522 CG1 ILE A 99 18.952 -17.364 3.676 1.00 0.00 C ATOM 1523 CG2 ILE A 99 19.017 -19.201 1.971 1.00 0.00 C ATOM 1524 CD1 ILE A 99 19.080 -16.004 3.028 1.00 0.00 C ATOM 0 H ILE A 99 21.560 -17.788 4.720 1.00 0.00 H new ATOM 0 HA ILE A 99 19.548 -19.846 4.623 1.00 0.00 H new ATOM 0 HB ILE A 99 20.652 -17.951 2.510 1.00 0.00 H new ATOM 0 HG12 ILE A 99 17.909 -17.677 3.642 1.00 0.00 H new ATOM 0 HG13 ILE A 99 19.226 -17.284 4.728 1.00 0.00 H new ATOM 0 HG21 ILE A 99 18.629 -18.504 1.228 1.00 0.00 H new ATOM 0 HG22 ILE A 99 19.661 -19.931 1.482 1.00 0.00 H new ATOM 0 HG23 ILE A 99 18.187 -19.716 2.454 1.00 0.00 H new ATOM 0 HD11 ILE A 99 18.439 -15.292 3.548 1.00 0.00 H new ATOM 0 HD12 ILE A 99 20.116 -15.670 3.086 1.00 0.00 H new ATOM 0 HD13 ILE A 99 18.777 -16.069 1.983 1.00 0.00 H new ATOM 1536 N LYS A 100 22.426 -20.153 3.047 1.00 0.00 N ATOM 1537 CA LYS A 100 23.318 -21.102 2.396 1.00 0.00 C ATOM 1538 C LYS A 100 23.467 -22.360 3.246 1.00 0.00 C ATOM 1539 O LYS A 100 23.320 -23.477 2.749 1.00 0.00 O ATOM 1540 CB LYS A 100 24.683 -20.455 2.158 1.00 0.00 C ATOM 1541 CG LYS A 100 25.699 -21.388 1.514 1.00 0.00 C ATOM 1542 CD LYS A 100 26.836 -21.724 2.468 1.00 0.00 C ATOM 1543 CE LYS A 100 28.191 -21.587 1.793 1.00 0.00 C ATOM 1544 NZ LYS A 100 29.205 -20.981 2.699 1.00 0.00 N ATOM 0 H LYS A 100 22.831 -19.229 3.199 1.00 0.00 H new ATOM 0 HA LYS A 100 22.890 -21.386 1.434 1.00 0.00 H new ATOM 0 HB2 LYS A 100 24.554 -19.579 1.523 1.00 0.00 H new ATOM 0 HB3 LYS A 100 25.079 -20.103 3.110 1.00 0.00 H new ATOM 0 HG2 LYS A 100 25.203 -22.307 1.201 1.00 0.00 H new ATOM 0 HG3 LYS A 100 26.103 -20.922 0.615 1.00 0.00 H new ATOM 0 HD2 LYS A 100 26.792 -21.064 3.334 1.00 0.00 H new ATOM 0 HD3 LYS A 100 26.714 -22.742 2.837 1.00 0.00 H new ATOM 0 HE2 LYS A 100 28.535 -22.569 1.468 1.00 0.00 H new ATOM 0 HE3 LYS A 100 28.090 -20.972 0.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 30.142 -21.381 2.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 29.228 -19.951 2.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 28.955 -21.187 3.687 1.00 0.00 H new ATOM 1558 N GLY A 101 23.745 -22.170 4.531 1.00 0.00 N ATOM 1559 CA GLY A 101 23.895 -23.297 5.431 1.00 0.00 C ATOM 1560 C GLY A 101 22.628 -24.126 5.520 1.00 0.00 C ATOM 1561 O GLY A 101 22.664 -25.349 5.377 1.00 0.00 O ATOM 0 H GLY A 101 23.869 -21.255 4.965 1.00 0.00 H new ATOM 0 HA2 GLY A 101 24.717 -23.926 5.090 1.00 0.00 H new ATOM 0 HA3 GLY A 101 24.162 -22.935 6.424 1.00 0.00 H new ATOM 1565 N LYS A 102 21.501 -23.458 5.748 1.00 0.00 N ATOM 1566 CA LYS A 102 20.219 -24.143 5.844 1.00 0.00 C ATOM 1567 C LYS A 102 19.910 -24.868 4.542 1.00 0.00 C ATOM 1568 O LYS A 102 19.418 -25.997 4.549 1.00 0.00 O ATOM 1569 CB LYS A 102 19.103 -23.148 6.170 1.00 0.00 C ATOM 1570 CG LYS A 102 17.812 -23.809 6.625 1.00 0.00 C ATOM 1571 CD LYS A 102 17.945 -24.393 8.023 1.00 0.00 C ATOM 1572 CE LYS A 102 17.335 -25.783 8.108 1.00 0.00 C ATOM 1573 NZ LYS A 102 18.149 -26.697 8.957 1.00 0.00 N ATOM 0 H LYS A 102 21.451 -22.446 5.869 1.00 0.00 H new ATOM 0 HA LYS A 102 20.278 -24.875 6.649 1.00 0.00 H new ATOM 0 HB2 LYS A 102 19.449 -22.470 6.950 1.00 0.00 H new ATOM 0 HB3 LYS A 102 18.899 -22.541 5.288 1.00 0.00 H new ATOM 0 HG2 LYS A 102 17.004 -23.078 6.611 1.00 0.00 H new ATOM 0 HG3 LYS A 102 17.540 -24.599 5.924 1.00 0.00 H new ATOM 0 HD2 LYS A 102 18.998 -24.439 8.300 1.00 0.00 H new ATOM 0 HD3 LYS A 102 17.455 -23.735 8.741 1.00 0.00 H new ATOM 0 HE2 LYS A 102 16.326 -25.712 8.515 1.00 0.00 H new ATOM 0 HE3 LYS A 102 17.246 -26.202 7.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 17.699 -27.634 8.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 19.104 -26.785 8.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 18.213 -26.311 9.920 1.00 0.00 H new ATOM 1587 N LEU A 103 20.216 -24.217 3.426 1.00 0.00 N ATOM 1588 CA LEU A 103 19.985 -24.807 2.116 1.00 0.00 C ATOM 1589 C LEU A 103 20.871 -26.031 1.930 1.00 0.00 C ATOM 1590 O LEU A 103 20.450 -27.033 1.358 1.00 0.00 O ATOM 1591 CB LEU A 103 20.257 -23.785 1.013 1.00 0.00 C ATOM 1592 CG LEU A 103 19.539 -24.057 -0.309 1.00 0.00 C ATOM 1593 CD1 LEU A 103 18.087 -23.614 -0.230 1.00 0.00 C ATOM 1594 CD2 LEU A 103 20.251 -23.353 -1.455 1.00 0.00 C ATOM 0 H LEU A 103 20.624 -23.282 3.403 1.00 0.00 H new ATOM 0 HA LEU A 103 18.941 -25.114 2.052 1.00 0.00 H new ATOM 0 HB2 LEU A 103 19.964 -22.798 1.372 1.00 0.00 H new ATOM 0 HB3 LEU A 103 21.330 -23.751 0.826 1.00 0.00 H new ATOM 0 HG LEU A 103 19.559 -25.130 -0.497 1.00 0.00 H new ATOM 0 HD11 LEU A 103 17.593 -23.816 -1.180 1.00 0.00 H new ATOM 0 HD12 LEU A 103 17.582 -24.162 0.565 1.00 0.00 H new ATOM 0 HD13 LEU A 103 18.044 -22.546 -0.018 1.00 0.00 H new ATOM 0 HD21 LEU A 103 19.727 -23.557 -2.389 1.00 0.00 H new ATOM 0 HD22 LEU A 103 20.261 -22.279 -1.272 1.00 0.00 H new ATOM 0 HD23 LEU A 103 21.275 -23.719 -1.526 1.00 0.00 H new ATOM 1606 N GLU A 104 22.101 -25.945 2.428 1.00 0.00 N ATOM 1607 CA GLU A 104 23.042 -27.048 2.327 1.00 0.00 C ATOM 1608 C GLU A 104 22.463 -28.311 2.957 1.00 0.00 C ATOM 1609 O GLU A 104 22.788 -29.426 2.548 1.00 0.00 O ATOM 1610 CB GLU A 104 24.354 -26.677 3.013 1.00 0.00 C ATOM 1611 CG GLU A 104 25.249 -25.788 2.167 1.00 0.00 C ATOM 1612 CD GLU A 104 26.469 -25.299 2.922 1.00 0.00 C ATOM 1613 OE1 GLU A 104 26.415 -25.252 4.169 1.00 0.00 O ATOM 1614 OE2 GLU A 104 27.478 -24.963 2.267 1.00 0.00 O ATOM 0 H GLU A 104 22.466 -25.121 2.905 1.00 0.00 H new ATOM 0 HA GLU A 104 23.232 -27.245 1.272 1.00 0.00 H new ATOM 0 HB2 GLU A 104 24.133 -26.169 3.952 1.00 0.00 H new ATOM 0 HB3 GLU A 104 24.894 -27.590 3.264 1.00 0.00 H new ATOM 0 HG2 GLU A 104 25.570 -26.339 1.283 1.00 0.00 H new ATOM 0 HG3 GLU A 104 24.675 -24.930 1.817 1.00 0.00 H new ATOM 1621 N GLU A 105 21.606 -28.127 3.957 1.00 0.00 N ATOM 1622 CA GLU A 105 20.984 -29.251 4.647 1.00 0.00 C ATOM 1623 C GLU A 105 19.705 -29.706 3.944 1.00 0.00 C ATOM 1624 O GLU A 105 19.241 -30.827 4.152 1.00 0.00 O ATOM 1625 CB GLU A 105 20.672 -28.873 6.096 1.00 0.00 C ATOM 1626 CG GLU A 105 21.908 -28.577 6.928 1.00 0.00 C ATOM 1627 CD GLU A 105 22.764 -29.808 7.156 1.00 0.00 C ATOM 1628 OE1 GLU A 105 22.348 -30.682 7.946 1.00 0.00 O ATOM 1629 OE2 GLU A 105 23.850 -29.898 6.547 1.00 0.00 O ATOM 0 H GLU A 105 21.327 -27.210 4.307 1.00 0.00 H new ATOM 0 HA GLU A 105 21.691 -30.080 4.631 1.00 0.00 H new ATOM 0 HB2 GLU A 105 20.022 -27.998 6.102 1.00 0.00 H new ATOM 0 HB3 GLU A 105 20.116 -29.686 6.563 1.00 0.00 H new ATOM 0 HG2 GLU A 105 22.503 -27.812 6.429 1.00 0.00 H new ATOM 0 HG3 GLU A 105 21.604 -28.167 7.891 1.00 0.00 H new ATOM 1636 N GLN A 106 19.132 -28.834 3.117 1.00 0.00 N ATOM 1637 CA GLN A 106 17.901 -29.160 2.400 1.00 0.00 C ATOM 1638 C GLN A 106 18.162 -29.387 0.914 1.00 0.00 C ATOM 1639 O GLN A 106 17.926 -30.476 0.390 1.00 0.00 O ATOM 1640 CB GLN A 106 16.875 -28.040 2.581 1.00 0.00 C ATOM 1641 CG GLN A 106 16.622 -27.682 4.034 1.00 0.00 C ATOM 1642 CD GLN A 106 15.394 -26.814 4.216 1.00 0.00 C ATOM 1643 OE1 GLN A 106 15.285 -25.767 3.406 1.00 0.00 O flip ATOM 1644 NE2 GLN A 106 14.552 -27.081 5.074 1.00 0.00 N flip ATOM 0 H GLN A 106 19.498 -27.901 2.927 1.00 0.00 H new ATOM 0 HA GLN A 106 17.508 -30.086 2.819 1.00 0.00 H new ATOM 0 HB2 GLN A 106 17.220 -27.152 2.051 1.00 0.00 H new ATOM 0 HB3 GLN A 106 15.934 -28.341 2.120 1.00 0.00 H new ATOM 0 HG2 GLN A 106 16.505 -28.597 4.614 1.00 0.00 H new ATOM 0 HG3 GLN A 106 17.493 -27.161 4.433 1.00 0.00 H new ATOM 0 HE21 GLN A 106 14.677 -27.896 5.675 1.00 0.00 H new ATOM 0 HE22 GLN A 106 13.730 -26.487 5.184 1.00 0.00 H new ATOM 1653 N ARG A 107 18.648 -28.351 0.239 1.00 0.00 N ATOM 1654 CA ARG A 107 18.939 -28.430 -1.187 1.00 0.00 C ATOM 1655 C ARG A 107 20.337 -27.890 -1.484 1.00 0.00 C ATOM 1656 O ARG A 107 20.493 -26.870 -2.155 1.00 0.00 O ATOM 1657 CB ARG A 107 17.892 -27.650 -1.986 1.00 0.00 C ATOM 1658 CG ARG A 107 16.486 -28.215 -1.855 1.00 0.00 C ATOM 1659 CD ARG A 107 15.467 -27.349 -2.579 1.00 0.00 C ATOM 1660 NE ARG A 107 14.297 -28.116 -2.998 1.00 0.00 N ATOM 1661 CZ ARG A 107 14.277 -28.913 -4.065 1.00 0.00 C ATOM 1662 NH1 ARG A 107 15.358 -29.047 -4.822 1.00 0.00 N ATOM 1663 NH2 ARG A 107 13.173 -29.579 -4.374 1.00 0.00 N ATOM 0 H ARG A 107 18.849 -27.443 0.659 1.00 0.00 H new ATOM 0 HA ARG A 107 18.903 -29.478 -1.486 1.00 0.00 H new ATOM 0 HB2 ARG A 107 17.891 -26.612 -1.653 1.00 0.00 H new ATOM 0 HB3 ARG A 107 18.177 -27.647 -3.038 1.00 0.00 H new ATOM 0 HG2 ARG A 107 16.460 -29.226 -2.261 1.00 0.00 H new ATOM 0 HG3 ARG A 107 16.219 -28.288 -0.801 1.00 0.00 H new ATOM 0 HD2 ARG A 107 15.152 -26.536 -1.925 1.00 0.00 H new ATOM 0 HD3 ARG A 107 15.934 -26.893 -3.452 1.00 0.00 H new ATOM 0 HE ARG A 107 13.446 -28.037 -2.441 1.00 0.00 H new ATOM 0 HH11 ARG A 107 16.211 -28.538 -4.588 1.00 0.00 H new ATOM 0 HH12 ARG A 107 15.337 -29.659 -5.638 1.00 0.00 H new ATOM 0 HH21 ARG A 107 12.339 -29.481 -3.795 1.00 0.00 H new ATOM 0 HH22 ARG A 107 13.157 -30.189 -5.191 1.00 0.00 H new ATOM 1677 N PRO A 108 21.376 -28.576 -0.978 1.00 0.00 N ATOM 1678 CA PRO A 108 22.773 -28.179 -1.177 1.00 0.00 C ATOM 1679 C PRO A 108 23.109 -27.916 -2.643 1.00 0.00 C ATOM 1680 O PRO A 108 24.057 -27.196 -2.949 1.00 0.00 O ATOM 1681 CB PRO A 108 23.576 -29.381 -0.650 1.00 0.00 C ATOM 1682 CG PRO A 108 22.576 -30.476 -0.451 1.00 0.00 C ATOM 1683 CD PRO A 108 21.274 -29.790 -0.166 1.00 0.00 C ATOM 0 HA PRO A 108 22.997 -27.243 -0.665 1.00 0.00 H new ATOM 0 HB2 PRO A 108 24.347 -29.679 -1.360 1.00 0.00 H new ATOM 0 HB3 PRO A 108 24.080 -29.136 0.285 1.00 0.00 H new ATOM 0 HG2 PRO A 108 22.501 -31.104 -1.339 1.00 0.00 H new ATOM 0 HG3 PRO A 108 22.866 -31.125 0.375 1.00 0.00 H new ATOM 0 HD2 PRO A 108 20.420 -30.402 -0.456 1.00 0.00 H new ATOM 0 HD3 PRO A 108 21.158 -29.562 0.894 1.00 0.00 H new ATOM 1691 N GLU A 109 22.328 -28.498 -3.545 1.00 0.00 N ATOM 1692 CA GLU A 109 22.553 -28.313 -4.975 1.00 0.00 C ATOM 1693 C GLU A 109 22.197 -26.891 -5.412 1.00 0.00 C ATOM 1694 O GLU A 109 22.490 -26.491 -6.539 1.00 0.00 O ATOM 1695 CB GLU A 109 21.728 -29.323 -5.773 1.00 0.00 C ATOM 1696 CG GLU A 109 20.228 -29.188 -5.558 1.00 0.00 C ATOM 1697 CD GLU A 109 19.466 -30.434 -5.965 1.00 0.00 C ATOM 1698 OE1 GLU A 109 19.257 -30.633 -7.180 1.00 0.00 O ATOM 1699 OE2 GLU A 109 19.079 -31.212 -5.067 1.00 0.00 O ATOM 0 H GLU A 109 21.537 -29.099 -3.314 1.00 0.00 H new ATOM 0 HA GLU A 109 23.613 -28.476 -5.172 1.00 0.00 H new ATOM 0 HB2 GLU A 109 21.947 -29.202 -6.834 1.00 0.00 H new ATOM 0 HB3 GLU A 109 22.037 -30.331 -5.497 1.00 0.00 H new ATOM 0 HG2 GLU A 109 20.033 -28.975 -4.507 1.00 0.00 H new ATOM 0 HG3 GLU A 109 19.858 -28.337 -6.130 1.00 0.00 H new ATOM 1706 N ARG A 110 21.556 -26.136 -4.522 1.00 0.00 N ATOM 1707 CA ARG A 110 21.153 -24.771 -4.821 1.00 0.00 C ATOM 1708 C ARG A 110 21.991 -23.748 -4.051 1.00 0.00 C ATOM 1709 O ARG A 110 21.793 -22.541 -4.194 1.00 0.00 O ATOM 1710 CB ARG A 110 19.683 -24.593 -4.464 1.00 0.00 C ATOM 1711 CG ARG A 110 18.730 -25.159 -5.504 1.00 0.00 C ATOM 1712 CD ARG A 110 18.449 -24.156 -6.612 1.00 0.00 C ATOM 1713 NE ARG A 110 17.020 -23.881 -6.751 1.00 0.00 N ATOM 1714 CZ ARG A 110 16.463 -23.383 -7.853 1.00 0.00 C ATOM 1715 NH1 ARG A 110 17.210 -23.099 -8.913 1.00 0.00 N ATOM 1716 NH2 ARG A 110 15.156 -23.169 -7.894 1.00 0.00 N ATOM 0 H ARG A 110 21.305 -26.452 -3.585 1.00 0.00 H new ATOM 0 HA ARG A 110 21.311 -24.598 -5.885 1.00 0.00 H new ATOM 0 HB2 ARG A 110 19.490 -25.075 -3.506 1.00 0.00 H new ATOM 0 HB3 ARG A 110 19.476 -23.531 -4.334 1.00 0.00 H new ATOM 0 HG2 ARG A 110 19.156 -26.066 -5.933 1.00 0.00 H new ATOM 0 HG3 ARG A 110 17.794 -25.443 -5.024 1.00 0.00 H new ATOM 0 HD2 ARG A 110 18.979 -23.227 -6.403 1.00 0.00 H new ATOM 0 HD3 ARG A 110 18.838 -24.539 -7.555 1.00 0.00 H new ATOM 0 HE ARG A 110 16.413 -24.083 -5.956 1.00 0.00 H new ATOM 0 HH11 ARG A 110 18.217 -23.262 -8.886 1.00 0.00 H new ATOM 0 HH12 ARG A 110 16.777 -22.718 -9.754 1.00 0.00 H new ATOM 0 HH21 ARG A 110 14.578 -23.386 -7.082 1.00 0.00 H new ATOM 0 HH22 ARG A 110 14.728 -22.788 -8.738 1.00 0.00 H new ATOM 1730 N VAL A 111 22.916 -24.231 -3.229 1.00 0.00 N ATOM 1731 CA VAL A 111 23.765 -23.347 -2.435 1.00 0.00 C ATOM 1732 C VAL A 111 24.801 -22.613 -3.286 1.00 0.00 C ATOM 1733 O VAL A 111 25.149 -21.469 -2.993 1.00 0.00 O ATOM 1734 CB VAL A 111 24.495 -24.120 -1.317 1.00 0.00 C ATOM 1735 CG1 VAL A 111 23.494 -24.810 -0.404 1.00 0.00 C ATOM 1736 CG2 VAL A 111 25.476 -25.125 -1.903 1.00 0.00 C ATOM 0 H VAL A 111 23.098 -25.226 -3.094 1.00 0.00 H new ATOM 0 HA VAL A 111 23.095 -22.610 -1.993 1.00 0.00 H new ATOM 0 HB VAL A 111 25.063 -23.404 -0.723 1.00 0.00 H new ATOM 0 HG11 VAL A 111 24.027 -25.350 0.378 1.00 0.00 H new ATOM 0 HG12 VAL A 111 22.841 -24.064 0.050 1.00 0.00 H new ATOM 0 HG13 VAL A 111 22.895 -25.511 -0.985 1.00 0.00 H new ATOM 0 HG21 VAL A 111 25.978 -25.657 -1.095 1.00 0.00 H new ATOM 0 HG22 VAL A 111 24.937 -25.838 -2.527 1.00 0.00 H new ATOM 0 HG23 VAL A 111 26.216 -24.601 -2.507 1.00 0.00 H new ATOM 1746 N LYS A 112 25.306 -23.268 -4.330 1.00 0.00 N ATOM 1747 CA LYS A 112 26.314 -22.650 -5.189 1.00 0.00 C ATOM 1748 C LYS A 112 25.729 -21.500 -6.006 1.00 0.00 C ATOM 1749 O LYS A 112 26.291 -20.405 -6.025 1.00 0.00 O ATOM 1750 CB LYS A 112 26.963 -23.688 -6.111 1.00 0.00 C ATOM 1751 CG LYS A 112 27.460 -24.921 -5.377 1.00 0.00 C ATOM 1752 CD LYS A 112 28.668 -25.533 -6.070 1.00 0.00 C ATOM 1753 CE LYS A 112 28.252 -26.560 -7.111 1.00 0.00 C ATOM 1754 NZ LYS A 112 29.429 -27.155 -7.803 1.00 0.00 N ATOM 0 H LYS A 112 25.038 -24.215 -4.599 1.00 0.00 H new ATOM 0 HA LYS A 112 27.085 -22.238 -4.538 1.00 0.00 H new ATOM 0 HB2 LYS A 112 26.241 -23.992 -6.869 1.00 0.00 H new ATOM 0 HB3 LYS A 112 27.799 -23.225 -6.635 1.00 0.00 H new ATOM 0 HG2 LYS A 112 27.723 -24.655 -4.353 1.00 0.00 H new ATOM 0 HG3 LYS A 112 26.660 -25.659 -5.319 1.00 0.00 H new ATOM 0 HD2 LYS A 112 29.253 -24.746 -6.547 1.00 0.00 H new ATOM 0 HD3 LYS A 112 29.313 -26.005 -5.329 1.00 0.00 H new ATOM 0 HE2 LYS A 112 27.675 -27.350 -6.631 1.00 0.00 H new ATOM 0 HE3 LYS A 112 27.599 -26.089 -7.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 29.104 -27.850 -8.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 29.966 -26.404 -8.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 30.040 -27.627 -7.106 1.00 0.00 H new ATOM 1768 N PRO A 113 24.587 -21.714 -6.687 1.00 0.00 N ATOM 1769 CA PRO A 113 23.947 -20.665 -7.486 1.00 0.00 C ATOM 1770 C PRO A 113 23.554 -19.467 -6.631 1.00 0.00 C ATOM 1771 O PRO A 113 23.563 -18.327 -7.094 1.00 0.00 O ATOM 1772 CB PRO A 113 22.698 -21.345 -8.058 1.00 0.00 C ATOM 1773 CG PRO A 113 22.966 -22.806 -7.946 1.00 0.00 C ATOM 1774 CD PRO A 113 23.824 -22.972 -6.726 1.00 0.00 C ATOM 0 HA PRO A 113 24.614 -20.274 -8.255 1.00 0.00 H new ATOM 0 HB2 PRO A 113 21.805 -21.064 -7.499 1.00 0.00 H new ATOM 0 HB3 PRO A 113 22.530 -21.053 -9.095 1.00 0.00 H new ATOM 0 HG2 PRO A 113 22.037 -23.368 -7.850 1.00 0.00 H new ATOM 0 HG3 PRO A 113 23.474 -23.180 -8.835 1.00 0.00 H new ATOM 0 HD2 PRO A 113 23.224 -23.109 -5.826 1.00 0.00 H new ATOM 0 HD3 PRO A 113 24.479 -23.839 -6.808 1.00 0.00 H new ATOM 1782 N PHE A 114 23.209 -19.739 -5.375 1.00 0.00 N ATOM 1783 CA PHE A 114 22.811 -18.687 -4.447 1.00 0.00 C ATOM 1784 C PHE A 114 24.010 -17.846 -4.024 1.00 0.00 C ATOM 1785 O PHE A 114 23.951 -16.616 -4.028 1.00 0.00 O ATOM 1786 CB PHE A 114 22.142 -19.289 -3.210 1.00 0.00 C ATOM 1787 CG PHE A 114 21.601 -18.254 -2.266 1.00 0.00 C ATOM 1788 CD1 PHE A 114 20.680 -17.317 -2.704 1.00 0.00 C ATOM 1789 CD2 PHE A 114 22.012 -18.218 -0.942 1.00 0.00 C ATOM 1790 CE1 PHE A 114 20.178 -16.363 -1.841 1.00 0.00 C ATOM 1791 CE2 PHE A 114 21.513 -17.265 -0.074 1.00 0.00 C ATOM 1792 CZ PHE A 114 20.594 -16.337 -0.525 1.00 0.00 C ATOM 0 H PHE A 114 23.197 -20.678 -4.978 1.00 0.00 H new ATOM 0 HA PHE A 114 22.099 -18.042 -4.962 1.00 0.00 H new ATOM 0 HB2 PHE A 114 21.329 -19.943 -3.527 1.00 0.00 H new ATOM 0 HB3 PHE A 114 22.864 -19.911 -2.681 1.00 0.00 H new ATOM 0 HD1 PHE A 114 20.351 -17.333 -3.732 1.00 0.00 H new ATOM 0 HD2 PHE A 114 22.729 -18.942 -0.585 1.00 0.00 H new ATOM 0 HE1 PHE A 114 19.460 -15.638 -2.195 1.00 0.00 H new ATOM 0 HE2 PHE A 114 21.841 -17.246 0.955 1.00 0.00 H new ATOM 0 HZ PHE A 114 20.202 -15.592 0.151 1.00 0.00 H new ATOM 1802 N MET A 115 25.099 -18.516 -3.655 1.00 0.00 N ATOM 1803 CA MET A 115 26.314 -17.828 -3.224 1.00 0.00 C ATOM 1804 C MET A 115 26.708 -16.740 -4.217 1.00 0.00 C ATOM 1805 O MET A 115 27.077 -15.632 -3.828 1.00 0.00 O ATOM 1806 CB MET A 115 27.459 -18.830 -3.063 1.00 0.00 C ATOM 1807 CG MET A 115 27.613 -19.354 -1.645 1.00 0.00 C ATOM 1808 SD MET A 115 28.556 -18.236 -0.590 1.00 0.00 S ATOM 1809 CE MET A 115 30.187 -18.383 -1.315 1.00 0.00 C ATOM 0 H MET A 115 25.165 -19.534 -3.646 1.00 0.00 H new ATOM 0 HA MET A 115 26.113 -17.356 -2.262 1.00 0.00 H new ATOM 0 HB2 MET A 115 27.292 -19.671 -3.736 1.00 0.00 H new ATOM 0 HB3 MET A 115 28.391 -18.356 -3.370 1.00 0.00 H new ATOM 0 HG2 MET A 115 26.626 -19.511 -1.211 1.00 0.00 H new ATOM 0 HG3 MET A 115 28.107 -20.325 -1.672 1.00 0.00 H new ATOM 0 HE1 MET A 115 30.903 -18.670 -0.545 1.00 0.00 H new ATOM 0 HE2 MET A 115 30.171 -19.143 -2.096 1.00 0.00 H new ATOM 0 HE3 MET A 115 30.481 -17.426 -1.746 1.00 0.00 H new ATOM 1819 N THR A 116 26.623 -17.067 -5.500 1.00 0.00 N ATOM 1820 CA THR A 116 26.967 -16.121 -6.553 1.00 0.00 C ATOM 1821 C THR A 116 25.863 -15.086 -6.734 1.00 0.00 C ATOM 1822 O THR A 116 26.130 -13.890 -6.848 1.00 0.00 O ATOM 1823 CB THR A 116 27.210 -16.859 -7.870 1.00 0.00 C ATOM 1824 OG1 THR A 116 28.221 -17.839 -7.717 1.00 0.00 O ATOM 1825 CG2 THR A 116 27.626 -15.943 -9.001 1.00 0.00 C ATOM 0 H THR A 116 26.319 -17.981 -5.836 1.00 0.00 H new ATOM 0 HA THR A 116 27.881 -15.605 -6.260 1.00 0.00 H new ATOM 0 HB THR A 116 26.254 -17.315 -8.126 1.00 0.00 H new ATOM 0 HG1 THR A 116 28.360 -18.301 -8.570 1.00 0.00 H new ATOM 0 HG21 THR A 116 27.782 -16.530 -9.906 1.00 0.00 H new ATOM 0 HG22 THR A 116 26.844 -15.205 -9.178 1.00 0.00 H new ATOM 0 HG23 THR A 116 28.552 -15.433 -8.735 1.00 0.00 H new ATOM 1833 N GLY A 117 24.624 -15.557 -6.761 1.00 0.00 N ATOM 1834 CA GLY A 117 23.490 -14.666 -6.931 1.00 0.00 C ATOM 1835 C GLY A 117 23.383 -13.635 -5.827 1.00 0.00 C ATOM 1836 O GLY A 117 23.331 -12.434 -6.091 1.00 0.00 O ATOM 0 H GLY A 117 24.382 -16.543 -6.668 1.00 0.00 H new ATOM 0 HA2 GLY A 117 23.575 -14.156 -7.891 1.00 0.00 H new ATOM 0 HA3 GLY A 117 22.573 -15.254 -6.963 1.00 0.00 H new ATOM 1840 N ALA A 118 23.347 -14.109 -4.589 1.00 0.00 N ATOM 1841 CA ALA A 118 23.241 -13.227 -3.430 1.00 0.00 C ATOM 1842 C ALA A 118 24.313 -12.145 -3.454 1.00 0.00 C ATOM 1843 O ALA A 118 24.016 -10.958 -3.321 1.00 0.00 O ATOM 1844 CB ALA A 118 23.334 -14.035 -2.143 1.00 0.00 C ATOM 0 H ALA A 118 23.390 -15.102 -4.359 1.00 0.00 H new ATOM 0 HA ALA A 118 22.269 -12.735 -3.472 1.00 0.00 H new ATOM 0 HB1 ALA A 118 23.254 -13.366 -1.287 1.00 0.00 H new ATOM 0 HB2 ALA A 118 22.524 -14.764 -2.111 1.00 0.00 H new ATOM 0 HB3 ALA A 118 24.291 -14.555 -2.108 1.00 0.00 H new ATOM 1850 N ALA A 119 25.559 -12.565 -3.620 1.00 0.00 N ATOM 1851 CA ALA A 119 26.685 -11.639 -3.657 1.00 0.00 C ATOM 1852 C ALA A 119 26.659 -10.770 -4.912 1.00 0.00 C ATOM 1853 O ALA A 119 27.147 -9.641 -4.904 1.00 0.00 O ATOM 1854 CB ALA A 119 27.996 -12.404 -3.572 1.00 0.00 C ATOM 0 H ALA A 119 25.818 -13.545 -3.732 1.00 0.00 H new ATOM 0 HA ALA A 119 26.600 -10.977 -2.795 1.00 0.00 H new ATOM 0 HB1 ALA A 119 28.829 -11.702 -3.601 1.00 0.00 H new ATOM 0 HB2 ALA A 119 28.028 -12.968 -2.640 1.00 0.00 H new ATOM 0 HB3 ALA A 119 28.072 -13.091 -4.415 1.00 0.00 H new ATOM 1860 N GLU A 120 26.095 -11.300 -5.989 1.00 0.00 N ATOM 1861 CA GLU A 120 26.019 -10.564 -7.247 1.00 0.00 C ATOM 1862 C GLU A 120 24.985 -9.444 -7.170 1.00 0.00 C ATOM 1863 O GLU A 120 25.296 -8.279 -7.419 1.00 0.00 O ATOM 1864 CB GLU A 120 25.675 -11.509 -8.399 1.00 0.00 C ATOM 1865 CG GLU A 120 26.896 -12.080 -9.101 1.00 0.00 C ATOM 1866 CD GLU A 120 26.623 -12.430 -10.551 1.00 0.00 C ATOM 1867 OE1 GLU A 120 26.187 -11.535 -11.305 1.00 0.00 O ATOM 1868 OE2 GLU A 120 26.848 -13.597 -10.933 1.00 0.00 O ATOM 0 H GLU A 120 25.684 -12.233 -6.019 1.00 0.00 H new ATOM 0 HA GLU A 120 26.996 -10.118 -7.430 1.00 0.00 H new ATOM 0 HB2 GLU A 120 25.069 -12.330 -8.016 1.00 0.00 H new ATOM 0 HB3 GLU A 120 25.064 -10.975 -9.127 1.00 0.00 H new ATOM 0 HG2 GLU A 120 27.710 -11.357 -9.052 1.00 0.00 H new ATOM 0 HG3 GLU A 120 27.231 -12.972 -8.572 1.00 0.00 H new ATOM 1875 N GLN A 121 23.753 -9.807 -6.830 1.00 0.00 N ATOM 1876 CA GLN A 121 22.670 -8.836 -6.728 1.00 0.00 C ATOM 1877 C GLN A 121 22.968 -7.775 -5.672 1.00 0.00 C ATOM 1878 O GLN A 121 22.538 -6.629 -5.796 1.00 0.00 O ATOM 1879 CB GLN A 121 21.356 -9.542 -6.396 1.00 0.00 C ATOM 1880 CG GLN A 121 20.129 -8.809 -6.916 1.00 0.00 C ATOM 1881 CD GLN A 121 18.851 -9.602 -6.725 1.00 0.00 C ATOM 1882 OE1 GLN A 121 18.473 -10.367 -7.742 1.00 0.00 O flip ATOM 1883 NE2 GLN A 121 18.211 -9.527 -5.676 1.00 0.00 N flip ATOM 0 H GLN A 121 23.479 -10.767 -6.620 1.00 0.00 H new ATOM 0 HA GLN A 121 22.580 -8.338 -7.693 1.00 0.00 H new ATOM 0 HB2 GLN A 121 21.375 -10.547 -6.817 1.00 0.00 H new ATOM 0 HB3 GLN A 121 21.274 -9.651 -5.315 1.00 0.00 H new ATOM 0 HG2 GLN A 121 20.038 -7.851 -6.403 1.00 0.00 H new ATOM 0 HG3 GLN A 121 20.262 -8.592 -7.976 1.00 0.00 H new ATOM 0 HE21 GLN A 121 18.539 -8.926 -4.920 1.00 0.00 H new ATOM 0 HE22 GLN A 121 17.353 -10.066 -5.563 1.00 0.00 H new ATOM 1892 N ILE A 122 23.696 -8.162 -4.629 1.00 0.00 N ATOM 1893 CA ILE A 122 24.032 -7.236 -3.557 1.00 0.00 C ATOM 1894 C ILE A 122 24.908 -6.095 -4.064 1.00 0.00 C ATOM 1895 O ILE A 122 24.665 -4.930 -3.751 1.00 0.00 O ATOM 1896 CB ILE A 122 24.721 -7.960 -2.376 1.00 0.00 C ATOM 1897 CG1 ILE A 122 24.221 -7.382 -1.057 1.00 0.00 C ATOM 1898 CG2 ILE A 122 26.240 -7.862 -2.457 1.00 0.00 C ATOM 1899 CD1 ILE A 122 24.615 -5.938 -0.848 1.00 0.00 C ATOM 0 H ILE A 122 24.062 -9.106 -4.505 1.00 0.00 H new ATOM 0 HA ILE A 122 23.095 -6.813 -3.194 1.00 0.00 H new ATOM 0 HB ILE A 122 24.462 -9.017 -2.433 1.00 0.00 H new ATOM 0 HG12 ILE A 122 23.135 -7.463 -1.022 1.00 0.00 H new ATOM 0 HG13 ILE A 122 24.613 -7.981 -0.235 1.00 0.00 H new ATOM 0 HG21 ILE A 122 26.684 -8.383 -1.609 1.00 0.00 H new ATOM 0 HG22 ILE A 122 26.585 -8.318 -3.385 1.00 0.00 H new ATOM 0 HG23 ILE A 122 26.539 -6.814 -2.435 1.00 0.00 H new ATOM 0 HD11 ILE A 122 24.227 -5.590 0.109 1.00 0.00 H new ATOM 0 HD12 ILE A 122 25.702 -5.853 -0.852 1.00 0.00 H new ATOM 0 HD13 ILE A 122 24.201 -5.328 -1.651 1.00 0.00 H new ATOM 1911 N LYS A 123 25.919 -6.433 -4.858 1.00 0.00 N ATOM 1912 CA LYS A 123 26.812 -5.423 -5.410 1.00 0.00 C ATOM 1913 C LYS A 123 26.031 -4.455 -6.291 1.00 0.00 C ATOM 1914 O LYS A 123 26.370 -3.276 -6.395 1.00 0.00 O ATOM 1915 CB LYS A 123 27.931 -6.081 -6.221 1.00 0.00 C ATOM 1916 CG LYS A 123 28.682 -7.163 -5.461 1.00 0.00 C ATOM 1917 CD LYS A 123 29.158 -8.267 -6.392 1.00 0.00 C ATOM 1918 CE LYS A 123 30.237 -9.119 -5.744 1.00 0.00 C ATOM 1919 NZ LYS A 123 29.829 -9.613 -4.400 1.00 0.00 N ATOM 0 H LYS A 123 26.139 -7.391 -5.131 1.00 0.00 H new ATOM 0 HA LYS A 123 27.259 -4.870 -4.584 1.00 0.00 H new ATOM 0 HB2 LYS A 123 27.505 -6.514 -7.126 1.00 0.00 H new ATOM 0 HB3 LYS A 123 28.638 -5.314 -6.537 1.00 0.00 H new ATOM 0 HG2 LYS A 123 29.538 -6.723 -4.949 1.00 0.00 H new ATOM 0 HG3 LYS A 123 28.034 -7.587 -4.693 1.00 0.00 H new ATOM 0 HD2 LYS A 123 28.314 -8.898 -6.671 1.00 0.00 H new ATOM 0 HD3 LYS A 123 29.544 -7.827 -7.311 1.00 0.00 H new ATOM 0 HE2 LYS A 123 30.463 -9.968 -6.389 1.00 0.00 H new ATOM 0 HE3 LYS A 123 31.153 -8.535 -5.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 30.217 -10.566 -4.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 30.193 -8.970 -3.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 28.791 -9.649 -4.344 1.00 0.00 H new ATOM 1933 N HIS A 124 24.975 -4.967 -6.916 1.00 0.00 N ATOM 1934 CA HIS A 124 24.132 -4.164 -7.786 1.00 0.00 C ATOM 1935 C HIS A 124 23.336 -3.144 -6.977 1.00 0.00 C ATOM 1936 O HIS A 124 23.387 -1.944 -7.247 1.00 0.00 O ATOM 1937 CB HIS A 124 23.180 -5.073 -8.560 1.00 0.00 C ATOM 1938 CG HIS A 124 22.384 -4.359 -9.608 1.00 0.00 C ATOM 1939 ND1 HIS A 124 21.651 -3.222 -9.541 1.00 0.00 N flip ATOM 1940 CD2 HIS A 124 22.278 -4.805 -10.908 1.00 0.00 C flip ATOM 1941 CE1 HIS A 124 21.123 -3.005 -10.790 1.00 0.00 C flip ATOM 1942 NE2 HIS A 124 21.516 -3.974 -11.596 1.00 0.00 N flip ATOM 0 H HIS A 124 24.684 -5.941 -6.833 1.00 0.00 H new ATOM 0 HA HIS A 124 24.769 -3.624 -8.487 1.00 0.00 H new ATOM 0 HB2 HIS A 124 23.756 -5.869 -9.033 1.00 0.00 H new ATOM 0 HB3 HIS A 124 22.495 -5.549 -7.858 1.00 0.00 H new ATOM 0 HD2 HIS A 124 22.745 -5.695 -11.302 1.00 0.00 H new ATOM 0 HE1 HIS A 124 20.489 -2.176 -11.068 1.00 0.00 H new ATOM 0 HE2 HIS A 124 21.273 -4.065 -12.582 1.00 0.00 H new ATOM 1951 N ILE A 125 22.599 -3.633 -5.984 1.00 0.00 N ATOM 1952 CA ILE A 125 21.792 -2.779 -5.134 1.00 0.00 C ATOM 1953 C ILE A 125 22.650 -1.756 -4.399 1.00 0.00 C ATOM 1954 O ILE A 125 22.287 -0.586 -4.298 1.00 0.00 O ATOM 1955 CB ILE A 125 21.009 -3.614 -4.108 1.00 0.00 C ATOM 1956 CG1 ILE A 125 21.944 -4.565 -3.357 1.00 0.00 C ATOM 1957 CG2 ILE A 125 19.889 -4.387 -4.792 1.00 0.00 C ATOM 1958 CD1 ILE A 125 21.231 -5.439 -2.346 1.00 0.00 C ATOM 0 H ILE A 125 22.548 -4.625 -5.751 1.00 0.00 H new ATOM 0 HA ILE A 125 21.092 -2.250 -5.781 1.00 0.00 H new ATOM 0 HB ILE A 125 20.562 -2.935 -3.382 1.00 0.00 H new ATOM 0 HG12 ILE A 125 22.458 -5.201 -4.078 1.00 0.00 H new ATOM 0 HG13 ILE A 125 22.709 -3.981 -2.845 1.00 0.00 H new ATOM 0 HG21 ILE A 125 19.345 -4.972 -4.050 1.00 0.00 H new ATOM 0 HG22 ILE A 125 19.206 -3.688 -5.274 1.00 0.00 H new ATOM 0 HG23 ILE A 125 20.313 -5.055 -5.542 1.00 0.00 H new ATOM 0 HD11 ILE A 125 21.954 -6.087 -1.851 1.00 0.00 H new ATOM 0 HD12 ILE A 125 20.740 -4.810 -1.603 1.00 0.00 H new ATOM 0 HD13 ILE A 125 20.485 -6.049 -2.855 1.00 0.00 H new ATOM 1970 N LEU A 126 23.791 -2.208 -3.889 1.00 0.00 N ATOM 1971 CA LEU A 126 24.703 -1.333 -3.163 1.00 0.00 C ATOM 1972 C LEU A 126 25.062 -0.109 -3.998 1.00 0.00 C ATOM 1973 O LEU A 126 25.177 1.000 -3.477 1.00 0.00 O ATOM 1974 CB LEU A 126 25.971 -2.095 -2.779 1.00 0.00 C ATOM 1975 CG LEU A 126 25.904 -2.837 -1.442 1.00 0.00 C ATOM 1976 CD1 LEU A 126 27.244 -3.482 -1.122 1.00 0.00 C ATOM 1977 CD2 LEU A 126 25.484 -1.889 -0.327 1.00 0.00 C ATOM 0 H LEU A 126 24.106 -3.175 -3.965 1.00 0.00 H new ATOM 0 HA LEU A 126 24.201 -0.995 -2.256 1.00 0.00 H new ATOM 0 HB2 LEU A 126 26.195 -2.815 -3.566 1.00 0.00 H new ATOM 0 HB3 LEU A 126 26.803 -1.391 -2.745 1.00 0.00 H new ATOM 0 HG LEU A 126 25.156 -3.625 -1.522 1.00 0.00 H new ATOM 0 HD11 LEU A 126 27.177 -4.005 -0.168 1.00 0.00 H new ATOM 0 HD12 LEU A 126 27.503 -4.192 -1.908 1.00 0.00 H new ATOM 0 HD13 LEU A 126 28.013 -2.712 -1.061 1.00 0.00 H new ATOM 0 HD21 LEU A 126 25.441 -2.433 0.616 1.00 0.00 H new ATOM 0 HD22 LEU A 126 26.209 -1.079 -0.246 1.00 0.00 H new ATOM 0 HD23 LEU A 126 24.501 -1.476 -0.552 1.00 0.00 H new ATOM 1989 N ALA A 127 25.231 -0.318 -5.299 1.00 0.00 N ATOM 1990 CA ALA A 127 25.570 0.768 -6.210 1.00 0.00 C ATOM 1991 C ALA A 127 24.424 1.772 -6.324 1.00 0.00 C ATOM 1992 O ALA A 127 24.610 2.885 -6.814 1.00 0.00 O ATOM 1993 CB ALA A 127 25.927 0.214 -7.581 1.00 0.00 C ATOM 0 H ALA A 127 25.139 -1.230 -5.746 1.00 0.00 H new ATOM 0 HA ALA A 127 26.436 1.291 -5.804 1.00 0.00 H new ATOM 0 HB1 ALA A 127 26.178 1.036 -8.251 1.00 0.00 H new ATOM 0 HB2 ALA A 127 26.783 -0.455 -7.491 1.00 0.00 H new ATOM 0 HB3 ALA A 127 25.077 -0.336 -7.984 1.00 0.00 H new ATOM 1999 N ASN A 128 23.239 1.371 -5.868 1.00 0.00 N ATOM 2000 CA ASN A 128 22.067 2.236 -5.918 1.00 0.00 C ATOM 2001 C ASN A 128 21.267 2.137 -4.624 1.00 0.00 C ATOM 2002 O ASN A 128 20.042 2.261 -4.626 1.00 0.00 O ATOM 2003 CB ASN A 128 21.182 1.863 -7.108 1.00 0.00 C ATOM 2004 CG ASN A 128 21.969 1.740 -8.398 1.00 0.00 C ATOM 2005 OD1 ASN A 128 22.161 2.720 -9.118 1.00 0.00 O ATOM 2006 ND2 ASN A 128 22.429 0.531 -8.698 1.00 0.00 N ATOM 0 H ASN A 128 23.067 0.452 -5.460 1.00 0.00 H new ATOM 0 HA ASN A 128 22.408 3.264 -6.038 1.00 0.00 H new ATOM 0 HB2 ASN A 128 20.679 0.918 -6.901 1.00 0.00 H new ATOM 0 HB3 ASN A 128 20.405 2.618 -7.230 1.00 0.00 H new ATOM 0 HD21 ASN A 128 22.965 0.387 -9.554 1.00 0.00 H new ATOM 0 HD22 ASN A 128 22.247 -0.254 -8.072 1.00 0.00 H new ATOM 2013 N PHE A 129 21.972 1.912 -3.520 1.00 0.00 N ATOM 2014 CA PHE A 129 21.340 1.792 -2.210 1.00 0.00 C ATOM 2015 C PHE A 129 20.424 2.985 -1.930 1.00 0.00 C ATOM 2016 O PHE A 129 19.450 2.870 -1.188 1.00 0.00 O ATOM 2017 CB PHE A 129 22.415 1.675 -1.122 1.00 0.00 C ATOM 2018 CG PHE A 129 21.939 2.038 0.258 1.00 0.00 C ATOM 2019 CD1 PHE A 129 20.806 1.446 0.794 1.00 0.00 C ATOM 2020 CD2 PHE A 129 22.625 2.973 1.018 1.00 0.00 C ATOM 2021 CE1 PHE A 129 20.367 1.779 2.062 1.00 0.00 C ATOM 2022 CE2 PHE A 129 22.190 3.309 2.285 1.00 0.00 C ATOM 2023 CZ PHE A 129 21.059 2.712 2.808 1.00 0.00 C ATOM 0 H PHE A 129 22.987 1.809 -3.507 1.00 0.00 H new ATOM 0 HA PHE A 129 20.726 0.891 -2.204 1.00 0.00 H new ATOM 0 HB2 PHE A 129 22.791 0.652 -1.107 1.00 0.00 H new ATOM 0 HB3 PHE A 129 23.254 2.319 -1.386 1.00 0.00 H new ATOM 0 HD1 PHE A 129 20.260 0.716 0.214 1.00 0.00 H new ATOM 0 HD2 PHE A 129 23.509 3.444 0.615 1.00 0.00 H new ATOM 0 HE1 PHE A 129 19.483 1.310 2.469 1.00 0.00 H new ATOM 0 HE2 PHE A 129 22.734 4.038 2.867 1.00 0.00 H new ATOM 0 HZ PHE A 129 20.717 2.975 3.798 1.00 0.00 H new ATOM 2033 N LYS A 130 20.745 4.128 -2.528 1.00 0.00 N ATOM 2034 CA LYS A 130 19.950 5.335 -2.340 1.00 0.00 C ATOM 2035 C LYS A 130 18.558 5.183 -2.950 1.00 0.00 C ATOM 2036 O LYS A 130 17.640 5.929 -2.612 1.00 0.00 O ATOM 2037 CB LYS A 130 20.661 6.539 -2.962 1.00 0.00 C ATOM 2038 CG LYS A 130 20.183 7.877 -2.420 1.00 0.00 C ATOM 2039 CD LYS A 130 21.349 8.779 -2.047 1.00 0.00 C ATOM 2040 CE LYS A 130 21.612 8.760 -0.551 1.00 0.00 C ATOM 2041 NZ LYS A 130 22.394 9.947 -0.109 1.00 0.00 N ATOM 0 H LYS A 130 21.549 4.243 -3.146 1.00 0.00 H new ATOM 0 HA LYS A 130 19.837 5.497 -1.268 1.00 0.00 H new ATOM 0 HB2 LYS A 130 21.733 6.448 -2.786 1.00 0.00 H new ATOM 0 HB3 LYS A 130 20.512 6.520 -4.042 1.00 0.00 H new ATOM 0 HG2 LYS A 130 19.564 8.373 -3.168 1.00 0.00 H new ATOM 0 HG3 LYS A 130 19.555 7.712 -1.544 1.00 0.00 H new ATOM 0 HD2 LYS A 130 22.244 8.457 -2.579 1.00 0.00 H new ATOM 0 HD3 LYS A 130 21.138 9.799 -2.367 1.00 0.00 H new ATOM 0 HE2 LYS A 130 20.663 8.731 -0.016 1.00 0.00 H new ATOM 0 HE3 LYS A 130 22.153 7.851 -0.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 22.552 9.896 0.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 23.311 9.961 -0.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 21.866 10.814 -0.335 1.00 0.00 H new ATOM 2055 N ASN A 131 18.408 4.217 -3.853 1.00 0.00 N ATOM 2056 CA ASN A 131 17.127 3.979 -4.509 1.00 0.00 C ATOM 2057 C ASN A 131 16.322 2.904 -3.782 1.00 0.00 C ATOM 2058 O ASN A 131 15.097 2.985 -3.701 1.00 0.00 O ATOM 2059 CB ASN A 131 17.347 3.567 -5.965 1.00 0.00 C ATOM 2060 CG ASN A 131 17.383 4.757 -6.904 1.00 0.00 C ATOM 2061 OD1 ASN A 131 16.398 5.482 -7.044 1.00 0.00 O ATOM 2062 ND2 ASN A 131 18.522 4.965 -7.554 1.00 0.00 N ATOM 0 H ASN A 131 19.156 3.588 -4.146 1.00 0.00 H new ATOM 0 HA ASN A 131 16.559 4.909 -4.479 1.00 0.00 H new ATOM 0 HB2 ASN A 131 18.284 3.015 -6.046 1.00 0.00 H new ATOM 0 HB3 ASN A 131 16.550 2.889 -6.272 1.00 0.00 H new ATOM 0 HD21 ASN A 131 18.605 5.751 -8.199 1.00 0.00 H new ATOM 0 HD22 ASN A 131 19.314 4.339 -7.408 1.00 0.00 H new ATOM 2069 N TYR A 132 17.015 1.896 -3.260 1.00 0.00 N ATOM 2070 CA TYR A 132 16.354 0.805 -2.550 1.00 0.00 C ATOM 2071 C TYR A 132 16.505 0.960 -1.038 1.00 0.00 C ATOM 2072 O TYR A 132 17.365 1.700 -0.563 1.00 0.00 O ATOM 2073 CB TYR A 132 16.924 -0.546 -2.995 1.00 0.00 C ATOM 2074 CG TYR A 132 17.236 -0.628 -4.476 1.00 0.00 C ATOM 2075 CD1 TYR A 132 16.509 0.108 -5.405 1.00 0.00 C ATOM 2076 CD2 TYR A 132 18.260 -1.443 -4.942 1.00 0.00 C ATOM 2077 CE1 TYR A 132 16.794 0.033 -6.755 1.00 0.00 C ATOM 2078 CE2 TYR A 132 18.551 -1.522 -6.291 1.00 0.00 C ATOM 2079 CZ TYR A 132 17.815 -0.782 -7.193 1.00 0.00 C ATOM 2080 OH TYR A 132 18.103 -0.859 -8.536 1.00 0.00 O ATOM 0 H TYR A 132 18.030 1.812 -3.315 1.00 0.00 H new ATOM 0 HA TYR A 132 15.293 0.843 -2.795 1.00 0.00 H new ATOM 0 HB2 TYR A 132 17.835 -0.748 -2.431 1.00 0.00 H new ATOM 0 HB3 TYR A 132 16.211 -1.331 -2.741 1.00 0.00 H new ATOM 0 HD1 TYR A 132 15.708 0.749 -5.066 1.00 0.00 H new ATOM 0 HD2 TYR A 132 18.838 -2.024 -4.239 1.00 0.00 H new ATOM 0 HE1 TYR A 132 16.219 0.611 -7.464 1.00 0.00 H new ATOM 0 HE2 TYR A 132 19.351 -2.160 -6.637 1.00 0.00 H new ATOM 0 HH TYR A 132 18.851 -1.477 -8.675 1.00 0.00 H new ATOM 2090 N GLN A 133 15.660 0.256 -0.289 1.00 0.00 N ATOM 2091 CA GLN A 133 15.695 0.314 1.169 1.00 0.00 C ATOM 2092 C GLN A 133 15.519 -1.078 1.774 1.00 0.00 C ATOM 2093 O GLN A 133 14.822 -1.924 1.215 1.00 0.00 O ATOM 2094 CB GLN A 133 14.606 1.256 1.687 1.00 0.00 C ATOM 2095 CG GLN A 133 15.138 2.599 2.159 1.00 0.00 C ATOM 2096 CD GLN A 133 16.227 2.460 3.204 1.00 0.00 C ATOM 2097 OE1 GLN A 133 16.025 1.549 4.149 1.00 0.00 O flip ATOM 2098 NE2 GLN A 133 17.237 3.162 3.163 1.00 0.00 N flip ATOM 0 H GLN A 133 14.942 -0.362 -0.668 1.00 0.00 H new ATOM 0 HA GLN A 133 16.669 0.698 1.472 1.00 0.00 H new ATOM 0 HB2 GLN A 133 13.874 1.422 0.896 1.00 0.00 H new ATOM 0 HB3 GLN A 133 14.081 0.773 2.511 1.00 0.00 H new ATOM 0 HG2 GLN A 133 15.528 3.152 1.304 1.00 0.00 H new ATOM 0 HG3 GLN A 133 14.317 3.186 2.571 1.00 0.00 H new ATOM 0 HE21 GLN A 133 17.350 3.850 2.418 1.00 0.00 H new ATOM 0 HE22 GLN A 133 17.961 3.056 3.874 1.00 0.00 H new ATOM 2107 N PHE A 134 16.155 -1.306 2.919 1.00 0.00 N ATOM 2108 CA PHE A 134 16.072 -2.594 3.602 1.00 0.00 C ATOM 2109 C PHE A 134 14.757 -2.724 4.363 1.00 0.00 C ATOM 2110 O PHE A 134 14.382 -1.840 5.132 1.00 0.00 O ATOM 2111 CB PHE A 134 17.245 -2.766 4.572 1.00 0.00 C ATOM 2112 CG PHE A 134 18.520 -2.114 4.111 1.00 0.00 C ATOM 2113 CD1 PHE A 134 19.205 -2.600 3.009 1.00 0.00 C ATOM 2114 CD2 PHE A 134 19.033 -1.017 4.785 1.00 0.00 C ATOM 2115 CE1 PHE A 134 20.378 -2.002 2.587 1.00 0.00 C ATOM 2116 CE2 PHE A 134 20.205 -0.416 4.368 1.00 0.00 C ATOM 2117 CZ PHE A 134 20.879 -0.910 3.268 1.00 0.00 C ATOM 0 H PHE A 134 16.735 -0.615 3.395 1.00 0.00 H new ATOM 0 HA PHE A 134 16.117 -3.375 2.843 1.00 0.00 H new ATOM 0 HB2 PHE A 134 16.966 -2.351 5.541 1.00 0.00 H new ATOM 0 HB3 PHE A 134 17.427 -3.830 4.722 1.00 0.00 H new ATOM 0 HD1 PHE A 134 18.819 -3.455 2.474 1.00 0.00 H new ATOM 0 HD2 PHE A 134 18.510 -0.627 5.646 1.00 0.00 H new ATOM 0 HE1 PHE A 134 20.902 -2.389 1.725 1.00 0.00 H new ATOM 0 HE2 PHE A 134 20.594 0.439 4.901 1.00 0.00 H new ATOM 0 HZ PHE A 134 21.796 -0.443 2.941 1.00 0.00 H new ATOM 2127 N PHE A 135 14.067 -3.838 4.147 1.00 0.00 N ATOM 2128 CA PHE A 135 12.795 -4.098 4.816 1.00 0.00 C ATOM 2129 C PHE A 135 12.749 -5.527 5.346 1.00 0.00 C ATOM 2130 O PHE A 135 13.116 -6.470 4.647 1.00 0.00 O ATOM 2131 CB PHE A 135 11.626 -3.864 3.856 1.00 0.00 C ATOM 2132 CG PHE A 135 11.236 -2.421 3.719 1.00 0.00 C ATOM 2133 CD1 PHE A 135 11.970 -1.561 2.917 1.00 0.00 C ATOM 2134 CD2 PHE A 135 10.131 -1.923 4.392 1.00 0.00 C ATOM 2135 CE1 PHE A 135 11.610 -0.234 2.788 1.00 0.00 C ATOM 2136 CE2 PHE A 135 9.766 -0.596 4.266 1.00 0.00 C ATOM 2137 CZ PHE A 135 10.507 0.250 3.463 1.00 0.00 C ATOM 0 H PHE A 135 14.367 -4.578 3.512 1.00 0.00 H new ATOM 0 HA PHE A 135 12.707 -3.408 5.655 1.00 0.00 H new ATOM 0 HB2 PHE A 135 11.891 -4.254 2.873 1.00 0.00 H new ATOM 0 HB3 PHE A 135 10.763 -4.433 4.203 1.00 0.00 H new ATOM 0 HD1 PHE A 135 12.834 -1.933 2.387 1.00 0.00 H new ATOM 0 HD2 PHE A 135 9.549 -2.579 5.022 1.00 0.00 H new ATOM 0 HE1 PHE A 135 12.191 0.425 2.160 1.00 0.00 H new ATOM 0 HE2 PHE A 135 8.902 -0.220 4.795 1.00 0.00 H new ATOM 0 HZ PHE A 135 10.224 1.288 3.364 1.00 0.00 H new ATOM 2147 N ILE A 136 12.296 -5.683 6.585 1.00 0.00 N ATOM 2148 CA ILE A 136 12.205 -7.000 7.203 1.00 0.00 C ATOM 2149 C ILE A 136 10.782 -7.288 7.663 1.00 0.00 C ATOM 2150 O ILE A 136 9.974 -6.372 7.823 1.00 0.00 O ATOM 2151 CB ILE A 136 13.154 -7.137 8.415 1.00 0.00 C ATOM 2152 CG1 ILE A 136 14.316 -6.144 8.315 1.00 0.00 C ATOM 2153 CG2 ILE A 136 13.676 -8.563 8.522 1.00 0.00 C ATOM 2154 CD1 ILE A 136 15.303 -6.245 9.458 1.00 0.00 C ATOM 0 H ILE A 136 11.987 -4.915 7.180 1.00 0.00 H new ATOM 0 HA ILE A 136 12.502 -7.720 6.441 1.00 0.00 H new ATOM 0 HB ILE A 136 12.589 -6.905 9.318 1.00 0.00 H new ATOM 0 HG12 ILE A 136 14.843 -6.309 7.376 1.00 0.00 H new ATOM 0 HG13 ILE A 136 13.915 -5.131 8.282 1.00 0.00 H new ATOM 0 HG21 ILE A 136 14.343 -8.643 9.380 1.00 0.00 H new ATOM 0 HG22 ILE A 136 12.838 -9.249 8.648 1.00 0.00 H new ATOM 0 HG23 ILE A 136 14.221 -8.820 7.614 1.00 0.00 H new ATOM 0 HD11 ILE A 136 16.097 -5.512 9.319 1.00 0.00 H new ATOM 0 HD12 ILE A 136 14.790 -6.050 10.400 1.00 0.00 H new ATOM 0 HD13 ILE A 136 15.733 -7.246 9.480 1.00 0.00 H new ATOM 2166 N GLY A 137 10.481 -8.563 7.880 1.00 0.00 N ATOM 2167 CA GLY A 137 9.154 -8.942 8.325 1.00 0.00 C ATOM 2168 C GLY A 137 8.805 -8.334 9.669 1.00 0.00 C ATOM 2169 O GLY A 137 9.451 -7.387 10.117 1.00 0.00 O ATOM 0 H GLY A 137 11.131 -9.339 7.756 1.00 0.00 H new ATOM 0 HA2 GLY A 137 8.420 -8.626 7.584 1.00 0.00 H new ATOM 0 HA3 GLY A 137 9.092 -10.028 8.392 1.00 0.00 H new ATOM 2173 N GLU A 138 7.779 -8.878 10.313 1.00 0.00 N ATOM 2174 CA GLU A 138 7.341 -8.388 11.609 1.00 0.00 C ATOM 2175 C GLU A 138 8.326 -8.770 12.716 1.00 0.00 C ATOM 2176 O GLU A 138 8.201 -8.310 13.851 1.00 0.00 O ATOM 2177 CB GLU A 138 5.957 -8.949 11.929 1.00 0.00 C ATOM 2178 CG GLU A 138 5.916 -10.467 12.000 1.00 0.00 C ATOM 2179 CD GLU A 138 4.579 -11.035 11.566 1.00 0.00 C ATOM 2180 OE1 GLU A 138 3.956 -10.455 10.651 1.00 0.00 O ATOM 2181 OE2 GLU A 138 4.155 -12.060 12.141 1.00 0.00 O ATOM 0 H GLU A 138 7.234 -9.662 9.954 1.00 0.00 H new ATOM 0 HA GLU A 138 7.297 -7.300 11.562 1.00 0.00 H new ATOM 0 HB2 GLU A 138 5.620 -8.540 12.881 1.00 0.00 H new ATOM 0 HB3 GLU A 138 5.252 -8.610 11.169 1.00 0.00 H new ATOM 0 HG2 GLU A 138 6.703 -10.878 11.368 1.00 0.00 H new ATOM 0 HG3 GLU A 138 6.128 -10.785 13.021 1.00 0.00 H new ATOM 2188 N ASN A 139 9.298 -9.617 12.386 1.00 0.00 N ATOM 2189 CA ASN A 139 10.288 -10.059 13.361 1.00 0.00 C ATOM 2190 C ASN A 139 11.562 -9.219 13.288 1.00 0.00 C ATOM 2191 O ASN A 139 12.200 -8.958 14.308 1.00 0.00 O ATOM 2192 CB ASN A 139 10.624 -11.532 13.137 1.00 0.00 C ATOM 2193 CG ASN A 139 9.706 -12.460 13.908 1.00 0.00 C ATOM 2194 OD1 ASN A 139 9.829 -12.605 15.125 1.00 0.00 O ATOM 2195 ND2 ASN A 139 8.778 -13.095 13.202 1.00 0.00 N ATOM 0 H ASN A 139 9.420 -10.010 11.453 1.00 0.00 H new ATOM 0 HA ASN A 139 9.857 -9.931 14.354 1.00 0.00 H new ATOM 0 HB2 ASN A 139 10.555 -11.759 12.073 1.00 0.00 H new ATOM 0 HB3 ASN A 139 11.656 -11.716 13.436 1.00 0.00 H new ATOM 0 HD21 ASN A 139 8.131 -13.733 13.666 1.00 0.00 H new ATOM 0 HD22 ASN A 139 8.712 -12.945 12.195 1.00 0.00 H new ATOM 2202 N MET A 140 11.931 -8.801 12.080 1.00 0.00 N ATOM 2203 CA MET A 140 13.130 -7.995 11.887 1.00 0.00 C ATOM 2204 C MET A 140 14.374 -8.726 12.388 1.00 0.00 C ATOM 2205 O MET A 140 15.255 -8.121 12.999 1.00 0.00 O ATOM 2206 CB MET A 140 12.992 -6.654 12.604 1.00 0.00 C ATOM 2207 CG MET A 140 12.013 -5.705 11.933 1.00 0.00 C ATOM 2208 SD MET A 140 12.427 -3.972 12.210 1.00 0.00 S ATOM 2209 CE MET A 140 13.180 -3.550 10.640 1.00 0.00 C ATOM 0 H MET A 140 11.418 -9.007 11.223 1.00 0.00 H new ATOM 0 HA MET A 140 13.243 -7.819 10.817 1.00 0.00 H new ATOM 0 HB2 MET A 140 12.669 -6.831 13.630 1.00 0.00 H new ATOM 0 HB3 MET A 140 13.971 -6.177 12.656 1.00 0.00 H new ATOM 0 HG2 MET A 140 11.996 -5.904 10.861 1.00 0.00 H new ATOM 0 HG3 MET A 140 11.009 -5.899 12.309 1.00 0.00 H new ATOM 0 HE1 MET A 140 13.119 -2.473 10.485 1.00 0.00 H new ATOM 0 HE2 MET A 140 14.226 -3.857 10.644 1.00 0.00 H new ATOM 0 HE3 MET A 140 12.654 -4.063 9.835 1.00 0.00 H new ATOM 2219 N ASN A 141 14.444 -10.027 12.121 1.00 0.00 N ATOM 2220 CA ASN A 141 15.584 -10.827 12.542 1.00 0.00 C ATOM 2221 C ASN A 141 16.829 -10.450 11.745 1.00 0.00 C ATOM 2222 O ASN A 141 16.865 -10.614 10.525 1.00 0.00 O ATOM 2223 CB ASN A 141 15.292 -12.318 12.359 1.00 0.00 C ATOM 2224 CG ASN A 141 13.839 -12.677 12.608 1.00 0.00 C ATOM 2225 OD1 ASN A 141 13.043 -12.698 11.545 1.00 0.00 O flip ATOM 2226 ND2 ASN A 141 13.440 -12.939 13.742 1.00 0.00 N flip ATOM 0 H ASN A 141 13.726 -10.546 11.616 1.00 0.00 H new ATOM 0 HA ASN A 141 15.763 -10.626 13.598 1.00 0.00 H new ATOM 0 HB2 ASN A 141 15.564 -12.613 11.346 1.00 0.00 H new ATOM 0 HB3 ASN A 141 15.923 -12.891 13.038 1.00 0.00 H new ATOM 0 HD21 ASN A 141 14.087 -12.910 14.530 1.00 0.00 H new ATOM 0 HD22 ASN A 141 12.462 -13.185 13.894 1.00 0.00 H new ATOM 2233 N PRO A 142 17.876 -9.944 12.419 1.00 0.00 N ATOM 2234 CA PRO A 142 19.121 -9.556 11.755 1.00 0.00 C ATOM 2235 C PRO A 142 19.803 -10.746 11.093 1.00 0.00 C ATOM 2236 O PRO A 142 20.576 -10.587 10.147 1.00 0.00 O ATOM 2237 CB PRO A 142 19.999 -9.007 12.885 1.00 0.00 C ATOM 2238 CG PRO A 142 19.078 -8.768 14.033 1.00 0.00 C ATOM 2239 CD PRO A 142 17.930 -9.719 13.871 1.00 0.00 C ATOM 0 HA PRO A 142 18.942 -8.832 10.960 1.00 0.00 H new ATOM 0 HB2 PRO A 142 20.782 -9.717 13.152 1.00 0.00 H new ATOM 0 HB3 PRO A 142 20.495 -8.085 12.582 1.00 0.00 H new ATOM 0 HG2 PRO A 142 19.589 -8.937 14.981 1.00 0.00 H new ATOM 0 HG3 PRO A 142 18.727 -7.736 14.039 1.00 0.00 H new ATOM 0 HD2 PRO A 142 18.098 -10.648 14.416 1.00 0.00 H new ATOM 0 HD3 PRO A 142 16.999 -9.293 14.247 1.00 0.00 H new ATOM 2247 N ASP A 143 19.510 -11.940 11.596 1.00 0.00 N ATOM 2248 CA ASP A 143 20.089 -13.161 11.055 1.00 0.00 C ATOM 2249 C ASP A 143 19.282 -13.659 9.862 1.00 0.00 C ATOM 2250 O ASP A 143 19.747 -14.501 9.093 1.00 0.00 O ATOM 2251 CB ASP A 143 20.146 -14.239 12.135 1.00 0.00 C ATOM 2252 CG ASP A 143 21.063 -15.386 11.760 1.00 0.00 C ATOM 2253 OD1 ASP A 143 22.204 -15.118 11.328 1.00 0.00 O ATOM 2254 OD2 ASP A 143 20.639 -16.553 11.896 1.00 0.00 O ATOM 0 H ASP A 143 18.873 -12.087 12.379 1.00 0.00 H new ATOM 0 HA ASP A 143 21.102 -12.940 10.718 1.00 0.00 H new ATOM 0 HB2 ASP A 143 20.488 -13.795 13.070 1.00 0.00 H new ATOM 0 HB3 ASP A 143 19.142 -14.624 12.314 1.00 0.00 H new ATOM 2259 N GLY A 144 18.071 -13.131 9.711 1.00 0.00 N ATOM 2260 CA GLY A 144 17.222 -13.533 8.606 1.00 0.00 C ATOM 2261 C GLY A 144 17.681 -12.948 7.285 1.00 0.00 C ATOM 2262 O GLY A 144 18.874 -12.943 6.983 1.00 0.00 O ATOM 0 H GLY A 144 17.664 -12.433 10.334 1.00 0.00 H new ATOM 0 HA2 GLY A 144 17.212 -14.621 8.535 1.00 0.00 H new ATOM 0 HA3 GLY A 144 16.198 -13.217 8.804 1.00 0.00 H new ATOM 2266 N MET A 145 16.733 -12.452 6.497 1.00 0.00 N ATOM 2267 CA MET A 145 17.049 -11.859 5.202 1.00 0.00 C ATOM 2268 C MET A 145 16.598 -10.403 5.151 1.00 0.00 C ATOM 2269 O MET A 145 16.117 -9.856 6.143 1.00 0.00 O ATOM 2270 CB MET A 145 16.384 -12.653 4.076 1.00 0.00 C ATOM 2271 CG MET A 145 14.865 -12.600 4.106 1.00 0.00 C ATOM 2272 SD MET A 145 14.123 -13.042 2.522 1.00 0.00 S ATOM 2273 CE MET A 145 15.113 -14.463 2.067 1.00 0.00 C ATOM 0 H MET A 145 15.740 -12.449 6.732 1.00 0.00 H new ATOM 0 HA MET A 145 18.130 -11.892 5.067 1.00 0.00 H new ATOM 0 HB2 MET A 145 16.733 -12.269 3.117 1.00 0.00 H new ATOM 0 HB3 MET A 145 16.704 -13.693 4.139 1.00 0.00 H new ATOM 0 HG2 MET A 145 14.497 -13.277 4.877 1.00 0.00 H new ATOM 0 HG3 MET A 145 14.546 -11.596 4.385 1.00 0.00 H new ATOM 0 HE1 MET A 145 14.612 -15.017 1.273 1.00 0.00 H new ATOM 0 HE2 MET A 145 16.089 -14.129 1.716 1.00 0.00 H new ATOM 0 HE3 MET A 145 15.242 -15.110 2.935 1.00 0.00 H new ATOM 2283 N VAL A 146 16.756 -9.779 3.988 1.00 0.00 N ATOM 2284 CA VAL A 146 16.364 -8.386 3.813 1.00 0.00 C ATOM 2285 C VAL A 146 15.480 -8.209 2.585 1.00 0.00 C ATOM 2286 O VAL A 146 15.666 -8.879 1.569 1.00 0.00 O ATOM 2287 CB VAL A 146 17.592 -7.462 3.683 1.00 0.00 C ATOM 2288 CG1 VAL A 146 17.164 -6.009 3.547 1.00 0.00 C ATOM 2289 CG2 VAL A 146 18.514 -7.639 4.875 1.00 0.00 C ATOM 0 H VAL A 146 17.152 -10.215 3.155 1.00 0.00 H new ATOM 0 HA VAL A 146 15.803 -8.108 4.705 1.00 0.00 H new ATOM 0 HB VAL A 146 18.136 -7.739 2.780 1.00 0.00 H new ATOM 0 HG11 VAL A 146 18.047 -5.376 3.457 1.00 0.00 H new ATOM 0 HG12 VAL A 146 16.543 -5.894 2.658 1.00 0.00 H new ATOM 0 HG13 VAL A 146 16.595 -5.713 4.428 1.00 0.00 H new ATOM 0 HG21 VAL A 146 19.376 -6.980 4.769 1.00 0.00 H new ATOM 0 HG22 VAL A 146 17.977 -7.390 5.790 1.00 0.00 H new ATOM 0 HG23 VAL A 146 18.852 -8.674 4.923 1.00 0.00 H new ATOM 2299 N ALA A 147 14.525 -7.295 2.686 1.00 0.00 N ATOM 2300 CA ALA A 147 13.615 -7.013 1.587 1.00 0.00 C ATOM 2301 C ALA A 147 13.881 -5.628 1.022 1.00 0.00 C ATOM 2302 O ALA A 147 13.753 -4.622 1.720 1.00 0.00 O ATOM 2303 CB ALA A 147 12.169 -7.141 2.041 1.00 0.00 C ATOM 0 H ALA A 147 14.361 -6.734 3.522 1.00 0.00 H new ATOM 0 HA ALA A 147 13.788 -7.745 0.798 1.00 0.00 H new ATOM 0 HB1 ALA A 147 11.505 -6.926 1.204 1.00 0.00 H new ATOM 0 HB2 ALA A 147 11.988 -8.155 2.397 1.00 0.00 H new ATOM 0 HB3 ALA A 147 11.977 -6.434 2.848 1.00 0.00 H new ATOM 2309 N LEU A 148 14.268 -5.586 -0.242 1.00 0.00 N ATOM 2310 CA LEU A 148 14.577 -4.333 -0.907 1.00 0.00 C ATOM 2311 C LEU A 148 13.350 -3.758 -1.603 1.00 0.00 C ATOM 2312 O LEU A 148 12.906 -4.272 -2.629 1.00 0.00 O ATOM 2313 CB LEU A 148 15.708 -4.562 -1.904 1.00 0.00 C ATOM 2314 CG LEU A 148 16.913 -5.303 -1.317 1.00 0.00 C ATOM 2315 CD1 LEU A 148 17.653 -6.080 -2.393 1.00 0.00 C ATOM 2316 CD2 LEU A 148 17.850 -4.326 -0.624 1.00 0.00 C ATOM 0 H LEU A 148 14.376 -6.412 -0.831 1.00 0.00 H new ATOM 0 HA LEU A 148 14.894 -3.605 -0.160 1.00 0.00 H new ATOM 0 HB2 LEU A 148 15.323 -5.129 -2.751 1.00 0.00 H new ATOM 0 HB3 LEU A 148 16.040 -3.598 -2.290 1.00 0.00 H new ATOM 0 HG LEU A 148 16.546 -6.017 -0.579 1.00 0.00 H new ATOM 0 HD11 LEU A 148 18.504 -6.596 -1.949 1.00 0.00 H new ATOM 0 HD12 LEU A 148 16.980 -6.810 -2.843 1.00 0.00 H new ATOM 0 HD13 LEU A 148 18.007 -5.392 -3.161 1.00 0.00 H new ATOM 0 HD21 LEU A 148 18.701 -4.868 -0.212 1.00 0.00 H new ATOM 0 HD22 LEU A 148 18.204 -3.588 -1.344 1.00 0.00 H new ATOM 0 HD23 LEU A 148 17.318 -3.821 0.182 1.00 0.00 H new ATOM 2328 N LEU A 149 12.808 -2.684 -1.036 1.00 0.00 N ATOM 2329 CA LEU A 149 11.632 -2.033 -1.599 1.00 0.00 C ATOM 2330 C LEU A 149 12.041 -0.987 -2.628 1.00 0.00 C ATOM 2331 O LEU A 149 12.768 -0.044 -2.318 1.00 0.00 O ATOM 2332 CB LEU A 149 10.798 -1.387 -0.487 1.00 0.00 C ATOM 2333 CG LEU A 149 9.689 -0.439 -0.960 1.00 0.00 C ATOM 2334 CD1 LEU A 149 8.358 -1.170 -1.053 1.00 0.00 C ATOM 2335 CD2 LEU A 149 9.583 0.757 -0.026 1.00 0.00 C ATOM 0 H LEU A 149 13.166 -2.247 -0.187 1.00 0.00 H new ATOM 0 HA LEU A 149 11.025 -2.789 -2.097 1.00 0.00 H new ATOM 0 HB2 LEU A 149 10.345 -2.178 0.110 1.00 0.00 H new ATOM 0 HB3 LEU A 149 11.468 -0.834 0.172 1.00 0.00 H new ATOM 0 HG LEU A 149 9.945 -0.078 -1.956 1.00 0.00 H new ATOM 0 HD11 LEU A 149 7.586 -0.478 -1.390 1.00 0.00 H new ATOM 0 HD12 LEU A 149 8.444 -1.993 -1.763 1.00 0.00 H new ATOM 0 HD13 LEU A 149 8.090 -1.563 -0.072 1.00 0.00 H new ATOM 0 HD21 LEU A 149 8.792 1.421 -0.374 1.00 0.00 H new ATOM 0 HD22 LEU A 149 9.350 0.412 0.982 1.00 0.00 H new ATOM 0 HD23 LEU A 149 10.531 1.296 -0.015 1.00 0.00 H new ATOM 2347 N ASP A 150 11.569 -1.170 -3.854 1.00 0.00 N ATOM 2348 CA ASP A 150 11.881 -0.252 -4.940 1.00 0.00 C ATOM 2349 C ASP A 150 10.609 0.335 -5.544 1.00 0.00 C ATOM 2350 O ASP A 150 9.580 -0.336 -5.621 1.00 0.00 O ATOM 2351 CB ASP A 150 12.689 -0.979 -6.015 1.00 0.00 C ATOM 2352 CG ASP A 150 14.041 -1.441 -5.513 1.00 0.00 C ATOM 2353 OD1 ASP A 150 14.278 -1.368 -4.289 1.00 0.00 O ATOM 2354 OD2 ASP A 150 14.864 -1.879 -6.345 1.00 0.00 O ATOM 0 H ASP A 150 10.967 -1.949 -4.121 1.00 0.00 H new ATOM 0 HA ASP A 150 12.473 0.570 -4.538 1.00 0.00 H new ATOM 0 HB2 ASP A 150 12.123 -1.841 -6.369 1.00 0.00 H new ATOM 0 HB3 ASP A 150 12.829 -0.317 -6.869 1.00 0.00 H new ATOM 2359 N TYR A 151 10.687 1.593 -5.968 1.00 0.00 N ATOM 2360 CA TYR A 151 9.541 2.273 -6.564 1.00 0.00 C ATOM 2361 C TYR A 151 9.651 2.295 -8.085 1.00 0.00 C ATOM 2362 O TYR A 151 10.715 2.578 -8.636 1.00 0.00 O ATOM 2363 CB TYR A 151 9.436 3.702 -6.029 1.00 0.00 C ATOM 2364 CG TYR A 151 9.059 3.777 -4.566 1.00 0.00 C ATOM 2365 CD1 TYR A 151 7.803 3.375 -4.131 1.00 0.00 C ATOM 2366 CD2 TYR A 151 9.960 4.249 -3.620 1.00 0.00 C ATOM 2367 CE1 TYR A 151 7.456 3.442 -2.795 1.00 0.00 C ATOM 2368 CE2 TYR A 151 9.621 4.320 -2.283 1.00 0.00 C ATOM 2369 CZ TYR A 151 8.367 3.915 -1.876 1.00 0.00 C ATOM 2370 OH TYR A 151 8.025 3.984 -0.545 1.00 0.00 O ATOM 0 H TYR A 151 11.531 2.162 -5.910 1.00 0.00 H new ATOM 0 HA TYR A 151 8.641 1.722 -6.291 1.00 0.00 H new ATOM 0 HB2 TYR A 151 10.391 4.206 -6.175 1.00 0.00 H new ATOM 0 HB3 TYR A 151 8.695 4.246 -6.614 1.00 0.00 H new ATOM 0 HD1 TYR A 151 7.086 3.004 -4.848 1.00 0.00 H new ATOM 0 HD2 TYR A 151 10.943 4.566 -3.936 1.00 0.00 H new ATOM 0 HE1 TYR A 151 6.475 3.125 -2.473 1.00 0.00 H new ATOM 0 HE2 TYR A 151 10.333 4.690 -1.561 1.00 0.00 H new ATOM 0 HH TYR A 151 8.780 4.338 -0.031 1.00 0.00 H new ATOM 2380 N ARG A 152 8.546 1.995 -8.758 1.00 0.00 N ATOM 2381 CA ARG A 152 8.518 1.982 -10.217 1.00 0.00 C ATOM 2382 C ARG A 152 8.853 3.359 -10.781 1.00 0.00 C ATOM 2383 O ARG A 152 9.125 4.299 -10.032 1.00 0.00 O ATOM 2384 CB ARG A 152 7.145 1.531 -10.718 1.00 0.00 C ATOM 2385 CG ARG A 152 6.923 0.031 -10.619 1.00 0.00 C ATOM 2386 CD ARG A 152 7.139 -0.655 -11.958 1.00 0.00 C ATOM 2387 NE ARG A 152 6.297 -0.083 -13.007 1.00 0.00 N ATOM 2388 CZ ARG A 152 4.980 -0.263 -13.081 1.00 0.00 C ATOM 2389 NH1 ARG A 152 4.351 -0.996 -12.171 1.00 0.00 N ATOM 2390 NH2 ARG A 152 4.290 0.290 -14.069 1.00 0.00 N ATOM 0 H ARG A 152 7.657 1.757 -8.317 1.00 0.00 H new ATOM 0 HA ARG A 152 9.272 1.276 -10.563 1.00 0.00 H new ATOM 0 HB2 ARG A 152 6.372 2.043 -10.144 1.00 0.00 H new ATOM 0 HB3 ARG A 152 7.027 1.839 -11.757 1.00 0.00 H new ATOM 0 HG2 ARG A 152 7.604 -0.390 -9.879 1.00 0.00 H new ATOM 0 HG3 ARG A 152 5.910 -0.165 -10.268 1.00 0.00 H new ATOM 0 HD2 ARG A 152 8.187 -0.567 -12.246 1.00 0.00 H new ATOM 0 HD3 ARG A 152 6.923 -1.719 -11.860 1.00 0.00 H new ATOM 0 HE ARG A 152 6.745 0.487 -13.724 1.00 0.00 H new ATOM 0 HH11 ARG A 152 4.877 -1.425 -11.410 1.00 0.00 H new ATOM 0 HH12 ARG A 152 3.342 -1.130 -12.233 1.00 0.00 H new ATOM 0 HH21 ARG A 152 4.768 0.853 -14.772 1.00 0.00 H new ATOM 0 HH22 ARG A 152 3.281 0.152 -14.126 1.00 0.00 H new ATOM 2404 N GLU A 153 8.830 3.473 -12.105 1.00 0.00 N ATOM 2405 CA GLU A 153 9.131 4.736 -12.769 1.00 0.00 C ATOM 2406 C GLU A 153 8.158 5.827 -12.335 1.00 0.00 C ATOM 2407 O GLU A 153 8.552 6.970 -12.108 1.00 0.00 O ATOM 2408 CB GLU A 153 9.077 4.564 -14.288 1.00 0.00 C ATOM 2409 CG GLU A 153 9.418 5.831 -15.055 1.00 0.00 C ATOM 2410 CD GLU A 153 9.108 5.717 -16.535 1.00 0.00 C ATOM 2411 OE1 GLU A 153 7.916 5.584 -16.884 1.00 0.00 O ATOM 2412 OE2 GLU A 153 10.057 5.762 -17.346 1.00 0.00 O ATOM 0 H GLU A 153 8.606 2.706 -12.739 1.00 0.00 H new ATOM 0 HA GLU A 153 10.138 5.037 -12.479 1.00 0.00 H new ATOM 0 HB2 GLU A 153 9.769 3.774 -14.581 1.00 0.00 H new ATOM 0 HB3 GLU A 153 8.078 4.234 -14.573 1.00 0.00 H new ATOM 0 HG2 GLU A 153 8.860 6.668 -14.634 1.00 0.00 H new ATOM 0 HG3 GLU A 153 10.477 6.056 -14.925 1.00 0.00 H new ATOM 2419 N ASP A 154 6.884 5.464 -12.223 1.00 0.00 N ATOM 2420 CA ASP A 154 5.853 6.412 -11.817 1.00 0.00 C ATOM 2421 C ASP A 154 5.884 6.653 -10.308 1.00 0.00 C ATOM 2422 O ASP A 154 5.289 7.609 -9.813 1.00 0.00 O ATOM 2423 CB ASP A 154 4.473 5.902 -12.234 1.00 0.00 C ATOM 2424 CG ASP A 154 3.382 6.928 -11.999 1.00 0.00 C ATOM 2425 OD1 ASP A 154 3.707 8.130 -11.901 1.00 0.00 O ATOM 2426 OD2 ASP A 154 2.201 6.530 -11.914 1.00 0.00 O ATOM 0 H ASP A 154 6.541 4.521 -12.408 1.00 0.00 H new ATOM 0 HA ASP A 154 6.054 7.359 -12.317 1.00 0.00 H new ATOM 0 HB2 ASP A 154 4.492 5.632 -13.290 1.00 0.00 H new ATOM 0 HB3 ASP A 154 4.241 4.994 -11.677 1.00 0.00 H new ATOM 2431 N GLY A 155 6.579 5.781 -9.581 1.00 0.00 N ATOM 2432 CA GLY A 155 6.668 5.925 -8.139 1.00 0.00 C ATOM 2433 C GLY A 155 5.338 5.693 -7.449 1.00 0.00 C ATOM 2434 O GLY A 155 5.104 6.199 -6.352 1.00 0.00 O ATOM 0 H GLY A 155 7.080 4.980 -9.964 1.00 0.00 H new ATOM 0 HA2 GLY A 155 7.403 5.219 -7.751 1.00 0.00 H new ATOM 0 HA3 GLY A 155 7.029 6.925 -7.899 1.00 0.00 H new ATOM 2438 N VAL A 156 4.465 4.926 -8.094 1.00 0.00 N ATOM 2439 CA VAL A 156 3.151 4.627 -7.539 1.00 0.00 C ATOM 2440 C VAL A 156 3.055 3.163 -7.122 1.00 0.00 C ATOM 2441 O VAL A 156 2.426 2.833 -6.117 1.00 0.00 O ATOM 2442 CB VAL A 156 2.032 4.939 -8.554 1.00 0.00 C ATOM 2443 CG1 VAL A 156 0.683 4.442 -8.051 1.00 0.00 C ATOM 2444 CG2 VAL A 156 1.981 6.431 -8.848 1.00 0.00 C ATOM 0 H VAL A 156 4.645 4.500 -9.003 1.00 0.00 H new ATOM 0 HA VAL A 156 3.021 5.260 -6.661 1.00 0.00 H new ATOM 0 HB VAL A 156 2.258 4.412 -9.481 1.00 0.00 H new ATOM 0 HG11 VAL A 156 -0.088 4.675 -8.786 1.00 0.00 H new ATOM 0 HG12 VAL A 156 0.726 3.363 -7.900 1.00 0.00 H new ATOM 0 HG13 VAL A 156 0.444 4.931 -7.107 1.00 0.00 H new ATOM 0 HG21 VAL A 156 1.186 6.633 -9.566 1.00 0.00 H new ATOM 0 HG22 VAL A 156 1.785 6.977 -7.925 1.00 0.00 H new ATOM 0 HG23 VAL A 156 2.936 6.753 -9.264 1.00 0.00 H new ATOM 2454 N THR A 157 3.676 2.288 -7.906 1.00 0.00 N ATOM 2455 CA THR A 157 3.651 0.860 -7.621 1.00 0.00 C ATOM 2456 C THR A 157 4.975 0.393 -7.018 1.00 0.00 C ATOM 2457 O THR A 157 5.930 0.110 -7.742 1.00 0.00 O ATOM 2458 CB THR A 157 3.356 0.072 -8.898 1.00 0.00 C ATOM 2459 OG1 THR A 157 2.101 0.443 -9.438 1.00 0.00 O ATOM 2460 CG2 THR A 157 3.337 -1.426 -8.681 1.00 0.00 C ATOM 0 H THR A 157 4.202 2.543 -8.742 1.00 0.00 H new ATOM 0 HA THR A 157 2.861 0.677 -6.893 1.00 0.00 H new ATOM 0 HB THR A 157 4.167 0.316 -9.584 1.00 0.00 H new ATOM 0 HG1 THR A 157 1.932 -0.071 -10.255 1.00 0.00 H new ATOM 0 HG21 THR A 157 3.122 -1.928 -9.625 1.00 0.00 H new ATOM 0 HG22 THR A 157 4.308 -1.752 -8.309 1.00 0.00 H new ATOM 0 HG23 THR A 157 2.566 -1.678 -7.953 1.00 0.00 H new ATOM 2468 N PRO A 158 5.048 0.299 -5.679 1.00 0.00 N ATOM 2469 CA PRO A 158 6.259 -0.144 -4.986 1.00 0.00 C ATOM 2470 C PRO A 158 6.457 -1.654 -5.081 1.00 0.00 C ATOM 2471 O PRO A 158 5.554 -2.428 -4.766 1.00 0.00 O ATOM 2472 CB PRO A 158 5.998 0.268 -3.537 1.00 0.00 C ATOM 2473 CG PRO A 158 4.517 0.207 -3.398 1.00 0.00 C ATOM 2474 CD PRO A 158 3.957 0.612 -4.735 1.00 0.00 C ATOM 0 HA PRO A 158 7.162 0.290 -5.415 1.00 0.00 H new ATOM 0 HB2 PRO A 158 6.491 -0.406 -2.837 1.00 0.00 H new ATOM 0 HB3 PRO A 158 6.376 1.270 -3.334 1.00 0.00 H new ATOM 0 HG2 PRO A 158 4.192 -0.797 -3.127 1.00 0.00 H new ATOM 0 HG3 PRO A 158 4.171 0.877 -2.611 1.00 0.00 H new ATOM 0 HD2 PRO A 158 3.049 0.058 -4.974 1.00 0.00 H new ATOM 0 HD3 PRO A 158 3.699 1.671 -4.757 1.00 0.00 H new ATOM 2482 N TYR A 159 7.645 -2.067 -5.512 1.00 0.00 N ATOM 2483 CA TYR A 159 7.960 -3.485 -5.642 1.00 0.00 C ATOM 2484 C TYR A 159 9.147 -3.857 -4.761 1.00 0.00 C ATOM 2485 O TYR A 159 10.179 -3.185 -4.778 1.00 0.00 O ATOM 2486 CB TYR A 159 8.240 -3.849 -7.104 1.00 0.00 C ATOM 2487 CG TYR A 159 9.532 -3.283 -7.659 1.00 0.00 C ATOM 2488 CD1 TYR A 159 9.693 -1.916 -7.854 1.00 0.00 C ATOM 2489 CD2 TYR A 159 10.588 -4.122 -8.002 1.00 0.00 C ATOM 2490 CE1 TYR A 159 10.865 -1.402 -8.372 1.00 0.00 C ATOM 2491 CE2 TYR A 159 11.763 -3.614 -8.520 1.00 0.00 C ATOM 2492 CZ TYR A 159 11.897 -2.255 -8.705 1.00 0.00 C ATOM 2493 OH TYR A 159 13.066 -1.745 -9.221 1.00 0.00 O ATOM 0 H TYR A 159 8.405 -1.440 -5.777 1.00 0.00 H new ATOM 0 HA TYR A 159 7.093 -4.056 -5.308 1.00 0.00 H new ATOM 0 HB2 TYR A 159 8.265 -4.935 -7.196 1.00 0.00 H new ATOM 0 HB3 TYR A 159 7.411 -3.496 -7.718 1.00 0.00 H new ATOM 0 HD1 TYR A 159 8.887 -1.245 -7.596 1.00 0.00 H new ATOM 0 HD2 TYR A 159 10.487 -5.188 -7.861 1.00 0.00 H new ATOM 0 HE1 TYR A 159 10.973 -0.337 -8.516 1.00 0.00 H new ATOM 0 HE2 TYR A 159 12.574 -4.279 -8.779 1.00 0.00 H new ATOM 0 HH TYR A 159 13.691 -2.478 -9.401 1.00 0.00 H new ATOM 2503 N MET A 160 8.989 -4.923 -3.983 1.00 0.00 N ATOM 2504 CA MET A 160 10.044 -5.374 -3.084 1.00 0.00 C ATOM 2505 C MET A 160 10.784 -6.580 -3.650 1.00 0.00 C ATOM 2506 O MET A 160 10.168 -7.526 -4.140 1.00 0.00 O ATOM 2507 CB MET A 160 9.458 -5.720 -1.715 1.00 0.00 C ATOM 2508 CG MET A 160 8.566 -4.629 -1.147 1.00 0.00 C ATOM 2509 SD MET A 160 8.456 -4.691 0.651 1.00 0.00 S ATOM 2510 CE MET A 160 10.173 -4.462 1.101 1.00 0.00 C ATOM 0 H MET A 160 8.141 -5.490 -3.957 1.00 0.00 H new ATOM 0 HA MET A 160 10.759 -4.559 -2.977 1.00 0.00 H new ATOM 0 HB2 MET A 160 8.884 -6.643 -1.797 1.00 0.00 H new ATOM 0 HB3 MET A 160 10.273 -5.913 -1.017 1.00 0.00 H new ATOM 0 HG2 MET A 160 8.951 -3.655 -1.451 1.00 0.00 H new ATOM 0 HG3 MET A 160 7.567 -4.724 -1.572 1.00 0.00 H new ATOM 0 HE1 MET A 160 10.449 -5.190 1.864 1.00 0.00 H new ATOM 0 HE2 MET A 160 10.801 -4.602 0.221 1.00 0.00 H new ATOM 0 HE3 MET A 160 10.315 -3.455 1.492 1.00 0.00 H new ATOM 2520 N ILE A 161 12.110 -6.538 -3.572 1.00 0.00 N ATOM 2521 CA ILE A 161 12.944 -7.624 -4.068 1.00 0.00 C ATOM 2522 C ILE A 161 13.209 -8.651 -2.970 1.00 0.00 C ATOM 2523 O ILE A 161 13.888 -8.361 -1.985 1.00 0.00 O ATOM 2524 CB ILE A 161 14.288 -7.091 -4.611 1.00 0.00 C ATOM 2525 CG1 ILE A 161 14.045 -6.158 -5.797 1.00 0.00 C ATOM 2526 CG2 ILE A 161 15.201 -8.241 -5.017 1.00 0.00 C ATOM 2527 CD1 ILE A 161 15.281 -5.407 -6.240 1.00 0.00 C ATOM 0 H ILE A 161 12.631 -5.760 -3.168 1.00 0.00 H new ATOM 0 HA ILE A 161 12.402 -8.105 -4.882 1.00 0.00 H new ATOM 0 HB ILE A 161 14.781 -6.529 -3.818 1.00 0.00 H new ATOM 0 HG12 ILE A 161 13.665 -6.741 -6.635 1.00 0.00 H new ATOM 0 HG13 ILE A 161 13.270 -5.440 -5.531 1.00 0.00 H new ATOM 0 HG21 ILE A 161 16.142 -7.842 -5.396 1.00 0.00 H new ATOM 0 HG22 ILE A 161 15.398 -8.873 -4.151 1.00 0.00 H new ATOM 0 HG23 ILE A 161 14.718 -8.832 -5.795 1.00 0.00 H new ATOM 0 HD11 ILE A 161 15.033 -4.765 -7.085 1.00 0.00 H new ATOM 0 HD12 ILE A 161 15.650 -4.796 -5.416 1.00 0.00 H new ATOM 0 HD13 ILE A 161 16.051 -6.118 -6.538 1.00 0.00 H new ATOM 2539 N PHE A 162 12.667 -9.851 -3.148 1.00 0.00 N ATOM 2540 CA PHE A 162 12.844 -10.922 -2.173 1.00 0.00 C ATOM 2541 C PHE A 162 13.747 -12.019 -2.727 1.00 0.00 C ATOM 2542 O PHE A 162 13.850 -12.199 -3.939 1.00 0.00 O ATOM 2543 CB PHE A 162 11.489 -11.513 -1.778 1.00 0.00 C ATOM 2544 CG PHE A 162 10.711 -10.647 -0.827 1.00 0.00 C ATOM 2545 CD1 PHE A 162 10.926 -10.732 0.539 1.00 0.00 C ATOM 2546 CD2 PHE A 162 9.767 -9.750 -1.300 1.00 0.00 C ATOM 2547 CE1 PHE A 162 10.213 -9.936 1.417 1.00 0.00 C ATOM 2548 CE2 PHE A 162 9.051 -8.952 -0.427 1.00 0.00 C ATOM 2549 CZ PHE A 162 9.275 -9.046 0.933 1.00 0.00 C ATOM 0 H PHE A 162 12.102 -10.107 -3.958 1.00 0.00 H new ATOM 0 HA PHE A 162 13.318 -10.497 -1.288 1.00 0.00 H new ATOM 0 HB2 PHE A 162 10.896 -11.674 -2.678 1.00 0.00 H new ATOM 0 HB3 PHE A 162 11.647 -12.490 -1.321 1.00 0.00 H new ATOM 0 HD1 PHE A 162 11.658 -11.427 0.922 1.00 0.00 H new ATOM 0 HD2 PHE A 162 9.588 -9.673 -2.362 1.00 0.00 H new ATOM 0 HE1 PHE A 162 10.390 -10.011 2.480 1.00 0.00 H new ATOM 0 HE2 PHE A 162 8.318 -8.256 -0.808 1.00 0.00 H new ATOM 0 HZ PHE A 162 8.717 -8.424 1.617 1.00 0.00 H new ATOM 2559 N PHE A 163 14.401 -12.750 -1.829 1.00 0.00 N ATOM 2560 CA PHE A 163 15.298 -13.828 -2.229 1.00 0.00 C ATOM 2561 C PHE A 163 14.573 -15.171 -2.204 1.00 0.00 C ATOM 2562 O PHE A 163 13.976 -15.547 -1.196 1.00 0.00 O ATOM 2563 CB PHE A 163 16.520 -13.867 -1.308 1.00 0.00 C ATOM 2564 CG PHE A 163 17.574 -12.848 -1.652 1.00 0.00 C ATOM 2565 CD1 PHE A 163 17.222 -11.605 -2.160 1.00 0.00 C ATOM 2566 CD2 PHE A 163 18.917 -13.133 -1.467 1.00 0.00 C ATOM 2567 CE1 PHE A 163 18.190 -10.670 -2.476 1.00 0.00 C ATOM 2568 CE2 PHE A 163 19.889 -12.200 -1.782 1.00 0.00 C ATOM 2569 CZ PHE A 163 19.525 -10.968 -2.287 1.00 0.00 C ATOM 0 H PHE A 163 14.326 -12.615 -0.821 1.00 0.00 H new ATOM 0 HA PHE A 163 15.632 -13.638 -3.249 1.00 0.00 H new ATOM 0 HB2 PHE A 163 16.194 -13.706 -0.280 1.00 0.00 H new ATOM 0 HB3 PHE A 163 16.963 -14.862 -1.350 1.00 0.00 H new ATOM 0 HD1 PHE A 163 16.180 -11.366 -2.310 1.00 0.00 H new ATOM 0 HD2 PHE A 163 19.209 -14.095 -1.072 1.00 0.00 H new ATOM 0 HE1 PHE A 163 17.902 -9.707 -2.871 1.00 0.00 H new ATOM 0 HE2 PHE A 163 20.932 -12.436 -1.633 1.00 0.00 H new ATOM 0 HZ PHE A 163 20.283 -10.239 -2.534 1.00 0.00 H new ATOM 2579 N LYS A 164 14.625 -15.886 -3.324 1.00 0.00 N ATOM 2580 CA LYS A 164 13.968 -17.185 -3.437 1.00 0.00 C ATOM 2581 C LYS A 164 14.672 -18.238 -2.587 1.00 0.00 C ATOM 2582 O LYS A 164 14.048 -18.892 -1.751 1.00 0.00 O ATOM 2583 CB LYS A 164 13.933 -17.635 -4.899 1.00 0.00 C ATOM 2584 CG LYS A 164 12.785 -18.578 -5.217 1.00 0.00 C ATOM 2585 CD LYS A 164 12.395 -18.509 -6.686 1.00 0.00 C ATOM 2586 CE LYS A 164 12.850 -19.747 -7.444 1.00 0.00 C ATOM 2587 NZ LYS A 164 14.315 -19.972 -7.313 1.00 0.00 N ATOM 0 H LYS A 164 15.116 -15.588 -4.167 1.00 0.00 H new ATOM 0 HA LYS A 164 12.948 -17.076 -3.069 1.00 0.00 H new ATOM 0 HB2 LYS A 164 13.858 -16.756 -5.539 1.00 0.00 H new ATOM 0 HB3 LYS A 164 14.875 -18.127 -5.142 1.00 0.00 H new ATOM 0 HG2 LYS A 164 13.071 -19.599 -4.963 1.00 0.00 H new ATOM 0 HG3 LYS A 164 11.924 -18.325 -4.599 1.00 0.00 H new ATOM 0 HD2 LYS A 164 11.313 -18.406 -6.772 1.00 0.00 H new ATOM 0 HD3 LYS A 164 12.836 -17.621 -7.139 1.00 0.00 H new ATOM 0 HE2 LYS A 164 12.314 -20.619 -7.069 1.00 0.00 H new ATOM 0 HE3 LYS A 164 12.592 -19.643 -8.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 14.615 -20.706 -7.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 14.822 -19.087 -7.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 14.534 -20.281 -6.344 1.00 0.00 H new ATOM 2601 N ASP A 165 15.974 -18.400 -2.808 1.00 0.00 N ATOM 2602 CA ASP A 165 16.763 -19.380 -2.064 1.00 0.00 C ATOM 2603 C ASP A 165 16.519 -19.259 -0.563 1.00 0.00 C ATOM 2604 O ASP A 165 16.473 -20.260 0.152 1.00 0.00 O ATOM 2605 CB ASP A 165 18.252 -19.196 -2.360 1.00 0.00 C ATOM 2606 CG ASP A 165 18.539 -19.086 -3.845 1.00 0.00 C ATOM 2607 OD1 ASP A 165 18.302 -18.000 -4.416 1.00 0.00 O ATOM 2608 OD2 ASP A 165 18.999 -20.084 -4.437 1.00 0.00 O ATOM 0 H ASP A 165 16.505 -17.866 -3.496 1.00 0.00 H new ATOM 0 HA ASP A 165 16.450 -20.374 -2.385 1.00 0.00 H new ATOM 0 HB2 ASP A 165 18.611 -18.299 -1.856 1.00 0.00 H new ATOM 0 HB3 ASP A 165 18.808 -20.038 -1.947 1.00 0.00 H new ATOM 2613 N GLY A 166 16.360 -18.027 -0.092 1.00 0.00 N ATOM 2614 CA GLY A 166 16.119 -17.798 1.320 1.00 0.00 C ATOM 2615 C GLY A 166 14.643 -17.669 1.640 1.00 0.00 C ATOM 2616 O GLY A 166 14.268 -17.022 2.618 1.00 0.00 O ATOM 0 H GLY A 166 16.394 -17.183 -0.663 1.00 0.00 H new ATOM 0 HA2 GLY A 166 16.543 -18.621 1.896 1.00 0.00 H new ATOM 0 HA3 GLY A 166 16.636 -16.891 1.632 1.00 0.00 H new ATOM 2620 N LEU A 167 13.804 -18.286 0.814 1.00 0.00 N ATOM 2621 CA LEU A 167 12.362 -18.235 1.012 1.00 0.00 C ATOM 2622 C LEU A 167 11.724 -19.585 0.697 1.00 0.00 C ATOM 2623 O LEU A 167 12.178 -20.305 -0.192 1.00 0.00 O ATOM 2624 CB LEU A 167 11.745 -17.148 0.132 1.00 0.00 C ATOM 2625 CG LEU A 167 10.245 -16.920 0.338 1.00 0.00 C ATOM 2626 CD1 LEU A 167 9.994 -15.574 1.005 1.00 0.00 C ATOM 2627 CD2 LEU A 167 9.503 -17.004 -0.988 1.00 0.00 C ATOM 0 H LEU A 167 14.099 -18.827 0.001 1.00 0.00 H new ATOM 0 HA LEU A 167 12.170 -17.997 2.058 1.00 0.00 H new ATOM 0 HB2 LEU A 167 12.268 -16.210 0.319 1.00 0.00 H new ATOM 0 HB3 LEU A 167 11.917 -17.407 -0.913 1.00 0.00 H new ATOM 0 HG LEU A 167 9.867 -17.705 0.994 1.00 0.00 H new ATOM 0 HD11 LEU A 167 8.922 -15.430 1.143 1.00 0.00 H new ATOM 0 HD12 LEU A 167 10.491 -15.550 1.975 1.00 0.00 H new ATOM 0 HD13 LEU A 167 10.389 -14.777 0.375 1.00 0.00 H new ATOM 0 HD21 LEU A 167 8.439 -16.839 -0.820 1.00 0.00 H new ATOM 0 HD22 LEU A 167 9.885 -16.243 -1.668 1.00 0.00 H new ATOM 0 HD23 LEU A 167 9.653 -17.990 -1.427 1.00 0.00 H new ATOM 2639 N GLU A 168 10.669 -19.920 1.432 1.00 0.00 N ATOM 2640 CA GLU A 168 9.967 -21.183 1.232 1.00 0.00 C ATOM 2641 C GLU A 168 8.512 -20.940 0.849 1.00 0.00 C ATOM 2642 O GLU A 168 7.874 -20.016 1.352 1.00 0.00 O ATOM 2643 CB GLU A 168 10.038 -22.037 2.498 1.00 0.00 C ATOM 2644 CG GLU A 168 9.839 -23.522 2.241 1.00 0.00 C ATOM 2645 CD GLU A 168 11.072 -24.182 1.655 1.00 0.00 C ATOM 2646 OE1 GLU A 168 11.445 -23.833 0.516 1.00 0.00 O ATOM 2647 OE2 GLU A 168 11.662 -25.046 2.335 1.00 0.00 O ATOM 0 H GLU A 168 10.281 -19.335 2.172 1.00 0.00 H new ATOM 0 HA GLU A 168 10.455 -21.716 0.416 1.00 0.00 H new ATOM 0 HB2 GLU A 168 11.006 -21.886 2.975 1.00 0.00 H new ATOM 0 HB3 GLU A 168 9.279 -21.693 3.201 1.00 0.00 H new ATOM 0 HG2 GLU A 168 9.576 -24.017 3.176 1.00 0.00 H new ATOM 0 HG3 GLU A 168 8.999 -23.660 1.560 1.00 0.00 H new ATOM 2654 N MET A 169 7.993 -21.775 -0.044 1.00 0.00 N ATOM 2655 CA MET A 169 6.613 -21.651 -0.495 1.00 0.00 C ATOM 2656 C MET A 169 5.755 -22.789 0.051 1.00 0.00 C ATOM 2657 O MET A 169 6.239 -23.903 0.251 1.00 0.00 O ATOM 2658 CB MET A 169 6.554 -21.633 -2.024 1.00 0.00 C ATOM 2659 CG MET A 169 6.248 -20.263 -2.605 1.00 0.00 C ATOM 2660 SD MET A 169 7.726 -19.415 -3.195 1.00 0.00 S ATOM 2661 CE MET A 169 8.079 -20.349 -4.683 1.00 0.00 C ATOM 0 H MET A 169 8.508 -22.546 -0.470 1.00 0.00 H new ATOM 0 HA MET A 169 6.215 -20.710 -0.114 1.00 0.00 H new ATOM 0 HB2 MET A 169 7.508 -21.982 -2.420 1.00 0.00 H new ATOM 0 HB3 MET A 169 5.793 -22.338 -2.358 1.00 0.00 H new ATOM 0 HG2 MET A 169 5.542 -20.371 -3.429 1.00 0.00 H new ATOM 0 HG3 MET A 169 5.761 -19.651 -1.846 1.00 0.00 H new ATOM 0 HE1 MET A 169 8.776 -19.790 -5.307 1.00 0.00 H new ATOM 0 HE2 MET A 169 8.522 -21.308 -4.414 1.00 0.00 H new ATOM 0 HE3 MET A 169 7.154 -20.518 -5.234 1.00 0.00 H new ATOM 2671 N GLU A 170 4.479 -22.501 0.286 1.00 0.00 N ATOM 2672 CA GLU A 170 3.550 -23.498 0.806 1.00 0.00 C ATOM 2673 C GLU A 170 2.123 -23.191 0.366 1.00 0.00 C ATOM 2674 O GLU A 170 1.591 -22.120 0.653 1.00 0.00 O ATOM 2675 CB GLU A 170 3.627 -23.548 2.335 1.00 0.00 C ATOM 2676 CG GLU A 170 3.143 -22.277 3.012 1.00 0.00 C ATOM 2677 CD GLU A 170 3.399 -22.278 4.506 1.00 0.00 C ATOM 2678 OE1 GLU A 170 4.508 -22.678 4.918 1.00 0.00 O ATOM 2679 OE2 GLU A 170 2.491 -21.879 5.264 1.00 0.00 O ATOM 0 H GLU A 170 4.064 -21.583 0.124 1.00 0.00 H new ATOM 0 HA GLU A 170 3.834 -24.470 0.403 1.00 0.00 H new ATOM 0 HB2 GLU A 170 3.033 -24.389 2.693 1.00 0.00 H new ATOM 0 HB3 GLU A 170 4.658 -23.737 2.632 1.00 0.00 H new ATOM 0 HG2 GLU A 170 3.641 -21.418 2.562 1.00 0.00 H new ATOM 0 HG3 GLU A 170 2.075 -22.157 2.830 1.00 0.00 H new