USER MOD reduce.3.24.130724 H: found=0, std=0, add=1146, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 957 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 59 GLN :FLIP amide:sc= -0.31 F(o=-1.3,f=-0.24) USER MOD Set 1.2: A 61 ASN : amide:sc= 0.0677 K(o=-0.24,f=-0.96) USER MOD Set 2.1: A 25 ASN :FLIP amide:sc=-0.000678 F(o=-0.5,f=1.3) USER MOD Set 2.2: A 31 SER OG : rot -104:sc= 1.27 USER MOD Set 3.1: A 10 TYR OH : rot 30:sc= -0.0943 USER MOD Set 3.2: A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 170:sc= 0 USER MOD Single : A 11 TYR OH : rot 180:sc= -0.0214 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot -170:sc= 0.119 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl 172:sc= -0.0417 (180deg=-0.235) USER MOD Single : A 23 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00852) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 176:sc= 1.17 (180deg=1.14) USER MOD Single : A 34 LYS NZ :NH3+ -165:sc=-0.000943 (180deg=-0.141) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot -74:sc= 1.21 USER MOD Single : A 42 THR OG1 : rot 97:sc= 0.851 USER MOD Single : A 47 MET CE :methyl 175:sc= 0 (180deg=-0.0619) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot -81:sc= 1.24 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= 0.574 K(o=0.57,f=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -0.108 K(o=-0.11,f=-2.8!) USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= 0.0748 X(o=0.075,f=0) USER MOD Single : A 76 ASN : amide:sc= 0.69 K(o=0.69,f=0) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 160:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ -177:sc= 0.314 (180deg=0.31) USER MOD Single : A 97 THR OG1 : rot -104:sc= 1.41 USER MOD Single : A 101 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 102 MET CE :methyl 178:sc= -0.605 (180deg=-0.659) USER MOD Single : A 103 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00803) USER MOD Single : A 104 ASN : amide:sc= -0.37 X(o=-0.37,f=-0.37) USER MOD Single : A 105 TYR OH : rot -25:sc= 1.16 USER MOD Single : A 111 SER OG : rot 165:sc= 1.14 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= -0.159 USER MOD Single : A 118 THR OG1 : rot -70:sc= 0.622 USER MOD Single : A 119 ASN : amide:sc= -0.236 K(o=-0.24,f=-0.88) USER MOD Single : A 120 HIS : no HD1:sc= -0.543 X(o=-0.54,f=-0.55) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 TYR OH : rot -11:sc= 1.23 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 HIS : no HE2:sc= -0.39 K(o=-0.39,f=-4.2!) USER MOD Single : A 128 ASN : amide:sc= 1.09 K(o=1.1,f=-0.0049) USER MOD Single : A 135 ASN : amide:sc= -0.101 X(o=-0.1,f=-0.027) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 178:sc= 1.26 (180deg=1.25) USER MOD Single : A 150 SER OG : rot -51:sc= -0.0323 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 33 N LYS A 4 -4.355 -17.649 -2.442 1.00 55.43 N ATOM 34 CA LYS A 4 -3.191 -17.127 -1.740 1.00 35.04 C ATOM 35 C LYS A 4 -2.361 -16.300 -2.723 1.00 12.33 C ATOM 36 O LYS A 4 -1.685 -16.870 -3.572 1.00 53.52 O ATOM 37 CB LYS A 4 -2.440 -18.248 -0.992 1.00 20.41 C ATOM 38 CG LYS A 4 -1.698 -19.369 -1.761 1.00 13.33 C ATOM 39 CD LYS A 4 -2.517 -20.226 -2.751 1.00 52.33 C ATOM 40 CE LYS A 4 -2.438 -19.610 -4.151 1.00 13.21 C ATOM 41 NZ LYS A 4 -3.204 -20.304 -5.207 1.00 40.10 N ATOM 0 HA LYS A 4 -3.479 -16.446 -0.939 1.00 35.04 H new ATOM 0 HB2 LYS A 4 -1.706 -17.764 -0.348 1.00 20.41 H new ATOM 0 HB3 LYS A 4 -3.164 -18.736 -0.339 1.00 20.41 H new ATOM 0 HG2 LYS A 4 -0.878 -18.910 -2.314 1.00 13.33 H new ATOM 0 HG3 LYS A 4 -1.251 -20.040 -1.027 1.00 13.33 H new ATOM 0 HD2 LYS A 4 -2.133 -21.246 -2.769 1.00 52.33 H new ATOM 0 HD3 LYS A 4 -3.556 -20.283 -2.426 1.00 52.33 H new ATOM 0 HE2 LYS A 4 -2.788 -18.579 -4.093 1.00 13.21 H new ATOM 0 HE3 LYS A 4 -1.391 -19.575 -4.453 1.00 13.21 H new ATOM 0 HZ1 LYS A 4 -3.080 -19.804 -6.111 1.00 40.10 H new ATOM 0 HZ2 LYS A 4 -2.859 -21.281 -5.301 1.00 40.10 H new ATOM 0 HZ3 LYS A 4 -4.213 -20.316 -4.953 1.00 40.10 H new ATOM 51 N LYS A 5 -2.485 -14.973 -2.711 1.00 41.40 N ATOM 52 CA LYS A 5 -1.734 -14.094 -3.601 1.00 13.53 C ATOM 53 C LYS A 5 -1.354 -12.804 -2.918 1.00 13.41 C ATOM 54 O LYS A 5 -2.118 -12.275 -2.115 1.00 35.04 O ATOM 55 CB LYS A 5 -2.549 -13.765 -4.862 1.00 3.14 C ATOM 56 CG LYS A 5 -2.379 -14.868 -5.888 1.00 75.32 C ATOM 57 CD LYS A 5 -2.657 -14.428 -7.331 1.00 3.23 C ATOM 58 CE LYS A 5 -2.036 -15.432 -8.306 1.00 52.40 C ATOM 59 NZ LYS A 5 -1.431 -14.800 -9.498 1.00 63.44 N ATOM 0 H LYS A 5 -3.113 -14.477 -2.079 1.00 41.40 H new ATOM 0 HA LYS A 5 -0.826 -14.629 -3.879 1.00 13.53 H new ATOM 0 HB2 LYS A 5 -3.603 -13.654 -4.606 1.00 3.14 H new ATOM 0 HB3 LYS A 5 -2.220 -12.814 -5.280 1.00 3.14 H new ATOM 0 HG2 LYS A 5 -1.361 -15.253 -5.826 1.00 75.32 H new ATOM 0 HG3 LYS A 5 -3.047 -15.691 -5.635 1.00 75.32 H new ATOM 0 HD2 LYS A 5 -3.732 -14.360 -7.500 1.00 3.23 H new ATOM 0 HD3 LYS A 5 -2.243 -13.435 -7.504 1.00 3.23 H new ATOM 0 HE2 LYS A 5 -1.273 -16.009 -7.784 1.00 52.40 H new ATOM 0 HE3 LYS A 5 -2.803 -16.136 -8.628 1.00 52.40 H new ATOM 0 HZ1 LYS A 5 -1.030 -15.535 -10.115 1.00 63.44 H new ATOM 0 HZ2 LYS A 5 -2.160 -14.271 -10.018 1.00 63.44 H new ATOM 0 HZ3 LYS A 5 -0.677 -14.148 -9.200 1.00 63.44 H new ATOM 69 N THR A 6 -0.240 -12.243 -3.365 1.00 40.34 N ATOM 70 CA THR A 6 0.339 -11.030 -2.842 1.00 4.35 C ATOM 71 C THR A 6 0.458 -10.037 -4.010 1.00 31.21 C ATOM 72 O THR A 6 1.244 -10.237 -4.939 1.00 14.21 O ATOM 73 CB THR A 6 1.652 -11.439 -2.148 1.00 20.05 C ATOM 74 OG1 THR A 6 1.370 -12.120 -0.943 1.00 13.44 O ATOM 75 CG2 THR A 6 2.570 -10.267 -1.792 1.00 35.45 C ATOM 0 H THR A 6 0.301 -12.642 -4.132 1.00 40.34 H new ATOM 0 HA THR A 6 -0.254 -10.513 -2.088 1.00 4.35 H new ATOM 0 HB THR A 6 2.169 -12.067 -2.874 1.00 20.05 H new ATOM 0 HG1 THR A 6 2.194 -12.516 -0.590 1.00 13.44 H new ATOM 0 HG21 THR A 6 3.471 -10.644 -1.307 1.00 35.45 H new ATOM 0 HG22 THR A 6 2.844 -9.731 -2.700 1.00 35.45 H new ATOM 0 HG23 THR A 6 2.050 -9.590 -1.114 1.00 35.45 H new ATOM 83 N LEU A 7 -0.357 -8.980 -4.022 1.00 13.14 N ATOM 84 CA LEU A 7 -0.217 -7.851 -4.951 1.00 74.30 C ATOM 85 C LEU A 7 0.499 -6.668 -4.283 1.00 61.10 C ATOM 86 O LEU A 7 -0.083 -6.000 -3.433 1.00 2.44 O ATOM 87 CB LEU A 7 -1.610 -7.473 -5.466 1.00 52.31 C ATOM 88 CG LEU A 7 -1.647 -6.263 -6.413 1.00 1.22 C ATOM 89 CD1 LEU A 7 -0.695 -6.411 -7.608 1.00 32.42 C ATOM 90 CD2 LEU A 7 -3.080 -6.078 -6.929 1.00 55.22 C ATOM 0 H LEU A 7 -1.143 -8.881 -3.380 1.00 13.14 H new ATOM 0 HA LEU A 7 0.406 -8.139 -5.798 1.00 74.30 H new ATOM 0 HB2 LEU A 7 -2.035 -8.333 -5.983 1.00 52.31 H new ATOM 0 HB3 LEU A 7 -2.253 -7.266 -4.611 1.00 52.31 H new ATOM 0 HG LEU A 7 -1.317 -5.393 -5.845 1.00 1.22 H new ATOM 0 HD11 LEU A 7 -0.765 -5.526 -8.241 1.00 32.42 H new ATOM 0 HD12 LEU A 7 0.328 -6.519 -7.247 1.00 32.42 H new ATOM 0 HD13 LEU A 7 -0.971 -7.293 -8.186 1.00 32.42 H new ATOM 0 HD21 LEU A 7 -3.117 -5.221 -7.602 1.00 55.22 H new ATOM 0 HD22 LEU A 7 -3.392 -6.974 -7.465 1.00 55.22 H new ATOM 0 HD23 LEU A 7 -3.751 -5.907 -6.087 1.00 55.22 H new ATOM 101 N ILE A 8 1.758 -6.405 -4.648 1.00 33.22 N ATOM 102 CA ILE A 8 2.595 -5.364 -4.043 1.00 35.03 C ATOM 103 C ILE A 8 2.484 -4.097 -4.906 1.00 3.41 C ATOM 104 O ILE A 8 3.094 -4.029 -5.974 1.00 2.42 O ATOM 105 CB ILE A 8 4.049 -5.892 -3.895 1.00 43.41 C ATOM 106 CG1 ILE A 8 4.063 -7.230 -3.114 1.00 53.34 C ATOM 107 CG2 ILE A 8 4.976 -4.874 -3.226 1.00 20.22 C ATOM 108 CD1 ILE A 8 5.449 -7.819 -2.853 1.00 22.23 C ATOM 0 H ILE A 8 2.234 -6.921 -5.388 1.00 33.22 H new ATOM 0 HA ILE A 8 2.260 -5.106 -3.038 1.00 35.03 H new ATOM 0 HB ILE A 8 4.431 -6.060 -4.902 1.00 43.41 H new ATOM 0 HG12 ILE A 8 3.565 -7.078 -2.157 1.00 53.34 H new ATOM 0 HG13 ILE A 8 3.474 -7.961 -3.668 1.00 53.34 H new ATOM 0 HG21 ILE A 8 5.979 -5.293 -3.147 1.00 20.22 H new ATOM 0 HG22 ILE A 8 5.009 -3.964 -3.824 1.00 20.22 H new ATOM 0 HG23 ILE A 8 4.601 -4.640 -2.230 1.00 20.22 H new ATOM 0 HD11 ILE A 8 5.349 -8.754 -2.301 1.00 22.23 H new ATOM 0 HD12 ILE A 8 5.948 -8.010 -3.803 1.00 22.23 H new ATOM 0 HD13 ILE A 8 6.040 -7.114 -2.269 1.00 22.23 H new ATOM 119 N LEU A 9 1.683 -3.105 -4.493 1.00 64.13 N ATOM 120 CA LEU A 9 1.475 -1.850 -5.233 1.00 0.15 C ATOM 121 C LEU A 9 2.351 -0.763 -4.617 1.00 31.34 C ATOM 122 O LEU A 9 2.262 -0.570 -3.407 1.00 43.52 O ATOM 123 CB LEU A 9 0.008 -1.387 -5.109 1.00 15.54 C ATOM 124 CG LEU A 9 -1.064 -2.428 -5.463 1.00 60.10 C ATOM 125 CD1 LEU A 9 -2.452 -1.828 -5.256 1.00 24.03 C ATOM 126 CD2 LEU A 9 -0.913 -2.884 -6.908 1.00 35.44 C ATOM 0 H LEU A 9 1.153 -3.151 -3.623 1.00 64.13 H new ATOM 0 HA LEU A 9 1.725 -2.019 -6.280 1.00 0.15 H new ATOM 0 HB2 LEU A 9 -0.161 -1.056 -4.084 1.00 15.54 H new ATOM 0 HB3 LEU A 9 -0.133 -0.518 -5.752 1.00 15.54 H new ATOM 0 HG LEU A 9 -0.938 -3.292 -4.810 1.00 60.10 H new ATOM 0 HD11 LEU A 9 -3.210 -2.569 -5.508 1.00 24.03 H new ATOM 0 HD12 LEU A 9 -2.568 -1.530 -4.214 1.00 24.03 H new ATOM 0 HD13 LEU A 9 -2.570 -0.955 -5.898 1.00 24.03 H new ATOM 0 HD21 LEU A 9 -1.682 -3.621 -7.139 1.00 35.44 H new ATOM 0 HD22 LEU A 9 -1.020 -2.027 -7.573 1.00 35.44 H new ATOM 0 HD23 LEU A 9 0.072 -3.330 -7.048 1.00 35.44 H new ATOM 137 N TYR A 10 3.176 -0.012 -5.349 1.00 21.15 N ATOM 138 CA TYR A 10 3.878 1.105 -4.709 1.00 31.43 C ATOM 139 C TYR A 10 4.078 2.320 -5.611 1.00 13.24 C ATOM 140 O TYR A 10 4.060 2.218 -6.844 1.00 4.25 O ATOM 141 CB TYR A 10 5.196 0.636 -4.048 1.00 62.00 C ATOM 142 CG TYR A 10 6.422 0.532 -4.929 1.00 0.24 C ATOM 143 CD1 TYR A 10 6.327 0.188 -6.290 1.00 22.32 C ATOM 144 CD2 TYR A 10 7.676 0.841 -4.374 1.00 11.34 C ATOM 145 CE1 TYR A 10 7.441 0.281 -7.133 1.00 55.42 C ATOM 146 CE2 TYR A 10 8.776 1.004 -5.228 1.00 3.41 C ATOM 147 CZ TYR A 10 8.661 0.749 -6.613 1.00 60.44 C ATOM 148 OH TYR A 10 9.714 0.962 -7.446 1.00 54.52 O ATOM 0 H TYR A 10 3.370 -0.145 -6.341 1.00 21.15 H new ATOM 0 HA TYR A 10 3.215 1.459 -3.920 1.00 31.43 H new ATOM 0 HB2 TYR A 10 5.425 1.322 -3.232 1.00 62.00 H new ATOM 0 HB3 TYR A 10 5.019 -0.343 -3.602 1.00 62.00 H new ATOM 0 HD1 TYR A 10 5.383 -0.152 -6.689 1.00 22.32 H new ATOM 0 HD2 TYR A 10 7.790 0.951 -3.306 1.00 11.34 H new ATOM 0 HE1 TYR A 10 7.364 -0.004 -8.172 1.00 55.42 H new ATOM 0 HE2 TYR A 10 9.723 1.328 -4.822 1.00 3.41 H new ATOM 0 HH TYR A 10 9.383 1.213 -8.334 1.00 54.52 H new ATOM 157 N TYR A 11 4.341 3.465 -4.976 1.00 23.05 N ATOM 158 CA TYR A 11 4.668 4.714 -5.626 1.00 41.33 C ATOM 159 C TYR A 11 6.123 5.025 -5.305 1.00 60.41 C ATOM 160 O TYR A 11 6.452 5.282 -4.145 1.00 51.13 O ATOM 161 CB TYR A 11 3.771 5.881 -5.202 1.00 3.24 C ATOM 162 CG TYR A 11 4.174 7.209 -5.856 1.00 22.12 C ATOM 163 CD1 TYR A 11 4.663 7.250 -7.184 1.00 33.22 C ATOM 164 CD2 TYR A 11 4.023 8.428 -5.164 1.00 75.33 C ATOM 165 CE1 TYR A 11 4.896 8.466 -7.842 1.00 74.00 C ATOM 166 CE2 TYR A 11 4.271 9.652 -5.812 1.00 52.44 C ATOM 167 CZ TYR A 11 4.684 9.681 -7.164 1.00 74.40 C ATOM 168 OH TYR A 11 4.841 10.870 -7.805 1.00 15.22 O ATOM 0 H TYR A 11 4.329 3.539 -3.959 1.00 23.05 H new ATOM 0 HA TYR A 11 4.503 4.597 -6.697 1.00 41.33 H new ATOM 0 HB2 TYR A 11 2.738 5.652 -5.462 1.00 3.24 H new ATOM 0 HB3 TYR A 11 3.810 5.988 -4.118 1.00 3.24 H new ATOM 0 HD1 TYR A 11 4.861 6.323 -7.702 1.00 33.22 H new ATOM 0 HD2 TYR A 11 3.715 8.422 -4.129 1.00 75.33 H new ATOM 0 HE1 TYR A 11 5.237 8.470 -8.867 1.00 74.00 H new ATOM 0 HE2 TYR A 11 4.145 10.578 -5.271 1.00 52.44 H new ATOM 0 HH TYR A 11 4.653 11.604 -7.184 1.00 15.22 H new ATOM 177 N SER A 12 7.004 4.970 -6.301 1.00 4.15 N ATOM 178 CA SER A 12 8.385 5.374 -6.147 1.00 4.43 C ATOM 179 C SER A 12 8.522 6.863 -6.464 1.00 61.21 C ATOM 180 O SER A 12 8.363 7.270 -7.612 1.00 41.44 O ATOM 181 CB SER A 12 9.335 4.472 -6.951 1.00 75.24 C ATOM 182 OG SER A 12 8.933 4.285 -8.295 1.00 51.40 O ATOM 0 H SER A 12 6.772 4.642 -7.238 1.00 4.15 H new ATOM 0 HA SER A 12 8.691 5.240 -5.109 1.00 4.43 H new ATOM 0 HB2 SER A 12 10.335 4.906 -6.936 1.00 75.24 H new ATOM 0 HB3 SER A 12 9.402 3.500 -6.461 1.00 75.24 H new ATOM 0 HG SER A 12 9.578 3.705 -8.752 1.00 51.40 H new ATOM 187 N TRP A 13 8.899 7.640 -5.444 1.00 4.33 N ATOM 188 CA TRP A 13 9.233 9.060 -5.523 1.00 42.13 C ATOM 189 C TRP A 13 10.140 9.348 -6.723 1.00 31.43 C ATOM 190 O TRP A 13 9.693 9.934 -7.704 1.00 74.00 O ATOM 191 CB TRP A 13 9.882 9.480 -4.194 1.00 51.54 C ATOM 192 CG TRP A 13 9.999 10.949 -3.932 1.00 55.53 C ATOM 193 CD1 TRP A 13 9.028 11.717 -3.392 1.00 2.50 C ATOM 194 CD2 TRP A 13 11.128 11.847 -4.157 1.00 60.05 C ATOM 195 NE1 TRP A 13 9.488 13.002 -3.218 1.00 24.42 N ATOM 196 CE2 TRP A 13 10.781 13.139 -3.666 1.00 41.44 C ATOM 197 CE3 TRP A 13 12.409 11.710 -4.737 1.00 24.12 C ATOM 198 CZ2 TRP A 13 11.672 14.221 -3.707 1.00 73.14 C ATOM 199 CZ3 TRP A 13 13.277 12.812 -4.864 1.00 3.14 C ATOM 200 CH2 TRP A 13 12.925 14.060 -4.319 1.00 62.14 C ATOM 0 H TRP A 13 8.983 7.275 -4.495 1.00 4.33 H new ATOM 0 HA TRP A 13 8.328 9.648 -5.678 1.00 42.13 H new ATOM 0 HB2 TRP A 13 9.308 9.035 -3.381 1.00 51.54 H new ATOM 0 HB3 TRP A 13 10.882 9.047 -4.153 1.00 51.54 H new ATOM 0 HD1 TRP A 13 8.037 11.373 -3.135 1.00 2.50 H new ATOM 0 HE1 TRP A 13 8.939 13.758 -2.808 1.00 24.42 H new ATOM 0 HE3 TRP A 13 12.729 10.741 -5.090 1.00 24.12 H new ATOM 0 HZ2 TRP A 13 11.397 15.170 -3.271 1.00 73.14 H new ATOM 0 HZ3 TRP A 13 14.218 12.698 -5.382 1.00 3.14 H new ATOM 0 HH2 TRP A 13 13.615 14.889 -4.371 1.00 62.14 H new ATOM 210 N SER A 14 11.393 8.881 -6.686 1.00 22.03 N ATOM 211 CA SER A 14 12.323 8.962 -7.813 1.00 41.53 C ATOM 212 C SER A 14 13.510 7.990 -7.689 1.00 51.44 C ATOM 213 O SER A 14 14.271 7.849 -8.644 1.00 74.31 O ATOM 214 CB SER A 14 12.813 10.417 -7.969 1.00 22.11 C ATOM 215 OG SER A 14 12.704 10.866 -9.307 1.00 22.01 O ATOM 0 H SER A 14 11.792 8.431 -5.862 1.00 22.03 H new ATOM 0 HA SER A 14 11.782 8.656 -8.708 1.00 41.53 H new ATOM 0 HB2 SER A 14 12.231 11.069 -7.318 1.00 22.11 H new ATOM 0 HB3 SER A 14 13.851 10.488 -7.645 1.00 22.11 H new ATOM 0 HG SER A 14 13.021 11.791 -9.368 1.00 22.01 H new ATOM 220 N GLY A 15 13.696 7.301 -6.552 1.00 3.12 N ATOM 221 CA GLY A 15 14.856 6.436 -6.354 1.00 12.41 C ATOM 222 C GLY A 15 15.201 6.175 -4.888 1.00 54.32 C ATOM 223 O GLY A 15 16.375 6.058 -4.534 1.00 3.31 O ATOM 0 H GLY A 15 13.055 7.330 -5.759 1.00 3.12 H new ATOM 0 HA2 GLY A 15 14.672 5.482 -6.848 1.00 12.41 H new ATOM 0 HA3 GLY A 15 15.719 6.887 -6.844 1.00 12.41 H new ATOM 227 N GLU A 16 14.193 6.066 -4.024 1.00 71.40 N ATOM 228 CA GLU A 16 14.331 5.724 -2.614 1.00 31.45 C ATOM 229 C GLU A 16 13.454 4.506 -2.349 1.00 75.13 C ATOM 230 O GLU A 16 13.962 3.418 -2.083 1.00 53.34 O ATOM 231 CB GLU A 16 13.918 6.913 -1.713 1.00 74.14 C ATOM 232 CG GLU A 16 14.326 8.320 -2.195 1.00 75.33 C ATOM 233 CD GLU A 16 13.808 9.445 -1.282 1.00 75.04 C ATOM 234 OE1 GLU A 16 12.728 9.299 -0.668 1.00 21.00 O ATOM 235 OE2 GLU A 16 14.457 10.518 -1.235 1.00 43.55 O ATOM 0 H GLU A 16 13.223 6.220 -4.299 1.00 71.40 H new ATOM 0 HA GLU A 16 15.371 5.498 -2.379 1.00 31.45 H new ATOM 0 HB2 GLU A 16 12.834 6.893 -1.599 1.00 74.14 H new ATOM 0 HB3 GLU A 16 14.346 6.755 -0.723 1.00 74.14 H new ATOM 0 HG2 GLU A 16 15.413 8.377 -2.251 1.00 75.33 H new ATOM 0 HG3 GLU A 16 13.946 8.476 -3.205 1.00 75.33 H new ATOM 240 N THR A 17 12.143 4.658 -2.523 1.00 34.31 N ATOM 241 CA THR A 17 11.140 3.604 -2.460 1.00 74.42 C ATOM 242 C THR A 17 11.554 2.413 -3.332 1.00 23.41 C ATOM 243 O THR A 17 11.294 1.271 -2.972 1.00 54.34 O ATOM 244 CB THR A 17 9.774 4.167 -2.933 1.00 33.12 C ATOM 245 OG1 THR A 17 9.739 5.595 -2.884 1.00 72.34 O ATOM 246 CG2 THR A 17 8.556 3.556 -2.230 1.00 73.02 C ATOM 0 H THR A 17 11.733 5.570 -2.722 1.00 34.31 H new ATOM 0 HA THR A 17 11.052 3.256 -1.431 1.00 74.42 H new ATOM 0 HB THR A 17 9.693 3.857 -3.975 1.00 33.12 H new ATOM 0 HG1 THR A 17 8.822 5.905 -3.036 1.00 72.34 H new ATOM 0 HG21 THR A 17 7.645 4.008 -2.622 1.00 73.02 H new ATOM 0 HG22 THR A 17 8.534 2.481 -2.409 1.00 73.02 H new ATOM 0 HG23 THR A 17 8.622 3.744 -1.158 1.00 73.02 H new ATOM 254 N LYS A 18 12.200 2.669 -4.480 1.00 44.30 N ATOM 255 CA LYS A 18 12.482 1.660 -5.495 1.00 62.20 C ATOM 256 C LYS A 18 13.284 0.486 -4.940 1.00 14.22 C ATOM 257 O LYS A 18 12.964 -0.645 -5.319 1.00 2.21 O ATOM 258 CB LYS A 18 13.065 2.319 -6.758 1.00 32.02 C ATOM 259 CG LYS A 18 13.213 1.365 -7.958 1.00 75.12 C ATOM 260 CD LYS A 18 14.533 0.584 -8.047 1.00 54.13 C ATOM 261 CE LYS A 18 15.688 1.470 -8.541 1.00 0.55 C ATOM 262 NZ LYS A 18 16.319 0.946 -9.774 1.00 12.13 N ATOM 0 H LYS A 18 12.543 3.598 -4.726 1.00 44.30 H new ATOM 0 HA LYS A 18 11.546 1.198 -5.810 1.00 62.20 H new ATOM 0 HB2 LYS A 18 12.425 3.152 -7.048 1.00 32.02 H new ATOM 0 HB3 LYS A 18 14.043 2.737 -6.518 1.00 32.02 H new ATOM 0 HG2 LYS A 18 12.392 0.648 -7.929 1.00 75.12 H new ATOM 0 HG3 LYS A 18 13.096 1.945 -8.873 1.00 75.12 H new ATOM 0 HD2 LYS A 18 14.781 0.176 -7.067 1.00 54.13 H new ATOM 0 HD3 LYS A 18 14.410 -0.263 -8.722 1.00 54.13 H new ATOM 0 HE2 LYS A 18 15.315 2.477 -8.728 1.00 0.55 H new ATOM 0 HE3 LYS A 18 16.441 1.550 -7.757 1.00 0.55 H new ATOM 0 HZ1 LYS A 18 17.091 1.579 -10.065 1.00 12.13 H new ATOM 0 HZ2 LYS A 18 16.701 -0.004 -9.592 1.00 12.13 H new ATOM 0 HZ3 LYS A 18 15.609 0.894 -10.532 1.00 12.13 H new ATOM 272 N LYS A 19 14.271 0.685 -4.053 1.00 43.21 N ATOM 273 CA LYS A 19 14.933 -0.479 -3.443 1.00 31.15 C ATOM 274 C LYS A 19 13.961 -1.287 -2.581 1.00 21.01 C ATOM 275 O LYS A 19 13.981 -2.513 -2.601 1.00 75.11 O ATOM 276 CB LYS A 19 16.121 -0.065 -2.569 1.00 14.21 C ATOM 277 CG LYS A 19 17.360 0.405 -3.352 1.00 2.52 C ATOM 278 CD LYS A 19 18.621 -0.240 -2.761 1.00 41.43 C ATOM 279 CE LYS A 19 19.905 0.411 -3.277 1.00 60.02 C ATOM 280 NZ LYS A 19 21.095 -0.263 -2.720 1.00 22.05 N ATOM 0 H LYS A 19 14.617 1.596 -3.752 1.00 43.21 H new ATOM 0 HA LYS A 19 15.289 -1.092 -4.271 1.00 31.15 H new ATOM 0 HB2 LYS A 19 15.803 0.737 -1.903 1.00 14.21 H new ATOM 0 HB3 LYS A 19 16.404 -0.909 -1.940 1.00 14.21 H new ATOM 0 HG2 LYS A 19 17.261 0.136 -4.404 1.00 2.52 H new ATOM 0 HG3 LYS A 19 17.440 1.491 -3.307 1.00 2.52 H new ATOM 0 HD2 LYS A 19 18.590 -0.164 -1.674 1.00 41.43 H new ATOM 0 HD3 LYS A 19 18.631 -1.302 -3.006 1.00 41.43 H new ATOM 0 HE2 LYS A 19 19.930 0.363 -4.366 1.00 60.02 H new ATOM 0 HE3 LYS A 19 19.918 1.466 -3.004 1.00 60.02 H new ATOM 0 HZ1 LYS A 19 21.955 0.195 -3.083 1.00 22.05 H new ATOM 0 HZ2 LYS A 19 21.079 -0.195 -1.682 1.00 22.05 H new ATOM 0 HZ3 LYS A 19 21.091 -1.264 -3.002 1.00 22.05 H new ATOM 290 N MET A 20 13.117 -0.603 -1.817 1.00 43.52 N ATOM 291 CA MET A 20 12.231 -1.206 -0.833 1.00 15.14 C ATOM 292 C MET A 20 11.111 -2.042 -1.464 1.00 52.42 C ATOM 293 O MET A 20 10.409 -2.749 -0.743 1.00 61.21 O ATOM 294 CB MET A 20 11.644 -0.071 0.028 1.00 32.03 C ATOM 295 CG MET A 20 11.177 -0.535 1.409 1.00 23.02 C ATOM 296 SD MET A 20 12.433 -1.392 2.406 1.00 2.11 S ATOM 297 CE MET A 20 13.788 -0.186 2.379 1.00 10.51 C ATOM 0 H MET A 20 13.029 0.412 -1.867 1.00 43.52 H new ATOM 0 HA MET A 20 12.808 -1.902 -0.225 1.00 15.14 H new ATOM 0 HB2 MET A 20 12.396 0.709 0.150 1.00 32.03 H new ATOM 0 HB3 MET A 20 10.803 0.378 -0.500 1.00 32.03 H new ATOM 0 HG2 MET A 20 10.825 0.333 1.966 1.00 23.02 H new ATOM 0 HG3 MET A 20 10.323 -1.200 1.281 1.00 23.02 H new ATOM 0 HE1 MET A 20 14.574 -0.506 3.064 1.00 10.51 H new ATOM 0 HE2 MET A 20 14.193 -0.116 1.369 1.00 10.51 H new ATOM 0 HE3 MET A 20 13.413 0.790 2.688 1.00 10.51 H new ATOM 305 N ALA A 21 10.894 -1.952 -2.779 1.00 12.42 N ATOM 306 CA ALA A 21 9.877 -2.725 -3.465 1.00 15.31 C ATOM 307 C ALA A 21 10.446 -4.119 -3.668 1.00 32.25 C ATOM 308 O ALA A 21 9.936 -5.093 -3.121 1.00 62.34 O ATOM 309 CB ALA A 21 9.515 -2.073 -4.804 1.00 23.05 C ATOM 0 H ALA A 21 11.426 -1.335 -3.393 1.00 12.42 H new ATOM 0 HA ALA A 21 8.958 -2.770 -2.880 1.00 15.31 H new ATOM 0 HB1 ALA A 21 8.750 -2.668 -5.303 1.00 23.05 H new ATOM 0 HB2 ALA A 21 9.134 -1.067 -4.628 1.00 23.05 H new ATOM 0 HB3 ALA A 21 10.403 -2.020 -5.434 1.00 23.05 H new ATOM 315 N GLU A 22 11.521 -4.198 -4.455 1.00 40.44 N ATOM 316 CA GLU A 22 12.116 -5.453 -4.883 1.00 4.24 C ATOM 317 C GLU A 22 12.550 -6.323 -3.705 1.00 54.53 C ATOM 318 O GLU A 22 12.359 -7.536 -3.761 1.00 22.23 O ATOM 319 CB GLU A 22 13.275 -5.239 -5.872 1.00 11.32 C ATOM 320 CG GLU A 22 14.215 -4.121 -5.429 1.00 73.42 C ATOM 321 CD GLU A 22 15.539 -4.128 -6.190 1.00 13.25 C ATOM 322 OE1 GLU A 22 16.502 -4.794 -5.735 1.00 1.12 O ATOM 323 OE2 GLU A 22 15.660 -3.462 -7.244 1.00 63.02 O ATOM 0 H GLU A 22 12.005 -3.376 -4.815 1.00 40.44 H new ATOM 0 HA GLU A 22 11.331 -5.994 -5.412 1.00 4.24 H new ATOM 0 HB2 GLU A 22 13.839 -6.166 -5.973 1.00 11.32 H new ATOM 0 HB3 GLU A 22 12.871 -5.002 -6.856 1.00 11.32 H new ATOM 0 HG2 GLU A 22 13.723 -3.159 -5.574 1.00 73.42 H new ATOM 0 HG3 GLU A 22 14.413 -4.220 -4.362 1.00 73.42 H new ATOM 328 N LYS A 23 13.093 -5.738 -2.628 1.00 2.13 N ATOM 329 CA LYS A 23 13.518 -6.536 -1.480 1.00 55.51 C ATOM 330 C LYS A 23 12.329 -7.299 -0.902 1.00 44.13 C ATOM 331 O LYS A 23 12.389 -8.517 -0.775 1.00 60.41 O ATOM 332 CB LYS A 23 14.243 -5.678 -0.429 1.00 63.22 C ATOM 333 CG LYS A 23 14.983 -6.604 0.553 1.00 41.43 C ATOM 334 CD LYS A 23 15.932 -5.860 1.500 1.00 52.13 C ATOM 335 CE LYS A 23 17.032 -6.786 2.045 1.00 41.42 C ATOM 336 NZ LYS A 23 16.495 -7.942 2.788 1.00 31.24 N ATOM 0 H LYS A 23 13.244 -4.734 -2.532 1.00 2.13 H new ATOM 0 HA LYS A 23 14.248 -7.272 -1.817 1.00 55.51 H new ATOM 0 HB2 LYS A 23 14.949 -5.004 -0.915 1.00 63.22 H new ATOM 0 HB3 LYS A 23 13.527 -5.056 0.108 1.00 63.22 H new ATOM 0 HG2 LYS A 23 14.250 -7.153 1.144 1.00 41.43 H new ATOM 0 HG3 LYS A 23 15.552 -7.341 -0.014 1.00 41.43 H new ATOM 0 HD2 LYS A 23 16.389 -5.022 0.973 1.00 52.13 H new ATOM 0 HD3 LYS A 23 15.363 -5.442 2.331 1.00 52.13 H new ATOM 0 HE2 LYS A 23 17.641 -7.145 1.216 1.00 41.42 H new ATOM 0 HE3 LYS A 23 17.690 -6.214 2.699 1.00 41.42 H new ATOM 0 HZ1 LYS A 23 17.281 -8.493 3.189 1.00 31.24 H new ATOM 0 HZ2 LYS A 23 15.881 -7.606 3.557 1.00 31.24 H new ATOM 0 HZ3 LYS A 23 15.944 -8.544 2.143 1.00 31.24 H new ATOM 346 N ILE A 24 11.243 -6.590 -0.599 1.00 15.34 N ATOM 347 CA ILE A 24 10.043 -7.188 -0.039 1.00 33.35 C ATOM 348 C ILE A 24 9.400 -8.131 -1.067 1.00 32.03 C ATOM 349 O ILE A 24 8.897 -9.188 -0.704 1.00 60.22 O ATOM 350 CB ILE A 24 9.130 -6.050 0.476 1.00 42.44 C ATOM 351 CG1 ILE A 24 9.822 -5.391 1.699 1.00 23.03 C ATOM 352 CG2 ILE A 24 7.711 -6.555 0.795 1.00 42.23 C ATOM 353 CD1 ILE A 24 9.126 -4.141 2.248 1.00 60.32 C ATOM 0 H ILE A 24 11.175 -5.582 -0.737 1.00 15.34 H new ATOM 0 HA ILE A 24 10.261 -7.823 0.820 1.00 33.35 H new ATOM 0 HB ILE A 24 8.996 -5.299 -0.302 1.00 42.44 H new ATOM 0 HG12 ILE A 24 9.891 -6.129 2.498 1.00 23.03 H new ATOM 0 HG13 ILE A 24 10.842 -5.126 1.420 1.00 23.03 H new ATOM 0 HG21 ILE A 24 7.102 -5.725 1.154 1.00 42.23 H new ATOM 0 HG22 ILE A 24 7.262 -6.972 -0.106 1.00 42.23 H new ATOM 0 HG23 ILE A 24 7.763 -7.326 1.564 1.00 42.23 H new ATOM 0 HD11 ILE A 24 9.687 -3.757 3.100 1.00 60.32 H new ATOM 0 HD12 ILE A 24 9.080 -3.379 1.470 1.00 60.32 H new ATOM 0 HD13 ILE A 24 8.115 -4.397 2.565 1.00 60.32 H new ATOM 364 N ASN A 25 9.431 -7.796 -2.358 1.00 11.21 N ATOM 365 CA ASN A 25 8.870 -8.659 -3.390 1.00 40.33 C ATOM 366 C ASN A 25 9.604 -9.996 -3.491 1.00 73.40 C ATOM 367 O ASN A 25 8.954 -11.032 -3.643 1.00 62.34 O ATOM 368 CB ASN A 25 8.845 -7.925 -4.731 1.00 32.01 C ATOM 369 CG ASN A 25 8.394 -8.838 -5.861 1.00 31.31 C ATOM 370 OD1 ASN A 25 7.211 -9.417 -5.786 1.00 14.45 O flip ATOM 371 ND2 ASN A 25 9.130 -9.073 -6.810 1.00 43.50 N flip ATOM 0 H ASN A 25 9.840 -6.931 -2.711 1.00 11.21 H new ATOM 0 HA ASN A 25 7.845 -8.897 -3.106 1.00 40.33 H new ATOM 0 HB2 ASN A 25 8.174 -7.068 -4.665 1.00 32.01 H new ATOM 0 HB3 ASN A 25 9.839 -7.536 -4.952 1.00 32.01 H new ATOM 0 HD21 ASN A 25 10.045 -8.626 -6.869 1.00 43.50 H new ATOM 0 HD22 ASN A 25 8.829 -9.716 -7.542 1.00 43.50 H new ATOM 377 N SER A 26 10.931 -9.984 -3.400 1.00 34.22 N ATOM 378 CA SER A 26 11.770 -11.171 -3.309 1.00 13.54 C ATOM 379 C SER A 26 11.360 -11.972 -2.068 1.00 75.30 C ATOM 380 O SER A 26 11.059 -13.163 -2.172 1.00 23.05 O ATOM 381 CB SER A 26 13.237 -10.707 -3.287 1.00 33.12 C ATOM 382 OG SER A 26 14.186 -11.756 -3.288 1.00 34.23 O ATOM 0 H SER A 26 11.468 -9.117 -3.387 1.00 34.22 H new ATOM 0 HA SER A 26 11.647 -11.837 -4.163 1.00 13.54 H new ATOM 0 HB2 SER A 26 13.416 -10.071 -4.154 1.00 33.12 H new ATOM 0 HB3 SER A 26 13.396 -10.091 -2.402 1.00 33.12 H new ATOM 0 HG SER A 26 15.090 -11.379 -3.275 1.00 34.23 H new ATOM 387 N GLU A 27 11.287 -11.309 -0.913 1.00 42.22 N ATOM 388 CA GLU A 27 11.038 -11.924 0.383 1.00 43.21 C ATOM 389 C GLU A 27 9.606 -12.454 0.569 1.00 71.01 C ATOM 390 O GLU A 27 9.346 -13.045 1.618 1.00 62.20 O ATOM 391 CB GLU A 27 11.401 -10.913 1.488 1.00 2.43 C ATOM 392 CG GLU A 27 12.918 -10.728 1.644 1.00 11.33 C ATOM 393 CD GLU A 27 13.589 -11.930 2.311 1.00 64.01 C ATOM 394 OE1 GLU A 27 13.309 -12.234 3.493 1.00 45.31 O ATOM 395 OE2 GLU A 27 14.507 -12.528 1.700 1.00 70.03 O ATOM 0 H GLU A 27 11.404 -10.297 -0.857 1.00 42.22 H new ATOM 0 HA GLU A 27 11.671 -12.809 0.446 1.00 43.21 H new ATOM 0 HB2 GLU A 27 10.943 -9.951 1.260 1.00 2.43 H new ATOM 0 HB3 GLU A 27 10.980 -11.249 2.436 1.00 2.43 H new ATOM 0 HG2 GLU A 27 13.364 -10.565 0.663 1.00 11.33 H new ATOM 0 HG3 GLU A 27 13.113 -9.833 2.235 1.00 11.33 H new ATOM 400 N ILE A 28 8.675 -12.284 -0.379 1.00 32.32 N ATOM 401 CA ILE A 28 7.309 -12.804 -0.258 1.00 21.33 C ATOM 402 C ILE A 28 7.056 -13.786 -1.385 1.00 13.35 C ATOM 403 O ILE A 28 7.321 -13.489 -2.556 1.00 44.32 O ATOM 404 CB ILE A 28 6.247 -11.684 -0.229 1.00 74.30 C ATOM 405 CG1 ILE A 28 6.454 -10.819 1.030 1.00 24.45 C ATOM 406 CG2 ILE A 28 4.846 -12.329 -0.199 1.00 14.24 C ATOM 407 CD1 ILE A 28 5.454 -9.673 1.163 1.00 74.03 C ATOM 0 H ILE A 28 8.849 -11.782 -1.250 1.00 32.32 H new ATOM 0 HA ILE A 28 7.218 -13.317 0.699 1.00 21.33 H new ATOM 0 HB ILE A 28 6.340 -11.054 -1.113 1.00 74.30 H new ATOM 0 HG12 ILE A 28 6.382 -11.455 1.912 1.00 24.45 H new ATOM 0 HG13 ILE A 28 7.463 -10.408 1.015 1.00 24.45 H new ATOM 0 HG21 ILE A 28 4.086 -11.548 -0.178 1.00 14.24 H new ATOM 0 HG22 ILE A 28 4.710 -12.944 -1.088 1.00 14.24 H new ATOM 0 HG23 ILE A 28 4.751 -12.951 0.691 1.00 14.24 H new ATOM 0 HD11 ILE A 28 5.664 -9.111 2.073 1.00 74.03 H new ATOM 0 HD12 ILE A 28 5.540 -9.013 0.300 1.00 74.03 H new ATOM 0 HD13 ILE A 28 4.443 -10.076 1.211 1.00 74.03 H new ATOM 418 N LYS A 29 6.494 -14.944 -1.043 1.00 32.13 N ATOM 419 CA LYS A 29 6.088 -15.935 -2.028 1.00 55.12 C ATOM 420 C LYS A 29 4.766 -15.520 -2.642 1.00 3.42 C ATOM 421 O LYS A 29 3.907 -14.929 -1.993 1.00 40.52 O ATOM 422 CB LYS A 29 5.985 -17.343 -1.410 1.00 53.32 C ATOM 423 CG LYS A 29 6.694 -18.439 -2.228 1.00 32.34 C ATOM 424 CD LYS A 29 5.790 -19.493 -2.895 1.00 15.32 C ATOM 425 CE LYS A 29 4.846 -18.897 -3.936 1.00 55.50 C ATOM 426 NZ LYS A 29 4.141 -19.896 -4.762 1.00 0.43 N ATOM 0 H LYS A 29 6.309 -15.218 -0.078 1.00 32.13 H new ATOM 0 HA LYS A 29 6.851 -15.983 -2.805 1.00 55.12 H new ATOM 0 HB2 LYS A 29 6.410 -17.320 -0.407 1.00 53.32 H new ATOM 0 HB3 LYS A 29 4.933 -17.606 -1.304 1.00 53.32 H new ATOM 0 HG2 LYS A 29 7.285 -17.955 -3.006 1.00 32.34 H new ATOM 0 HG3 LYS A 29 7.393 -18.956 -1.571 1.00 32.34 H new ATOM 0 HD2 LYS A 29 6.414 -20.250 -3.370 1.00 15.32 H new ATOM 0 HD3 LYS A 29 5.203 -19.998 -2.128 1.00 15.32 H new ATOM 0 HE2 LYS A 29 4.107 -18.278 -3.427 1.00 55.50 H new ATOM 0 HE3 LYS A 29 5.416 -18.239 -4.591 1.00 55.50 H new ATOM 0 HZ1 LYS A 29 3.472 -19.413 -5.395 1.00 0.43 H new ATOM 0 HZ2 LYS A 29 4.832 -20.428 -5.329 1.00 0.43 H new ATOM 0 HZ3 LYS A 29 3.622 -20.552 -4.145 1.00 0.43 H new ATOM 436 N ASP A 30 4.579 -15.946 -3.883 1.00 71.41 N ATOM 437 CA ASP A 30 3.354 -15.765 -4.671 1.00 41.24 C ATOM 438 C ASP A 30 3.036 -14.274 -4.847 1.00 63.04 C ATOM 439 O ASP A 30 1.875 -13.881 -4.982 1.00 4.12 O ATOM 440 CB ASP A 30 2.176 -16.633 -4.119 1.00 40.50 C ATOM 441 CG ASP A 30 1.675 -17.704 -5.102 1.00 11.42 C ATOM 442 OD1 ASP A 30 2.423 -18.098 -6.022 1.00 74.01 O ATOM 443 OD2 ASP A 30 0.554 -18.245 -4.981 1.00 34.31 O ATOM 0 H ASP A 30 5.303 -16.449 -4.396 1.00 71.41 H new ATOM 0 HA ASP A 30 3.518 -16.146 -5.679 1.00 41.24 H new ATOM 0 HB2 ASP A 30 2.498 -17.121 -3.199 1.00 40.50 H new ATOM 0 HB3 ASP A 30 1.346 -15.977 -3.858 1.00 40.50 H new ATOM 447 N SER A 31 4.070 -13.427 -4.856 1.00 62.43 N ATOM 448 CA SER A 31 3.973 -12.000 -5.039 1.00 15.22 C ATOM 449 C SER A 31 3.979 -11.605 -6.521 1.00 1.52 C ATOM 450 O SER A 31 4.522 -12.313 -7.375 1.00 31.02 O ATOM 451 CB SER A 31 5.138 -11.387 -4.258 1.00 24.32 C ATOM 452 OG SER A 31 6.368 -11.976 -4.647 1.00 33.21 O ATOM 0 H SER A 31 5.031 -13.744 -4.730 1.00 62.43 H new ATOM 0 HA SER A 31 3.023 -11.621 -4.663 1.00 15.22 H new ATOM 0 HB2 SER A 31 5.173 -10.312 -4.432 1.00 24.32 H new ATOM 0 HB3 SER A 31 4.982 -11.532 -3.189 1.00 24.32 H new ATOM 0 HG SER A 31 6.663 -12.604 -3.955 1.00 33.21 H new ATOM 457 N GLU A 32 3.443 -10.423 -6.801 1.00 41.52 N ATOM 458 CA GLU A 32 3.721 -9.592 -7.965 1.00 43.41 C ATOM 459 C GLU A 32 4.270 -8.262 -7.441 1.00 32.25 C ATOM 460 O GLU A 32 4.236 -8.029 -6.230 1.00 24.23 O ATOM 461 CB GLU A 32 2.425 -9.362 -8.756 1.00 41.33 C ATOM 462 CG GLU A 32 2.700 -9.124 -10.243 1.00 73.04 C ATOM 463 CD GLU A 32 1.459 -8.823 -11.084 1.00 74.42 C ATOM 464 OE1 GLU A 32 0.319 -9.182 -10.702 1.00 33.21 O ATOM 465 OE2 GLU A 32 1.624 -8.246 -12.182 1.00 22.15 O ATOM 0 H GLU A 32 2.758 -9.992 -6.180 1.00 41.52 H new ATOM 0 HA GLU A 32 4.440 -10.069 -8.631 1.00 43.41 H new ATOM 0 HB2 GLU A 32 1.771 -10.227 -8.641 1.00 41.33 H new ATOM 0 HB3 GLU A 32 1.895 -8.504 -8.343 1.00 41.33 H new ATOM 0 HG2 GLU A 32 3.398 -8.293 -10.341 1.00 73.04 H new ATOM 0 HG3 GLU A 32 3.194 -10.005 -10.652 1.00 73.04 H new ATOM 470 N LEU A 33 4.695 -7.375 -8.337 1.00 71.11 N ATOM 471 CA LEU A 33 5.105 -6.001 -8.076 1.00 55.43 C ATOM 472 C LEU A 33 4.394 -5.098 -9.085 1.00 61.01 C ATOM 473 O LEU A 33 4.162 -5.488 -10.233 1.00 43.54 O ATOM 474 CB LEU A 33 6.639 -5.870 -8.190 1.00 40.22 C ATOM 475 CG LEU A 33 7.321 -5.382 -6.900 1.00 54.33 C ATOM 476 CD1 LEU A 33 8.848 -5.386 -7.057 1.00 61.42 C ATOM 477 CD2 LEU A 33 6.934 -3.979 -6.430 1.00 55.40 C ATOM 0 H LEU A 33 4.766 -7.613 -9.326 1.00 71.11 H new ATOM 0 HA LEU A 33 4.831 -5.704 -7.064 1.00 55.43 H new ATOM 0 HB2 LEU A 33 7.057 -6.838 -8.466 1.00 40.22 H new ATOM 0 HB3 LEU A 33 6.876 -5.178 -8.998 1.00 40.22 H new ATOM 0 HG LEU A 33 6.968 -6.090 -6.150 1.00 54.33 H new ATOM 0 HD11 LEU A 33 9.310 -5.037 -6.133 1.00 61.42 H new ATOM 0 HD12 LEU A 33 9.189 -6.398 -7.273 1.00 61.42 H new ATOM 0 HD13 LEU A 33 9.131 -4.725 -7.876 1.00 61.42 H new ATOM 0 HD21 LEU A 33 7.474 -3.740 -5.514 1.00 55.40 H new ATOM 0 HD22 LEU A 33 7.190 -3.253 -7.202 1.00 55.40 H new ATOM 0 HD23 LEU A 33 5.862 -3.942 -6.239 1.00 55.40 H new ATOM 488 N LYS A 34 4.020 -3.891 -8.659 1.00 53.34 N ATOM 489 CA LYS A 34 3.161 -2.996 -9.423 1.00 73.31 C ATOM 490 C LYS A 34 3.494 -1.556 -9.088 1.00 0.35 C ATOM 491 O LYS A 34 3.675 -1.233 -7.915 1.00 64.41 O ATOM 492 CB LYS A 34 1.714 -3.312 -9.015 1.00 52.44 C ATOM 493 CG LYS A 34 0.863 -3.794 -10.183 1.00 3.44 C ATOM 494 CD LYS A 34 0.082 -2.643 -10.807 1.00 55.12 C ATOM 495 CE LYS A 34 -0.593 -3.126 -12.088 1.00 71.10 C ATOM 496 NZ LYS A 34 0.362 -3.335 -13.193 1.00 24.43 N ATOM 0 H LYS A 34 4.311 -3.506 -7.761 1.00 53.34 H new ATOM 0 HA LYS A 34 3.302 -3.134 -10.495 1.00 73.31 H new ATOM 0 HB2 LYS A 34 1.719 -4.075 -8.236 1.00 52.44 H new ATOM 0 HB3 LYS A 34 1.260 -2.420 -8.584 1.00 52.44 H new ATOM 0 HG2 LYS A 34 1.502 -4.254 -10.937 1.00 3.44 H new ATOM 0 HG3 LYS A 34 0.171 -4.563 -9.839 1.00 3.44 H new ATOM 0 HD2 LYS A 34 -0.666 -2.274 -10.105 1.00 55.12 H new ATOM 0 HD3 LYS A 34 0.751 -1.811 -11.027 1.00 55.12 H new ATOM 0 HE2 LYS A 34 -1.119 -4.059 -11.887 1.00 71.10 H new ATOM 0 HE3 LYS A 34 -1.343 -2.397 -12.395 1.00 71.10 H new ATOM 0 HZ1 LYS A 34 -0.157 -3.412 -14.091 1.00 24.43 H new ATOM 0 HZ2 LYS A 34 1.019 -2.530 -13.241 1.00 24.43 H new ATOM 0 HZ3 LYS A 34 0.899 -4.210 -13.027 1.00 24.43 H new ATOM 506 N GLU A 35 3.517 -0.678 -10.088 1.00 71.40 N ATOM 507 CA GLU A 35 3.800 0.740 -9.887 1.00 4.53 C ATOM 508 C GLU A 35 2.530 1.567 -10.068 1.00 41.21 C ATOM 509 O GLU A 35 1.624 1.163 -10.804 1.00 2.22 O ATOM 510 CB GLU A 35 4.948 1.203 -10.797 1.00 71.23 C ATOM 511 CG GLU A 35 4.552 1.503 -12.247 1.00 0.51 C ATOM 512 CD GLU A 35 5.791 1.513 -13.128 1.00 11.42 C ATOM 513 OE1 GLU A 35 6.211 0.411 -13.542 1.00 15.12 O ATOM 514 OE2 GLU A 35 6.384 2.583 -13.385 1.00 74.44 O ATOM 0 H GLU A 35 3.340 -0.930 -11.060 1.00 71.40 H new ATOM 0 HA GLU A 35 4.137 0.895 -8.862 1.00 4.53 H new ATOM 0 HB2 GLU A 35 5.393 2.100 -10.366 1.00 71.23 H new ATOM 0 HB3 GLU A 35 5.720 0.434 -10.800 1.00 71.23 H new ATOM 0 HG2 GLU A 35 3.847 0.752 -12.604 1.00 0.51 H new ATOM 0 HG3 GLU A 35 4.047 2.467 -12.304 1.00 0.51 H new ATOM 519 N VAL A 36 2.498 2.737 -9.428 1.00 1.22 N ATOM 520 CA VAL A 36 1.407 3.705 -9.455 1.00 31.42 C ATOM 521 C VAL A 36 2.049 5.090 -9.570 1.00 72.34 C ATOM 522 O VAL A 36 2.997 5.363 -8.831 1.00 42.42 O ATOM 523 CB VAL A 36 0.586 3.598 -8.145 1.00 2.43 C ATOM 524 CG1 VAL A 36 -0.708 4.423 -8.250 1.00 3.31 C ATOM 525 CG2 VAL A 36 0.218 2.142 -7.797 1.00 64.03 C ATOM 0 H VAL A 36 3.276 3.049 -8.846 1.00 1.22 H new ATOM 0 HA VAL A 36 0.731 3.523 -10.291 1.00 31.42 H new ATOM 0 HB VAL A 36 1.221 3.990 -7.351 1.00 2.43 H new ATOM 0 HG11 VAL A 36 -1.271 4.336 -7.321 1.00 3.31 H new ATOM 0 HG12 VAL A 36 -0.459 5.469 -8.427 1.00 3.31 H new ATOM 0 HG13 VAL A 36 -1.312 4.049 -9.077 1.00 3.31 H new ATOM 0 HG21 VAL A 36 -0.356 2.123 -6.871 1.00 64.03 H new ATOM 0 HG22 VAL A 36 -0.379 1.715 -8.603 1.00 64.03 H new ATOM 0 HG23 VAL A 36 1.129 1.557 -7.671 1.00 64.03 H new ATOM 535 N LYS A 37 1.559 5.986 -10.432 1.00 54.13 N ATOM 536 CA LYS A 37 2.041 7.372 -10.558 1.00 33.04 C ATOM 537 C LYS A 37 0.883 8.370 -10.386 1.00 1.53 C ATOM 538 O LYS A 37 -0.274 7.945 -10.314 1.00 32.21 O ATOM 539 CB LYS A 37 2.806 7.544 -11.886 1.00 2.45 C ATOM 540 CG LYS A 37 4.174 6.840 -11.918 1.00 35.21 C ATOM 541 CD LYS A 37 4.160 5.371 -12.390 1.00 73.42 C ATOM 542 CE LYS A 37 4.678 5.213 -13.826 1.00 14.22 C ATOM 543 NZ LYS A 37 3.728 5.716 -14.839 1.00 63.02 N ATOM 0 H LYS A 37 0.800 5.767 -11.077 1.00 54.13 H new ATOM 0 HA LYS A 37 2.746 7.590 -9.756 1.00 33.04 H new ATOM 0 HB2 LYS A 37 2.192 7.158 -12.700 1.00 2.45 H new ATOM 0 HB3 LYS A 37 2.952 8.608 -12.074 1.00 2.45 H new ATOM 0 HG2 LYS A 37 4.838 7.406 -12.571 1.00 35.21 H new ATOM 0 HG3 LYS A 37 4.604 6.877 -10.917 1.00 35.21 H new ATOM 0 HD2 LYS A 37 4.772 4.770 -11.718 1.00 73.42 H new ATOM 0 HD3 LYS A 37 3.144 4.982 -12.328 1.00 73.42 H new ATOM 0 HE2 LYS A 37 5.624 5.746 -13.926 1.00 14.22 H new ATOM 0 HE3 LYS A 37 4.883 4.160 -14.019 1.00 14.22 H new ATOM 0 HZ1 LYS A 37 4.131 5.583 -15.789 1.00 63.02 H new ATOM 0 HZ2 LYS A 37 2.833 5.192 -14.766 1.00 63.02 H new ATOM 0 HZ3 LYS A 37 3.551 6.728 -14.676 1.00 63.02 H new ATOM 553 N VAL A 38 1.180 9.674 -10.298 1.00 33.25 N ATOM 554 CA VAL A 38 0.226 10.773 -10.096 1.00 33.24 C ATOM 555 C VAL A 38 0.509 11.904 -11.092 1.00 24.45 C ATOM 556 O VAL A 38 1.548 11.912 -11.755 1.00 23.12 O ATOM 557 CB VAL A 38 0.260 11.318 -8.646 1.00 53.13 C ATOM 558 CG1 VAL A 38 -0.169 10.273 -7.616 1.00 75.01 C ATOM 559 CG2 VAL A 38 1.635 11.859 -8.233 1.00 3.10 C ATOM 0 H VAL A 38 2.141 10.008 -10.369 1.00 33.25 H new ATOM 0 HA VAL A 38 -0.773 10.374 -10.270 1.00 33.24 H new ATOM 0 HB VAL A 38 -0.455 12.141 -8.655 1.00 53.13 H new ATOM 0 HG11 VAL A 38 -0.127 10.708 -6.617 1.00 75.01 H new ATOM 0 HG12 VAL A 38 -1.188 9.950 -7.828 1.00 75.01 H new ATOM 0 HG13 VAL A 38 0.502 9.415 -7.667 1.00 75.01 H new ATOM 0 HG21 VAL A 38 1.589 12.225 -7.207 1.00 3.10 H new ATOM 0 HG22 VAL A 38 2.375 11.062 -8.301 1.00 3.10 H new ATOM 0 HG23 VAL A 38 1.919 12.675 -8.897 1.00 3.10 H new ATOM 569 N SER A 39 -0.408 12.874 -11.156 1.00 35.11 N ATOM 570 CA SER A 39 -0.302 14.087 -11.941 1.00 54.12 C ATOM 571 C SER A 39 0.916 14.886 -11.497 1.00 15.31 C ATOM 572 O SER A 39 1.380 14.814 -10.354 1.00 4.32 O ATOM 573 CB SER A 39 -1.613 14.878 -11.764 1.00 33.10 C ATOM 574 OG SER A 39 -1.621 16.237 -12.167 1.00 75.41 O ATOM 0 H SER A 39 -1.282 12.823 -10.633 1.00 35.11 H new ATOM 0 HA SER A 39 -0.164 13.863 -12.999 1.00 54.12 H new ATOM 0 HB2 SER A 39 -2.395 14.359 -12.318 1.00 33.10 H new ATOM 0 HB3 SER A 39 -1.889 14.839 -10.710 1.00 33.10 H new ATOM 0 HG SER A 39 -1.124 16.774 -11.516 1.00 75.41 H new ATOM 579 N GLU A 40 1.327 15.752 -12.409 1.00 41.42 N ATOM 580 CA GLU A 40 2.176 16.892 -12.140 1.00 33.41 C ATOM 581 C GLU A 40 1.467 17.842 -11.199 1.00 41.54 C ATOM 582 O GLU A 40 0.256 17.723 -10.947 1.00 53.31 O ATOM 583 CB GLU A 40 2.438 17.632 -13.451 1.00 73.03 C ATOM 584 CG GLU A 40 3.340 16.803 -14.358 1.00 63.31 C ATOM 585 CD GLU A 40 4.637 17.496 -14.783 1.00 32.14 C ATOM 586 OE1 GLU A 40 5.274 18.207 -13.973 1.00 75.14 O ATOM 587 OE2 GLU A 40 5.171 17.166 -15.868 1.00 12.20 O ATOM 0 H GLU A 40 1.067 15.674 -13.392 1.00 41.42 H new ATOM 0 HA GLU A 40 3.110 16.550 -11.694 1.00 33.41 H new ATOM 0 HB2 GLU A 40 1.494 17.837 -13.955 1.00 73.03 H new ATOM 0 HB3 GLU A 40 2.905 18.595 -13.245 1.00 73.03 H new ATOM 0 HG2 GLU A 40 3.592 15.875 -13.845 1.00 63.31 H new ATOM 0 HG3 GLU A 40 2.780 16.531 -15.253 1.00 63.31 H new ATOM 592 N GLY A 41 2.221 18.822 -10.714 1.00 4.51 N ATOM 593 CA GLY A 41 1.628 19.949 -10.044 1.00 44.51 C ATOM 594 C GLY A 41 1.188 19.610 -8.617 1.00 41.14 C ATOM 595 O GLY A 41 0.971 20.522 -7.820 1.00 1.41 O ATOM 0 H GLY A 41 3.239 18.850 -10.777 1.00 4.51 H new ATOM 0 HA2 GLY A 41 2.344 20.770 -10.016 1.00 44.51 H new ATOM 0 HA3 GLY A 41 0.767 20.296 -10.615 1.00 44.51 H new ATOM 599 N THR A 42 1.098 18.321 -8.275 1.00 55.12 N ATOM 600 CA THR A 42 0.752 17.846 -6.958 1.00 61.12 C ATOM 601 C THR A 42 1.864 18.236 -5.971 1.00 42.45 C ATOM 602 O THR A 42 1.559 18.892 -4.987 1.00 4.20 O ATOM 603 CB THR A 42 0.461 16.329 -7.005 1.00 73.42 C ATOM 604 OG1 THR A 42 -0.151 15.905 -8.224 1.00 34.14 O ATOM 605 CG2 THR A 42 -0.497 15.929 -5.882 1.00 61.25 C ATOM 0 H THR A 42 1.272 17.566 -8.938 1.00 55.12 H new ATOM 0 HA THR A 42 -0.164 18.317 -6.602 1.00 61.12 H new ATOM 0 HB THR A 42 1.436 15.853 -6.905 1.00 73.42 H new ATOM 0 HG1 THR A 42 0.536 15.562 -8.833 1.00 34.14 H new ATOM 0 HG21 THR A 42 -0.689 14.857 -5.932 1.00 61.25 H new ATOM 0 HG22 THR A 42 -0.050 16.173 -4.918 1.00 61.25 H new ATOM 0 HG23 THR A 42 -1.436 16.472 -5.994 1.00 61.25 H new ATOM 613 N PHE A 43 3.134 17.854 -6.188 1.00 42.21 N ATOM 614 CA PHE A 43 4.236 18.191 -5.270 1.00 15.33 C ATOM 615 C PHE A 43 5.462 18.672 -6.050 1.00 73.42 C ATOM 616 O PHE A 43 5.523 18.541 -7.273 1.00 40.51 O ATOM 617 CB PHE A 43 4.567 17.024 -4.307 1.00 75.44 C ATOM 618 CG PHE A 43 3.566 16.850 -3.175 1.00 74.04 C ATOM 619 CD1 PHE A 43 2.249 16.435 -3.435 1.00 22.44 C ATOM 620 CD2 PHE A 43 3.921 17.193 -1.859 1.00 2.21 C ATOM 621 CE1 PHE A 43 1.264 16.518 -2.438 1.00 35.01 C ATOM 622 CE2 PHE A 43 2.950 17.246 -0.844 1.00 51.25 C ATOM 623 CZ PHE A 43 1.611 16.949 -1.150 1.00 40.55 C ATOM 0 H PHE A 43 3.425 17.307 -6.998 1.00 42.21 H new ATOM 0 HA PHE A 43 3.906 19.016 -4.639 1.00 15.33 H new ATOM 0 HB2 PHE A 43 4.617 16.098 -4.879 1.00 75.44 H new ATOM 0 HB3 PHE A 43 5.557 17.189 -3.881 1.00 75.44 H new ATOM 0 HD1 PHE A 43 1.992 16.049 -4.410 1.00 22.44 H new ATOM 0 HD2 PHE A 43 4.951 17.418 -1.625 1.00 2.21 H new ATOM 0 HE1 PHE A 43 0.242 16.251 -2.663 1.00 35.01 H new ATOM 0 HE2 PHE A 43 3.231 17.513 0.164 1.00 51.25 H new ATOM 0 HZ PHE A 43 0.849 17.053 -0.392 1.00 40.55 H new ATOM 632 N ASP A 44 6.444 19.241 -5.341 1.00 54.32 N ATOM 633 CA ASP A 44 7.560 20.015 -5.921 1.00 20.12 C ATOM 634 C ASP A 44 8.892 19.714 -5.237 1.00 61.35 C ATOM 635 O ASP A 44 9.820 20.524 -5.235 1.00 43.35 O ATOM 636 CB ASP A 44 7.249 21.508 -5.813 1.00 33.12 C ATOM 637 CG ASP A 44 7.975 22.307 -6.903 1.00 22.24 C ATOM 638 OD1 ASP A 44 7.545 22.227 -8.076 1.00 51.31 O ATOM 639 OD2 ASP A 44 8.955 23.032 -6.614 1.00 33.03 O ATOM 0 H ASP A 44 6.490 19.178 -4.324 1.00 54.32 H new ATOM 0 HA ASP A 44 7.660 19.722 -6.966 1.00 20.12 H new ATOM 0 HB2 ASP A 44 6.174 21.665 -5.899 1.00 33.12 H new ATOM 0 HB3 ASP A 44 7.547 21.874 -4.831 1.00 33.12 H new ATOM 643 N ALA A 45 8.945 18.569 -4.560 1.00 54.45 N ATOM 644 CA ALA A 45 10.089 18.075 -3.787 1.00 21.20 C ATOM 645 C ALA A 45 10.642 19.115 -2.788 1.00 41.23 C ATOM 646 O ALA A 45 11.824 19.088 -2.454 1.00 15.32 O ATOM 647 CB ALA A 45 11.164 17.574 -4.768 1.00 24.42 C ATOM 0 H ALA A 45 8.153 17.927 -4.532 1.00 54.45 H new ATOM 0 HA ALA A 45 9.755 17.247 -3.161 1.00 21.20 H new ATOM 0 HB1 ALA A 45 12.023 17.203 -4.208 1.00 24.42 H new ATOM 0 HB2 ALA A 45 10.753 16.770 -5.378 1.00 24.42 H new ATOM 0 HB3 ALA A 45 11.479 18.394 -5.413 1.00 24.42 H new ATOM 653 N ASP A 46 9.818 20.078 -2.369 1.00 41.34 N ATOM 654 CA ASP A 46 10.252 21.322 -1.735 1.00 11.51 C ATOM 655 C ASP A 46 10.098 21.259 -0.217 1.00 71.21 C ATOM 656 O ASP A 46 9.251 20.516 0.286 1.00 60.01 O ATOM 657 CB ASP A 46 9.388 22.460 -2.284 1.00 62.11 C ATOM 658 CG ASP A 46 10.023 23.812 -2.020 1.00 4.20 C ATOM 659 OD1 ASP A 46 9.765 24.356 -0.933 1.00 14.30 O ATOM 660 OD2 ASP A 46 10.734 24.310 -2.930 1.00 71.21 O ATOM 0 H ASP A 46 8.805 20.011 -2.464 1.00 41.34 H new ATOM 0 HA ASP A 46 11.307 21.485 -1.956 1.00 11.51 H new ATOM 0 HB2 ASP A 46 9.245 22.326 -3.356 1.00 62.11 H new ATOM 0 HB3 ASP A 46 8.400 22.424 -1.824 1.00 62.11 H new ATOM 664 N MET A 47 10.862 22.062 0.518 1.00 14.33 N ATOM 665 CA MET A 47 10.861 22.133 1.974 1.00 63.11 C ATOM 666 C MET A 47 9.716 22.980 2.545 1.00 20.11 C ATOM 667 O MET A 47 9.254 22.727 3.663 1.00 63.41 O ATOM 668 CB MET A 47 12.223 22.721 2.380 1.00 4.10 C ATOM 669 CG MET A 47 12.303 23.108 3.857 1.00 22.32 C ATOM 670 SD MET A 47 13.974 23.418 4.501 1.00 44.33 S ATOM 671 CE MET A 47 14.438 24.809 3.450 1.00 32.03 C ATOM 0 H MET A 47 11.528 22.709 0.095 1.00 14.33 H new ATOM 0 HA MET A 47 10.703 21.135 2.383 1.00 63.11 H new ATOM 0 HB2 MET A 47 13.004 21.993 2.160 1.00 4.10 H new ATOM 0 HB3 MET A 47 12.426 23.601 1.770 1.00 4.10 H new ATOM 0 HG2 MET A 47 11.702 24.004 4.012 1.00 22.32 H new ATOM 0 HG3 MET A 47 11.848 22.313 4.447 1.00 22.32 H new ATOM 0 HE1 MET A 47 15.408 25.194 3.764 1.00 32.03 H new ATOM 0 HE2 MET A 47 14.497 24.478 2.413 1.00 32.03 H new ATOM 0 HE3 MET A 47 13.690 25.597 3.537 1.00 32.03 H new ATOM 679 N TYR A 48 9.290 24.017 1.833 1.00 13.40 N ATOM 680 CA TYR A 48 8.396 25.056 2.326 1.00 22.30 C ATOM 681 C TYR A 48 7.187 25.265 1.425 1.00 0.53 C ATOM 682 O TYR A 48 6.190 25.832 1.872 1.00 61.32 O ATOM 683 CB TYR A 48 9.202 26.347 2.481 1.00 15.50 C ATOM 684 CG TYR A 48 9.993 26.776 1.260 1.00 63.12 C ATOM 685 CD1 TYR A 48 9.384 27.550 0.257 1.00 51.45 C ATOM 686 CD2 TYR A 48 11.334 26.373 1.113 1.00 20.34 C ATOM 687 CE1 TYR A 48 10.086 27.865 -0.918 1.00 61.44 C ATOM 688 CE2 TYR A 48 12.034 26.654 -0.071 1.00 64.45 C ATOM 689 CZ TYR A 48 11.399 27.373 -1.108 1.00 0.54 C ATOM 690 OH TYR A 48 12.036 27.581 -2.294 1.00 2.50 O ATOM 0 H TYR A 48 9.568 24.162 0.862 1.00 13.40 H new ATOM 0 HA TYR A 48 7.993 24.745 3.290 1.00 22.30 H new ATOM 0 HB2 TYR A 48 8.517 27.152 2.749 1.00 15.50 H new ATOM 0 HB3 TYR A 48 9.893 26.225 3.315 1.00 15.50 H new ATOM 0 HD1 TYR A 48 8.372 27.904 0.390 1.00 51.45 H new ATOM 0 HD2 TYR A 48 11.827 25.845 1.916 1.00 20.34 H new ATOM 0 HE1 TYR A 48 9.624 28.482 -1.675 1.00 61.44 H new ATOM 0 HE2 TYR A 48 13.055 26.322 -0.189 1.00 64.45 H new ATOM 0 HH TYR A 48 12.930 27.181 -2.260 1.00 2.50 H new ATOM 699 N LYS A 49 7.245 24.810 0.174 1.00 41.35 N ATOM 700 CA LYS A 49 6.072 24.714 -0.687 1.00 11.42 C ATOM 701 C LYS A 49 5.254 23.482 -0.300 1.00 3.30 C ATOM 702 O LYS A 49 4.062 23.608 -0.038 1.00 1.50 O ATOM 703 CB LYS A 49 6.478 24.725 -2.175 1.00 51.42 C ATOM 704 CG LYS A 49 5.339 25.213 -3.082 1.00 40.21 C ATOM 705 CD LYS A 49 5.237 26.747 -3.159 1.00 61.13 C ATOM 706 CE LYS A 49 3.893 27.114 -3.799 1.00 63.42 C ATOM 707 NZ LYS A 49 3.707 28.561 -4.038 1.00 21.33 N ATOM 0 H LYS A 49 8.109 24.498 -0.269 1.00 41.35 H new ATOM 0 HA LYS A 49 5.437 25.588 -0.543 1.00 11.42 H new ATOM 0 HB2 LYS A 49 7.348 25.369 -2.308 1.00 51.42 H new ATOM 0 HB3 LYS A 49 6.776 23.721 -2.476 1.00 51.42 H new ATOM 0 HG2 LYS A 49 5.487 24.815 -4.086 1.00 40.21 H new ATOM 0 HG3 LYS A 49 4.394 24.811 -2.716 1.00 40.21 H new ATOM 0 HD2 LYS A 49 5.313 27.182 -2.163 1.00 61.13 H new ATOM 0 HD3 LYS A 49 6.060 27.152 -3.748 1.00 61.13 H new ATOM 0 HE2 LYS A 49 3.800 26.586 -4.748 1.00 63.42 H new ATOM 0 HE3 LYS A 49 3.088 26.758 -3.156 1.00 63.42 H new ATOM 0 HZ1 LYS A 49 2.776 28.724 -4.472 1.00 21.33 H new ATOM 0 HZ2 LYS A 49 3.762 29.072 -3.134 1.00 21.33 H new ATOM 0 HZ3 LYS A 49 4.452 28.906 -4.677 1.00 21.33 H new ATOM 717 N THR A 50 5.854 22.285 -0.241 1.00 72.24 N ATOM 718 CA THR A 50 5.040 21.074 -0.091 1.00 74.32 C ATOM 719 C THR A 50 4.309 21.010 1.250 1.00 13.42 C ATOM 720 O THR A 50 3.232 20.417 1.328 1.00 0.13 O ATOM 721 CB THR A 50 5.860 19.799 -0.306 1.00 44.54 C ATOM 722 OG1 THR A 50 6.836 19.634 0.700 1.00 75.33 O ATOM 723 CG2 THR A 50 6.481 19.740 -1.705 1.00 74.45 C ATOM 0 H THR A 50 6.861 22.132 -0.293 1.00 72.24 H new ATOM 0 HA THR A 50 4.284 21.135 -0.874 1.00 74.32 H new ATOM 0 HB THR A 50 5.166 18.962 -0.232 1.00 44.54 H new ATOM 0 HG1 THR A 50 7.618 20.187 0.491 1.00 75.33 H new ATOM 0 HG21 THR A 50 7.053 18.818 -1.811 1.00 74.45 H new ATOM 0 HG22 THR A 50 5.691 19.765 -2.455 1.00 74.45 H new ATOM 0 HG23 THR A 50 7.142 20.595 -1.846 1.00 74.45 H new ATOM 731 N SER A 51 4.872 21.625 2.296 1.00 75.13 N ATOM 732 CA SER A 51 4.261 21.648 3.609 1.00 0.30 C ATOM 733 C SER A 51 2.942 22.433 3.592 1.00 2.40 C ATOM 734 O SER A 51 2.098 22.210 4.464 1.00 1.42 O ATOM 735 CB SER A 51 5.277 22.207 4.611 1.00 21.30 C ATOM 736 OG SER A 51 5.645 23.536 4.291 1.00 14.51 O ATOM 0 H SER A 51 5.764 22.118 2.245 1.00 75.13 H new ATOM 0 HA SER A 51 3.996 20.637 3.919 1.00 0.30 H new ATOM 0 HB2 SER A 51 4.853 22.178 5.615 1.00 21.30 H new ATOM 0 HB3 SER A 51 6.165 21.575 4.621 1.00 21.30 H new ATOM 0 HG SER A 51 6.292 23.864 4.950 1.00 14.51 H new ATOM 741 N ASP A 52 2.754 23.326 2.617 1.00 22.31 N ATOM 742 CA ASP A 52 1.509 24.048 2.388 1.00 42.11 C ATOM 743 C ASP A 52 0.573 23.211 1.513 1.00 62.42 C ATOM 744 O ASP A 52 -0.607 23.067 1.819 1.00 41.23 O ATOM 745 CB ASP A 52 1.809 25.394 1.711 1.00 1.13 C ATOM 746 CG ASP A 52 0.605 26.322 1.840 1.00 31.14 C ATOM 747 OD1 ASP A 52 0.245 26.636 3.001 1.00 35.01 O ATOM 748 OD2 ASP A 52 0.049 26.752 0.804 1.00 23.43 O ATOM 0 H ASP A 52 3.486 23.570 1.950 1.00 22.31 H new ATOM 0 HA ASP A 52 1.019 24.234 3.344 1.00 42.11 H new ATOM 0 HB2 ASP A 52 2.684 25.854 2.170 1.00 1.13 H new ATOM 0 HB3 ASP A 52 2.046 25.237 0.659 1.00 1.13 H new ATOM 752 N ILE A 53 1.110 22.611 0.445 1.00 43.54 N ATOM 753 CA ILE A 53 0.331 21.842 -0.525 1.00 75.24 C ATOM 754 C ILE A 53 -0.391 20.676 0.160 1.00 3.11 C ATOM 755 O ILE A 53 -1.607 20.550 0.009 1.00 53.25 O ATOM 756 CB ILE A 53 1.193 21.377 -1.723 1.00 42.15 C ATOM 757 CG1 ILE A 53 1.800 22.581 -2.489 1.00 0.42 C ATOM 758 CG2 ILE A 53 0.323 20.524 -2.669 1.00 51.51 C ATOM 759 CD1 ILE A 53 2.954 22.191 -3.423 1.00 75.12 C ATOM 0 H ILE A 53 2.106 22.647 0.230 1.00 43.54 H new ATOM 0 HA ILE A 53 -0.432 22.502 -0.939 1.00 75.24 H new ATOM 0 HB ILE A 53 2.023 20.781 -1.344 1.00 42.15 H new ATOM 0 HG12 ILE A 53 1.016 23.062 -3.074 1.00 0.42 H new ATOM 0 HG13 ILE A 53 2.158 23.317 -1.769 1.00 0.42 H new ATOM 0 HG21 ILE A 53 0.924 20.193 -3.516 1.00 51.51 H new ATOM 0 HG22 ILE A 53 -0.056 19.655 -2.131 1.00 51.51 H new ATOM 0 HG23 ILE A 53 -0.515 21.121 -3.030 1.00 51.51 H new ATOM 0 HD11 ILE A 53 3.331 23.081 -3.927 1.00 75.12 H new ATOM 0 HD12 ILE A 53 3.756 21.736 -2.841 1.00 75.12 H new ATOM 0 HD13 ILE A 53 2.596 21.478 -4.166 1.00 75.12 H new ATOM 770 N ALA A 54 0.307 19.833 0.936 1.00 44.54 N ATOM 771 CA ALA A 54 -0.395 18.726 1.581 1.00 43.43 C ATOM 772 C ALA A 54 -1.424 19.237 2.590 1.00 12.50 C ATOM 773 O ALA A 54 -2.397 18.540 2.844 1.00 53.45 O ATOM 774 CB ALA A 54 0.559 17.744 2.269 1.00 0.34 C ATOM 0 H ALA A 54 1.308 19.893 1.123 1.00 44.54 H new ATOM 0 HA ALA A 54 -0.908 18.188 0.784 1.00 43.43 H new ATOM 0 HB1 ALA A 54 -0.016 16.942 2.732 1.00 0.34 H new ATOM 0 HB2 ALA A 54 1.242 17.322 1.531 1.00 0.34 H new ATOM 0 HB3 ALA A 54 1.131 18.268 3.034 1.00 0.34 H new ATOM 780 N LEU A 55 -1.236 20.432 3.159 1.00 71.22 N ATOM 781 CA LEU A 55 -2.148 20.998 4.144 1.00 64.34 C ATOM 782 C LEU A 55 -3.489 21.335 3.496 1.00 42.34 C ATOM 783 O LEU A 55 -4.557 21.055 4.042 1.00 72.34 O ATOM 784 CB LEU A 55 -1.540 22.280 4.740 1.00 14.53 C ATOM 785 CG LEU A 55 -1.662 22.390 6.270 1.00 4.54 C ATOM 786 CD1 LEU A 55 -1.543 23.862 6.667 1.00 72.13 C ATOM 787 CD2 LEU A 55 -2.962 21.862 6.872 1.00 14.51 C ATOM 0 H LEU A 55 -0.440 21.033 2.944 1.00 71.22 H new ATOM 0 HA LEU A 55 -2.306 20.262 4.933 1.00 64.34 H new ATOM 0 HB2 LEU A 55 -0.486 22.328 4.467 1.00 14.53 H new ATOM 0 HB3 LEU A 55 -2.026 23.143 4.286 1.00 14.53 H new ATOM 0 HG LEU A 55 -0.862 21.762 6.662 1.00 4.54 H new ATOM 0 HD11 LEU A 55 -1.628 23.955 7.750 1.00 72.13 H new ATOM 0 HD12 LEU A 55 -0.576 24.249 6.344 1.00 72.13 H new ATOM 0 HD13 LEU A 55 -2.340 24.433 6.190 1.00 72.13 H new ATOM 0 HD21 LEU A 55 -2.940 21.989 7.954 1.00 14.51 H new ATOM 0 HD22 LEU A 55 -3.805 22.415 6.459 1.00 14.51 H new ATOM 0 HD23 LEU A 55 -3.070 20.804 6.633 1.00 14.51 H new ATOM 798 N ASP A 56 -3.418 21.950 2.319 1.00 71.14 N ATOM 799 CA ASP A 56 -4.552 22.234 1.449 1.00 71.25 C ATOM 800 C ASP A 56 -5.310 20.936 1.144 1.00 41.21 C ATOM 801 O ASP A 56 -6.534 20.858 1.301 1.00 72.44 O ATOM 802 CB ASP A 56 -4.032 22.901 0.168 1.00 41.34 C ATOM 803 CG ASP A 56 -4.984 22.814 -0.943 1.00 20.02 C ATOM 804 OD1 ASP A 56 -5.978 23.537 -0.763 1.00 33.23 O ATOM 805 OD2 ASP A 56 -4.630 22.232 -1.997 1.00 12.11 O ATOM 0 H ASP A 56 -2.533 22.277 1.931 1.00 71.14 H new ATOM 0 HA ASP A 56 -5.250 22.914 1.938 1.00 71.25 H new ATOM 0 HB2 ASP A 56 -3.814 23.949 0.372 1.00 41.34 H new ATOM 0 HB3 ASP A 56 -3.093 22.431 -0.126 1.00 41.34 H new ATOM 809 N GLN A 57 -4.576 19.881 0.789 1.00 71.02 N ATOM 810 CA GLN A 57 -5.122 18.557 0.499 1.00 64.23 C ATOM 811 C GLN A 57 -5.396 17.725 1.772 1.00 62.31 C ATOM 812 O GLN A 57 -5.664 16.528 1.661 1.00 40.25 O ATOM 813 CB GLN A 57 -4.218 17.834 -0.520 1.00 15.43 C ATOM 814 CG GLN A 57 -4.040 18.666 -1.800 1.00 13.50 C ATOM 815 CD GLN A 57 -3.382 17.877 -2.927 1.00 21.41 C ATOM 816 OE1 GLN A 57 -2.211 17.519 -2.866 1.00 52.24 O ATOM 817 NE2 GLN A 57 -4.118 17.597 -3.990 1.00 3.54 N ATOM 0 H GLN A 57 -3.561 19.926 0.693 1.00 71.02 H new ATOM 0 HA GLN A 57 -6.105 18.684 0.045 1.00 64.23 H new ATOM 0 HB2 GLN A 57 -3.244 17.641 -0.071 1.00 15.43 H new ATOM 0 HB3 GLN A 57 -4.651 16.866 -0.771 1.00 15.43 H new ATOM 0 HG2 GLN A 57 -5.014 19.025 -2.134 1.00 13.50 H new ATOM 0 HG3 GLN A 57 -3.436 19.545 -1.576 1.00 13.50 H new ATOM 0 HE21 GLN A 57 -5.091 17.900 -4.031 1.00 3.54 H new ATOM 0 HE22 GLN A 57 -3.712 17.079 -4.769 1.00 3.54 H new ATOM 824 N ILE A 58 -5.355 18.321 2.969 1.00 1.52 N ATOM 825 CA ILE A 58 -5.819 17.724 4.224 1.00 51.42 C ATOM 826 C ILE A 58 -7.122 18.392 4.648 1.00 51.33 C ATOM 827 O ILE A 58 -8.090 17.701 4.946 1.00 21.13 O ATOM 828 CB ILE A 58 -4.721 17.798 5.320 1.00 40.22 C ATOM 829 CG1 ILE A 58 -3.626 16.741 5.061 1.00 64.01 C ATOM 830 CG2 ILE A 58 -5.250 17.661 6.764 1.00 1.53 C ATOM 831 CD1 ILE A 58 -2.296 17.093 5.744 1.00 2.14 C ATOM 0 H ILE A 58 -4.985 19.263 3.094 1.00 1.52 H new ATOM 0 HA ILE A 58 -6.020 16.663 4.073 1.00 51.42 H new ATOM 0 HB ILE A 58 -4.305 18.803 5.244 1.00 40.22 H new ATOM 0 HG12 ILE A 58 -3.970 15.771 5.420 1.00 64.01 H new ATOM 0 HG13 ILE A 58 -3.465 16.645 3.987 1.00 64.01 H new ATOM 0 HG21 ILE A 58 -4.417 17.724 7.464 1.00 1.53 H new ATOM 0 HG22 ILE A 58 -5.958 18.464 6.970 1.00 1.53 H new ATOM 0 HG23 ILE A 58 -5.749 16.699 6.879 1.00 1.53 H new ATOM 0 HD11 ILE A 58 -1.561 16.317 5.530 1.00 2.14 H new ATOM 0 HD12 ILE A 58 -1.935 18.050 5.366 1.00 2.14 H new ATOM 0 HD13 ILE A 58 -2.447 17.162 6.821 1.00 2.14 H new ATOM 842 N GLN A 59 -7.140 19.725 4.736 1.00 0.30 N ATOM 843 CA GLN A 59 -8.155 20.436 5.509 1.00 64.24 C ATOM 844 C GLN A 59 -9.564 20.417 4.894 1.00 33.44 C ATOM 845 O GLN A 59 -10.479 20.974 5.512 1.00 0.10 O ATOM 846 CB GLN A 59 -7.703 21.889 5.728 1.00 53.54 C ATOM 847 CG GLN A 59 -6.579 22.026 6.757 1.00 2.50 C ATOM 848 CD GLN A 59 -6.205 23.493 6.943 1.00 63.44 C ATOM 849 OE1 GLN A 59 -5.583 24.109 5.952 1.00 1.14 O flip ATOM 850 NE2 GLN A 59 -6.500 24.104 7.966 1.00 71.25 N flip ATOM 0 H GLN A 59 -6.460 20.332 4.279 1.00 0.30 H new ATOM 0 HA GLN A 59 -8.242 19.900 6.454 1.00 64.24 H new ATOM 0 HB2 GLN A 59 -7.368 22.305 4.778 1.00 53.54 H new ATOM 0 HB3 GLN A 59 -8.557 22.483 6.053 1.00 53.54 H new ATOM 0 HG2 GLN A 59 -6.896 21.601 7.710 1.00 2.50 H new ATOM 0 HG3 GLN A 59 -5.707 21.460 6.430 1.00 2.50 H new ATOM 0 HE21 GLN A 59 -6.980 23.623 8.727 1.00 71.25 H new ATOM 0 HE22 GLN A 59 -6.265 25.093 8.055 1.00 71.25 H new ATOM 857 N GLY A 60 -9.763 19.852 3.704 1.00 13.40 N ATOM 858 CA GLY A 60 -11.005 19.995 2.952 1.00 63.35 C ATOM 859 C GLY A 60 -11.049 21.306 2.165 1.00 41.45 C ATOM 860 O GLY A 60 -12.123 21.757 1.762 1.00 71.43 O ATOM 0 H GLY A 60 -9.062 19.279 3.233 1.00 13.40 H new ATOM 0 HA2 GLY A 60 -11.112 19.156 2.265 1.00 63.35 H new ATOM 0 HA3 GLY A 60 -11.851 19.955 3.638 1.00 63.35 H new ATOM 864 N ASN A 61 -9.887 21.942 1.973 1.00 13.10 N ATOM 865 CA ASN A 61 -9.758 23.172 1.194 1.00 40.35 C ATOM 866 C ASN A 61 -9.803 22.843 -0.296 1.00 32.21 C ATOM 867 O ASN A 61 -10.371 23.598 -1.083 1.00 2.54 O ATOM 868 CB ASN A 61 -8.429 23.888 1.486 1.00 12.10 C ATOM 869 CG ASN A 61 -8.201 24.265 2.942 1.00 52.33 C ATOM 870 OD1 ASN A 61 -9.075 24.152 3.796 1.00 4.33 O ATOM 871 ND2 ASN A 61 -6.991 24.669 3.273 1.00 11.34 N ATOM 0 H ASN A 61 -9.003 21.611 2.359 1.00 13.10 H new ATOM 0 HA ASN A 61 -10.584 23.826 1.474 1.00 40.35 H new ATOM 0 HB2 ASN A 61 -7.610 23.246 1.161 1.00 12.10 H new ATOM 0 HB3 ASN A 61 -8.383 24.794 0.882 1.00 12.10 H new ATOM 0 HD21 ASN A 61 -6.775 24.890 4.245 1.00 11.34 H new ATOM 0 HD22 ASN A 61 -6.270 24.760 2.557 1.00 11.34 H new ATOM 877 N LYS A 62 -9.202 21.718 -0.690 1.00 55.14 N ATOM 878 CA LYS A 62 -9.023 21.291 -2.070 1.00 73.35 C ATOM 879 C LYS A 62 -9.281 19.809 -2.215 1.00 22.32 C ATOM 880 O LYS A 62 -9.483 19.092 -1.227 1.00 0.33 O ATOM 881 CB LYS A 62 -7.575 21.589 -2.482 1.00 35.31 C ATOM 882 CG LYS A 62 -7.339 22.930 -3.194 1.00 14.20 C ATOM 883 CD LYS A 62 -8.251 23.271 -4.386 1.00 43.52 C ATOM 884 CE LYS A 62 -7.438 23.624 -5.642 1.00 43.43 C ATOM 885 NZ LYS A 62 -7.206 22.444 -6.504 1.00 31.34 N ATOM 0 H LYS A 62 -8.811 21.054 -0.022 1.00 55.14 H new ATOM 0 HA LYS A 62 -9.729 21.827 -2.704 1.00 73.35 H new ATOM 0 HB2 LYS A 62 -6.951 21.560 -1.589 1.00 35.31 H new ATOM 0 HB3 LYS A 62 -7.232 20.788 -3.137 1.00 35.31 H new ATOM 0 HG2 LYS A 62 -7.439 23.725 -2.455 1.00 14.20 H new ATOM 0 HG3 LYS A 62 -6.307 22.948 -3.544 1.00 14.20 H new ATOM 0 HD2 LYS A 62 -8.902 22.423 -4.600 1.00 43.52 H new ATOM 0 HD3 LYS A 62 -8.896 24.109 -4.123 1.00 43.52 H new ATOM 0 HE2 LYS A 62 -7.965 24.390 -6.211 1.00 43.43 H new ATOM 0 HE3 LYS A 62 -6.480 24.050 -5.345 1.00 43.43 H new ATOM 0 HZ1 LYS A 62 -6.654 22.727 -7.339 1.00 31.34 H new ATOM 0 HZ2 LYS A 62 -6.681 21.722 -5.970 1.00 31.34 H new ATOM 0 HZ3 LYS A 62 -8.120 22.052 -6.809 1.00 31.34 H new ATOM 895 N ASP A 63 -9.240 19.370 -3.464 1.00 15.34 N ATOM 896 CA ASP A 63 -9.446 17.989 -3.864 1.00 3.24 C ATOM 897 C ASP A 63 -8.105 17.256 -3.838 1.00 63.25 C ATOM 898 O ASP A 63 -7.028 17.870 -3.788 1.00 33.21 O ATOM 899 CB ASP A 63 -10.122 17.960 -5.241 1.00 35.12 C ATOM 900 CG ASP A 63 -11.118 16.819 -5.416 1.00 41.44 C ATOM 901 OD1 ASP A 63 -10.832 15.679 -4.998 1.00 13.44 O ATOM 902 OD2 ASP A 63 -12.199 17.070 -5.992 1.00 44.43 O ATOM 0 H ASP A 63 -9.056 19.989 -4.254 1.00 15.34 H new ATOM 0 HA ASP A 63 -10.109 17.471 -3.171 1.00 3.24 H new ATOM 0 HB2 ASP A 63 -10.637 18.907 -5.402 1.00 35.12 H new ATOM 0 HB3 ASP A 63 -9.354 17.880 -6.010 1.00 35.12 H new ATOM 906 N PHE A 64 -8.168 15.934 -3.851 1.00 55.55 N ATOM 907 CA PHE A 64 -7.025 15.034 -3.707 1.00 21.11 C ATOM 908 C PHE A 64 -6.495 14.644 -5.097 1.00 40.13 C ATOM 909 O PHE A 64 -7.204 14.831 -6.094 1.00 43.52 O ATOM 910 CB PHE A 64 -7.451 13.818 -2.861 1.00 20.41 C ATOM 911 CG PHE A 64 -8.793 13.232 -3.227 1.00 1.34 C ATOM 912 CD1 PHE A 64 -9.957 13.741 -2.617 1.00 62.21 C ATOM 913 CD2 PHE A 64 -8.890 12.255 -4.233 1.00 51.11 C ATOM 914 CE1 PHE A 64 -11.219 13.317 -3.055 1.00 54.11 C ATOM 915 CE2 PHE A 64 -10.155 11.826 -4.662 1.00 13.24 C ATOM 916 CZ PHE A 64 -11.316 12.379 -4.097 1.00 73.01 C ATOM 0 H PHE A 64 -9.050 15.435 -3.967 1.00 55.55 H new ATOM 0 HA PHE A 64 -6.204 15.525 -3.185 1.00 21.11 H new ATOM 0 HB2 PHE A 64 -6.692 13.041 -2.958 1.00 20.41 H new ATOM 0 HB3 PHE A 64 -7.473 14.113 -1.812 1.00 20.41 H new ATOM 0 HD1 PHE A 64 -9.877 14.457 -1.813 1.00 62.21 H new ATOM 0 HD2 PHE A 64 -7.996 11.837 -4.673 1.00 51.11 H new ATOM 0 HE1 PHE A 64 -12.113 13.709 -2.594 1.00 54.11 H new ATOM 0 HE2 PHE A 64 -10.236 11.069 -5.428 1.00 13.24 H new ATOM 0 HZ PHE A 64 -12.287 12.082 -4.465 1.00 73.01 H new ATOM 925 N PRO A 65 -5.255 14.130 -5.214 1.00 1.50 N ATOM 926 CA PRO A 65 -4.689 13.805 -6.516 1.00 31.32 C ATOM 927 C PRO A 65 -5.367 12.617 -7.190 1.00 32.02 C ATOM 928 O PRO A 65 -5.861 11.693 -6.539 1.00 1.44 O ATOM 929 CB PRO A 65 -3.208 13.509 -6.285 1.00 41.34 C ATOM 930 CG PRO A 65 -3.091 13.237 -4.784 1.00 20.11 C ATOM 931 CD PRO A 65 -4.251 14.008 -4.165 1.00 3.11 C ATOM 0 HA PRO A 65 -4.842 14.646 -7.193 1.00 31.32 H new ATOM 0 HB2 PRO A 65 -2.881 12.649 -6.869 1.00 41.34 H new ATOM 0 HB3 PRO A 65 -2.585 14.352 -6.584 1.00 41.34 H new ATOM 0 HG2 PRO A 65 -3.162 12.171 -4.567 1.00 20.11 H new ATOM 0 HG3 PRO A 65 -2.133 13.579 -4.392 1.00 20.11 H new ATOM 0 HD2 PRO A 65 -4.653 13.481 -3.300 1.00 3.11 H new ATOM 0 HD3 PRO A 65 -3.927 14.989 -3.819 1.00 3.11 H new ATOM 936 N GLU A 66 -5.282 12.606 -8.515 1.00 60.30 N ATOM 937 CA GLU A 66 -5.559 11.443 -9.344 1.00 12.52 C ATOM 938 C GLU A 66 -4.367 10.475 -9.295 1.00 20.11 C ATOM 939 O GLU A 66 -3.226 10.905 -9.095 1.00 35.25 O ATOM 940 CB GLU A 66 -5.891 11.916 -10.768 1.00 23.44 C ATOM 941 CG GLU A 66 -4.654 12.317 -11.578 1.00 34.35 C ATOM 942 CD GLU A 66 -4.993 13.323 -12.676 1.00 51.31 C ATOM 943 OE1 GLU A 66 -4.975 14.535 -12.371 1.00 40.53 O ATOM 944 OE2 GLU A 66 -5.268 12.934 -13.837 1.00 44.21 O ATOM 0 H GLU A 66 -5.011 13.428 -9.055 1.00 60.30 H new ATOM 0 HA GLU A 66 -6.423 10.894 -8.970 1.00 12.52 H new ATOM 0 HB2 GLU A 66 -6.419 11.120 -11.294 1.00 23.44 H new ATOM 0 HB3 GLU A 66 -6.571 12.766 -10.712 1.00 23.44 H new ATOM 0 HG2 GLU A 66 -3.907 12.746 -10.911 1.00 34.35 H new ATOM 0 HG3 GLU A 66 -4.209 11.428 -12.025 1.00 34.35 H new ATOM 949 N ILE A 67 -4.622 9.188 -9.535 1.00 41.11 N ATOM 950 CA ILE A 67 -3.604 8.199 -9.876 1.00 51.14 C ATOM 951 C ILE A 67 -3.669 7.916 -11.378 1.00 75.31 C ATOM 952 O ILE A 67 -4.713 8.063 -12.013 1.00 4.51 O ATOM 953 CB ILE A 67 -3.751 6.904 -9.044 1.00 35.43 C ATOM 954 CG1 ILE A 67 -5.141 6.237 -9.176 1.00 74.40 C ATOM 955 CG2 ILE A 67 -3.395 7.200 -7.580 1.00 52.23 C ATOM 956 CD1 ILE A 67 -5.230 4.875 -8.477 1.00 41.33 C ATOM 0 H ILE A 67 -5.564 8.798 -9.496 1.00 41.11 H new ATOM 0 HA ILE A 67 -2.623 8.604 -9.629 1.00 51.14 H new ATOM 0 HB ILE A 67 -3.052 6.171 -9.448 1.00 35.43 H new ATOM 0 HG12 ILE A 67 -5.896 6.902 -8.758 1.00 74.40 H new ATOM 0 HG13 ILE A 67 -5.377 6.111 -10.233 1.00 74.40 H new ATOM 0 HG21 ILE A 67 -3.497 6.290 -6.989 1.00 52.23 H new ATOM 0 HG22 ILE A 67 -2.367 7.557 -7.521 1.00 52.23 H new ATOM 0 HG23 ILE A 67 -4.068 7.963 -7.189 1.00 52.23 H new ATOM 0 HD11 ILE A 67 -6.231 4.463 -8.609 1.00 41.33 H new ATOM 0 HD12 ILE A 67 -4.498 4.195 -8.911 1.00 41.33 H new ATOM 0 HD13 ILE A 67 -5.025 4.998 -7.413 1.00 41.33 H new ATOM 967 N GLN A 68 -2.554 7.446 -11.928 1.00 41.10 N ATOM 968 CA GLN A 68 -2.330 7.203 -13.352 1.00 13.22 C ATOM 969 C GLN A 68 -2.234 5.702 -13.626 1.00 0.11 C ATOM 970 O GLN A 68 -1.506 5.254 -14.514 1.00 74.13 O ATOM 971 CB GLN A 68 -1.044 7.923 -13.764 1.00 72.24 C ATOM 972 CG GLN A 68 -1.133 9.427 -13.497 1.00 43.43 C ATOM 973 CD GLN A 68 0.170 10.122 -13.887 1.00 11.45 C ATOM 974 OE1 GLN A 68 1.246 9.626 -13.580 1.00 23.34 O ATOM 975 NE2 GLN A 68 0.146 11.255 -14.558 1.00 24.45 N ATOM 0 H GLN A 68 -1.738 7.211 -11.363 1.00 41.10 H new ATOM 0 HA GLN A 68 -3.165 7.587 -13.937 1.00 13.22 H new ATOM 0 HB2 GLN A 68 -0.200 7.504 -13.216 1.00 72.24 H new ATOM 0 HB3 GLN A 68 -0.853 7.751 -14.823 1.00 72.24 H new ATOM 0 HG2 GLN A 68 -1.962 9.853 -14.062 1.00 43.43 H new ATOM 0 HG3 GLN A 68 -1.343 9.602 -12.442 1.00 43.43 H new ATOM 0 HE21 GLN A 68 -0.746 11.675 -14.818 1.00 24.45 H new ATOM 0 HE22 GLN A 68 1.020 11.712 -14.818 1.00 24.45 H new ATOM 982 N LEU A 69 -2.875 4.917 -12.774 1.00 33.44 N ATOM 983 CA LEU A 69 -2.914 3.467 -12.818 1.00 42.43 C ATOM 984 C LEU A 69 -3.930 3.002 -13.869 1.00 40.50 C ATOM 985 O LEU A 69 -4.374 3.790 -14.707 1.00 35.43 O ATOM 986 CB LEU A 69 -3.229 2.927 -11.409 1.00 41.30 C ATOM 987 CG LEU A 69 -2.256 1.829 -10.947 1.00 71.40 C ATOM 988 CD1 LEU A 69 -2.832 1.197 -9.687 1.00 32.34 C ATOM 989 CD2 LEU A 69 -1.997 0.707 -11.953 1.00 54.51 C ATOM 0 H LEU A 69 -3.410 5.296 -11.993 1.00 33.44 H new ATOM 0 HA LEU A 69 -1.945 3.068 -13.117 1.00 42.43 H new ATOM 0 HB2 LEU A 69 -3.200 3.752 -10.697 1.00 41.30 H new ATOM 0 HB3 LEU A 69 -4.245 2.531 -11.398 1.00 41.30 H new ATOM 0 HG LEU A 69 -1.297 2.325 -10.798 1.00 71.40 H new ATOM 0 HD11 LEU A 69 -2.162 0.412 -9.335 1.00 32.34 H new ATOM 0 HD12 LEU A 69 -2.938 1.958 -8.914 1.00 32.34 H new ATOM 0 HD13 LEU A 69 -3.809 0.767 -9.909 1.00 32.34 H new ATOM 0 HD21 LEU A 69 -1.298 -0.011 -11.525 1.00 54.51 H new ATOM 0 HD22 LEU A 69 -2.935 0.205 -12.187 1.00 54.51 H new ATOM 0 HD23 LEU A 69 -1.573 1.127 -12.865 1.00 54.51 H new ATOM 1000 N ASP A 70 -4.296 1.727 -13.831 1.00 54.40 N ATOM 1001 CA ASP A 70 -5.371 1.129 -14.621 1.00 60.20 C ATOM 1002 C ASP A 70 -6.368 0.432 -13.703 1.00 40.20 C ATOM 1003 O ASP A 70 -6.101 0.274 -12.507 1.00 44.10 O ATOM 1004 CB ASP A 70 -4.798 0.108 -15.613 1.00 3.51 C ATOM 1005 CG ASP A 70 -5.304 0.299 -17.043 1.00 20.14 C ATOM 1006 OD1 ASP A 70 -6.424 0.821 -17.243 1.00 14.44 O ATOM 1007 OD2 ASP A 70 -4.596 -0.146 -17.973 1.00 62.34 O ATOM 0 H ASP A 70 -3.834 1.050 -13.224 1.00 54.40 H new ATOM 0 HA ASP A 70 -5.876 1.922 -15.172 1.00 60.20 H new ATOM 0 HB2 ASP A 70 -3.710 0.179 -15.608 1.00 3.51 H new ATOM 0 HB3 ASP A 70 -5.053 -0.897 -15.277 1.00 3.51 H new ATOM 1011 N ASN A 71 -7.499 -0.019 -14.253 1.00 41.24 N ATOM 1012 CA ASN A 71 -8.518 -0.675 -13.443 1.00 35.01 C ATOM 1013 C ASN A 71 -8.179 -2.136 -13.199 1.00 41.44 C ATOM 1014 O ASN A 71 -8.051 -2.918 -14.144 1.00 61.12 O ATOM 1015 CB ASN A 71 -9.925 -0.576 -14.044 1.00 11.35 C ATOM 1016 CG ASN A 71 -10.919 -0.728 -12.901 1.00 61.34 C ATOM 1017 OD1 ASN A 71 -11.117 0.216 -12.140 1.00 33.22 O ATOM 1018 ND2 ASN A 71 -11.494 -1.892 -12.685 1.00 42.13 N ATOM 0 H ASN A 71 -7.727 0.059 -15.244 1.00 41.24 H new ATOM 0 HA ASN A 71 -8.523 -0.137 -12.495 1.00 35.01 H new ATOM 0 HB2 ASN A 71 -10.061 0.382 -14.547 1.00 11.35 H new ATOM 0 HB3 ASN A 71 -10.078 -1.354 -14.792 1.00 11.35 H new ATOM 0 HD21 ASN A 71 -12.109 -2.015 -11.881 1.00 42.13 H new ATOM 0 HD22 ASN A 71 -11.324 -2.671 -13.322 1.00 42.13 H new ATOM 1024 N ILE A 72 -8.075 -2.510 -11.930 1.00 23.02 N ATOM 1025 CA ILE A 72 -7.758 -3.853 -11.488 1.00 23.33 C ATOM 1026 C ILE A 72 -8.890 -4.314 -10.579 1.00 22.01 C ATOM 1027 O ILE A 72 -9.431 -3.555 -9.772 1.00 33.02 O ATOM 1028 CB ILE A 72 -6.348 -3.844 -10.857 1.00 72.23 C ATOM 1029 CG1 ILE A 72 -5.323 -3.760 -12.014 1.00 73.01 C ATOM 1030 CG2 ILE A 72 -6.069 -5.070 -9.965 1.00 75.42 C ATOM 1031 CD1 ILE A 72 -3.890 -3.485 -11.577 1.00 0.31 C ATOM 0 H ILE A 72 -8.215 -1.860 -11.157 1.00 23.02 H new ATOM 0 HA ILE A 72 -7.701 -4.581 -12.297 1.00 23.33 H new ATOM 0 HB ILE A 72 -6.268 -2.984 -10.192 1.00 72.23 H new ATOM 0 HG12 ILE A 72 -5.345 -4.698 -12.570 1.00 73.01 H new ATOM 0 HG13 ILE A 72 -5.636 -2.974 -12.702 1.00 73.01 H new ATOM 0 HG21 ILE A 72 -5.062 -5.000 -9.554 1.00 75.42 H new ATOM 0 HG22 ILE A 72 -6.792 -5.099 -9.150 1.00 75.42 H new ATOM 0 HG23 ILE A 72 -6.156 -5.980 -10.559 1.00 75.42 H new ATOM 0 HD11 ILE A 72 -3.244 -3.443 -12.454 1.00 0.31 H new ATOM 0 HD12 ILE A 72 -3.847 -2.532 -11.049 1.00 0.31 H new ATOM 0 HD13 ILE A 72 -3.552 -4.282 -10.915 1.00 0.31 H new ATOM 1042 N ASP A 73 -9.265 -5.579 -10.729 1.00 4.35 N ATOM 1043 CA ASP A 73 -10.237 -6.253 -9.898 1.00 32.34 C ATOM 1044 C ASP A 73 -9.463 -6.822 -8.723 1.00 3.11 C ATOM 1045 O ASP A 73 -8.853 -7.891 -8.809 1.00 15.24 O ATOM 1046 CB ASP A 73 -10.979 -7.319 -10.704 1.00 75.20 C ATOM 1047 CG ASP A 73 -12.068 -6.660 -11.540 1.00 52.24 C ATOM 1048 OD1 ASP A 73 -13.044 -6.135 -10.967 1.00 11.15 O ATOM 1049 OD2 ASP A 73 -11.904 -6.569 -12.784 1.00 2.31 O ATOM 0 H ASP A 73 -8.883 -6.179 -11.460 1.00 4.35 H new ATOM 0 HA ASP A 73 -11.012 -5.579 -9.533 1.00 32.34 H new ATOM 0 HB2 ASP A 73 -10.282 -7.851 -11.351 1.00 75.20 H new ATOM 0 HB3 ASP A 73 -11.418 -8.057 -10.033 1.00 75.20 H new ATOM 1053 N TYR A 74 -9.413 -6.057 -7.638 1.00 2.42 N ATOM 1054 CA TYR A 74 -8.626 -6.367 -6.453 1.00 40.50 C ATOM 1055 C TYR A 74 -9.139 -7.603 -5.704 1.00 2.53 C ATOM 1056 O TYR A 74 -8.454 -8.109 -4.822 1.00 2.21 O ATOM 1057 CB TYR A 74 -8.584 -5.119 -5.559 1.00 72.44 C ATOM 1058 CG TYR A 74 -7.844 -3.974 -6.229 1.00 53.42 C ATOM 1059 CD1 TYR A 74 -6.447 -4.064 -6.359 1.00 51.53 C ATOM 1060 CD2 TYR A 74 -8.528 -2.868 -6.778 1.00 34.21 C ATOM 1061 CE1 TYR A 74 -5.733 -3.064 -7.034 1.00 21.33 C ATOM 1062 CE2 TYR A 74 -7.815 -1.863 -7.463 1.00 33.25 C ATOM 1063 CZ TYR A 74 -6.411 -1.960 -7.594 1.00 22.23 C ATOM 1064 OH TYR A 74 -5.683 -1.031 -8.273 1.00 31.45 O ATOM 0 H TYR A 74 -9.932 -5.183 -7.558 1.00 2.42 H new ATOM 0 HA TYR A 74 -7.613 -6.629 -6.760 1.00 40.50 H new ATOM 0 HB2 TYR A 74 -9.601 -4.806 -5.322 1.00 72.44 H new ATOM 0 HB3 TYR A 74 -8.098 -5.364 -4.615 1.00 72.44 H new ATOM 0 HD1 TYR A 74 -5.921 -4.908 -5.937 1.00 51.53 H new ATOM 0 HD2 TYR A 74 -9.600 -2.791 -6.673 1.00 34.21 H new ATOM 0 HE1 TYR A 74 -4.660 -3.139 -7.126 1.00 21.33 H new ATOM 0 HE2 TYR A 74 -8.341 -1.020 -7.887 1.00 33.25 H new ATOM 0 HH TYR A 74 -6.279 -0.327 -8.605 1.00 31.45 H new ATOM 1073 N ASN A 75 -10.308 -8.139 -6.061 1.00 21.42 N ATOM 1074 CA ASN A 75 -11.033 -9.144 -5.286 1.00 4.22 C ATOM 1075 C ASN A 75 -10.441 -10.563 -5.352 1.00 71.43 C ATOM 1076 O ASN A 75 -11.152 -11.527 -5.067 1.00 32.12 O ATOM 1077 CB ASN A 75 -12.520 -9.127 -5.697 1.00 52.12 C ATOM 1078 CG ASN A 75 -13.399 -9.001 -4.465 1.00 52.13 C ATOM 1079 OD1 ASN A 75 -14.038 -7.968 -4.284 1.00 33.02 O ATOM 1080 ND2 ASN A 75 -13.367 -9.967 -3.565 1.00 40.12 N ATOM 0 H ASN A 75 -10.789 -7.877 -6.922 1.00 21.42 H new ATOM 0 HA ASN A 75 -10.929 -8.865 -4.237 1.00 4.22 H new ATOM 0 HB2 ASN A 75 -12.709 -8.295 -6.375 1.00 52.12 H new ATOM 0 HB3 ASN A 75 -12.767 -10.041 -6.238 1.00 52.12 H new ATOM 0 HD21 ASN A 75 -13.882 -9.867 -2.691 1.00 40.12 H new ATOM 0 HD22 ASN A 75 -12.827 -10.814 -3.744 1.00 40.12 H new ATOM 1086 N ASN A 76 -9.181 -10.714 -5.778 1.00 1.33 N ATOM 1087 CA ASN A 76 -8.529 -11.980 -6.096 1.00 20.35 C ATOM 1088 C ASN A 76 -7.257 -12.230 -5.279 1.00 11.41 C ATOM 1089 O ASN A 76 -6.749 -13.352 -5.270 1.00 55.11 O ATOM 1090 CB ASN A 76 -8.109 -11.951 -7.565 1.00 43.44 C ATOM 1091 CG ASN A 76 -9.268 -11.822 -8.528 1.00 14.11 C ATOM 1092 OD1 ASN A 76 -9.952 -12.796 -8.825 1.00 22.12 O ATOM 1093 ND2 ASN A 76 -9.516 -10.627 -9.030 1.00 3.22 N ATOM 0 H ASN A 76 -8.563 -9.915 -5.915 1.00 1.33 H new ATOM 0 HA ASN A 76 -9.246 -12.768 -5.867 1.00 20.35 H new ATOM 0 HB2 ASN A 76 -7.424 -11.117 -7.721 1.00 43.44 H new ATOM 0 HB3 ASN A 76 -7.558 -12.863 -7.794 1.00 43.44 H new ATOM 0 HD21 ASN A 76 -10.291 -10.498 -9.680 1.00 3.22 H new ATOM 0 HD22 ASN A 76 -8.933 -9.832 -8.768 1.00 3.22 H new ATOM 1099 N TYR A 77 -6.702 -11.198 -4.645 1.00 2.51 N ATOM 1100 CA TYR A 77 -5.427 -11.243 -3.931 1.00 43.24 C ATOM 1101 C TYR A 77 -5.750 -11.562 -2.467 1.00 35.24 C ATOM 1102 O TYR A 77 -6.831 -11.213 -1.993 1.00 32.15 O ATOM 1103 CB TYR A 77 -4.664 -9.935 -4.198 1.00 3.12 C ATOM 1104 CG TYR A 77 -4.567 -9.650 -5.699 1.00 55.41 C ATOM 1105 CD1 TYR A 77 -3.583 -10.262 -6.503 1.00 43.32 C ATOM 1106 CD2 TYR A 77 -5.558 -8.867 -6.318 1.00 15.42 C ATOM 1107 CE1 TYR A 77 -3.583 -10.078 -7.902 1.00 24.15 C ATOM 1108 CE2 TYR A 77 -5.622 -8.745 -7.717 1.00 33.41 C ATOM 1109 CZ TYR A 77 -4.619 -9.334 -8.517 1.00 20.34 C ATOM 1110 OH TYR A 77 -4.684 -9.203 -9.871 1.00 20.41 O ATOM 0 H TYR A 77 -7.142 -10.278 -4.613 1.00 2.51 H new ATOM 0 HA TYR A 77 -4.747 -12.024 -4.271 1.00 43.24 H new ATOM 0 HB2 TYR A 77 -5.169 -9.108 -3.700 1.00 3.12 H new ATOM 0 HB3 TYR A 77 -3.663 -10.001 -3.772 1.00 3.12 H new ATOM 0 HD1 TYR A 77 -2.823 -10.877 -6.044 1.00 43.32 H new ATOM 0 HD2 TYR A 77 -6.283 -8.350 -5.707 1.00 15.42 H new ATOM 0 HE1 TYR A 77 -2.794 -10.504 -8.503 1.00 24.15 H new ATOM 0 HE2 TYR A 77 -6.435 -8.203 -8.178 1.00 33.41 H new ATOM 0 HH TYR A 77 -5.463 -8.659 -10.110 1.00 20.41 H new ATOM 1119 N ASP A 78 -4.888 -12.306 -1.775 1.00 31.04 N ATOM 1120 CA ASP A 78 -5.101 -12.670 -0.361 1.00 21.01 C ATOM 1121 C ASP A 78 -4.622 -11.555 0.571 1.00 63.02 C ATOM 1122 O ASP A 78 -5.190 -11.343 1.645 1.00 74.01 O ATOM 1123 CB ASP A 78 -4.361 -13.979 -0.058 1.00 1.25 C ATOM 1124 CG ASP A 78 -4.590 -14.561 1.342 1.00 34.02 C ATOM 1125 OD1 ASP A 78 -5.736 -14.528 1.854 1.00 74.11 O ATOM 1126 OD2 ASP A 78 -3.642 -15.197 1.850 1.00 35.21 O ATOM 0 H ASP A 78 -4.023 -12.676 -2.170 1.00 31.04 H new ATOM 0 HA ASP A 78 -6.168 -12.809 -0.189 1.00 21.01 H new ATOM 0 HB2 ASP A 78 -4.661 -14.724 -0.795 1.00 1.25 H new ATOM 0 HB3 ASP A 78 -3.292 -13.811 -0.192 1.00 1.25 H new ATOM 1130 N LEU A 79 -3.588 -10.840 0.123 1.00 52.34 N ATOM 1131 CA LEU A 79 -2.845 -9.813 0.834 1.00 42.10 C ATOM 1132 C LEU A 79 -2.440 -8.739 -0.185 1.00 21.05 C ATOM 1133 O LEU A 79 -2.060 -9.072 -1.315 1.00 11.33 O ATOM 1134 CB LEU A 79 -1.626 -10.521 1.456 1.00 60.12 C ATOM 1135 CG LEU A 79 -0.516 -9.608 1.994 1.00 3.32 C ATOM 1136 CD1 LEU A 79 -0.938 -8.786 3.215 1.00 3.24 C ATOM 1137 CD2 LEU A 79 0.699 -10.468 2.334 1.00 71.41 C ATOM 0 H LEU A 79 -3.225 -10.980 -0.820 1.00 52.34 H new ATOM 0 HA LEU A 79 -3.417 -9.323 1.622 1.00 42.10 H new ATOM 0 HB2 LEU A 79 -1.976 -11.153 2.272 1.00 60.12 H new ATOM 0 HB3 LEU A 79 -1.193 -11.181 0.705 1.00 60.12 H new ATOM 0 HG LEU A 79 -0.279 -8.884 1.214 1.00 3.32 H new ATOM 0 HD11 LEU A 79 -0.104 -8.164 3.541 1.00 3.24 H new ATOM 0 HD12 LEU A 79 -1.783 -8.150 2.951 1.00 3.24 H new ATOM 0 HD13 LEU A 79 -1.228 -9.458 4.023 1.00 3.24 H new ATOM 0 HD21 LEU A 79 1.498 -9.834 2.718 1.00 71.41 H new ATOM 0 HD22 LEU A 79 0.424 -11.203 3.090 1.00 71.41 H new ATOM 0 HD23 LEU A 79 1.044 -10.982 1.437 1.00 71.41 H new ATOM 1148 N ILE A 80 -2.443 -7.455 0.193 1.00 55.11 N ATOM 1149 CA ILE A 80 -2.030 -6.342 -0.674 1.00 74.21 C ATOM 1150 C ILE A 80 -1.095 -5.419 0.131 1.00 63.11 C ATOM 1151 O ILE A 80 -1.545 -4.676 1.004 1.00 14.42 O ATOM 1152 CB ILE A 80 -3.250 -5.625 -1.316 1.00 14.35 C ATOM 1153 CG1 ILE A 80 -4.222 -6.622 -2.005 1.00 23.33 C ATOM 1154 CG2 ILE A 80 -2.780 -4.619 -2.386 1.00 72.22 C ATOM 1155 CD1 ILE A 80 -5.426 -5.976 -2.706 1.00 42.52 C ATOM 0 H ILE A 80 -2.736 -7.155 1.123 1.00 55.11 H new ATOM 0 HA ILE A 80 -1.467 -6.714 -1.530 1.00 74.21 H new ATOM 0 HB ILE A 80 -3.771 -5.119 -0.503 1.00 14.35 H new ATOM 0 HG12 ILE A 80 -3.663 -7.203 -2.738 1.00 23.33 H new ATOM 0 HG13 ILE A 80 -4.590 -7.323 -1.256 1.00 23.33 H new ATOM 0 HG21 ILE A 80 -3.646 -4.125 -2.826 1.00 72.22 H new ATOM 0 HG22 ILE A 80 -2.132 -3.873 -1.925 1.00 72.22 H new ATOM 0 HG23 ILE A 80 -2.229 -5.147 -3.164 1.00 72.22 H new ATOM 0 HD11 ILE A 80 -6.045 -6.752 -3.156 1.00 42.52 H new ATOM 0 HD12 ILE A 80 -6.015 -5.419 -1.978 1.00 42.52 H new ATOM 0 HD13 ILE A 80 -5.074 -5.297 -3.483 1.00 42.52 H new ATOM 1166 N LEU A 81 0.219 -5.486 -0.106 1.00 64.34 N ATOM 1167 CA LEU A 81 1.201 -4.558 0.466 1.00 54.11 C ATOM 1168 C LEU A 81 1.185 -3.256 -0.336 1.00 60.21 C ATOM 1169 O LEU A 81 1.181 -3.308 -1.572 1.00 15.33 O ATOM 1170 CB LEU A 81 2.632 -5.119 0.349 1.00 75.01 C ATOM 1171 CG LEU A 81 3.120 -6.188 1.342 1.00 71.11 C ATOM 1172 CD1 LEU A 81 2.966 -5.764 2.802 1.00 63.00 C ATOM 1173 CD2 LEU A 81 2.463 -7.540 1.136 1.00 33.12 C ATOM 0 H LEU A 81 0.636 -6.195 -0.708 1.00 64.34 H new ATOM 0 HA LEU A 81 0.938 -4.405 1.513 1.00 54.11 H new ATOM 0 HB2 LEU A 81 2.737 -5.535 -0.653 1.00 75.01 H new ATOM 0 HB3 LEU A 81 3.318 -4.275 0.417 1.00 75.01 H new ATOM 0 HG LEU A 81 4.183 -6.289 1.124 1.00 71.11 H new ATOM 0 HD11 LEU A 81 3.328 -6.561 3.452 1.00 63.00 H new ATOM 0 HD12 LEU A 81 3.545 -4.858 2.981 1.00 63.00 H new ATOM 0 HD13 LEU A 81 1.915 -5.570 3.016 1.00 63.00 H new ATOM 0 HD21 LEU A 81 2.851 -8.248 1.868 1.00 33.12 H new ATOM 0 HD22 LEU A 81 1.385 -7.443 1.261 1.00 33.12 H new ATOM 0 HD23 LEU A 81 2.681 -7.901 0.131 1.00 33.12 H new ATOM 1184 N ILE A 82 1.274 -2.090 0.319 1.00 75.40 N ATOM 1185 CA ILE A 82 1.366 -0.790 -0.351 1.00 13.33 C ATOM 1186 C ILE A 82 2.652 -0.054 0.065 1.00 73.31 C ATOM 1187 O ILE A 82 3.060 -0.128 1.223 1.00 0.45 O ATOM 1188 CB ILE A 82 0.069 0.032 -0.162 1.00 53.30 C ATOM 1189 CG1 ILE A 82 -1.115 -0.543 -0.978 1.00 53.53 C ATOM 1190 CG2 ILE A 82 0.236 1.491 -0.615 1.00 60.02 C ATOM 1191 CD1 ILE A 82 -1.803 -1.754 -0.351 1.00 43.31 C ATOM 0 H ILE A 82 1.284 -2.025 1.337 1.00 75.40 H new ATOM 0 HA ILE A 82 1.449 -0.945 -1.427 1.00 13.33 H new ATOM 0 HB ILE A 82 -0.138 -0.021 0.907 1.00 53.30 H new ATOM 0 HG12 ILE A 82 -1.856 0.244 -1.119 1.00 53.53 H new ATOM 0 HG13 ILE A 82 -0.753 -0.822 -1.968 1.00 53.53 H new ATOM 0 HG21 ILE A 82 -0.700 2.028 -0.463 1.00 60.02 H new ATOM 0 HG22 ILE A 82 1.025 1.965 -0.032 1.00 60.02 H new ATOM 0 HG23 ILE A 82 0.501 1.516 -1.672 1.00 60.02 H new ATOM 0 HD11 ILE A 82 -2.618 -2.084 -0.996 1.00 43.31 H new ATOM 0 HD12 ILE A 82 -1.082 -2.563 -0.236 1.00 43.31 H new ATOM 0 HD13 ILE A 82 -2.201 -1.481 0.626 1.00 43.31 H new ATOM 1202 N GLY A 83 3.261 0.704 -0.859 1.00 2.54 N ATOM 1203 CA GLY A 83 4.421 1.566 -0.626 1.00 51.12 C ATOM 1204 C GLY A 83 4.193 2.962 -1.206 1.00 61.44 C ATOM 1205 O GLY A 83 3.541 3.085 -2.241 1.00 62.21 O ATOM 0 H GLY A 83 2.943 0.732 -1.828 1.00 2.54 H new ATOM 0 HA2 GLY A 83 4.614 1.640 0.444 1.00 51.12 H new ATOM 0 HA3 GLY A 83 5.306 1.120 -1.079 1.00 51.12 H new ATOM 1209 N SER A 84 4.724 4.024 -0.593 1.00 22.03 N ATOM 1210 CA SER A 84 4.612 5.402 -1.090 1.00 54.14 C ATOM 1211 C SER A 84 5.573 6.320 -0.314 1.00 62.23 C ATOM 1212 O SER A 84 5.985 5.953 0.772 1.00 0.13 O ATOM 1213 CB SER A 84 3.156 5.863 -0.972 1.00 2.55 C ATOM 1214 OG SER A 84 2.567 5.559 0.282 1.00 60.31 O ATOM 0 H SER A 84 5.252 3.951 0.276 1.00 22.03 H new ATOM 0 HA SER A 84 4.898 5.448 -2.141 1.00 54.14 H new ATOM 0 HB2 SER A 84 3.110 6.940 -1.135 1.00 2.55 H new ATOM 0 HB3 SER A 84 2.570 5.395 -1.763 1.00 2.55 H new ATOM 0 HG SER A 84 1.786 6.134 0.425 1.00 60.31 H new ATOM 1219 N PRO A 85 5.942 7.514 -0.788 1.00 44.54 N ATOM 1220 CA PRO A 85 6.869 8.392 -0.070 1.00 62.11 C ATOM 1221 C PRO A 85 6.233 9.047 1.157 1.00 74.10 C ATOM 1222 O PRO A 85 5.219 9.721 1.018 1.00 60.31 O ATOM 1223 CB PRO A 85 7.235 9.458 -1.113 1.00 0.52 C ATOM 1224 CG PRO A 85 6.044 9.501 -2.067 1.00 11.21 C ATOM 1225 CD PRO A 85 5.599 8.047 -2.091 1.00 44.23 C ATOM 0 HA PRO A 85 7.725 7.840 0.318 1.00 62.11 H new ATOM 0 HB2 PRO A 85 7.401 10.428 -0.645 1.00 0.52 H new ATOM 0 HB3 PRO A 85 8.153 9.197 -1.639 1.00 0.52 H new ATOM 0 HG2 PRO A 85 5.256 10.162 -1.705 1.00 11.21 H new ATOM 0 HG3 PRO A 85 6.328 9.856 -3.058 1.00 11.21 H new ATOM 0 HD2 PRO A 85 4.528 7.968 -2.278 1.00 44.23 H new ATOM 0 HD3 PRO A 85 6.103 7.496 -2.885 1.00 44.23 H new ATOM 1230 N VAL A 86 6.825 8.946 2.350 1.00 4.35 N ATOM 1231 CA VAL A 86 6.483 9.889 3.420 1.00 0.11 C ATOM 1232 C VAL A 86 7.052 11.261 2.996 1.00 31.44 C ATOM 1233 O VAL A 86 8.169 11.297 2.469 1.00 55.51 O ATOM 1234 CB VAL A 86 7.052 9.390 4.767 1.00 40.52 C ATOM 1235 CG1 VAL A 86 6.681 10.258 5.956 1.00 72.32 C ATOM 1236 CG2 VAL A 86 6.532 7.997 5.142 1.00 31.15 C ATOM 0 H VAL A 86 7.523 8.244 2.596 1.00 4.35 H new ATOM 0 HA VAL A 86 5.406 9.975 3.567 1.00 0.11 H new ATOM 0 HB VAL A 86 8.128 9.405 4.591 1.00 40.52 H new ATOM 0 HG11 VAL A 86 7.119 9.840 6.862 1.00 72.32 H new ATOM 0 HG12 VAL A 86 7.061 11.268 5.802 1.00 72.32 H new ATOM 0 HG13 VAL A 86 5.596 10.290 6.059 1.00 72.32 H new ATOM 0 HG21 VAL A 86 6.962 7.693 6.096 1.00 31.15 H new ATOM 0 HG22 VAL A 86 5.446 8.025 5.226 1.00 31.15 H new ATOM 0 HG23 VAL A 86 6.818 7.282 4.371 1.00 31.15 H new ATOM 1246 N TRP A 87 6.327 12.365 3.237 1.00 40.55 N ATOM 1247 CA TRP A 87 6.760 13.752 2.983 1.00 34.02 C ATOM 1248 C TRP A 87 7.132 14.447 4.305 1.00 0.12 C ATOM 1249 O TRP A 87 7.388 13.747 5.294 1.00 1.13 O ATOM 1250 CB TRP A 87 5.736 14.515 2.121 1.00 2.53 C ATOM 1251 CG TRP A 87 6.292 14.961 0.799 1.00 33.12 C ATOM 1252 CD1 TRP A 87 7.129 16.003 0.569 1.00 2.24 C ATOM 1253 CD2 TRP A 87 6.091 14.336 -0.499 1.00 61.15 C ATOM 1254 NE1 TRP A 87 7.392 16.105 -0.783 1.00 15.54 N ATOM 1255 CE2 TRP A 87 6.796 15.086 -1.484 1.00 4.20 C ATOM 1256 CE3 TRP A 87 5.365 13.214 -0.943 1.00 2.23 C ATOM 1257 CZ2 TRP A 87 6.777 14.749 -2.840 1.00 43.35 C ATOM 1258 CZ3 TRP A 87 5.279 12.910 -2.313 1.00 4.10 C ATOM 1259 CH2 TRP A 87 5.993 13.667 -3.257 1.00 72.03 C ATOM 0 H TRP A 87 5.387 12.316 3.629 1.00 40.55 H new ATOM 0 HA TRP A 87 7.670 13.744 2.384 1.00 34.02 H new ATOM 0 HB2 TRP A 87 4.870 13.877 1.947 1.00 2.53 H new ATOM 0 HB3 TRP A 87 5.384 15.387 2.673 1.00 2.53 H new ATOM 0 HD1 TRP A 87 7.530 16.656 1.330 1.00 2.24 H new ATOM 0 HE1 TRP A 87 7.956 16.842 -1.206 1.00 15.54 H new ATOM 0 HE3 TRP A 87 4.869 12.580 -0.223 1.00 2.23 H new ATOM 0 HZ2 TRP A 87 7.358 15.314 -3.554 1.00 43.35 H new ATOM 0 HZ3 TRP A 87 4.660 12.089 -2.642 1.00 4.10 H new ATOM 0 HH2 TRP A 87 5.937 13.414 -4.305 1.00 72.03 H new ATOM 1269 N SER A 88 7.253 15.780 4.353 1.00 13.31 N ATOM 1270 CA SER A 88 7.585 16.562 5.546 1.00 53.13 C ATOM 1271 C SER A 88 6.438 16.515 6.567 1.00 45.52 C ATOM 1272 O SER A 88 5.681 17.466 6.762 1.00 43.54 O ATOM 1273 CB SER A 88 7.976 17.996 5.152 1.00 54.51 C ATOM 1274 OG SER A 88 8.780 18.576 6.157 1.00 65.35 O ATOM 0 H SER A 88 7.116 16.364 3.528 1.00 13.31 H new ATOM 0 HA SER A 88 8.452 16.118 6.036 1.00 53.13 H new ATOM 0 HB2 SER A 88 8.516 17.986 4.205 1.00 54.51 H new ATOM 0 HB3 SER A 88 7.079 18.597 5.002 1.00 54.51 H new ATOM 0 HG SER A 88 9.024 19.488 5.895 1.00 65.35 H new ATOM 1279 N GLY A 89 6.317 15.383 7.254 1.00 10.54 N ATOM 1280 CA GLY A 89 5.396 15.163 8.356 1.00 1.31 C ATOM 1281 C GLY A 89 4.000 14.733 7.937 1.00 13.43 C ATOM 1282 O GLY A 89 3.328 14.095 8.753 1.00 61.14 O ATOM 0 H GLY A 89 6.884 14.561 7.046 1.00 10.54 H new ATOM 0 HA2 GLY A 89 5.814 14.402 9.015 1.00 1.31 H new ATOM 0 HA3 GLY A 89 5.320 16.082 8.938 1.00 1.31 H new ATOM 1286 N TYR A 90 3.583 14.960 6.691 1.00 24.12 N ATOM 1287 CA TYR A 90 2.321 14.451 6.189 1.00 44.14 C ATOM 1288 C TYR A 90 2.625 13.895 4.793 1.00 21.10 C ATOM 1289 O TYR A 90 3.384 14.532 4.059 1.00 61.15 O ATOM 1290 CB TYR A 90 1.302 15.613 6.115 1.00 24.11 C ATOM 1291 CG TYR A 90 1.398 16.667 7.217 1.00 72.14 C ATOM 1292 CD1 TYR A 90 2.444 17.613 7.197 1.00 51.14 C ATOM 1293 CD2 TYR A 90 0.478 16.687 8.282 1.00 61.42 C ATOM 1294 CE1 TYR A 90 2.634 18.503 8.264 1.00 22.02 C ATOM 1295 CE2 TYR A 90 0.667 17.566 9.365 1.00 12.30 C ATOM 1296 CZ TYR A 90 1.764 18.456 9.372 1.00 73.43 C ATOM 1297 OH TYR A 90 2.024 19.229 10.459 1.00 61.13 O ATOM 0 H TYR A 90 4.114 15.501 6.009 1.00 24.12 H new ATOM 0 HA TYR A 90 1.893 13.679 6.828 1.00 44.14 H new ATOM 0 HB2 TYR A 90 1.421 16.112 5.153 1.00 24.11 H new ATOM 0 HB3 TYR A 90 0.298 15.189 6.133 1.00 24.11 H new ATOM 0 HD1 TYR A 90 3.109 17.653 6.347 1.00 51.14 H new ATOM 0 HD2 TYR A 90 -0.376 16.026 8.268 1.00 61.42 H new ATOM 0 HE1 TYR A 90 3.442 19.220 8.237 1.00 22.02 H new ATOM 0 HE2 TYR A 90 -0.028 17.560 10.192 1.00 12.30 H new ATOM 0 HH TYR A 90 1.331 19.084 11.137 1.00 61.13 H new ATOM 1306 N PRO A 91 2.015 12.773 4.379 1.00 63.21 N ATOM 1307 CA PRO A 91 2.180 12.236 3.038 1.00 61.14 C ATOM 1308 C PRO A 91 1.414 13.087 2.018 1.00 13.14 C ATOM 1309 O PRO A 91 0.491 13.822 2.367 1.00 40.13 O ATOM 1310 CB PRO A 91 1.696 10.781 3.110 1.00 11.44 C ATOM 1311 CG PRO A 91 0.834 10.703 4.373 1.00 35.40 C ATOM 1312 CD PRO A 91 1.313 11.850 5.245 1.00 3.12 C ATOM 0 HA PRO A 91 3.216 12.262 2.699 1.00 61.14 H new ATOM 0 HB2 PRO A 91 1.120 10.514 2.224 1.00 11.44 H new ATOM 0 HB3 PRO A 91 2.537 10.089 3.164 1.00 11.44 H new ATOM 0 HG2 PRO A 91 -0.225 10.803 4.135 1.00 35.40 H new ATOM 0 HG3 PRO A 91 0.958 9.745 4.877 1.00 35.40 H new ATOM 0 HD2 PRO A 91 0.471 12.342 5.732 1.00 3.12 H new ATOM 0 HD3 PRO A 91 1.970 11.486 6.035 1.00 3.12 H new ATOM 1317 N ALA A 92 1.758 12.934 0.743 1.00 12.23 N ATOM 1318 CA ALA A 92 1.181 13.609 -0.412 1.00 41.23 C ATOM 1319 C ALA A 92 -0.214 13.071 -0.797 1.00 44.14 C ATOM 1320 O ALA A 92 -0.583 13.066 -1.972 1.00 12.33 O ATOM 1321 CB ALA A 92 2.159 13.475 -1.578 1.00 60.34 C ATOM 0 H ALA A 92 2.500 12.289 0.472 1.00 12.23 H new ATOM 0 HA ALA A 92 1.026 14.657 -0.156 1.00 41.23 H new ATOM 0 HB1 ALA A 92 1.749 13.973 -2.456 1.00 60.34 H new ATOM 0 HB2 ALA A 92 3.110 13.936 -1.310 1.00 60.34 H new ATOM 0 HB3 ALA A 92 2.317 12.420 -1.801 1.00 60.34 H new ATOM 1327 N THR A 93 -0.870 12.399 0.148 1.00 4.12 N ATOM 1328 CA THR A 93 -2.103 11.625 0.020 1.00 51.51 C ATOM 1329 C THR A 93 -2.145 10.741 -1.257 1.00 22.23 C ATOM 1330 O THR A 93 -3.150 10.695 -1.965 1.00 11.32 O ATOM 1331 CB THR A 93 -3.305 12.575 0.245 1.00 75.44 C ATOM 1332 OG1 THR A 93 -3.343 13.633 -0.683 1.00 54.53 O ATOM 1333 CG2 THR A 93 -3.225 13.209 1.641 1.00 60.22 C ATOM 0 H THR A 93 -0.521 12.381 1.106 1.00 4.12 H new ATOM 0 HA THR A 93 -2.157 10.865 0.800 1.00 51.51 H new ATOM 0 HB THR A 93 -4.198 11.961 0.128 1.00 75.44 H new ATOM 0 HG1 THR A 93 -4.120 14.202 -0.499 1.00 54.53 H new ATOM 0 HG21 THR A 93 -4.075 13.875 1.787 1.00 60.22 H new ATOM 0 HG22 THR A 93 -3.243 12.425 2.398 1.00 60.22 H new ATOM 0 HG23 THR A 93 -2.299 13.778 1.730 1.00 60.22 H new ATOM 1341 N PRO A 94 -1.129 9.891 -1.518 1.00 3.11 N ATOM 1342 CA PRO A 94 -1.043 9.076 -2.728 1.00 61.14 C ATOM 1343 C PRO A 94 -2.088 7.962 -2.701 1.00 4.11 C ATOM 1344 O PRO A 94 -2.861 7.763 -3.643 1.00 60.01 O ATOM 1345 CB PRO A 94 0.406 8.547 -2.778 1.00 2.54 C ATOM 1346 CG PRO A 94 0.839 8.584 -1.317 1.00 14.31 C ATOM 1347 CD PRO A 94 0.123 9.807 -0.791 1.00 51.52 C ATOM 0 HA PRO A 94 -1.261 9.647 -3.631 1.00 61.14 H new ATOM 0 HB2 PRO A 94 0.453 7.538 -3.187 1.00 2.54 H new ATOM 0 HB3 PRO A 94 1.042 9.174 -3.403 1.00 2.54 H new ATOM 0 HG2 PRO A 94 0.543 7.681 -0.784 1.00 14.31 H new ATOM 0 HG3 PRO A 94 1.921 8.673 -1.217 1.00 14.31 H new ATOM 0 HD2 PRO A 94 -0.055 9.722 0.281 1.00 51.52 H new ATOM 0 HD3 PRO A 94 0.722 10.704 -0.944 1.00 51.52 H new ATOM 1352 N ILE A 95 -2.151 7.243 -1.583 1.00 14.42 N ATOM 1353 CA ILE A 95 -3.013 6.086 -1.416 1.00 52.22 C ATOM 1354 C ILE A 95 -4.474 6.541 -1.147 1.00 13.41 C ATOM 1355 O ILE A 95 -5.353 5.700 -0.977 1.00 42.40 O ATOM 1356 CB ILE A 95 -2.376 5.133 -0.359 1.00 11.14 C ATOM 1357 CG1 ILE A 95 -0.829 4.965 -0.470 1.00 15.41 C ATOM 1358 CG2 ILE A 95 -2.980 3.720 -0.431 1.00 14.13 C ATOM 1359 CD1 ILE A 95 -0.243 4.615 -1.860 1.00 52.24 C ATOM 0 H ILE A 95 -1.593 7.455 -0.756 1.00 14.42 H new ATOM 0 HA ILE A 95 -3.089 5.494 -2.328 1.00 52.22 H new ATOM 0 HB ILE A 95 -2.602 5.626 0.586 1.00 11.14 H new ATOM 0 HG12 ILE A 95 -0.366 5.893 -0.134 1.00 15.41 H new ATOM 0 HG13 ILE A 95 -0.525 4.186 0.229 1.00 15.41 H new ATOM 0 HG21 ILE A 95 -2.511 3.085 0.321 1.00 14.13 H new ATOM 0 HG22 ILE A 95 -4.052 3.773 -0.243 1.00 14.13 H new ATOM 0 HG23 ILE A 95 -2.805 3.300 -1.421 1.00 14.13 H new ATOM 0 HD11 ILE A 95 0.841 4.529 -1.787 1.00 52.24 H new ATOM 0 HD12 ILE A 95 -0.660 3.668 -2.202 1.00 52.24 H new ATOM 0 HD13 ILE A 95 -0.498 5.401 -2.571 1.00 52.24 H new ATOM 1370 N LYS A 96 -4.789 7.850 -1.147 1.00 0.21 N ATOM 1371 CA LYS A 96 -6.149 8.362 -0.950 1.00 14.45 C ATOM 1372 C LYS A 96 -7.055 7.880 -2.080 1.00 74.01 C ATOM 1373 O LYS A 96 -8.068 7.236 -1.825 1.00 14.14 O ATOM 1374 CB LYS A 96 -6.108 9.899 -0.836 1.00 12.45 C ATOM 1375 CG LYS A 96 -7.459 10.629 -0.724 1.00 12.14 C ATOM 1376 CD LYS A 96 -8.363 10.144 0.421 1.00 12.13 C ATOM 1377 CE LYS A 96 -9.153 11.278 1.097 1.00 72.42 C ATOM 1378 NZ LYS A 96 -10.054 12.023 0.196 1.00 44.20 N ATOM 0 H LYS A 96 -4.096 8.585 -1.286 1.00 0.21 H new ATOM 0 HA LYS A 96 -6.568 7.976 -0.020 1.00 14.45 H new ATOM 0 HB2 LYS A 96 -5.510 10.158 0.038 1.00 12.45 H new ATOM 0 HB3 LYS A 96 -5.584 10.289 -1.708 1.00 12.45 H new ATOM 0 HG2 LYS A 96 -7.270 11.694 -0.592 1.00 12.14 H new ATOM 0 HG3 LYS A 96 -7.997 10.515 -1.665 1.00 12.14 H new ATOM 0 HD2 LYS A 96 -9.063 9.404 0.033 1.00 12.13 H new ATOM 0 HD3 LYS A 96 -7.751 9.641 1.170 1.00 12.13 H new ATOM 0 HE2 LYS A 96 -9.742 10.857 1.911 1.00 72.42 H new ATOM 0 HE3 LYS A 96 -8.447 11.978 1.544 1.00 72.42 H new ATOM 0 HZ1 LYS A 96 -10.507 12.798 0.721 1.00 44.20 H new ATOM 0 HZ2 LYS A 96 -9.506 12.415 -0.596 1.00 44.20 H new ATOM 0 HZ3 LYS A 96 -10.785 11.381 -0.172 1.00 44.20 H new ATOM 1388 N THR A 97 -6.679 8.168 -3.324 1.00 73.44 N ATOM 1389 CA THR A 97 -7.456 7.807 -4.504 1.00 75.03 C ATOM 1390 C THR A 97 -7.615 6.284 -4.590 1.00 2.43 C ATOM 1391 O THR A 97 -8.697 5.764 -4.846 1.00 4.42 O ATOM 1392 CB THR A 97 -6.751 8.347 -5.768 1.00 1.53 C ATOM 1393 OG1 THR A 97 -5.728 9.287 -5.455 1.00 62.23 O ATOM 1394 CG2 THR A 97 -7.758 8.957 -6.743 1.00 35.25 C ATOM 0 H THR A 97 -5.815 8.665 -3.542 1.00 73.44 H new ATOM 0 HA THR A 97 -8.449 8.251 -4.431 1.00 75.03 H new ATOM 0 HB THR A 97 -6.274 7.493 -6.249 1.00 1.53 H new ATOM 0 HG1 THR A 97 -6.048 10.194 -5.645 1.00 62.23 H new ATOM 0 HG21 THR A 97 -7.233 9.329 -7.623 1.00 35.25 H new ATOM 0 HG22 THR A 97 -8.479 8.197 -7.045 1.00 35.25 H new ATOM 0 HG23 THR A 97 -8.281 9.781 -6.258 1.00 35.25 H new ATOM 1402 N LEU A 98 -6.516 5.557 -4.380 1.00 41.42 N ATOM 1403 CA LEU A 98 -6.454 4.122 -4.619 1.00 40.23 C ATOM 1404 C LEU A 98 -7.399 3.353 -3.691 1.00 22.23 C ATOM 1405 O LEU A 98 -8.033 2.392 -4.122 1.00 34.43 O ATOM 1406 CB LEU A 98 -4.989 3.686 -4.463 1.00 2.53 C ATOM 1407 CG LEU A 98 -4.713 2.209 -4.787 1.00 53.31 C ATOM 1408 CD1 LEU A 98 -5.064 1.830 -6.230 1.00 72.41 C ATOM 1409 CD2 LEU A 98 -3.221 1.943 -4.547 1.00 40.24 C ATOM 0 H LEU A 98 -5.641 5.954 -4.037 1.00 41.42 H new ATOM 0 HA LEU A 98 -6.794 3.891 -5.628 1.00 40.23 H new ATOM 0 HB2 LEU A 98 -4.370 4.306 -5.111 1.00 2.53 H new ATOM 0 HB3 LEU A 98 -4.674 3.883 -3.438 1.00 2.53 H new ATOM 0 HG LEU A 98 -5.347 1.601 -4.141 1.00 53.31 H new ATOM 0 HD11 LEU A 98 -4.845 0.775 -6.392 1.00 72.41 H new ATOM 0 HD12 LEU A 98 -6.124 2.012 -6.406 1.00 72.41 H new ATOM 0 HD13 LEU A 98 -4.473 2.433 -6.919 1.00 72.41 H new ATOM 0 HD21 LEU A 98 -2.997 0.900 -4.770 1.00 40.24 H new ATOM 0 HD22 LEU A 98 -2.628 2.588 -5.195 1.00 40.24 H new ATOM 0 HD23 LEU A 98 -2.977 2.152 -3.505 1.00 40.24 H new ATOM 1420 N LEU A 99 -7.561 3.787 -2.436 1.00 42.41 N ATOM 1421 CA LEU A 99 -8.387 3.107 -1.457 1.00 12.54 C ATOM 1422 C LEU A 99 -9.868 3.200 -1.825 1.00 20.43 C ATOM 1423 O LEU A 99 -10.626 2.268 -1.557 1.00 20.31 O ATOM 1424 CB LEU A 99 -8.013 3.665 -0.072 1.00 40.40 C ATOM 1425 CG LEU A 99 -9.005 4.667 0.551 1.00 34.45 C ATOM 1426 CD1 LEU A 99 -9.844 3.879 1.546 1.00 15.52 C ATOM 1427 CD2 LEU A 99 -8.278 5.794 1.258 1.00 0.33 C ATOM 0 H LEU A 99 -7.113 4.630 -2.077 1.00 42.41 H new ATOM 0 HA LEU A 99 -8.199 2.033 -1.438 1.00 12.54 H new ATOM 0 HB2 LEU A 99 -7.897 2.827 0.615 1.00 40.40 H new ATOM 0 HB3 LEU A 99 -7.040 4.150 -0.150 1.00 40.40 H new ATOM 0 HG LEU A 99 -9.622 5.125 -0.222 1.00 34.45 H new ATOM 0 HD11 LEU A 99 -10.567 4.544 2.019 1.00 15.52 H new ATOM 0 HD12 LEU A 99 -10.372 3.080 1.025 1.00 15.52 H new ATOM 0 HD13 LEU A 99 -9.195 3.448 2.308 1.00 15.52 H new ATOM 0 HD21 LEU A 99 -9.005 6.484 1.687 1.00 0.33 H new ATOM 0 HD22 LEU A 99 -7.655 5.383 2.053 1.00 0.33 H new ATOM 0 HD23 LEU A 99 -7.650 6.327 0.544 1.00 0.33 H new ATOM 1438 N ASP A 100 -10.269 4.294 -2.477 1.00 44.50 N ATOM 1439 CA ASP A 100 -11.641 4.526 -2.916 1.00 60.30 C ATOM 1440 C ASP A 100 -12.017 3.526 -4.012 1.00 41.10 C ATOM 1441 O ASP A 100 -13.169 3.100 -4.120 1.00 33.22 O ATOM 1442 CB ASP A 100 -11.765 5.959 -3.452 1.00 0.44 C ATOM 1443 CG ASP A 100 -13.205 6.322 -3.808 1.00 40.32 C ATOM 1444 OD1 ASP A 100 -14.137 5.879 -3.100 1.00 63.04 O ATOM 1445 OD2 ASP A 100 -13.402 7.084 -4.779 1.00 62.33 O ATOM 0 H ASP A 100 -9.635 5.056 -2.718 1.00 44.50 H new ATOM 0 HA ASP A 100 -12.318 4.392 -2.073 1.00 60.30 H new ATOM 0 HB2 ASP A 100 -11.391 6.658 -2.704 1.00 0.44 H new ATOM 0 HB3 ASP A 100 -11.136 6.070 -4.335 1.00 0.44 H new ATOM 1449 N GLN A 101 -11.034 3.109 -4.815 1.00 12.45 N ATOM 1450 CA GLN A 101 -11.185 2.054 -5.809 1.00 20.24 C ATOM 1451 C GLN A 101 -11.147 0.688 -5.123 1.00 72.12 C ATOM 1452 O GLN A 101 -12.033 -0.135 -5.342 1.00 22.35 O ATOM 1453 CB GLN A 101 -10.089 2.172 -6.875 1.00 62.04 C ATOM 1454 CG GLN A 101 -10.183 3.503 -7.641 1.00 71.10 C ATOM 1455 CD GLN A 101 -9.143 3.625 -8.749 1.00 51.42 C ATOM 1456 OE1 GLN A 101 -8.515 2.655 -9.169 1.00 15.43 O ATOM 1457 NE2 GLN A 101 -8.933 4.824 -9.257 1.00 34.43 N ATOM 0 H GLN A 101 -10.095 3.506 -4.788 1.00 12.45 H new ATOM 0 HA GLN A 101 -12.149 2.160 -6.307 1.00 20.24 H new ATOM 0 HB2 GLN A 101 -9.110 2.093 -6.401 1.00 62.04 H new ATOM 0 HB3 GLN A 101 -10.172 1.342 -7.576 1.00 62.04 H new ATOM 0 HG2 GLN A 101 -11.179 3.598 -8.073 1.00 71.10 H new ATOM 0 HG3 GLN A 101 -10.059 4.329 -6.941 1.00 71.10 H new ATOM 0 HE21 GLN A 101 -9.456 5.626 -8.905 1.00 34.43 H new ATOM 0 HE22 GLN A 101 -8.247 4.949 -10.002 1.00 34.43 H new ATOM 1464 N MET A 102 -10.168 0.440 -4.247 1.00 42.41 N ATOM 1465 CA MET A 102 -9.999 -0.839 -3.557 1.00 32.02 C ATOM 1466 C MET A 102 -11.126 -1.171 -2.569 1.00 14.24 C ATOM 1467 O MET A 102 -11.116 -2.255 -1.995 1.00 24.45 O ATOM 1468 CB MET A 102 -8.648 -0.876 -2.828 1.00 14.25 C ATOM 1469 CG MET A 102 -7.462 -0.888 -3.796 1.00 32.23 C ATOM 1470 SD MET A 102 -6.254 -2.203 -3.469 1.00 2.13 S ATOM 1471 CE MET A 102 -4.895 -1.177 -2.872 1.00 64.21 C ATOM 0 H MET A 102 -9.462 1.132 -3.995 1.00 42.41 H new ATOM 0 HA MET A 102 -10.035 -1.602 -4.335 1.00 32.02 H new ATOM 0 HB2 MET A 102 -8.569 -0.009 -2.172 1.00 14.25 H new ATOM 0 HB3 MET A 102 -8.605 -1.761 -2.194 1.00 14.25 H new ATOM 0 HG2 MET A 102 -7.838 -0.999 -4.813 1.00 32.23 H new ATOM 0 HG3 MET A 102 -6.956 0.076 -3.746 1.00 32.23 H new ATOM 0 HE1 MET A 102 -4.059 -1.813 -2.582 1.00 64.21 H new ATOM 0 HE2 MET A 102 -4.577 -0.498 -3.663 1.00 64.21 H new ATOM 0 HE3 MET A 102 -5.227 -0.599 -2.010 1.00 64.21 H new ATOM 1479 N LYS A 103 -12.108 -0.298 -2.339 1.00 23.44 N ATOM 1480 CA LYS A 103 -13.144 -0.429 -1.325 1.00 20.02 C ATOM 1481 C LYS A 103 -13.969 -1.724 -1.372 1.00 22.13 C ATOM 1482 O LYS A 103 -14.565 -2.102 -0.364 1.00 15.23 O ATOM 1483 CB LYS A 103 -14.016 0.825 -1.435 1.00 35.44 C ATOM 1484 CG LYS A 103 -14.504 1.382 -0.103 1.00 20.41 C ATOM 1485 CD LYS A 103 -13.421 2.043 0.766 1.00 61.00 C ATOM 1486 CE LYS A 103 -13.987 3.217 1.585 1.00 40.32 C ATOM 1487 NZ LYS A 103 -15.081 2.819 2.500 1.00 0.53 N ATOM 0 H LYS A 103 -12.203 0.559 -2.883 1.00 23.44 H new ATOM 0 HA LYS A 103 -12.663 -0.509 -0.350 1.00 20.02 H new ATOM 0 HB2 LYS A 103 -13.450 1.600 -1.952 1.00 35.44 H new ATOM 0 HB3 LYS A 103 -14.882 0.595 -2.056 1.00 35.44 H new ATOM 0 HG2 LYS A 103 -15.287 2.114 -0.299 1.00 20.41 H new ATOM 0 HG3 LYS A 103 -14.960 0.572 0.466 1.00 20.41 H new ATOM 0 HD2 LYS A 103 -12.993 1.302 1.441 1.00 61.00 H new ATOM 0 HD3 LYS A 103 -12.611 2.400 0.130 1.00 61.00 H new ATOM 0 HE2 LYS A 103 -13.182 3.667 2.166 1.00 40.32 H new ATOM 0 HE3 LYS A 103 -14.354 3.983 0.902 1.00 40.32 H new ATOM 0 HZ1 LYS A 103 -15.395 3.646 3.046 1.00 0.53 H new ATOM 0 HZ2 LYS A 103 -15.879 2.447 1.946 1.00 0.53 H new ATOM 0 HZ3 LYS A 103 -14.739 2.084 3.151 1.00 0.53 H new ATOM 1497 N ASN A 104 -13.993 -2.433 -2.500 1.00 23.44 N ATOM 1498 CA ASN A 104 -14.642 -3.737 -2.627 1.00 61.44 C ATOM 1499 C ASN A 104 -13.834 -4.855 -1.951 1.00 33.45 C ATOM 1500 O ASN A 104 -14.376 -5.919 -1.669 1.00 12.11 O ATOM 1501 CB ASN A 104 -14.925 -4.117 -4.101 1.00 52.50 C ATOM 1502 CG ASN A 104 -14.265 -3.296 -5.204 1.00 32.41 C ATOM 1503 OD1 ASN A 104 -14.797 -2.273 -5.606 1.00 24.34 O ATOM 1504 ND2 ASN A 104 -13.092 -3.677 -5.686 1.00 0.12 N ATOM 0 H ASN A 104 -13.556 -2.113 -3.364 1.00 23.44 H new ATOM 0 HA ASN A 104 -15.597 -3.638 -2.111 1.00 61.44 H new ATOM 0 HB2 ASN A 104 -14.627 -5.157 -4.238 1.00 52.50 H new ATOM 0 HB3 ASN A 104 -16.003 -4.071 -4.254 1.00 52.50 H new ATOM 0 HD21 ASN A 104 -12.626 -3.115 -6.398 1.00 0.12 H new ATOM 0 HD22 ASN A 104 -12.654 -4.533 -5.345 1.00 0.12 H new ATOM 1510 N TYR A 105 -12.525 -4.687 -1.746 1.00 75.04 N ATOM 1511 CA TYR A 105 -11.633 -5.738 -1.258 1.00 35.15 C ATOM 1512 C TYR A 105 -11.801 -5.986 0.229 1.00 33.14 C ATOM 1513 O TYR A 105 -12.107 -5.086 1.012 1.00 12.23 O ATOM 1514 CB TYR A 105 -10.176 -5.330 -1.558 1.00 60.41 C ATOM 1515 CG TYR A 105 -9.088 -6.167 -0.909 1.00 60.20 C ATOM 1516 CD1 TYR A 105 -8.614 -5.840 0.378 1.00 40.51 C ATOM 1517 CD2 TYR A 105 -8.542 -7.268 -1.588 1.00 13.15 C ATOM 1518 CE1 TYR A 105 -7.584 -6.592 0.964 1.00 14.11 C ATOM 1519 CE2 TYR A 105 -7.485 -8.000 -1.020 1.00 44.42 C ATOM 1520 CZ TYR A 105 -6.982 -7.651 0.250 1.00 42.40 C ATOM 1521 OH TYR A 105 -5.917 -8.322 0.766 1.00 54.51 O ATOM 0 H TYR A 105 -12.049 -3.801 -1.918 1.00 75.04 H new ATOM 0 HA TYR A 105 -11.886 -6.666 -1.770 1.00 35.15 H new ATOM 0 HB2 TYR A 105 -10.030 -5.359 -2.638 1.00 60.41 H new ATOM 0 HB3 TYR A 105 -10.041 -4.294 -1.246 1.00 60.41 H new ATOM 0 HD1 TYR A 105 -9.045 -5.008 0.915 1.00 40.51 H new ATOM 0 HD2 TYR A 105 -8.936 -7.554 -2.552 1.00 13.15 H new ATOM 0 HE1 TYR A 105 -7.251 -6.360 1.965 1.00 14.11 H new ATOM 0 HE2 TYR A 105 -7.057 -8.833 -1.558 1.00 44.42 H new ATOM 0 HH TYR A 105 -5.443 -7.745 1.401 1.00 54.51 H new ATOM 1530 N ARG A 106 -11.513 -7.231 0.601 1.00 11.31 N ATOM 1531 CA ARG A 106 -11.454 -7.800 1.929 1.00 3.23 C ATOM 1532 C ARG A 106 -10.215 -8.696 1.914 1.00 12.53 C ATOM 1533 O ARG A 106 -9.939 -9.305 0.878 1.00 55.40 O ATOM 1534 CB ARG A 106 -12.727 -8.630 2.131 1.00 40.11 C ATOM 1535 CG ARG A 106 -14.016 -7.790 2.079 1.00 13.33 C ATOM 1536 CD ARG A 106 -14.397 -7.304 3.484 1.00 32.02 C ATOM 1537 NE ARG A 106 -15.712 -6.647 3.504 1.00 0.12 N ATOM 1538 CZ ARG A 106 -16.391 -6.262 4.590 1.00 31.33 C ATOM 1539 NH1 ARG A 106 -15.829 -6.268 5.791 1.00 63.43 N ATOM 1540 NH2 ARG A 106 -17.658 -5.880 4.481 1.00 4.45 N ATOM 0 H ARG A 106 -11.293 -7.935 -0.103 1.00 11.31 H new ATOM 0 HA ARG A 106 -11.393 -7.063 2.729 1.00 3.23 H new ATOM 0 HB2 ARG A 106 -12.774 -9.403 1.364 1.00 40.11 H new ATOM 0 HB3 ARG A 106 -12.672 -9.139 3.093 1.00 40.11 H new ATOM 0 HG2 ARG A 106 -13.874 -6.935 1.418 1.00 13.33 H new ATOM 0 HG3 ARG A 106 -14.828 -8.385 1.661 1.00 13.33 H new ATOM 0 HD2 ARG A 106 -14.405 -8.151 4.170 1.00 32.02 H new ATOM 0 HD3 ARG A 106 -13.639 -6.608 3.844 1.00 32.02 H new ATOM 0 HE ARG A 106 -16.150 -6.467 2.600 1.00 0.12 H new ATOM 0 HH11 ARG A 106 -14.861 -6.570 5.900 1.00 63.43 H new ATOM 0 HH12 ARG A 106 -16.365 -5.970 6.606 1.00 63.43 H new ATOM 0 HH21 ARG A 106 -18.114 -5.880 3.569 1.00 4.45 H new ATOM 0 HH22 ARG A 106 -18.175 -5.587 5.310 1.00 4.45 H new ATOM 1551 N GLY A 107 -9.489 -8.783 3.021 1.00 60.01 N ATOM 1552 CA GLY A 107 -8.169 -9.395 3.110 1.00 12.35 C ATOM 1553 C GLY A 107 -7.235 -8.467 3.882 1.00 71.22 C ATOM 1554 O GLY A 107 -7.672 -7.426 4.390 1.00 52.13 O ATOM 0 H GLY A 107 -9.815 -8.416 3.915 1.00 60.01 H new ATOM 0 HA2 GLY A 107 -8.236 -10.361 3.610 1.00 12.35 H new ATOM 0 HA3 GLY A 107 -7.773 -9.580 2.111 1.00 12.35 H new ATOM 1558 N GLU A 108 -5.955 -8.824 3.989 1.00 1.41 N ATOM 1559 CA GLU A 108 -4.968 -8.034 4.722 1.00 24.42 C ATOM 1560 C GLU A 108 -4.376 -6.958 3.818 1.00 22.31 C ATOM 1561 O GLU A 108 -4.237 -7.168 2.606 1.00 21.15 O ATOM 1562 CB GLU A 108 -3.873 -8.950 5.299 1.00 13.53 C ATOM 1563 CG GLU A 108 -4.465 -9.758 6.462 1.00 74.13 C ATOM 1564 CD GLU A 108 -3.461 -10.460 7.388 1.00 61.33 C ATOM 1565 OE1 GLU A 108 -2.438 -11.019 6.923 1.00 5.44 O ATOM 1566 OE2 GLU A 108 -3.748 -10.509 8.609 1.00 30.01 O ATOM 0 H GLU A 108 -5.573 -9.671 3.568 1.00 1.41 H new ATOM 0 HA GLU A 108 -5.460 -7.535 5.557 1.00 24.42 H new ATOM 0 HB2 GLU A 108 -3.497 -9.621 4.527 1.00 13.53 H new ATOM 0 HB3 GLU A 108 -3.027 -8.356 5.645 1.00 13.53 H new ATOM 0 HG2 GLU A 108 -5.077 -9.088 7.067 1.00 74.13 H new ATOM 0 HG3 GLU A 108 -5.133 -10.513 6.048 1.00 74.13 H new ATOM 1571 N VAL A 109 -4.023 -5.805 4.396 1.00 44.13 N ATOM 1572 CA VAL A 109 -3.460 -4.677 3.675 1.00 52.43 C ATOM 1573 C VAL A 109 -2.405 -4.024 4.569 1.00 52.40 C ATOM 1574 O VAL A 109 -2.695 -3.736 5.731 1.00 3.35 O ATOM 1575 CB VAL A 109 -4.584 -3.674 3.332 1.00 21.12 C ATOM 1576 CG1 VAL A 109 -4.064 -2.603 2.369 1.00 20.33 C ATOM 1577 CG2 VAL A 109 -5.812 -4.307 2.675 1.00 15.13 C ATOM 0 H VAL A 109 -4.126 -5.635 5.396 1.00 44.13 H new ATOM 0 HA VAL A 109 -2.998 -5.002 2.743 1.00 52.43 H new ATOM 0 HB VAL A 109 -4.888 -3.257 4.292 1.00 21.12 H new ATOM 0 HG11 VAL A 109 -4.866 -1.903 2.136 1.00 20.33 H new ATOM 0 HG12 VAL A 109 -3.237 -2.066 2.834 1.00 20.33 H new ATOM 0 HG13 VAL A 109 -3.718 -3.077 1.451 1.00 20.33 H new ATOM 0 HG21 VAL A 109 -6.552 -3.534 2.467 1.00 15.13 H new ATOM 0 HG22 VAL A 109 -5.518 -4.788 1.742 1.00 15.13 H new ATOM 0 HG23 VAL A 109 -6.242 -5.050 3.347 1.00 15.13 H new ATOM 1587 N ALA A 110 -1.205 -3.718 4.069 1.00 13.24 N ATOM 1588 CA ALA A 110 -0.200 -2.976 4.843 1.00 41.32 C ATOM 1589 C ALA A 110 0.281 -1.746 4.078 1.00 60.04 C ATOM 1590 O ALA A 110 -0.115 -1.525 2.928 1.00 21.11 O ATOM 1591 CB ALA A 110 0.958 -3.887 5.250 1.00 22.04 C ATOM 0 H ALA A 110 -0.903 -3.973 3.129 1.00 13.24 H new ATOM 0 HA ALA A 110 -0.669 -2.621 5.761 1.00 41.32 H new ATOM 0 HB1 ALA A 110 1.688 -3.314 5.822 1.00 22.04 H new ATOM 0 HB2 ALA A 110 0.579 -4.705 5.862 1.00 22.04 H new ATOM 0 HB3 ALA A 110 1.434 -4.292 4.357 1.00 22.04 H new ATOM 1597 N SER A 111 1.137 -0.943 4.713 1.00 1.42 N ATOM 1598 CA SER A 111 1.673 0.277 4.133 1.00 44.40 C ATOM 1599 C SER A 111 3.090 0.494 4.678 1.00 63.01 C ATOM 1600 O SER A 111 3.259 0.964 5.799 1.00 65.30 O ATOM 1601 CB SER A 111 0.687 1.420 4.416 1.00 32.03 C ATOM 1602 OG SER A 111 0.938 2.589 3.654 1.00 75.00 O ATOM 0 H SER A 111 1.478 -1.129 5.656 1.00 1.42 H new ATOM 0 HA SER A 111 1.773 0.224 3.049 1.00 44.40 H new ATOM 0 HB2 SER A 111 -0.326 1.074 4.211 1.00 32.03 H new ATOM 0 HB3 SER A 111 0.730 1.671 5.476 1.00 32.03 H new ATOM 0 HG SER A 111 0.156 3.178 3.691 1.00 75.00 H new ATOM 1607 N PHE A 112 4.119 0.103 3.925 1.00 2.11 N ATOM 1608 CA PHE A 112 5.518 0.405 4.247 1.00 72.43 C ATOM 1609 C PHE A 112 5.966 1.664 3.505 1.00 4.12 C ATOM 1610 O PHE A 112 5.260 2.100 2.595 1.00 20.15 O ATOM 1611 CB PHE A 112 6.415 -0.801 3.925 1.00 20.01 C ATOM 1612 CG PHE A 112 6.093 -1.594 2.667 1.00 15.14 C ATOM 1613 CD1 PHE A 112 5.944 -0.961 1.421 1.00 41.44 C ATOM 1614 CD2 PHE A 112 5.962 -2.992 2.735 1.00 53.33 C ATOM 1615 CE1 PHE A 112 5.708 -1.711 0.258 1.00 24.01 C ATOM 1616 CE2 PHE A 112 5.744 -3.741 1.573 1.00 61.23 C ATOM 1617 CZ PHE A 112 5.649 -3.105 0.330 1.00 51.20 C ATOM 0 H PHE A 112 4.006 -0.437 3.067 1.00 2.11 H new ATOM 0 HA PHE A 112 5.608 0.600 5.316 1.00 72.43 H new ATOM 0 HB2 PHE A 112 7.442 -0.446 3.846 1.00 20.01 H new ATOM 0 HB3 PHE A 112 6.378 -1.485 4.773 1.00 20.01 H new ATOM 0 HD1 PHE A 112 6.012 0.115 1.358 1.00 41.44 H new ATOM 0 HD2 PHE A 112 6.030 -3.491 3.690 1.00 53.33 H new ATOM 0 HE1 PHE A 112 5.572 -1.212 -0.690 1.00 24.01 H new ATOM 0 HE2 PHE A 112 5.649 -4.815 1.636 1.00 61.23 H new ATOM 0 HZ PHE A 112 5.531 -3.690 -0.570 1.00 51.20 H new ATOM 1626 N PHE A 113 7.136 2.234 3.836 1.00 54.41 N ATOM 1627 CA PHE A 113 7.669 3.470 3.239 1.00 12.34 C ATOM 1628 C PHE A 113 9.030 3.882 3.811 1.00 12.43 C ATOM 1629 O PHE A 113 9.619 3.117 4.573 1.00 71.01 O ATOM 1630 CB PHE A 113 6.635 4.608 3.226 1.00 42.40 C ATOM 1631 CG PHE A 113 5.642 4.862 4.343 1.00 74.30 C ATOM 1632 CD1 PHE A 113 5.762 4.319 5.637 1.00 22.12 C ATOM 1633 CD2 PHE A 113 4.532 5.669 4.023 1.00 1.55 C ATOM 1634 CE1 PHE A 113 4.753 4.555 6.574 1.00 50.14 C ATOM 1635 CE2 PHE A 113 3.520 5.889 4.965 1.00 3.43 C ATOM 1636 CZ PHE A 113 3.616 5.308 6.232 1.00 34.43 C ATOM 0 H PHE A 113 7.754 1.838 4.545 1.00 54.41 H new ATOM 0 HA PHE A 113 7.868 3.240 2.192 1.00 12.34 H new ATOM 0 HB2 PHE A 113 7.200 5.532 3.105 1.00 42.40 H new ATOM 0 HB3 PHE A 113 6.046 4.474 2.319 1.00 42.40 H new ATOM 0 HD1 PHE A 113 6.625 3.726 5.902 1.00 22.12 H new ATOM 0 HD2 PHE A 113 4.462 6.121 3.045 1.00 1.55 H new ATOM 0 HE1 PHE A 113 4.847 4.154 7.573 1.00 50.14 H new ATOM 0 HE2 PHE A 113 2.669 6.505 4.714 1.00 3.43 H new ATOM 0 HZ PHE A 113 2.818 5.437 6.948 1.00 34.43 H new ATOM 1645 N THR A 114 9.564 5.047 3.414 1.00 55.34 N ATOM 1646 CA THR A 114 10.814 5.600 3.942 1.00 70.22 C ATOM 1647 C THR A 114 10.578 7.056 4.366 1.00 32.34 C ATOM 1648 O THR A 114 9.556 7.626 3.982 1.00 54.30 O ATOM 1649 CB THR A 114 11.951 5.446 2.909 1.00 22.31 C ATOM 1650 OG1 THR A 114 11.679 6.157 1.717 1.00 74.34 O ATOM 1651 CG2 THR A 114 12.174 3.982 2.498 1.00 20.11 C ATOM 0 H THR A 114 9.130 5.639 2.705 1.00 55.34 H new ATOM 0 HA THR A 114 11.131 5.047 4.826 1.00 70.22 H new ATOM 0 HB THR A 114 12.836 5.841 3.407 1.00 22.31 H new ATOM 0 HG1 THR A 114 12.421 6.037 1.088 1.00 74.34 H new ATOM 0 HG21 THR A 114 12.984 3.928 1.770 1.00 20.11 H new ATOM 0 HG22 THR A 114 12.436 3.393 3.377 1.00 20.11 H new ATOM 0 HG23 THR A 114 11.261 3.585 2.055 1.00 20.11 H new ATOM 1659 N SER A 115 11.451 7.663 5.183 1.00 61.04 N ATOM 1660 CA SER A 115 11.250 9.019 5.717 1.00 1.31 C ATOM 1661 C SER A 115 12.575 9.716 6.076 1.00 24.10 C ATOM 1662 O SER A 115 13.652 9.129 5.990 1.00 70.33 O ATOM 1663 CB SER A 115 10.340 8.981 6.963 1.00 52.53 C ATOM 1664 OG SER A 115 9.393 7.930 6.933 1.00 31.25 O ATOM 0 H SER A 115 12.319 7.226 5.493 1.00 61.04 H new ATOM 0 HA SER A 115 10.773 9.596 4.925 1.00 1.31 H new ATOM 0 HB2 SER A 115 10.960 8.877 7.854 1.00 52.53 H new ATOM 0 HB3 SER A 115 9.814 9.932 7.050 1.00 52.53 H new ATOM 0 HG SER A 115 8.848 7.957 7.747 1.00 31.25 H new ATOM 1669 N ALA A 116 12.486 10.943 6.600 1.00 3.52 N ATOM 1670 CA ALA A 116 13.572 11.827 7.005 1.00 12.23 C ATOM 1671 C ALA A 116 14.017 11.546 8.447 1.00 42.33 C ATOM 1672 O ALA A 116 14.488 12.446 9.156 1.00 73.03 O ATOM 1673 CB ALA A 116 13.059 13.264 6.883 1.00 32.40 C ATOM 0 H ALA A 116 11.576 11.374 6.763 1.00 3.52 H new ATOM 0 HA ALA A 116 14.440 11.663 6.366 1.00 12.23 H new ATOM 0 HB1 ALA A 116 13.846 13.958 7.179 1.00 32.40 H new ATOM 0 HB2 ALA A 116 12.771 13.461 5.850 1.00 32.40 H new ATOM 0 HB3 ALA A 116 12.194 13.398 7.533 1.00 32.40 H new ATOM 1679 N GLY A 117 13.788 10.327 8.944 1.00 1.10 N ATOM 1680 CA GLY A 117 14.280 9.952 10.257 1.00 31.22 C ATOM 1681 C GLY A 117 13.616 10.715 11.410 1.00 62.14 C ATOM 1682 O GLY A 117 14.189 10.843 12.491 1.00 74.04 O ATOM 0 H GLY A 117 13.270 9.596 8.457 1.00 1.10 H new ATOM 0 HA2 GLY A 117 14.121 8.883 10.402 1.00 31.22 H new ATOM 0 HA3 GLY A 117 15.356 10.122 10.293 1.00 31.22 H new ATOM 1686 N THR A 118 12.422 11.253 11.182 1.00 24.23 N ATOM 1687 CA THR A 118 11.631 12.116 12.060 1.00 14.42 C ATOM 1688 C THR A 118 10.154 11.763 11.819 1.00 21.40 C ATOM 1689 O THR A 118 9.880 10.910 10.977 1.00 32.24 O ATOM 1690 CB THR A 118 11.922 13.596 11.716 1.00 41.13 C ATOM 1691 OG1 THR A 118 12.208 13.776 10.338 1.00 52.34 O ATOM 1692 CG2 THR A 118 13.102 14.153 12.505 1.00 11.51 C ATOM 0 H THR A 118 11.938 11.082 10.300 1.00 24.23 H new ATOM 0 HA THR A 118 11.880 11.969 13.111 1.00 14.42 H new ATOM 0 HB THR A 118 11.012 14.133 11.984 1.00 41.13 H new ATOM 0 HG1 THR A 118 13.081 13.383 10.131 1.00 52.34 H new ATOM 0 HG21 THR A 118 13.266 15.194 12.228 1.00 11.51 H new ATOM 0 HG22 THR A 118 12.888 14.091 13.572 1.00 11.51 H new ATOM 0 HG23 THR A 118 13.997 13.573 12.280 1.00 11.51 H new ATOM 1700 N ASN A 119 9.200 12.408 12.502 1.00 12.31 N ATOM 1701 CA ASN A 119 7.781 12.452 12.130 1.00 41.54 C ATOM 1702 C ASN A 119 7.112 11.082 12.226 1.00 50.23 C ATOM 1703 O ASN A 119 6.187 10.784 11.471 1.00 12.21 O ATOM 1704 CB ASN A 119 7.580 13.109 10.747 1.00 32.04 C ATOM 1705 CG ASN A 119 7.903 14.592 10.742 1.00 65.05 C ATOM 1706 OD1 ASN A 119 7.563 15.300 11.681 1.00 53.54 O ATOM 1707 ND2 ASN A 119 8.562 15.078 9.706 1.00 41.45 N ATOM 0 H ASN A 119 9.401 12.930 13.355 1.00 12.31 H new ATOM 0 HA ASN A 119 7.278 13.085 12.861 1.00 41.54 H new ATOM 0 HB2 ASN A 119 8.210 12.603 10.016 1.00 32.04 H new ATOM 0 HB3 ASN A 119 6.547 12.967 10.430 1.00 32.04 H new ATOM 0 HD21 ASN A 119 8.801 16.069 9.673 1.00 41.45 H new ATOM 0 HD22 ASN A 119 8.832 14.462 8.939 1.00 41.45 H new ATOM 1713 N HIS A 120 7.587 10.229 13.134 1.00 21.03 N ATOM 1714 CA HIS A 120 7.077 8.879 13.301 1.00 73.33 C ATOM 1715 C HIS A 120 5.588 8.908 13.646 1.00 4.40 C ATOM 1716 O HIS A 120 4.773 8.366 12.909 1.00 21.33 O ATOM 1717 CB HIS A 120 7.943 8.115 14.323 1.00 12.25 C ATOM 1718 CG HIS A 120 7.793 8.549 15.765 1.00 13.43 C ATOM 1719 ND1 HIS A 120 7.057 7.877 16.715 1.00 25.01 N ATOM 1720 CD2 HIS A 120 8.281 9.689 16.350 1.00 72.14 C ATOM 1721 CE1 HIS A 120 7.063 8.613 17.838 1.00 43.12 C ATOM 1722 NE2 HIS A 120 7.806 9.727 17.668 1.00 22.22 N ATOM 0 H HIS A 120 8.343 10.463 13.777 1.00 21.03 H new ATOM 0 HA HIS A 120 7.151 8.330 12.363 1.00 73.33 H new ATOM 0 HB2 HIS A 120 7.702 7.054 14.255 1.00 12.25 H new ATOM 0 HB3 HIS A 120 8.989 8.223 14.037 1.00 12.25 H new ATOM 0 HD2 HIS A 120 8.917 10.425 15.880 1.00 72.14 H new ATOM 0 HE1 HIS A 120 6.546 8.351 18.749 1.00 43.12 H new ATOM 0 HE2 HIS A 120 7.986 10.453 18.362 1.00 22.22 H new ATOM 1729 N LYS A 121 5.207 9.601 14.722 1.00 22.43 N ATOM 1730 CA LYS A 121 3.827 9.599 15.208 1.00 44.53 C ATOM 1731 C LYS A 121 2.887 10.183 14.145 1.00 2.13 C ATOM 1732 O LYS A 121 1.815 9.636 13.896 1.00 73.02 O ATOM 1733 CB LYS A 121 3.765 10.367 16.542 1.00 5.41 C ATOM 1734 CG LYS A 121 3.353 9.500 17.740 1.00 54.33 C ATOM 1735 CD LYS A 121 1.873 9.105 17.706 1.00 74.30 C ATOM 1736 CE LYS A 121 1.352 8.682 19.085 1.00 53.14 C ATOM 1737 NZ LYS A 121 1.917 7.399 19.554 1.00 2.51 N ATOM 0 H LYS A 121 5.842 10.175 15.277 1.00 22.43 H new ATOM 0 HA LYS A 121 3.491 8.579 15.392 1.00 44.53 H new ATOM 0 HB2 LYS A 121 4.742 10.806 16.743 1.00 5.41 H new ATOM 0 HB3 LYS A 121 3.059 11.192 16.443 1.00 5.41 H new ATOM 0 HG2 LYS A 121 3.965 8.598 17.757 1.00 54.33 H new ATOM 0 HG3 LYS A 121 3.558 10.042 18.663 1.00 54.33 H new ATOM 0 HD2 LYS A 121 1.283 9.945 17.339 1.00 74.30 H new ATOM 0 HD3 LYS A 121 1.734 8.286 17.000 1.00 74.30 H new ATOM 0 HE2 LYS A 121 1.587 9.461 19.810 1.00 53.14 H new ATOM 0 HE3 LYS A 121 0.266 8.600 19.046 1.00 53.14 H new ATOM 0 HZ1 LYS A 121 1.526 7.169 20.490 1.00 2.51 H new ATOM 0 HZ2 LYS A 121 1.671 6.645 18.881 1.00 2.51 H new ATOM 0 HZ3 LYS A 121 2.952 7.479 19.621 1.00 2.51 H new ATOM 1747 N ALA A 122 3.338 11.254 13.492 1.00 73.44 N ATOM 1748 CA ALA A 122 2.632 11.953 12.438 1.00 51.22 C ATOM 1749 C ALA A 122 2.329 11.023 11.262 1.00 44.31 C ATOM 1750 O ALA A 122 1.160 10.890 10.919 1.00 23.12 O ATOM 1751 CB ALA A 122 3.438 13.177 11.999 1.00 32.42 C ATOM 0 H ALA A 122 4.246 11.670 13.698 1.00 73.44 H new ATOM 0 HA ALA A 122 1.672 12.295 12.824 1.00 51.22 H new ATOM 0 HB1 ALA A 122 2.903 13.700 11.206 1.00 32.42 H new ATOM 0 HB2 ALA A 122 3.574 13.847 12.848 1.00 32.42 H new ATOM 0 HB3 ALA A 122 4.413 12.858 11.630 1.00 32.42 H new ATOM 1757 N TYR A 123 3.332 10.364 10.656 1.00 71.34 N ATOM 1758 CA TYR A 123 3.136 9.492 9.491 1.00 30.43 C ATOM 1759 C TYR A 123 2.026 8.484 9.772 1.00 62.42 C ATOM 1760 O TYR A 123 1.226 8.212 8.886 1.00 34.21 O ATOM 1761 CB TYR A 123 4.469 8.802 9.100 1.00 73.24 C ATOM 1762 CG TYR A 123 4.809 7.401 9.606 1.00 2.55 C ATOM 1763 CD1 TYR A 123 3.976 6.297 9.354 1.00 41.53 C ATOM 1764 CD2 TYR A 123 6.024 7.186 10.272 1.00 44.14 C ATOM 1765 CE1 TYR A 123 4.285 5.032 9.874 1.00 73.04 C ATOM 1766 CE2 TYR A 123 6.368 5.917 10.771 1.00 44.11 C ATOM 1767 CZ TYR A 123 5.484 4.832 10.581 1.00 24.32 C ATOM 1768 OH TYR A 123 5.784 3.601 11.077 1.00 45.10 O ATOM 0 H TYR A 123 4.303 10.423 10.963 1.00 71.34 H new ATOM 0 HA TYR A 123 2.824 10.094 8.638 1.00 30.43 H new ATOM 0 HB2 TYR A 123 4.501 8.765 8.011 1.00 73.24 H new ATOM 0 HB3 TYR A 123 5.276 9.461 9.420 1.00 73.24 H new ATOM 0 HD1 TYR A 123 3.088 6.425 8.753 1.00 41.53 H new ATOM 0 HD2 TYR A 123 6.709 8.011 10.404 1.00 44.14 H new ATOM 0 HE1 TYR A 123 3.600 4.209 9.731 1.00 73.04 H new ATOM 0 HE2 TYR A 123 7.301 5.773 11.296 1.00 44.11 H new ATOM 0 HH TYR A 123 4.997 3.021 11.010 1.00 45.10 H new ATOM 1777 N VAL A 124 1.991 7.919 10.981 1.00 33.31 N ATOM 1778 CA VAL A 124 1.047 6.881 11.357 1.00 73.41 C ATOM 1779 C VAL A 124 -0.365 7.477 11.261 1.00 42.22 C ATOM 1780 O VAL A 124 -1.177 6.988 10.472 1.00 5.24 O ATOM 1781 CB VAL A 124 1.451 6.302 12.737 1.00 65.12 C ATOM 1782 CG1 VAL A 124 0.534 5.185 13.255 1.00 73.30 C ATOM 1783 CG2 VAL A 124 2.873 5.711 12.714 1.00 10.44 C ATOM 0 H VAL A 124 2.630 8.178 11.733 1.00 33.31 H new ATOM 0 HA VAL A 124 1.058 6.022 10.687 1.00 73.41 H new ATOM 0 HB VAL A 124 1.375 7.164 13.400 1.00 65.12 H new ATOM 0 HG11 VAL A 124 0.892 4.841 14.225 1.00 73.30 H new ATOM 0 HG12 VAL A 124 -0.482 5.567 13.358 1.00 73.30 H new ATOM 0 HG13 VAL A 124 0.539 4.354 12.550 1.00 73.30 H new ATOM 0 HG21 VAL A 124 3.119 5.316 13.700 1.00 10.44 H new ATOM 0 HG22 VAL A 124 2.921 4.908 11.978 1.00 10.44 H new ATOM 0 HG23 VAL A 124 3.587 6.491 12.448 1.00 10.44 H new ATOM 1793 N SER A 125 -0.660 8.574 11.968 1.00 53.34 N ATOM 1794 CA SER A 125 -1.992 9.181 11.901 1.00 4.14 C ATOM 1795 C SER A 125 -2.316 9.705 10.498 1.00 1.13 C ATOM 1796 O SER A 125 -3.453 9.591 10.049 1.00 32.32 O ATOM 1797 CB SER A 125 -2.117 10.298 12.940 1.00 34.14 C ATOM 1798 OG SER A 125 -2.428 9.736 14.201 1.00 72.10 O ATOM 0 H SER A 125 -0.004 9.053 12.585 1.00 53.34 H new ATOM 0 HA SER A 125 -2.721 8.403 12.127 1.00 4.14 H new ATOM 0 HB2 SER A 125 -1.185 10.860 13.000 1.00 34.14 H new ATOM 0 HB3 SER A 125 -2.894 11.002 12.642 1.00 34.14 H new ATOM 0 HG SER A 125 -2.506 10.450 14.867 1.00 72.10 H new ATOM 1803 N HIS A 126 -1.340 10.264 9.783 1.00 33.22 N ATOM 1804 CA HIS A 126 -1.565 10.887 8.483 1.00 13.34 C ATOM 1805 C HIS A 126 -1.595 9.863 7.341 1.00 73.40 C ATOM 1806 O HIS A 126 -1.976 10.196 6.219 1.00 64.20 O ATOM 1807 CB HIS A 126 -0.519 11.984 8.256 1.00 31.04 C ATOM 1808 CG HIS A 126 -0.434 13.018 9.358 1.00 5.23 C ATOM 1809 ND1 HIS A 126 0.651 13.816 9.651 1.00 54.44 N ATOM 1810 CD2 HIS A 126 -1.414 13.321 10.266 1.00 24.23 C ATOM 1811 CE1 HIS A 126 0.324 14.586 10.700 1.00 21.02 C ATOM 1812 NE2 HIS A 126 -0.926 14.319 11.109 1.00 5.31 N ATOM 0 H HIS A 126 -0.368 10.297 10.092 1.00 33.22 H new ATOM 0 HA HIS A 126 -2.554 11.345 8.485 1.00 13.34 H new ATOM 0 HB2 HIS A 126 0.459 11.516 8.140 1.00 31.04 H new ATOM 0 HB3 HIS A 126 -0.743 12.491 7.318 1.00 31.04 H new ATOM 0 HD1 HIS A 126 1.544 13.820 9.158 1.00 54.44 H new ATOM 0 HD2 HIS A 126 -2.392 12.867 10.320 1.00 24.23 H new ATOM 0 HE1 HIS A 126 0.976 15.319 11.152 1.00 21.02 H new ATOM 1819 N PHE A 127 -1.219 8.611 7.597 1.00 53.30 N ATOM 1820 CA PHE A 127 -1.641 7.492 6.775 1.00 75.31 C ATOM 1821 C PHE A 127 -3.076 7.126 7.145 1.00 55.31 C ATOM 1822 O PHE A 127 -3.924 7.149 6.258 1.00 60.30 O ATOM 1823 CB PHE A 127 -0.689 6.299 6.890 1.00 60.34 C ATOM 1824 CG PHE A 127 -1.203 5.096 6.120 1.00 15.24 C ATOM 1825 CD1 PHE A 127 -1.278 5.115 4.710 1.00 61.12 C ATOM 1826 CD2 PHE A 127 -1.718 3.995 6.827 1.00 52.13 C ATOM 1827 CE1 PHE A 127 -1.842 4.029 4.021 1.00 41.34 C ATOM 1828 CE2 PHE A 127 -2.260 2.900 6.135 1.00 20.24 C ATOM 1829 CZ PHE A 127 -2.325 2.922 4.735 1.00 54.50 C ATOM 0 H PHE A 127 -0.616 8.351 8.378 1.00 53.30 H new ATOM 0 HA PHE A 127 -1.609 7.786 5.726 1.00 75.31 H new ATOM 0 HB2 PHE A 127 0.294 6.580 6.513 1.00 60.34 H new ATOM 0 HB3 PHE A 127 -0.563 6.033 7.940 1.00 60.34 H new ATOM 0 HD1 PHE A 127 -0.901 5.965 4.161 1.00 61.12 H new ATOM 0 HD2 PHE A 127 -1.697 3.992 7.907 1.00 52.13 H new ATOM 0 HE1 PHE A 127 -1.904 4.046 2.943 1.00 41.34 H new ATOM 0 HE2 PHE A 127 -2.626 2.043 6.680 1.00 20.24 H new ATOM 0 HZ PHE A 127 -2.749 2.083 4.203 1.00 54.50 H new ATOM 1838 N ASN A 128 -3.341 6.835 8.431 1.00 10.15 N ATOM 1839 CA ASN A 128 -4.632 6.343 8.935 1.00 10.14 C ATOM 1840 C ASN A 128 -5.787 7.185 8.404 1.00 3.34 C ATOM 1841 O ASN A 128 -6.722 6.635 7.838 1.00 55.44 O ATOM 1842 CB ASN A 128 -4.700 6.316 10.476 1.00 32.34 C ATOM 1843 CG ASN A 128 -4.151 5.042 11.102 1.00 52.43 C ATOM 1844 OD1 ASN A 128 -4.883 4.117 11.437 1.00 24.22 O ATOM 1845 ND2 ASN A 128 -2.853 4.942 11.311 1.00 43.13 N ATOM 0 H ASN A 128 -2.643 6.939 9.167 1.00 10.15 H new ATOM 0 HA ASN A 128 -4.722 5.319 8.572 1.00 10.14 H new ATOM 0 HB2 ASN A 128 -4.145 7.168 10.868 1.00 32.34 H new ATOM 0 HB3 ASN A 128 -5.738 6.442 10.785 1.00 32.34 H new ATOM 0 HD21 ASN A 128 -2.470 4.103 11.746 1.00 43.13 H new ATOM 0 HD22 ASN A 128 -2.232 5.704 11.037 1.00 43.13 H new ATOM 1851 N GLU A 129 -5.706 8.511 8.539 1.00 12.43 N ATOM 1852 CA GLU A 129 -6.736 9.460 8.116 1.00 1.55 C ATOM 1853 C GLU A 129 -7.173 9.290 6.658 1.00 61.23 C ATOM 1854 O GLU A 129 -8.318 9.599 6.324 1.00 51.30 O ATOM 1855 CB GLU A 129 -6.213 10.890 8.338 1.00 44.50 C ATOM 1856 CG GLU A 129 -6.783 11.538 9.605 1.00 1.13 C ATOM 1857 CD GLU A 129 -7.737 12.672 9.231 1.00 42.21 C ATOM 1858 OE1 GLU A 129 -8.916 12.394 8.930 1.00 41.11 O ATOM 1859 OE2 GLU A 129 -7.279 13.844 9.204 1.00 15.14 O ATOM 0 H GLU A 129 -4.896 8.967 8.959 1.00 12.43 H new ATOM 0 HA GLU A 129 -7.621 9.262 8.721 1.00 1.55 H new ATOM 0 HB2 GLU A 129 -5.125 10.869 8.404 1.00 44.50 H new ATOM 0 HB3 GLU A 129 -6.468 11.504 7.474 1.00 44.50 H new ATOM 0 HG2 GLU A 129 -7.309 10.791 10.200 1.00 1.13 H new ATOM 0 HG3 GLU A 129 -5.972 11.924 10.222 1.00 1.13 H new ATOM 1864 N TRP A 130 -6.294 8.777 5.800 1.00 11.14 N ATOM 1865 CA TRP A 130 -6.515 8.595 4.375 1.00 3.41 C ATOM 1866 C TRP A 130 -6.354 7.116 4.016 1.00 54.44 C ATOM 1867 O TRP A 130 -5.898 6.803 2.915 1.00 62.30 O ATOM 1868 CB TRP A 130 -5.571 9.522 3.597 1.00 21.41 C ATOM 1869 CG TRP A 130 -5.496 10.936 4.098 1.00 42.52 C ATOM 1870 CD1 TRP A 130 -4.368 11.555 4.510 1.00 3.43 C ATOM 1871 CD2 TRP A 130 -6.571 11.908 4.294 1.00 75.44 C ATOM 1872 NE1 TRP A 130 -4.661 12.826 4.950 1.00 11.43 N ATOM 1873 CE2 TRP A 130 -6.007 13.099 4.836 1.00 32.43 C ATOM 1874 CE3 TRP A 130 -7.967 11.897 4.096 1.00 2.42 C ATOM 1875 CZ2 TRP A 130 -6.785 14.218 5.157 1.00 53.24 C ATOM 1876 CZ3 TRP A 130 -8.755 13.028 4.384 1.00 63.03 C ATOM 1877 CH2 TRP A 130 -8.168 14.187 4.919 1.00 12.20 C ATOM 0 H TRP A 130 -5.369 8.465 6.096 1.00 11.14 H new ATOM 0 HA TRP A 130 -7.532 8.872 4.096 1.00 3.41 H new ATOM 0 HB2 TRP A 130 -4.569 9.093 3.619 1.00 21.41 H new ATOM 0 HB3 TRP A 130 -5.886 9.541 2.554 1.00 21.41 H new ATOM 0 HD1 TRP A 130 -3.381 11.117 4.496 1.00 3.43 H new ATOM 0 HE1 TRP A 130 -3.970 13.482 5.314 1.00 11.43 H new ATOM 0 HE3 TRP A 130 -8.441 11.004 3.716 1.00 2.42 H new ATOM 0 HZ2 TRP A 130 -6.325 15.097 5.584 1.00 53.24 H new ATOM 0 HZ3 TRP A 130 -9.818 13.004 4.192 1.00 63.03 H new ATOM 0 HH2 TRP A 130 -8.777 15.049 5.146 1.00 12.20 H new ATOM 1887 N ALA A 131 -6.672 6.210 4.947 1.00 20.43 N ATOM 1888 CA ALA A 131 -6.740 4.761 4.783 1.00 74.43 C ATOM 1889 C ALA A 131 -7.804 4.132 5.692 1.00 33.11 C ATOM 1890 O ALA A 131 -7.797 2.913 5.884 1.00 60.10 O ATOM 1891 CB ALA A 131 -5.371 4.145 5.051 1.00 13.24 C ATOM 0 H ALA A 131 -6.904 6.493 5.899 1.00 20.43 H new ATOM 0 HA ALA A 131 -7.033 4.552 3.754 1.00 74.43 H new ATOM 0 HB1 ALA A 131 -5.428 3.064 4.927 1.00 13.24 H new ATOM 0 HB2 ALA A 131 -4.645 4.553 4.348 1.00 13.24 H new ATOM 0 HB3 ALA A 131 -5.060 4.378 6.070 1.00 13.24 H new ATOM 1897 N ASP A 132 -8.696 4.937 6.275 1.00 11.41 N ATOM 1898 CA ASP A 132 -9.636 4.553 7.330 1.00 21.44 C ATOM 1899 C ASP A 132 -10.843 3.858 6.688 1.00 75.41 C ATOM 1900 O ASP A 132 -11.967 4.361 6.674 1.00 34.41 O ATOM 1901 CB ASP A 132 -10.037 5.795 8.143 1.00 42.33 C ATOM 1902 CG ASP A 132 -10.415 5.461 9.590 1.00 32.33 C ATOM 1903 OD1 ASP A 132 -11.584 5.147 9.904 1.00 64.32 O ATOM 1904 OD2 ASP A 132 -9.514 5.507 10.462 1.00 3.42 O ATOM 0 H ASP A 132 -8.786 5.918 6.012 1.00 11.41 H new ATOM 0 HA ASP A 132 -9.174 3.851 8.024 1.00 21.44 H new ATOM 0 HB2 ASP A 132 -9.211 6.506 8.143 1.00 42.33 H new ATOM 0 HB3 ASP A 132 -10.880 6.286 7.656 1.00 42.33 H new ATOM 1908 N GLY A 133 -10.580 2.741 6.020 1.00 64.20 N ATOM 1909 CA GLY A 133 -11.561 2.049 5.198 1.00 11.32 C ATOM 1910 C GLY A 133 -11.172 0.649 4.716 1.00 3.53 C ATOM 1911 O GLY A 133 -12.018 -0.022 4.123 1.00 21.04 O ATOM 0 H GLY A 133 -9.667 2.286 6.035 1.00 64.20 H new ATOM 0 HA2 GLY A 133 -12.489 1.971 5.765 1.00 11.32 H new ATOM 0 HA3 GLY A 133 -11.772 2.666 4.324 1.00 11.32 H new ATOM 1915 N LEU A 134 -9.935 0.187 4.930 1.00 74.10 N ATOM 1916 CA LEU A 134 -9.517 -1.188 4.638 1.00 31.41 C ATOM 1917 C LEU A 134 -8.714 -1.706 5.833 1.00 13.15 C ATOM 1918 O LEU A 134 -8.219 -0.912 6.637 1.00 43.30 O ATOM 1919 CB LEU A 134 -8.663 -1.275 3.351 1.00 55.20 C ATOM 1920 CG LEU A 134 -9.373 -1.288 1.979 1.00 53.41 C ATOM 1921 CD1 LEU A 134 -10.506 -2.315 1.889 1.00 23.11 C ATOM 1922 CD2 LEU A 134 -9.860 0.090 1.510 1.00 41.11 C ATOM 0 H LEU A 134 -9.188 0.764 5.315 1.00 74.10 H new ATOM 0 HA LEU A 134 -10.405 -1.797 4.472 1.00 31.41 H new ATOM 0 HB2 LEU A 134 -7.973 -0.431 3.356 1.00 55.20 H new ATOM 0 HB3 LEU A 134 -8.059 -2.180 3.417 1.00 55.20 H new ATOM 0 HG LEU A 134 -8.587 -1.598 1.290 1.00 53.41 H new ATOM 0 HD11 LEU A 134 -10.960 -2.270 0.899 1.00 23.11 H new ATOM 0 HD12 LEU A 134 -10.106 -3.314 2.059 1.00 23.11 H new ATOM 0 HD13 LEU A 134 -11.259 -2.093 2.645 1.00 23.11 H new ATOM 0 HD21 LEU A 134 -10.347 -0.007 0.540 1.00 41.11 H new ATOM 0 HD22 LEU A 134 -10.570 0.491 2.234 1.00 41.11 H new ATOM 0 HD23 LEU A 134 -9.010 0.766 1.423 1.00 41.11 H new ATOM 1933 N ASN A 135 -8.575 -3.031 5.948 1.00 12.15 N ATOM 1934 CA ASN A 135 -7.911 -3.696 7.068 1.00 2.55 C ATOM 1935 C ASN A 135 -6.395 -3.510 7.041 1.00 33.44 C ATOM 1936 O ASN A 135 -5.664 -4.332 6.484 1.00 43.12 O ATOM 1937 CB ASN A 135 -8.263 -5.182 7.088 1.00 2.12 C ATOM 1938 CG ASN A 135 -7.532 -5.926 8.197 1.00 54.54 C ATOM 1939 OD1 ASN A 135 -7.493 -5.478 9.338 1.00 43.11 O ATOM 1940 ND2 ASN A 135 -6.947 -7.063 7.873 1.00 51.40 N ATOM 0 H ASN A 135 -8.930 -3.683 5.248 1.00 12.15 H new ATOM 0 HA ASN A 135 -8.276 -3.226 7.981 1.00 2.55 H new ATOM 0 HB2 ASN A 135 -9.339 -5.298 7.221 1.00 2.12 H new ATOM 0 HB3 ASN A 135 -8.011 -5.627 6.125 1.00 2.12 H new ATOM 0 HD21 ASN A 135 -6.443 -7.597 8.581 1.00 51.40 H new ATOM 0 HD22 ASN A 135 -6.998 -7.408 6.914 1.00 51.40 H new ATOM 1946 N VAL A 136 -5.923 -2.436 7.667 1.00 13.25 N ATOM 1947 CA VAL A 136 -4.510 -2.216 7.947 1.00 4.23 C ATOM 1948 C VAL A 136 -4.032 -3.299 8.912 1.00 11.33 C ATOM 1949 O VAL A 136 -4.668 -3.521 9.947 1.00 70.31 O ATOM 1950 CB VAL A 136 -4.283 -0.802 8.519 1.00 62.00 C ATOM 1951 CG1 VAL A 136 -2.791 -0.493 8.716 1.00 52.54 C ATOM 1952 CG2 VAL A 136 -4.858 0.257 7.570 1.00 22.03 C ATOM 0 H VAL A 136 -6.523 -1.681 7.999 1.00 13.25 H new ATOM 0 HA VAL A 136 -3.931 -2.281 7.026 1.00 4.23 H new ATOM 0 HB VAL A 136 -4.787 -0.774 9.485 1.00 62.00 H new ATOM 0 HG11 VAL A 136 -2.678 0.513 9.120 1.00 52.54 H new ATOM 0 HG12 VAL A 136 -2.359 -1.214 9.410 1.00 52.54 H new ATOM 0 HG13 VAL A 136 -2.276 -0.559 7.757 1.00 52.54 H new ATOM 0 HG21 VAL A 136 -4.690 1.250 7.988 1.00 22.03 H new ATOM 0 HG22 VAL A 136 -4.365 0.183 6.601 1.00 22.03 H new ATOM 0 HG23 VAL A 136 -5.928 0.092 7.446 1.00 22.03 H new ATOM 1962 N ILE A 137 -2.922 -3.964 8.593 1.00 31.21 N ATOM 1963 CA ILE A 137 -2.260 -4.886 9.507 1.00 24.23 C ATOM 1964 C ILE A 137 -1.107 -4.202 10.252 1.00 42.40 C ATOM 1965 O ILE A 137 -0.883 -4.490 11.430 1.00 43.53 O ATOM 1966 CB ILE A 137 -1.857 -6.182 8.778 1.00 3.25 C ATOM 1967 CG1 ILE A 137 -0.832 -5.930 7.655 1.00 74.10 C ATOM 1968 CG2 ILE A 137 -3.126 -6.851 8.221 1.00 33.03 C ATOM 1969 CD1 ILE A 137 -0.319 -7.201 6.986 1.00 14.45 C ATOM 0 H ILE A 137 -2.457 -3.876 7.689 1.00 31.21 H new ATOM 0 HA ILE A 137 -2.965 -5.185 10.282 1.00 24.23 H new ATOM 0 HB ILE A 137 -1.369 -6.843 9.494 1.00 3.25 H new ATOM 0 HG12 ILE A 137 -1.288 -5.292 6.898 1.00 74.10 H new ATOM 0 HG13 ILE A 137 0.015 -5.381 8.067 1.00 74.10 H new ATOM 0 HG21 ILE A 137 -2.855 -7.770 7.702 1.00 33.03 H new ATOM 0 HG22 ILE A 137 -3.804 -7.084 9.042 1.00 33.03 H new ATOM 0 HG23 ILE A 137 -3.619 -6.173 7.524 1.00 33.03 H new ATOM 0 HD11 ILE A 137 0.397 -6.939 6.208 1.00 14.45 H new ATOM 0 HD12 ILE A 137 0.168 -7.832 7.729 1.00 14.45 H new ATOM 0 HD13 ILE A 137 -1.155 -7.742 6.542 1.00 14.45 H new ATOM 1980 N GLY A 138 -0.416 -3.253 9.619 1.00 2.33 N ATOM 1981 CA GLY A 138 0.740 -2.591 10.195 1.00 74.43 C ATOM 1982 C GLY A 138 1.329 -1.596 9.210 1.00 71.13 C ATOM 1983 O GLY A 138 1.119 -1.717 7.998 1.00 32.12 O ATOM 0 H GLY A 138 -0.651 -2.924 8.683 1.00 2.33 H new ATOM 0 HA2 GLY A 138 0.453 -2.077 11.112 1.00 74.43 H new ATOM 0 HA3 GLY A 138 1.492 -3.331 10.467 1.00 74.43 H new ATOM 1987 N VAL A 139 2.033 -0.594 9.737 1.00 22.12 N ATOM 1988 CA VAL A 139 2.605 0.498 8.966 1.00 4.13 C ATOM 1989 C VAL A 139 3.952 0.843 9.596 1.00 31.04 C ATOM 1990 O VAL A 139 4.040 1.613 10.558 1.00 12.34 O ATOM 1991 CB VAL A 139 1.636 1.699 8.920 1.00 45.24 C ATOM 1992 CG1 VAL A 139 2.131 2.832 8.008 1.00 61.02 C ATOM 1993 CG2 VAL A 139 0.232 1.292 8.451 1.00 71.43 C ATOM 0 H VAL A 139 2.223 -0.522 10.737 1.00 22.12 H new ATOM 0 HA VAL A 139 2.763 0.210 7.927 1.00 4.13 H new ATOM 0 HB VAL A 139 1.594 2.060 9.948 1.00 45.24 H new ATOM 0 HG11 VAL A 139 1.408 3.648 8.016 1.00 61.02 H new ATOM 0 HG12 VAL A 139 3.093 3.196 8.369 1.00 61.02 H new ATOM 0 HG13 VAL A 139 2.243 2.457 6.991 1.00 61.02 H new ATOM 0 HG21 VAL A 139 -0.415 2.169 8.435 1.00 71.43 H new ATOM 0 HG22 VAL A 139 0.292 0.867 7.449 1.00 71.43 H new ATOM 0 HG23 VAL A 139 -0.180 0.551 9.136 1.00 71.43 H new ATOM 2003 N ALA A 140 5.021 0.261 9.062 1.00 14.23 N ATOM 2004 CA ALA A 140 6.388 0.480 9.514 1.00 32.41 C ATOM 2005 C ALA A 140 7.231 0.902 8.321 1.00 61.03 C ATOM 2006 O ALA A 140 6.989 0.447 7.202 1.00 34.34 O ATOM 2007 CB ALA A 140 6.925 -0.789 10.181 1.00 52.52 C ATOM 0 H ALA A 140 4.957 -0.393 8.282 1.00 14.23 H new ATOM 0 HA ALA A 140 6.426 1.274 10.260 1.00 32.41 H new ATOM 0 HB1 ALA A 140 7.948 -0.619 10.517 1.00 52.52 H new ATOM 0 HB2 ALA A 140 6.300 -1.043 11.037 1.00 52.52 H new ATOM 0 HB3 ALA A 140 6.910 -1.611 9.465 1.00 52.52 H new ATOM 2013 N ARG A 141 8.204 1.789 8.541 1.00 2.43 N ATOM 2014 CA ARG A 141 9.174 2.096 7.500 1.00 5.22 C ATOM 2015 C ARG A 141 10.083 0.898 7.288 1.00 30.33 C ATOM 2016 O ARG A 141 10.266 0.096 8.212 1.00 23.12 O ATOM 2017 CB ARG A 141 10.008 3.329 7.869 1.00 73.12 C ATOM 2018 CG ARG A 141 9.154 4.603 7.928 1.00 21.14 C ATOM 2019 CD ARG A 141 9.422 5.377 9.219 1.00 22.12 C ATOM 2020 NE ARG A 141 10.768 5.973 9.230 1.00 45.14 N ATOM 2021 CZ ARG A 141 11.563 6.140 10.293 1.00 31.22 C ATOM 2022 NH1 ARG A 141 11.211 5.725 11.504 1.00 24.03 N ATOM 2023 NH2 ARG A 141 12.735 6.735 10.140 1.00 21.03 N ATOM 0 H ARG A 141 8.337 2.297 9.416 1.00 2.43 H new ATOM 0 HA ARG A 141 8.636 2.317 6.578 1.00 5.22 H new ATOM 0 HB2 ARG A 141 10.486 3.168 8.835 1.00 73.12 H new ATOM 0 HB3 ARG A 141 10.805 3.460 7.137 1.00 73.12 H new ATOM 0 HG2 ARG A 141 9.375 5.235 7.068 1.00 21.14 H new ATOM 0 HG3 ARG A 141 8.098 4.341 7.868 1.00 21.14 H new ATOM 0 HD2 ARG A 141 8.676 6.163 9.333 1.00 22.12 H new ATOM 0 HD3 ARG A 141 9.314 4.708 10.073 1.00 22.12 H new ATOM 0 HE ARG A 141 11.133 6.292 8.333 1.00 45.14 H new ATOM 0 HH11 ARG A 141 10.312 5.264 11.644 1.00 24.03 H new ATOM 0 HH12 ARG A 141 11.840 5.867 12.295 1.00 24.03 H new ATOM 0 HH21 ARG A 141 13.025 7.061 9.218 1.00 21.03 H new ATOM 0 HH22 ARG A 141 13.349 6.867 10.944 1.00 21.03 H new ATOM 2034 N ASP A 142 10.716 0.878 6.120 1.00 65.44 N ATOM 2035 CA ASP A 142 11.699 -0.112 5.696 1.00 50.14 C ATOM 2036 C ASP A 142 11.069 -1.512 5.663 1.00 32.45 C ATOM 2037 O ASP A 142 9.846 -1.653 5.668 1.00 45.52 O ATOM 2038 CB ASP A 142 12.991 -0.019 6.537 1.00 21.25 C ATOM 2039 CG ASP A 142 13.723 1.313 6.382 1.00 54.30 C ATOM 2040 OD1 ASP A 142 13.221 2.371 6.821 1.00 62.24 O ATOM 2041 OD2 ASP A 142 14.855 1.317 5.842 1.00 52.42 O ATOM 0 H ASP A 142 10.549 1.588 5.407 1.00 65.44 H new ATOM 0 HA ASP A 142 12.010 0.105 4.674 1.00 50.14 H new ATOM 0 HB2 ASP A 142 12.743 -0.168 7.588 1.00 21.25 H new ATOM 0 HB3 ASP A 142 13.662 -0.829 6.250 1.00 21.25 H new ATOM 2045 N ASP A 143 11.890 -2.557 5.562 1.00 14.31 N ATOM 2046 CA ASP A 143 11.480 -3.963 5.494 1.00 13.45 C ATOM 2047 C ASP A 143 11.378 -4.614 6.881 1.00 10.41 C ATOM 2048 O ASP A 143 11.098 -5.806 6.975 1.00 63.43 O ATOM 2049 CB ASP A 143 12.433 -4.744 4.574 1.00 73.01 C ATOM 2050 CG ASP A 143 13.833 -4.905 5.147 1.00 42.51 C ATOM 2051 OD1 ASP A 143 14.074 -5.900 5.866 1.00 45.23 O ATOM 2052 OD2 ASP A 143 14.715 -4.067 4.869 1.00 25.02 O ATOM 0 H ASP A 143 12.903 -2.444 5.524 1.00 14.31 H new ATOM 0 HA ASP A 143 10.476 -3.996 5.071 1.00 13.45 H new ATOM 0 HB2 ASP A 143 12.012 -5.731 4.382 1.00 73.01 H new ATOM 0 HB3 ASP A 143 12.499 -4.233 3.614 1.00 73.01 H new ATOM 2056 N SER A 144 11.588 -3.881 7.978 1.00 72.22 N ATOM 2057 CA SER A 144 11.780 -4.463 9.296 1.00 71.13 C ATOM 2058 C SER A 144 10.562 -5.220 9.860 1.00 24.23 C ATOM 2059 O SER A 144 10.763 -6.100 10.703 1.00 64.03 O ATOM 2060 CB SER A 144 12.264 -3.358 10.238 1.00 73.11 C ATOM 2061 OG SER A 144 13.569 -3.663 10.691 1.00 2.14 O ATOM 0 H SER A 144 11.629 -2.862 7.970 1.00 72.22 H new ATOM 0 HA SER A 144 12.532 -5.246 9.203 1.00 71.13 H new ATOM 0 HB2 SER A 144 12.262 -2.398 9.721 1.00 73.11 H new ATOM 0 HB3 SER A 144 11.585 -3.265 11.086 1.00 73.11 H new ATOM 0 HG SER A 144 13.880 -2.955 11.293 1.00 2.14 H new ATOM 2066 N GLU A 145 9.342 -4.996 9.364 1.00 43.50 N ATOM 2067 CA GLU A 145 8.127 -5.715 9.759 1.00 13.52 C ATOM 2068 C GLU A 145 7.527 -6.539 8.607 1.00 14.43 C ATOM 2069 O GLU A 145 6.453 -7.109 8.782 1.00 74.12 O ATOM 2070 CB GLU A 145 7.078 -4.771 10.389 1.00 2.54 C ATOM 2071 CG GLU A 145 7.548 -4.143 11.717 1.00 62.10 C ATOM 2072 CD GLU A 145 6.436 -3.446 12.524 1.00 64.32 C ATOM 2073 OE1 GLU A 145 5.264 -3.880 12.508 1.00 30.41 O ATOM 2074 OE2 GLU A 145 6.729 -2.486 13.279 1.00 51.11 O ATOM 0 H GLU A 145 9.167 -4.286 8.653 1.00 43.50 H new ATOM 0 HA GLU A 145 8.429 -6.427 10.527 1.00 13.52 H new ATOM 0 HB2 GLU A 145 6.842 -3.976 9.682 1.00 2.54 H new ATOM 0 HB3 GLU A 145 6.156 -5.326 10.563 1.00 2.54 H new ATOM 0 HG2 GLU A 145 7.994 -4.922 12.335 1.00 62.10 H new ATOM 0 HG3 GLU A 145 8.333 -3.418 11.503 1.00 62.10 H new ATOM 2079 N VAL A 146 8.182 -6.693 7.449 1.00 10.31 N ATOM 2080 CA VAL A 146 7.635 -7.585 6.422 1.00 54.43 C ATOM 2081 C VAL A 146 7.484 -9.029 6.943 1.00 41.31 C ATOM 2082 O VAL A 146 6.584 -9.752 6.523 1.00 72.33 O ATOM 2083 CB VAL A 146 8.417 -7.450 5.102 1.00 73.04 C ATOM 2084 CG1 VAL A 146 9.797 -8.112 5.091 1.00 4.54 C ATOM 2085 CG2 VAL A 146 7.589 -8.021 3.952 1.00 65.02 C ATOM 0 H VAL A 146 9.058 -6.231 7.206 1.00 10.31 H new ATOM 0 HA VAL A 146 6.618 -7.273 6.187 1.00 54.43 H new ATOM 0 HB VAL A 146 8.594 -6.381 4.986 1.00 73.04 H new ATOM 0 HG11 VAL A 146 10.265 -7.961 4.119 1.00 4.54 H new ATOM 0 HG12 VAL A 146 10.420 -7.667 5.867 1.00 4.54 H new ATOM 0 HG13 VAL A 146 9.690 -9.180 5.280 1.00 4.54 H new ATOM 0 HG21 VAL A 146 8.145 -7.924 3.020 1.00 65.02 H new ATOM 0 HG22 VAL A 146 7.380 -9.074 4.142 1.00 65.02 H new ATOM 0 HG23 VAL A 146 6.650 -7.473 3.873 1.00 65.02 H new ATOM 2095 N ASP A 147 8.274 -9.426 7.943 1.00 22.04 N ATOM 2096 CA ASP A 147 8.315 -10.780 8.503 1.00 70.20 C ATOM 2097 C ASP A 147 7.095 -11.135 9.365 1.00 71.13 C ATOM 2098 O ASP A 147 7.041 -12.205 9.968 1.00 72.30 O ATOM 2099 CB ASP A 147 9.553 -10.932 9.389 1.00 45.23 C ATOM 2100 CG ASP A 147 10.192 -12.306 9.276 1.00 34.41 C ATOM 2101 OD1 ASP A 147 11.084 -12.446 8.412 1.00 10.14 O ATOM 2102 OD2 ASP A 147 9.935 -13.172 10.143 1.00 25.41 O ATOM 0 H ASP A 147 8.927 -8.791 8.402 1.00 22.04 H new ATOM 0 HA ASP A 147 8.330 -11.451 7.644 1.00 70.20 H new ATOM 0 HB2 ASP A 147 10.285 -10.172 9.116 1.00 45.23 H new ATOM 0 HB3 ASP A 147 9.276 -10.749 10.427 1.00 45.23 H new ATOM 2106 N LYS A 148 6.138 -10.222 9.523 1.00 64.10 N ATOM 2107 CA LYS A 148 4.829 -10.505 10.107 1.00 31.11 C ATOM 2108 C LYS A 148 3.716 -10.372 9.080 1.00 61.44 C ATOM 2109 O LYS A 148 2.629 -10.893 9.323 1.00 23.42 O ATOM 2110 CB LYS A 148 4.579 -9.589 11.315 1.00 70.13 C ATOM 2111 CG LYS A 148 4.785 -8.109 11.011 1.00 22.01 C ATOM 2112 CD LYS A 148 4.232 -7.172 12.079 1.00 2.25 C ATOM 2113 CE LYS A 148 5.212 -7.118 13.249 1.00 51.12 C ATOM 2114 NZ LYS A 148 4.886 -6.012 14.161 1.00 34.44 N ATOM 0 H LYS A 148 6.253 -9.248 9.244 1.00 64.10 H new ATOM 0 HA LYS A 148 4.828 -11.540 10.448 1.00 31.11 H new ATOM 0 HB2 LYS A 148 3.560 -9.740 11.670 1.00 70.13 H new ATOM 0 HB3 LYS A 148 5.246 -9.881 12.126 1.00 70.13 H new ATOM 0 HG2 LYS A 148 5.852 -7.918 10.892 1.00 22.01 H new ATOM 0 HG3 LYS A 148 4.312 -7.875 10.057 1.00 22.01 H new ATOM 0 HD2 LYS A 148 4.085 -6.175 11.665 1.00 2.25 H new ATOM 0 HD3 LYS A 148 3.258 -7.523 12.420 1.00 2.25 H new ATOM 0 HE2 LYS A 148 5.186 -8.062 13.793 1.00 51.12 H new ATOM 0 HE3 LYS A 148 6.227 -6.995 12.872 1.00 51.12 H new ATOM 0 HZ1 LYS A 148 5.546 -6.019 14.965 1.00 34.44 H new ATOM 0 HZ2 LYS A 148 4.967 -5.108 13.653 1.00 34.44 H new ATOM 0 HZ3 LYS A 148 3.913 -6.126 14.511 1.00 34.44 H new ATOM 2124 N TRP A 149 3.953 -9.658 7.980 1.00 64.40 N ATOM 2125 CA TRP A 149 2.882 -9.234 7.091 1.00 42.42 C ATOM 2126 C TRP A 149 2.472 -10.284 6.052 1.00 33.45 C ATOM 2127 O TRP A 149 1.564 -10.002 5.280 1.00 43.51 O ATOM 2128 CB TRP A 149 3.269 -7.887 6.455 1.00 62.11 C ATOM 2129 CG TRP A 149 3.347 -6.710 7.394 1.00 41.53 C ATOM 2130 CD1 TRP A 149 2.690 -6.575 8.571 1.00 74.00 C ATOM 2131 CD2 TRP A 149 4.125 -5.484 7.246 1.00 3.51 C ATOM 2132 NE1 TRP A 149 3.057 -5.394 9.182 1.00 53.50 N ATOM 2133 CE2 TRP A 149 3.884 -4.647 8.375 1.00 25.45 C ATOM 2134 CE3 TRP A 149 5.027 -5.001 6.277 1.00 63.41 C ATOM 2135 CZ2 TRP A 149 4.462 -3.376 8.512 1.00 41.21 C ATOM 2136 CZ3 TRP A 149 5.653 -3.751 6.429 1.00 42.41 C ATOM 2137 CH2 TRP A 149 5.342 -2.921 7.518 1.00 44.41 C ATOM 0 H TRP A 149 4.884 -9.362 7.686 1.00 64.40 H new ATOM 0 HA TRP A 149 1.981 -9.108 7.692 1.00 42.42 H new ATOM 0 HB2 TRP A 149 4.237 -8.003 5.968 1.00 62.11 H new ATOM 0 HB3 TRP A 149 2.545 -7.656 5.674 1.00 62.11 H new ATOM 0 HD1 TRP A 149 1.983 -7.287 8.972 1.00 74.00 H new ATOM 0 HE1 TRP A 149 2.754 -5.110 10.114 1.00 53.50 H new ATOM 0 HE3 TRP A 149 5.241 -5.600 5.404 1.00 63.41 H new ATOM 0 HZ2 TRP A 149 4.234 -2.758 9.368 1.00 41.21 H new ATOM 0 HZ3 TRP A 149 6.381 -3.426 5.700 1.00 42.41 H new ATOM 0 HH2 TRP A 149 5.779 -1.936 7.590 1.00 44.41 H new ATOM 2147 N SER A 150 3.095 -11.468 6.001 1.00 43.22 N ATOM 2148 CA SER A 150 2.782 -12.503 5.017 1.00 62.34 C ATOM 2149 C SER A 150 2.968 -13.896 5.633 1.00 12.55 C ATOM 2150 O SER A 150 3.602 -14.783 5.053 1.00 73.22 O ATOM 2151 CB SER A 150 3.644 -12.267 3.763 1.00 33.11 C ATOM 2152 OG SER A 150 3.221 -13.047 2.655 1.00 75.12 O ATOM 0 H SER A 150 3.837 -11.733 6.649 1.00 43.22 H new ATOM 0 HA SER A 150 1.737 -12.449 4.713 1.00 62.34 H new ATOM 0 HB2 SER A 150 3.607 -11.211 3.495 1.00 33.11 H new ATOM 0 HB3 SER A 150 4.684 -12.501 3.992 1.00 33.11 H new ATOM 0 HG SER A 150 3.134 -13.984 2.929 1.00 75.12 H new ATOM 2157 N LYS A 151 2.428 -14.126 6.830 1.00 21.43 N ATOM 2158 CA LYS A 151 2.586 -15.392 7.538 1.00 24.13 C ATOM 2159 C LYS A 151 1.263 -16.106 7.544 1.00 3.55 C ATOM 2160 O LYS A 151 1.137 -17.095 6.779 1.00 45.50 O ATOM 2161 CB LYS A 151 3.135 -15.144 8.943 1.00 44.13 C ATOM 2162 CG LYS A 151 4.670 -15.145 8.904 1.00 11.55 C ATOM 2163 CD LYS A 151 5.274 -14.708 10.237 1.00 13.12 C ATOM 2164 CE LYS A 151 4.823 -15.606 11.387 1.00 5.55 C ATOM 2165 NZ LYS A 151 5.289 -15.122 12.699 1.00 74.33 N ATOM 0 H LYS A 151 1.869 -13.438 7.335 1.00 21.43 H new ATOM 0 HA LYS A 151 3.311 -16.031 7.034 1.00 24.13 H new ATOM 0 HB2 LYS A 151 2.771 -14.189 9.323 1.00 44.13 H new ATOM 0 HB3 LYS A 151 2.778 -15.915 9.625 1.00 44.13 H new ATOM 0 HG2 LYS A 151 5.026 -16.144 8.654 1.00 11.55 H new ATOM 0 HG3 LYS A 151 5.013 -14.478 8.114 1.00 11.55 H new ATOM 0 HD2 LYS A 151 6.362 -14.727 10.167 1.00 13.12 H new ATOM 0 HD3 LYS A 151 4.986 -13.678 10.446 1.00 13.12 H new ATOM 0 HE2 LYS A 151 3.735 -15.666 11.391 1.00 5.55 H new ATOM 0 HE3 LYS A 151 5.197 -16.616 11.223 1.00 5.55 H new ATOM 0 HZ1 LYS A 151 4.956 -15.766 13.445 1.00 74.33 H new ATOM 0 HZ2 LYS A 151 6.328 -15.089 12.708 1.00 74.33 H new ATOM 0 HZ3 LYS A 151 4.911 -14.168 12.871 1.00 74.33 H new