USER MOD reduce.3.24.130724 H: found=0, std=0, add=1118, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1119 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 19 ASN : amide:sc= -0.0773 X(o=-0.0069,f=-0.019!) USER MOD Set 1.2: A 149 TYR OH : rot 38:sc= 0.0704 USER MOD Set 2.1: A 76 LYS NZ :NH3+ -114:sc= 0.429 (180deg=0) USER MOD Set 2.2: A 108 TYR OH : rot 180:sc= 0.404 USER MOD Set 3.1: A 59 GLN : amide:sc= 0.00189 K(o=-2.4,f=-0.86) USER MOD Set 3.2: A 143 GLN : amide:sc= -2.41! K(o=-2.4!,f=-0.86) USER MOD Set 4.1: A 46 ASN : amide:sc= -1.13! X(o=-0.4!,f=0.049) USER MOD Set 4.2: A 97 SER OG : rot 87:sc= 0.734 USER MOD Set 5.1: A 40 THR OG1 : rot -91:sc= 1.36 USER MOD Set 5.2: A 41 GLN : amide:sc= -0.557 X(o=0.8,f=0.32) USER MOD Set 6.1: A 5 THR OG1 : rot -144:sc= 0.841 USER MOD Set 6.2: A 7 ASN : amide:sc= -0.589 K(o=0.25,f=3.3) USER MOD Set 6.3: A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ -173:sc= 0.622 (180deg=0.203) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= -0.934 K(o=-0.93,f=-1.5) USER MOD Single : A 29 ASN : amide:sc= -0.793 X(o=-0.79,f=-1.2) USER MOD Single : A 32 GLN : amide:sc= -0.534 X(o=-0.53,f=-0.79) USER MOD Single : A 33 ASN : amide:sc= -1.27! K(o=-1.3!,f=-0.06) USER MOD Single : A 39 SER OG : rot 180:sc= -0.757 USER MOD Single : A 45 HIS : no HE2:sc= -0.981 K(o=-0.98,f=-4.2!) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.0264 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0.759 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc=-0.000188 USER MOD Single : A 70 ASN : amide:sc= 0 X(o=0,f=-0.099) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot -21:sc= -0.573 USER MOD Single : A 78 SER OG : rot -130:sc= -0.588 USER MOD Single : A 80 SER OG : rot -107:sc= 0.0427 USER MOD Single : A 81 SER OG : rot 43:sc= 0.0779 USER MOD Single : A 82 TYR OH : rot 134:sc= -2.39! USER MOD Single : A 86 THR OG1 : rot 180:sc= 0.184 USER MOD Single : A 87 THR OG1 : rot 180:sc=0.000594 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 149:sc= 0.634 USER MOD Single : A 95 TYR OH : rot -133:sc= -1.32! USER MOD Single : A 96 ASN : amide:sc= -2.01! K(o=-2!,f=-0.065) USER MOD Single : A 99 THR OG1 : rot 180:sc= -0.0383 USER MOD Single : A 101 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0762) USER MOD Single : A 110 THR OG1 : rot -141:sc= 0.116 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot -44:sc= 0.536 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot -160:sc= 0 USER MOD Single : A 133 GLN : amide:sc= -0.661 K(o=-0.66,f=-0.068) USER MOD Single : A 134 THR OG1 : rot 180:sc= -0.0783 USER MOD Single : A 135 ASN : amide:sc= -0.103 X(o=-0.1,f=-0.21) USER MOD Single : A 147 ASN : amide:sc= 0.234 K(o=0.23,f=-0.81) USER MOD Single : A 151 ASN : amide:sc= -0.363 K(o=-0.36,f=0.15) USER MOD Single : A 152 ASN : amide:sc= -0.474 X(o=-0.47,f=-0.052) USER MOD Single : A 158 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 23 N ALA A 2 14.031 4.343 0.296 1.00 0.00 N ATOM 24 CA ALA A 2 13.160 5.283 0.918 1.00 0.00 C ATOM 25 C ALA A 2 12.014 5.452 0.032 1.00 0.00 C ATOM 26 O ALA A 2 12.169 5.453 -1.191 1.00 0.00 O ATOM 27 CB ALA A 2 13.797 6.582 1.248 1.00 0.00 C ATOM 0 HA ALA A 2 12.859 4.891 1.890 1.00 0.00 H new ATOM 0 HB1 ALA A 2 13.064 7.238 1.718 1.00 0.00 H new ATOM 0 HB2 ALA A 2 14.628 6.416 1.934 1.00 0.00 H new ATOM 0 HB3 ALA A 2 14.168 7.048 0.335 1.00 0.00 H new ATOM 33 N CYS A 3 10.885 5.558 0.581 1.00 0.00 N ATOM 34 CA CYS A 3 9.733 5.551 -0.219 1.00 0.00 C ATOM 35 C CYS A 3 8.906 6.786 0.088 1.00 0.00 C ATOM 36 O CYS A 3 9.100 7.420 1.119 1.00 0.00 O ATOM 37 CB CYS A 3 8.962 4.259 0.022 1.00 0.00 C ATOM 38 SG CYS A 3 9.964 2.695 0.056 1.00 0.00 S ATOM 0 H CYS A 3 10.725 5.651 1.584 1.00 0.00 H new ATOM 0 HA CYS A 3 9.994 5.584 -1.277 1.00 0.00 H new ATOM 0 HB2 CYS A 3 8.434 4.348 0.972 1.00 0.00 H new ATOM 0 HB3 CYS A 3 8.204 4.163 -0.756 1.00 0.00 H new ATOM 43 N LYS A 4 7.993 7.122 -0.779 1.00 0.00 N ATOM 44 CA LYS A 4 7.233 8.341 -0.643 1.00 0.00 C ATOM 45 C LYS A 4 5.818 8.148 -1.165 1.00 0.00 C ATOM 46 O LYS A 4 5.548 7.229 -1.932 1.00 0.00 O ATOM 47 CB LYS A 4 7.971 9.493 -1.372 1.00 0.00 C ATOM 48 CG LYS A 4 8.126 9.353 -2.865 1.00 0.00 C ATOM 49 CD LYS A 4 7.011 10.018 -3.607 1.00 0.00 C ATOM 50 CE LYS A 4 7.284 9.990 -5.076 1.00 0.00 C ATOM 51 NZ LYS A 4 8.521 10.715 -5.444 1.00 0.00 N ATOM 0 H LYS A 4 7.752 6.564 -1.598 1.00 0.00 H new ATOM 0 HA LYS A 4 7.149 8.606 0.411 1.00 0.00 H new ATOM 0 HB2 LYS A 4 7.438 10.422 -1.170 1.00 0.00 H new ATOM 0 HB3 LYS A 4 8.964 9.594 -0.934 1.00 0.00 H new ATOM 0 HG2 LYS A 4 9.077 9.787 -3.173 1.00 0.00 H new ATOM 0 HG3 LYS A 4 8.158 8.296 -3.129 1.00 0.00 H new ATOM 0 HD2 LYS A 4 6.069 9.512 -3.394 1.00 0.00 H new ATOM 0 HD3 LYS A 4 6.902 11.049 -3.269 1.00 0.00 H new ATOM 0 HE2 LYS A 4 7.364 8.954 -5.406 1.00 0.00 H new ATOM 0 HE3 LYS A 4 6.439 10.430 -5.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 8.599 10.765 -6.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 8.489 11.678 -5.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 9.346 10.212 -5.059 1.00 0.00 H new ATOM 65 N THR A 5 4.932 8.993 -0.734 1.00 0.00 N ATOM 66 CA THR A 5 3.551 8.912 -1.142 1.00 0.00 C ATOM 67 C THR A 5 3.251 9.900 -2.239 1.00 0.00 C ATOM 68 O THR A 5 4.079 10.733 -2.589 1.00 0.00 O ATOM 69 CB THR A 5 2.603 9.230 0.012 1.00 0.00 C ATOM 70 OG1 THR A 5 2.859 10.546 0.517 1.00 0.00 O ATOM 71 CG2 THR A 5 2.729 8.240 1.117 1.00 0.00 C ATOM 0 H THR A 5 5.138 9.758 -0.092 1.00 0.00 H new ATOM 0 HA THR A 5 3.398 7.889 -1.487 1.00 0.00 H new ATOM 0 HB THR A 5 1.586 9.178 -0.378 1.00 0.00 H new ATOM 0 HG1 THR A 5 2.731 10.554 1.489 1.00 0.00 H new ATOM 0 HG21 THR A 5 2.039 8.500 1.919 1.00 0.00 H new ATOM 0 HG22 THR A 5 2.491 7.244 0.742 1.00 0.00 H new ATOM 0 HG23 THR A 5 3.750 8.249 1.499 1.00 0.00 H new ATOM 79 N ALA A 6 2.032 9.832 -2.720 1.00 0.00 N ATOM 80 CA ALA A 6 1.538 10.721 -3.751 1.00 0.00 C ATOM 81 C ALA A 6 1.152 12.056 -3.149 1.00 0.00 C ATOM 82 O ALA A 6 0.875 13.024 -3.861 1.00 0.00 O ATOM 83 CB ALA A 6 0.344 10.099 -4.444 1.00 0.00 C ATOM 0 H ALA A 6 1.344 9.149 -2.403 1.00 0.00 H new ATOM 0 HA ALA A 6 2.328 10.882 -4.484 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -0.020 10.775 -5.218 1.00 0.00 H new ATOM 0 HB2 ALA A 6 0.639 9.153 -4.898 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -0.447 9.921 -3.716 1.00 0.00 H new ATOM 89 N ASN A 7 1.067 12.106 -1.832 1.00 0.00 N ATOM 90 CA ASN A 7 0.795 13.364 -1.198 1.00 0.00 C ATOM 91 C ASN A 7 2.092 14.082 -0.902 1.00 0.00 C ATOM 92 O ASN A 7 2.137 15.309 -0.916 1.00 0.00 O ATOM 93 CB ASN A 7 -0.110 13.267 0.050 1.00 0.00 C ATOM 94 CG ASN A 7 0.560 12.738 1.293 1.00 0.00 C ATOM 95 OD1 ASN A 7 1.175 13.483 2.036 1.00 0.00 O ATOM 96 ND2 ASN A 7 0.412 11.474 1.555 1.00 0.00 N ATOM 0 H ASN A 7 1.180 11.310 -1.204 1.00 0.00 H new ATOM 0 HA ASN A 7 0.212 13.951 -1.908 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -0.510 14.258 0.266 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -0.959 12.625 -0.186 1.00 0.00 H new ATOM 0 HD21 ASN A 7 0.816 11.078 2.404 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -0.109 10.877 0.912 1.00 0.00 H new ATOM 103 N GLY A 8 3.150 13.325 -0.637 1.00 0.00 N ATOM 104 CA GLY A 8 4.434 13.949 -0.447 1.00 0.00 C ATOM 105 C GLY A 8 5.171 13.461 0.773 1.00 0.00 C ATOM 106 O GLY A 8 6.242 13.975 1.096 1.00 0.00 O ATOM 0 H GLY A 8 3.139 12.309 -0.552 1.00 0.00 H new ATOM 0 HA2 GLY A 8 5.049 13.769 -1.328 1.00 0.00 H new ATOM 0 HA3 GLY A 8 4.296 15.027 -0.370 1.00 0.00 H new ATOM 110 N THR A 9 4.633 12.471 1.440 1.00 0.00 N ATOM 111 CA THR A 9 5.265 11.949 2.616 1.00 0.00 C ATOM 112 C THR A 9 6.396 11.026 2.210 1.00 0.00 C ATOM 113 O THR A 9 6.168 9.886 1.805 1.00 0.00 O ATOM 114 CB THR A 9 4.265 11.170 3.486 1.00 0.00 C ATOM 115 OG1 THR A 9 3.031 11.900 3.560 1.00 0.00 O ATOM 116 CG2 THR A 9 4.827 11.002 4.892 1.00 0.00 C ATOM 0 H THR A 9 3.758 12.013 1.185 1.00 0.00 H new ATOM 0 HA THR A 9 5.649 12.787 3.198 1.00 0.00 H new ATOM 0 HB THR A 9 4.092 10.189 3.043 1.00 0.00 H new ATOM 0 HG1 THR A 9 2.391 11.405 4.113 1.00 0.00 H new ATOM 0 HG21 THR A 9 4.115 10.449 5.505 1.00 0.00 H new ATOM 0 HG22 THR A 9 5.768 10.453 4.845 1.00 0.00 H new ATOM 0 HG23 THR A 9 5.001 11.983 5.334 1.00 0.00 H new ATOM 124 N ALA A 10 7.587 11.544 2.252 1.00 0.00 N ATOM 125 CA ALA A 10 8.755 10.773 1.971 1.00 0.00 C ATOM 126 C ALA A 10 9.287 10.216 3.269 1.00 0.00 C ATOM 127 O ALA A 10 9.628 10.979 4.181 1.00 0.00 O ATOM 128 CB ALA A 10 9.813 11.630 1.289 1.00 0.00 C ATOM 0 H ALA A 10 7.774 12.520 2.484 1.00 0.00 H new ATOM 0 HA ALA A 10 8.500 9.957 1.294 1.00 0.00 H new ATOM 0 HB1 ALA A 10 10.695 11.024 1.083 1.00 0.00 H new ATOM 0 HB2 ALA A 10 9.416 12.022 0.353 1.00 0.00 H new ATOM 0 HB3 ALA A 10 10.086 12.459 1.942 1.00 0.00 H new ATOM 134 N ILE A 11 9.313 8.923 3.372 1.00 0.00 N ATOM 135 CA ILE A 11 9.813 8.252 4.557 1.00 0.00 C ATOM 136 C ILE A 11 11.285 7.933 4.346 1.00 0.00 C ATOM 137 O ILE A 11 11.634 7.276 3.365 1.00 0.00 O ATOM 138 CB ILE A 11 9.063 6.920 4.830 1.00 0.00 C ATOM 139 CG1 ILE A 11 7.562 7.150 4.987 1.00 0.00 C ATOM 140 CG2 ILE A 11 9.616 6.233 6.087 1.00 0.00 C ATOM 141 CD1 ILE A 11 6.799 5.862 5.145 1.00 0.00 C ATOM 0 H ILE A 11 8.989 8.291 2.640 1.00 0.00 H new ATOM 0 HA ILE A 11 9.660 8.914 5.410 1.00 0.00 H new ATOM 0 HB ILE A 11 9.225 6.272 3.969 1.00 0.00 H new ATOM 0 HG12 ILE A 11 7.383 7.784 5.855 1.00 0.00 H new ATOM 0 HG13 ILE A 11 7.186 7.688 4.116 1.00 0.00 H new ATOM 0 HG21 ILE A 11 9.076 5.302 6.260 1.00 0.00 H new ATOM 0 HG22 ILE A 11 10.676 6.018 5.948 1.00 0.00 H new ATOM 0 HG23 ILE A 11 9.489 6.891 6.947 1.00 0.00 H new ATOM 0 HD11 ILE A 11 5.736 6.079 5.253 1.00 0.00 H new ATOM 0 HD12 ILE A 11 6.954 5.237 4.265 1.00 0.00 H new ATOM 0 HD13 ILE A 11 7.154 5.335 6.031 1.00 0.00 H new ATOM 153 N PRO A 12 12.158 8.406 5.241 1.00 0.00 N ATOM 154 CA PRO A 12 13.596 8.154 5.156 1.00 0.00 C ATOM 155 C PRO A 12 13.948 6.742 5.636 1.00 0.00 C ATOM 156 O PRO A 12 13.120 6.040 6.251 1.00 0.00 O ATOM 157 CB PRO A 12 14.164 9.191 6.121 1.00 0.00 C ATOM 158 CG PRO A 12 13.117 9.322 7.161 1.00 0.00 C ATOM 159 CD PRO A 12 11.814 9.216 6.428 1.00 0.00 C ATOM 0 HA PRO A 12 13.982 8.225 4.139 1.00 0.00 H new ATOM 0 HB2 PRO A 12 15.112 8.863 6.548 1.00 0.00 H new ATOM 0 HB3 PRO A 12 14.352 10.141 5.621 1.00 0.00 H new ATOM 0 HG2 PRO A 12 13.210 8.538 7.913 1.00 0.00 H new ATOM 0 HG3 PRO A 12 13.198 10.276 7.683 1.00 0.00 H new ATOM 0 HD2 PRO A 12 11.048 8.734 7.036 1.00 0.00 H new ATOM 0 HD3 PRO A 12 11.429 10.196 6.148 1.00 0.00 H new ATOM 167 N ILE A 13 15.169 6.332 5.360 1.00 0.00 N ATOM 168 CA ILE A 13 15.634 5.025 5.749 1.00 0.00 C ATOM 169 C ILE A 13 15.793 4.969 7.257 1.00 0.00 C ATOM 170 O ILE A 13 16.535 5.758 7.850 1.00 0.00 O ATOM 171 CB ILE A 13 16.979 4.659 5.078 1.00 0.00 C ATOM 172 CG1 ILE A 13 16.860 4.795 3.556 1.00 0.00 C ATOM 173 CG2 ILE A 13 17.374 3.224 5.456 1.00 0.00 C ATOM 174 CD1 ILE A 13 18.152 4.561 2.812 1.00 0.00 C ATOM 0 H ILE A 13 15.860 6.894 4.863 1.00 0.00 H new ATOM 0 HA ILE A 13 14.890 4.301 5.418 1.00 0.00 H new ATOM 0 HB ILE A 13 17.752 5.342 5.429 1.00 0.00 H new ATOM 0 HG12 ILE A 13 16.113 4.087 3.196 1.00 0.00 H new ATOM 0 HG13 ILE A 13 16.493 5.794 3.319 1.00 0.00 H new ATOM 0 HG21 ILE A 13 18.322 2.970 4.981 1.00 0.00 H new ATOM 0 HG22 ILE A 13 17.479 3.149 6.538 1.00 0.00 H new ATOM 0 HG23 ILE A 13 16.602 2.533 5.117 1.00 0.00 H new ATOM 0 HD11 ILE A 13 17.981 4.676 1.742 1.00 0.00 H new ATOM 0 HD12 ILE A 13 18.897 5.285 3.141 1.00 0.00 H new ATOM 0 HD13 ILE A 13 18.512 3.552 3.016 1.00 0.00 H new ATOM 186 N GLY A 14 15.079 4.069 7.862 1.00 0.00 N ATOM 187 CA GLY A 14 15.138 3.915 9.294 1.00 0.00 C ATOM 188 C GLY A 14 13.784 3.645 9.907 1.00 0.00 C ATOM 189 O GLY A 14 13.605 3.807 11.116 1.00 0.00 O ATOM 0 H GLY A 14 14.445 3.425 7.389 1.00 0.00 H new ATOM 0 HA2 GLY A 14 15.814 3.096 9.540 1.00 0.00 H new ATOM 0 HA3 GLY A 14 15.559 4.818 9.736 1.00 0.00 H new ATOM 193 N GLY A 15 12.843 3.183 9.092 1.00 0.00 N ATOM 194 CA GLY A 15 11.488 2.949 9.567 1.00 0.00 C ATOM 195 C GLY A 15 10.662 4.221 9.532 1.00 0.00 C ATOM 196 O GLY A 15 11.223 5.322 9.499 1.00 0.00 O ATOM 0 H GLY A 15 12.993 2.965 8.107 1.00 0.00 H new ATOM 0 HA2 GLY A 15 11.011 2.187 8.951 1.00 0.00 H new ATOM 0 HA3 GLY A 15 11.520 2.562 10.585 1.00 0.00 H new ATOM 200 N GLY A 16 9.357 4.092 9.516 1.00 0.00 N ATOM 201 CA GLY A 16 8.524 5.261 9.516 1.00 0.00 C ATOM 202 C GLY A 16 7.123 4.935 9.110 1.00 0.00 C ATOM 203 O GLY A 16 6.802 3.761 8.888 1.00 0.00 O ATOM 0 H GLY A 16 8.859 3.202 9.503 1.00 0.00 H new ATOM 0 HA2 GLY A 16 8.521 5.707 10.511 1.00 0.00 H new ATOM 0 HA3 GLY A 16 8.938 6.004 8.834 1.00 0.00 H new ATOM 207 N SER A 17 6.302 5.936 8.993 1.00 0.00 N ATOM 208 CA SER A 17 4.931 5.759 8.631 1.00 0.00 C ATOM 209 C SER A 17 4.454 6.937 7.792 1.00 0.00 C ATOM 210 O SER A 17 4.935 8.066 7.959 1.00 0.00 O ATOM 211 CB SER A 17 4.073 5.575 9.894 1.00 0.00 C ATOM 212 OG SER A 17 4.275 6.633 10.825 1.00 0.00 O ATOM 0 H SER A 17 6.570 6.908 9.148 1.00 0.00 H new ATOM 0 HA SER A 17 4.829 4.859 8.025 1.00 0.00 H new ATOM 0 HB2 SER A 17 3.020 5.531 9.616 1.00 0.00 H new ATOM 0 HB3 SER A 17 4.318 4.623 10.365 1.00 0.00 H new ATOM 0 HG SER A 17 3.714 6.486 11.615 1.00 0.00 H new ATOM 218 N ALA A 18 3.552 6.681 6.880 1.00 0.00 N ATOM 219 CA ALA A 18 3.012 7.702 6.036 1.00 0.00 C ATOM 220 C ALA A 18 1.534 7.535 5.966 1.00 0.00 C ATOM 221 O ALA A 18 1.000 6.458 6.307 1.00 0.00 O ATOM 222 CB ALA A 18 3.595 7.607 4.638 1.00 0.00 C ATOM 0 H ALA A 18 3.172 5.751 6.705 1.00 0.00 H new ATOM 0 HA ALA A 18 3.266 8.677 6.451 1.00 0.00 H new ATOM 0 HB1 ALA A 18 3.171 8.393 4.013 1.00 0.00 H new ATOM 0 HB2 ALA A 18 4.677 7.726 4.686 1.00 0.00 H new ATOM 0 HB3 ALA A 18 3.356 6.634 4.210 1.00 0.00 H new ATOM 228 N ASN A 19 0.868 8.566 5.564 1.00 0.00 N ATOM 229 CA ASN A 19 -0.555 8.520 5.385 1.00 0.00 C ATOM 230 C ASN A 19 -0.803 8.671 3.921 1.00 0.00 C ATOM 231 O ASN A 19 -0.523 9.703 3.347 1.00 0.00 O ATOM 232 CB ASN A 19 -1.262 9.645 6.158 1.00 0.00 C ATOM 233 CG ASN A 19 -0.908 9.674 7.634 1.00 0.00 C ATOM 234 OD1 ASN A 19 -1.563 9.045 8.473 1.00 0.00 O ATOM 235 ND2 ASN A 19 0.128 10.382 7.956 1.00 0.00 N ATOM 0 H ASN A 19 1.291 9.469 5.348 1.00 0.00 H new ATOM 0 HA ASN A 19 -0.952 7.580 5.769 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -1.001 10.604 5.710 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -2.340 9.527 6.052 1.00 0.00 H new ATOM 0 HD21 ASN A 19 0.428 10.434 8.930 1.00 0.00 H new ATOM 0 HD22 ASN A 19 0.644 10.888 7.236 1.00 0.00 H new ATOM 242 N VAL A 20 -1.230 7.628 3.317 1.00 0.00 N ATOM 243 CA VAL A 20 -1.487 7.593 1.886 1.00 0.00 C ATOM 244 C VAL A 20 -2.960 7.896 1.636 1.00 0.00 C ATOM 245 O VAL A 20 -3.805 7.362 2.310 1.00 0.00 O ATOM 246 CB VAL A 20 -1.166 6.200 1.309 1.00 0.00 C ATOM 247 CG1 VAL A 20 -1.321 6.208 -0.192 1.00 0.00 C ATOM 248 CG2 VAL A 20 0.228 5.773 1.714 1.00 0.00 C ATOM 0 H VAL A 20 -1.422 6.746 3.791 1.00 0.00 H new ATOM 0 HA VAL A 20 -0.853 8.335 1.400 1.00 0.00 H new ATOM 0 HB VAL A 20 -1.871 5.476 1.717 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -1.091 5.218 -0.587 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -2.346 6.473 -0.451 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -0.637 6.939 -0.624 1.00 0.00 H new ATOM 0 HG21 VAL A 20 0.441 4.788 1.300 1.00 0.00 H new ATOM 0 HG22 VAL A 20 0.954 6.492 1.333 1.00 0.00 H new ATOM 0 HG23 VAL A 20 0.294 5.732 2.801 1.00 0.00 H new ATOM 258 N TYR A 21 -3.255 8.743 0.684 1.00 0.00 N ATOM 259 CA TYR A 21 -4.634 9.120 0.391 1.00 0.00 C ATOM 260 C TYR A 21 -5.030 8.684 -0.999 1.00 0.00 C ATOM 261 O TYR A 21 -4.422 9.103 -1.981 1.00 0.00 O ATOM 262 CB TYR A 21 -4.806 10.621 0.550 1.00 0.00 C ATOM 263 CG TYR A 21 -4.720 11.080 1.989 1.00 0.00 C ATOM 264 CD1 TYR A 21 -3.495 11.291 2.601 1.00 0.00 C ATOM 265 CD2 TYR A 21 -5.874 11.282 2.735 1.00 0.00 C ATOM 266 CE1 TYR A 21 -3.419 11.697 3.919 1.00 0.00 C ATOM 267 CE2 TYR A 21 -5.812 11.691 4.055 1.00 0.00 C ATOM 268 CZ TYR A 21 -4.576 11.898 4.643 1.00 0.00 C ATOM 269 OH TYR A 21 -4.493 12.308 5.966 1.00 0.00 O ATOM 0 H TYR A 21 -2.560 9.194 0.088 1.00 0.00 H new ATOM 0 HA TYR A 21 -5.289 8.613 1.099 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -4.041 11.132 -0.034 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -5.771 10.916 0.138 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -2.586 11.136 2.039 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -6.838 11.117 2.276 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -2.456 11.857 4.382 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -6.718 11.847 4.621 1.00 0.00 H new ATOM 0 HH TYR A 21 -5.395 12.406 6.335 1.00 0.00 H new ATOM 279 N VAL A 22 -6.046 7.851 -1.093 1.00 0.00 N ATOM 280 CA VAL A 22 -6.447 7.305 -2.375 1.00 0.00 C ATOM 281 C VAL A 22 -7.909 7.624 -2.673 1.00 0.00 C ATOM 282 O VAL A 22 -8.796 7.406 -1.830 1.00 0.00 O ATOM 283 CB VAL A 22 -6.264 5.783 -2.407 1.00 0.00 C ATOM 284 CG1 VAL A 22 -6.455 5.213 -3.809 1.00 0.00 C ATOM 285 CG2 VAL A 22 -4.944 5.375 -1.792 1.00 0.00 C ATOM 0 H VAL A 22 -6.608 7.538 -0.301 1.00 0.00 H new ATOM 0 HA VAL A 22 -5.811 7.766 -3.131 1.00 0.00 H new ATOM 0 HB VAL A 22 -7.050 5.346 -1.792 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -6.316 4.132 -3.784 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -7.461 5.442 -4.161 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -5.724 5.657 -4.485 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -4.845 4.290 -1.830 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -4.126 5.834 -2.348 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -4.908 5.706 -0.754 1.00 0.00 H new ATOM 295 N ASN A 23 -8.147 8.180 -3.830 1.00 0.00 N ATOM 296 CA ASN A 23 -9.493 8.492 -4.284 1.00 0.00 C ATOM 297 C ASN A 23 -10.108 7.258 -4.859 1.00 0.00 C ATOM 298 O ASN A 23 -9.548 6.623 -5.746 1.00 0.00 O ATOM 299 CB ASN A 23 -9.524 9.606 -5.344 1.00 0.00 C ATOM 300 CG ASN A 23 -9.162 10.985 -4.840 1.00 0.00 C ATOM 301 OD1 ASN A 23 -10.015 11.756 -4.396 1.00 0.00 O ATOM 302 ND2 ASN A 23 -7.915 11.304 -4.910 1.00 0.00 N ATOM 0 H ASN A 23 -7.416 8.434 -4.494 1.00 0.00 H new ATOM 0 HA ASN A 23 -10.053 8.851 -3.420 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -8.839 9.339 -6.148 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -10.524 9.646 -5.777 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -7.605 12.222 -4.592 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -7.239 10.638 -5.284 1.00 0.00 H new ATOM 309 N LEU A 24 -11.224 6.908 -4.340 1.00 0.00 N ATOM 310 CA LEU A 24 -11.932 5.743 -4.762 1.00 0.00 C ATOM 311 C LEU A 24 -13.225 6.159 -5.366 1.00 0.00 C ATOM 312 O LEU A 24 -13.723 7.234 -5.055 1.00 0.00 O ATOM 313 CB LEU A 24 -12.137 4.873 -3.554 1.00 0.00 C ATOM 314 CG LEU A 24 -10.833 4.390 -2.973 1.00 0.00 C ATOM 315 CD1 LEU A 24 -11.006 3.895 -1.581 1.00 0.00 C ATOM 316 CD2 LEU A 24 -10.212 3.330 -3.855 1.00 0.00 C ATOM 0 H LEU A 24 -11.687 7.428 -3.595 1.00 0.00 H new ATOM 0 HA LEU A 24 -11.378 5.182 -5.515 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -12.686 5.431 -2.796 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -12.752 4.015 -3.826 1.00 0.00 H new ATOM 0 HG LEU A 24 -10.152 5.240 -2.934 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -10.046 3.555 -1.194 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -11.386 4.701 -0.953 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -11.714 3.066 -1.575 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -9.272 2.996 -3.416 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -10.893 2.483 -3.941 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -10.023 3.745 -4.845 1.00 0.00 H new ATOM 328 N ALA A 25 -13.738 5.328 -6.245 1.00 0.00 N ATOM 329 CA ALA A 25 -14.986 5.588 -6.953 1.00 0.00 C ATOM 330 C ALA A 25 -16.114 5.792 -5.963 1.00 0.00 C ATOM 331 O ALA A 25 -16.404 4.909 -5.181 1.00 0.00 O ATOM 332 CB ALA A 25 -15.314 4.429 -7.885 1.00 0.00 C ATOM 0 H ALA A 25 -13.301 4.441 -6.496 1.00 0.00 H new ATOM 0 HA ALA A 25 -14.869 6.494 -7.547 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -16.248 4.635 -8.408 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -14.511 4.308 -8.612 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -15.418 3.513 -7.304 1.00 0.00 H new ATOM 338 N PRO A 26 -16.773 6.963 -5.994 1.00 0.00 N ATOM 339 CA PRO A 26 -17.835 7.305 -5.041 1.00 0.00 C ATOM 340 C PRO A 26 -19.135 6.533 -5.276 1.00 0.00 C ATOM 341 O PRO A 26 -20.103 6.689 -4.538 1.00 0.00 O ATOM 342 CB PRO A 26 -18.044 8.799 -5.265 1.00 0.00 C ATOM 343 CG PRO A 26 -17.640 9.020 -6.680 1.00 0.00 C ATOM 344 CD PRO A 26 -16.524 8.058 -6.956 1.00 0.00 C ATOM 0 HA PRO A 26 -17.553 7.045 -4.021 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -19.083 9.084 -5.099 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -17.437 9.392 -4.581 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -18.478 8.847 -7.355 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -17.314 10.048 -6.835 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -16.546 7.701 -7.986 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -15.548 8.518 -6.798 1.00 0.00 H new ATOM 352 N VAL A 27 -19.142 5.724 -6.294 1.00 0.00 N ATOM 353 CA VAL A 27 -20.268 4.901 -6.629 1.00 0.00 C ATOM 354 C VAL A 27 -19.788 3.459 -6.677 1.00 0.00 C ATOM 355 O VAL A 27 -19.023 3.077 -7.575 1.00 0.00 O ATOM 356 CB VAL A 27 -20.855 5.259 -8.019 1.00 0.00 C ATOM 357 CG1 VAL A 27 -22.055 4.386 -8.316 1.00 0.00 C ATOM 358 CG2 VAL A 27 -21.235 6.728 -8.104 1.00 0.00 C ATOM 0 H VAL A 27 -18.350 5.615 -6.928 1.00 0.00 H new ATOM 0 HA VAL A 27 -21.046 5.056 -5.881 1.00 0.00 H new ATOM 0 HB VAL A 27 -20.084 5.075 -8.767 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -22.460 4.645 -9.294 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -21.752 3.339 -8.314 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -22.818 4.545 -7.554 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -21.643 6.942 -9.092 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -21.984 6.954 -7.346 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -20.351 7.343 -7.935 1.00 0.00 H new ATOM 368 N VAL A 28 -20.196 2.671 -5.723 1.00 0.00 N ATOM 369 CA VAL A 28 -19.764 1.289 -5.659 1.00 0.00 C ATOM 370 C VAL A 28 -20.942 0.442 -5.249 1.00 0.00 C ATOM 371 O VAL A 28 -21.366 0.494 -4.147 1.00 0.00 O ATOM 372 CB VAL A 28 -18.642 1.040 -4.615 1.00 0.00 C ATOM 373 CG1 VAL A 28 -17.822 -0.161 -5.011 1.00 0.00 C ATOM 374 CG2 VAL A 28 -17.761 2.244 -4.382 1.00 0.00 C ATOM 0 H VAL A 28 -20.828 2.955 -4.974 1.00 0.00 H new ATOM 0 HA VAL A 28 -19.373 1.036 -6.645 1.00 0.00 H new ATOM 0 HB VAL A 28 -19.136 0.844 -3.663 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -17.038 -0.326 -4.272 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -18.465 -1.040 -5.061 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -17.369 0.013 -5.987 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -16.999 2.000 -3.642 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -17.280 2.529 -5.317 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -18.367 3.074 -4.018 1.00 0.00 H new ATOM 384 N ASN A 29 -21.468 -0.283 -6.142 1.00 0.00 N ATOM 385 CA ASN A 29 -22.624 -1.150 -5.886 1.00 0.00 C ATOM 386 C ASN A 29 -22.190 -2.565 -5.631 1.00 0.00 C ATOM 387 O ASN A 29 -21.174 -2.974 -6.104 1.00 0.00 O ATOM 388 CB ASN A 29 -23.589 -1.095 -7.072 1.00 0.00 C ATOM 389 CG ASN A 29 -22.904 -0.857 -8.394 1.00 0.00 C ATOM 390 OD1 ASN A 29 -22.524 -1.782 -9.089 1.00 0.00 O ATOM 391 ND2 ASN A 29 -22.713 0.402 -8.726 1.00 0.00 N ATOM 0 H ASN A 29 -21.130 -0.320 -7.104 1.00 0.00 H new ATOM 0 HA ASN A 29 -23.135 -0.789 -4.993 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -24.144 -2.032 -7.123 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -24.317 -0.302 -6.901 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -22.230 0.633 -9.594 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -23.048 1.147 -8.115 1.00 0.00 H new ATOM 398 N VAL A 30 -22.940 -3.277 -4.803 1.00 0.00 N ATOM 399 CA VAL A 30 -22.693 -4.695 -4.522 1.00 0.00 C ATOM 400 C VAL A 30 -22.476 -5.493 -5.814 1.00 0.00 C ATOM 401 O VAL A 30 -23.364 -5.566 -6.678 1.00 0.00 O ATOM 402 CB VAL A 30 -23.858 -5.304 -3.702 1.00 0.00 C ATOM 403 CG1 VAL A 30 -23.676 -6.790 -3.498 1.00 0.00 C ATOM 404 CG2 VAL A 30 -23.933 -4.633 -2.363 1.00 0.00 C ATOM 0 H VAL A 30 -23.741 -2.892 -4.302 1.00 0.00 H new ATOM 0 HA VAL A 30 -21.780 -4.758 -3.930 1.00 0.00 H new ATOM 0 HB VAL A 30 -24.780 -5.144 -4.261 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -24.512 -7.183 -2.919 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -23.640 -7.288 -4.467 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -22.745 -6.972 -2.961 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -24.753 -5.062 -1.787 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -22.995 -4.783 -1.828 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -24.105 -3.565 -2.500 1.00 0.00 H new ATOM 414 N GLY A 31 -21.276 -6.035 -5.939 1.00 0.00 N ATOM 415 CA GLY A 31 -20.889 -6.793 -7.123 1.00 0.00 C ATOM 416 C GLY A 31 -20.028 -5.972 -8.074 1.00 0.00 C ATOM 417 O GLY A 31 -19.781 -6.353 -9.215 1.00 0.00 O ATOM 0 H GLY A 31 -20.546 -5.965 -5.230 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -20.342 -7.685 -6.819 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -21.784 -7.130 -7.645 1.00 0.00 H new ATOM 421 N GLN A 32 -19.614 -4.831 -7.602 1.00 0.00 N ATOM 422 CA GLN A 32 -18.704 -3.936 -8.291 1.00 0.00 C ATOM 423 C GLN A 32 -17.288 -4.443 -8.149 1.00 0.00 C ATOM 424 O GLN A 32 -17.070 -5.548 -7.641 1.00 0.00 O ATOM 425 CB GLN A 32 -18.836 -2.560 -7.684 1.00 0.00 C ATOM 426 CG GLN A 32 -19.303 -1.529 -8.653 1.00 0.00 C ATOM 427 CD GLN A 32 -18.189 -1.111 -9.530 1.00 0.00 C ATOM 428 OE1 GLN A 32 -17.959 -1.682 -10.580 1.00 0.00 O ATOM 429 NE2 GLN A 32 -17.451 -0.167 -9.078 1.00 0.00 N ATOM 0 H GLN A 32 -19.908 -4.477 -6.692 1.00 0.00 H new ATOM 0 HA GLN A 32 -18.947 -3.891 -9.353 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -19.534 -2.605 -6.848 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -17.871 -2.256 -7.278 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -20.119 -1.928 -9.255 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -19.696 -0.666 -8.116 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -17.683 0.283 -8.192 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -16.631 0.135 -9.604 1.00 0.00 H new ATOM 438 N ASN A 33 -16.341 -3.708 -8.661 1.00 0.00 N ATOM 439 CA ASN A 33 -14.954 -4.070 -8.496 1.00 0.00 C ATOM 440 C ASN A 33 -14.198 -2.857 -8.050 1.00 0.00 C ATOM 441 O ASN A 33 -13.633 -2.121 -8.874 1.00 0.00 O ATOM 442 CB ASN A 33 -14.369 -4.586 -9.791 1.00 0.00 C ATOM 443 CG ASN A 33 -13.051 -5.340 -9.597 1.00 0.00 C ATOM 444 OD1 ASN A 33 -12.166 -5.287 -10.452 1.00 0.00 O ATOM 445 ND2 ASN A 33 -12.922 -6.083 -8.525 1.00 0.00 N ATOM 0 H ASN A 33 -16.500 -2.854 -9.196 1.00 0.00 H new ATOM 0 HA ASN A 33 -14.877 -4.864 -7.753 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -15.091 -5.246 -10.271 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -14.205 -3.748 -10.468 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -12.075 -6.634 -8.385 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -13.669 -6.111 -7.831 1.00 0.00 H new ATOM 452 N LEU A 34 -14.223 -2.598 -6.773 1.00 0.00 N ATOM 453 CA LEU A 34 -13.515 -1.465 -6.274 1.00 0.00 C ATOM 454 C LEU A 34 -12.140 -1.886 -5.890 1.00 0.00 C ATOM 455 O LEU A 34 -11.937 -2.933 -5.299 1.00 0.00 O ATOM 456 CB LEU A 34 -14.189 -0.817 -5.097 1.00 0.00 C ATOM 457 CG LEU A 34 -13.655 0.587 -4.751 1.00 0.00 C ATOM 458 CD1 LEU A 34 -13.981 1.581 -5.848 1.00 0.00 C ATOM 459 CD2 LEU A 34 -14.188 1.051 -3.433 1.00 0.00 C ATOM 0 H LEU A 34 -14.719 -3.149 -6.072 1.00 0.00 H new ATOM 0 HA LEU A 34 -13.491 -0.721 -7.070 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -15.258 -0.746 -5.299 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -14.072 -1.462 -4.226 1.00 0.00 H new ATOM 0 HG LEU A 34 -12.570 0.522 -4.672 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -13.592 2.563 -5.577 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -13.524 1.255 -6.782 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -15.062 1.641 -5.975 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -13.797 2.044 -3.211 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -15.276 1.091 -3.474 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -13.880 0.357 -2.651 1.00 0.00 H new ATOM 471 N VAL A 35 -11.219 -1.115 -6.289 1.00 0.00 N ATOM 472 CA VAL A 35 -9.875 -1.359 -6.073 1.00 0.00 C ATOM 473 C VAL A 35 -9.143 -0.101 -5.762 1.00 0.00 C ATOM 474 O VAL A 35 -9.393 0.954 -6.350 1.00 0.00 O ATOM 475 CB VAL A 35 -9.297 -2.131 -7.259 1.00 0.00 C ATOM 476 CG1 VAL A 35 -9.753 -1.548 -8.570 1.00 0.00 C ATOM 477 CG2 VAL A 35 -7.804 -2.264 -7.197 1.00 0.00 C ATOM 0 H VAL A 35 -11.400 -0.252 -6.802 1.00 0.00 H new ATOM 0 HA VAL A 35 -9.751 -1.989 -5.192 1.00 0.00 H new ATOM 0 HB VAL A 35 -9.693 -3.144 -7.191 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -9.324 -2.121 -9.392 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -10.841 -1.590 -8.628 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -9.425 -0.511 -8.641 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -7.452 -2.821 -8.065 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -7.350 -1.273 -7.193 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -7.523 -2.795 -6.287 1.00 0.00 H new ATOM 487 N VAL A 36 -8.315 -0.217 -4.790 1.00 0.00 N ATOM 488 CA VAL A 36 -7.485 0.827 -4.326 1.00 0.00 C ATOM 489 C VAL A 36 -6.101 0.636 -4.943 1.00 0.00 C ATOM 490 O VAL A 36 -5.282 -0.071 -4.370 1.00 0.00 O ATOM 491 CB VAL A 36 -7.339 0.696 -2.787 1.00 0.00 C ATOM 492 CG1 VAL A 36 -6.592 1.844 -2.214 1.00 0.00 C ATOM 493 CG2 VAL A 36 -8.679 0.505 -2.087 1.00 0.00 C ATOM 0 H VAL A 36 -8.193 -1.087 -4.272 1.00 0.00 H new ATOM 0 HA VAL A 36 -7.907 1.797 -4.591 1.00 0.00 H new ATOM 0 HB VAL A 36 -6.758 -0.208 -2.606 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -6.508 1.721 -1.134 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -5.595 1.885 -2.653 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -7.124 2.770 -2.433 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -8.519 0.419 -1.012 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -9.321 1.362 -2.291 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -9.156 -0.402 -2.457 1.00 0.00 H new ATOM 503 N ASP A 37 -5.855 1.200 -6.110 1.00 0.00 N ATOM 504 CA ASP A 37 -4.528 1.083 -6.715 1.00 0.00 C ATOM 505 C ASP A 37 -3.578 2.021 -6.056 1.00 0.00 C ATOM 506 O ASP A 37 -3.758 3.223 -6.099 1.00 0.00 O ATOM 507 CB ASP A 37 -4.508 1.332 -8.222 1.00 0.00 C ATOM 508 CG ASP A 37 -3.074 1.355 -8.753 1.00 0.00 C ATOM 509 OD1 ASP A 37 -2.430 0.285 -8.812 1.00 0.00 O ATOM 510 OD2 ASP A 37 -2.566 2.450 -9.115 1.00 0.00 O ATOM 0 H ASP A 37 -6.534 1.733 -6.653 1.00 0.00 H new ATOM 0 HA ASP A 37 -4.225 0.048 -6.560 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -5.076 0.553 -8.731 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -4.998 2.280 -8.444 1.00 0.00 H new ATOM 515 N LEU A 38 -2.574 1.469 -5.459 1.00 0.00 N ATOM 516 CA LEU A 38 -1.592 2.225 -4.742 1.00 0.00 C ATOM 517 C LEU A 38 -0.380 2.500 -5.586 1.00 0.00 C ATOM 518 O LEU A 38 0.520 3.213 -5.162 1.00 0.00 O ATOM 519 CB LEU A 38 -1.197 1.496 -3.482 1.00 0.00 C ATOM 520 CG LEU A 38 -2.328 1.245 -2.504 1.00 0.00 C ATOM 521 CD1 LEU A 38 -1.835 0.459 -1.347 1.00 0.00 C ATOM 522 CD2 LEU A 38 -2.914 2.546 -2.027 1.00 0.00 C ATOM 0 H LEU A 38 -2.407 0.463 -5.454 1.00 0.00 H new ATOM 0 HA LEU A 38 -2.036 3.185 -4.479 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -0.756 0.538 -3.758 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -0.421 2.070 -2.976 1.00 0.00 H new ATOM 0 HG LEU A 38 -3.107 0.679 -3.015 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -2.655 0.284 -0.650 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -1.445 -0.497 -1.696 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.042 1.012 -0.843 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.724 2.345 -1.326 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -2.141 3.133 -1.530 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.302 3.104 -2.879 1.00 0.00 H new ATOM 534 N SER A 39 -0.390 2.024 -6.812 1.00 0.00 N ATOM 535 CA SER A 39 0.736 2.223 -7.702 1.00 0.00 C ATOM 536 C SER A 39 0.750 3.668 -8.198 1.00 0.00 C ATOM 537 O SER A 39 1.668 4.110 -8.857 1.00 0.00 O ATOM 538 CB SER A 39 0.667 1.241 -8.876 1.00 0.00 C ATOM 539 OG SER A 39 1.823 1.322 -9.697 1.00 0.00 O ATOM 0 H SER A 39 -1.164 1.497 -7.216 1.00 0.00 H new ATOM 0 HA SER A 39 1.662 2.032 -7.159 1.00 0.00 H new ATOM 0 HB2 SER A 39 0.562 0.225 -8.495 1.00 0.00 H new ATOM 0 HB3 SER A 39 -0.220 1.451 -9.474 1.00 0.00 H new ATOM 0 HG SER A 39 1.746 0.681 -10.435 1.00 0.00 H new ATOM 545 N THR A 40 -0.270 4.372 -7.882 1.00 0.00 N ATOM 546 CA THR A 40 -0.388 5.739 -8.231 1.00 0.00 C ATOM 547 C THR A 40 -0.468 6.605 -6.969 1.00 0.00 C ATOM 548 O THR A 40 -0.566 7.830 -7.040 1.00 0.00 O ATOM 549 CB THR A 40 -1.632 5.907 -9.111 1.00 0.00 C ATOM 550 OG1 THR A 40 -2.699 5.062 -8.593 1.00 0.00 O ATOM 551 CG2 THR A 40 -1.326 5.512 -10.545 1.00 0.00 C ATOM 0 H THR A 40 -1.067 4.007 -7.361 1.00 0.00 H new ATOM 0 HA THR A 40 0.490 6.066 -8.789 1.00 0.00 H new ATOM 0 HB THR A 40 -1.940 6.952 -9.095 1.00 0.00 H new ATOM 0 HG1 THR A 40 -2.663 4.185 -9.030 1.00 0.00 H new ATOM 0 HG21 THR A 40 -2.220 5.637 -11.156 1.00 0.00 H new ATOM 0 HG22 THR A 40 -0.529 6.145 -10.935 1.00 0.00 H new ATOM 0 HG23 THR A 40 -1.009 4.470 -10.576 1.00 0.00 H new ATOM 559 N GLN A 41 -0.369 5.952 -5.808 1.00 0.00 N ATOM 560 CA GLN A 41 -0.559 6.628 -4.524 1.00 0.00 C ATOM 561 C GLN A 41 0.690 6.505 -3.668 1.00 0.00 C ATOM 562 O GLN A 41 0.901 7.294 -2.731 1.00 0.00 O ATOM 563 CB GLN A 41 -1.720 5.973 -3.762 1.00 0.00 C ATOM 564 CG GLN A 41 -2.900 5.643 -4.634 1.00 0.00 C ATOM 565 CD GLN A 41 -3.523 6.834 -5.298 1.00 0.00 C ATOM 566 OE1 GLN A 41 -3.493 7.947 -4.781 1.00 0.00 O ATOM 567 NE2 GLN A 41 -4.086 6.603 -6.446 1.00 0.00 N ATOM 0 H GLN A 41 -0.159 4.957 -5.732 1.00 0.00 H new ATOM 0 HA GLN A 41 -0.771 7.679 -4.722 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -1.363 5.059 -3.287 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -2.044 6.642 -2.964 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -2.584 4.936 -5.402 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -3.656 5.141 -4.030 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -4.085 5.660 -6.834 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -4.529 7.365 -6.959 1.00 0.00 H new ATOM 576 N ILE A 42 1.490 5.493 -3.957 1.00 0.00 N ATOM 577 CA ILE A 42 2.683 5.196 -3.195 1.00 0.00 C ATOM 578 C ILE A 42 3.816 4.871 -4.172 1.00 0.00 C ATOM 579 O ILE A 42 3.588 4.223 -5.201 1.00 0.00 O ATOM 580 CB ILE A 42 2.468 3.970 -2.254 1.00 0.00 C ATOM 581 CG1 ILE A 42 1.155 4.107 -1.475 1.00 0.00 C ATOM 582 CG2 ILE A 42 3.610 3.894 -1.273 1.00 0.00 C ATOM 583 CD1 ILE A 42 0.855 2.964 -0.528 1.00 0.00 C ATOM 0 H ILE A 42 1.326 4.852 -4.733 1.00 0.00 H new ATOM 0 HA ILE A 42 2.926 6.063 -2.581 1.00 0.00 H new ATOM 0 HB ILE A 42 2.426 3.067 -2.863 1.00 0.00 H new ATOM 0 HG12 ILE A 42 1.183 5.035 -0.904 1.00 0.00 H new ATOM 0 HG13 ILE A 42 0.334 4.195 -2.187 1.00 0.00 H new ATOM 0 HG21 ILE A 42 3.466 3.039 -0.612 1.00 0.00 H new ATOM 0 HG22 ILE A 42 4.549 3.779 -1.815 1.00 0.00 H new ATOM 0 HG23 ILE A 42 3.643 4.809 -0.681 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -0.093 3.150 -0.022 1.00 0.00 H new ATOM 0 HD12 ILE A 42 0.790 2.033 -1.091 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.652 2.886 0.212 1.00 0.00 H new ATOM 595 N PHE A 43 5.010 5.344 -3.874 1.00 0.00 N ATOM 596 CA PHE A 43 6.174 5.162 -4.728 1.00 0.00 C ATOM 597 C PHE A 43 7.369 4.876 -3.846 1.00 0.00 C ATOM 598 O PHE A 43 7.333 5.155 -2.645 1.00 0.00 O ATOM 599 CB PHE A 43 6.461 6.460 -5.506 1.00 0.00 C ATOM 600 CG PHE A 43 5.304 6.981 -6.307 1.00 0.00 C ATOM 601 CD1 PHE A 43 4.353 7.796 -5.714 1.00 0.00 C ATOM 602 CD2 PHE A 43 5.158 6.642 -7.633 1.00 0.00 C ATOM 603 CE1 PHE A 43 3.281 8.256 -6.425 1.00 0.00 C ATOM 604 CE2 PHE A 43 4.089 7.103 -8.362 1.00 0.00 C ATOM 605 CZ PHE A 43 3.141 7.915 -7.758 1.00 0.00 C ATOM 0 H PHE A 43 5.205 5.872 -3.023 1.00 0.00 H new ATOM 0 HA PHE A 43 5.989 4.345 -5.426 1.00 0.00 H new ATOM 0 HB2 PHE A 43 6.772 7.230 -4.799 1.00 0.00 H new ATOM 0 HB3 PHE A 43 7.301 6.286 -6.178 1.00 0.00 H new ATOM 0 HD1 PHE A 43 4.461 8.071 -4.675 1.00 0.00 H new ATOM 0 HD2 PHE A 43 5.892 6.006 -8.106 1.00 0.00 H new ATOM 0 HE1 PHE A 43 2.544 8.885 -5.947 1.00 0.00 H new ATOM 0 HE2 PHE A 43 3.987 6.834 -9.403 1.00 0.00 H new ATOM 0 HZ PHE A 43 2.298 8.279 -8.326 1.00 0.00 H new ATOM 615 N CYS A 44 8.414 4.345 -4.400 1.00 0.00 N ATOM 616 CA CYS A 44 9.605 4.134 -3.635 1.00 0.00 C ATOM 617 C CYS A 44 10.827 4.343 -4.496 1.00 0.00 C ATOM 618 O CYS A 44 10.839 3.977 -5.671 1.00 0.00 O ATOM 619 CB CYS A 44 9.620 2.757 -2.980 1.00 0.00 C ATOM 620 SG CYS A 44 10.936 2.552 -1.734 1.00 0.00 S ATOM 0 H CYS A 44 8.468 4.050 -5.375 1.00 0.00 H new ATOM 0 HA CYS A 44 9.620 4.869 -2.830 1.00 0.00 H new ATOM 0 HB2 CYS A 44 8.654 2.578 -2.508 1.00 0.00 H new ATOM 0 HB3 CYS A 44 9.742 1.998 -3.753 1.00 0.00 H new ATOM 625 N HIS A 45 11.845 4.933 -3.916 1.00 0.00 N ATOM 626 CA HIS A 45 13.062 5.218 -4.623 1.00 0.00 C ATOM 627 C HIS A 45 14.227 4.511 -3.971 1.00 0.00 C ATOM 628 O HIS A 45 14.158 4.036 -2.811 1.00 0.00 O ATOM 629 CB HIS A 45 13.333 6.743 -4.760 1.00 0.00 C ATOM 630 CG HIS A 45 13.410 7.504 -3.471 1.00 0.00 C ATOM 631 ND1 HIS A 45 12.362 8.219 -2.955 1.00 0.00 N ATOM 632 CD2 HIS A 45 14.429 7.633 -2.587 1.00 0.00 C ATOM 633 CE1 HIS A 45 12.756 8.738 -1.789 1.00 0.00 C ATOM 634 NE2 HIS A 45 14.010 8.416 -1.523 1.00 0.00 N ATOM 0 H HIS A 45 11.849 5.228 -2.939 1.00 0.00 H new ATOM 0 HA HIS A 45 12.943 4.837 -5.637 1.00 0.00 H new ATOM 0 HB2 HIS A 45 14.270 6.881 -5.299 1.00 0.00 H new ATOM 0 HB3 HIS A 45 12.545 7.180 -5.373 1.00 0.00 H new ATOM 0 HD1 HIS A 45 11.444 8.335 -3.385 1.00 0.00 H new ATOM 0 HD2 HIS A 45 15.411 7.196 -2.694 1.00 0.00 H new ATOM 0 HE1 HIS A 45 12.131 9.342 -1.147 1.00 0.00 H new ATOM 642 N ASN A 46 15.278 4.457 -4.684 1.00 0.00 N ATOM 643 CA ASN A 46 16.443 3.747 -4.291 1.00 0.00 C ATOM 644 C ASN A 46 17.489 4.768 -3.998 1.00 0.00 C ATOM 645 O ASN A 46 17.986 5.412 -4.927 1.00 0.00 O ATOM 646 CB ASN A 46 16.925 2.935 -5.472 1.00 0.00 C ATOM 647 CG ASN A 46 15.809 2.255 -6.256 1.00 0.00 C ATOM 648 OD1 ASN A 46 15.194 2.862 -7.138 1.00 0.00 O ATOM 649 ND2 ASN A 46 15.590 1.011 -6.013 1.00 0.00 N ATOM 0 H ASN A 46 15.364 4.918 -5.590 1.00 0.00 H new ATOM 0 HA ASN A 46 16.244 3.103 -3.435 1.00 0.00 H new ATOM 0 HB2 ASN A 46 17.482 3.587 -6.145 1.00 0.00 H new ATOM 0 HB3 ASN A 46 17.621 2.175 -5.117 1.00 0.00 H new ATOM 0 HD21 ASN A 46 14.893 0.500 -6.555 1.00 0.00 H new ATOM 0 HD22 ASN A 46 16.113 0.535 -5.278 1.00 0.00 H new ATOM 656 N ASP A 47 17.836 4.968 -2.745 1.00 0.00 N ATOM 657 CA ASP A 47 18.806 5.989 -2.466 1.00 0.00 C ATOM 658 C ASP A 47 20.203 5.437 -2.647 1.00 0.00 C ATOM 659 O ASP A 47 21.132 6.158 -2.975 1.00 0.00 O ATOM 660 CB ASP A 47 18.608 6.598 -1.085 1.00 0.00 C ATOM 661 CG ASP A 47 19.460 7.830 -0.896 1.00 0.00 C ATOM 662 OD1 ASP A 47 19.241 8.827 -1.616 1.00 0.00 O ATOM 663 OD2 ASP A 47 20.353 7.827 -0.049 1.00 0.00 O ATOM 0 H ASP A 47 17.476 4.459 -1.938 1.00 0.00 H new ATOM 0 HA ASP A 47 18.665 6.801 -3.179 1.00 0.00 H new ATOM 0 HB2 ASP A 47 17.558 6.856 -0.947 1.00 0.00 H new ATOM 0 HB3 ASP A 47 18.858 5.861 -0.322 1.00 0.00 H new ATOM 668 N TYR A 48 20.332 4.127 -2.493 1.00 0.00 N ATOM 669 CA TYR A 48 21.631 3.461 -2.685 1.00 0.00 C ATOM 670 C TYR A 48 21.463 2.216 -3.571 1.00 0.00 C ATOM 671 O TYR A 48 21.741 1.102 -3.134 1.00 0.00 O ATOM 672 CB TYR A 48 22.232 3.033 -1.339 1.00 0.00 C ATOM 673 CG TYR A 48 22.359 4.130 -0.318 1.00 0.00 C ATOM 674 CD1 TYR A 48 23.501 4.908 -0.233 1.00 0.00 C ATOM 675 CD2 TYR A 48 21.328 4.381 0.565 1.00 0.00 C ATOM 676 CE1 TYR A 48 23.605 5.911 0.710 1.00 0.00 C ATOM 677 CE2 TYR A 48 21.417 5.373 1.500 1.00 0.00 C ATOM 678 CZ TYR A 48 22.559 6.143 1.573 1.00 0.00 C ATOM 679 OH TYR A 48 22.663 7.149 2.528 1.00 0.00 O ATOM 0 H TYR A 48 19.567 3.502 -2.238 1.00 0.00 H new ATOM 0 HA TYR A 48 22.302 4.172 -3.167 1.00 0.00 H new ATOM 0 HB2 TYR A 48 21.615 2.238 -0.920 1.00 0.00 H new ATOM 0 HB3 TYR A 48 23.220 2.609 -1.519 1.00 0.00 H new ATOM 0 HD1 TYR A 48 24.321 4.728 -0.913 1.00 0.00 H new ATOM 0 HD2 TYR A 48 20.432 3.780 0.516 1.00 0.00 H new ATOM 0 HE1 TYR A 48 24.502 6.510 0.770 1.00 0.00 H new ATOM 0 HE2 TYR A 48 20.597 5.554 2.179 1.00 0.00 H new ATOM 0 HH TYR A 48 21.839 7.184 3.057 1.00 0.00 H new ATOM 689 N PRO A 49 21.079 2.392 -4.851 1.00 0.00 N ATOM 690 CA PRO A 49 20.764 1.264 -5.772 1.00 0.00 C ATOM 691 C PRO A 49 21.984 0.439 -6.193 1.00 0.00 C ATOM 692 O PRO A 49 21.877 -0.501 -6.998 1.00 0.00 O ATOM 693 CB PRO A 49 20.189 1.980 -6.994 1.00 0.00 C ATOM 694 CG PRO A 49 20.851 3.311 -6.974 1.00 0.00 C ATOM 695 CD PRO A 49 20.923 3.693 -5.537 1.00 0.00 C ATOM 0 HA PRO A 49 20.101 0.543 -5.293 1.00 0.00 H new ATOM 0 HB2 PRO A 49 20.409 1.439 -7.914 1.00 0.00 H new ATOM 0 HB3 PRO A 49 19.105 2.072 -6.929 1.00 0.00 H new ATOM 0 HG2 PRO A 49 21.845 3.262 -7.418 1.00 0.00 H new ATOM 0 HG3 PRO A 49 20.281 4.042 -7.547 1.00 0.00 H new ATOM 0 HD2 PRO A 49 21.764 4.357 -5.338 1.00 0.00 H new ATOM 0 HD3 PRO A 49 20.022 4.214 -5.213 1.00 0.00 H new ATOM 703 N GLU A 50 23.128 0.797 -5.692 1.00 0.00 N ATOM 704 CA GLU A 50 24.332 0.090 -6.023 1.00 0.00 C ATOM 705 C GLU A 50 24.919 -0.557 -4.785 1.00 0.00 C ATOM 706 O GLU A 50 25.678 -1.513 -4.869 1.00 0.00 O ATOM 707 CB GLU A 50 25.342 1.045 -6.649 1.00 0.00 C ATOM 708 CG GLU A 50 25.787 2.155 -5.717 1.00 0.00 C ATOM 709 CD GLU A 50 26.733 3.116 -6.365 1.00 0.00 C ATOM 710 OE1 GLU A 50 27.818 2.693 -6.799 1.00 0.00 O ATOM 711 OE2 GLU A 50 26.420 4.310 -6.458 1.00 0.00 O ATOM 0 H GLU A 50 23.255 1.579 -5.049 1.00 0.00 H new ATOM 0 HA GLU A 50 24.094 -0.693 -6.743 1.00 0.00 H new ATOM 0 HB2 GLU A 50 26.216 0.478 -6.968 1.00 0.00 H new ATOM 0 HB3 GLU A 50 24.905 1.487 -7.544 1.00 0.00 H new ATOM 0 HG2 GLU A 50 24.911 2.698 -5.363 1.00 0.00 H new ATOM 0 HG3 GLU A 50 26.266 1.717 -4.841 1.00 0.00 H new ATOM 718 N THR A 51 24.527 -0.061 -3.647 1.00 0.00 N ATOM 719 CA THR A 51 25.110 -0.472 -2.417 1.00 0.00 C ATOM 720 C THR A 51 24.148 -1.406 -1.711 1.00 0.00 C ATOM 721 O THR A 51 24.536 -2.307 -0.982 1.00 0.00 O ATOM 722 CB THR A 51 25.343 0.777 -1.562 1.00 0.00 C ATOM 723 OG1 THR A 51 25.527 1.911 -2.445 1.00 0.00 O ATOM 724 CG2 THR A 51 26.584 0.616 -0.706 1.00 0.00 C ATOM 0 H THR A 51 23.793 0.641 -3.553 1.00 0.00 H new ATOM 0 HA THR A 51 26.055 -0.989 -2.585 1.00 0.00 H new ATOM 0 HB THR A 51 24.484 0.928 -0.909 1.00 0.00 H new ATOM 0 HG1 THR A 51 25.676 2.720 -1.912 1.00 0.00 H new ATOM 0 HG21 THR A 51 26.731 1.514 -0.106 1.00 0.00 H new ATOM 0 HG22 THR A 51 26.463 -0.244 -0.047 1.00 0.00 H new ATOM 0 HG23 THR A 51 27.451 0.462 -1.348 1.00 0.00 H new ATOM 732 N ILE A 52 22.898 -1.210 -1.992 1.00 0.00 N ATOM 733 CA ILE A 52 21.819 -1.926 -1.396 1.00 0.00 C ATOM 734 C ILE A 52 20.914 -2.471 -2.498 1.00 0.00 C ATOM 735 O ILE A 52 20.782 -1.853 -3.555 1.00 0.00 O ATOM 736 CB ILE A 52 20.991 -0.978 -0.421 1.00 0.00 C ATOM 737 CG1 ILE A 52 21.674 -0.767 0.933 1.00 0.00 C ATOM 738 CG2 ILE A 52 19.582 -1.437 -0.205 1.00 0.00 C ATOM 739 CD1 ILE A 52 22.753 0.259 0.972 1.00 0.00 C ATOM 0 H ILE A 52 22.591 -0.516 -2.673 1.00 0.00 H new ATOM 0 HA ILE A 52 22.216 -2.753 -0.807 1.00 0.00 H new ATOM 0 HB ILE A 52 20.959 -0.021 -0.942 1.00 0.00 H new ATOM 0 HG12 ILE A 52 20.912 -0.491 1.662 1.00 0.00 H new ATOM 0 HG13 ILE A 52 22.095 -1.719 1.257 1.00 0.00 H new ATOM 0 HG21 ILE A 52 19.074 -0.747 0.469 1.00 0.00 H new ATOM 0 HG22 ILE A 52 19.058 -1.464 -1.160 1.00 0.00 H new ATOM 0 HG23 ILE A 52 19.588 -2.435 0.234 1.00 0.00 H new ATOM 0 HD11 ILE A 52 23.161 0.319 1.981 1.00 0.00 H new ATOM 0 HD12 ILE A 52 23.545 -0.019 0.276 1.00 0.00 H new ATOM 0 HD13 ILE A 52 22.344 1.228 0.688 1.00 0.00 H new ATOM 751 N THR A 53 20.382 -3.668 -2.298 1.00 0.00 N ATOM 752 CA THR A 53 19.363 -4.159 -3.178 1.00 0.00 C ATOM 753 C THR A 53 18.054 -3.674 -2.571 1.00 0.00 C ATOM 754 O THR A 53 17.859 -3.751 -1.341 1.00 0.00 O ATOM 755 CB THR A 53 19.371 -5.739 -3.320 1.00 0.00 C ATOM 756 OG1 THR A 53 18.662 -6.144 -4.508 1.00 0.00 O ATOM 757 CG2 THR A 53 18.695 -6.435 -2.125 1.00 0.00 C ATOM 0 H THR A 53 20.643 -4.301 -1.541 1.00 0.00 H new ATOM 0 HA THR A 53 19.521 -3.791 -4.192 1.00 0.00 H new ATOM 0 HB THR A 53 20.419 -6.033 -3.367 1.00 0.00 H new ATOM 0 HG1 THR A 53 18.678 -7.121 -4.581 1.00 0.00 H new ATOM 0 HG21 THR A 53 18.725 -7.515 -2.268 1.00 0.00 H new ATOM 0 HG22 THR A 53 19.222 -6.176 -1.207 1.00 0.00 H new ATOM 0 HG23 THR A 53 17.658 -6.108 -2.052 1.00 0.00 H new ATOM 765 N ASP A 54 17.209 -3.137 -3.352 1.00 0.00 N ATOM 766 CA ASP A 54 15.988 -2.655 -2.811 1.00 0.00 C ATOM 767 C ASP A 54 14.996 -3.744 -2.928 1.00 0.00 C ATOM 768 O ASP A 54 14.466 -4.028 -4.000 1.00 0.00 O ATOM 769 CB ASP A 54 15.507 -1.389 -3.519 1.00 0.00 C ATOM 770 CG ASP A 54 16.473 -0.227 -3.388 1.00 0.00 C ATOM 771 OD1 ASP A 54 17.349 -0.081 -4.265 1.00 0.00 O ATOM 772 OD2 ASP A 54 16.325 0.590 -2.458 1.00 0.00 O ATOM 0 H ASP A 54 17.327 -3.016 -4.358 1.00 0.00 H new ATOM 0 HA ASP A 54 16.130 -2.375 -1.767 1.00 0.00 H new ATOM 0 HB2 ASP A 54 15.353 -1.608 -4.576 1.00 0.00 H new ATOM 0 HB3 ASP A 54 14.540 -1.097 -3.110 1.00 0.00 H new ATOM 777 N TYR A 55 14.712 -4.315 -1.825 1.00 0.00 N ATOM 778 CA TYR A 55 13.873 -5.449 -1.735 1.00 0.00 C ATOM 779 C TYR A 55 12.682 -5.101 -0.921 1.00 0.00 C ATOM 780 O TYR A 55 12.808 -4.585 0.196 1.00 0.00 O ATOM 781 CB TYR A 55 14.670 -6.596 -1.118 1.00 0.00 C ATOM 782 CG TYR A 55 13.860 -7.794 -0.693 1.00 0.00 C ATOM 783 CD1 TYR A 55 13.308 -8.633 -1.626 1.00 0.00 C ATOM 784 CD2 TYR A 55 13.665 -8.090 0.653 1.00 0.00 C ATOM 785 CE1 TYR A 55 12.588 -9.731 -1.247 1.00 0.00 C ATOM 786 CE2 TYR A 55 12.939 -9.195 1.042 1.00 0.00 C ATOM 787 CZ TYR A 55 12.404 -10.013 0.080 1.00 0.00 C ATOM 788 OH TYR A 55 11.690 -11.134 0.439 1.00 0.00 O ATOM 0 H TYR A 55 15.069 -3.997 -0.924 1.00 0.00 H new ATOM 0 HA TYR A 55 13.527 -5.765 -2.719 1.00 0.00 H new ATOM 0 HB2 TYR A 55 15.420 -6.923 -1.838 1.00 0.00 H new ATOM 0 HB3 TYR A 55 15.207 -6.216 -0.249 1.00 0.00 H new ATOM 0 HD1 TYR A 55 13.444 -8.423 -2.677 1.00 0.00 H new ATOM 0 HD2 TYR A 55 14.090 -7.442 1.406 1.00 0.00 H new ATOM 0 HE1 TYR A 55 12.162 -10.380 -1.998 1.00 0.00 H new ATOM 0 HE2 TYR A 55 12.793 -9.414 2.090 1.00 0.00 H new ATOM 0 HH TYR A 55 11.648 -11.196 1.416 1.00 0.00 H new ATOM 798 N VAL A 56 11.537 -5.365 -1.454 1.00 0.00 N ATOM 799 CA VAL A 56 10.341 -4.988 -0.815 1.00 0.00 C ATOM 800 C VAL A 56 9.355 -6.122 -0.837 1.00 0.00 C ATOM 801 O VAL A 56 9.239 -6.847 -1.821 1.00 0.00 O ATOM 802 CB VAL A 56 9.715 -3.723 -1.464 1.00 0.00 C ATOM 803 CG1 VAL A 56 9.304 -3.960 -2.909 1.00 0.00 C ATOM 804 CG2 VAL A 56 8.555 -3.218 -0.638 1.00 0.00 C ATOM 0 H VAL A 56 11.413 -5.848 -2.344 1.00 0.00 H new ATOM 0 HA VAL A 56 10.585 -4.745 0.219 1.00 0.00 H new ATOM 0 HB VAL A 56 10.485 -2.952 -1.481 1.00 0.00 H new ATOM 0 HG11 VAL A 56 8.872 -3.047 -3.319 1.00 0.00 H new ATOM 0 HG12 VAL A 56 10.179 -4.242 -3.495 1.00 0.00 H new ATOM 0 HG13 VAL A 56 8.566 -4.761 -2.951 1.00 0.00 H new ATOM 0 HG21 VAL A 56 8.131 -2.332 -1.110 1.00 0.00 H new ATOM 0 HG22 VAL A 56 7.792 -3.993 -0.570 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.904 -2.964 0.363 1.00 0.00 H new ATOM 814 N THR A 57 8.697 -6.285 0.251 1.00 0.00 N ATOM 815 CA THR A 57 7.648 -7.222 0.385 1.00 0.00 C ATOM 816 C THR A 57 6.661 -6.614 1.338 1.00 0.00 C ATOM 817 O THR A 57 7.066 -6.021 2.331 1.00 0.00 O ATOM 818 CB THR A 57 8.159 -8.610 0.913 1.00 0.00 C ATOM 819 OG1 THR A 57 9.141 -8.427 1.955 1.00 0.00 O ATOM 820 CG2 THR A 57 8.745 -9.473 -0.213 1.00 0.00 C ATOM 0 H THR A 57 8.881 -5.751 1.100 1.00 0.00 H new ATOM 0 HA THR A 57 7.194 -7.426 -0.585 1.00 0.00 H new ATOM 0 HB THR A 57 7.295 -9.136 1.321 1.00 0.00 H new ATOM 0 HG1 THR A 57 9.447 -9.302 2.273 1.00 0.00 H new ATOM 0 HG21 THR A 57 9.086 -10.424 0.197 1.00 0.00 H new ATOM 0 HG22 THR A 57 7.979 -9.657 -0.967 1.00 0.00 H new ATOM 0 HG23 THR A 57 9.586 -8.952 -0.670 1.00 0.00 H new ATOM 828 N LEU A 58 5.417 -6.615 0.983 1.00 0.00 N ATOM 829 CA LEU A 58 4.389 -6.191 1.880 1.00 0.00 C ATOM 830 C LEU A 58 4.376 -7.167 3.026 1.00 0.00 C ATOM 831 O LEU A 58 4.175 -8.366 2.841 1.00 0.00 O ATOM 832 CB LEU A 58 3.031 -6.160 1.171 1.00 0.00 C ATOM 833 CG LEU A 58 1.789 -5.871 2.030 1.00 0.00 C ATOM 834 CD1 LEU A 58 1.893 -4.530 2.671 1.00 0.00 C ATOM 835 CD2 LEU A 58 0.527 -5.953 1.193 1.00 0.00 C ATOM 0 H LEU A 58 5.084 -6.909 0.065 1.00 0.00 H new ATOM 0 HA LEU A 58 4.581 -5.180 2.240 1.00 0.00 H new ATOM 0 HB2 LEU A 58 3.079 -5.407 0.385 1.00 0.00 H new ATOM 0 HB3 LEU A 58 2.885 -7.123 0.681 1.00 0.00 H new ATOM 0 HG LEU A 58 1.737 -6.628 2.813 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.004 -4.345 3.274 1.00 0.00 H new ATOM 0 HD12 LEU A 58 2.777 -4.499 3.308 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.974 -3.764 1.900 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.340 -5.745 1.820 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.576 -5.220 0.388 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.436 -6.953 0.768 1.00 0.00 H new ATOM 847 N GLN A 59 4.672 -6.629 4.181 1.00 0.00 N ATOM 848 CA GLN A 59 4.755 -7.354 5.419 1.00 0.00 C ATOM 849 C GLN A 59 3.421 -7.967 5.725 1.00 0.00 C ATOM 850 O GLN A 59 3.322 -9.132 6.034 1.00 0.00 O ATOM 851 CB GLN A 59 5.140 -6.378 6.548 1.00 0.00 C ATOM 852 CG GLN A 59 4.965 -6.937 7.947 1.00 0.00 C ATOM 853 CD GLN A 59 6.037 -7.894 8.352 1.00 0.00 C ATOM 854 OE1 GLN A 59 5.975 -9.072 8.067 1.00 0.00 O ATOM 855 NE2 GLN A 59 6.972 -7.412 9.096 1.00 0.00 N ATOM 0 H GLN A 59 4.869 -5.634 4.287 1.00 0.00 H new ATOM 0 HA GLN A 59 5.506 -8.139 5.338 1.00 0.00 H new ATOM 0 HB2 GLN A 59 6.181 -6.081 6.416 1.00 0.00 H new ATOM 0 HB3 GLN A 59 4.537 -5.475 6.453 1.00 0.00 H new ATOM 0 HG2 GLN A 59 4.941 -6.111 8.658 1.00 0.00 H new ATOM 0 HG3 GLN A 59 4.000 -7.440 8.009 1.00 0.00 H new ATOM 0 HE21 GLN A 59 6.989 -6.415 9.312 1.00 0.00 H new ATOM 0 HE22 GLN A 59 7.695 -8.027 9.468 1.00 0.00 H new ATOM 864 N ARG A 60 2.413 -7.142 5.637 1.00 0.00 N ATOM 865 CA ARG A 60 1.069 -7.504 5.918 1.00 0.00 C ATOM 866 C ARG A 60 0.198 -6.326 5.606 1.00 0.00 C ATOM 867 O ARG A 60 0.694 -5.189 5.507 1.00 0.00 O ATOM 868 CB ARG A 60 0.885 -7.911 7.385 1.00 0.00 C ATOM 869 CG ARG A 60 1.279 -6.843 8.401 1.00 0.00 C ATOM 870 CD ARG A 60 0.153 -6.639 9.391 1.00 0.00 C ATOM 871 NE ARG A 60 -0.264 -7.926 9.976 1.00 0.00 N ATOM 872 CZ ARG A 60 -1.514 -8.429 9.945 1.00 0.00 C ATOM 873 NH1 ARG A 60 -2.543 -7.678 9.570 1.00 0.00 N ATOM 874 NH2 ARG A 60 -1.731 -9.684 10.311 1.00 0.00 N ATOM 0 H ARG A 60 2.519 -6.167 5.357 1.00 0.00 H new ATOM 0 HA ARG A 60 0.797 -8.365 5.307 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -0.160 -8.177 7.545 1.00 0.00 H new ATOM 0 HB3 ARG A 60 1.475 -8.808 7.575 1.00 0.00 H new ATOM 0 HG2 ARG A 60 2.186 -7.143 8.925 1.00 0.00 H new ATOM 0 HG3 ARG A 60 1.501 -5.906 7.890 1.00 0.00 H new ATOM 0 HD2 ARG A 60 0.475 -5.962 10.182 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -0.695 -6.168 8.894 1.00 0.00 H new ATOM 0 HE ARG A 60 0.453 -8.482 10.443 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -2.393 -6.706 9.300 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -3.483 -8.073 9.552 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -0.952 -10.268 10.616 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -2.677 -10.066 10.288 1.00 0.00 H new ATOM 888 N GLY A 61 -1.058 -6.575 5.451 1.00 0.00 N ATOM 889 CA GLY A 61 -1.973 -5.556 5.145 1.00 0.00 C ATOM 890 C GLY A 61 -3.176 -5.740 5.967 1.00 0.00 C ATOM 891 O GLY A 61 -3.626 -6.862 6.121 1.00 0.00 O ATOM 0 H GLY A 61 -1.471 -7.504 5.536 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -1.529 -4.579 5.338 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -2.231 -5.585 4.086 1.00 0.00 H new ATOM 895 N SER A 62 -3.668 -4.683 6.500 1.00 0.00 N ATOM 896 CA SER A 62 -4.784 -4.699 7.390 1.00 0.00 C ATOM 897 C SER A 62 -5.886 -3.790 6.852 1.00 0.00 C ATOM 898 O SER A 62 -5.592 -2.789 6.214 1.00 0.00 O ATOM 899 CB SER A 62 -4.277 -4.211 8.728 1.00 0.00 C ATOM 900 OG SER A 62 -3.237 -5.057 9.215 1.00 0.00 O ATOM 0 H SER A 62 -3.297 -3.749 6.327 1.00 0.00 H new ATOM 0 HA SER A 62 -5.209 -5.698 7.488 1.00 0.00 H new ATOM 0 HB2 SER A 62 -3.906 -3.191 8.631 1.00 0.00 H new ATOM 0 HB3 SER A 62 -5.097 -4.186 9.445 1.00 0.00 H new ATOM 0 HG SER A 62 -2.922 -4.723 10.081 1.00 0.00 H new ATOM 906 N ALA A 63 -7.133 -4.157 7.098 1.00 0.00 N ATOM 907 CA ALA A 63 -8.289 -3.400 6.625 1.00 0.00 C ATOM 908 C ALA A 63 -8.989 -2.797 7.811 1.00 0.00 C ATOM 909 O ALA A 63 -8.845 -3.325 8.913 1.00 0.00 O ATOM 910 CB ALA A 63 -9.242 -4.321 5.902 1.00 0.00 C ATOM 0 H ALA A 63 -7.377 -4.991 7.633 1.00 0.00 H new ATOM 0 HA ALA A 63 -7.960 -2.617 5.942 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -10.103 -3.751 5.551 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -8.735 -4.774 5.050 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -9.578 -5.104 6.582 1.00 0.00 H new ATOM 916 N TYR A 64 -9.741 -1.705 7.598 1.00 0.00 N ATOM 917 CA TYR A 64 -10.445 -0.970 8.650 1.00 0.00 C ATOM 918 C TYR A 64 -11.616 -0.205 8.030 1.00 0.00 C ATOM 919 O TYR A 64 -11.872 -0.335 6.828 1.00 0.00 O ATOM 920 CB TYR A 64 -9.530 0.022 9.417 1.00 0.00 C ATOM 921 CG TYR A 64 -8.344 -0.608 10.093 1.00 0.00 C ATOM 922 CD1 TYR A 64 -8.438 -1.133 11.371 1.00 0.00 C ATOM 923 CD2 TYR A 64 -7.134 -0.709 9.431 1.00 0.00 C ATOM 924 CE1 TYR A 64 -7.351 -1.739 11.964 1.00 0.00 C ATOM 925 CE2 TYR A 64 -6.059 -1.301 10.006 1.00 0.00 C ATOM 926 CZ TYR A 64 -6.163 -1.824 11.275 1.00 0.00 C ATOM 927 OH TYR A 64 -5.068 -2.422 11.863 1.00 0.00 O ATOM 0 H TYR A 64 -9.876 -1.304 6.670 1.00 0.00 H new ATOM 0 HA TYR A 64 -10.796 -1.704 9.375 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -9.173 0.779 8.719 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -10.127 0.538 10.169 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -9.372 -1.067 11.909 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -7.044 -0.307 8.433 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -7.431 -2.144 12.962 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -5.123 -1.362 9.470 1.00 0.00 H new ATOM 0 HH TYR A 64 -4.310 -2.400 11.242 1.00 0.00 H new ATOM 937 N GLY A 65 -12.346 0.534 8.856 1.00 0.00 N ATOM 938 CA GLY A 65 -13.455 1.350 8.394 1.00 0.00 C ATOM 939 C GLY A 65 -14.560 0.519 7.789 1.00 0.00 C ATOM 940 O GLY A 65 -14.875 -0.553 8.282 1.00 0.00 O ATOM 0 H GLY A 65 -12.184 0.583 9.862 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -13.852 1.927 9.229 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -13.094 2.066 7.655 1.00 0.00 H new ATOM 944 N GLY A 66 -15.137 0.992 6.712 1.00 0.00 N ATOM 945 CA GLY A 66 -16.151 0.236 6.040 1.00 0.00 C ATOM 946 C GLY A 66 -15.540 -0.768 5.092 1.00 0.00 C ATOM 947 O GLY A 66 -16.217 -1.617 4.575 1.00 0.00 O ATOM 0 H GLY A 66 -14.919 1.894 6.287 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -16.770 -0.281 6.773 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -16.806 0.910 5.488 1.00 0.00 H new ATOM 951 N VAL A 67 -14.248 -0.694 4.930 1.00 0.00 N ATOM 952 CA VAL A 67 -13.501 -1.533 3.995 1.00 0.00 C ATOM 953 C VAL A 67 -13.460 -2.968 4.442 1.00 0.00 C ATOM 954 O VAL A 67 -13.559 -3.871 3.642 1.00 0.00 O ATOM 955 CB VAL A 67 -12.083 -0.996 3.837 1.00 0.00 C ATOM 956 CG1 VAL A 67 -11.201 -1.893 2.999 1.00 0.00 C ATOM 957 CG2 VAL A 67 -12.135 0.381 3.260 1.00 0.00 C ATOM 0 H VAL A 67 -13.661 -0.040 5.448 1.00 0.00 H new ATOM 0 HA VAL A 67 -14.015 -1.501 3.035 1.00 0.00 H new ATOM 0 HB VAL A 67 -11.631 -0.968 4.829 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -10.205 -1.456 2.924 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -11.132 -2.875 3.466 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -11.629 -1.995 2.002 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -11.122 0.766 3.146 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -12.622 0.349 2.286 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -12.699 1.034 3.926 1.00 0.00 H new ATOM 967 N LEU A 68 -13.326 -3.176 5.715 1.00 0.00 N ATOM 968 CA LEU A 68 -13.297 -4.519 6.223 1.00 0.00 C ATOM 969 C LEU A 68 -14.705 -5.072 6.480 1.00 0.00 C ATOM 970 O LEU A 68 -14.916 -6.280 6.545 1.00 0.00 O ATOM 971 CB LEU A 68 -12.401 -4.646 7.479 1.00 0.00 C ATOM 972 CG LEU A 68 -12.505 -3.600 8.604 1.00 0.00 C ATOM 973 CD1 LEU A 68 -13.870 -3.313 9.056 1.00 0.00 C ATOM 974 CD2 LEU A 68 -11.695 -4.030 9.768 1.00 0.00 C ATOM 0 H LEU A 68 -13.235 -2.443 6.419 1.00 0.00 H new ATOM 0 HA LEU A 68 -12.849 -5.134 5.443 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -12.600 -5.621 7.923 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -11.365 -4.656 7.139 1.00 0.00 H new ATOM 0 HG LEU A 68 -12.126 -2.675 8.170 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -13.841 -2.566 9.849 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -14.458 -2.933 8.220 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -14.327 -4.227 9.435 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -11.773 -3.286 10.560 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -12.063 -4.989 10.133 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -10.652 -4.132 9.468 1.00 0.00 H new ATOM 986 N SER A 69 -15.645 -4.174 6.639 1.00 0.00 N ATOM 987 CA SER A 69 -16.990 -4.532 7.026 1.00 0.00 C ATOM 988 C SER A 69 -17.983 -4.558 5.855 1.00 0.00 C ATOM 989 O SER A 69 -18.685 -5.548 5.642 1.00 0.00 O ATOM 990 CB SER A 69 -17.445 -3.596 8.149 1.00 0.00 C ATOM 991 OG SER A 69 -16.881 -3.954 9.402 1.00 0.00 O ATOM 0 H SER A 69 -15.501 -3.173 6.504 1.00 0.00 H new ATOM 0 HA SER A 69 -16.974 -5.560 7.388 1.00 0.00 H new ATOM 0 HB2 SER A 69 -17.163 -2.572 7.904 1.00 0.00 H new ATOM 0 HB3 SER A 69 -18.532 -3.618 8.221 1.00 0.00 H new ATOM 0 HG SER A 69 -17.194 -3.332 10.091 1.00 0.00 H new ATOM 997 N ASN A 70 -18.008 -3.499 5.090 1.00 0.00 N ATOM 998 CA ASN A 70 -18.957 -3.339 3.988 1.00 0.00 C ATOM 999 C ASN A 70 -18.314 -3.827 2.733 1.00 0.00 C ATOM 1000 O ASN A 70 -18.989 -4.148 1.767 1.00 0.00 O ATOM 1001 CB ASN A 70 -19.321 -1.853 3.796 1.00 0.00 C ATOM 1002 CG ASN A 70 -19.799 -1.159 5.057 1.00 0.00 C ATOM 1003 OD1 ASN A 70 -20.417 -1.758 5.922 1.00 0.00 O ATOM 1004 ND2 ASN A 70 -19.471 0.101 5.188 1.00 0.00 N ATOM 0 H ASN A 70 -17.371 -2.710 5.204 1.00 0.00 H new ATOM 0 HA ASN A 70 -19.861 -3.904 4.216 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -18.448 -1.324 3.413 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -20.099 -1.777 3.036 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -19.732 0.611 6.032 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -18.954 0.573 4.446 1.00 0.00 H new ATOM 1011 N PHE A 71 -17.012 -3.846 2.719 1.00 0.00 N ATOM 1012 CA PHE A 71 -16.315 -4.345 1.591 1.00 0.00 C ATOM 1013 C PHE A 71 -15.650 -5.655 1.953 1.00 0.00 C ATOM 1014 O PHE A 71 -15.520 -5.989 3.138 1.00 0.00 O ATOM 1015 CB PHE A 71 -15.283 -3.339 1.076 1.00 0.00 C ATOM 1016 CG PHE A 71 -15.838 -2.006 0.637 1.00 0.00 C ATOM 1017 CD1 PHE A 71 -16.051 -0.984 1.541 1.00 0.00 C ATOM 1018 CD2 PHE A 71 -16.141 -1.782 -0.685 1.00 0.00 C ATOM 1019 CE1 PHE A 71 -16.556 0.218 1.132 1.00 0.00 C ATOM 1020 CE2 PHE A 71 -16.652 -0.573 -1.102 1.00 0.00 C ATOM 1021 CZ PHE A 71 -16.860 0.427 -0.193 1.00 0.00 C ATOM 0 H PHE A 71 -16.420 -3.519 3.482 1.00 0.00 H new ATOM 0 HA PHE A 71 -17.031 -4.511 0.786 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -14.547 -3.166 1.861 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -14.753 -3.787 0.235 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -15.816 -1.137 2.584 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -15.976 -2.567 -1.408 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -16.717 1.007 1.852 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -16.888 -0.415 -2.144 1.00 0.00 H new ATOM 0 HZ PHE A 71 -17.261 1.377 -0.514 1.00 0.00 H new ATOM 1031 N SER A 72 -15.314 -6.408 0.951 1.00 0.00 N ATOM 1032 CA SER A 72 -14.610 -7.628 1.085 1.00 0.00 C ATOM 1033 C SER A 72 -14.144 -7.996 -0.304 1.00 0.00 C ATOM 1034 O SER A 72 -14.903 -7.872 -1.269 1.00 0.00 O ATOM 1035 CB SER A 72 -15.537 -8.716 1.621 1.00 0.00 C ATOM 1036 OG SER A 72 -14.816 -9.857 2.071 1.00 0.00 O ATOM 0 H SER A 72 -15.535 -6.173 -0.016 1.00 0.00 H new ATOM 0 HA SER A 72 -13.776 -7.529 1.780 1.00 0.00 H new ATOM 0 HB2 SER A 72 -16.130 -8.315 2.443 1.00 0.00 H new ATOM 0 HB3 SER A 72 -16.236 -9.014 0.840 1.00 0.00 H new ATOM 0 HG SER A 72 -15.445 -10.529 2.408 1.00 0.00 H new ATOM 1042 N GLY A 73 -12.912 -8.333 -0.426 1.00 0.00 N ATOM 1043 CA GLY A 73 -12.389 -8.776 -1.648 1.00 0.00 C ATOM 1044 C GLY A 73 -11.046 -9.398 -1.447 1.00 0.00 C ATOM 1045 O GLY A 73 -10.910 -10.403 -0.741 1.00 0.00 O ATOM 0 H GLY A 73 -12.236 -8.305 0.337 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -13.068 -9.500 -2.100 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -12.308 -7.938 -2.341 1.00 0.00 H new ATOM 1049 N THR A 74 -10.064 -8.751 -1.956 1.00 0.00 N ATOM 1050 CA THR A 74 -8.710 -9.260 -2.012 1.00 0.00 C ATOM 1051 C THR A 74 -7.709 -8.117 -2.136 1.00 0.00 C ATOM 1052 O THR A 74 -8.083 -6.948 -2.146 1.00 0.00 O ATOM 1053 CB THR A 74 -8.556 -10.216 -3.225 1.00 0.00 C ATOM 1054 OG1 THR A 74 -9.397 -9.771 -4.306 1.00 0.00 O ATOM 1055 CG2 THR A 74 -8.882 -11.657 -2.859 1.00 0.00 C ATOM 0 H THR A 74 -10.165 -7.821 -2.363 1.00 0.00 H new ATOM 0 HA THR A 74 -8.509 -9.804 -1.089 1.00 0.00 H new ATOM 0 HB THR A 74 -7.513 -10.191 -3.540 1.00 0.00 H new ATOM 0 HG1 THR A 74 -9.295 -10.376 -5.070 1.00 0.00 H new ATOM 0 HG21 THR A 74 -8.761 -12.292 -3.737 1.00 0.00 H new ATOM 0 HG22 THR A 74 -8.207 -11.994 -2.072 1.00 0.00 H new ATOM 0 HG23 THR A 74 -9.911 -11.719 -2.505 1.00 0.00 H new ATOM 1063 N VAL A 75 -6.455 -8.460 -2.182 1.00 0.00 N ATOM 1064 CA VAL A 75 -5.383 -7.519 -2.332 1.00 0.00 C ATOM 1065 C VAL A 75 -4.396 -8.047 -3.373 1.00 0.00 C ATOM 1066 O VAL A 75 -4.250 -9.264 -3.552 1.00 0.00 O ATOM 1067 CB VAL A 75 -4.691 -7.237 -0.960 1.00 0.00 C ATOM 1068 CG1 VAL A 75 -4.356 -8.524 -0.258 1.00 0.00 C ATOM 1069 CG2 VAL A 75 -3.439 -6.379 -1.097 1.00 0.00 C ATOM 0 H VAL A 75 -6.141 -9.428 -2.114 1.00 0.00 H new ATOM 0 HA VAL A 75 -5.779 -6.566 -2.682 1.00 0.00 H new ATOM 0 HB VAL A 75 -5.408 -6.673 -0.363 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -3.875 -8.304 0.695 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -5.270 -9.090 -0.081 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -3.680 -9.112 -0.879 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -3.000 -6.216 -0.113 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -2.717 -6.888 -1.736 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -3.703 -5.419 -1.541 1.00 0.00 H new ATOM 1079 N LYS A 76 -3.785 -7.144 -4.076 1.00 0.00 N ATOM 1080 CA LYS A 76 -2.859 -7.455 -5.117 1.00 0.00 C ATOM 1081 C LYS A 76 -1.553 -6.737 -4.851 1.00 0.00 C ATOM 1082 O LYS A 76 -1.542 -5.673 -4.237 1.00 0.00 O ATOM 1083 CB LYS A 76 -3.471 -7.002 -6.413 1.00 0.00 C ATOM 1084 CG LYS A 76 -2.732 -7.353 -7.681 1.00 0.00 C ATOM 1085 CD LYS A 76 -3.631 -7.025 -8.815 1.00 0.00 C ATOM 1086 CE LYS A 76 -3.120 -7.426 -10.165 1.00 0.00 C ATOM 1087 NZ LYS A 76 -4.071 -6.997 -11.223 1.00 0.00 N ATOM 0 H LYS A 76 -3.922 -6.143 -3.936 1.00 0.00 H new ATOM 0 HA LYS A 76 -2.651 -8.524 -5.163 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -4.474 -7.423 -6.479 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -3.581 -5.918 -6.375 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -1.801 -6.791 -7.752 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -2.467 -8.410 -7.693 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -4.593 -7.510 -8.649 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -3.812 -5.950 -8.816 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -2.143 -6.976 -10.340 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -2.985 -8.507 -10.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -4.484 -7.835 -11.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -4.828 -6.425 -10.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -3.567 -6.430 -11.934 1.00 0.00 H new ATOM 1101 N TYR A 77 -0.482 -7.330 -5.290 1.00 0.00 N ATOM 1102 CA TYR A 77 0.862 -6.810 -5.093 1.00 0.00 C ATOM 1103 C TYR A 77 1.706 -7.287 -6.236 1.00 0.00 C ATOM 1104 O TYR A 77 1.866 -8.479 -6.382 1.00 0.00 O ATOM 1105 CB TYR A 77 1.434 -7.394 -3.806 1.00 0.00 C ATOM 1106 CG TYR A 77 2.809 -6.892 -3.410 1.00 0.00 C ATOM 1107 CD1 TYR A 77 3.962 -7.497 -3.879 1.00 0.00 C ATOM 1108 CD2 TYR A 77 2.947 -5.828 -2.540 1.00 0.00 C ATOM 1109 CE1 TYR A 77 5.203 -7.044 -3.491 1.00 0.00 C ATOM 1110 CE2 TYR A 77 4.179 -5.370 -2.157 1.00 0.00 C ATOM 1111 CZ TYR A 77 5.299 -5.978 -2.633 1.00 0.00 C ATOM 1112 OH TYR A 77 6.524 -5.527 -2.249 1.00 0.00 O ATOM 0 H TYR A 77 -0.507 -8.209 -5.808 1.00 0.00 H new ATOM 0 HA TYR A 77 0.847 -5.722 -5.038 1.00 0.00 H new ATOM 0 HB2 TYR A 77 0.741 -7.180 -2.992 1.00 0.00 H new ATOM 0 HB3 TYR A 77 1.479 -8.478 -3.909 1.00 0.00 H new ATOM 0 HD1 TYR A 77 3.887 -8.334 -4.557 1.00 0.00 H new ATOM 0 HD2 TYR A 77 2.062 -5.346 -2.153 1.00 0.00 H new ATOM 0 HE1 TYR A 77 6.096 -7.526 -3.860 1.00 0.00 H new ATOM 0 HE2 TYR A 77 4.261 -4.531 -1.481 1.00 0.00 H new ATOM 0 HH TYR A 77 7.189 -6.235 -2.380 1.00 0.00 H new ATOM 1122 N SER A 78 2.211 -6.388 -7.056 1.00 0.00 N ATOM 1123 CA SER A 78 3.047 -6.744 -8.169 1.00 0.00 C ATOM 1124 C SER A 78 2.403 -7.794 -9.103 1.00 0.00 C ATOM 1125 O SER A 78 3.094 -8.643 -9.677 1.00 0.00 O ATOM 1126 CB SER A 78 4.389 -7.216 -7.634 1.00 0.00 C ATOM 1127 OG SER A 78 5.303 -6.152 -7.445 1.00 0.00 O ATOM 0 H SER A 78 2.048 -5.385 -6.963 1.00 0.00 H new ATOM 0 HA SER A 78 3.185 -5.860 -8.791 1.00 0.00 H new ATOM 0 HB2 SER A 78 4.237 -7.733 -6.686 1.00 0.00 H new ATOM 0 HB3 SER A 78 4.818 -7.940 -8.327 1.00 0.00 H new ATOM 0 HG SER A 78 6.158 -6.376 -7.869 1.00 0.00 H new ATOM 1133 N GLY A 79 1.089 -7.730 -9.242 1.00 0.00 N ATOM 1134 CA GLY A 79 0.395 -8.690 -10.075 1.00 0.00 C ATOM 1135 C GLY A 79 0.046 -9.977 -9.334 1.00 0.00 C ATOM 1136 O GLY A 79 -0.372 -10.963 -9.952 1.00 0.00 O ATOM 0 H GLY A 79 0.492 -7.034 -8.795 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -0.520 -8.237 -10.457 1.00 0.00 H new ATOM 0 HA3 GLY A 79 1.016 -8.931 -10.938 1.00 0.00 H new ATOM 1140 N SER A 80 0.228 -9.980 -8.027 1.00 0.00 N ATOM 1141 CA SER A 80 -0.109 -11.141 -7.202 1.00 0.00 C ATOM 1142 C SER A 80 -1.627 -11.140 -6.937 1.00 0.00 C ATOM 1143 O SER A 80 -2.333 -10.255 -7.388 1.00 0.00 O ATOM 1144 CB SER A 80 0.671 -11.091 -5.867 1.00 0.00 C ATOM 1145 OG SER A 80 0.611 -12.321 -5.156 1.00 0.00 O ATOM 0 H SER A 80 0.609 -9.191 -7.505 1.00 0.00 H new ATOM 0 HA SER A 80 0.169 -12.057 -7.724 1.00 0.00 H new ATOM 0 HB2 SER A 80 1.713 -10.841 -6.068 1.00 0.00 H new ATOM 0 HB3 SER A 80 0.267 -10.294 -5.243 1.00 0.00 H new ATOM 0 HG SER A 80 0.016 -12.224 -4.384 1.00 0.00 H new ATOM 1151 N SER A 81 -2.101 -12.097 -6.215 1.00 0.00 N ATOM 1152 CA SER A 81 -3.509 -12.217 -5.913 1.00 0.00 C ATOM 1153 C SER A 81 -3.690 -12.998 -4.600 1.00 0.00 C ATOM 1154 O SER A 81 -3.400 -14.199 -4.537 1.00 0.00 O ATOM 1155 CB SER A 81 -4.219 -12.902 -7.090 1.00 0.00 C ATOM 1156 OG SER A 81 -3.508 -14.064 -7.527 1.00 0.00 O ATOM 0 H SER A 81 -1.525 -12.833 -5.807 1.00 0.00 H new ATOM 0 HA SER A 81 -3.955 -11.232 -5.775 1.00 0.00 H new ATOM 0 HB2 SER A 81 -5.229 -13.183 -6.793 1.00 0.00 H new ATOM 0 HB3 SER A 81 -4.314 -12.199 -7.918 1.00 0.00 H new ATOM 0 HG SER A 81 -3.205 -14.574 -6.747 1.00 0.00 H new ATOM 1162 N TYR A 82 -4.120 -12.320 -3.559 1.00 0.00 N ATOM 1163 CA TYR A 82 -4.228 -12.920 -2.241 1.00 0.00 C ATOM 1164 C TYR A 82 -5.330 -12.194 -1.426 1.00 0.00 C ATOM 1165 O TYR A 82 -5.721 -11.086 -1.788 1.00 0.00 O ATOM 1166 CB TYR A 82 -2.815 -12.903 -1.553 1.00 0.00 C ATOM 1167 CG TYR A 82 -2.125 -11.550 -1.500 1.00 0.00 C ATOM 1168 CD1 TYR A 82 -1.634 -10.943 -2.656 1.00 0.00 C ATOM 1169 CD2 TYR A 82 -1.966 -10.887 -0.303 1.00 0.00 C ATOM 1170 CE1 TYR A 82 -1.035 -9.714 -2.615 1.00 0.00 C ATOM 1171 CE2 TYR A 82 -1.353 -9.658 -0.249 1.00 0.00 C ATOM 1172 CZ TYR A 82 -0.901 -9.072 -1.403 1.00 0.00 C ATOM 1173 OH TYR A 82 -0.342 -7.828 -1.346 1.00 0.00 O ATOM 0 H TYR A 82 -4.404 -11.341 -3.598 1.00 0.00 H new ATOM 0 HA TYR A 82 -4.536 -13.964 -2.306 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -2.923 -13.276 -0.534 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -2.166 -13.601 -2.081 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -1.729 -11.454 -3.603 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -2.329 -11.340 0.608 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -0.672 -9.252 -3.521 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -1.228 -9.156 0.699 1.00 0.00 H new ATOM 0 HH TYR A 82 -0.889 -7.249 -0.775 1.00 0.00 H new ATOM 1183 N PRO A 83 -5.887 -12.830 -0.358 1.00 0.00 N ATOM 1184 CA PRO A 83 -7.004 -12.257 0.433 1.00 0.00 C ATOM 1185 C PRO A 83 -6.611 -11.017 1.227 1.00 0.00 C ATOM 1186 O PRO A 83 -5.464 -10.873 1.634 1.00 0.00 O ATOM 1187 CB PRO A 83 -7.379 -13.387 1.396 1.00 0.00 C ATOM 1188 CG PRO A 83 -6.148 -14.211 1.516 1.00 0.00 C ATOM 1189 CD PRO A 83 -5.473 -14.143 0.176 1.00 0.00 C ATOM 0 HA PRO A 83 -7.814 -11.929 -0.219 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -7.688 -12.994 2.365 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -8.212 -13.975 1.010 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -5.496 -13.827 2.301 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -6.391 -15.240 1.779 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -4.389 -14.214 0.269 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -5.791 -14.958 -0.474 1.00 0.00 H new ATOM 1197 N PHE A 84 -7.564 -10.126 1.439 1.00 0.00 N ATOM 1198 CA PHE A 84 -7.319 -8.920 2.196 1.00 0.00 C ATOM 1199 C PHE A 84 -8.328 -8.807 3.328 1.00 0.00 C ATOM 1200 O PHE A 84 -9.522 -9.005 3.109 1.00 0.00 O ATOM 1201 CB PHE A 84 -7.406 -7.688 1.314 1.00 0.00 C ATOM 1202 CG PHE A 84 -6.924 -6.432 1.983 1.00 0.00 C ATOM 1203 CD1 PHE A 84 -5.576 -6.195 2.139 1.00 0.00 C ATOM 1204 CD2 PHE A 84 -7.811 -5.498 2.445 1.00 0.00 C ATOM 1205 CE1 PHE A 84 -5.127 -5.051 2.741 1.00 0.00 C ATOM 1206 CE2 PHE A 84 -7.372 -4.341 3.044 1.00 0.00 C ATOM 1207 CZ PHE A 84 -6.026 -4.117 3.193 1.00 0.00 C ATOM 0 H PHE A 84 -8.519 -10.220 1.093 1.00 0.00 H new ATOM 0 HA PHE A 84 -6.310 -8.978 2.605 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -6.819 -7.856 0.411 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -8.441 -7.548 1.001 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -4.863 -6.923 1.781 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -8.871 -5.672 2.338 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -4.067 -4.883 2.860 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -8.085 -3.610 3.397 1.00 0.00 H new ATOM 0 HZ PHE A 84 -5.676 -3.210 3.664 1.00 0.00 H new ATOM 1217 N PRO A 85 -7.870 -8.506 4.554 1.00 0.00 N ATOM 1218 CA PRO A 85 -6.447 -8.313 4.844 1.00 0.00 C ATOM 1219 C PRO A 85 -5.708 -9.665 4.820 1.00 0.00 C ATOM 1220 O PRO A 85 -6.277 -10.706 5.198 1.00 0.00 O ATOM 1221 CB PRO A 85 -6.463 -7.703 6.239 1.00 0.00 C ATOM 1222 CG PRO A 85 -7.699 -8.220 6.872 1.00 0.00 C ATOM 1223 CD PRO A 85 -8.705 -8.342 5.760 1.00 0.00 C ATOM 0 HA PRO A 85 -5.929 -7.685 4.119 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -5.579 -7.993 6.806 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -6.469 -6.614 6.193 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -7.522 -9.185 7.347 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -8.054 -7.543 7.649 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -9.366 -9.196 5.909 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -9.338 -7.457 5.693 1.00 0.00 H new ATOM 1231 N THR A 86 -4.475 -9.633 4.344 1.00 0.00 N ATOM 1232 CA THR A 86 -3.680 -10.841 4.109 1.00 0.00 C ATOM 1233 C THR A 86 -3.318 -11.568 5.425 1.00 0.00 C ATOM 1234 O THR A 86 -3.674 -11.128 6.524 1.00 0.00 O ATOM 1235 CB THR A 86 -2.383 -10.466 3.288 1.00 0.00 C ATOM 1236 OG1 THR A 86 -1.592 -11.622 2.947 1.00 0.00 O ATOM 1237 CG2 THR A 86 -1.510 -9.486 4.048 1.00 0.00 C ATOM 0 H THR A 86 -3.989 -8.768 4.107 1.00 0.00 H new ATOM 0 HA THR A 86 -4.284 -11.539 3.529 1.00 0.00 H new ATOM 0 HB THR A 86 -2.739 -10.004 2.367 1.00 0.00 H new ATOM 0 HG1 THR A 86 -0.803 -11.340 2.439 1.00 0.00 H new ATOM 0 HG21 THR A 86 -0.627 -9.250 3.455 1.00 0.00 H new ATOM 0 HG22 THR A 86 -2.072 -8.572 4.242 1.00 0.00 H new ATOM 0 HG23 THR A 86 -1.203 -9.931 4.995 1.00 0.00 H new ATOM 1245 N THR A 87 -2.552 -12.617 5.292 1.00 0.00 N ATOM 1246 CA THR A 87 -2.232 -13.491 6.363 1.00 0.00 C ATOM 1247 C THR A 87 -0.736 -13.522 6.619 1.00 0.00 C ATOM 1248 O THR A 87 -0.284 -13.375 7.755 1.00 0.00 O ATOM 1249 CB THR A 87 -2.709 -14.908 5.985 1.00 0.00 C ATOM 1250 OG1 THR A 87 -2.304 -15.177 4.616 1.00 0.00 O ATOM 1251 CG2 THR A 87 -4.224 -15.030 6.102 1.00 0.00 C ATOM 0 H THR A 87 -2.126 -12.886 4.405 1.00 0.00 H new ATOM 0 HA THR A 87 -2.724 -13.138 7.270 1.00 0.00 H new ATOM 0 HB THR A 87 -2.262 -15.629 6.669 1.00 0.00 H new ATOM 0 HG1 THR A 87 -2.598 -16.076 4.359 1.00 0.00 H new ATOM 0 HG21 THR A 87 -4.530 -16.040 5.829 1.00 0.00 H new ATOM 0 HG22 THR A 87 -4.527 -14.824 7.128 1.00 0.00 H new ATOM 0 HG23 THR A 87 -4.700 -14.313 5.432 1.00 0.00 H new ATOM 1259 N SER A 88 0.024 -13.710 5.569 1.00 0.00 N ATOM 1260 CA SER A 88 1.432 -13.873 5.704 1.00 0.00 C ATOM 1261 C SER A 88 2.197 -12.619 5.279 1.00 0.00 C ATOM 1262 O SER A 88 2.549 -11.815 6.118 1.00 0.00 O ATOM 1263 CB SER A 88 1.878 -15.112 4.920 1.00 0.00 C ATOM 1264 OG SER A 88 3.221 -15.483 5.216 1.00 0.00 O ATOM 0 H SER A 88 -0.321 -13.753 4.610 1.00 0.00 H new ATOM 0 HA SER A 88 1.667 -14.023 6.758 1.00 0.00 H new ATOM 0 HB2 SER A 88 1.214 -15.945 5.152 1.00 0.00 H new ATOM 0 HB3 SER A 88 1.784 -14.917 3.852 1.00 0.00 H new ATOM 0 HG SER A 88 3.463 -16.278 4.696 1.00 0.00 H new ATOM 1270 N GLU A 89 2.400 -12.452 3.978 1.00 0.00 N ATOM 1271 CA GLU A 89 3.183 -11.365 3.408 1.00 0.00 C ATOM 1272 C GLU A 89 3.047 -11.516 1.899 1.00 0.00 C ATOM 1273 O GLU A 89 2.208 -12.307 1.449 1.00 0.00 O ATOM 1274 CB GLU A 89 4.659 -11.543 3.810 1.00 0.00 C ATOM 1275 CG GLU A 89 5.327 -12.699 3.100 1.00 0.00 C ATOM 1276 CD GLU A 89 6.552 -13.186 3.798 1.00 0.00 C ATOM 1277 OE1 GLU A 89 6.438 -14.024 4.697 1.00 0.00 O ATOM 1278 OE2 GLU A 89 7.674 -12.769 3.435 1.00 0.00 O ATOM 0 H GLU A 89 2.016 -13.083 3.275 1.00 0.00 H new ATOM 0 HA GLU A 89 2.846 -10.387 3.752 1.00 0.00 H new ATOM 0 HB2 GLU A 89 5.203 -10.625 3.590 1.00 0.00 H new ATOM 0 HB3 GLU A 89 4.721 -11.700 4.887 1.00 0.00 H new ATOM 0 HG2 GLU A 89 4.617 -13.521 3.009 1.00 0.00 H new ATOM 0 HG3 GLU A 89 5.591 -12.392 2.088 1.00 0.00 H new ATOM 1285 N THR A 90 3.810 -10.787 1.134 1.00 0.00 N ATOM 1286 CA THR A 90 3.784 -10.945 -0.308 1.00 0.00 C ATOM 1287 C THR A 90 4.965 -11.763 -0.837 1.00 0.00 C ATOM 1288 O THR A 90 5.947 -11.963 -0.116 1.00 0.00 O ATOM 1289 CB THR A 90 3.732 -9.597 -1.015 1.00 0.00 C ATOM 1290 OG1 THR A 90 4.836 -8.783 -0.605 1.00 0.00 O ATOM 1291 CG2 THR A 90 2.435 -8.913 -0.722 1.00 0.00 C ATOM 0 H THR A 90 4.458 -10.077 1.475 1.00 0.00 H new ATOM 0 HA THR A 90 2.872 -11.500 -0.530 1.00 0.00 H new ATOM 0 HB THR A 90 3.803 -9.757 -2.091 1.00 0.00 H new ATOM 0 HG1 THR A 90 5.096 -8.190 -1.340 1.00 0.00 H new ATOM 0 HG21 THR A 90 2.408 -7.950 -1.232 1.00 0.00 H new ATOM 0 HG22 THR A 90 1.610 -9.533 -1.072 1.00 0.00 H new ATOM 0 HG23 THR A 90 2.341 -8.757 0.353 1.00 0.00 H new ATOM 1299 N PRO A 91 4.882 -12.250 -2.105 1.00 0.00 N ATOM 1300 CA PRO A 91 6.002 -12.932 -2.784 1.00 0.00 C ATOM 1301 C PRO A 91 7.241 -12.008 -2.927 1.00 0.00 C ATOM 1302 O PRO A 91 7.178 -10.795 -2.657 1.00 0.00 O ATOM 1303 CB PRO A 91 5.416 -13.266 -4.171 1.00 0.00 C ATOM 1304 CG PRO A 91 4.258 -12.351 -4.330 1.00 0.00 C ATOM 1305 CD PRO A 91 3.676 -12.230 -2.968 1.00 0.00 C ATOM 0 HA PRO A 91 6.355 -13.804 -2.233 1.00 0.00 H new ATOM 0 HB2 PRO A 91 6.153 -13.110 -4.959 1.00 0.00 H new ATOM 0 HB3 PRO A 91 5.105 -14.309 -4.227 1.00 0.00 H new ATOM 0 HG2 PRO A 91 4.572 -11.380 -4.713 1.00 0.00 H new ATOM 0 HG3 PRO A 91 3.531 -12.753 -5.036 1.00 0.00 H new ATOM 0 HD2 PRO A 91 3.107 -11.308 -2.850 1.00 0.00 H new ATOM 0 HD3 PRO A 91 3.000 -13.054 -2.740 1.00 0.00 H new ATOM 1313 N ARG A 92 8.339 -12.592 -3.377 1.00 0.00 N ATOM 1314 CA ARG A 92 9.637 -11.926 -3.455 1.00 0.00 C ATOM 1315 C ARG A 92 9.644 -10.923 -4.611 1.00 0.00 C ATOM 1316 O ARG A 92 9.482 -11.302 -5.773 1.00 0.00 O ATOM 1317 CB ARG A 92 10.722 -13.000 -3.664 1.00 0.00 C ATOM 1318 CG ARG A 92 12.136 -12.635 -3.199 1.00 0.00 C ATOM 1319 CD ARG A 92 12.833 -11.563 -4.051 1.00 0.00 C ATOM 1320 NE ARG A 92 13.067 -11.982 -5.442 1.00 0.00 N ATOM 1321 CZ ARG A 92 14.172 -11.684 -6.165 1.00 0.00 C ATOM 1322 NH1 ARG A 92 15.229 -11.101 -5.590 1.00 0.00 N ATOM 1323 NH2 ARG A 92 14.223 -11.990 -7.453 1.00 0.00 N ATOM 0 H ARG A 92 8.358 -13.558 -3.705 1.00 0.00 H new ATOM 0 HA ARG A 92 9.835 -11.379 -2.533 1.00 0.00 H new ATOM 0 HB2 ARG A 92 10.413 -13.905 -3.141 1.00 0.00 H new ATOM 0 HB3 ARG A 92 10.763 -13.243 -4.726 1.00 0.00 H new ATOM 0 HG2 ARG A 92 12.086 -12.285 -2.168 1.00 0.00 H new ATOM 0 HG3 ARG A 92 12.749 -13.536 -3.200 1.00 0.00 H new ATOM 0 HD2 ARG A 92 12.226 -10.657 -4.049 1.00 0.00 H new ATOM 0 HD3 ARG A 92 13.788 -11.308 -3.591 1.00 0.00 H new ATOM 0 HE ARG A 92 12.342 -12.539 -5.895 1.00 0.00 H new ATOM 0 HH11 ARG A 92 15.209 -10.876 -4.595 1.00 0.00 H new ATOM 0 HH12 ARG A 92 16.056 -10.882 -6.146 1.00 0.00 H new ATOM 0 HH21 ARG A 92 13.430 -12.450 -7.900 1.00 0.00 H new ATOM 0 HH22 ARG A 92 15.055 -11.766 -7.998 1.00 0.00 H new ATOM 1337 N VAL A 93 9.859 -9.668 -4.287 1.00 0.00 N ATOM 1338 CA VAL A 93 9.850 -8.574 -5.239 1.00 0.00 C ATOM 1339 C VAL A 93 11.004 -7.634 -4.908 1.00 0.00 C ATOM 1340 O VAL A 93 11.294 -7.371 -3.742 1.00 0.00 O ATOM 1341 CB VAL A 93 8.481 -7.796 -5.228 1.00 0.00 C ATOM 1342 CG1 VAL A 93 8.522 -6.558 -6.124 1.00 0.00 C ATOM 1343 CG2 VAL A 93 7.348 -8.710 -5.681 1.00 0.00 C ATOM 0 H VAL A 93 10.050 -9.370 -3.331 1.00 0.00 H new ATOM 0 HA VAL A 93 9.971 -8.980 -6.243 1.00 0.00 H new ATOM 0 HB VAL A 93 8.305 -7.469 -4.203 1.00 0.00 H new ATOM 0 HG11 VAL A 93 7.558 -6.050 -6.088 1.00 0.00 H new ATOM 0 HG12 VAL A 93 9.302 -5.881 -5.774 1.00 0.00 H new ATOM 0 HG13 VAL A 93 8.736 -6.858 -7.150 1.00 0.00 H new ATOM 0 HG21 VAL A 93 6.408 -8.158 -5.668 1.00 0.00 H new ATOM 0 HG22 VAL A 93 7.548 -9.063 -6.693 1.00 0.00 H new ATOM 0 HG23 VAL A 93 7.277 -9.563 -5.006 1.00 0.00 H new ATOM 1353 N VAL A 94 11.661 -7.165 -5.915 1.00 0.00 N ATOM 1354 CA VAL A 94 12.817 -6.335 -5.772 1.00 0.00 C ATOM 1355 C VAL A 94 12.788 -5.215 -6.821 1.00 0.00 C ATOM 1356 O VAL A 94 12.328 -5.415 -7.944 1.00 0.00 O ATOM 1357 CB VAL A 94 14.109 -7.216 -5.866 1.00 0.00 C ATOM 1358 CG1 VAL A 94 14.040 -8.135 -7.064 1.00 0.00 C ATOM 1359 CG2 VAL A 94 15.389 -6.385 -5.901 1.00 0.00 C ATOM 0 H VAL A 94 11.406 -7.351 -6.885 1.00 0.00 H new ATOM 0 HA VAL A 94 12.820 -5.856 -4.793 1.00 0.00 H new ATOM 0 HB VAL A 94 14.147 -7.816 -4.957 1.00 0.00 H new ATOM 0 HG11 VAL A 94 14.946 -8.739 -7.112 1.00 0.00 H new ATOM 0 HG12 VAL A 94 13.173 -8.789 -6.971 1.00 0.00 H new ATOM 0 HG13 VAL A 94 13.951 -7.541 -7.974 1.00 0.00 H new ATOM 0 HG21 VAL A 94 16.252 -7.048 -5.966 1.00 0.00 H new ATOM 0 HG22 VAL A 94 15.371 -5.726 -6.769 1.00 0.00 H new ATOM 0 HG23 VAL A 94 15.459 -5.787 -4.993 1.00 0.00 H new ATOM 1369 N TYR A 95 13.217 -4.042 -6.430 1.00 0.00 N ATOM 1370 CA TYR A 95 13.258 -2.883 -7.298 1.00 0.00 C ATOM 1371 C TYR A 95 14.633 -2.742 -7.899 1.00 0.00 C ATOM 1372 O TYR A 95 15.574 -2.351 -7.218 1.00 0.00 O ATOM 1373 CB TYR A 95 12.920 -1.599 -6.520 1.00 0.00 C ATOM 1374 CG TYR A 95 11.446 -1.299 -6.329 1.00 0.00 C ATOM 1375 CD1 TYR A 95 10.553 -2.244 -5.846 1.00 0.00 C ATOM 1376 CD2 TYR A 95 10.955 -0.035 -6.618 1.00 0.00 C ATOM 1377 CE1 TYR A 95 9.222 -1.934 -5.667 1.00 0.00 C ATOM 1378 CE2 TYR A 95 9.628 0.276 -6.439 1.00 0.00 C ATOM 1379 CZ TYR A 95 8.770 -0.673 -5.967 1.00 0.00 C ATOM 1380 OH TYR A 95 7.455 -0.365 -5.791 1.00 0.00 O ATOM 0 H TYR A 95 13.554 -3.858 -5.485 1.00 0.00 H new ATOM 0 HA TYR A 95 12.517 -3.025 -8.085 1.00 0.00 H new ATOM 0 HB2 TYR A 95 13.387 -1.661 -5.537 1.00 0.00 H new ATOM 0 HB3 TYR A 95 13.377 -0.755 -7.037 1.00 0.00 H new ATOM 0 HD1 TYR A 95 10.905 -3.236 -5.607 1.00 0.00 H new ATOM 0 HD2 TYR A 95 11.629 0.721 -6.992 1.00 0.00 H new ATOM 0 HE1 TYR A 95 8.537 -2.680 -5.292 1.00 0.00 H new ATOM 0 HE2 TYR A 95 9.267 1.267 -6.671 1.00 0.00 H new ATOM 0 HH TYR A 95 7.116 0.092 -6.589 1.00 0.00 H new ATOM 1390 N ASN A 96 14.769 -3.073 -9.156 1.00 0.00 N ATOM 1391 CA ASN A 96 16.054 -2.911 -9.840 1.00 0.00 C ATOM 1392 C ASN A 96 16.089 -1.555 -10.528 1.00 0.00 C ATOM 1393 O ASN A 96 16.392 -1.441 -11.725 1.00 0.00 O ATOM 1394 CB ASN A 96 16.330 -4.031 -10.867 1.00 0.00 C ATOM 1395 CG ASN A 96 16.623 -5.402 -10.264 1.00 0.00 C ATOM 1396 OD1 ASN A 96 17.411 -6.162 -10.811 1.00 0.00 O ATOM 1397 ND2 ASN A 96 15.979 -5.748 -9.181 1.00 0.00 N ATOM 0 H ASN A 96 14.021 -3.455 -9.735 1.00 0.00 H new ATOM 0 HA ASN A 96 16.838 -2.976 -9.085 1.00 0.00 H new ATOM 0 HB2 ASN A 96 15.467 -4.118 -11.527 1.00 0.00 H new ATOM 0 HB3 ASN A 96 17.177 -3.735 -11.486 1.00 0.00 H new ATOM 0 HD21 ASN A 96 16.128 -6.670 -8.772 1.00 0.00 H new ATOM 0 HD22 ASN A 96 15.328 -5.096 -8.745 1.00 0.00 H new ATOM 1404 N SER A 97 15.771 -0.544 -9.770 1.00 0.00 N ATOM 1405 CA SER A 97 15.657 0.802 -10.249 1.00 0.00 C ATOM 1406 C SER A 97 16.682 1.710 -9.569 1.00 0.00 C ATOM 1407 O SER A 97 17.489 1.244 -8.747 1.00 0.00 O ATOM 1408 CB SER A 97 14.236 1.276 -9.941 1.00 0.00 C ATOM 1409 OG SER A 97 13.890 0.965 -8.592 1.00 0.00 O ATOM 0 H SER A 97 15.579 -0.638 -8.773 1.00 0.00 H new ATOM 0 HA SER A 97 15.853 0.841 -11.321 1.00 0.00 H new ATOM 0 HB2 SER A 97 14.161 2.351 -10.104 1.00 0.00 H new ATOM 0 HB3 SER A 97 13.531 0.800 -10.623 1.00 0.00 H new ATOM 0 HG SER A 97 14.186 1.690 -8.003 1.00 0.00 H new ATOM 1415 N ARG A 98 16.690 2.974 -9.960 1.00 0.00 N ATOM 1416 CA ARG A 98 17.484 4.002 -9.309 1.00 0.00 C ATOM 1417 C ARG A 98 16.676 5.312 -9.338 1.00 0.00 C ATOM 1418 O ARG A 98 17.220 6.413 -9.483 1.00 0.00 O ATOM 1419 CB ARG A 98 18.837 4.182 -10.019 1.00 0.00 C ATOM 1420 CG ARG A 98 18.711 4.600 -11.465 1.00 0.00 C ATOM 1421 CD ARG A 98 20.035 4.897 -12.091 1.00 0.00 C ATOM 1422 NE ARG A 98 19.866 5.493 -13.419 1.00 0.00 N ATOM 1423 CZ ARG A 98 20.852 5.834 -14.253 1.00 0.00 C ATOM 1424 NH1 ARG A 98 22.121 5.559 -13.952 1.00 0.00 N ATOM 1425 NH2 ARG A 98 20.557 6.447 -15.394 1.00 0.00 N ATOM 0 H ARG A 98 16.139 3.318 -10.747 1.00 0.00 H new ATOM 0 HA ARG A 98 17.697 3.713 -8.280 1.00 0.00 H new ATOM 0 HB2 ARG A 98 19.422 4.929 -9.483 1.00 0.00 H new ATOM 0 HB3 ARG A 98 19.392 3.245 -9.967 1.00 0.00 H new ATOM 0 HG2 ARG A 98 18.216 3.808 -12.027 1.00 0.00 H new ATOM 0 HG3 ARG A 98 18.075 5.483 -11.531 1.00 0.00 H new ATOM 0 HD2 ARG A 98 20.599 5.577 -11.452 1.00 0.00 H new ATOM 0 HD3 ARG A 98 20.617 3.979 -12.172 1.00 0.00 H new ATOM 0 HE ARG A 98 18.911 5.662 -13.734 1.00 0.00 H new ATOM 0 HH11 ARG A 98 22.346 5.084 -13.078 1.00 0.00 H new ATOM 0 HH12 ARG A 98 22.867 5.824 -14.596 1.00 0.00 H new ATOM 0 HH21 ARG A 98 19.585 6.653 -15.626 1.00 0.00 H new ATOM 0 HH22 ARG A 98 21.302 6.712 -16.038 1.00 0.00 H new ATOM 1439 N THR A 99 15.381 5.177 -9.175 1.00 0.00 N ATOM 1440 CA THR A 99 14.453 6.278 -9.302 1.00 0.00 C ATOM 1441 C THR A 99 13.171 5.910 -8.539 1.00 0.00 C ATOM 1442 O THR A 99 13.041 4.764 -8.074 1.00 0.00 O ATOM 1443 CB THR A 99 14.151 6.557 -10.821 1.00 0.00 C ATOM 1444 OG1 THR A 99 13.280 7.677 -10.977 1.00 0.00 O ATOM 1445 CG2 THR A 99 13.533 5.346 -11.500 1.00 0.00 C ATOM 0 H THR A 99 14.936 4.288 -8.947 1.00 0.00 H new ATOM 0 HA THR A 99 14.878 7.189 -8.881 1.00 0.00 H new ATOM 0 HB THR A 99 15.107 6.777 -11.295 1.00 0.00 H new ATOM 0 HG1 THR A 99 13.110 7.829 -11.930 1.00 0.00 H new ATOM 0 HG21 THR A 99 13.338 5.576 -12.548 1.00 0.00 H new ATOM 0 HG22 THR A 99 14.220 4.502 -11.435 1.00 0.00 H new ATOM 0 HG23 THR A 99 12.596 5.090 -11.005 1.00 0.00 H new ATOM 1453 N ASP A 100 12.259 6.866 -8.397 1.00 0.00 N ATOM 1454 CA ASP A 100 11.002 6.652 -7.679 1.00 0.00 C ATOM 1455 C ASP A 100 10.069 5.846 -8.532 1.00 0.00 C ATOM 1456 O ASP A 100 9.408 6.383 -9.430 1.00 0.00 O ATOM 1457 CB ASP A 100 10.291 7.972 -7.317 1.00 0.00 C ATOM 1458 CG ASP A 100 10.952 8.819 -6.255 1.00 0.00 C ATOM 1459 OD1 ASP A 100 11.897 9.565 -6.566 1.00 0.00 O ATOM 1460 OD2 ASP A 100 10.479 8.820 -5.091 1.00 0.00 O ATOM 0 H ASP A 100 12.367 7.808 -8.774 1.00 0.00 H new ATOM 0 HA ASP A 100 11.253 6.132 -6.755 1.00 0.00 H new ATOM 0 HB2 ASP A 100 10.198 8.570 -8.223 1.00 0.00 H new ATOM 0 HB3 ASP A 100 9.280 7.736 -6.986 1.00 0.00 H new ATOM 1465 N LYS A 101 10.012 4.588 -8.265 1.00 0.00 N ATOM 1466 CA LYS A 101 9.146 3.698 -8.964 1.00 0.00 C ATOM 1467 C LYS A 101 7.902 3.496 -8.136 1.00 0.00 C ATOM 1468 O LYS A 101 7.976 3.421 -6.911 1.00 0.00 O ATOM 1469 CB LYS A 101 9.847 2.358 -9.199 1.00 0.00 C ATOM 1470 CG LYS A 101 9.983 1.993 -10.652 1.00 0.00 C ATOM 1471 CD LYS A 101 10.870 2.970 -11.375 1.00 0.00 C ATOM 1472 CE LYS A 101 10.825 2.764 -12.866 1.00 0.00 C ATOM 1473 NZ LYS A 101 11.188 1.393 -13.270 1.00 0.00 N ATOM 0 H LYS A 101 10.575 4.139 -7.543 1.00 0.00 H new ATOM 0 HA LYS A 101 8.882 4.119 -9.934 1.00 0.00 H new ATOM 0 HB2 LYS A 101 10.839 2.393 -8.748 1.00 0.00 H new ATOM 0 HB3 LYS A 101 9.291 1.573 -8.687 1.00 0.00 H new ATOM 0 HG2 LYS A 101 10.396 0.988 -10.741 1.00 0.00 H new ATOM 0 HG3 LYS A 101 8.999 1.976 -11.120 1.00 0.00 H new ATOM 0 HD2 LYS A 101 10.559 3.988 -11.139 1.00 0.00 H new ATOM 0 HD3 LYS A 101 11.896 2.860 -11.023 1.00 0.00 H new ATOM 0 HE2 LYS A 101 9.822 2.990 -13.228 1.00 0.00 H new ATOM 0 HE3 LYS A 101 11.504 3.470 -13.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 11.321 1.359 -14.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 12.071 1.114 -12.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 10.428 0.738 -12.997 1.00 0.00 H new ATOM 1487 N PRO A 102 6.737 3.463 -8.784 1.00 0.00 N ATOM 1488 CA PRO A 102 5.459 3.247 -8.110 1.00 0.00 C ATOM 1489 C PRO A 102 5.411 1.907 -7.386 1.00 0.00 C ATOM 1490 O PRO A 102 6.025 0.922 -7.836 1.00 0.00 O ATOM 1491 CB PRO A 102 4.448 3.262 -9.251 1.00 0.00 C ATOM 1492 CG PRO A 102 5.229 3.047 -10.488 1.00 0.00 C ATOM 1493 CD PRO A 102 6.560 3.658 -10.231 1.00 0.00 C ATOM 0 HA PRO A 102 5.271 3.999 -7.344 1.00 0.00 H new ATOM 0 HB2 PRO A 102 3.700 2.480 -9.120 1.00 0.00 H new ATOM 0 HB3 PRO A 102 3.913 4.211 -9.287 1.00 0.00 H new ATOM 0 HG2 PRO A 102 5.322 1.985 -10.713 1.00 0.00 H new ATOM 0 HG3 PRO A 102 4.742 3.513 -11.345 1.00 0.00 H new ATOM 0 HD2 PRO A 102 7.347 3.168 -10.804 1.00 0.00 H new ATOM 0 HD3 PRO A 102 6.579 4.714 -10.502 1.00 0.00 H new ATOM 1501 N TRP A 103 4.696 1.869 -6.288 1.00 0.00 N ATOM 1502 CA TRP A 103 4.587 0.676 -5.477 1.00 0.00 C ATOM 1503 C TRP A 103 3.338 -0.080 -5.926 1.00 0.00 C ATOM 1504 O TRP A 103 2.219 0.356 -5.660 1.00 0.00 O ATOM 1505 CB TRP A 103 4.521 1.074 -3.985 1.00 0.00 C ATOM 1506 CG TRP A 103 4.703 -0.065 -3.022 1.00 0.00 C ATOM 1507 CD1 TRP A 103 5.749 -0.933 -2.986 1.00 0.00 C ATOM 1508 CD2 TRP A 103 3.849 -0.428 -1.925 1.00 0.00 C ATOM 1509 NE1 TRP A 103 5.580 -1.830 -1.965 1.00 0.00 N ATOM 1510 CE2 TRP A 103 4.432 -1.544 -1.300 1.00 0.00 C ATOM 1511 CE3 TRP A 103 2.646 0.066 -1.421 1.00 0.00 C ATOM 1512 CZ2 TRP A 103 3.861 -2.170 -0.197 1.00 0.00 C ATOM 1513 CZ3 TRP A 103 2.076 -0.562 -0.318 1.00 0.00 C ATOM 1514 CH2 TRP A 103 2.690 -1.667 0.275 1.00 0.00 C ATOM 0 H TRP A 103 4.171 2.666 -5.929 1.00 0.00 H new ATOM 0 HA TRP A 103 5.454 0.027 -5.599 1.00 0.00 H new ATOM 0 HB2 TRP A 103 5.288 1.824 -3.789 1.00 0.00 H new ATOM 0 HB3 TRP A 103 3.557 1.545 -3.791 1.00 0.00 H new ATOM 0 HD1 TRP A 103 6.590 -0.917 -3.663 1.00 0.00 H new ATOM 0 HE1 TRP A 103 6.217 -2.594 -1.740 1.00 0.00 H new ATOM 0 HE3 TRP A 103 2.166 0.919 -1.878 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 4.331 -3.024 0.267 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 1.146 -0.190 0.085 1.00 0.00 H new ATOM 0 HH2 TRP A 103 2.223 -2.133 1.130 1.00 0.00 H new ATOM 1525 N PRO A 104 3.508 -1.206 -6.643 1.00 0.00 N ATOM 1526 CA PRO A 104 2.388 -1.911 -7.248 1.00 0.00 C ATOM 1527 C PRO A 104 1.585 -2.730 -6.249 1.00 0.00 C ATOM 1528 O PRO A 104 1.847 -3.916 -6.035 1.00 0.00 O ATOM 1529 CB PRO A 104 3.052 -2.821 -8.282 1.00 0.00 C ATOM 1530 CG PRO A 104 4.440 -3.054 -7.778 1.00 0.00 C ATOM 1531 CD PRO A 104 4.796 -1.895 -6.882 1.00 0.00 C ATOM 0 HA PRO A 104 1.664 -1.216 -7.673 1.00 0.00 H new ATOM 0 HB2 PRO A 104 2.509 -3.761 -8.384 1.00 0.00 H new ATOM 0 HB3 PRO A 104 3.066 -2.352 -9.266 1.00 0.00 H new ATOM 0 HG2 PRO A 104 4.496 -3.994 -7.229 1.00 0.00 H new ATOM 0 HG3 PRO A 104 5.142 -3.127 -8.608 1.00 0.00 H new ATOM 0 HD2 PRO A 104 5.243 -2.237 -5.949 1.00 0.00 H new ATOM 0 HD3 PRO A 104 5.519 -1.232 -7.358 1.00 0.00 H new ATOM 1539 N VAL A 105 0.606 -2.101 -5.654 1.00 0.00 N ATOM 1540 CA VAL A 105 -0.279 -2.735 -4.713 1.00 0.00 C ATOM 1541 C VAL A 105 -1.654 -2.220 -4.974 1.00 0.00 C ATOM 1542 O VAL A 105 -1.810 -1.080 -5.382 1.00 0.00 O ATOM 1543 CB VAL A 105 0.109 -2.420 -3.234 1.00 0.00 C ATOM 1544 CG1 VAL A 105 -0.840 -3.089 -2.244 1.00 0.00 C ATOM 1545 CG2 VAL A 105 1.498 -2.881 -2.970 1.00 0.00 C ATOM 0 H VAL A 105 0.398 -1.115 -5.813 1.00 0.00 H new ATOM 0 HA VAL A 105 -0.215 -3.815 -4.843 1.00 0.00 H new ATOM 0 HB VAL A 105 0.037 -1.341 -3.097 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -0.535 -2.845 -1.226 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -1.855 -2.731 -2.415 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -0.808 -4.170 -2.383 1.00 0.00 H new ATOM 0 HG21 VAL A 105 1.765 -2.659 -1.937 1.00 0.00 H new ATOM 0 HG22 VAL A 105 1.563 -3.956 -3.139 1.00 0.00 H new ATOM 0 HG23 VAL A 105 2.186 -2.366 -3.641 1.00 0.00 H new ATOM 1555 N ALA A 106 -2.633 -3.039 -4.779 1.00 0.00 N ATOM 1556 CA ALA A 106 -3.984 -2.625 -4.952 1.00 0.00 C ATOM 1557 C ALA A 106 -4.896 -3.396 -4.058 1.00 0.00 C ATOM 1558 O ALA A 106 -4.768 -4.610 -3.930 1.00 0.00 O ATOM 1559 CB ALA A 106 -4.417 -2.756 -6.378 1.00 0.00 C ATOM 0 H ALA A 106 -2.519 -4.012 -4.496 1.00 0.00 H new ATOM 0 HA ALA A 106 -4.041 -1.571 -4.679 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -5.453 -2.432 -6.475 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -3.782 -2.135 -7.010 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.332 -3.797 -6.690 1.00 0.00 H new ATOM 1565 N LEU A 107 -5.790 -2.704 -3.423 1.00 0.00 N ATOM 1566 CA LEU A 107 -6.729 -3.339 -2.538 1.00 0.00 C ATOM 1567 C LEU A 107 -8.072 -3.487 -3.251 1.00 0.00 C ATOM 1568 O LEU A 107 -8.816 -2.524 -3.370 1.00 0.00 O ATOM 1569 CB LEU A 107 -6.934 -2.516 -1.247 1.00 0.00 C ATOM 1570 CG LEU A 107 -5.692 -2.019 -0.486 1.00 0.00 C ATOM 1571 CD1 LEU A 107 -6.094 -1.432 0.843 1.00 0.00 C ATOM 1572 CD2 LEU A 107 -4.702 -3.123 -0.285 1.00 0.00 C ATOM 0 H LEU A 107 -5.893 -1.692 -3.499 1.00 0.00 H new ATOM 0 HA LEU A 107 -6.330 -4.315 -2.264 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -7.537 -1.644 -1.502 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -7.524 -3.121 -0.559 1.00 0.00 H new ATOM 0 HG LEU A 107 -5.217 -1.244 -1.088 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -5.206 -1.084 1.371 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -6.771 -0.593 0.680 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -6.596 -2.193 1.440 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -3.836 -2.741 0.255 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -5.164 -3.925 0.290 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -4.384 -3.508 -1.254 1.00 0.00 H new ATOM 1584 N TYR A 108 -8.353 -4.656 -3.758 1.00 0.00 N ATOM 1585 CA TYR A 108 -9.638 -4.933 -4.414 1.00 0.00 C ATOM 1586 C TYR A 108 -10.715 -5.247 -3.365 1.00 0.00 C ATOM 1587 O TYR A 108 -11.050 -6.410 -3.141 1.00 0.00 O ATOM 1588 CB TYR A 108 -9.527 -6.140 -5.369 1.00 0.00 C ATOM 1589 CG TYR A 108 -8.684 -5.917 -6.594 1.00 0.00 C ATOM 1590 CD1 TYR A 108 -7.306 -5.937 -6.525 1.00 0.00 C ATOM 1591 CD2 TYR A 108 -9.276 -5.699 -7.832 1.00 0.00 C ATOM 1592 CE1 TYR A 108 -6.538 -5.746 -7.645 1.00 0.00 C ATOM 1593 CE2 TYR A 108 -8.510 -5.505 -8.964 1.00 0.00 C ATOM 1594 CZ TYR A 108 -7.138 -5.530 -8.865 1.00 0.00 C ATOM 1595 OH TYR A 108 -6.358 -5.344 -9.994 1.00 0.00 O ATOM 0 H TYR A 108 -7.714 -5.451 -3.738 1.00 0.00 H new ATOM 0 HA TYR A 108 -9.911 -4.044 -4.983 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -9.116 -6.984 -4.815 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -10.530 -6.425 -5.686 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -6.824 -6.106 -5.573 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -10.353 -5.681 -7.910 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -5.461 -5.765 -7.570 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -8.984 -5.335 -9.919 1.00 0.00 H new ATOM 0 HH TYR A 108 -6.937 -5.205 -10.772 1.00 0.00 H new ATOM 1605 N LEU A 109 -11.217 -4.241 -2.701 1.00 0.00 N ATOM 1606 CA LEU A 109 -12.299 -4.437 -1.753 1.00 0.00 C ATOM 1607 C LEU A 109 -13.582 -4.027 -2.379 1.00 0.00 C ATOM 1608 O LEU A 109 -13.720 -2.905 -2.837 1.00 0.00 O ATOM 1609 CB LEU A 109 -12.107 -3.693 -0.427 1.00 0.00 C ATOM 1610 CG LEU A 109 -11.107 -4.259 0.561 1.00 0.00 C ATOM 1611 CD1 LEU A 109 -11.289 -5.750 0.760 1.00 0.00 C ATOM 1612 CD2 LEU A 109 -9.721 -3.896 0.182 1.00 0.00 C ATOM 0 H LEU A 109 -10.900 -3.276 -2.793 1.00 0.00 H new ATOM 0 HA LEU A 109 -12.307 -5.498 -1.505 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -11.809 -2.670 -0.657 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -13.075 -3.639 0.070 1.00 0.00 H new ATOM 0 HG LEU A 109 -11.301 -3.802 1.531 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -10.552 -6.114 1.476 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -12.292 -5.947 1.140 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -11.155 -6.263 -0.192 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -9.024 -4.315 0.908 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -9.498 -4.295 -0.808 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -9.620 -2.811 0.167 1.00 0.00 H new ATOM 1624 N THR A 110 -14.527 -4.901 -2.380 1.00 0.00 N ATOM 1625 CA THR A 110 -15.731 -4.634 -3.039 1.00 0.00 C ATOM 1626 C THR A 110 -16.887 -4.846 -2.080 1.00 0.00 C ATOM 1627 O THR A 110 -16.793 -5.654 -1.163 1.00 0.00 O ATOM 1628 CB THR A 110 -15.821 -5.516 -4.305 1.00 0.00 C ATOM 1629 OG1 THR A 110 -16.166 -4.684 -5.399 1.00 0.00 O ATOM 1630 CG2 THR A 110 -16.843 -6.657 -4.169 1.00 0.00 C ATOM 0 H THR A 110 -14.476 -5.812 -1.924 1.00 0.00 H new ATOM 0 HA THR A 110 -15.778 -3.595 -3.367 1.00 0.00 H new ATOM 0 HB THR A 110 -14.852 -5.990 -4.460 1.00 0.00 H new ATOM 0 HG1 THR A 110 -16.791 -5.158 -5.986 1.00 0.00 H new ATOM 0 HG21 THR A 110 -16.861 -7.241 -5.089 1.00 0.00 H new ATOM 0 HG22 THR A 110 -16.561 -7.301 -3.336 1.00 0.00 H new ATOM 0 HG23 THR A 110 -17.833 -6.239 -3.985 1.00 0.00 H new ATOM 1638 N PRO A 111 -17.958 -4.075 -2.250 1.00 0.00 N ATOM 1639 CA PRO A 111 -19.105 -4.111 -1.371 1.00 0.00 C ATOM 1640 C PRO A 111 -19.803 -5.437 -1.349 1.00 0.00 C ATOM 1641 O PRO A 111 -20.213 -5.978 -2.400 1.00 0.00 O ATOM 1642 CB PRO A 111 -20.052 -3.080 -1.949 1.00 0.00 C ATOM 1643 CG PRO A 111 -19.611 -2.923 -3.351 1.00 0.00 C ATOM 1644 CD PRO A 111 -18.137 -3.103 -3.327 1.00 0.00 C ATOM 0 HA PRO A 111 -18.792 -3.922 -0.344 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -21.087 -3.416 -1.893 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -19.993 -2.137 -1.406 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -20.086 -3.662 -3.997 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -19.880 -1.941 -3.739 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -17.758 -3.476 -4.278 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -17.617 -2.168 -3.121 1.00 0.00 H new ATOM 1652 N VAL A 112 -19.909 -5.962 -0.177 1.00 0.00 N ATOM 1653 CA VAL A 112 -20.678 -7.101 0.079 1.00 0.00 C ATOM 1654 C VAL A 112 -22.119 -6.670 0.340 1.00 0.00 C ATOM 1655 O VAL A 112 -22.492 -5.560 0.029 1.00 0.00 O ATOM 1656 CB VAL A 112 -20.109 -7.901 1.274 1.00 0.00 C ATOM 1657 CG1 VAL A 112 -18.785 -8.505 0.893 1.00 0.00 C ATOM 1658 CG2 VAL A 112 -19.944 -7.010 2.498 1.00 0.00 C ATOM 0 H VAL A 112 -19.442 -5.587 0.648 1.00 0.00 H new ATOM 0 HA VAL A 112 -20.648 -7.762 -0.787 1.00 0.00 H new ATOM 0 HB VAL A 112 -20.812 -8.695 1.526 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -18.386 -9.068 1.737 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -18.921 -9.173 0.042 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -18.087 -7.712 0.624 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -19.542 -7.597 3.324 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -19.259 -6.195 2.265 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -20.913 -6.599 2.782 1.00 0.00 H new ATOM 1668 N SER A 113 -22.852 -7.452 0.990 1.00 0.00 N ATOM 1669 CA SER A 113 -24.261 -7.230 1.129 1.00 0.00 C ATOM 1670 C SER A 113 -24.498 -6.219 2.250 1.00 0.00 C ATOM 1671 O SER A 113 -25.466 -5.455 2.241 1.00 0.00 O ATOM 1672 CB SER A 113 -24.999 -8.566 1.368 1.00 0.00 C ATOM 1673 OG SER A 113 -26.414 -8.428 1.290 1.00 0.00 O ATOM 0 H SER A 113 -22.511 -8.290 1.461 1.00 0.00 H new ATOM 0 HA SER A 113 -24.669 -6.813 0.208 1.00 0.00 H new ATOM 0 HB2 SER A 113 -24.667 -9.298 0.631 1.00 0.00 H new ATOM 0 HB3 SER A 113 -24.729 -8.956 2.349 1.00 0.00 H new ATOM 0 HG SER A 113 -26.837 -9.298 1.446 1.00 0.00 H new ATOM 1679 N SER A 114 -23.547 -6.150 3.151 1.00 0.00 N ATOM 1680 CA SER A 114 -23.586 -5.235 4.254 1.00 0.00 C ATOM 1681 C SER A 114 -23.126 -3.828 3.805 1.00 0.00 C ATOM 1682 O SER A 114 -22.760 -2.984 4.624 1.00 0.00 O ATOM 1683 CB SER A 114 -22.704 -5.774 5.390 1.00 0.00 C ATOM 1684 OG SER A 114 -22.792 -4.974 6.566 1.00 0.00 O ATOM 0 H SER A 114 -22.714 -6.739 3.133 1.00 0.00 H new ATOM 0 HA SER A 114 -24.609 -5.144 4.618 1.00 0.00 H new ATOM 0 HB2 SER A 114 -23.001 -6.796 5.625 1.00 0.00 H new ATOM 0 HB3 SER A 114 -21.667 -5.813 5.056 1.00 0.00 H new ATOM 0 HG SER A 114 -22.746 -4.026 6.321 1.00 0.00 H new ATOM 1690 N ALA A 115 -23.143 -3.592 2.521 1.00 0.00 N ATOM 1691 CA ALA A 115 -22.759 -2.339 1.971 1.00 0.00 C ATOM 1692 C ALA A 115 -23.983 -1.593 1.492 1.00 0.00 C ATOM 1693 O ALA A 115 -24.900 -2.200 0.927 1.00 0.00 O ATOM 1694 CB ALA A 115 -21.794 -2.570 0.840 1.00 0.00 C ATOM 0 H ALA A 115 -23.430 -4.281 1.825 1.00 0.00 H new ATOM 0 HA ALA A 115 -22.269 -1.734 2.733 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -21.496 -1.612 0.414 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -20.912 -3.090 1.214 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -22.273 -3.175 0.071 1.00 0.00 H new ATOM 1700 N GLY A 116 -24.017 -0.306 1.741 1.00 0.00 N ATOM 1701 CA GLY A 116 -25.132 0.505 1.322 1.00 0.00 C ATOM 1702 C GLY A 116 -24.970 1.930 1.782 1.00 0.00 C ATOM 1703 O GLY A 116 -24.763 2.183 2.970 1.00 0.00 O ATOM 0 H GLY A 116 -23.282 0.202 2.233 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -25.217 0.478 0.236 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -26.057 0.093 1.725 1.00 0.00 H new ATOM 1707 N GLY A 117 -25.043 2.845 0.849 1.00 0.00 N ATOM 1708 CA GLY A 117 -24.832 4.251 1.120 1.00 0.00 C ATOM 1709 C GLY A 117 -23.404 4.531 1.469 1.00 0.00 C ATOM 1710 O GLY A 117 -22.525 3.842 0.972 1.00 0.00 O ATOM 0 H GLY A 117 -25.252 2.638 -0.128 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -25.117 4.838 0.247 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -25.477 4.566 1.940 1.00 0.00 H new ATOM 1714 N VAL A 118 -23.164 5.530 2.294 1.00 0.00 N ATOM 1715 CA VAL A 118 -21.804 5.930 2.638 1.00 0.00 C ATOM 1716 C VAL A 118 -21.040 4.777 3.273 1.00 0.00 C ATOM 1717 O VAL A 118 -21.300 4.374 4.416 1.00 0.00 O ATOM 1718 CB VAL A 118 -21.764 7.172 3.559 1.00 0.00 C ATOM 1719 CG1 VAL A 118 -20.326 7.563 3.885 1.00 0.00 C ATOM 1720 CG2 VAL A 118 -22.494 8.341 2.912 1.00 0.00 C ATOM 0 H VAL A 118 -23.893 6.085 2.743 1.00 0.00 H new ATOM 0 HA VAL A 118 -21.317 6.206 1.703 1.00 0.00 H new ATOM 0 HB VAL A 118 -22.269 6.917 4.491 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -20.325 8.439 4.534 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -19.830 6.735 4.392 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -19.794 7.794 2.962 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -22.455 9.206 3.575 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -22.016 8.589 1.964 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -23.534 8.067 2.734 1.00 0.00 H new ATOM 1730 N ALA A 119 -20.148 4.219 2.499 1.00 0.00 N ATOM 1731 CA ALA A 119 -19.357 3.099 2.939 1.00 0.00 C ATOM 1732 C ALA A 119 -17.942 3.518 3.238 1.00 0.00 C ATOM 1733 O ALA A 119 -17.312 2.986 4.153 1.00 0.00 O ATOM 1734 CB ALA A 119 -19.384 1.998 1.911 1.00 0.00 C ATOM 0 H ALA A 119 -19.949 4.527 1.547 1.00 0.00 H new ATOM 0 HA ALA A 119 -19.793 2.718 3.863 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -18.781 1.160 2.260 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -20.411 1.668 1.759 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -18.979 2.369 0.970 1.00 0.00 H new ATOM 1740 N ILE A 120 -17.436 4.462 2.481 1.00 0.00 N ATOM 1741 CA ILE A 120 -16.103 4.973 2.709 1.00 0.00 C ATOM 1742 C ILE A 120 -16.188 6.456 3.007 1.00 0.00 C ATOM 1743 O ILE A 120 -16.955 7.165 2.368 1.00 0.00 O ATOM 1744 CB ILE A 120 -15.171 4.732 1.478 1.00 0.00 C ATOM 1745 CG1 ILE A 120 -14.934 3.241 1.240 1.00 0.00 C ATOM 1746 CG2 ILE A 120 -13.862 5.457 1.617 1.00 0.00 C ATOM 1747 CD1 ILE A 120 -14.064 2.942 0.030 1.00 0.00 C ATOM 0 H ILE A 120 -17.928 4.894 1.699 1.00 0.00 H new ATOM 0 HA ILE A 120 -15.671 4.440 3.556 1.00 0.00 H new ATOM 0 HB ILE A 120 -15.687 5.139 0.608 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -14.467 2.811 2.126 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -15.897 2.745 1.115 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -13.244 5.263 0.741 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -14.046 6.528 1.701 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -13.345 5.107 2.510 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -13.942 1.864 -0.073 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -14.539 3.340 -0.867 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -13.087 3.407 0.161 1.00 0.00 H new ATOM 1759 N LYS A 121 -15.445 6.900 3.982 1.00 0.00 N ATOM 1760 CA LYS A 121 -15.381 8.294 4.331 1.00 0.00 C ATOM 1761 C LYS A 121 -14.005 8.847 4.043 1.00 0.00 C ATOM 1762 O LYS A 121 -12.996 8.200 4.304 1.00 0.00 O ATOM 1763 CB LYS A 121 -15.733 8.501 5.795 1.00 0.00 C ATOM 1764 CG LYS A 121 -17.227 8.544 6.133 1.00 0.00 C ATOM 1765 CD LYS A 121 -17.850 9.942 5.935 1.00 0.00 C ATOM 1766 CE LYS A 121 -18.126 10.307 4.483 1.00 0.00 C ATOM 1767 NZ LYS A 121 -18.705 11.663 4.353 1.00 0.00 N ATOM 0 H LYS A 121 -14.861 6.299 4.563 1.00 0.00 H new ATOM 0 HA LYS A 121 -16.110 8.830 3.723 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -15.274 7.700 6.374 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -15.280 9.435 6.127 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -17.756 7.825 5.508 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -17.369 8.232 7.168 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -18.785 9.992 6.494 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -17.182 10.688 6.364 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -17.199 10.253 3.913 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -18.810 9.578 4.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -18.878 11.872 3.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -19.603 11.709 4.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -18.042 12.363 4.743 1.00 0.00 H new ATOM 1781 N ALA A 122 -13.979 10.039 3.504 1.00 0.00 N ATOM 1782 CA ALA A 122 -12.749 10.721 3.170 1.00 0.00 C ATOM 1783 C ALA A 122 -12.057 11.185 4.432 1.00 0.00 C ATOM 1784 O ALA A 122 -12.716 11.685 5.370 1.00 0.00 O ATOM 1785 CB ALA A 122 -13.036 11.907 2.272 1.00 0.00 C ATOM 0 H ALA A 122 -14.820 10.572 3.281 1.00 0.00 H new ATOM 0 HA ALA A 122 -12.096 10.028 2.640 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -12.102 12.413 2.027 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -13.513 11.562 1.355 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -13.700 12.601 2.787 1.00 0.00 H new ATOM 1791 N GLY A 123 -10.759 11.009 4.468 1.00 0.00 N ATOM 1792 CA GLY A 123 -9.968 11.386 5.615 1.00 0.00 C ATOM 1793 C GLY A 123 -10.004 10.332 6.693 1.00 0.00 C ATOM 1794 O GLY A 123 -9.474 10.523 7.785 1.00 0.00 O ATOM 0 H GLY A 123 -10.221 10.601 3.704 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -8.936 11.554 5.305 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -10.338 12.329 6.017 1.00 0.00 H new ATOM 1798 N SER A 124 -10.631 9.233 6.397 1.00 0.00 N ATOM 1799 CA SER A 124 -10.737 8.157 7.319 1.00 0.00 C ATOM 1800 C SER A 124 -9.792 7.045 6.917 1.00 0.00 C ATOM 1801 O SER A 124 -9.576 6.791 5.715 1.00 0.00 O ATOM 1802 CB SER A 124 -12.175 7.664 7.348 1.00 0.00 C ATOM 1803 OG SER A 124 -13.051 8.737 7.696 1.00 0.00 O ATOM 0 H SER A 124 -11.085 9.063 5.500 1.00 0.00 H new ATOM 0 HA SER A 124 -10.461 8.494 8.318 1.00 0.00 H new ATOM 0 HB2 SER A 124 -12.450 7.260 6.373 1.00 0.00 H new ATOM 0 HB3 SER A 124 -12.276 6.853 8.069 1.00 0.00 H new ATOM 0 HG SER A 124 -13.901 8.373 8.021 1.00 0.00 H new ATOM 1809 N LEU A 125 -9.186 6.440 7.918 1.00 0.00 N ATOM 1810 CA LEU A 125 -8.282 5.332 7.743 1.00 0.00 C ATOM 1811 C LEU A 125 -9.083 4.140 7.239 1.00 0.00 C ATOM 1812 O LEU A 125 -10.067 3.731 7.869 1.00 0.00 O ATOM 1813 CB LEU A 125 -7.594 5.043 9.111 1.00 0.00 C ATOM 1814 CG LEU A 125 -6.439 4.017 9.186 1.00 0.00 C ATOM 1815 CD1 LEU A 125 -6.904 2.606 8.964 1.00 0.00 C ATOM 1816 CD2 LEU A 125 -5.341 4.373 8.217 1.00 0.00 C ATOM 0 H LEU A 125 -9.313 6.713 8.892 1.00 0.00 H new ATOM 0 HA LEU A 125 -7.503 5.550 7.012 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -7.213 5.991 9.490 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -8.369 4.712 9.802 1.00 0.00 H new ATOM 0 HG LEU A 125 -6.043 4.065 10.200 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -6.053 1.928 9.027 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -7.637 2.340 9.726 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -7.360 2.524 7.977 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -4.540 3.637 8.288 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -5.739 4.379 7.202 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -4.949 5.361 8.459 1.00 0.00 H new ATOM 1828 N ILE A 126 -8.679 3.609 6.119 1.00 0.00 N ATOM 1829 CA ILE A 126 -9.374 2.491 5.524 1.00 0.00 C ATOM 1830 C ILE A 126 -8.547 1.210 5.568 1.00 0.00 C ATOM 1831 O ILE A 126 -9.098 0.108 5.563 1.00 0.00 O ATOM 1832 CB ILE A 126 -9.798 2.769 4.066 1.00 0.00 C ATOM 1833 CG1 ILE A 126 -8.609 3.227 3.214 1.00 0.00 C ATOM 1834 CG2 ILE A 126 -10.956 3.761 4.009 1.00 0.00 C ATOM 1835 CD1 ILE A 126 -8.884 3.294 1.732 1.00 0.00 C ATOM 0 H ILE A 126 -7.867 3.932 5.593 1.00 0.00 H new ATOM 0 HA ILE A 126 -10.271 2.354 6.128 1.00 0.00 H new ATOM 0 HB ILE A 126 -10.153 1.832 3.638 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -8.293 4.212 3.556 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -7.774 2.547 3.384 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -11.233 3.938 2.970 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -11.811 3.353 4.548 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -10.652 4.702 4.468 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -7.987 3.627 1.210 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -9.169 2.306 1.370 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -9.695 3.997 1.544 1.00 0.00 H new ATOM 1847 N ALA A 127 -7.233 1.349 5.605 1.00 0.00 N ATOM 1848 CA ALA A 127 -6.353 0.205 5.611 1.00 0.00 C ATOM 1849 C ALA A 127 -4.988 0.607 6.100 1.00 0.00 C ATOM 1850 O ALA A 127 -4.691 1.785 6.213 1.00 0.00 O ATOM 1851 CB ALA A 127 -6.241 -0.386 4.215 1.00 0.00 C ATOM 0 H ALA A 127 -6.755 2.250 5.631 1.00 0.00 H new ATOM 0 HA ALA A 127 -6.769 -0.547 6.281 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -5.574 -1.248 4.237 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -7.227 -0.699 3.872 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -5.842 0.365 3.533 1.00 0.00 H new ATOM 1857 N VAL A 128 -4.169 -0.365 6.376 1.00 0.00 N ATOM 1858 CA VAL A 128 -2.811 -0.165 6.848 1.00 0.00 C ATOM 1859 C VAL A 128 -1.946 -1.220 6.223 1.00 0.00 C ATOM 1860 O VAL A 128 -2.154 -2.411 6.449 1.00 0.00 O ATOM 1861 CB VAL A 128 -2.691 -0.269 8.403 1.00 0.00 C ATOM 1862 CG1 VAL A 128 -1.236 -0.243 8.844 1.00 0.00 C ATOM 1863 CG2 VAL A 128 -3.446 0.851 9.082 1.00 0.00 C ATOM 0 H VAL A 128 -4.424 -1.348 6.280 1.00 0.00 H new ATOM 0 HA VAL A 128 -2.498 0.841 6.567 1.00 0.00 H new ATOM 0 HB VAL A 128 -3.131 -1.222 8.698 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -1.184 -0.317 9.930 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -0.705 -1.084 8.397 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -0.775 0.690 8.521 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -3.346 0.754 10.163 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -3.038 1.810 8.764 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -4.500 0.797 8.809 1.00 0.00 H new ATOM 1873 N LEU A 129 -1.041 -0.810 5.406 1.00 0.00 N ATOM 1874 CA LEU A 129 -0.145 -1.728 4.776 1.00 0.00 C ATOM 1875 C LEU A 129 1.244 -1.429 5.234 1.00 0.00 C ATOM 1876 O LEU A 129 1.573 -0.284 5.472 1.00 0.00 O ATOM 1877 CB LEU A 129 -0.240 -1.565 3.282 1.00 0.00 C ATOM 1878 CG LEU A 129 -1.642 -1.667 2.712 1.00 0.00 C ATOM 1879 CD1 LEU A 129 -1.612 -1.454 1.255 1.00 0.00 C ATOM 1880 CD2 LEU A 129 -2.263 -3.000 3.016 1.00 0.00 C ATOM 0 H LEU A 129 -0.897 0.167 5.153 1.00 0.00 H new ATOM 0 HA LEU A 129 -0.404 -2.753 5.040 1.00 0.00 H new ATOM 0 HB2 LEU A 129 0.176 -0.595 3.011 1.00 0.00 H new ATOM 0 HB3 LEU A 129 0.384 -2.323 2.809 1.00 0.00 H new ATOM 0 HG LEU A 129 -2.250 -0.894 3.182 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -2.623 -1.529 0.855 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -1.210 -0.464 1.040 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -0.981 -2.211 0.790 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -3.267 -3.039 2.593 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -1.655 -3.793 2.580 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -2.319 -3.138 4.096 1.00 0.00 H new ATOM 1892 N ILE A 130 2.045 -2.425 5.407 1.00 0.00 N ATOM 1893 CA ILE A 130 3.397 -2.182 5.813 1.00 0.00 C ATOM 1894 C ILE A 130 4.352 -2.804 4.830 1.00 0.00 C ATOM 1895 O ILE A 130 4.294 -3.996 4.577 1.00 0.00 O ATOM 1896 CB ILE A 130 3.737 -2.713 7.231 1.00 0.00 C ATOM 1897 CG1 ILE A 130 2.772 -2.179 8.303 1.00 0.00 C ATOM 1898 CG2 ILE A 130 5.175 -2.382 7.583 1.00 0.00 C ATOM 1899 CD1 ILE A 130 1.562 -3.053 8.521 1.00 0.00 C ATOM 0 H ILE A 130 1.797 -3.406 5.277 1.00 0.00 H new ATOM 0 HA ILE A 130 3.503 -1.097 5.840 1.00 0.00 H new ATOM 0 HB ILE A 130 3.616 -3.796 7.213 1.00 0.00 H new ATOM 0 HG12 ILE A 130 3.310 -2.078 9.245 1.00 0.00 H new ATOM 0 HG13 ILE A 130 2.441 -1.181 8.016 1.00 0.00 H new ATOM 0 HG21 ILE A 130 5.402 -2.760 8.580 1.00 0.00 H new ATOM 0 HG22 ILE A 130 5.843 -2.847 6.858 1.00 0.00 H new ATOM 0 HG23 ILE A 130 5.315 -1.301 7.564 1.00 0.00 H new ATOM 0 HD11 ILE A 130 0.929 -2.612 9.291 1.00 0.00 H new ATOM 0 HD12 ILE A 130 1.000 -3.134 7.591 1.00 0.00 H new ATOM 0 HD13 ILE A 130 1.882 -4.045 8.839 1.00 0.00 H new ATOM 1911 N LEU A 131 5.213 -2.015 4.287 1.00 0.00 N ATOM 1912 CA LEU A 131 6.212 -2.507 3.393 1.00 0.00 C ATOM 1913 C LEU A 131 7.432 -2.904 4.185 1.00 0.00 C ATOM 1914 O LEU A 131 7.831 -2.206 5.103 1.00 0.00 O ATOM 1915 CB LEU A 131 6.497 -1.473 2.271 1.00 0.00 C ATOM 1916 CG LEU A 131 7.952 -1.040 1.984 1.00 0.00 C ATOM 1917 CD1 LEU A 131 7.991 -0.254 0.688 1.00 0.00 C ATOM 1918 CD2 LEU A 131 8.499 -0.120 3.038 1.00 0.00 C ATOM 0 H LEU A 131 5.247 -1.008 4.448 1.00 0.00 H new ATOM 0 HA LEU A 131 5.861 -3.402 2.880 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.088 -1.876 1.345 1.00 0.00 H new ATOM 0 HB3 LEU A 131 5.929 -0.573 2.505 1.00 0.00 H new ATOM 0 HG LEU A 131 8.545 -1.954 1.949 1.00 0.00 H new ATOM 0 HD11 LEU A 131 9.016 0.054 0.480 1.00 0.00 H new ATOM 0 HD12 LEU A 131 7.628 -0.879 -0.128 1.00 0.00 H new ATOM 0 HD13 LEU A 131 7.358 0.629 0.779 1.00 0.00 H new ATOM 0 HD21 LEU A 131 9.524 0.153 2.787 1.00 0.00 H new ATOM 0 HD22 LEU A 131 7.886 0.780 3.089 1.00 0.00 H new ATOM 0 HD23 LEU A 131 8.484 -0.624 4.004 1.00 0.00 H new ATOM 1930 N ARG A 132 7.963 -4.026 3.884 1.00 0.00 N ATOM 1931 CA ARG A 132 9.129 -4.513 4.540 1.00 0.00 C ATOM 1932 C ARG A 132 10.321 -4.273 3.621 1.00 0.00 C ATOM 1933 O ARG A 132 10.409 -4.877 2.539 1.00 0.00 O ATOM 1934 CB ARG A 132 8.958 -6.011 4.805 1.00 0.00 C ATOM 1935 CG ARG A 132 10.038 -6.649 5.621 1.00 0.00 C ATOM 1936 CD ARG A 132 9.931 -6.299 7.082 1.00 0.00 C ATOM 1937 NE ARG A 132 11.000 -6.912 7.851 1.00 0.00 N ATOM 1938 CZ ARG A 132 10.880 -7.960 8.680 1.00 0.00 C ATOM 1939 NH1 ARG A 132 9.788 -8.739 8.645 1.00 0.00 N ATOM 1940 NH2 ARG A 132 11.881 -8.263 9.489 1.00 0.00 N ATOM 0 H ARG A 132 7.599 -4.649 3.163 1.00 0.00 H new ATOM 0 HA ARG A 132 9.287 -4.002 5.490 1.00 0.00 H new ATOM 0 HB2 ARG A 132 8.005 -6.166 5.311 1.00 0.00 H new ATOM 0 HB3 ARG A 132 8.898 -6.527 3.847 1.00 0.00 H new ATOM 0 HG2 ARG A 132 9.988 -7.732 5.504 1.00 0.00 H new ATOM 0 HG3 ARG A 132 11.011 -6.333 5.244 1.00 0.00 H new ATOM 0 HD2 ARG A 132 9.968 -5.216 7.202 1.00 0.00 H new ATOM 0 HD3 ARG A 132 8.967 -6.630 7.468 1.00 0.00 H new ATOM 0 HE ARG A 132 11.931 -6.507 7.751 1.00 0.00 H new ATOM 0 HH11 ARG A 132 9.038 -8.537 7.983 1.00 0.00 H new ATOM 0 HH12 ARG A 132 9.708 -9.533 9.280 1.00 0.00 H new ATOM 0 HH21 ARG A 132 12.733 -7.702 9.478 1.00 0.00 H new ATOM 0 HH22 ARG A 132 11.801 -9.058 10.124 1.00 0.00 H new ATOM 1954 N GLN A 133 11.163 -3.351 4.004 1.00 0.00 N ATOM 1955 CA GLN A 133 12.380 -3.047 3.292 1.00 0.00 C ATOM 1956 C GLN A 133 13.535 -3.710 4.012 1.00 0.00 C ATOM 1957 O GLN A 133 13.941 -3.278 5.085 1.00 0.00 O ATOM 1958 CB GLN A 133 12.592 -1.516 3.201 1.00 0.00 C ATOM 1959 CG GLN A 133 11.728 -0.817 2.161 1.00 0.00 C ATOM 1960 CD GLN A 133 12.326 -0.808 0.758 1.00 0.00 C ATOM 1961 OE1 GLN A 133 13.008 0.134 0.359 1.00 0.00 O ATOM 1962 NE2 GLN A 133 12.127 -1.849 0.024 1.00 0.00 N ATOM 0 H GLN A 133 11.021 -2.778 4.836 1.00 0.00 H new ATOM 0 HA GLN A 133 12.317 -3.428 2.273 1.00 0.00 H new ATOM 0 HB2 GLN A 133 12.390 -1.076 4.177 1.00 0.00 H new ATOM 0 HB3 GLN A 133 13.640 -1.320 2.974 1.00 0.00 H new ATOM 0 HG2 GLN A 133 10.754 -1.305 2.126 1.00 0.00 H new ATOM 0 HG3 GLN A 133 11.558 0.212 2.478 1.00 0.00 H new ATOM 0 HE21 GLN A 133 11.558 -2.619 0.375 1.00 0.00 H new ATOM 0 HE22 GLN A 133 12.539 -1.902 -0.908 1.00 0.00 H new ATOM 1971 N THR A 134 14.018 -4.767 3.442 1.00 0.00 N ATOM 1972 CA THR A 134 15.125 -5.501 3.989 1.00 0.00 C ATOM 1973 C THR A 134 16.189 -5.561 2.899 1.00 0.00 C ATOM 1974 O THR A 134 15.847 -5.788 1.734 1.00 0.00 O ATOM 1975 CB THR A 134 14.675 -6.948 4.318 1.00 0.00 C ATOM 1976 OG1 THR A 134 13.403 -6.928 5.004 1.00 0.00 O ATOM 1977 CG2 THR A 134 15.705 -7.652 5.195 1.00 0.00 C ATOM 0 H THR A 134 13.653 -5.154 2.572 1.00 0.00 H new ATOM 0 HA THR A 134 15.498 -5.027 4.897 1.00 0.00 H new ATOM 0 HB THR A 134 14.579 -7.492 3.379 1.00 0.00 H new ATOM 0 HG1 THR A 134 13.126 -7.846 5.206 1.00 0.00 H new ATOM 0 HG21 THR A 134 15.367 -8.665 5.412 1.00 0.00 H new ATOM 0 HG22 THR A 134 16.661 -7.693 4.672 1.00 0.00 H new ATOM 0 HG23 THR A 134 15.825 -7.102 6.128 1.00 0.00 H new ATOM 1985 N ASN A 135 17.451 -5.337 3.215 1.00 0.00 N ATOM 1986 CA ASN A 135 18.440 -5.436 2.161 1.00 0.00 C ATOM 1987 C ASN A 135 19.494 -6.479 2.458 1.00 0.00 C ATOM 1988 O ASN A 135 19.607 -6.975 3.572 1.00 0.00 O ATOM 1989 CB ASN A 135 19.071 -4.098 1.729 1.00 0.00 C ATOM 1990 CG ASN A 135 20.164 -3.525 2.622 1.00 0.00 C ATOM 1991 OD1 ASN A 135 21.289 -3.942 2.518 1.00 0.00 O ATOM 1992 ND2 ASN A 135 19.899 -2.463 3.320 1.00 0.00 N ATOM 0 H ASN A 135 17.802 -5.098 4.142 1.00 0.00 H new ATOM 0 HA ASN A 135 17.869 -5.769 1.294 1.00 0.00 H new ATOM 0 HB2 ASN A 135 19.484 -4.227 0.729 1.00 0.00 H new ATOM 0 HB3 ASN A 135 18.275 -3.358 1.652 1.00 0.00 H new ATOM 0 HD21 ASN A 135 20.651 -1.964 3.794 1.00 0.00 H new ATOM 0 HD22 ASN A 135 18.938 -2.128 3.394 1.00 0.00 H new ATOM 2083 N PHE A 142 13.917 -2.307 7.789 1.00 0.00 N ATOM 2084 CA PHE A 142 12.956 -1.416 8.327 1.00 0.00 C ATOM 2085 C PHE A 142 11.671 -1.540 7.566 1.00 0.00 C ATOM 2086 O PHE A 142 11.665 -1.630 6.337 1.00 0.00 O ATOM 2087 CB PHE A 142 13.448 0.025 8.253 1.00 0.00 C ATOM 2088 CG PHE A 142 14.720 0.297 9.000 1.00 0.00 C ATOM 2089 CD1 PHE A 142 14.742 0.285 10.384 1.00 0.00 C ATOM 2090 CD2 PHE A 142 15.889 0.574 8.320 1.00 0.00 C ATOM 2091 CE1 PHE A 142 15.906 0.543 11.073 1.00 0.00 C ATOM 2092 CE2 PHE A 142 17.056 0.836 9.003 1.00 0.00 C ATOM 2093 CZ PHE A 142 17.066 0.820 10.381 1.00 0.00 C ATOM 0 HA PHE A 142 12.796 -1.677 9.373 1.00 0.00 H new ATOM 0 HB2 PHE A 142 13.595 0.290 7.206 1.00 0.00 H new ATOM 0 HB3 PHE A 142 12.668 0.680 8.641 1.00 0.00 H new ATOM 0 HD1 PHE A 142 13.835 0.071 10.930 1.00 0.00 H new ATOM 0 HD2 PHE A 142 15.888 0.585 7.240 1.00 0.00 H new ATOM 0 HE1 PHE A 142 15.910 0.528 12.153 1.00 0.00 H new ATOM 0 HE2 PHE A 142 17.963 1.054 8.459 1.00 0.00 H new ATOM 0 HZ PHE A 142 17.981 1.024 10.918 1.00 0.00 H new ATOM 2103 N GLN A 143 10.594 -1.558 8.265 1.00 0.00 N ATOM 2104 CA GLN A 143 9.335 -1.610 7.626 1.00 0.00 C ATOM 2105 C GLN A 143 8.632 -0.280 7.759 1.00 0.00 C ATOM 2106 O GLN A 143 8.618 0.343 8.836 1.00 0.00 O ATOM 2107 CB GLN A 143 8.489 -2.784 8.105 1.00 0.00 C ATOM 2108 CG GLN A 143 8.181 -2.770 9.601 1.00 0.00 C ATOM 2109 CD GLN A 143 7.462 -4.017 10.089 1.00 0.00 C ATOM 2110 OE1 GLN A 143 8.090 -5.037 10.354 1.00 0.00 O ATOM 2111 NE2 GLN A 143 6.191 -3.907 10.364 1.00 0.00 N ATOM 0 H GLN A 143 10.562 -1.537 9.284 1.00 0.00 H new ATOM 0 HA GLN A 143 9.496 -1.793 6.564 1.00 0.00 H new ATOM 0 HB2 GLN A 143 7.549 -2.788 7.553 1.00 0.00 H new ATOM 0 HB3 GLN A 143 9.006 -3.712 7.861 1.00 0.00 H new ATOM 0 HG2 GLN A 143 9.114 -2.660 10.154 1.00 0.00 H new ATOM 0 HG3 GLN A 143 7.570 -1.897 9.829 1.00 0.00 H new ATOM 0 HE21 GLN A 143 5.692 -3.048 10.133 1.00 0.00 H new ATOM 0 HE22 GLN A 143 5.697 -4.680 10.810 1.00 0.00 H new ATOM 2120 N PHE A 144 8.106 0.176 6.669 1.00 0.00 N ATOM 2121 CA PHE A 144 7.457 1.464 6.623 1.00 0.00 C ATOM 2122 C PHE A 144 5.974 1.239 6.630 1.00 0.00 C ATOM 2123 O PHE A 144 5.474 0.372 5.908 1.00 0.00 O ATOM 2124 CB PHE A 144 7.854 2.257 5.361 1.00 0.00 C ATOM 2125 CG PHE A 144 9.343 2.544 5.170 1.00 0.00 C ATOM 2126 CD1 PHE A 144 10.284 2.218 6.134 1.00 0.00 C ATOM 2127 CD2 PHE A 144 9.788 3.132 3.997 1.00 0.00 C ATOM 2128 CE1 PHE A 144 11.622 2.466 5.933 1.00 0.00 C ATOM 2129 CE2 PHE A 144 11.126 3.387 3.793 1.00 0.00 C ATOM 2130 CZ PHE A 144 12.046 3.053 4.761 1.00 0.00 C ATOM 0 H PHE A 144 8.109 -0.326 5.781 1.00 0.00 H new ATOM 0 HA PHE A 144 7.769 2.049 7.488 1.00 0.00 H new ATOM 0 HB2 PHE A 144 7.499 1.708 4.489 1.00 0.00 H new ATOM 0 HB3 PHE A 144 7.323 3.209 5.377 1.00 0.00 H new ATOM 0 HD1 PHE A 144 9.961 1.762 7.058 1.00 0.00 H new ATOM 0 HD2 PHE A 144 9.074 3.395 3.230 1.00 0.00 H new ATOM 0 HE1 PHE A 144 12.340 2.200 6.694 1.00 0.00 H new ATOM 0 HE2 PHE A 144 11.453 3.849 2.873 1.00 0.00 H new ATOM 0 HZ PHE A 144 13.096 3.250 4.602 1.00 0.00 H new ATOM 2140 N VAL A 145 5.287 1.974 7.440 1.00 0.00 N ATOM 2141 CA VAL A 145 3.861 1.840 7.570 1.00 0.00 C ATOM 2142 C VAL A 145 3.172 2.778 6.614 1.00 0.00 C ATOM 2143 O VAL A 145 3.471 3.966 6.566 1.00 0.00 O ATOM 2144 CB VAL A 145 3.394 2.167 8.997 1.00 0.00 C ATOM 2145 CG1 VAL A 145 1.897 1.945 9.150 1.00 0.00 C ATOM 2146 CG2 VAL A 145 4.179 1.378 10.024 1.00 0.00 C ATOM 0 H VAL A 145 5.696 2.692 8.038 1.00 0.00 H new ATOM 0 HA VAL A 145 3.605 0.805 7.343 1.00 0.00 H new ATOM 0 HB VAL A 145 3.589 3.224 9.177 1.00 0.00 H new ATOM 0 HG11 VAL A 145 1.596 2.185 10.170 1.00 0.00 H new ATOM 0 HG12 VAL A 145 1.361 2.589 8.453 1.00 0.00 H new ATOM 0 HG13 VAL A 145 1.660 0.903 8.937 1.00 0.00 H new ATOM 0 HG21 VAL A 145 3.826 1.630 11.024 1.00 0.00 H new ATOM 0 HG22 VAL A 145 4.039 0.311 9.848 1.00 0.00 H new ATOM 0 HG23 VAL A 145 5.238 1.624 9.940 1.00 0.00 H new ATOM 2156 N TRP A 146 2.265 2.255 5.883 1.00 0.00 N ATOM 2157 CA TRP A 146 1.520 3.016 4.920 1.00 0.00 C ATOM 2158 C TRP A 146 0.068 2.937 5.283 1.00 0.00 C ATOM 2159 O TRP A 146 -0.621 1.951 4.987 1.00 0.00 O ATOM 2160 CB TRP A 146 1.770 2.499 3.491 1.00 0.00 C ATOM 2161 CG TRP A 146 3.228 2.433 3.166 1.00 0.00 C ATOM 2162 CD1 TRP A 146 4.028 1.350 3.308 1.00 0.00 C ATOM 2163 CD2 TRP A 146 4.072 3.493 2.683 1.00 0.00 C ATOM 2164 NE1 TRP A 146 5.310 1.667 2.971 1.00 0.00 N ATOM 2165 CE2 TRP A 146 5.362 2.963 2.574 1.00 0.00 C ATOM 2166 CE3 TRP A 146 3.868 4.829 2.335 1.00 0.00 C ATOM 2167 CZ2 TRP A 146 6.439 3.706 2.141 1.00 0.00 C ATOM 2168 CZ3 TRP A 146 4.955 5.576 1.897 1.00 0.00 C ATOM 2169 CH2 TRP A 146 6.227 5.011 1.804 1.00 0.00 C ATOM 0 H TRP A 146 2.004 1.270 5.927 1.00 0.00 H new ATOM 0 HA TRP A 146 1.846 4.056 4.937 1.00 0.00 H new ATOM 0 HB2 TRP A 146 1.329 1.508 3.382 1.00 0.00 H new ATOM 0 HB3 TRP A 146 1.269 3.152 2.776 1.00 0.00 H new ATOM 0 HD1 TRP A 146 3.698 0.377 3.640 1.00 0.00 H new ATOM 0 HE1 TRP A 146 6.105 1.030 3.011 1.00 0.00 H new ATOM 0 HE3 TRP A 146 2.886 5.273 2.405 1.00 0.00 H new ATOM 0 HZ2 TRP A 146 7.423 3.267 2.070 1.00 0.00 H new ATOM 0 HZ3 TRP A 146 4.813 6.611 1.624 1.00 0.00 H new ATOM 0 HH2 TRP A 146 7.055 5.614 1.461 1.00 0.00 H new ATOM 2180 N ASN A 147 -0.377 3.933 5.980 1.00 0.00 N ATOM 2181 CA ASN A 147 -1.737 4.008 6.406 1.00 0.00 C ATOM 2182 C ASN A 147 -2.538 4.499 5.246 1.00 0.00 C ATOM 2183 O ASN A 147 -2.324 5.615 4.778 1.00 0.00 O ATOM 2184 CB ASN A 147 -1.889 4.972 7.593 1.00 0.00 C ATOM 2185 CG ASN A 147 -1.098 4.573 8.825 1.00 0.00 C ATOM 2186 OD1 ASN A 147 -1.572 3.803 9.668 1.00 0.00 O ATOM 2187 ND2 ASN A 147 0.091 5.115 8.961 1.00 0.00 N ATOM 0 H ASN A 147 0.198 4.723 6.272 1.00 0.00 H new ATOM 0 HA ASN A 147 -2.081 3.028 6.735 1.00 0.00 H new ATOM 0 HB2 ASN A 147 -1.575 5.968 7.280 1.00 0.00 H new ATOM 0 HB3 ASN A 147 -2.944 5.040 7.859 1.00 0.00 H new ATOM 0 HD21 ASN A 147 0.656 4.905 9.784 1.00 0.00 H new ATOM 0 HD22 ASN A 147 0.449 5.746 8.244 1.00 0.00 H new ATOM 2194 N ILE A 148 -3.405 3.676 4.749 1.00 0.00 N ATOM 2195 CA ILE A 148 -4.191 4.019 3.604 1.00 0.00 C ATOM 2196 C ILE A 148 -5.453 4.747 4.066 1.00 0.00 C ATOM 2197 O ILE A 148 -6.211 4.242 4.912 1.00 0.00 O ATOM 2198 CB ILE A 148 -4.598 2.766 2.763 1.00 0.00 C ATOM 2199 CG1 ILE A 148 -3.393 1.840 2.480 1.00 0.00 C ATOM 2200 CG2 ILE A 148 -5.235 3.190 1.446 1.00 0.00 C ATOM 2201 CD1 ILE A 148 -2.204 2.521 1.825 1.00 0.00 C ATOM 0 H ILE A 148 -3.589 2.746 5.125 1.00 0.00 H new ATOM 0 HA ILE A 148 -3.583 4.659 2.965 1.00 0.00 H new ATOM 0 HB ILE A 148 -5.321 2.206 3.356 1.00 0.00 H new ATOM 0 HG12 ILE A 148 -3.066 1.395 3.420 1.00 0.00 H new ATOM 0 HG13 ILE A 148 -3.724 1.023 1.839 1.00 0.00 H new ATOM 0 HG21 ILE A 148 -5.512 2.304 0.874 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -6.126 3.785 1.648 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -4.524 3.785 0.873 1.00 0.00 H new ATOM 0 HD11 ILE A 148 -1.409 1.792 1.666 1.00 0.00 H new ATOM 0 HD12 ILE A 148 -2.508 2.941 0.866 1.00 0.00 H new ATOM 0 HD13 ILE A 148 -1.840 3.319 2.472 1.00 0.00 H new ATOM 2213 N TYR A 149 -5.637 5.922 3.561 1.00 0.00 N ATOM 2214 CA TYR A 149 -6.776 6.749 3.837 1.00 0.00 C ATOM 2215 C TYR A 149 -7.544 6.970 2.576 1.00 0.00 C ATOM 2216 O TYR A 149 -6.979 6.962 1.466 1.00 0.00 O ATOM 2217 CB TYR A 149 -6.344 8.119 4.365 1.00 0.00 C ATOM 2218 CG TYR A 149 -5.800 8.119 5.758 1.00 0.00 C ATOM 2219 CD1 TYR A 149 -4.514 7.711 6.021 1.00 0.00 C ATOM 2220 CD2 TYR A 149 -6.590 8.526 6.813 1.00 0.00 C ATOM 2221 CE1 TYR A 149 -4.024 7.706 7.300 1.00 0.00 C ATOM 2222 CE2 TYR A 149 -6.111 8.525 8.103 1.00 0.00 C ATOM 2223 CZ TYR A 149 -4.824 8.113 8.342 1.00 0.00 C ATOM 2224 OH TYR A 149 -4.331 8.102 9.626 1.00 0.00 O ATOM 0 H TYR A 149 -4.974 6.354 2.918 1.00 0.00 H new ATOM 0 HA TYR A 149 -7.385 6.244 4.587 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -5.586 8.527 3.696 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -7.200 8.793 4.326 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -3.881 7.390 5.207 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -7.602 8.851 6.623 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -3.011 7.383 7.490 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -6.742 8.845 8.919 1.00 0.00 H new ATOM 0 HH TYR A 149 -3.390 8.375 9.617 1.00 0.00 H new ATOM 2234 N ALA A 150 -8.808 7.162 2.728 1.00 0.00 N ATOM 2235 CA ALA A 150 -9.646 7.474 1.637 1.00 0.00 C ATOM 2236 C ALA A 150 -9.523 8.937 1.368 1.00 0.00 C ATOM 2237 O ALA A 150 -9.607 9.748 2.286 1.00 0.00 O ATOM 2238 CB ALA A 150 -11.057 7.132 1.961 1.00 0.00 C ATOM 0 H ALA A 150 -9.289 7.105 3.626 1.00 0.00 H new ATOM 0 HA ALA A 150 -9.351 6.901 0.758 1.00 0.00 H new ATOM 0 HB1 ALA A 150 -11.695 7.377 1.112 1.00 0.00 H new ATOM 0 HB2 ALA A 150 -11.133 6.066 2.176 1.00 0.00 H new ATOM 0 HB3 ALA A 150 -11.379 7.702 2.833 1.00 0.00 H new ATOM 2244 N ASN A 151 -9.327 9.269 0.135 1.00 0.00 N ATOM 2245 CA ASN A 151 -9.113 10.651 -0.271 1.00 0.00 C ATOM 2246 C ASN A 151 -10.456 11.240 -0.658 1.00 0.00 C ATOM 2247 O ASN A 151 -10.621 12.442 -0.836 1.00 0.00 O ATOM 2248 CB ASN A 151 -8.189 10.647 -1.484 1.00 0.00 C ATOM 2249 CG ASN A 151 -7.425 11.930 -1.721 1.00 0.00 C ATOM 2250 OD1 ASN A 151 -7.866 13.030 -1.393 1.00 0.00 O ATOM 2251 ND2 ASN A 151 -6.269 11.788 -2.312 1.00 0.00 N ATOM 0 H ASN A 151 -9.308 8.600 -0.635 1.00 0.00 H new ATOM 0 HA ASN A 151 -8.669 11.238 0.533 1.00 0.00 H new ATOM 0 HB2 ASN A 151 -7.473 9.833 -1.371 1.00 0.00 H new ATOM 0 HB3 ASN A 151 -8.783 10.428 -2.371 1.00 0.00 H new ATOM 0 HD21 ASN A 151 -5.697 12.607 -2.517 1.00 0.00 H new ATOM 0 HD22 ASN A 151 -5.938 10.858 -2.568 1.00 0.00 H new ATOM 2258 N ASN A 152 -11.409 10.359 -0.770 1.00 0.00 N ATOM 2259 CA ASN A 152 -12.751 10.673 -1.177 1.00 0.00 C ATOM 2260 C ASN A 152 -13.709 9.670 -0.569 1.00 0.00 C ATOM 2261 O ASN A 152 -13.373 8.491 -0.436 1.00 0.00 O ATOM 2262 CB ASN A 152 -12.832 10.660 -2.708 1.00 0.00 C ATOM 2263 CG ASN A 152 -14.236 10.510 -3.259 1.00 0.00 C ATOM 2264 OD1 ASN A 152 -14.953 11.480 -3.481 1.00 0.00 O ATOM 2265 ND2 ASN A 152 -14.618 9.301 -3.506 1.00 0.00 N ATOM 0 H ASN A 152 -11.269 9.368 -0.574 1.00 0.00 H new ATOM 0 HA ASN A 152 -13.029 11.667 -0.826 1.00 0.00 H new ATOM 0 HB2 ASN A 152 -12.402 11.586 -3.090 1.00 0.00 H new ATOM 0 HB3 ASN A 152 -12.217 9.843 -3.085 1.00 0.00 H new ATOM 0 HD21 ASN A 152 -15.543 9.129 -3.899 1.00 0.00 H new ATOM 0 HD22 ASN A 152 -13.994 8.519 -3.308 1.00 0.00 H new ATOM 2272 N ASP A 153 -14.870 10.149 -0.200 1.00 0.00 N ATOM 2273 CA ASP A 153 -15.912 9.346 0.413 1.00 0.00 C ATOM 2274 C ASP A 153 -16.767 8.689 -0.659 1.00 0.00 C ATOM 2275 O ASP A 153 -17.072 9.298 -1.693 1.00 0.00 O ATOM 2276 CB ASP A 153 -16.773 10.210 1.347 1.00 0.00 C ATOM 2277 CG ASP A 153 -17.486 11.348 0.674 1.00 0.00 C ATOM 2278 OD1 ASP A 153 -16.870 12.401 0.453 1.00 0.00 O ATOM 2279 OD2 ASP A 153 -18.677 11.231 0.406 1.00 0.00 O ATOM 0 H ASP A 153 -15.128 11.129 -0.317 1.00 0.00 H new ATOM 0 HA ASP A 153 -15.447 8.561 1.010 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -17.513 9.572 1.830 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -16.137 10.613 2.135 1.00 0.00 H new ATOM 2284 N VAL A 154 -17.130 7.449 -0.442 1.00 0.00 N ATOM 2285 CA VAL A 154 -17.861 6.708 -1.439 1.00 0.00 C ATOM 2286 C VAL A 154 -19.212 6.246 -0.903 1.00 0.00 C ATOM 2287 O VAL A 154 -19.381 6.034 0.318 1.00 0.00 O ATOM 2288 CB VAL A 154 -17.060 5.484 -1.983 1.00 0.00 C ATOM 2289 CG1 VAL A 154 -15.577 5.771 -2.175 1.00 0.00 C ATOM 2290 CG2 VAL A 154 -17.325 4.181 -1.239 1.00 0.00 C ATOM 0 H VAL A 154 -16.931 6.932 0.415 1.00 0.00 H new ATOM 0 HA VAL A 154 -18.022 7.394 -2.271 1.00 0.00 H new ATOM 0 HB VAL A 154 -17.463 5.319 -2.982 1.00 0.00 H new ATOM 0 HG11 VAL A 154 -15.080 4.878 -2.555 1.00 0.00 H new ATOM 0 HG12 VAL A 154 -15.454 6.586 -2.888 1.00 0.00 H new ATOM 0 HG13 VAL A 154 -15.135 6.054 -1.220 1.00 0.00 H new ATOM 0 HG21 VAL A 154 -16.729 3.382 -1.681 1.00 0.00 H new ATOM 0 HG22 VAL A 154 -17.053 4.299 -0.190 1.00 0.00 H new ATOM 0 HG23 VAL A 154 -18.383 3.928 -1.313 1.00 0.00 H new ATOM 2300 N VAL A 155 -20.152 6.071 -1.804 1.00 0.00 N ATOM 2301 CA VAL A 155 -21.479 5.642 -1.466 1.00 0.00 C ATOM 2302 C VAL A 155 -21.769 4.368 -2.257 1.00 0.00 C ATOM 2303 O VAL A 155 -21.333 4.217 -3.409 1.00 0.00 O ATOM 2304 CB VAL A 155 -22.536 6.710 -1.868 1.00 0.00 C ATOM 2305 CG1 VAL A 155 -23.856 6.533 -1.177 1.00 0.00 C ATOM 2306 CG2 VAL A 155 -22.017 8.134 -1.798 1.00 0.00 C ATOM 0 H VAL A 155 -20.009 6.226 -2.802 1.00 0.00 H new ATOM 0 HA VAL A 155 -21.538 5.481 -0.390 1.00 0.00 H new ATOM 0 HB VAL A 155 -22.732 6.525 -2.924 1.00 0.00 H new ATOM 0 HG11 VAL A 155 -24.545 7.312 -1.504 1.00 0.00 H new ATOM 0 HG12 VAL A 155 -24.269 5.555 -1.426 1.00 0.00 H new ATOM 0 HG13 VAL A 155 -23.714 6.603 -0.099 1.00 0.00 H new ATOM 0 HG21 VAL A 155 -22.808 8.824 -2.092 1.00 0.00 H new ATOM 0 HG22 VAL A 155 -21.701 8.356 -0.779 1.00 0.00 H new ATOM 0 HG23 VAL A 155 -21.169 8.246 -2.473 1.00 0.00 H new ATOM 2316 N VAL A 156 -22.455 3.465 -1.644 1.00 0.00 N ATOM 2317 CA VAL A 156 -22.830 2.223 -2.239 1.00 0.00 C ATOM 2318 C VAL A 156 -24.310 2.252 -2.624 1.00 0.00 C ATOM 2319 O VAL A 156 -25.177 2.152 -1.763 1.00 0.00 O ATOM 2320 CB VAL A 156 -22.540 1.043 -1.254 1.00 0.00 C ATOM 2321 CG1 VAL A 156 -23.096 -0.276 -1.770 1.00 0.00 C ATOM 2322 CG2 VAL A 156 -21.040 0.919 -1.008 1.00 0.00 C ATOM 0 H VAL A 156 -22.782 3.572 -0.684 1.00 0.00 H new ATOM 0 HA VAL A 156 -22.240 2.070 -3.142 1.00 0.00 H new ATOM 0 HB VAL A 156 -23.044 1.269 -0.314 1.00 0.00 H new ATOM 0 HG11 VAL A 156 -22.873 -1.069 -1.056 1.00 0.00 H new ATOM 0 HG12 VAL A 156 -24.176 -0.192 -1.894 1.00 0.00 H new ATOM 0 HG13 VAL A 156 -22.638 -0.513 -2.730 1.00 0.00 H new ATOM 0 HG21 VAL A 156 -20.851 0.094 -0.321 1.00 0.00 H new ATOM 0 HG22 VAL A 156 -20.531 0.728 -1.953 1.00 0.00 H new ATOM 0 HG23 VAL A 156 -20.665 1.846 -0.574 1.00 0.00 H new ATOM 2332 N PRO A 157 -24.620 2.441 -3.917 1.00 0.00 N ATOM 2333 CA PRO A 157 -25.999 2.415 -4.407 1.00 0.00 C ATOM 2334 C PRO A 157 -26.604 1.026 -4.298 1.00 0.00 C ATOM 2335 O PRO A 157 -27.815 0.890 -4.258 1.00 0.00 O ATOM 2336 CB PRO A 157 -25.880 2.809 -5.869 1.00 0.00 C ATOM 2337 CG PRO A 157 -24.469 2.520 -6.222 1.00 0.00 C ATOM 2338 CD PRO A 157 -23.674 2.765 -4.991 1.00 0.00 C ATOM 0 HA PRO A 157 -26.645 3.077 -3.830 1.00 0.00 H new ATOM 0 HB2 PRO A 157 -26.569 2.237 -6.491 1.00 0.00 H new ATOM 0 HB3 PRO A 157 -26.117 3.863 -6.016 1.00 0.00 H new ATOM 0 HG2 PRO A 157 -24.356 1.490 -6.560 1.00 0.00 H new ATOM 0 HG3 PRO A 157 -24.133 3.161 -7.037 1.00 0.00 H new ATOM 0 HD2 PRO A 157 -22.787 2.133 -4.951 1.00 0.00 H new ATOM 0 HD3 PRO A 157 -23.333 3.798 -4.930 1.00 0.00 H new ATOM 2346 N THR A 158 -25.718 0.008 -4.263 1.00 0.00 N ATOM 2347 CA THR A 158 -26.073 -1.402 -4.078 1.00 0.00 C ATOM 2348 C THR A 158 -27.196 -1.887 -5.013 1.00 0.00 C ATOM 2349 O THR A 158 -26.861 -2.321 -6.145 1.00 0.00 O ATOM 2350 CB THR A 158 -26.261 -1.812 -2.551 1.00 0.00 C ATOM 2351 OG1 THR A 158 -26.695 -3.164 -2.415 1.00 0.00 O ATOM 2352 CG2 THR A 158 -27.190 -0.890 -1.774 1.00 0.00 C ATOM 2353 OXT THR A 158 -28.403 -1.805 -4.667 1.00 0.00 O ATOM 0 H THR A 158 -24.714 0.155 -4.366 1.00 0.00 H new ATOM 0 HA THR A 158 -25.198 -1.965 -4.404 1.00 0.00 H new ATOM 0 HB THR A 158 -25.269 -1.707 -2.111 1.00 0.00 H new ATOM 0 HG1 THR A 158 -26.798 -3.380 -1.465 1.00 0.00 H new ATOM 0 HG21 THR A 158 -27.267 -1.235 -0.743 1.00 0.00 H new ATOM 0 HG22 THR A 158 -26.791 0.124 -1.788 1.00 0.00 H new ATOM 0 HG23 THR A 158 -28.178 -0.898 -2.234 1.00 0.00 H new