USER MOD reduce.3.24.130724 H: found=0, std=0, add=1225, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1226 hydrogens (8 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 145 MET CE :methyl -115:sc= -2.69! (180deg=-3.55!) USER MOD Set 1.2: A 148 LYS NZ :NH3+ 159:sc= -0.0818 (180deg=0) USER MOD Set 2.1: A 94 LYS NZ :NH3+ -174:sc= -4.56! (180deg=-3.41!) USER MOD Set 2.2: A 107 HIS : no HD1:sc= -0.881 K(o=-5.4,f=-1.4) USER MOD Set 3.1: A 34 THR OG1 : rot -24:sc= -2.52! USER MOD Set 3.2: A 111 ASN : amide:sc= -3.29! C(o=-5.8!,f=-9.4!) USER MOD Set 4.1: A 5 THR OG1 : rot 180:sc= -1.14 USER MOD Set 4.2: A 8 GLN : amide:sc= -0.213 K(o=-1.3,f=1) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot -38:sc= 0.0512 USER MOD Single : A 21 LYS NZ :NH3+ -147:sc= -0.64 (180deg=-1.79) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot -146:sc= -2.87! USER MOD Single : A 29 THR OG1 : rot -34:sc= 0.352 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 MET CE :methyl 161:sc= 0 (180deg=-0.455) USER MOD Single : A 38 SER OG : rot -71:sc= -0.187 USER MOD Single : A 41 GLN : amide:sc= -0.746 K(o=-0.75,f=-1.9) USER MOD Single : A 42 ASN : amide:sc= -0.485 K(o=-0.48,f=-1.9) USER MOD Single : A 44 THR OG1 : rot -90:sc= -0.204 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 MET CE :methyl 177:sc= 0 (180deg=-0.0113) USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 ASN : amide:sc= -3.63! C(o=-3.6!,f=-5.6!) USER MOD Single : A 62 THR OG1 : rot -176:sc= -3.97! USER MOD Single : A 70 THR OG1 : rot 56:sc= 0.545 USER MOD Single : A 71 MET CE :methyl -165:sc= 0 (180deg=-0.121) USER MOD Single : A 72 MET CE :methyl 176:sc= 0 (180deg=-0.0273) USER MOD Single : A 75 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00178) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0.00685 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 97 ASN : amide:sc= -0.278 K(o=-0.28,f=0.56) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= -1.94! USER MOD Single : A 109 MET CE :methyl 173:sc= -3.52! (180deg=-3.62!) USER MOD Single : A 110 THR OG1 : rot -160:sc= -2.82! USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl -174:sc= -1.51 (180deg=-1.59) USER MOD Single : A 135 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 ASN : amide:sc= -1.27 K(o=-1.3,f=-3.8) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 144 MET CE :methyl -179:sc= -0.403 (180deg=-0.411) USER MOD Single : A 146 THR OG1 : rot 180:sc= 0 USER MOD Single : B 497 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 501 ASN : amide:sc= -2.12! K(o=-2.1!,f=0.11) USER MOD Single : B 504 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 506 SER OG : rot 150:sc= 0 USER MOD Single : B 508 SER OG : rot -82:sc= 0.0686 USER MOD Single : B 510 MET CE :methyl 179:sc= 0 (180deg=-0.00105) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -3.498 26.608 -4.227 1.00 0.00 N ATOM 2 CA ALA A 1 -3.350 25.454 -3.303 1.00 0.00 C ATOM 3 C ALA A 1 -2.233 25.700 -2.294 1.00 0.00 C ATOM 4 O ALA A 1 -1.151 26.170 -2.659 1.00 0.00 O ATOM 5 CB ALA A 1 -3.078 24.181 -4.090 1.00 0.00 C ATOM 0 H1 ALA A 1 -4.264 26.415 -4.903 1.00 0.00 H new ATOM 0 H2 ALA A 1 -3.725 27.463 -3.681 1.00 0.00 H new ATOM 0 H3 ALA A 1 -2.608 26.754 -4.745 1.00 0.00 H new ATOM 0 HA ALA A 1 -4.284 25.338 -2.753 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -2.972 23.343 -3.401 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -3.908 23.989 -4.770 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -2.159 24.298 -4.664 1.00 0.00 H new ATOM 13 N ASP A 2 -2.510 25.378 -1.027 1.00 0.00 N ATOM 14 CA ASP A 2 -1.539 25.557 0.055 1.00 0.00 C ATOM 15 C ASP A 2 -0.871 24.232 0.410 1.00 0.00 C ATOM 16 O ASP A 2 -1.521 23.182 0.409 1.00 0.00 O ATOM 17 CB ASP A 2 -2.219 26.146 1.295 1.00 0.00 C ATOM 18 CG ASP A 2 -2.634 27.593 1.102 1.00 0.00 C ATOM 19 OD1 ASP A 2 -3.773 27.828 0.647 1.00 0.00 O ATOM 20 OD2 ASP A 2 -1.820 28.490 1.406 1.00 0.00 O ATOM 0 H ASP A 2 -3.404 24.990 -0.725 1.00 0.00 H new ATOM 0 HA ASP A 2 -0.773 26.251 -0.292 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -3.098 25.550 1.541 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -1.540 26.077 2.145 1.00 0.00 H new ATOM 25 N GLN A 3 0.431 24.297 0.713 1.00 0.00 N ATOM 26 CA GLN A 3 1.213 23.123 1.073 1.00 0.00 C ATOM 27 C GLN A 3 2.144 23.417 2.245 1.00 0.00 C ATOM 28 O GLN A 3 2.733 24.498 2.328 1.00 0.00 O ATOM 29 CB GLN A 3 2.045 22.646 -0.126 1.00 0.00 C ATOM 30 CG GLN A 3 1.226 21.963 -1.212 1.00 0.00 C ATOM 31 CD GLN A 3 2.075 21.504 -2.381 1.00 0.00 C ATOM 32 OE1 GLN A 3 2.579 20.381 -2.395 1.00 0.00 O ATOM 33 NE2 GLN A 3 2.239 22.375 -3.371 1.00 0.00 N ATOM 0 H GLN A 3 0.965 25.166 0.714 1.00 0.00 H new ATOM 0 HA GLN A 3 0.514 22.341 1.368 1.00 0.00 H new ATOM 0 HB2 GLN A 3 2.563 23.501 -0.559 1.00 0.00 H new ATOM 0 HB3 GLN A 3 2.810 21.955 0.227 1.00 0.00 H new ATOM 0 HG2 GLN A 3 0.708 21.104 -0.785 1.00 0.00 H new ATOM 0 HG3 GLN A 3 0.461 22.651 -1.572 1.00 0.00 H new ATOM 0 HE21 GLN A 3 1.803 23.295 -3.318 1.00 0.00 H new ATOM 0 HE22 GLN A 3 2.801 22.123 -4.184 1.00 0.00 H new ATOM 42 N LEU A 4 2.260 22.437 3.142 1.00 0.00 N ATOM 43 CA LEU A 4 3.161 22.515 4.293 1.00 0.00 C ATOM 44 C LEU A 4 4.309 21.560 3.997 1.00 0.00 C ATOM 45 O LEU A 4 5.468 21.972 3.884 1.00 0.00 O ATOM 46 CB LEU A 4 2.437 22.143 5.604 1.00 0.00 C ATOM 47 CG LEU A 4 1.180 22.964 5.928 1.00 0.00 C ATOM 48 CD1 LEU A 4 0.231 22.158 6.802 1.00 0.00 C ATOM 49 CD2 LEU A 4 1.546 24.274 6.618 1.00 0.00 C ATOM 0 H LEU A 4 1.732 21.566 3.091 1.00 0.00 H new ATOM 0 HA LEU A 4 3.526 23.532 4.438 1.00 0.00 H new ATOM 0 HB2 LEU A 4 2.159 21.090 5.557 1.00 0.00 H new ATOM 0 HB3 LEU A 4 3.141 22.250 6.429 1.00 0.00 H new ATOM 0 HG LEU A 4 0.680 23.200 4.989 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -0.655 22.754 7.023 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -0.064 21.250 6.277 1.00 0.00 H new ATOM 0 HD13 LEU A 4 0.731 21.892 7.733 1.00 0.00 H new ATOM 0 HD21 LEU A 4 0.638 24.836 6.836 1.00 0.00 H new ATOM 0 HD22 LEU A 4 2.073 24.061 7.548 1.00 0.00 H new ATOM 0 HD23 LEU A 4 2.189 24.863 5.964 1.00 0.00 H new ATOM 61 N THR A 5 3.955 20.277 3.878 1.00 0.00 N ATOM 62 CA THR A 5 4.855 19.244 3.488 1.00 0.00 C ATOM 63 C THR A 5 4.126 18.335 2.525 1.00 0.00 C ATOM 64 O THR A 5 3.090 17.746 2.851 1.00 0.00 O ATOM 65 CB THR A 5 5.374 18.407 4.638 1.00 0.00 C ATOM 66 OG1 THR A 5 4.343 18.175 5.605 1.00 0.00 O ATOM 67 CG2 THR A 5 6.582 19.054 5.298 1.00 0.00 C ATOM 0 H THR A 5 3.008 19.944 4.059 1.00 0.00 H new ATOM 0 HA THR A 5 5.724 19.727 3.042 1.00 0.00 H new ATOM 0 HB THR A 5 5.689 17.448 4.227 1.00 0.00 H new ATOM 0 HG1 THR A 5 4.699 17.631 6.339 1.00 0.00 H new ATOM 0 HG21 THR A 5 6.928 18.426 6.119 1.00 0.00 H new ATOM 0 HG22 THR A 5 7.381 19.166 4.565 1.00 0.00 H new ATOM 0 HG23 THR A 5 6.304 20.035 5.684 1.00 0.00 H new ATOM 75 N GLU A 6 4.686 18.248 1.341 1.00 0.00 N ATOM 76 CA GLU A 6 4.162 17.456 0.228 1.00 0.00 C ATOM 77 C GLU A 6 3.850 15.982 0.574 1.00 0.00 C ATOM 78 O GLU A 6 2.956 15.382 -0.025 1.00 0.00 O ATOM 79 CB GLU A 6 5.191 17.538 -0.891 1.00 0.00 C ATOM 80 CG GLU A 6 6.620 17.255 -0.407 1.00 0.00 C ATOM 81 CD GLU A 6 7.658 18.104 -1.115 1.00 0.00 C ATOM 82 OE1 GLU A 6 8.171 17.662 -2.165 1.00 0.00 O ATOM 83 OE2 GLU A 6 7.958 19.211 -0.620 1.00 0.00 O ATOM 0 H GLU A 6 5.549 18.740 1.108 1.00 0.00 H new ATOM 0 HA GLU A 6 3.197 17.872 -0.061 1.00 0.00 H new ATOM 0 HB2 GLU A 6 4.929 16.825 -1.672 1.00 0.00 H new ATOM 0 HB3 GLU A 6 5.154 18.530 -1.340 1.00 0.00 H new ATOM 0 HG2 GLU A 6 6.678 17.437 0.666 1.00 0.00 H new ATOM 0 HG3 GLU A 6 6.850 16.201 -0.564 1.00 0.00 H new ATOM 90 N GLU A 7 4.587 15.416 1.541 1.00 0.00 N ATOM 91 CA GLU A 7 4.401 14.010 1.959 1.00 0.00 C ATOM 92 C GLU A 7 3.089 13.779 2.726 1.00 0.00 C ATOM 93 O GLU A 7 2.598 12.649 2.794 1.00 0.00 O ATOM 94 CB GLU A 7 5.604 13.520 2.797 1.00 0.00 C ATOM 95 CG GLU A 7 6.012 14.433 3.955 1.00 0.00 C ATOM 96 CD GLU A 7 7.127 13.844 4.797 1.00 0.00 C ATOM 97 OE1 GLU A 7 6.819 13.122 5.768 1.00 0.00 O ATOM 98 OE2 GLU A 7 8.308 14.104 4.484 1.00 0.00 O ATOM 0 H GLU A 7 5.320 15.908 2.052 1.00 0.00 H new ATOM 0 HA GLU A 7 4.340 13.425 1.041 1.00 0.00 H new ATOM 0 HB2 GLU A 7 5.368 12.535 3.199 1.00 0.00 H new ATOM 0 HB3 GLU A 7 6.461 13.397 2.134 1.00 0.00 H new ATOM 0 HG2 GLU A 7 6.332 15.396 3.558 1.00 0.00 H new ATOM 0 HG3 GLU A 7 5.145 14.621 4.588 1.00 0.00 H new ATOM 105 N GLN A 8 2.534 14.856 3.292 1.00 0.00 N ATOM 106 CA GLN A 8 1.295 14.789 4.078 1.00 0.00 C ATOM 107 C GLN A 8 0.031 14.713 3.241 1.00 0.00 C ATOM 108 O GLN A 8 -0.863 13.922 3.559 1.00 0.00 O ATOM 109 CB GLN A 8 1.214 15.967 5.051 1.00 0.00 C ATOM 110 CG GLN A 8 2.282 15.927 6.133 1.00 0.00 C ATOM 111 CD GLN A 8 1.960 16.833 7.307 1.00 0.00 C ATOM 112 OE1 GLN A 8 2.321 18.009 7.318 1.00 0.00 O ATOM 113 NE2 GLN A 8 1.277 16.285 8.305 1.00 0.00 N ATOM 0 H GLN A 8 2.927 15.794 3.220 1.00 0.00 H new ATOM 0 HA GLN A 8 1.347 13.851 4.630 1.00 0.00 H new ATOM 0 HB2 GLN A 8 1.307 16.898 4.492 1.00 0.00 H new ATOM 0 HB3 GLN A 8 0.230 15.974 5.521 1.00 0.00 H new ATOM 0 HG2 GLN A 8 2.394 14.903 6.490 1.00 0.00 H new ATOM 0 HG3 GLN A 8 3.240 16.222 5.704 1.00 0.00 H new ATOM 0 HE21 GLN A 8 0.998 15.305 8.254 1.00 0.00 H new ATOM 0 HE22 GLN A 8 1.032 16.844 9.122 1.00 0.00 H new ATOM 122 N ILE A 9 -0.060 15.516 2.180 1.00 0.00 N ATOM 123 CA ILE A 9 -1.277 15.528 1.365 1.00 0.00 C ATOM 124 C ILE A 9 -1.023 15.639 -0.150 1.00 0.00 C ATOM 125 O ILE A 9 -1.949 15.425 -0.939 1.00 0.00 O ATOM 126 CB ILE A 9 -2.270 16.651 1.813 1.00 0.00 C ATOM 127 CG1 ILE A 9 -1.682 18.101 1.691 1.00 0.00 C ATOM 128 CG2 ILE A 9 -2.825 16.384 3.217 1.00 0.00 C ATOM 129 CD1 ILE A 9 -0.523 18.455 2.625 1.00 0.00 C ATOM 0 H ILE A 9 0.674 16.152 1.869 1.00 0.00 H new ATOM 0 HA ILE A 9 -1.728 14.551 1.541 1.00 0.00 H new ATOM 0 HB ILE A 9 -3.099 16.610 1.106 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -1.348 18.247 0.664 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -2.490 18.811 1.867 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -3.511 17.184 3.495 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -3.356 15.432 3.223 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -2.003 16.346 3.932 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -0.209 19.482 2.441 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -0.847 18.354 3.661 1.00 0.00 H new ATOM 0 HD13 ILE A 9 0.313 17.781 2.439 1.00 0.00 H new ATOM 141 N ALA A 10 0.211 15.969 -0.554 1.00 0.00 N ATOM 142 CA ALA A 10 0.544 16.110 -1.981 1.00 0.00 C ATOM 143 C ALA A 10 0.914 14.777 -2.626 1.00 0.00 C ATOM 144 O ALA A 10 0.620 14.546 -3.802 1.00 0.00 O ATOM 145 CB ALA A 10 1.666 17.116 -2.172 1.00 0.00 C ATOM 0 H ALA A 10 0.991 16.142 0.080 1.00 0.00 H new ATOM 0 HA ALA A 10 -0.353 16.475 -2.481 1.00 0.00 H new ATOM 0 HB1 ALA A 10 1.897 17.206 -3.233 1.00 0.00 H new ATOM 0 HB2 ALA A 10 1.355 18.086 -1.785 1.00 0.00 H new ATOM 0 HB3 ALA A 10 2.552 16.779 -1.635 1.00 0.00 H new ATOM 151 N GLU A 11 1.558 13.909 -1.843 1.00 0.00 N ATOM 152 CA GLU A 11 1.990 12.587 -2.304 1.00 0.00 C ATOM 153 C GLU A 11 0.824 11.587 -2.413 1.00 0.00 C ATOM 154 O GLU A 11 1.038 10.421 -2.766 1.00 0.00 O ATOM 155 CB GLU A 11 3.078 12.071 -1.363 1.00 0.00 C ATOM 156 CG GLU A 11 4.047 11.083 -2.001 1.00 0.00 C ATOM 157 CD GLU A 11 5.155 10.662 -1.056 1.00 0.00 C ATOM 158 OE1 GLU A 11 4.899 9.804 -0.186 1.00 0.00 O ATOM 159 OE2 GLU A 11 6.279 11.191 -1.186 1.00 0.00 O ATOM 0 H GLU A 11 1.795 14.103 -0.870 1.00 0.00 H new ATOM 0 HA GLU A 11 2.389 12.687 -3.313 1.00 0.00 H new ATOM 0 HB2 GLU A 11 3.644 12.921 -0.981 1.00 0.00 H new ATOM 0 HB3 GLU A 11 2.603 11.593 -0.506 1.00 0.00 H new ATOM 0 HG2 GLU A 11 3.498 10.200 -2.327 1.00 0.00 H new ATOM 0 HG3 GLU A 11 4.485 11.533 -2.892 1.00 0.00 H new ATOM 166 N PHE A 12 -0.403 12.038 -2.107 1.00 0.00 N ATOM 167 CA PHE A 12 -1.586 11.193 -2.233 1.00 0.00 C ATOM 168 C PHE A 12 -1.878 10.978 -3.713 1.00 0.00 C ATOM 169 O PHE A 12 -2.176 9.861 -4.144 1.00 0.00 O ATOM 170 CB PHE A 12 -2.789 11.818 -1.508 1.00 0.00 C ATOM 171 CG PHE A 12 -3.890 10.842 -1.187 1.00 0.00 C ATOM 172 CD1 PHE A 12 -4.917 10.615 -2.089 1.00 0.00 C ATOM 173 CD2 PHE A 12 -3.897 10.155 0.017 1.00 0.00 C ATOM 174 CE1 PHE A 12 -5.930 9.721 -1.798 1.00 0.00 C ATOM 175 CE2 PHE A 12 -4.908 9.261 0.314 1.00 0.00 C ATOM 176 CZ PHE A 12 -5.925 9.043 -0.594 1.00 0.00 C ATOM 0 H PHE A 12 -0.594 12.982 -1.772 1.00 0.00 H new ATOM 0 HA PHE A 12 -1.399 10.228 -1.761 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -2.443 12.276 -0.581 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -3.196 12.618 -2.126 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -4.926 11.143 -3.031 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -3.104 10.320 0.731 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -6.724 9.553 -2.510 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -4.903 8.733 1.256 1.00 0.00 H new ATOM 0 HZ PHE A 12 -6.715 8.344 -0.364 1.00 0.00 H new ATOM 186 N LYS A 13 -1.786 12.075 -4.480 1.00 0.00 N ATOM 187 CA LYS A 13 -1.953 12.037 -5.922 1.00 0.00 C ATOM 188 C LYS A 13 -0.671 11.537 -6.590 1.00 0.00 C ATOM 189 O LYS A 13 -0.531 11.512 -7.818 1.00 0.00 O ATOM 190 CB LYS A 13 -2.383 13.409 -6.435 1.00 0.00 C ATOM 191 CG LYS A 13 -3.203 13.369 -7.719 1.00 0.00 C ATOM 192 CD LYS A 13 -3.610 14.764 -8.164 1.00 0.00 C ATOM 193 CE LYS A 13 -4.439 14.723 -9.437 1.00 0.00 C ATOM 194 NZ LYS A 13 -4.851 16.085 -9.877 1.00 0.00 N ATOM 0 H LYS A 13 -1.594 13.006 -4.110 1.00 0.00 H new ATOM 0 HA LYS A 13 -2.744 11.333 -6.181 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -2.966 13.907 -5.661 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -1.494 14.016 -6.604 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -2.623 12.889 -8.507 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -4.094 12.761 -7.564 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -4.182 15.247 -7.372 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -2.718 15.369 -8.329 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -3.864 14.244 -10.229 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -5.326 14.111 -9.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -5.414 16.013 -10.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -5.422 16.533 -9.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -4.005 16.662 -10.059 1.00 0.00 H new ATOM 208 N GLU A 14 0.232 11.134 -5.719 1.00 0.00 N ATOM 209 CA GLU A 14 1.512 10.564 -6.071 1.00 0.00 C ATOM 210 C GLU A 14 1.419 9.060 -5.863 1.00 0.00 C ATOM 211 O GLU A 14 2.073 8.271 -6.551 1.00 0.00 O ATOM 212 CB GLU A 14 2.639 11.135 -5.229 1.00 0.00 C ATOM 213 CG GLU A 14 3.055 12.544 -5.635 1.00 0.00 C ATOM 214 CD GLU A 14 4.211 13.078 -4.810 1.00 0.00 C ATOM 215 OE1 GLU A 14 5.336 12.553 -4.953 1.00 0.00 O ATOM 216 OE2 GLU A 14 3.993 14.022 -4.023 1.00 0.00 O ATOM 0 H GLU A 14 0.087 11.198 -4.711 1.00 0.00 H new ATOM 0 HA GLU A 14 1.739 10.806 -7.109 1.00 0.00 H new ATOM 0 HB2 GLU A 14 2.331 11.144 -4.184 1.00 0.00 H new ATOM 0 HB3 GLU A 14 3.504 10.476 -5.301 1.00 0.00 H new ATOM 0 HG2 GLU A 14 3.335 12.545 -6.688 1.00 0.00 H new ATOM 0 HG3 GLU A 14 2.201 13.214 -5.532 1.00 0.00 H new ATOM 223 N ALA A 15 0.573 8.694 -4.879 1.00 0.00 N ATOM 224 CA ALA A 15 0.298 7.306 -4.525 1.00 0.00 C ATOM 225 C ALA A 15 -0.666 6.674 -5.526 1.00 0.00 C ATOM 226 O ALA A 15 -0.658 5.454 -5.711 1.00 0.00 O ATOM 227 CB ALA A 15 -0.266 7.221 -3.114 1.00 0.00 C ATOM 0 H ALA A 15 0.062 9.367 -4.308 1.00 0.00 H new ATOM 0 HA ALA A 15 1.235 6.751 -4.558 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -0.466 6.179 -2.864 1.00 0.00 H new ATOM 0 HB2 ALA A 15 0.456 7.631 -2.408 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -1.193 7.792 -3.058 1.00 0.00 H new ATOM 233 N PHE A 16 -1.505 7.516 -6.167 1.00 0.00 N ATOM 234 CA PHE A 16 -2.444 7.045 -7.181 1.00 0.00 C ATOM 235 C PHE A 16 -1.688 6.549 -8.409 1.00 0.00 C ATOM 236 O PHE A 16 -2.152 5.664 -9.127 1.00 0.00 O ATOM 237 CB PHE A 16 -3.457 8.118 -7.582 1.00 0.00 C ATOM 238 CG PHE A 16 -4.700 7.515 -8.153 1.00 0.00 C ATOM 239 CD1 PHE A 16 -5.565 6.816 -7.336 1.00 0.00 C ATOM 240 CD2 PHE A 16 -4.980 7.610 -9.503 1.00 0.00 C ATOM 241 CE1 PHE A 16 -6.687 6.228 -7.845 1.00 0.00 C ATOM 242 CE2 PHE A 16 -6.107 7.017 -10.024 1.00 0.00 C ATOM 243 CZ PHE A 16 -6.963 6.324 -9.194 1.00 0.00 C ATOM 0 H PHE A 16 -1.543 8.520 -5.994 1.00 0.00 H new ATOM 0 HA PHE A 16 -3.006 6.221 -6.741 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -3.712 8.722 -6.711 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -3.007 8.788 -8.315 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -5.352 6.733 -6.281 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -4.310 8.153 -10.153 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -7.358 5.688 -7.193 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -6.321 7.094 -11.080 1.00 0.00 H new ATOM 0 HZ PHE A 16 -7.848 5.857 -9.599 1.00 0.00 H new ATOM 253 N SER A 17 -0.508 7.138 -8.616 1.00 0.00 N ATOM 254 CA SER A 17 0.383 6.787 -9.716 1.00 0.00 C ATOM 255 C SER A 17 1.018 5.405 -9.499 1.00 0.00 C ATOM 256 O SER A 17 1.624 4.842 -10.416 1.00 0.00 O ATOM 257 CB SER A 17 1.462 7.854 -9.827 1.00 0.00 C ATOM 258 OG SER A 17 2.238 7.694 -11.003 1.00 0.00 O ATOM 0 H SER A 17 -0.144 7.879 -8.017 1.00 0.00 H new ATOM 0 HA SER A 17 -0.192 6.739 -10.641 1.00 0.00 H new ATOM 0 HB2 SER A 17 0.999 8.841 -9.828 1.00 0.00 H new ATOM 0 HB3 SER A 17 2.112 7.807 -8.953 1.00 0.00 H new ATOM 0 HG SER A 17 2.378 6.739 -11.175 1.00 0.00 H new ATOM 264 N LEU A 18 0.867 4.870 -8.270 1.00 0.00 N ATOM 265 CA LEU A 18 1.399 3.554 -7.909 1.00 0.00 C ATOM 266 C LEU A 18 0.539 2.439 -8.520 1.00 0.00 C ATOM 267 O LEU A 18 1.067 1.506 -9.134 1.00 0.00 O ATOM 268 CB LEU A 18 1.473 3.386 -6.380 1.00 0.00 C ATOM 269 CG LEU A 18 2.436 4.331 -5.641 1.00 0.00 C ATOM 270 CD1 LEU A 18 2.113 4.357 -4.155 1.00 0.00 C ATOM 271 CD2 LEU A 18 3.890 3.912 -5.846 1.00 0.00 C ATOM 0 H LEU A 18 0.375 5.340 -7.510 1.00 0.00 H new ATOM 0 HA LEU A 18 2.410 3.481 -8.311 1.00 0.00 H new ATOM 0 HB2 LEU A 18 0.473 3.527 -5.971 1.00 0.00 H new ATOM 0 HB3 LEU A 18 1.765 2.359 -6.161 1.00 0.00 H new ATOM 0 HG LEU A 18 2.305 5.330 -6.056 1.00 0.00 H new ATOM 0 HD11 LEU A 18 2.802 5.030 -3.645 1.00 0.00 H new ATOM 0 HD12 LEU A 18 1.091 4.707 -4.011 1.00 0.00 H new ATOM 0 HD13 LEU A 18 2.214 3.353 -3.743 1.00 0.00 H new ATOM 0 HD21 LEU A 18 4.546 4.599 -5.311 1.00 0.00 H new ATOM 0 HD22 LEU A 18 4.035 2.901 -5.464 1.00 0.00 H new ATOM 0 HD23 LEU A 18 4.129 3.936 -6.909 1.00 0.00 H new ATOM 283 N PHE A 19 -0.789 2.553 -8.341 1.00 0.00 N ATOM 284 CA PHE A 19 -1.746 1.581 -8.882 1.00 0.00 C ATOM 285 C PHE A 19 -2.198 1.986 -10.290 1.00 0.00 C ATOM 286 O PHE A 19 -2.295 1.137 -11.181 1.00 0.00 O ATOM 287 CB PHE A 19 -2.971 1.435 -7.967 1.00 0.00 C ATOM 288 CG PHE A 19 -2.649 1.003 -6.560 1.00 0.00 C ATOM 289 CD1 PHE A 19 -2.347 1.942 -5.585 1.00 0.00 C ATOM 290 CD2 PHE A 19 -2.654 -0.338 -6.215 1.00 0.00 C ATOM 291 CE1 PHE A 19 -2.056 1.549 -4.293 1.00 0.00 C ATOM 292 CE2 PHE A 19 -2.365 -0.737 -4.924 1.00 0.00 C ATOM 293 CZ PHE A 19 -2.065 0.208 -3.961 1.00 0.00 C ATOM 0 H PHE A 19 -1.223 3.316 -7.821 1.00 0.00 H new ATOM 0 HA PHE A 19 -1.237 0.619 -8.935 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -3.497 2.389 -7.930 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -3.655 0.711 -8.409 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -2.339 2.992 -5.839 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -2.887 -1.081 -6.964 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -1.822 2.290 -3.543 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -2.374 -1.786 -4.668 1.00 0.00 H new ATOM 0 HZ PHE A 19 -1.838 -0.101 -2.951 1.00 0.00 H new ATOM 303 N ASP A 20 -2.472 3.294 -10.481 1.00 0.00 N ATOM 304 CA ASP A 20 -2.907 3.825 -11.780 1.00 0.00 C ATOM 305 C ASP A 20 -1.697 4.069 -12.680 1.00 0.00 C ATOM 306 O ASP A 20 -1.216 5.194 -12.862 1.00 0.00 O ATOM 307 CB ASP A 20 -3.745 5.100 -11.598 1.00 0.00 C ATOM 308 CG ASP A 20 -4.787 5.277 -12.686 1.00 0.00 C ATOM 309 OD1 ASP A 20 -4.411 5.666 -13.812 1.00 0.00 O ATOM 310 OD2 ASP A 20 -5.979 5.029 -12.409 1.00 0.00 O ATOM 0 H ASP A 20 -2.398 3.999 -9.747 1.00 0.00 H new ATOM 0 HA ASP A 20 -3.545 3.087 -12.266 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -4.241 5.068 -10.628 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.084 5.966 -11.590 1.00 0.00 H new ATOM 315 N LYS A 21 -1.217 2.953 -13.209 1.00 0.00 N ATOM 316 CA LYS A 21 -0.046 2.887 -14.087 1.00 0.00 C ATOM 317 C LYS A 21 -0.330 3.437 -15.496 1.00 0.00 C ATOM 318 O LYS A 21 0.592 3.591 -16.304 1.00 0.00 O ATOM 319 CB LYS A 21 0.432 1.429 -14.158 1.00 0.00 C ATOM 320 CG LYS A 21 0.348 0.696 -12.816 1.00 0.00 C ATOM 321 CD LYS A 21 0.292 -0.808 -13.000 1.00 0.00 C ATOM 322 CE LYS A 21 0.200 -1.522 -11.665 1.00 0.00 C ATOM 323 NZ LYS A 21 0.043 -2.992 -11.831 1.00 0.00 N ATOM 0 H LYS A 21 -1.639 2.040 -13.038 1.00 0.00 H new ATOM 0 HA LYS A 21 0.734 3.521 -13.666 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -0.167 0.893 -14.894 1.00 0.00 H new ATOM 0 HB3 LYS A 21 1.463 1.409 -14.511 1.00 0.00 H new ATOM 0 HG2 LYS A 21 1.212 0.956 -12.205 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -0.537 1.029 -12.274 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -0.569 -1.070 -13.615 1.00 0.00 H new ATOM 0 HD3 LYS A 21 1.180 -1.145 -13.535 1.00 0.00 H new ATOM 0 HE2 LYS A 21 1.097 -1.317 -11.081 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -0.645 -1.128 -11.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -0.543 -3.368 -11.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -0.416 -3.191 -12.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 0.978 -3.446 -11.808 1.00 0.00 H new ATOM 337 N ASP A 22 -1.609 3.733 -15.774 1.00 0.00 N ATOM 338 CA ASP A 22 -2.035 4.253 -17.078 1.00 0.00 C ATOM 339 C ASP A 22 -2.015 5.788 -17.113 1.00 0.00 C ATOM 340 O ASP A 22 -1.692 6.379 -18.147 1.00 0.00 O ATOM 341 CB ASP A 22 -3.440 3.738 -17.412 1.00 0.00 C ATOM 342 CG ASP A 22 -3.695 3.650 -18.907 1.00 0.00 C ATOM 343 OD1 ASP A 22 -4.170 4.649 -19.488 1.00 0.00 O ATOM 344 OD2 ASP A 22 -3.418 2.584 -19.495 1.00 0.00 O ATOM 0 H ASP A 22 -2.371 3.619 -15.105 1.00 0.00 H new ATOM 0 HA ASP A 22 -1.327 3.896 -17.826 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -3.576 2.753 -16.966 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -4.181 4.398 -16.960 1.00 0.00 H new ATOM 349 N GLY A 23 -2.362 6.422 -15.979 1.00 0.00 N ATOM 350 CA GLY A 23 -2.386 7.884 -15.892 1.00 0.00 C ATOM 351 C GLY A 23 -3.614 8.515 -16.543 1.00 0.00 C ATOM 352 O GLY A 23 -3.814 9.729 -16.444 1.00 0.00 O ATOM 0 H GLY A 23 -2.627 5.944 -15.118 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -2.350 8.178 -14.843 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -1.489 8.283 -16.366 1.00 0.00 H new ATOM 356 N ASP A 24 -4.430 7.684 -17.207 1.00 0.00 N ATOM 357 CA ASP A 24 -5.661 8.140 -17.858 1.00 0.00 C ATOM 358 C ASP A 24 -6.847 8.026 -16.884 1.00 0.00 C ATOM 359 O ASP A 24 -7.993 8.328 -17.237 1.00 0.00 O ATOM 360 CB ASP A 24 -5.920 7.313 -19.126 1.00 0.00 C ATOM 361 CG ASP A 24 -6.778 8.048 -20.143 1.00 0.00 C ATOM 362 OD1 ASP A 24 -6.207 8.756 -20.999 1.00 0.00 O ATOM 363 OD2 ASP A 24 -8.018 7.914 -20.081 1.00 0.00 O ATOM 0 H ASP A 24 -4.255 6.684 -17.306 1.00 0.00 H new ATOM 0 HA ASP A 24 -5.549 9.186 -18.143 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -4.966 7.050 -19.584 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -6.410 6.379 -18.851 1.00 0.00 H new ATOM 368 N GLY A 25 -6.537 7.598 -15.653 1.00 0.00 N ATOM 369 CA GLY A 25 -7.539 7.438 -14.612 1.00 0.00 C ATOM 370 C GLY A 25 -8.028 6.006 -14.466 1.00 0.00 C ATOM 371 O GLY A 25 -9.141 5.776 -13.985 1.00 0.00 O ATOM 0 H GLY A 25 -5.590 7.357 -15.361 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -7.122 7.771 -13.662 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -8.389 8.084 -14.832 1.00 0.00 H new ATOM 375 N THR A 26 -7.191 5.049 -14.883 1.00 0.00 N ATOM 376 CA THR A 26 -7.507 3.619 -14.795 1.00 0.00 C ATOM 377 C THR A 26 -6.295 2.829 -14.433 1.00 0.00 C ATOM 378 O THR A 26 -5.179 3.082 -14.896 1.00 0.00 O ATOM 379 CB THR A 26 -8.094 3.035 -16.092 1.00 0.00 C ATOM 380 OG1 THR A 26 -7.209 3.263 -17.198 1.00 0.00 O ATOM 381 CG2 THR A 26 -9.460 3.617 -16.403 1.00 0.00 C ATOM 0 H THR A 26 -6.276 5.244 -15.291 1.00 0.00 H new ATOM 0 HA THR A 26 -8.268 3.542 -14.018 1.00 0.00 H new ATOM 0 HB THR A 26 -8.208 1.962 -15.937 1.00 0.00 H new ATOM 0 HG1 THR A 26 -7.599 2.883 -18.013 1.00 0.00 H new ATOM 0 HG21 THR A 26 -9.840 3.179 -17.326 1.00 0.00 H new ATOM 0 HG22 THR A 26 -10.146 3.393 -15.586 1.00 0.00 H new ATOM 0 HG23 THR A 26 -9.377 4.697 -16.521 1.00 0.00 H new ATOM 389 N ILE A 27 -6.565 1.867 -13.589 1.00 0.00 N ATOM 390 CA ILE A 27 -5.558 0.969 -13.072 1.00 0.00 C ATOM 391 C ILE A 27 -5.423 -0.307 -13.921 1.00 0.00 C ATOM 392 O ILE A 27 -6.062 -0.429 -14.965 1.00 0.00 O ATOM 393 CB ILE A 27 -5.874 0.612 -11.602 1.00 0.00 C ATOM 394 CG1 ILE A 27 -7.321 0.099 -11.429 1.00 0.00 C ATOM 395 CG2 ILE A 27 -5.590 1.807 -10.687 1.00 0.00 C ATOM 396 CD1 ILE A 27 -7.569 -0.668 -10.140 1.00 0.00 C ATOM 0 H ILE A 27 -7.503 1.680 -13.235 1.00 0.00 H new ATOM 0 HA ILE A 27 -4.600 1.486 -13.121 1.00 0.00 H new ATOM 0 HB ILE A 27 -5.215 -0.206 -11.311 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -8.001 0.950 -11.467 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -7.568 -0.545 -12.273 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -5.818 1.538 -9.656 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.539 2.084 -10.766 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -6.211 2.651 -10.987 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -8.610 -0.990 -10.103 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -6.918 -1.541 -10.105 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -7.358 -0.023 -9.287 1.00 0.00 H new ATOM 408 N THR A 28 -4.558 -1.229 -13.478 1.00 0.00 N ATOM 409 CA THR A 28 -4.357 -2.502 -14.164 1.00 0.00 C ATOM 410 C THR A 28 -5.092 -3.598 -13.391 1.00 0.00 C ATOM 411 O THR A 28 -4.783 -3.863 -12.225 1.00 0.00 O ATOM 412 CB THR A 28 -2.852 -2.845 -14.295 1.00 0.00 C ATOM 413 OG1 THR A 28 -2.120 -1.674 -14.678 1.00 0.00 O ATOM 414 CG2 THR A 28 -2.609 -3.939 -15.335 1.00 0.00 C ATOM 0 H THR A 28 -3.985 -1.111 -12.642 1.00 0.00 H new ATOM 0 HA THR A 28 -4.758 -2.427 -15.175 1.00 0.00 H new ATOM 0 HB THR A 28 -2.513 -3.208 -13.325 1.00 0.00 H new ATOM 0 HG1 THR A 28 -1.372 -1.931 -15.257 1.00 0.00 H new ATOM 0 HG21 THR A 28 -1.542 -4.151 -15.397 1.00 0.00 H new ATOM 0 HG22 THR A 28 -3.142 -4.844 -15.043 1.00 0.00 H new ATOM 0 HG23 THR A 28 -2.970 -3.603 -16.307 1.00 0.00 H new ATOM 422 N THR A 29 -6.067 -4.226 -14.059 1.00 0.00 N ATOM 423 CA THR A 29 -6.898 -5.282 -13.453 1.00 0.00 C ATOM 424 C THR A 29 -6.162 -6.614 -13.234 1.00 0.00 C ATOM 425 O THR A 29 -6.777 -7.612 -12.839 1.00 0.00 O ATOM 426 CB THR A 29 -8.217 -5.496 -14.267 1.00 0.00 C ATOM 427 OG1 THR A 29 -9.053 -6.470 -13.627 1.00 0.00 O ATOM 428 CG2 THR A 29 -7.952 -5.931 -15.713 1.00 0.00 C ATOM 0 H THR A 29 -6.304 -4.021 -15.030 1.00 0.00 H new ATOM 0 HA THR A 29 -7.150 -4.920 -12.456 1.00 0.00 H new ATOM 0 HB THR A 29 -8.723 -4.531 -14.294 1.00 0.00 H new ATOM 0 HG1 THR A 29 -8.493 -7.154 -13.204 1.00 0.00 H new ATOM 0 HG21 THR A 29 -8.901 -6.065 -16.232 1.00 0.00 H new ATOM 0 HG22 THR A 29 -7.365 -5.166 -16.221 1.00 0.00 H new ATOM 0 HG23 THR A 29 -7.401 -6.872 -15.715 1.00 0.00 H new ATOM 436 N LYS A 30 -4.861 -6.624 -13.486 1.00 0.00 N ATOM 437 CA LYS A 30 -4.055 -7.807 -13.290 1.00 0.00 C ATOM 438 C LYS A 30 -3.764 -8.055 -11.798 1.00 0.00 C ATOM 439 O LYS A 30 -4.231 -9.044 -11.225 1.00 0.00 O ATOM 440 CB LYS A 30 -2.751 -7.692 -14.093 1.00 0.00 C ATOM 441 CG LYS A 30 -2.910 -7.951 -15.589 1.00 0.00 C ATOM 442 CD LYS A 30 -2.813 -9.434 -15.924 1.00 0.00 C ATOM 443 CE LYS A 30 -2.974 -9.680 -17.416 1.00 0.00 C ATOM 444 NZ LYS A 30 -2.877 -11.127 -17.754 1.00 0.00 N ATOM 0 H LYS A 30 -4.343 -5.815 -13.830 1.00 0.00 H new ATOM 0 HA LYS A 30 -4.618 -8.666 -13.654 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -2.337 -6.694 -13.951 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -2.026 -8.398 -13.689 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -3.873 -7.566 -15.923 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -2.141 -7.405 -16.135 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -1.849 -9.821 -15.592 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -3.581 -9.982 -15.379 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -3.939 -9.294 -17.745 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -2.207 -9.128 -17.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -2.992 -11.252 -18.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -1.947 -11.490 -17.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -3.624 -11.651 -17.255 1.00 0.00 H new ATOM 458 N GLU A 31 -2.991 -7.143 -11.187 1.00 0.00 N ATOM 459 CA GLU A 31 -2.572 -7.260 -9.788 1.00 0.00 C ATOM 460 C GLU A 31 -3.578 -6.885 -8.701 1.00 0.00 C ATOM 461 O GLU A 31 -3.181 -6.873 -7.526 1.00 0.00 O ATOM 462 CB GLU A 31 -1.274 -6.499 -9.534 1.00 0.00 C ATOM 463 CG GLU A 31 -0.035 -7.127 -10.167 1.00 0.00 C ATOM 464 CD GLU A 31 0.106 -6.819 -11.647 1.00 0.00 C ATOM 465 OE1 GLU A 31 0.503 -5.685 -11.982 1.00 0.00 O ATOM 466 OE2 GLU A 31 -0.176 -7.716 -12.468 1.00 0.00 O ATOM 0 H GLU A 31 -2.641 -6.305 -11.652 1.00 0.00 H new ATOM 0 HA GLU A 31 -2.449 -8.338 -9.687 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -1.384 -5.483 -9.913 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -1.117 -6.423 -8.458 1.00 0.00 H new ATOM 0 HG2 GLU A 31 0.852 -6.771 -9.643 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -0.074 -8.208 -10.030 1.00 0.00 H new ATOM 473 N LEU A 32 -4.847 -6.580 -9.010 1.00 0.00 N ATOM 474 CA LEU A 32 -5.801 -6.223 -7.927 1.00 0.00 C ATOM 475 C LEU A 32 -5.797 -7.225 -6.770 1.00 0.00 C ATOM 476 O LEU A 32 -6.156 -6.870 -5.642 1.00 0.00 O ATOM 477 CB LEU A 32 -7.208 -6.171 -8.441 1.00 0.00 C ATOM 478 CG LEU A 32 -7.398 -5.396 -9.713 1.00 0.00 C ATOM 479 CD1 LEU A 32 -8.284 -6.200 -10.636 1.00 0.00 C ATOM 480 CD2 LEU A 32 -7.968 -4.021 -9.409 1.00 0.00 C ATOM 0 H LEU A 32 -5.233 -6.570 -9.954 1.00 0.00 H new ATOM 0 HA LEU A 32 -5.467 -5.249 -7.570 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -7.557 -7.191 -8.601 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -7.843 -5.734 -7.670 1.00 0.00 H new ATOM 0 HG LEU A 32 -6.443 -5.232 -10.212 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -8.433 -5.652 -11.566 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -7.811 -7.158 -10.851 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -9.248 -6.371 -10.157 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -8.101 -3.469 -10.339 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -8.931 -4.129 -8.910 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.281 -3.478 -8.760 1.00 0.00 H new ATOM 492 N GLY A 33 -5.388 -8.475 -7.054 1.00 0.00 N ATOM 493 CA GLY A 33 -5.330 -9.497 -6.027 1.00 0.00 C ATOM 494 C GLY A 33 -4.180 -9.318 -5.054 1.00 0.00 C ATOM 495 O GLY A 33 -3.783 -10.246 -4.345 1.00 0.00 O ATOM 0 H GLY A 33 -5.098 -8.787 -7.981 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -6.268 -9.495 -5.472 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -5.243 -10.474 -6.503 1.00 0.00 H new ATOM 499 N THR A 34 -3.670 -8.100 -5.051 1.00 0.00 N ATOM 500 CA THR A 34 -2.549 -7.675 -4.204 1.00 0.00 C ATOM 501 C THR A 34 -2.944 -7.444 -2.735 1.00 0.00 C ATOM 502 O THR A 34 -2.067 -7.292 -1.879 1.00 0.00 O ATOM 503 CB THR A 34 -1.861 -6.406 -4.787 1.00 0.00 C ATOM 504 OG1 THR A 34 -0.712 -6.065 -4.006 1.00 0.00 O ATOM 505 CG2 THR A 34 -2.804 -5.199 -4.861 1.00 0.00 C ATOM 0 H THR A 34 -4.026 -7.354 -5.649 1.00 0.00 H new ATOM 0 HA THR A 34 -1.840 -8.503 -4.208 1.00 0.00 H new ATOM 0 HB THR A 34 -1.564 -6.652 -5.807 1.00 0.00 H new ATOM 0 HG1 THR A 34 -0.811 -6.429 -3.102 1.00 0.00 H new ATOM 0 HG21 THR A 34 -2.269 -4.344 -5.275 1.00 0.00 H new ATOM 0 HG22 THR A 34 -3.654 -5.440 -5.500 1.00 0.00 H new ATOM 0 HG23 THR A 34 -3.160 -4.954 -3.861 1.00 0.00 H new ATOM 513 N VAL A 35 -4.259 -7.410 -2.456 1.00 0.00 N ATOM 514 CA VAL A 35 -4.775 -7.183 -1.092 1.00 0.00 C ATOM 515 C VAL A 35 -4.197 -8.198 -0.092 1.00 0.00 C ATOM 516 O VAL A 35 -3.569 -7.814 0.896 1.00 0.00 O ATOM 517 CB VAL A 35 -6.339 -7.183 -1.040 1.00 0.00 C ATOM 518 CG1 VAL A 35 -6.885 -5.879 -1.601 1.00 0.00 C ATOM 519 CG2 VAL A 35 -6.958 -8.367 -1.789 1.00 0.00 C ATOM 0 H VAL A 35 -4.987 -7.537 -3.159 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.440 -6.188 -0.798 1.00 0.00 H new ATOM 0 HB VAL A 35 -6.617 -7.282 0.009 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -7.974 -5.892 -1.559 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -6.509 -5.043 -1.011 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -6.563 -5.765 -2.636 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -8.044 -8.314 -1.719 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -6.660 -8.331 -2.837 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -6.611 -9.300 -1.345 1.00 0.00 H new ATOM 529 N MET A 36 -4.420 -9.487 -0.372 1.00 0.00 N ATOM 530 CA MET A 36 -3.913 -10.591 0.453 1.00 0.00 C ATOM 531 C MET A 36 -2.402 -10.769 0.313 1.00 0.00 C ATOM 532 O MET A 36 -1.681 -10.860 1.309 1.00 0.00 O ATOM 533 CB MET A 36 -4.642 -11.892 0.087 1.00 0.00 C ATOM 534 CG MET A 36 -6.091 -11.943 0.554 1.00 0.00 C ATOM 535 SD MET A 36 -6.905 -13.492 0.121 1.00 0.00 S ATOM 536 CE MET A 36 -8.509 -13.256 0.884 1.00 0.00 C ATOM 0 H MET A 36 -4.960 -9.796 -1.181 1.00 0.00 H new ATOM 0 HA MET A 36 -4.111 -10.343 1.496 1.00 0.00 H new ATOM 0 HB2 MET A 36 -4.615 -12.019 -0.995 1.00 0.00 H new ATOM 0 HB3 MET A 36 -4.102 -12.734 0.520 1.00 0.00 H new ATOM 0 HG2 MET A 36 -6.125 -11.809 1.635 1.00 0.00 H new ATOM 0 HG3 MET A 36 -6.641 -11.112 0.112 1.00 0.00 H new ATOM 0 HE1 MET A 36 -9.228 -13.944 0.440 1.00 0.00 H new ATOM 0 HE2 MET A 36 -8.435 -13.450 1.954 1.00 0.00 H new ATOM 0 HE3 MET A 36 -8.841 -12.230 0.723 1.00 0.00 H new ATOM 546 N ARG A 37 -1.941 -10.738 -0.932 1.00 0.00 N ATOM 547 CA ARG A 37 -0.537 -10.984 -1.295 1.00 0.00 C ATOM 548 C ARG A 37 0.509 -10.059 -0.662 1.00 0.00 C ATOM 549 O ARG A 37 1.705 -10.368 -0.716 1.00 0.00 O ATOM 550 CB ARG A 37 -0.423 -10.981 -2.813 1.00 0.00 C ATOM 551 CG ARG A 37 0.029 -12.308 -3.416 1.00 0.00 C ATOM 552 CD ARG A 37 1.543 -12.482 -3.358 1.00 0.00 C ATOM 553 NE ARG A 37 1.974 -13.750 -3.956 1.00 0.00 N ATOM 554 CZ ARG A 37 3.247 -14.165 -4.033 1.00 0.00 C ATOM 555 NH1 ARG A 37 4.244 -13.423 -3.553 1.00 0.00 N ATOM 556 NH2 ARG A 37 3.521 -15.333 -4.597 1.00 0.00 N ATOM 0 H ARG A 37 -2.536 -10.539 -1.736 1.00 0.00 H new ATOM 0 HA ARG A 37 -0.289 -11.957 -0.870 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -1.391 -10.715 -3.237 1.00 0.00 H new ATOM 0 HB3 ARG A 37 0.280 -10.203 -3.110 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -0.450 -13.129 -2.883 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -0.302 -12.365 -4.453 1.00 0.00 H new ATOM 0 HD2 ARG A 37 2.023 -11.654 -3.879 1.00 0.00 H new ATOM 0 HD3 ARG A 37 1.873 -12.440 -2.320 1.00 0.00 H new ATOM 0 HE ARG A 37 1.253 -14.360 -4.341 1.00 0.00 H new ATOM 0 HH11 ARG A 37 4.045 -12.522 -3.118 1.00 0.00 H new ATOM 0 HH12 ARG A 37 5.206 -13.756 -3.621 1.00 0.00 H new ATOM 0 HH21 ARG A 37 2.766 -15.909 -4.969 1.00 0.00 H new ATOM 0 HH22 ARG A 37 4.487 -15.655 -4.659 1.00 0.00 H new ATOM 570 N SER A 38 0.084 -8.949 -0.068 1.00 0.00 N ATOM 571 CA SER A 38 1.016 -8.043 0.612 1.00 0.00 C ATOM 572 C SER A 38 1.282 -8.551 2.022 1.00 0.00 C ATOM 573 O SER A 38 2.330 -8.286 2.612 1.00 0.00 O ATOM 574 CB SER A 38 0.457 -6.650 0.636 1.00 0.00 C ATOM 575 OG SER A 38 -0.689 -6.542 1.470 1.00 0.00 O ATOM 0 H SER A 38 -0.892 -8.652 -0.041 1.00 0.00 H new ATOM 0 HA SER A 38 1.961 -8.016 0.069 1.00 0.00 H new ATOM 0 HB2 SER A 38 1.224 -5.959 0.986 1.00 0.00 H new ATOM 0 HB3 SER A 38 0.195 -6.349 -0.378 1.00 0.00 H new ATOM 0 HG SER A 38 -1.443 -7.008 1.052 1.00 0.00 H new ATOM 581 N LEU A 39 0.312 -9.329 2.521 1.00 0.00 N ATOM 582 CA LEU A 39 0.389 -9.972 3.828 1.00 0.00 C ATOM 583 C LEU A 39 1.217 -11.248 3.691 1.00 0.00 C ATOM 584 O LEU A 39 1.219 -12.110 4.580 1.00 0.00 O ATOM 585 CB LEU A 39 -1.032 -10.343 4.304 1.00 0.00 C ATOM 586 CG LEU A 39 -1.893 -9.182 4.816 1.00 0.00 C ATOM 587 CD1 LEU A 39 -2.608 -8.484 3.668 1.00 0.00 C ATOM 588 CD2 LEU A 39 -2.896 -9.681 5.845 1.00 0.00 C ATOM 0 H LEU A 39 -0.554 -9.528 2.020 1.00 0.00 H new ATOM 0 HA LEU A 39 0.848 -9.296 4.549 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -1.557 -10.822 3.478 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -0.946 -11.084 5.099 1.00 0.00 H new ATOM 0 HG LEU A 39 -1.235 -8.456 5.293 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -3.211 -7.665 4.059 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -1.872 -8.090 2.967 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -3.253 -9.197 3.154 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -3.500 -8.846 6.199 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -3.544 -10.429 5.388 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -2.364 -10.126 6.686 1.00 0.00 H new ATOM 600 N GLY A 40 1.951 -11.335 2.562 1.00 0.00 N ATOM 601 CA GLY A 40 2.724 -12.532 2.254 1.00 0.00 C ATOM 602 C GLY A 40 1.781 -13.715 2.115 1.00 0.00 C ATOM 603 O GLY A 40 2.046 -14.817 2.603 1.00 0.00 O ATOM 0 H GLY A 40 2.018 -10.595 1.863 1.00 0.00 H new ATOM 0 HA2 GLY A 40 3.285 -12.389 1.331 1.00 0.00 H new ATOM 0 HA3 GLY A 40 3.451 -12.722 3.043 1.00 0.00 H new ATOM 607 N GLN A 41 0.672 -13.435 1.426 1.00 0.00 N ATOM 608 CA GLN A 41 -0.421 -14.368 1.228 1.00 0.00 C ATOM 609 C GLN A 41 -0.554 -14.840 -0.210 1.00 0.00 C ATOM 610 O GLN A 41 0.398 -14.849 -0.995 1.00 0.00 O ATOM 611 CB GLN A 41 -1.732 -13.674 1.589 1.00 0.00 C ATOM 612 CG GLN A 41 -2.492 -14.209 2.788 1.00 0.00 C ATOM 613 CD GLN A 41 -1.692 -14.218 4.083 1.00 0.00 C ATOM 614 OE1 GLN A 41 -1.722 -13.259 4.852 1.00 0.00 O ATOM 615 NE2 GLN A 41 -0.971 -15.307 4.325 1.00 0.00 N ATOM 0 H GLN A 41 0.513 -12.530 0.983 1.00 0.00 H new ATOM 0 HA GLN A 41 -0.209 -15.232 1.858 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -1.518 -12.620 1.767 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -2.391 -13.724 0.722 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -3.389 -13.607 2.933 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -2.821 -15.225 2.571 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -0.975 -16.080 3.659 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -0.413 -15.370 5.177 1.00 0.00 H new ATOM 624 N ASN A 42 -1.790 -15.228 -0.498 1.00 0.00 N ATOM 625 CA ASN A 42 -2.222 -15.758 -1.762 1.00 0.00 C ATOM 626 C ASN A 42 -3.022 -14.720 -2.573 1.00 0.00 C ATOM 627 O ASN A 42 -3.542 -13.768 -1.989 1.00 0.00 O ATOM 628 CB ASN A 42 -3.107 -16.926 -1.408 1.00 0.00 C ATOM 629 CG ASN A 42 -2.771 -18.191 -2.175 1.00 0.00 C ATOM 630 OD1 ASN A 42 -3.343 -18.462 -3.231 1.00 0.00 O ATOM 631 ND2 ASN A 42 -1.838 -18.973 -1.645 1.00 0.00 N ATOM 0 H ASN A 42 -2.546 -15.174 0.184 1.00 0.00 H new ATOM 0 HA ASN A 42 -1.372 -16.040 -2.383 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -3.023 -17.125 -0.340 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -4.145 -16.657 -1.602 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -1.570 -19.837 -2.115 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -1.390 -18.709 -0.768 1.00 0.00 H new ATOM 638 N PRO A 43 -3.142 -14.874 -3.932 1.00 0.00 N ATOM 639 CA PRO A 43 -3.904 -13.929 -4.773 1.00 0.00 C ATOM 640 C PRO A 43 -5.423 -14.133 -4.677 1.00 0.00 C ATOM 641 O PRO A 43 -5.901 -15.266 -4.575 1.00 0.00 O ATOM 642 CB PRO A 43 -3.426 -14.236 -6.205 1.00 0.00 C ATOM 643 CG PRO A 43 -2.329 -15.245 -6.077 1.00 0.00 C ATOM 644 CD PRO A 43 -2.549 -15.942 -4.767 1.00 0.00 C ATOM 0 HA PRO A 43 -3.732 -12.900 -4.458 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -4.243 -14.626 -6.812 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -3.067 -13.332 -6.697 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -2.355 -15.954 -6.904 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -1.352 -14.762 -6.101 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -3.218 -16.796 -4.869 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -1.616 -16.317 -4.345 1.00 0.00 H new ATOM 652 N THR A 44 -6.161 -13.016 -4.711 1.00 0.00 N ATOM 653 CA THR A 44 -7.629 -13.020 -4.642 1.00 0.00 C ATOM 654 C THR A 44 -8.247 -13.066 -6.011 1.00 0.00 C ATOM 655 O THR A 44 -8.412 -12.054 -6.685 1.00 0.00 O ATOM 656 CB THR A 44 -8.171 -11.831 -3.843 1.00 0.00 C ATOM 657 OG1 THR A 44 -7.167 -10.820 -3.676 1.00 0.00 O ATOM 658 CG2 THR A 44 -8.640 -12.339 -2.497 1.00 0.00 C ATOM 0 H THR A 44 -5.757 -12.083 -4.787 1.00 0.00 H new ATOM 0 HA THR A 44 -7.913 -13.929 -4.112 1.00 0.00 H new ATOM 0 HB THR A 44 -9.001 -11.376 -4.384 1.00 0.00 H new ATOM 0 HG1 THR A 44 -6.665 -10.991 -2.852 1.00 0.00 H new ATOM 0 HG21 THR A 44 -9.031 -11.508 -1.910 1.00 0.00 H new ATOM 0 HG22 THR A 44 -9.425 -13.081 -2.642 1.00 0.00 H new ATOM 0 HG23 THR A 44 -7.803 -12.794 -1.968 1.00 0.00 H new ATOM 666 N GLU A 45 -8.556 -14.295 -6.405 1.00 0.00 N ATOM 667 CA GLU A 45 -9.184 -14.597 -7.697 1.00 0.00 C ATOM 668 C GLU A 45 -10.631 -14.117 -7.699 1.00 0.00 C ATOM 669 O GLU A 45 -11.090 -13.454 -8.630 1.00 0.00 O ATOM 670 CB GLU A 45 -9.142 -16.107 -7.981 1.00 0.00 C ATOM 671 CG GLU A 45 -7.741 -16.661 -8.205 1.00 0.00 C ATOM 672 CD GLU A 45 -7.741 -18.152 -8.478 1.00 0.00 C ATOM 673 OE1 GLU A 45 -7.652 -18.933 -7.507 1.00 0.00 O ATOM 674 OE2 GLU A 45 -7.829 -18.539 -9.662 1.00 0.00 O ATOM 0 H GLU A 45 -8.378 -15.122 -5.835 1.00 0.00 H new ATOM 0 HA GLU A 45 -8.628 -14.078 -8.478 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -9.600 -16.636 -7.145 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -9.749 -16.317 -8.862 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -7.279 -16.142 -9.044 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -7.128 -16.456 -7.327 1.00 0.00 H new ATOM 681 N ALA A 46 -11.343 -14.516 -6.646 1.00 0.00 N ATOM 682 CA ALA A 46 -12.738 -14.173 -6.453 1.00 0.00 C ATOM 683 C ALA A 46 -12.973 -12.710 -6.051 1.00 0.00 C ATOM 684 O ALA A 46 -13.884 -12.060 -6.571 1.00 0.00 O ATOM 685 CB ALA A 46 -13.349 -15.121 -5.435 1.00 0.00 C ATOM 0 H ALA A 46 -10.957 -15.093 -5.899 1.00 0.00 H new ATOM 0 HA ALA A 46 -13.230 -14.285 -7.419 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -14.399 -14.868 -5.286 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -13.271 -16.145 -5.799 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -12.816 -15.031 -4.488 1.00 0.00 H new ATOM 691 N GLU A 47 -12.143 -12.207 -5.126 1.00 0.00 N ATOM 692 CA GLU A 47 -12.294 -10.849 -4.587 1.00 0.00 C ATOM 693 C GLU A 47 -11.797 -9.695 -5.480 1.00 0.00 C ATOM 694 O GLU A 47 -12.236 -8.557 -5.288 1.00 0.00 O ATOM 695 CB GLU A 47 -11.633 -10.755 -3.215 1.00 0.00 C ATOM 696 CG GLU A 47 -12.526 -11.217 -2.076 1.00 0.00 C ATOM 697 CD GLU A 47 -11.846 -11.114 -0.724 1.00 0.00 C ATOM 698 OE1 GLU A 47 -11.195 -12.096 -0.311 1.00 0.00 O ATOM 699 OE2 GLU A 47 -11.965 -10.051 -0.080 1.00 0.00 O ATOM 0 H GLU A 47 -11.356 -12.724 -4.734 1.00 0.00 H new ATOM 0 HA GLU A 47 -13.373 -10.705 -4.528 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -10.723 -11.355 -3.218 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -11.334 -9.722 -3.035 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -13.437 -10.618 -2.067 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -12.826 -12.250 -2.250 1.00 0.00 H new ATOM 706 N LEU A 48 -10.901 -9.964 -6.443 1.00 0.00 N ATOM 707 CA LEU A 48 -10.337 -8.932 -7.290 1.00 0.00 C ATOM 708 C LEU A 48 -11.290 -8.471 -8.390 1.00 0.00 C ATOM 709 O LEU A 48 -11.477 -7.265 -8.573 1.00 0.00 O ATOM 710 CB LEU A 48 -8.993 -9.433 -7.784 1.00 0.00 C ATOM 711 CG LEU A 48 -8.934 -9.877 -9.220 1.00 0.00 C ATOM 712 CD1 LEU A 48 -7.566 -9.570 -9.751 1.00 0.00 C ATOM 713 CD2 LEU A 48 -9.275 -11.344 -9.371 1.00 0.00 C ATOM 0 H LEU A 48 -10.556 -10.902 -6.646 1.00 0.00 H new ATOM 0 HA LEU A 48 -10.179 -8.017 -6.719 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -8.259 -8.640 -7.641 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -8.687 -10.269 -7.155 1.00 0.00 H new ATOM 0 HG LEU A 48 -9.682 -9.335 -9.798 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -7.501 -9.884 -10.793 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -7.382 -8.498 -9.683 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -6.819 -10.104 -9.164 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -9.221 -11.624 -10.423 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -8.566 -11.943 -8.799 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -10.284 -11.523 -9.000 1.00 0.00 H new ATOM 725 N GLN A 49 -11.879 -9.420 -9.130 1.00 0.00 N ATOM 726 CA GLN A 49 -12.878 -9.075 -10.147 1.00 0.00 C ATOM 727 C GLN A 49 -14.081 -8.557 -9.417 1.00 0.00 C ATOM 728 O GLN A 49 -14.839 -7.771 -9.947 1.00 0.00 O ATOM 729 CB GLN A 49 -13.238 -10.278 -11.026 1.00 0.00 C ATOM 730 CG GLN A 49 -12.133 -10.691 -11.987 1.00 0.00 C ATOM 731 CD GLN A 49 -12.515 -11.888 -12.835 1.00 0.00 C ATOM 732 OE1 GLN A 49 -12.279 -13.035 -12.454 1.00 0.00 O ATOM 733 NE2 GLN A 49 -13.110 -11.627 -13.993 1.00 0.00 N ATOM 0 H GLN A 49 -11.684 -10.418 -9.045 1.00 0.00 H new ATOM 0 HA GLN A 49 -12.480 -8.321 -10.826 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -13.483 -11.124 -10.384 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -14.135 -10.042 -11.599 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -11.891 -9.851 -12.638 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -11.232 -10.925 -11.420 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -13.286 -10.661 -14.269 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -13.391 -12.392 -14.606 1.00 0.00 H new ATOM 742 N ASP A 50 -14.207 -8.984 -8.159 1.00 0.00 N ATOM 743 CA ASP A 50 -15.255 -8.514 -7.298 1.00 0.00 C ATOM 744 C ASP A 50 -14.953 -7.074 -6.857 1.00 0.00 C ATOM 745 O ASP A 50 -15.833 -6.386 -6.332 1.00 0.00 O ATOM 746 CB ASP A 50 -15.416 -9.436 -6.085 1.00 0.00 C ATOM 747 CG ASP A 50 -16.830 -9.439 -5.532 1.00 0.00 C ATOM 748 OD1 ASP A 50 -17.748 -9.888 -6.250 1.00 0.00 O ATOM 749 OD2 ASP A 50 -17.017 -8.997 -4.379 1.00 0.00 O ATOM 0 H ASP A 50 -13.581 -9.662 -7.725 1.00 0.00 H new ATOM 0 HA ASP A 50 -16.197 -8.524 -7.847 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -15.139 -10.452 -6.367 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -14.725 -9.123 -5.302 1.00 0.00 H new ATOM 754 N MET A 51 -13.690 -6.628 -7.075 1.00 0.00 N ATOM 755 CA MET A 51 -13.282 -5.269 -6.717 1.00 0.00 C ATOM 756 C MET A 51 -13.518 -4.286 -7.863 1.00 0.00 C ATOM 757 O MET A 51 -14.199 -3.291 -7.649 1.00 0.00 O ATOM 758 CB MET A 51 -11.814 -5.272 -6.277 1.00 0.00 C ATOM 759 CG MET A 51 -11.440 -4.150 -5.317 1.00 0.00 C ATOM 760 SD MET A 51 -9.671 -4.094 -4.970 1.00 0.00 S ATOM 761 CE MET A 51 -9.583 -2.667 -3.891 1.00 0.00 C ATOM 0 H MET A 51 -12.951 -7.193 -7.494 1.00 0.00 H new ATOM 0 HA MET A 51 -13.899 -4.931 -5.885 1.00 0.00 H new ATOM 0 HB2 MET A 51 -11.592 -6.228 -5.803 1.00 0.00 H new ATOM 0 HB3 MET A 51 -11.182 -5.201 -7.162 1.00 0.00 H new ATOM 0 HG2 MET A 51 -11.754 -3.196 -5.740 1.00 0.00 H new ATOM 0 HG3 MET A 51 -11.986 -4.280 -4.382 1.00 0.00 H new ATOM 0 HE1 MET A 51 -8.557 -2.534 -3.547 1.00 0.00 H new ATOM 0 HE2 MET A 51 -9.901 -1.778 -4.436 1.00 0.00 H new ATOM 0 HE3 MET A 51 -10.237 -2.819 -3.032 1.00 0.00 H new ATOM 771 N ILE A 52 -13.020 -4.574 -9.085 1.00 0.00 N ATOM 772 CA ILE A 52 -13.207 -3.655 -10.206 1.00 0.00 C ATOM 773 C ILE A 52 -14.635 -3.741 -10.666 1.00 0.00 C ATOM 774 O ILE A 52 -15.314 -2.734 -10.807 1.00 0.00 O ATOM 775 CB ILE A 52 -12.230 -3.924 -11.394 1.00 0.00 C ATOM 776 CG1 ILE A 52 -10.890 -3.249 -11.082 1.00 0.00 C ATOM 777 CG2 ILE A 52 -12.807 -3.443 -12.745 1.00 0.00 C ATOM 778 CD1 ILE A 52 -9.859 -3.310 -12.198 1.00 0.00 C ATOM 0 H ILE A 52 -12.497 -5.421 -9.309 1.00 0.00 H new ATOM 0 HA ILE A 52 -12.977 -2.649 -9.855 1.00 0.00 H new ATOM 0 HB ILE A 52 -12.085 -4.999 -11.499 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -11.076 -2.203 -10.838 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -10.466 -3.713 -10.192 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -12.092 -3.651 -13.541 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -13.740 -3.967 -12.949 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -12.996 -2.371 -12.699 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -8.947 -2.805 -11.879 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -9.635 -4.351 -12.430 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -10.255 -2.818 -13.086 1.00 0.00 H new ATOM 790 N ASN A 53 -15.073 -4.983 -10.818 1.00 0.00 N ATOM 791 CA ASN A 53 -16.407 -5.322 -11.262 1.00 0.00 C ATOM 792 C ASN A 53 -17.495 -4.577 -10.471 1.00 0.00 C ATOM 793 O ASN A 53 -18.497 -4.134 -11.039 1.00 0.00 O ATOM 794 CB ASN A 53 -16.573 -6.814 -11.081 1.00 0.00 C ATOM 795 CG ASN A 53 -16.622 -7.565 -12.398 1.00 0.00 C ATOM 796 OD1 ASN A 53 -17.692 -7.766 -12.972 1.00 0.00 O ATOM 797 ND2 ASN A 53 -15.459 -7.984 -12.884 1.00 0.00 N ATOM 0 H ASN A 53 -14.491 -5.799 -10.630 1.00 0.00 H new ATOM 0 HA ASN A 53 -16.523 -5.025 -12.304 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -15.748 -7.196 -10.481 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -17.489 -7.008 -10.523 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -15.429 -8.494 -13.767 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -14.596 -7.795 -12.375 1.00 0.00 H new ATOM 804 N GLU A 54 -17.269 -4.454 -9.152 1.00 0.00 N ATOM 805 CA GLU A 54 -18.202 -3.781 -8.247 1.00 0.00 C ATOM 806 C GLU A 54 -18.010 -2.267 -8.181 1.00 0.00 C ATOM 807 O GLU A 54 -18.992 -1.531 -8.043 1.00 0.00 O ATOM 808 CB GLU A 54 -18.107 -4.372 -6.838 1.00 0.00 C ATOM 809 CG GLU A 54 -18.804 -5.715 -6.687 1.00 0.00 C ATOM 810 CD GLU A 54 -18.913 -6.154 -5.240 1.00 0.00 C ATOM 811 OE1 GLU A 54 -17.876 -6.526 -4.652 1.00 0.00 O ATOM 812 OE2 GLU A 54 -20.036 -6.123 -4.694 1.00 0.00 O ATOM 0 H GLU A 54 -16.436 -4.819 -8.689 1.00 0.00 H new ATOM 0 HA GLU A 54 -19.195 -3.956 -8.662 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -17.056 -4.487 -6.572 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -18.540 -3.667 -6.128 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -19.802 -5.653 -7.121 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -18.257 -6.470 -7.252 1.00 0.00 H new ATOM 819 N VAL A 55 -16.762 -1.804 -8.281 1.00 0.00 N ATOM 820 CA VAL A 55 -16.489 -0.360 -8.181 1.00 0.00 C ATOM 821 C VAL A 55 -16.454 0.384 -9.535 1.00 0.00 C ATOM 822 O VAL A 55 -16.478 1.616 -9.555 1.00 0.00 O ATOM 823 CB VAL A 55 -15.233 -0.001 -7.332 1.00 0.00 C ATOM 824 CG1 VAL A 55 -15.473 -0.351 -5.875 1.00 0.00 C ATOM 825 CG2 VAL A 55 -13.962 -0.671 -7.832 1.00 0.00 C ATOM 0 H VAL A 55 -15.939 -2.388 -8.428 1.00 0.00 H new ATOM 0 HA VAL A 55 -17.362 0.004 -7.639 1.00 0.00 H new ATOM 0 HB VAL A 55 -15.079 1.073 -7.435 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -14.590 -0.097 -5.289 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -16.330 0.211 -5.502 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -15.672 -1.419 -5.785 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -13.124 -0.380 -7.198 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -14.084 -1.754 -7.798 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -13.766 -0.360 -8.858 1.00 0.00 H new ATOM 835 N ASP A 56 -16.402 -0.359 -10.654 1.00 0.00 N ATOM 836 CA ASP A 56 -16.399 0.232 -12.013 1.00 0.00 C ATOM 837 C ASP A 56 -17.828 0.691 -12.391 1.00 0.00 C ATOM 838 O ASP A 56 -18.408 0.251 -13.392 1.00 0.00 O ATOM 839 CB ASP A 56 -15.800 -0.771 -13.034 1.00 0.00 C ATOM 840 CG ASP A 56 -16.509 -2.127 -13.119 1.00 0.00 C ATOM 841 OD1 ASP A 56 -17.747 -2.180 -12.950 1.00 0.00 O ATOM 842 OD2 ASP A 56 -15.815 -3.137 -13.357 1.00 0.00 O ATOM 0 H ASP A 56 -16.361 -1.378 -10.648 1.00 0.00 H new ATOM 0 HA ASP A 56 -15.762 1.116 -12.030 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -15.815 -0.310 -14.022 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -14.754 -0.943 -12.778 1.00 0.00 H new ATOM 847 N ALA A 57 -18.374 1.606 -11.561 1.00 0.00 N ATOM 848 CA ALA A 57 -19.732 2.145 -11.733 1.00 0.00 C ATOM 849 C ALA A 57 -19.823 3.018 -12.968 1.00 0.00 C ATOM 850 O ALA A 57 -20.874 3.103 -13.611 1.00 0.00 O ATOM 851 CB ALA A 57 -20.154 2.925 -10.496 1.00 0.00 C ATOM 0 H ALA A 57 -17.882 1.989 -10.754 1.00 0.00 H new ATOM 0 HA ALA A 57 -20.413 1.305 -11.866 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -21.161 3.317 -10.639 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -20.141 2.266 -9.628 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -19.462 3.752 -10.334 1.00 0.00 H new ATOM 857 N ASP A 58 -18.704 3.659 -13.279 1.00 0.00 N ATOM 858 CA ASP A 58 -18.594 4.493 -14.454 1.00 0.00 C ATOM 859 C ASP A 58 -17.909 3.689 -15.554 1.00 0.00 C ATOM 860 O ASP A 58 -17.525 4.205 -16.610 1.00 0.00 O ATOM 861 CB ASP A 58 -17.841 5.794 -14.139 1.00 0.00 C ATOM 862 CG ASP A 58 -18.160 6.911 -15.119 1.00 0.00 C ATOM 863 OD1 ASP A 58 -19.118 7.670 -14.862 1.00 0.00 O ATOM 864 OD2 ASP A 58 -17.451 7.024 -16.141 1.00 0.00 O ATOM 0 H ASP A 58 -17.852 3.611 -12.721 1.00 0.00 H new ATOM 0 HA ASP A 58 -19.586 4.789 -14.795 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -18.093 6.119 -13.130 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -16.768 5.600 -14.153 1.00 0.00 H new ATOM 869 N GLY A 59 -17.822 2.393 -15.251 1.00 0.00 N ATOM 870 CA GLY A 59 -17.208 1.365 -16.092 1.00 0.00 C ATOM 871 C GLY A 59 -16.027 1.832 -16.926 1.00 0.00 C ATOM 872 O GLY A 59 -16.146 2.010 -18.141 1.00 0.00 O ATOM 0 H GLY A 59 -18.192 2.016 -14.378 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -16.880 0.544 -15.454 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -17.969 0.964 -16.761 1.00 0.00 H new ATOM 876 N ASN A 60 -14.894 2.027 -16.256 1.00 0.00 N ATOM 877 CA ASN A 60 -13.665 2.474 -16.883 1.00 0.00 C ATOM 878 C ASN A 60 -12.822 1.287 -17.371 1.00 0.00 C ATOM 879 O ASN A 60 -11.626 1.436 -17.655 1.00 0.00 O ATOM 880 CB ASN A 60 -12.881 3.280 -15.841 1.00 0.00 C ATOM 881 CG ASN A 60 -13.644 4.503 -15.361 1.00 0.00 C ATOM 882 OD1 ASN A 60 -14.475 4.414 -14.458 1.00 0.00 O ATOM 883 ND2 ASN A 60 -13.366 5.651 -15.968 1.00 0.00 N ATOM 0 H ASN A 60 -14.808 1.876 -15.251 1.00 0.00 H new ATOM 0 HA ASN A 60 -13.899 3.084 -17.755 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -12.651 2.641 -14.989 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -11.929 3.594 -16.269 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -13.849 6.505 -15.690 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -12.669 5.679 -16.712 1.00 0.00 H new ATOM 890 N GLY A 61 -13.469 0.111 -17.503 1.00 0.00 N ATOM 891 CA GLY A 61 -12.776 -1.114 -17.874 1.00 0.00 C ATOM 892 C GLY A 61 -12.047 -1.656 -16.682 1.00 0.00 C ATOM 893 O GLY A 61 -12.179 -2.833 -16.332 1.00 0.00 O ATOM 0 H GLY A 61 -14.472 -0.004 -17.355 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -13.490 -1.851 -18.243 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -12.074 -0.916 -18.684 1.00 0.00 H new ATOM 897 N THR A 62 -11.268 -0.765 -16.062 1.00 0.00 N ATOM 898 CA THR A 62 -10.562 -1.088 -14.875 1.00 0.00 C ATOM 899 C THR A 62 -11.207 -0.253 -13.756 1.00 0.00 C ATOM 900 O THR A 62 -12.318 -0.583 -13.334 1.00 0.00 O ATOM 901 CB THR A 62 -9.013 -0.895 -14.998 1.00 0.00 C ATOM 902 OG1 THR A 62 -8.682 0.491 -15.059 1.00 0.00 O ATOM 903 CG2 THR A 62 -8.430 -1.592 -16.240 1.00 0.00 C ATOM 0 H THR A 62 -11.126 0.191 -16.388 1.00 0.00 H new ATOM 0 HA THR A 62 -10.648 -2.151 -14.652 1.00 0.00 H new ATOM 0 HB THR A 62 -8.577 -1.351 -14.109 1.00 0.00 H new ATOM 0 HG1 THR A 62 -7.718 0.591 -15.205 1.00 0.00 H new ATOM 0 HG21 THR A 62 -7.353 -1.427 -16.278 1.00 0.00 H new ATOM 0 HG22 THR A 62 -8.632 -2.662 -16.185 1.00 0.00 H new ATOM 0 HG23 THR A 62 -8.892 -1.181 -17.138 1.00 0.00 H new ATOM 911 N ILE A 63 -10.561 0.817 -13.282 1.00 0.00 N ATOM 912 CA ILE A 63 -11.188 1.659 -12.248 1.00 0.00 C ATOM 913 C ILE A 63 -11.032 3.154 -12.585 1.00 0.00 C ATOM 914 O ILE A 63 -10.341 3.502 -13.544 1.00 0.00 O ATOM 915 CB ILE A 63 -10.612 1.298 -10.845 1.00 0.00 C ATOM 916 CG1 ILE A 63 -11.743 0.975 -9.842 1.00 0.00 C ATOM 917 CG2 ILE A 63 -9.632 2.346 -10.277 1.00 0.00 C ATOM 918 CD1 ILE A 63 -12.690 2.123 -9.496 1.00 0.00 C ATOM 0 H ILE A 63 -9.634 1.118 -13.583 1.00 0.00 H new ATOM 0 HA ILE A 63 -12.259 1.459 -12.223 1.00 0.00 H new ATOM 0 HB ILE A 63 -10.015 0.399 -10.995 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -12.335 0.154 -10.246 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -11.289 0.616 -8.918 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -9.277 2.020 -9.299 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -8.784 2.455 -10.953 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -10.142 3.304 -10.177 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -13.439 1.775 -8.785 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -12.123 2.942 -9.054 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -13.185 2.472 -10.402 1.00 0.00 H new ATOM 930 N ASP A 64 -11.669 4.024 -11.790 1.00 0.00 N ATOM 931 CA ASP A 64 -11.571 5.463 -11.986 1.00 0.00 C ATOM 932 C ASP A 64 -11.052 6.146 -10.699 1.00 0.00 C ATOM 933 O ASP A 64 -10.691 5.463 -9.735 1.00 0.00 O ATOM 934 CB ASP A 64 -12.948 6.003 -12.397 1.00 0.00 C ATOM 935 CG ASP A 64 -12.884 7.352 -13.098 1.00 0.00 C ATOM 936 OD1 ASP A 64 -12.249 7.435 -14.170 1.00 0.00 O ATOM 937 OD2 ASP A 64 -13.473 8.320 -12.575 1.00 0.00 O ATOM 0 H ASP A 64 -12.258 3.748 -11.004 1.00 0.00 H new ATOM 0 HA ASP A 64 -10.857 5.685 -12.779 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -13.431 5.282 -13.057 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -13.575 6.092 -11.510 1.00 0.00 H new ATOM 942 N PHE A 65 -11.019 7.494 -10.695 1.00 0.00 N ATOM 943 CA PHE A 65 -10.538 8.281 -9.547 1.00 0.00 C ATOM 944 C PHE A 65 -11.477 8.210 -8.310 1.00 0.00 C ATOM 945 O PHE A 65 -11.024 7.779 -7.246 1.00 0.00 O ATOM 946 CB PHE A 65 -10.310 9.738 -9.956 1.00 0.00 C ATOM 947 CG PHE A 65 -8.880 10.112 -9.799 1.00 0.00 C ATOM 948 CD1 PHE A 65 -8.404 10.550 -8.575 1.00 0.00 C ATOM 949 CD2 PHE A 65 -7.999 9.970 -10.854 1.00 0.00 C ATOM 950 CE1 PHE A 65 -7.077 10.846 -8.411 1.00 0.00 C ATOM 951 CE2 PHE A 65 -6.667 10.254 -10.690 1.00 0.00 C ATOM 952 CZ PHE A 65 -6.210 10.693 -9.468 1.00 0.00 C ATOM 0 H PHE A 65 -11.324 8.063 -11.485 1.00 0.00 H new ATOM 0 HA PHE A 65 -9.593 7.831 -9.243 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -10.617 9.882 -10.992 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -10.931 10.393 -9.346 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -9.084 10.659 -7.743 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -8.361 9.633 -11.814 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -6.713 11.198 -7.457 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -5.981 10.134 -11.515 1.00 0.00 H new ATOM 0 HZ PHE A 65 -5.162 10.919 -9.338 1.00 0.00 H new ATOM 962 N PRO A 66 -12.792 8.623 -8.408 1.00 0.00 N ATOM 963 CA PRO A 66 -13.726 8.608 -7.257 1.00 0.00 C ATOM 964 C PRO A 66 -14.181 7.205 -6.835 1.00 0.00 C ATOM 965 O PRO A 66 -14.323 6.928 -5.641 1.00 0.00 O ATOM 966 CB PRO A 66 -14.935 9.431 -7.747 1.00 0.00 C ATOM 967 CG PRO A 66 -14.525 10.027 -9.053 1.00 0.00 C ATOM 968 CD PRO A 66 -13.497 9.097 -9.620 1.00 0.00 C ATOM 0 HA PRO A 66 -13.238 9.010 -6.369 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -15.815 8.799 -7.866 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -15.195 10.208 -7.028 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -15.378 10.123 -9.724 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -14.114 11.027 -8.915 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -13.953 8.275 -10.172 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -12.823 9.608 -10.308 1.00 0.00 H new ATOM 976 N GLU A 67 -14.405 6.331 -7.828 1.00 0.00 N ATOM 977 CA GLU A 67 -14.879 4.959 -7.598 1.00 0.00 C ATOM 978 C GLU A 67 -13.845 4.053 -6.905 1.00 0.00 C ATOM 979 O GLU A 67 -14.188 2.955 -6.456 1.00 0.00 O ATOM 980 CB GLU A 67 -15.310 4.329 -8.930 1.00 0.00 C ATOM 981 CG GLU A 67 -16.625 4.869 -9.487 1.00 0.00 C ATOM 982 CD GLU A 67 -16.469 6.209 -10.185 1.00 0.00 C ATOM 983 OE1 GLU A 67 -16.592 7.251 -9.507 1.00 0.00 O ATOM 984 OE2 GLU A 67 -16.224 6.215 -11.410 1.00 0.00 O ATOM 0 H GLU A 67 -14.262 6.556 -8.813 1.00 0.00 H new ATOM 0 HA GLU A 67 -15.726 5.037 -6.916 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -14.523 4.492 -9.667 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -15.402 3.251 -8.795 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -17.040 4.146 -10.189 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -17.343 4.971 -8.673 1.00 0.00 H new ATOM 991 N PHE A 68 -12.586 4.509 -6.828 1.00 0.00 N ATOM 992 CA PHE A 68 -11.509 3.738 -6.188 1.00 0.00 C ATOM 993 C PHE A 68 -11.624 3.748 -4.651 1.00 0.00 C ATOM 994 O PHE A 68 -11.522 2.695 -4.014 1.00 0.00 O ATOM 995 CB PHE A 68 -10.136 4.276 -6.642 1.00 0.00 C ATOM 996 CG PHE A 68 -8.953 3.432 -6.241 1.00 0.00 C ATOM 997 CD1 PHE A 68 -8.767 2.165 -6.775 1.00 0.00 C ATOM 998 CD2 PHE A 68 -8.024 3.916 -5.334 1.00 0.00 C ATOM 999 CE1 PHE A 68 -7.680 1.401 -6.411 1.00 0.00 C ATOM 1000 CE2 PHE A 68 -6.935 3.156 -4.969 1.00 0.00 C ATOM 1001 CZ PHE A 68 -6.764 1.899 -5.508 1.00 0.00 C ATOM 0 H PHE A 68 -12.288 5.410 -7.202 1.00 0.00 H new ATOM 0 HA PHE A 68 -11.607 2.700 -6.504 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -10.142 4.373 -7.728 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -10.003 5.278 -6.234 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -9.482 1.774 -7.484 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -8.155 4.900 -4.909 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -7.545 0.415 -6.831 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -6.217 3.544 -4.262 1.00 0.00 H new ATOM 0 HZ PHE A 68 -5.910 1.302 -5.222 1.00 0.00 H new ATOM 1011 N LEU A 69 -11.835 4.941 -4.074 1.00 0.00 N ATOM 1012 CA LEU A 69 -11.945 5.110 -2.615 1.00 0.00 C ATOM 1013 C LEU A 69 -13.263 4.577 -2.027 1.00 0.00 C ATOM 1014 O LEU A 69 -13.404 4.508 -0.801 1.00 0.00 O ATOM 1015 CB LEU A 69 -11.772 6.591 -2.243 1.00 0.00 C ATOM 1016 CG LEU A 69 -10.357 7.011 -1.817 1.00 0.00 C ATOM 1017 CD1 LEU A 69 -9.475 7.283 -3.031 1.00 0.00 C ATOM 1018 CD2 LEU A 69 -10.419 8.239 -0.921 1.00 0.00 C ATOM 0 H LEU A 69 -11.934 5.810 -4.600 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.146 4.511 -2.178 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -12.069 7.198 -3.098 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -12.460 6.825 -1.431 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.914 6.188 -1.257 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.480 7.578 -2.699 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -9.402 6.380 -3.637 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -9.912 8.085 -3.626 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.410 8.526 -0.626 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.886 9.061 -1.463 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -11.006 8.011 -0.031 1.00 0.00 H new ATOM 1030 N THR A 70 -14.220 4.193 -2.889 1.00 0.00 N ATOM 1031 CA THR A 70 -15.513 3.675 -2.426 1.00 0.00 C ATOM 1032 C THR A 70 -15.415 2.260 -1.885 1.00 0.00 C ATOM 1033 O THR A 70 -16.183 1.879 -0.997 1.00 0.00 O ATOM 1034 CB THR A 70 -16.613 3.730 -3.509 1.00 0.00 C ATOM 1035 OG1 THR A 70 -16.036 3.869 -4.812 1.00 0.00 O ATOM 1036 CG2 THR A 70 -17.572 4.881 -3.248 1.00 0.00 C ATOM 0 H THR A 70 -14.121 4.232 -3.903 1.00 0.00 H new ATOM 0 HA THR A 70 -15.800 4.343 -1.614 1.00 0.00 H new ATOM 0 HB THR A 70 -17.168 2.793 -3.466 1.00 0.00 H new ATOM 0 HG1 THR A 70 -15.398 3.142 -4.966 1.00 0.00 H new ATOM 0 HG21 THR A 70 -18.338 4.900 -4.024 1.00 0.00 H new ATOM 0 HG22 THR A 70 -18.044 4.747 -2.275 1.00 0.00 H new ATOM 0 HG23 THR A 70 -17.022 5.822 -3.258 1.00 0.00 H new ATOM 1044 N MET A 71 -14.490 1.474 -2.431 1.00 0.00 N ATOM 1045 CA MET A 71 -14.254 0.123 -1.938 1.00 0.00 C ATOM 1046 C MET A 71 -13.711 0.212 -0.512 1.00 0.00 C ATOM 1047 O MET A 71 -14.032 -0.610 0.350 1.00 0.00 O ATOM 1048 CB MET A 71 -13.266 -0.583 -2.843 1.00 0.00 C ATOM 1049 CG MET A 71 -13.747 -1.945 -3.306 1.00 0.00 C ATOM 1050 SD MET A 71 -13.834 -3.146 -1.964 1.00 0.00 S ATOM 1051 CE MET A 71 -14.683 -4.500 -2.772 1.00 0.00 C ATOM 0 H MET A 71 -13.895 1.750 -3.212 1.00 0.00 H new ATOM 0 HA MET A 71 -15.183 -0.447 -1.935 1.00 0.00 H new ATOM 0 HB2 MET A 71 -13.071 0.042 -3.715 1.00 0.00 H new ATOM 0 HB3 MET A 71 -12.319 -0.699 -2.316 1.00 0.00 H new ATOM 0 HG2 MET A 71 -14.732 -1.842 -3.761 1.00 0.00 H new ATOM 0 HG3 MET A 71 -13.076 -2.319 -4.080 1.00 0.00 H new ATOM 0 HE1 MET A 71 -15.047 -5.201 -2.021 1.00 0.00 H new ATOM 0 HE2 MET A 71 -15.526 -4.112 -3.344 1.00 0.00 H new ATOM 0 HE3 MET A 71 -13.994 -5.013 -3.443 1.00 0.00 H new ATOM 1061 N MET A 72 -12.876 1.244 -0.302 1.00 0.00 N ATOM 1062 CA MET A 72 -12.291 1.556 0.999 1.00 0.00 C ATOM 1063 C MET A 72 -13.333 2.259 1.886 1.00 0.00 C ATOM 1064 O MET A 72 -13.195 2.292 3.110 1.00 0.00 O ATOM 1065 CB MET A 72 -11.056 2.451 0.813 1.00 0.00 C ATOM 1066 CG MET A 72 -10.064 2.407 1.969 1.00 0.00 C ATOM 1067 SD MET A 72 -8.709 3.579 1.768 1.00 0.00 S ATOM 1068 CE MET A 72 -7.836 3.356 3.316 1.00 0.00 C ATOM 0 H MET A 72 -12.590 1.886 -1.041 1.00 0.00 H new ATOM 0 HA MET A 72 -11.984 0.631 1.487 1.00 0.00 H new ATOM 0 HB2 MET A 72 -10.542 2.154 -0.101 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.387 3.480 0.673 1.00 0.00 H new ATOM 0 HG2 MET A 72 -10.588 2.620 2.901 1.00 0.00 H new ATOM 0 HG3 MET A 72 -9.658 1.399 2.055 1.00 0.00 H new ATOM 0 HE1 MET A 72 -6.930 3.962 3.314 1.00 0.00 H new ATOM 0 HE2 MET A 72 -8.477 3.664 4.143 1.00 0.00 H new ATOM 0 HE3 MET A 72 -7.569 2.306 3.435 1.00 0.00 H new ATOM 1078 N ALA A 73 -14.381 2.816 1.236 1.00 0.00 N ATOM 1079 CA ALA A 73 -15.460 3.542 1.918 1.00 0.00 C ATOM 1080 C ALA A 73 -16.257 2.663 2.888 1.00 0.00 C ATOM 1081 O ALA A 73 -16.542 3.081 4.014 1.00 0.00 O ATOM 1082 CB ALA A 73 -16.390 4.158 0.890 1.00 0.00 C ATOM 0 H ALA A 73 -14.496 2.771 0.223 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.991 4.322 2.518 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -17.190 4.696 1.399 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -15.830 4.850 0.261 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -16.820 3.371 0.270 1.00 0.00 H new ATOM 1088 N ARG A 74 -16.613 1.446 2.442 1.00 0.00 N ATOM 1089 CA ARG A 74 -17.375 0.497 3.260 1.00 0.00 C ATOM 1090 C ARG A 74 -16.582 0.067 4.503 1.00 0.00 C ATOM 1091 O ARG A 74 -17.152 -0.103 5.584 1.00 0.00 O ATOM 1092 CB ARG A 74 -17.757 -0.733 2.420 1.00 0.00 C ATOM 1093 CG ARG A 74 -19.061 -1.409 2.845 1.00 0.00 C ATOM 1094 CD ARG A 74 -20.277 -0.761 2.193 1.00 0.00 C ATOM 1095 NE ARG A 74 -21.530 -1.401 2.608 1.00 0.00 N ATOM 1096 CZ ARG A 74 -22.750 -1.037 2.186 1.00 0.00 C ATOM 1097 NH1 ARG A 74 -22.910 -0.031 1.327 1.00 0.00 N ATOM 1098 NH2 ARG A 74 -23.817 -1.688 2.628 1.00 0.00 N ATOM 0 H ARG A 74 -16.381 1.098 1.512 1.00 0.00 H new ATOM 0 HA ARG A 74 -18.283 0.996 3.600 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -17.842 -0.432 1.376 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -16.949 -1.462 2.477 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -19.026 -2.465 2.578 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -19.160 -1.357 3.929 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -20.307 0.297 2.453 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -20.182 -0.820 1.109 1.00 0.00 H new ATOM 0 HE ARG A 74 -21.469 -2.179 3.265 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -22.097 0.477 0.979 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -23.846 0.231 1.017 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -23.707 -2.460 3.285 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -24.748 -1.416 2.311 1.00 0.00 H new ATOM 1112 N LYS A 75 -15.266 -0.103 4.323 1.00 0.00 N ATOM 1113 CA LYS A 75 -14.361 -0.504 5.407 1.00 0.00 C ATOM 1114 C LYS A 75 -13.961 0.683 6.295 1.00 0.00 C ATOM 1115 O LYS A 75 -13.625 0.492 7.468 1.00 0.00 O ATOM 1116 CB LYS A 75 -13.102 -1.170 4.833 1.00 0.00 C ATOM 1117 CG LYS A 75 -13.342 -2.557 4.239 1.00 0.00 C ATOM 1118 CD LYS A 75 -13.760 -2.484 2.775 1.00 0.00 C ATOM 1119 CE LYS A 75 -14.004 -3.868 2.187 1.00 0.00 C ATOM 1120 NZ LYS A 75 -15.269 -4.478 2.687 1.00 0.00 N ATOM 0 H LYS A 75 -14.800 0.033 3.426 1.00 0.00 H new ATOM 0 HA LYS A 75 -14.901 -1.218 6.029 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -12.683 -0.524 4.061 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -12.355 -1.250 5.623 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -12.433 -3.152 4.328 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -14.115 -3.069 4.812 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -14.667 -1.886 2.685 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -12.985 -1.976 2.201 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -14.042 -3.797 1.100 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -13.166 -4.519 2.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -15.402 -5.411 2.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -15.218 -4.586 3.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -16.071 -3.863 2.443 1.00 0.00 H new ATOM 1134 N MET A 76 -13.999 1.908 5.732 1.00 0.00 N ATOM 1135 CA MET A 76 -13.635 3.122 6.462 1.00 0.00 C ATOM 1136 C MET A 76 -14.774 3.602 7.393 1.00 0.00 C ATOM 1137 O MET A 76 -15.111 4.793 7.432 1.00 0.00 O ATOM 1138 CB MET A 76 -13.228 4.218 5.460 1.00 0.00 C ATOM 1139 CG MET A 76 -12.266 5.257 6.027 1.00 0.00 C ATOM 1140 SD MET A 76 -10.679 4.548 6.508 1.00 0.00 S ATOM 1141 CE MET A 76 -9.824 6.005 7.102 1.00 0.00 C ATOM 0 H MET A 76 -14.282 2.074 4.766 1.00 0.00 H new ATOM 0 HA MET A 76 -12.786 2.896 7.108 1.00 0.00 H new ATOM 0 HB2 MET A 76 -12.767 3.748 4.592 1.00 0.00 H new ATOM 0 HB3 MET A 76 -14.127 4.725 5.108 1.00 0.00 H new ATOM 0 HG2 MET A 76 -12.100 6.037 5.283 1.00 0.00 H new ATOM 0 HG3 MET A 76 -12.723 5.735 6.893 1.00 0.00 H new ATOM 0 HE1 MET A 76 -8.824 5.729 7.436 1.00 0.00 H new ATOM 0 HE2 MET A 76 -9.749 6.736 6.297 1.00 0.00 H new ATOM 0 HE3 MET A 76 -10.378 6.438 7.935 1.00 0.00 H new ATOM 1151 N LYS A 77 -15.347 2.655 8.150 1.00 0.00 N ATOM 1152 CA LYS A 77 -16.430 2.939 9.088 1.00 0.00 C ATOM 1153 C LYS A 77 -15.883 3.377 10.461 1.00 0.00 C ATOM 1154 O LYS A 77 -16.349 2.924 11.514 1.00 0.00 O ATOM 1155 CB LYS A 77 -17.345 1.707 9.227 1.00 0.00 C ATOM 1156 CG LYS A 77 -18.238 1.448 8.015 1.00 0.00 C ATOM 1157 CD LYS A 77 -19.538 2.241 8.088 1.00 0.00 C ATOM 1158 CE LYS A 77 -20.419 1.978 6.877 1.00 0.00 C ATOM 1159 NZ LYS A 77 -21.691 2.750 6.937 1.00 0.00 N ATOM 0 H LYS A 77 -15.069 1.674 8.125 1.00 0.00 H new ATOM 0 HA LYS A 77 -17.017 3.768 8.692 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -16.726 0.827 9.402 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -17.975 1.834 10.107 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -17.701 1.714 7.105 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -18.465 0.384 7.952 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -20.078 1.974 8.997 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -19.313 3.306 8.151 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -19.877 2.242 5.969 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -20.643 0.913 6.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -22.263 2.543 6.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -22.221 2.480 7.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -21.478 3.768 6.970 1.00 0.00 H new ATOM 1173 N ASP A 78 -14.887 4.288 10.430 1.00 0.00 N ATOM 1174 CA ASP A 78 -14.224 4.830 11.641 1.00 0.00 C ATOM 1175 C ASP A 78 -13.520 3.715 12.443 1.00 0.00 C ATOM 1176 O ASP A 78 -13.984 3.300 13.514 1.00 0.00 O ATOM 1177 CB ASP A 78 -15.222 5.616 12.524 1.00 0.00 C ATOM 1178 CG ASP A 78 -14.543 6.661 13.393 1.00 0.00 C ATOM 1179 OD1 ASP A 78 -14.396 7.812 12.933 1.00 0.00 O ATOM 1180 OD2 ASP A 78 -14.158 6.325 14.533 1.00 0.00 O ATOM 0 H ASP A 78 -14.516 4.672 9.561 1.00 0.00 H new ATOM 0 HA ASP A 78 -13.456 5.530 11.310 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -15.959 6.104 11.886 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -15.765 4.918 13.161 1.00 0.00 H new ATOM 1185 N THR A 79 -12.403 3.228 11.887 1.00 0.00 N ATOM 1186 CA THR A 79 -11.601 2.164 12.509 1.00 0.00 C ATOM 1187 C THR A 79 -10.687 2.709 13.614 1.00 0.00 C ATOM 1188 O THR A 79 -10.502 3.924 13.733 1.00 0.00 O ATOM 1189 CB THR A 79 -10.739 1.423 11.460 1.00 0.00 C ATOM 1190 OG1 THR A 79 -10.046 2.367 10.635 1.00 0.00 O ATOM 1191 CG2 THR A 79 -11.594 0.510 10.589 1.00 0.00 C ATOM 0 H THR A 79 -12.030 3.558 10.997 1.00 0.00 H new ATOM 0 HA THR A 79 -12.309 1.465 12.953 1.00 0.00 H new ATOM 0 HB THR A 79 -10.015 0.808 11.995 1.00 0.00 H new ATOM 0 HG1 THR A 79 -9.502 1.888 9.976 1.00 0.00 H new ATOM 0 HG21 THR A 79 -10.960 0.003 9.862 1.00 0.00 H new ATOM 0 HG22 THR A 79 -12.091 -0.230 11.216 1.00 0.00 H new ATOM 0 HG23 THR A 79 -12.344 1.104 10.066 1.00 0.00 H new ATOM 1199 N ASP A 80 -10.118 1.793 14.417 1.00 0.00 N ATOM 1200 CA ASP A 80 -9.215 2.145 15.513 1.00 0.00 C ATOM 1201 C ASP A 80 -7.822 2.538 14.987 1.00 0.00 C ATOM 1202 O ASP A 80 -7.576 2.482 13.778 1.00 0.00 O ATOM 1203 CB ASP A 80 -9.111 0.974 16.500 1.00 0.00 C ATOM 1204 CG ASP A 80 -10.354 0.824 17.357 1.00 0.00 C ATOM 1205 OD1 ASP A 80 -11.370 0.307 16.845 1.00 0.00 O ATOM 1206 OD2 ASP A 80 -10.314 1.228 18.538 1.00 0.00 O ATOM 0 H ASP A 80 -10.275 0.790 14.320 1.00 0.00 H new ATOM 0 HA ASP A 80 -9.626 3.011 16.031 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -8.942 0.050 15.946 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -8.245 1.122 17.145 1.00 0.00 H new ATOM 1211 N SER A 81 -6.918 2.933 15.902 1.00 0.00 N ATOM 1212 CA SER A 81 -5.558 3.349 15.536 1.00 0.00 C ATOM 1213 C SER A 81 -4.660 2.148 15.192 1.00 0.00 C ATOM 1214 O SER A 81 -4.240 1.998 14.047 1.00 0.00 O ATOM 1215 CB SER A 81 -4.936 4.182 16.665 1.00 0.00 C ATOM 1216 OG SER A 81 -5.703 5.346 16.922 1.00 0.00 O ATOM 0 H SER A 81 -7.109 2.972 16.903 1.00 0.00 H new ATOM 0 HA SER A 81 -5.632 3.963 14.639 1.00 0.00 H new ATOM 0 HB2 SER A 81 -4.869 3.580 17.571 1.00 0.00 H new ATOM 0 HB3 SER A 81 -3.919 4.465 16.394 1.00 0.00 H new ATOM 0 HG SER A 81 -5.287 5.859 17.646 1.00 0.00 H new ATOM 1222 N GLU A 82 -4.389 1.282 16.179 1.00 0.00 N ATOM 1223 CA GLU A 82 -3.544 0.103 15.987 1.00 0.00 C ATOM 1224 C GLU A 82 -4.111 -0.872 14.952 1.00 0.00 C ATOM 1225 O GLU A 82 -3.362 -1.676 14.393 1.00 0.00 O ATOM 1226 CB GLU A 82 -3.311 -0.610 17.324 1.00 0.00 C ATOM 1227 CG GLU A 82 -1.941 -1.264 17.447 1.00 0.00 C ATOM 1228 CD GLU A 82 -1.740 -1.950 18.784 1.00 0.00 C ATOM 1229 OE1 GLU A 82 -2.075 -3.149 18.892 1.00 0.00 O ATOM 1230 OE2 GLU A 82 -1.247 -1.290 19.722 1.00 0.00 O ATOM 0 H GLU A 82 -4.750 1.382 17.128 1.00 0.00 H new ATOM 0 HA GLU A 82 -2.591 0.458 15.595 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -3.433 0.109 18.134 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -4.079 -1.372 17.456 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -1.818 -1.993 16.646 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -1.168 -0.508 17.311 1.00 0.00 H new ATOM 1237 N GLU A 83 -5.424 -0.798 14.696 1.00 0.00 N ATOM 1238 CA GLU A 83 -6.055 -1.658 13.693 1.00 0.00 C ATOM 1239 C GLU A 83 -5.663 -1.187 12.297 1.00 0.00 C ATOM 1240 O GLU A 83 -5.401 -2.007 11.413 1.00 0.00 O ATOM 1241 CB GLU A 83 -7.579 -1.681 13.851 1.00 0.00 C ATOM 1242 CG GLU A 83 -8.058 -2.505 15.037 1.00 0.00 C ATOM 1243 CD GLU A 83 -9.569 -2.624 15.093 1.00 0.00 C ATOM 1244 OE1 GLU A 83 -10.118 -3.521 14.419 1.00 0.00 O ATOM 1245 OE2 GLU A 83 -10.202 -1.821 15.809 1.00 0.00 O ATOM 0 H GLU A 83 -6.063 -0.157 15.166 1.00 0.00 H new ATOM 0 HA GLU A 83 -5.700 -2.678 13.841 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -7.940 -0.658 13.961 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -8.024 -2.080 12.939 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -7.621 -3.502 14.982 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -7.699 -2.050 15.960 1.00 0.00 H new ATOM 1252 N GLU A 84 -5.625 0.144 12.111 1.00 0.00 N ATOM 1253 CA GLU A 84 -5.194 0.730 10.843 1.00 0.00 C ATOM 1254 C GLU A 84 -3.659 0.685 10.743 1.00 0.00 C ATOM 1255 O GLU A 84 -3.106 0.711 9.640 1.00 0.00 O ATOM 1256 CB GLU A 84 -5.755 2.157 10.634 1.00 0.00 C ATOM 1257 CG GLU A 84 -5.412 3.167 11.720 1.00 0.00 C ATOM 1258 CD GLU A 84 -6.040 4.526 11.475 1.00 0.00 C ATOM 1259 OE1 GLU A 84 -5.402 5.361 10.800 1.00 0.00 O ATOM 1260 OE2 GLU A 84 -7.168 4.754 11.958 1.00 0.00 O ATOM 0 H GLU A 84 -5.887 0.826 12.823 1.00 0.00 H new ATOM 0 HA GLU A 84 -5.608 0.132 10.031 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -5.386 2.536 9.681 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -6.840 2.093 10.553 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -5.747 2.785 12.684 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -4.329 3.277 11.779 1.00 0.00 H new ATOM 1267 N ILE A 85 -2.978 0.604 11.917 1.00 0.00 N ATOM 1268 CA ILE A 85 -1.524 0.501 11.978 1.00 0.00 C ATOM 1269 C ILE A 85 -1.095 -0.910 11.581 1.00 0.00 C ATOM 1270 O ILE A 85 -0.137 -1.082 10.821 1.00 0.00 O ATOM 1271 CB ILE A 85 -1.041 0.867 13.414 1.00 0.00 C ATOM 1272 CG1 ILE A 85 -0.549 2.320 13.488 1.00 0.00 C ATOM 1273 CG2 ILE A 85 0.036 -0.075 13.939 1.00 0.00 C ATOM 1274 CD1 ILE A 85 -1.649 3.329 13.735 1.00 0.00 C ATOM 0 H ILE A 85 -3.431 0.609 12.831 1.00 0.00 H new ATOM 0 HA ILE A 85 -1.066 1.200 11.278 1.00 0.00 H new ATOM 0 HB ILE A 85 -1.914 0.754 14.057 1.00 0.00 H new ATOM 0 HG12 ILE A 85 0.191 2.402 14.284 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -0.043 2.570 12.555 1.00 0.00 H new ATOM 0 HG21 ILE A 85 0.330 0.232 14.942 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -0.354 -1.092 13.971 1.00 0.00 H new ATOM 0 HG23 ILE A 85 0.903 -0.040 13.280 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -1.222 4.331 13.774 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -2.379 3.277 12.927 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -2.140 3.107 14.682 1.00 0.00 H new ATOM 1286 N ARG A 86 -1.817 -1.914 12.108 1.00 0.00 N ATOM 1287 CA ARG A 86 -1.534 -3.319 11.775 1.00 0.00 C ATOM 1288 C ARG A 86 -1.831 -3.589 10.296 1.00 0.00 C ATOM 1289 O ARG A 86 -1.268 -4.511 9.707 1.00 0.00 O ATOM 1290 CB ARG A 86 -2.330 -4.285 12.645 1.00 0.00 C ATOM 1291 CG ARG A 86 -1.906 -4.301 14.108 1.00 0.00 C ATOM 1292 CD ARG A 86 -2.804 -5.204 14.938 1.00 0.00 C ATOM 1293 NE ARG A 86 -2.407 -5.226 16.350 1.00 0.00 N ATOM 1294 CZ ARG A 86 -3.030 -5.929 17.307 1.00 0.00 C ATOM 1295 NH1 ARG A 86 -4.091 -6.684 17.028 1.00 0.00 N ATOM 1296 NH2 ARG A 86 -2.584 -5.874 18.555 1.00 0.00 N ATOM 0 H ARG A 86 -2.591 -1.781 12.758 1.00 0.00 H new ATOM 0 HA ARG A 86 -0.475 -3.488 11.971 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -3.386 -4.023 12.587 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -2.229 -5.291 12.238 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -0.874 -4.642 14.185 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -1.937 -3.288 14.508 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -3.836 -4.863 14.857 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -2.771 -6.217 14.536 1.00 0.00 H new ATOM 0 HE ARG A 86 -1.599 -4.666 16.623 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -4.444 -6.735 16.072 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -4.551 -7.211 17.770 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -1.772 -5.300 18.782 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -3.053 -6.406 19.288 1.00 0.00 H new ATOM 1310 N GLU A 87 -2.733 -2.765 9.714 1.00 0.00 N ATOM 1311 CA GLU A 87 -3.100 -2.839 8.292 1.00 0.00 C ATOM 1312 C GLU A 87 -1.981 -2.339 7.399 1.00 0.00 C ATOM 1313 O GLU A 87 -2.149 -2.180 6.183 1.00 0.00 O ATOM 1314 CB GLU A 87 -4.407 -2.083 8.022 1.00 0.00 C ATOM 1315 CG GLU A 87 -5.652 -2.827 8.481 1.00 0.00 C ATOM 1316 CD GLU A 87 -6.928 -2.055 8.205 1.00 0.00 C ATOM 1317 OE1 GLU A 87 -7.344 -1.265 9.079 1.00 0.00 O ATOM 1318 OE2 GLU A 87 -7.510 -2.241 7.117 1.00 0.00 O ATOM 0 H GLU A 87 -3.224 -2.031 10.224 1.00 0.00 H new ATOM 0 HA GLU A 87 -3.263 -3.889 8.049 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -4.367 -1.116 8.524 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -4.487 -1.884 6.953 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -5.700 -3.793 7.978 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -5.577 -3.028 9.550 1.00 0.00 H new ATOM 1325 N ALA A 88 -0.832 -2.109 8.019 1.00 0.00 N ATOM 1326 CA ALA A 88 0.344 -1.713 7.313 1.00 0.00 C ATOM 1327 C ALA A 88 1.582 -2.379 7.914 1.00 0.00 C ATOM 1328 O ALA A 88 2.636 -2.391 7.294 1.00 0.00 O ATOM 1329 CB ALA A 88 0.499 -0.195 7.275 1.00 0.00 C ATOM 0 H ALA A 88 -0.705 -2.196 9.027 1.00 0.00 H new ATOM 0 HA ALA A 88 0.239 -2.050 6.282 1.00 0.00 H new ATOM 0 HB1 ALA A 88 1.406 0.065 6.729 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -0.364 0.246 6.776 1.00 0.00 H new ATOM 0 HB3 ALA A 88 0.566 0.190 8.293 1.00 0.00 H new ATOM 1335 N PHE A 89 1.439 -2.903 9.143 1.00 0.00 N ATOM 1336 CA PHE A 89 2.526 -3.574 9.862 1.00 0.00 C ATOM 1337 C PHE A 89 2.840 -4.992 9.338 1.00 0.00 C ATOM 1338 O PHE A 89 3.838 -5.174 8.636 1.00 0.00 O ATOM 1339 CB PHE A 89 2.238 -3.587 11.374 1.00 0.00 C ATOM 1340 CG PHE A 89 3.462 -3.458 12.253 1.00 0.00 C ATOM 1341 CD1 PHE A 89 4.569 -4.279 12.072 1.00 0.00 C ATOM 1342 CD2 PHE A 89 3.497 -2.516 13.270 1.00 0.00 C ATOM 1343 CE1 PHE A 89 5.679 -4.160 12.884 1.00 0.00 C ATOM 1344 CE2 PHE A 89 4.606 -2.396 14.085 1.00 0.00 C ATOM 1345 CZ PHE A 89 5.697 -3.218 13.892 1.00 0.00 C ATOM 0 H PHE A 89 0.563 -2.871 9.664 1.00 0.00 H new ATOM 0 HA PHE A 89 3.427 -2.991 9.673 1.00 0.00 H new ATOM 0 HB2 PHE A 89 1.553 -2.771 11.606 1.00 0.00 H new ATOM 0 HB3 PHE A 89 1.724 -4.515 11.624 1.00 0.00 H new ATOM 0 HD1 PHE A 89 4.561 -5.020 11.286 1.00 0.00 H new ATOM 0 HD2 PHE A 89 2.647 -1.868 13.427 1.00 0.00 H new ATOM 0 HE1 PHE A 89 6.533 -4.804 12.730 1.00 0.00 H new ATOM 0 HE2 PHE A 89 4.619 -1.658 14.874 1.00 0.00 H new ATOM 0 HZ PHE A 89 6.564 -3.124 14.529 1.00 0.00 H new ATOM 1355 N ARG A 90 1.982 -5.992 9.668 1.00 0.00 N ATOM 1356 CA ARG A 90 2.200 -7.395 9.240 1.00 0.00 C ATOM 1357 C ARG A 90 1.931 -7.523 7.753 1.00 0.00 C ATOM 1358 O ARG A 90 2.295 -8.508 7.105 1.00 0.00 O ATOM 1359 CB ARG A 90 1.304 -8.363 10.024 1.00 0.00 C ATOM 1360 CG ARG A 90 1.748 -8.596 11.467 1.00 0.00 C ATOM 1361 CD ARG A 90 1.037 -7.665 12.440 1.00 0.00 C ATOM 1362 NE ARG A 90 -0.352 -8.073 12.684 1.00 0.00 N ATOM 1363 CZ ARG A 90 -1.004 -7.910 13.844 1.00 0.00 C ATOM 1364 NH1 ARG A 90 -0.410 -7.344 14.894 1.00 0.00 N ATOM 1365 NH2 ARG A 90 -2.261 -8.317 13.951 1.00 0.00 N ATOM 0 H ARG A 90 1.139 -5.852 10.225 1.00 0.00 H new ATOM 0 HA ARG A 90 3.237 -7.659 9.447 1.00 0.00 H new ATOM 0 HB2 ARG A 90 0.285 -7.976 10.027 1.00 0.00 H new ATOM 0 HB3 ARG A 90 1.280 -9.321 9.504 1.00 0.00 H new ATOM 0 HG2 ARG A 90 1.549 -9.631 11.745 1.00 0.00 H new ATOM 0 HG3 ARG A 90 2.825 -8.447 11.544 1.00 0.00 H new ATOM 0 HD2 ARG A 90 1.580 -7.647 13.385 1.00 0.00 H new ATOM 0 HD3 ARG A 90 1.051 -6.649 12.045 1.00 0.00 H new ATOM 0 HE ARG A 90 -0.858 -8.512 11.915 1.00 0.00 H new ATOM 0 HH11 ARG A 90 0.557 -7.026 14.823 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -0.922 -7.228 15.769 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -2.726 -8.751 13.154 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -2.763 -8.196 14.831 1.00 0.00 H new ATOM 1379 N VAL A 91 1.279 -6.484 7.251 1.00 0.00 N ATOM 1380 CA VAL A 91 0.927 -6.335 5.852 1.00 0.00 C ATOM 1381 C VAL A 91 2.188 -5.931 5.089 1.00 0.00 C ATOM 1382 O VAL A 91 2.344 -6.208 3.900 1.00 0.00 O ATOM 1383 CB VAL A 91 -0.179 -5.262 5.694 1.00 0.00 C ATOM 1384 CG1 VAL A 91 -0.933 -5.427 4.383 1.00 0.00 C ATOM 1385 CG2 VAL A 91 -1.151 -5.301 6.861 1.00 0.00 C ATOM 0 H VAL A 91 0.972 -5.699 7.826 1.00 0.00 H new ATOM 0 HA VAL A 91 0.539 -7.272 5.453 1.00 0.00 H new ATOM 0 HB VAL A 91 0.316 -4.291 5.684 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -1.701 -4.658 4.306 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -0.238 -5.331 3.549 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -1.401 -6.411 4.354 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -1.916 -4.537 6.723 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -1.623 -6.282 6.909 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -0.612 -5.111 7.790 1.00 0.00 H new ATOM 1395 N PHE A 92 3.060 -5.236 5.822 1.00 0.00 N ATOM 1396 CA PHE A 92 4.355 -4.792 5.331 1.00 0.00 C ATOM 1397 C PHE A 92 5.419 -5.892 5.549 1.00 0.00 C ATOM 1398 O PHE A 92 5.973 -6.412 4.582 1.00 0.00 O ATOM 1399 CB PHE A 92 4.722 -3.458 6.026 1.00 0.00 C ATOM 1400 CG PHE A 92 6.021 -2.821 5.588 1.00 0.00 C ATOM 1401 CD1 PHE A 92 6.238 -2.496 4.259 1.00 0.00 C ATOM 1402 CD2 PHE A 92 7.015 -2.535 6.512 1.00 0.00 C ATOM 1403 CE1 PHE A 92 7.414 -1.906 3.860 1.00 0.00 C ATOM 1404 CE2 PHE A 92 8.199 -1.942 6.113 1.00 0.00 C ATOM 1405 CZ PHE A 92 8.398 -1.628 4.786 1.00 0.00 C ATOM 0 H PHE A 92 2.878 -4.964 6.788 1.00 0.00 H new ATOM 0 HA PHE A 92 4.315 -4.612 4.257 1.00 0.00 H new ATOM 0 HB2 PHE A 92 3.914 -2.747 5.853 1.00 0.00 H new ATOM 0 HB3 PHE A 92 4.769 -3.632 7.101 1.00 0.00 H new ATOM 0 HD1 PHE A 92 5.473 -2.709 3.527 1.00 0.00 H new ATOM 0 HD2 PHE A 92 6.863 -2.778 7.553 1.00 0.00 H new ATOM 0 HE1 PHE A 92 7.568 -1.660 2.820 1.00 0.00 H new ATOM 0 HE2 PHE A 92 8.967 -1.725 6.841 1.00 0.00 H new ATOM 0 HZ PHE A 92 9.322 -1.165 4.472 1.00 0.00 H new ATOM 1415 N ASP A 93 5.666 -6.262 6.822 1.00 0.00 N ATOM 1416 CA ASP A 93 6.645 -7.277 7.191 1.00 0.00 C ATOM 1417 C ASP A 93 6.225 -8.706 6.771 1.00 0.00 C ATOM 1418 O ASP A 93 5.178 -9.208 7.191 1.00 0.00 O ATOM 1419 CB ASP A 93 6.888 -7.181 8.703 1.00 0.00 C ATOM 1420 CG ASP A 93 5.761 -7.714 9.584 1.00 0.00 C ATOM 1421 OD1 ASP A 93 5.621 -8.949 9.693 1.00 0.00 O ATOM 1422 OD2 ASP A 93 5.028 -6.891 10.170 1.00 0.00 O ATOM 0 H ASP A 93 5.182 -5.855 7.622 1.00 0.00 H new ATOM 0 HA ASP A 93 7.570 -7.083 6.648 1.00 0.00 H new ATOM 0 HB2 ASP A 93 7.801 -7.726 8.942 1.00 0.00 H new ATOM 0 HB3 ASP A 93 7.063 -6.136 8.960 1.00 0.00 H new ATOM 1427 N LYS A 94 7.036 -9.327 5.902 1.00 0.00 N ATOM 1428 CA LYS A 94 6.812 -10.695 5.432 1.00 0.00 C ATOM 1429 C LYS A 94 6.933 -11.746 6.547 1.00 0.00 C ATOM 1430 O LYS A 94 6.129 -12.681 6.607 1.00 0.00 O ATOM 1431 CB LYS A 94 7.788 -11.008 4.311 1.00 0.00 C ATOM 1432 CG LYS A 94 7.261 -10.553 2.970 1.00 0.00 C ATOM 1433 CD LYS A 94 6.651 -11.718 2.198 1.00 0.00 C ATOM 1434 CE LYS A 94 5.720 -11.246 1.095 1.00 0.00 C ATOM 1435 NZ LYS A 94 5.196 -12.384 0.290 1.00 0.00 N ATOM 0 H LYS A 94 7.868 -8.890 5.506 1.00 0.00 H new ATOM 0 HA LYS A 94 5.785 -10.748 5.070 1.00 0.00 H new ATOM 0 HB2 LYS A 94 8.742 -10.520 4.512 1.00 0.00 H new ATOM 0 HB3 LYS A 94 7.978 -12.081 4.283 1.00 0.00 H new ATOM 0 HG2 LYS A 94 6.511 -9.776 3.115 1.00 0.00 H new ATOM 0 HG3 LYS A 94 8.070 -10.111 2.389 1.00 0.00 H new ATOM 0 HD2 LYS A 94 7.448 -12.323 1.765 1.00 0.00 H new ATOM 0 HD3 LYS A 94 6.101 -12.360 2.886 1.00 0.00 H new ATOM 0 HE2 LYS A 94 4.887 -10.696 1.533 1.00 0.00 H new ATOM 0 HE3 LYS A 94 6.251 -10.553 0.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 4.647 -12.017 -0.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 5.991 -12.953 -0.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 4.584 -12.977 0.885 1.00 0.00 H new ATOM 1449 N ASP A 95 7.937 -11.584 7.420 1.00 0.00 N ATOM 1450 CA ASP A 95 8.164 -12.520 8.526 1.00 0.00 C ATOM 1451 C ASP A 95 7.730 -11.908 9.864 1.00 0.00 C ATOM 1452 O ASP A 95 6.983 -12.535 10.621 1.00 0.00 O ATOM 1453 CB ASP A 95 9.641 -12.936 8.578 1.00 0.00 C ATOM 1454 CG ASP A 95 9.831 -14.347 9.104 1.00 0.00 C ATOM 1455 OD1 ASP A 95 9.674 -14.552 10.325 1.00 0.00 O ATOM 1456 OD2 ASP A 95 10.134 -15.247 8.292 1.00 0.00 O ATOM 0 H ASP A 95 8.604 -10.813 7.380 1.00 0.00 H new ATOM 0 HA ASP A 95 7.557 -13.408 8.350 1.00 0.00 H new ATOM 0 HB2 ASP A 95 10.071 -12.864 7.579 1.00 0.00 H new ATOM 0 HB3 ASP A 95 10.189 -12.239 9.212 1.00 0.00 H new ATOM 1461 N GLY A 96 8.206 -10.683 10.142 1.00 0.00 N ATOM 1462 CA GLY A 96 7.860 -9.985 11.378 1.00 0.00 C ATOM 1463 C GLY A 96 8.711 -10.394 12.571 1.00 0.00 C ATOM 1464 O GLY A 96 8.230 -11.089 13.471 1.00 0.00 O ATOM 0 H GLY A 96 8.829 -10.162 9.525 1.00 0.00 H new ATOM 0 HA2 GLY A 96 7.964 -8.912 11.220 1.00 0.00 H new ATOM 0 HA3 GLY A 96 6.812 -10.173 11.610 1.00 0.00 H new ATOM 1468 N ASN A 97 9.974 -9.958 12.567 1.00 0.00 N ATOM 1469 CA ASN A 97 10.908 -10.250 13.644 1.00 0.00 C ATOM 1470 C ASN A 97 11.467 -8.954 14.240 1.00 0.00 C ATOM 1471 O ASN A 97 12.663 -8.848 14.543 1.00 0.00 O ATOM 1472 CB ASN A 97 12.037 -11.164 13.142 1.00 0.00 C ATOM 1473 CG ASN A 97 11.561 -12.575 12.848 1.00 0.00 C ATOM 1474 OD1 ASN A 97 11.154 -12.883 11.729 1.00 0.00 O ATOM 1475 ND2 ASN A 97 11.609 -13.438 13.856 1.00 0.00 N ATOM 0 H ASN A 97 10.372 -9.394 11.816 1.00 0.00 H new ATOM 0 HA ASN A 97 10.374 -10.777 14.435 1.00 0.00 H new ATOM 0 HB2 ASN A 97 12.471 -10.736 12.239 1.00 0.00 H new ATOM 0 HB3 ASN A 97 12.829 -11.201 13.890 1.00 0.00 H new ATOM 0 HD21 ASN A 97 11.301 -14.401 13.718 1.00 0.00 H new ATOM 0 HD22 ASN A 97 11.954 -13.138 14.768 1.00 0.00 H new ATOM 1482 N GLY A 98 10.572 -7.970 14.426 1.00 0.00 N ATOM 1483 CA GLY A 98 10.966 -6.668 14.955 1.00 0.00 C ATOM 1484 C GLY A 98 11.463 -5.749 13.851 1.00 0.00 C ATOM 1485 O GLY A 98 11.275 -4.534 13.910 1.00 0.00 O ATOM 0 H GLY A 98 9.577 -8.057 14.217 1.00 0.00 H new ATOM 0 HA2 GLY A 98 10.117 -6.207 15.460 1.00 0.00 H new ATOM 0 HA3 GLY A 98 11.749 -6.799 15.702 1.00 0.00 H new ATOM 1489 N TYR A 99 12.084 -6.368 12.843 1.00 0.00 N ATOM 1490 CA TYR A 99 12.635 -5.675 11.674 1.00 0.00 C ATOM 1491 C TYR A 99 12.013 -6.245 10.401 1.00 0.00 C ATOM 1492 O TYR A 99 11.697 -7.437 10.333 1.00 0.00 O ATOM 1493 CB TYR A 99 14.152 -5.862 11.606 1.00 0.00 C ATOM 1494 CG TYR A 99 14.922 -5.182 12.719 1.00 0.00 C ATOM 1495 CD1 TYR A 99 15.109 -5.809 13.946 1.00 0.00 C ATOM 1496 CD2 TYR A 99 15.469 -3.918 12.538 1.00 0.00 C ATOM 1497 CE1 TYR A 99 15.819 -5.193 14.960 1.00 0.00 C ATOM 1498 CE2 TYR A 99 16.179 -3.297 13.547 1.00 0.00 C ATOM 1499 CZ TYR A 99 16.351 -3.938 14.756 1.00 0.00 C ATOM 1500 OH TYR A 99 17.059 -3.323 15.763 1.00 0.00 O ATOM 0 H TYR A 99 12.220 -7.378 12.815 1.00 0.00 H new ATOM 0 HA TYR A 99 12.406 -4.613 11.763 1.00 0.00 H new ATOM 0 HB2 TYR A 99 14.375 -6.929 11.627 1.00 0.00 H new ATOM 0 HB3 TYR A 99 14.509 -5.481 10.649 1.00 0.00 H new ATOM 0 HD1 TYR A 99 14.693 -6.792 14.109 1.00 0.00 H new ATOM 0 HD2 TYR A 99 15.337 -3.413 11.593 1.00 0.00 H new ATOM 0 HE1 TYR A 99 15.956 -5.693 15.907 1.00 0.00 H new ATOM 0 HE2 TYR A 99 16.598 -2.314 13.390 1.00 0.00 H new ATOM 0 HH TYR A 99 17.367 -2.444 15.457 1.00 0.00 H new ATOM 1510 N ILE A 100 11.846 -5.380 9.403 1.00 0.00 N ATOM 1511 CA ILE A 100 11.287 -5.759 8.108 1.00 0.00 C ATOM 1512 C ILE A 100 12.417 -6.009 7.161 1.00 0.00 C ATOM 1513 O ILE A 100 13.344 -5.225 7.064 1.00 0.00 O ATOM 1514 CB ILE A 100 10.276 -4.720 7.554 1.00 0.00 C ATOM 1515 CG1 ILE A 100 9.040 -4.651 8.452 1.00 0.00 C ATOM 1516 CG2 ILE A 100 9.835 -5.086 6.153 1.00 0.00 C ATOM 1517 CD1 ILE A 100 9.008 -3.490 9.408 1.00 0.00 C ATOM 0 H ILE A 100 12.096 -4.393 9.470 1.00 0.00 H new ATOM 0 HA ILE A 100 10.704 -6.671 8.232 1.00 0.00 H new ATOM 0 HB ILE A 100 10.777 -3.752 7.533 1.00 0.00 H new ATOM 0 HG12 ILE A 100 8.153 -4.605 7.820 1.00 0.00 H new ATOM 0 HG13 ILE A 100 8.975 -5.576 9.026 1.00 0.00 H new ATOM 0 HG21 ILE A 100 9.127 -4.342 5.788 1.00 0.00 H new ATOM 0 HG22 ILE A 100 10.703 -5.115 5.494 1.00 0.00 H new ATOM 0 HG23 ILE A 100 9.357 -6.066 6.166 1.00 0.00 H new ATOM 0 HD11 ILE A 100 8.093 -3.530 9.999 1.00 0.00 H new ATOM 0 HD12 ILE A 100 9.871 -3.541 10.072 1.00 0.00 H new ATOM 0 HD13 ILE A 100 9.037 -2.556 8.847 1.00 0.00 H new ATOM 1529 N SER A 101 12.243 -7.059 6.390 1.00 0.00 N ATOM 1530 CA SER A 101 13.254 -7.549 5.489 1.00 0.00 C ATOM 1531 C SER A 101 13.448 -6.651 4.285 1.00 0.00 C ATOM 1532 O SER A 101 12.534 -5.935 3.866 1.00 0.00 O ATOM 1533 CB SER A 101 12.838 -8.950 5.121 1.00 0.00 C ATOM 1534 OG SER A 101 12.190 -9.027 3.860 1.00 0.00 O ATOM 0 H SER A 101 11.380 -7.603 6.373 1.00 0.00 H new ATOM 0 HA SER A 101 14.234 -7.553 5.966 1.00 0.00 H new ATOM 0 HB2 SER A 101 13.718 -9.593 5.110 1.00 0.00 H new ATOM 0 HB3 SER A 101 12.170 -9.338 5.890 1.00 0.00 H new ATOM 0 HG SER A 101 11.945 -9.958 3.674 1.00 0.00 H new ATOM 1540 N ALA A 102 14.666 -6.707 3.745 1.00 0.00 N ATOM 1541 CA ALA A 102 15.054 -5.842 2.637 1.00 0.00 C ATOM 1542 C ALA A 102 14.362 -6.182 1.332 1.00 0.00 C ATOM 1543 O ALA A 102 13.761 -5.318 0.697 1.00 0.00 O ATOM 1544 CB ALA A 102 16.569 -5.853 2.460 1.00 0.00 C ATOM 0 H ALA A 102 15.399 -7.343 4.059 1.00 0.00 H new ATOM 0 HA ALA A 102 14.724 -4.837 2.902 1.00 0.00 H new ATOM 0 HB1 ALA A 102 16.843 -5.203 1.629 1.00 0.00 H new ATOM 0 HB2 ALA A 102 17.045 -5.495 3.373 1.00 0.00 H new ATOM 0 HB3 ALA A 102 16.904 -6.869 2.251 1.00 0.00 H new ATOM 1550 N ALA A 103 14.433 -7.448 0.965 1.00 0.00 N ATOM 1551 CA ALA A 103 13.809 -7.956 -0.259 1.00 0.00 C ATOM 1552 C ALA A 103 12.290 -8.096 -0.111 1.00 0.00 C ATOM 1553 O ALA A 103 11.633 -8.763 -0.921 1.00 0.00 O ATOM 1554 CB ALA A 103 14.456 -9.282 -0.643 1.00 0.00 C ATOM 0 H ALA A 103 14.925 -8.161 1.504 1.00 0.00 H new ATOM 0 HA ALA A 103 13.974 -7.234 -1.059 1.00 0.00 H new ATOM 0 HB1 ALA A 103 13.993 -9.662 -1.554 1.00 0.00 H new ATOM 0 HB2 ALA A 103 15.522 -9.131 -0.813 1.00 0.00 H new ATOM 0 HB3 ALA A 103 14.316 -10.002 0.163 1.00 0.00 H new ATOM 1560 N GLU A 104 11.735 -7.454 0.924 1.00 0.00 N ATOM 1561 CA GLU A 104 10.308 -7.529 1.189 1.00 0.00 C ATOM 1562 C GLU A 104 9.486 -6.654 0.270 1.00 0.00 C ATOM 1563 O GLU A 104 8.538 -7.158 -0.328 1.00 0.00 O ATOM 1564 CB GLU A 104 10.026 -7.232 2.683 1.00 0.00 C ATOM 1565 CG GLU A 104 8.552 -7.051 3.069 1.00 0.00 C ATOM 1566 CD GLU A 104 8.046 -5.637 2.814 1.00 0.00 C ATOM 1567 OE1 GLU A 104 8.448 -4.717 3.552 1.00 0.00 O ATOM 1568 OE2 GLU A 104 7.250 -5.453 1.870 1.00 0.00 O ATOM 0 H GLU A 104 12.258 -6.880 1.586 1.00 0.00 H new ATOM 0 HA GLU A 104 9.990 -8.549 0.973 1.00 0.00 H new ATOM 0 HB2 GLU A 104 10.439 -8.046 3.278 1.00 0.00 H new ATOM 0 HB3 GLU A 104 10.567 -6.327 2.961 1.00 0.00 H new ATOM 0 HG2 GLU A 104 7.944 -7.757 2.504 1.00 0.00 H new ATOM 0 HG3 GLU A 104 8.425 -7.293 4.124 1.00 0.00 H new ATOM 1575 N LEU A 105 9.808 -5.364 0.151 1.00 0.00 N ATOM 1576 CA LEU A 105 9.019 -4.521 -0.722 1.00 0.00 C ATOM 1577 C LEU A 105 9.108 -4.973 -2.167 1.00 0.00 C ATOM 1578 O LEU A 105 8.151 -4.810 -2.913 1.00 0.00 O ATOM 1579 CB LEU A 105 9.286 -3.045 -0.539 1.00 0.00 C ATOM 1580 CG LEU A 105 8.523 -2.430 0.642 1.00 0.00 C ATOM 1581 CD1 LEU A 105 9.268 -1.203 1.101 1.00 0.00 C ATOM 1582 CD2 LEU A 105 7.044 -2.097 0.311 1.00 0.00 C ATOM 0 H LEU A 105 10.580 -4.902 0.631 1.00 0.00 H new ATOM 0 HA LEU A 105 7.980 -4.649 -0.418 1.00 0.00 H new ATOM 0 HB2 LEU A 105 10.355 -2.892 -0.391 1.00 0.00 H new ATOM 0 HB3 LEU A 105 9.013 -2.518 -1.453 1.00 0.00 H new ATOM 0 HG LEU A 105 8.478 -3.170 1.441 1.00 0.00 H new ATOM 0 HD11 LEU A 105 8.741 -0.750 1.941 1.00 0.00 H new ATOM 0 HD12 LEU A 105 10.274 -1.484 1.412 1.00 0.00 H new ATOM 0 HD13 LEU A 105 9.328 -0.486 0.282 1.00 0.00 H new ATOM 0 HD21 LEU A 105 6.563 -1.666 1.189 1.00 0.00 H new ATOM 0 HD22 LEU A 105 7.007 -1.382 -0.511 1.00 0.00 H new ATOM 0 HD23 LEU A 105 6.522 -3.009 0.022 1.00 0.00 H new ATOM 1594 N ARG A 106 10.244 -5.562 -2.584 1.00 0.00 N ATOM 1595 CA ARG A 106 10.306 -6.074 -3.946 1.00 0.00 C ATOM 1596 C ARG A 106 9.402 -7.311 -4.030 1.00 0.00 C ATOM 1597 O ARG A 106 8.916 -7.654 -5.104 1.00 0.00 O ATOM 1598 CB ARG A 106 11.757 -6.317 -4.443 1.00 0.00 C ATOM 1599 CG ARG A 106 12.139 -7.770 -4.695 1.00 0.00 C ATOM 1600 CD ARG A 106 12.993 -8.288 -3.567 1.00 0.00 C ATOM 1601 NE ARG A 106 12.793 -9.723 -3.340 1.00 0.00 N ATOM 1602 CZ ARG A 106 13.676 -10.680 -3.663 1.00 0.00 C ATOM 1603 NH1 ARG A 106 14.841 -10.379 -4.236 1.00 0.00 N ATOM 1604 NH2 ARG A 106 13.387 -11.949 -3.411 1.00 0.00 N ATOM 0 H ARG A 106 11.087 -5.687 -2.023 1.00 0.00 H new ATOM 0 HA ARG A 106 9.932 -5.319 -4.638 1.00 0.00 H new ATOM 0 HB2 ARG A 106 11.902 -5.758 -5.367 1.00 0.00 H new ATOM 0 HB3 ARG A 106 12.447 -5.902 -3.708 1.00 0.00 H new ATOM 0 HG2 ARG A 106 11.240 -8.379 -4.789 1.00 0.00 H new ATOM 0 HG3 ARG A 106 12.680 -7.853 -5.638 1.00 0.00 H new ATOM 0 HD2 ARG A 106 14.043 -8.099 -3.791 1.00 0.00 H new ATOM 0 HD3 ARG A 106 12.759 -7.741 -2.654 1.00 0.00 H new ATOM 0 HE ARG A 106 11.918 -10.015 -2.904 1.00 0.00 H new ATOM 0 HH11 ARG A 106 15.075 -9.407 -4.437 1.00 0.00 H new ATOM 0 HH12 ARG A 106 15.499 -11.121 -4.474 1.00 0.00 H new ATOM 0 HH21 ARG A 106 12.498 -12.193 -2.974 1.00 0.00 H new ATOM 0 HH22 ARG A 106 14.054 -12.682 -3.654 1.00 0.00 H new ATOM 1618 N HIS A 107 9.227 -8.001 -2.881 1.00 0.00 N ATOM 1619 CA HIS A 107 8.331 -9.153 -2.794 1.00 0.00 C ATOM 1620 C HIS A 107 6.853 -8.709 -2.714 1.00 0.00 C ATOM 1621 O HIS A 107 6.016 -9.140 -3.511 1.00 0.00 O ATOM 1622 CB HIS A 107 8.699 -9.996 -1.586 1.00 0.00 C ATOM 1623 CG HIS A 107 8.533 -11.470 -1.798 1.00 0.00 C ATOM 1624 ND1 HIS A 107 9.598 -12.331 -1.956 1.00 0.00 N ATOM 1625 CD2 HIS A 107 7.418 -12.238 -1.874 1.00 0.00 C ATOM 1626 CE1 HIS A 107 9.148 -13.562 -2.121 1.00 0.00 C ATOM 1627 NE2 HIS A 107 7.829 -13.532 -2.075 1.00 0.00 N ATOM 0 H HIS A 107 9.699 -7.772 -2.006 1.00 0.00 H new ATOM 0 HA HIS A 107 8.447 -9.750 -3.699 1.00 0.00 H new ATOM 0 HB2 HIS A 107 9.735 -9.793 -1.316 1.00 0.00 H new ATOM 0 HB3 HIS A 107 8.083 -9.689 -0.741 1.00 0.00 H new ATOM 0 HD2 HIS A 107 6.397 -11.895 -1.792 1.00 0.00 H new ATOM 0 HE1 HIS A 107 9.756 -14.443 -2.268 1.00 0.00 H new ATOM 0 HE2 HIS A 107 7.214 -14.340 -2.173 1.00 0.00 H new ATOM 1636 N VAL A 108 6.571 -7.836 -1.725 1.00 0.00 N ATOM 1637 CA VAL A 108 5.223 -7.307 -1.440 1.00 0.00 C ATOM 1638 C VAL A 108 4.763 -6.238 -2.453 1.00 0.00 C ATOM 1639 O VAL A 108 3.715 -6.398 -3.084 1.00 0.00 O ATOM 1640 CB VAL A 108 5.178 -6.715 0.011 1.00 0.00 C ATOM 1641 CG1 VAL A 108 3.834 -6.068 0.339 1.00 0.00 C ATOM 1642 CG2 VAL A 108 5.488 -7.789 1.045 1.00 0.00 C ATOM 0 H VAL A 108 7.285 -7.474 -1.093 1.00 0.00 H new ATOM 0 HA VAL A 108 4.532 -8.145 -1.529 1.00 0.00 H new ATOM 0 HB VAL A 108 5.941 -5.938 0.048 1.00 0.00 H new ATOM 0 HG11 VAL A 108 3.858 -5.675 1.355 1.00 0.00 H new ATOM 0 HG12 VAL A 108 3.641 -5.255 -0.360 1.00 0.00 H new ATOM 0 HG13 VAL A 108 3.042 -6.812 0.257 1.00 0.00 H new ATOM 0 HG21 VAL A 108 5.451 -7.354 2.044 1.00 0.00 H new ATOM 0 HG22 VAL A 108 4.752 -8.589 0.970 1.00 0.00 H new ATOM 0 HG23 VAL A 108 6.484 -8.193 0.862 1.00 0.00 H new ATOM 1652 N MET A 109 5.561 -5.164 -2.610 1.00 0.00 N ATOM 1653 CA MET A 109 5.231 -4.053 -3.519 1.00 0.00 C ATOM 1654 C MET A 109 5.082 -4.505 -4.973 1.00 0.00 C ATOM 1655 O MET A 109 4.343 -3.891 -5.746 1.00 0.00 O ATOM 1656 CB MET A 109 6.256 -2.924 -3.428 1.00 0.00 C ATOM 1657 CG MET A 109 5.642 -1.588 -3.041 1.00 0.00 C ATOM 1658 SD MET A 109 6.875 -0.301 -2.774 1.00 0.00 S ATOM 1659 CE MET A 109 5.822 1.136 -2.582 1.00 0.00 C ATOM 0 H MET A 109 6.444 -5.044 -2.114 1.00 0.00 H new ATOM 0 HA MET A 109 4.264 -3.676 -3.187 1.00 0.00 H new ATOM 0 HB2 MET A 109 7.018 -3.192 -2.696 1.00 0.00 H new ATOM 0 HB3 MET A 109 6.759 -2.820 -4.389 1.00 0.00 H new ATOM 0 HG2 MET A 109 4.955 -1.269 -3.825 1.00 0.00 H new ATOM 0 HG3 MET A 109 5.053 -1.714 -2.133 1.00 0.00 H new ATOM 0 HE1 MET A 109 6.427 1.993 -2.287 1.00 0.00 H new ATOM 0 HE2 MET A 109 5.324 1.351 -3.528 1.00 0.00 H new ATOM 0 HE3 MET A 109 5.073 0.939 -1.815 1.00 0.00 H new ATOM 1669 N THR A 110 5.809 -5.570 -5.340 1.00 0.00 N ATOM 1670 CA THR A 110 5.769 -6.127 -6.695 1.00 0.00 C ATOM 1671 C THR A 110 4.357 -6.572 -7.059 1.00 0.00 C ATOM 1672 O THR A 110 3.895 -6.368 -8.186 1.00 0.00 O ATOM 1673 CB THR A 110 6.809 -7.281 -6.820 1.00 0.00 C ATOM 1674 OG1 THR A 110 7.415 -7.263 -8.115 1.00 0.00 O ATOM 1675 CG2 THR A 110 6.226 -8.669 -6.554 1.00 0.00 C ATOM 0 H THR A 110 6.437 -6.066 -4.708 1.00 0.00 H new ATOM 0 HA THR A 110 6.043 -5.354 -7.413 1.00 0.00 H new ATOM 0 HB THR A 110 7.553 -7.097 -6.045 1.00 0.00 H new ATOM 0 HG1 THR A 110 7.811 -8.140 -8.303 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.010 -9.419 -6.660 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.822 -8.706 -5.542 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.430 -8.873 -7.270 1.00 0.00 H new ATOM 1683 N ASN A 111 3.696 -7.181 -6.081 1.00 0.00 N ATOM 1684 CA ASN A 111 2.323 -7.622 -6.222 1.00 0.00 C ATOM 1685 C ASN A 111 1.396 -6.408 -6.191 1.00 0.00 C ATOM 1686 O ASN A 111 0.274 -6.457 -6.697 1.00 0.00 O ATOM 1687 CB ASN A 111 1.973 -8.619 -5.124 1.00 0.00 C ATOM 1688 CG ASN A 111 0.867 -9.570 -5.542 1.00 0.00 C ATOM 1689 OD1 ASN A 111 -0.315 -9.280 -5.369 1.00 0.00 O ATOM 1690 ND2 ASN A 111 1.249 -10.715 -6.095 1.00 0.00 N ATOM 0 H ASN A 111 4.103 -7.381 -5.167 1.00 0.00 H new ATOM 0 HA ASN A 111 2.196 -8.129 -7.178 1.00 0.00 H new ATOM 0 HB2 ASN A 111 2.862 -9.192 -4.860 1.00 0.00 H new ATOM 0 HB3 ASN A 111 1.665 -8.078 -4.229 1.00 0.00 H new ATOM 0 HD21 ASN A 111 0.550 -11.395 -6.395 1.00 0.00 H new ATOM 0 HD22 ASN A 111 2.241 -10.915 -6.220 1.00 0.00 H new ATOM 1697 N LEU A 112 1.920 -5.302 -5.621 1.00 0.00 N ATOM 1698 CA LEU A 112 1.181 -4.032 -5.523 1.00 0.00 C ATOM 1699 C LEU A 112 1.137 -3.332 -6.893 1.00 0.00 C ATOM 1700 O LEU A 112 0.487 -2.291 -7.044 1.00 0.00 O ATOM 1701 CB LEU A 112 1.786 -3.091 -4.440 1.00 0.00 C ATOM 1702 CG LEU A 112 1.221 -3.176 -2.997 1.00 0.00 C ATOM 1703 CD1 LEU A 112 -0.243 -2.749 -2.933 1.00 0.00 C ATOM 1704 CD2 LEU A 112 1.405 -4.564 -2.390 1.00 0.00 C ATOM 0 H LEU A 112 2.857 -5.267 -5.221 1.00 0.00 H new ATOM 0 HA LEU A 112 0.162 -4.265 -5.214 1.00 0.00 H new ATOM 0 HB2 LEU A 112 2.857 -3.286 -4.390 1.00 0.00 H new ATOM 0 HB3 LEU A 112 1.665 -2.064 -4.785 1.00 0.00 H new ATOM 0 HG LEU A 112 1.801 -2.474 -2.398 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -0.599 -2.823 -1.906 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -0.337 -1.719 -3.276 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -0.840 -3.400 -3.572 1.00 0.00 H new ATOM 0 HD21 LEU A 112 0.995 -4.577 -1.380 1.00 0.00 H new ATOM 0 HD22 LEU A 112 0.885 -5.301 -3.002 1.00 0.00 H new ATOM 0 HD23 LEU A 112 2.467 -4.807 -2.354 1.00 0.00 H new ATOM 1716 N GLY A 113 1.832 -3.925 -7.887 1.00 0.00 N ATOM 1717 CA GLY A 113 1.807 -3.395 -9.246 1.00 0.00 C ATOM 1718 C GLY A 113 3.019 -2.570 -9.619 1.00 0.00 C ATOM 1719 O GLY A 113 3.010 -1.877 -10.640 1.00 0.00 O ATOM 0 H GLY A 113 2.407 -4.759 -7.766 1.00 0.00 H new ATOM 0 HA2 GLY A 113 1.720 -4.226 -9.945 1.00 0.00 H new ATOM 0 HA3 GLY A 113 0.914 -2.782 -9.367 1.00 0.00 H new ATOM 1723 N GLU A 114 4.059 -2.646 -8.799 1.00 0.00 N ATOM 1724 CA GLU A 114 5.310 -1.962 -9.082 1.00 0.00 C ATOM 1725 C GLU A 114 6.440 -2.988 -8.996 1.00 0.00 C ATOM 1726 O GLU A 114 7.020 -3.226 -7.930 1.00 0.00 O ATOM 1727 CB GLU A 114 5.521 -0.732 -8.168 1.00 0.00 C ATOM 1728 CG GLU A 114 5.335 -0.977 -6.671 1.00 0.00 C ATOM 1729 CD GLU A 114 5.421 0.303 -5.865 1.00 0.00 C ATOM 1730 OE1 GLU A 114 6.551 0.730 -5.548 1.00 0.00 O ATOM 1731 OE2 GLU A 114 4.359 0.880 -5.551 1.00 0.00 O ATOM 0 H GLU A 114 4.059 -3.178 -7.929 1.00 0.00 H new ATOM 0 HA GLU A 114 5.292 -1.547 -10.090 1.00 0.00 H new ATOM 0 HB2 GLU A 114 6.528 -0.349 -8.332 1.00 0.00 H new ATOM 0 HB3 GLU A 114 4.828 0.051 -8.478 1.00 0.00 H new ATOM 0 HG2 GLU A 114 4.367 -1.448 -6.499 1.00 0.00 H new ATOM 0 HG3 GLU A 114 6.095 -1.676 -6.322 1.00 0.00 H new ATOM 1738 N LYS A 115 6.721 -3.604 -10.155 1.00 0.00 N ATOM 1739 CA LYS A 115 7.733 -4.659 -10.281 1.00 0.00 C ATOM 1740 C LYS A 115 9.157 -4.110 -10.226 1.00 0.00 C ATOM 1741 O LYS A 115 9.644 -3.495 -11.183 1.00 0.00 O ATOM 1742 CB LYS A 115 7.521 -5.447 -11.586 1.00 0.00 C ATOM 1743 CG LYS A 115 6.277 -6.333 -11.593 1.00 0.00 C ATOM 1744 CD LYS A 115 6.576 -7.733 -11.070 1.00 0.00 C ATOM 1745 CE LYS A 115 5.335 -8.617 -11.079 1.00 0.00 C ATOM 1746 NZ LYS A 115 4.953 -9.037 -12.458 1.00 0.00 N ATOM 0 H LYS A 115 6.250 -3.382 -11.032 1.00 0.00 H new ATOM 0 HA LYS A 115 7.609 -5.325 -9.427 1.00 0.00 H new ATOM 0 HB2 LYS A 115 7.455 -4.742 -12.415 1.00 0.00 H new ATOM 0 HB3 LYS A 115 8.397 -6.070 -11.766 1.00 0.00 H new ATOM 0 HG2 LYS A 115 5.501 -5.874 -10.981 1.00 0.00 H new ATOM 0 HG3 LYS A 115 5.884 -6.400 -12.608 1.00 0.00 H new ATOM 0 HD2 LYS A 115 7.353 -8.191 -11.682 1.00 0.00 H new ATOM 0 HD3 LYS A 115 6.967 -7.666 -10.055 1.00 0.00 H new ATOM 0 HE2 LYS A 115 5.517 -9.502 -10.469 1.00 0.00 H new ATOM 0 HE3 LYS A 115 4.505 -8.079 -10.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 4.104 -9.636 -12.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 4.754 -8.195 -13.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 5.734 -9.573 -12.887 1.00 0.00 H new ATOM 1760 N LEU A 116 9.804 -4.324 -9.078 1.00 0.00 N ATOM 1761 CA LEU A 116 11.184 -3.885 -8.869 1.00 0.00 C ATOM 1762 C LEU A 116 11.974 -4.871 -8.024 1.00 0.00 C ATOM 1763 O LEU A 116 11.415 -5.790 -7.418 1.00 0.00 O ATOM 1764 CB LEU A 116 11.269 -2.478 -8.232 1.00 0.00 C ATOM 1765 CG LEU A 116 10.079 -2.089 -7.337 1.00 0.00 C ATOM 1766 CD1 LEU A 116 10.152 -2.845 -6.030 1.00 0.00 C ATOM 1767 CD2 LEU A 116 10.024 -0.587 -7.094 1.00 0.00 C ATOM 0 H LEU A 116 9.391 -4.801 -8.276 1.00 0.00 H new ATOM 0 HA LEU A 116 11.628 -3.838 -9.863 1.00 0.00 H new ATOM 0 HB2 LEU A 116 12.182 -2.420 -7.640 1.00 0.00 H new ATOM 0 HB3 LEU A 116 11.359 -1.741 -9.030 1.00 0.00 H new ATOM 0 HG LEU A 116 9.160 -2.362 -7.855 1.00 0.00 H new ATOM 0 HD11 LEU A 116 9.307 -2.566 -5.400 1.00 0.00 H new ATOM 0 HD12 LEU A 116 10.119 -3.917 -6.227 1.00 0.00 H new ATOM 0 HD13 LEU A 116 11.083 -2.599 -5.519 1.00 0.00 H new ATOM 0 HD21 LEU A 116 9.170 -0.352 -6.458 1.00 0.00 H new ATOM 0 HD22 LEU A 116 10.942 -0.264 -6.603 1.00 0.00 H new ATOM 0 HD23 LEU A 116 9.920 -0.068 -8.047 1.00 0.00 H new ATOM 1779 N THR A 117 13.288 -4.656 -8.010 1.00 0.00 N ATOM 1780 CA THR A 117 14.223 -5.467 -7.251 1.00 0.00 C ATOM 1781 C THR A 117 14.525 -4.771 -5.906 1.00 0.00 C ATOM 1782 O THR A 117 13.978 -3.700 -5.623 1.00 0.00 O ATOM 1783 CB THR A 117 15.521 -5.681 -8.079 1.00 0.00 C ATOM 1784 OG1 THR A 117 15.197 -5.869 -9.463 1.00 0.00 O ATOM 1785 CG2 THR A 117 16.323 -6.881 -7.598 1.00 0.00 C ATOM 0 H THR A 117 13.734 -3.903 -8.534 1.00 0.00 H new ATOM 0 HA THR A 117 13.789 -6.445 -7.044 1.00 0.00 H new ATOM 0 HB THR A 117 16.131 -4.787 -7.946 1.00 0.00 H new ATOM 0 HG1 THR A 117 16.021 -6.001 -9.977 1.00 0.00 H new ATOM 0 HG21 THR A 117 17.220 -6.988 -8.208 1.00 0.00 H new ATOM 0 HG22 THR A 117 16.608 -6.734 -6.556 1.00 0.00 H new ATOM 0 HG23 THR A 117 15.716 -7.782 -7.684 1.00 0.00 H new ATOM 1793 N ASP A 118 15.391 -5.385 -5.085 1.00 0.00 N ATOM 1794 CA ASP A 118 15.780 -4.848 -3.768 1.00 0.00 C ATOM 1795 C ASP A 118 16.376 -3.434 -3.860 1.00 0.00 C ATOM 1796 O ASP A 118 16.304 -2.660 -2.911 1.00 0.00 O ATOM 1797 CB ASP A 118 16.800 -5.792 -3.133 1.00 0.00 C ATOM 1798 CG ASP A 118 16.946 -5.605 -1.631 1.00 0.00 C ATOM 1799 OD1 ASP A 118 17.636 -4.650 -1.216 1.00 0.00 O ATOM 1800 OD2 ASP A 118 16.373 -6.416 -0.874 1.00 0.00 O ATOM 0 H ASP A 118 15.843 -6.270 -5.315 1.00 0.00 H new ATOM 0 HA ASP A 118 14.880 -4.777 -3.157 1.00 0.00 H new ATOM 0 HB2 ASP A 118 16.506 -6.822 -3.336 1.00 0.00 H new ATOM 0 HB3 ASP A 118 17.770 -5.638 -3.606 1.00 0.00 H new ATOM 1805 N GLU A 119 16.998 -3.140 -4.997 1.00 0.00 N ATOM 1806 CA GLU A 119 17.616 -1.826 -5.276 1.00 0.00 C ATOM 1807 C GLU A 119 16.649 -0.653 -5.110 1.00 0.00 C ATOM 1808 O GLU A 119 16.950 0.328 -4.424 1.00 0.00 O ATOM 1809 CB GLU A 119 18.183 -1.815 -6.705 1.00 0.00 C ATOM 1810 CG GLU A 119 17.219 -2.394 -7.746 1.00 0.00 C ATOM 1811 CD GLU A 119 17.376 -1.759 -9.114 1.00 0.00 C ATOM 1812 OE1 GLU A 119 16.790 -0.679 -9.338 1.00 0.00 O ATOM 1813 OE2 GLU A 119 18.085 -2.341 -9.961 1.00 0.00 O ATOM 0 H GLU A 119 17.094 -3.805 -5.764 1.00 0.00 H new ATOM 0 HA GLU A 119 18.409 -1.693 -4.540 1.00 0.00 H new ATOM 0 HB2 GLU A 119 18.432 -0.790 -6.981 1.00 0.00 H new ATOM 0 HB3 GLU A 119 19.112 -2.385 -6.724 1.00 0.00 H new ATOM 0 HG2 GLU A 119 17.384 -3.468 -7.829 1.00 0.00 H new ATOM 0 HG3 GLU A 119 16.194 -2.255 -7.402 1.00 0.00 H new ATOM 1820 N GLU A 120 15.495 -0.784 -5.751 1.00 0.00 N ATOM 1821 CA GLU A 120 14.445 0.236 -5.727 1.00 0.00 C ATOM 1822 C GLU A 120 13.792 0.275 -4.353 1.00 0.00 C ATOM 1823 O GLU A 120 13.351 1.333 -3.895 1.00 0.00 O ATOM 1824 CB GLU A 120 13.396 -0.041 -6.808 1.00 0.00 C ATOM 1825 CG GLU A 120 13.962 -0.214 -8.220 1.00 0.00 C ATOM 1826 CD GLU A 120 14.340 1.103 -8.877 1.00 0.00 C ATOM 1827 OE1 GLU A 120 15.489 1.554 -8.686 1.00 0.00 O ATOM 1828 OE2 GLU A 120 13.485 1.682 -9.580 1.00 0.00 O ATOM 0 H GLU A 120 15.256 -1.605 -6.307 1.00 0.00 H new ATOM 0 HA GLU A 120 14.897 1.206 -5.933 1.00 0.00 H new ATOM 0 HB2 GLU A 120 12.846 -0.943 -6.539 1.00 0.00 H new ATOM 0 HB3 GLU A 120 12.678 0.779 -6.817 1.00 0.00 H new ATOM 0 HG2 GLU A 120 14.841 -0.857 -8.176 1.00 0.00 H new ATOM 0 HG3 GLU A 120 13.225 -0.724 -8.840 1.00 0.00 H new ATOM 1835 N VAL A 121 13.737 -0.901 -3.705 1.00 0.00 N ATOM 1836 CA VAL A 121 13.195 -1.015 -2.353 1.00 0.00 C ATOM 1837 C VAL A 121 14.204 -0.464 -1.352 1.00 0.00 C ATOM 1838 O VAL A 121 13.841 -0.043 -0.265 1.00 0.00 O ATOM 1839 CB VAL A 121 12.727 -2.440 -1.937 1.00 0.00 C ATOM 1840 CG1 VAL A 121 11.973 -3.118 -3.061 1.00 0.00 C ATOM 1841 CG2 VAL A 121 13.854 -3.322 -1.425 1.00 0.00 C ATOM 0 H VAL A 121 14.063 -1.783 -4.101 1.00 0.00 H new ATOM 0 HA VAL A 121 12.281 -0.421 -2.351 1.00 0.00 H new ATOM 0 HB VAL A 121 12.047 -2.299 -1.096 1.00 0.00 H new ATOM 0 HG11 VAL A 121 11.659 -4.111 -2.741 1.00 0.00 H new ATOM 0 HG12 VAL A 121 11.095 -2.526 -3.320 1.00 0.00 H new ATOM 0 HG13 VAL A 121 12.621 -3.206 -3.933 1.00 0.00 H new ATOM 0 HG21 VAL A 121 13.456 -4.300 -1.153 1.00 0.00 H new ATOM 0 HG22 VAL A 121 14.606 -3.440 -2.205 1.00 0.00 H new ATOM 0 HG23 VAL A 121 14.309 -2.859 -0.549 1.00 0.00 H new ATOM 1851 N ASP A 122 15.494 -0.569 -1.715 1.00 0.00 N ATOM 1852 CA ASP A 122 16.590 -0.078 -0.893 1.00 0.00 C ATOM 1853 C ASP A 122 16.429 1.403 -0.582 1.00 0.00 C ATOM 1854 O ASP A 122 16.766 1.840 0.513 1.00 0.00 O ATOM 1855 CB ASP A 122 17.898 -0.401 -1.582 1.00 0.00 C ATOM 1856 CG ASP A 122 19.090 -0.411 -0.638 1.00 0.00 C ATOM 1857 OD1 ASP A 122 19.377 -1.479 -0.057 1.00 0.00 O ATOM 1858 OD2 ASP A 122 19.733 0.648 -0.482 1.00 0.00 O ATOM 0 H ASP A 122 15.796 -0.999 -2.589 1.00 0.00 H new ATOM 0 HA ASP A 122 16.583 -0.579 0.075 1.00 0.00 H new ATOM 0 HB2 ASP A 122 17.816 -1.376 -2.063 1.00 0.00 H new ATOM 0 HB3 ASP A 122 18.075 0.330 -2.371 1.00 0.00 H new ATOM 1863 N GLU A 123 15.913 2.166 -1.550 1.00 0.00 N ATOM 1864 CA GLU A 123 15.607 3.580 -1.329 1.00 0.00 C ATOM 1865 C GLU A 123 14.360 3.642 -0.451 1.00 0.00 C ATOM 1866 O GLU A 123 14.170 4.577 0.326 1.00 0.00 O ATOM 1867 CB GLU A 123 15.376 4.318 -2.653 1.00 0.00 C ATOM 1868 CG GLU A 123 16.644 4.540 -3.463 1.00 0.00 C ATOM 1869 CD GLU A 123 16.383 5.275 -4.763 1.00 0.00 C ATOM 1870 OE1 GLU A 123 16.436 6.523 -4.761 1.00 0.00 O ATOM 1871 OE2 GLU A 123 16.127 4.602 -5.784 1.00 0.00 O ATOM 0 H GLU A 123 15.700 1.829 -2.489 1.00 0.00 H new ATOM 0 HA GLU A 123 16.448 4.073 -0.842 1.00 0.00 H new ATOM 0 HB2 GLU A 123 14.666 3.751 -3.255 1.00 0.00 H new ATOM 0 HB3 GLU A 123 14.916 5.284 -2.444 1.00 0.00 H new ATOM 0 HG2 GLU A 123 17.358 5.108 -2.866 1.00 0.00 H new ATOM 0 HG3 GLU A 123 17.105 3.577 -3.681 1.00 0.00 H new ATOM 1878 N MET A 124 13.518 2.604 -0.609 1.00 0.00 N ATOM 1879 CA MET A 124 12.295 2.434 0.164 1.00 0.00 C ATOM 1880 C MET A 124 12.602 1.981 1.603 1.00 0.00 C ATOM 1881 O MET A 124 11.859 2.325 2.527 1.00 0.00 O ATOM 1882 CB MET A 124 11.345 1.422 -0.494 1.00 0.00 C ATOM 1883 CG MET A 124 10.984 1.738 -1.943 1.00 0.00 C ATOM 1884 SD MET A 124 9.958 0.464 -2.697 1.00 0.00 S ATOM 1885 CE MET A 124 9.448 1.292 -4.201 1.00 0.00 C ATOM 0 H MET A 124 13.678 1.858 -1.286 1.00 0.00 H new ATOM 0 HA MET A 124 11.806 3.408 0.192 1.00 0.00 H new ATOM 0 HB2 MET A 124 11.804 0.434 -0.455 1.00 0.00 H new ATOM 0 HB3 MET A 124 10.428 1.371 0.092 1.00 0.00 H new ATOM 0 HG2 MET A 124 10.459 2.692 -1.983 1.00 0.00 H new ATOM 0 HG3 MET A 124 11.899 1.853 -2.524 1.00 0.00 H new ATOM 0 HE1 MET A 124 8.721 0.674 -4.728 1.00 0.00 H new ATOM 0 HE2 MET A 124 8.996 2.252 -3.952 1.00 0.00 H new ATOM 0 HE3 MET A 124 10.316 1.455 -4.839 1.00 0.00 H new ATOM 1895 N ILE A 125 13.702 1.209 1.788 1.00 0.00 N ATOM 1896 CA ILE A 125 14.070 0.708 3.119 1.00 0.00 C ATOM 1897 C ILE A 125 15.106 1.592 3.820 1.00 0.00 C ATOM 1898 O ILE A 125 15.129 1.660 5.052 1.00 0.00 O ATOM 1899 CB ILE A 125 14.514 -0.789 3.118 1.00 0.00 C ATOM 1900 CG1 ILE A 125 15.658 -1.076 2.115 1.00 0.00 C ATOM 1901 CG2 ILE A 125 13.304 -1.681 2.832 1.00 0.00 C ATOM 1902 CD1 ILE A 125 16.459 -2.315 2.436 1.00 0.00 C ATOM 0 H ILE A 125 14.335 0.928 1.040 1.00 0.00 H new ATOM 0 HA ILE A 125 13.150 0.761 3.701 1.00 0.00 H new ATOM 0 HB ILE A 125 14.913 -1.015 4.107 1.00 0.00 H new ATOM 0 HG12 ILE A 125 15.234 -1.178 1.116 1.00 0.00 H new ATOM 0 HG13 ILE A 125 16.330 -0.218 2.090 1.00 0.00 H new ATOM 0 HG21 ILE A 125 13.614 -2.726 2.831 1.00 0.00 H new ATOM 0 HG22 ILE A 125 12.548 -1.527 3.602 1.00 0.00 H new ATOM 0 HG23 ILE A 125 12.886 -1.426 1.858 1.00 0.00 H new ATOM 0 HD11 ILE A 125 17.240 -2.447 1.688 1.00 0.00 H new ATOM 0 HD12 ILE A 125 16.914 -2.209 3.421 1.00 0.00 H new ATOM 0 HD13 ILE A 125 15.802 -3.185 2.431 1.00 0.00 H new ATOM 1914 N ARG A 126 15.955 2.265 3.032 1.00 0.00 N ATOM 1915 CA ARG A 126 16.987 3.176 3.574 1.00 0.00 C ATOM 1916 C ARG A 126 16.341 4.328 4.338 1.00 0.00 C ATOM 1917 O ARG A 126 16.875 4.800 5.346 1.00 0.00 O ATOM 1918 CB ARG A 126 17.883 3.731 2.464 1.00 0.00 C ATOM 1919 CG ARG A 126 19.094 2.860 2.166 1.00 0.00 C ATOM 1920 CD ARG A 126 19.969 3.475 1.086 1.00 0.00 C ATOM 1921 NE ARG A 126 21.158 2.660 0.811 1.00 0.00 N ATOM 1922 CZ ARG A 126 22.100 2.964 -0.093 1.00 0.00 C ATOM 1923 NH1 ARG A 126 22.017 4.071 -0.830 1.00 0.00 N ATOM 1924 NH2 ARG A 126 23.135 2.152 -0.259 1.00 0.00 N ATOM 0 H ARG A 126 15.952 2.199 2.014 1.00 0.00 H new ATOM 0 HA ARG A 126 17.607 2.595 4.258 1.00 0.00 H new ATOM 0 HB2 ARG A 126 17.293 3.842 1.554 1.00 0.00 H new ATOM 0 HB3 ARG A 126 18.223 4.727 2.747 1.00 0.00 H new ATOM 0 HG2 ARG A 126 19.679 2.724 3.076 1.00 0.00 H new ATOM 0 HG3 ARG A 126 18.763 1.871 1.849 1.00 0.00 H new ATOM 0 HD2 ARG A 126 19.388 3.589 0.171 1.00 0.00 H new ATOM 0 HD3 ARG A 126 20.278 4.474 1.395 1.00 0.00 H new ATOM 0 HE ARG A 126 21.276 1.800 1.346 1.00 0.00 H new ATOM 0 HH11 ARG A 126 21.226 4.705 -0.711 1.00 0.00 H new ATOM 0 HH12 ARG A 126 22.744 4.285 -1.513 1.00 0.00 H new ATOM 0 HH21 ARG A 126 23.211 1.302 0.299 1.00 0.00 H new ATOM 0 HH22 ARG A 126 23.855 2.377 -0.945 1.00 0.00 H new ATOM 1938 N GLU A 127 15.182 4.767 3.832 1.00 0.00 N ATOM 1939 CA GLU A 127 14.391 5.839 4.456 1.00 0.00 C ATOM 1940 C GLU A 127 13.840 5.402 5.818 1.00 0.00 C ATOM 1941 O GLU A 127 13.618 6.232 6.702 1.00 0.00 O ATOM 1942 CB GLU A 127 13.263 6.265 3.516 1.00 0.00 C ATOM 1943 CG GLU A 127 13.763 6.858 2.205 1.00 0.00 C ATOM 1944 CD GLU A 127 14.020 8.352 2.292 1.00 0.00 C ATOM 1945 OE1 GLU A 127 13.081 9.131 2.027 1.00 0.00 O ATOM 1946 OE2 GLU A 127 15.159 8.740 2.624 1.00 0.00 O ATOM 0 H GLU A 127 14.765 4.391 2.980 1.00 0.00 H new ATOM 0 HA GLU A 127 15.043 6.695 4.631 1.00 0.00 H new ATOM 0 HB2 GLU A 127 12.634 5.401 3.300 1.00 0.00 H new ATOM 0 HB3 GLU A 127 12.635 6.998 4.022 1.00 0.00 H new ATOM 0 HG2 GLU A 127 14.683 6.353 1.911 1.00 0.00 H new ATOM 0 HG3 GLU A 127 13.030 6.666 1.422 1.00 0.00 H new ATOM 1953 N ALA A 128 13.667 4.084 5.978 1.00 0.00 N ATOM 1954 CA ALA A 128 13.167 3.488 7.208 1.00 0.00 C ATOM 1955 C ALA A 128 14.280 3.184 8.202 1.00 0.00 C ATOM 1956 O ALA A 128 14.028 3.042 9.399 1.00 0.00 O ATOM 1957 CB ALA A 128 12.417 2.218 6.868 1.00 0.00 C ATOM 0 H ALA A 128 13.874 3.402 5.248 1.00 0.00 H new ATOM 0 HA ALA A 128 12.504 4.209 7.686 1.00 0.00 H new ATOM 0 HB1 ALA A 128 12.038 1.763 7.783 1.00 0.00 H new ATOM 0 HB2 ALA A 128 11.583 2.454 6.208 1.00 0.00 H new ATOM 0 HB3 ALA A 128 13.090 1.521 6.368 1.00 0.00 H new ATOM 1963 N ASP A 129 15.500 3.079 7.695 1.00 0.00 N ATOM 1964 CA ASP A 129 16.648 2.791 8.506 1.00 0.00 C ATOM 1965 C ASP A 129 17.581 3.993 8.628 1.00 0.00 C ATOM 1966 O ASP A 129 18.239 4.387 7.658 1.00 0.00 O ATOM 1967 CB ASP A 129 17.342 1.594 7.918 1.00 0.00 C ATOM 1968 CG ASP A 129 18.026 0.738 8.968 1.00 0.00 C ATOM 1969 OD1 ASP A 129 18.991 1.226 9.594 1.00 0.00 O ATOM 1970 OD2 ASP A 129 17.600 -0.418 9.163 1.00 0.00 O ATOM 0 H ASP A 129 15.710 3.194 6.703 1.00 0.00 H new ATOM 0 HA ASP A 129 16.331 2.568 9.525 1.00 0.00 H new ATOM 0 HB2 ASP A 129 16.615 0.987 7.378 1.00 0.00 H new ATOM 0 HB3 ASP A 129 18.081 1.929 7.191 1.00 0.00 H new ATOM 1975 N ILE A 130 17.614 4.582 9.829 1.00 0.00 N ATOM 1976 CA ILE A 130 18.485 5.735 10.121 1.00 0.00 C ATOM 1977 C ILE A 130 19.945 5.295 10.295 1.00 0.00 C ATOM 1978 O ILE A 130 20.874 6.094 10.141 1.00 0.00 O ATOM 1979 CB ILE A 130 18.021 6.551 11.367 1.00 0.00 C ATOM 1980 CG1 ILE A 130 17.711 5.650 12.577 1.00 0.00 C ATOM 1981 CG2 ILE A 130 16.805 7.397 11.020 1.00 0.00 C ATOM 1982 CD1 ILE A 130 18.878 5.479 13.527 1.00 0.00 C ATOM 0 H ILE A 130 17.046 4.280 10.620 1.00 0.00 H new ATOM 0 HA ILE A 130 18.409 6.395 9.257 1.00 0.00 H new ATOM 0 HB ILE A 130 18.849 7.201 11.651 1.00 0.00 H new ATOM 0 HG12 ILE A 130 16.868 6.070 13.125 1.00 0.00 H new ATOM 0 HG13 ILE A 130 17.400 4.669 12.218 1.00 0.00 H new ATOM 0 HG21 ILE A 130 16.492 7.961 11.898 1.00 0.00 H new ATOM 0 HG22 ILE A 130 17.060 8.088 10.217 1.00 0.00 H new ATOM 0 HG23 ILE A 130 15.991 6.748 10.696 1.00 0.00 H new ATOM 0 HD11 ILE A 130 18.583 4.832 14.353 1.00 0.00 H new ATOM 0 HD12 ILE A 130 19.717 5.029 12.996 1.00 0.00 H new ATOM 0 HD13 ILE A 130 19.175 6.452 13.917 1.00 0.00 H new ATOM 1994 N ASP A 131 20.108 4.013 10.616 1.00 0.00 N ATOM 1995 CA ASP A 131 21.418 3.401 10.828 1.00 0.00 C ATOM 1996 C ASP A 131 21.907 2.670 9.559 1.00 0.00 C ATOM 1997 O ASP A 131 23.009 2.110 9.549 1.00 0.00 O ATOM 1998 CB ASP A 131 21.318 2.426 12.011 1.00 0.00 C ATOM 1999 CG ASP A 131 22.672 1.964 12.531 1.00 0.00 C ATOM 2000 OD1 ASP A 131 23.220 2.631 13.433 1.00 0.00 O ATOM 2001 OD2 ASP A 131 23.179 0.936 12.034 1.00 0.00 O ATOM 0 H ASP A 131 19.329 3.365 10.737 1.00 0.00 H new ATOM 0 HA ASP A 131 22.147 4.180 11.051 1.00 0.00 H new ATOM 0 HB2 ASP A 131 20.770 2.906 12.822 1.00 0.00 H new ATOM 0 HB3 ASP A 131 20.738 1.555 11.706 1.00 0.00 H new ATOM 2006 N GLY A 132 21.083 2.693 8.493 1.00 0.00 N ATOM 2007 CA GLY A 132 21.431 2.044 7.223 1.00 0.00 C ATOM 2008 C GLY A 132 21.694 0.546 7.344 1.00 0.00 C ATOM 2009 O GLY A 132 22.714 0.054 6.851 1.00 0.00 O ATOM 0 H GLY A 132 20.174 3.155 8.491 1.00 0.00 H new ATOM 0 HA2 GLY A 132 20.621 2.204 6.511 1.00 0.00 H new ATOM 0 HA3 GLY A 132 22.318 2.526 6.811 1.00 0.00 H new ATOM 2013 N ASP A 133 20.772 -0.171 7.998 1.00 0.00 N ATOM 2014 CA ASP A 133 20.903 -1.620 8.195 1.00 0.00 C ATOM 2015 C ASP A 133 20.209 -2.426 7.085 1.00 0.00 C ATOM 2016 O ASP A 133 20.353 -3.652 7.029 1.00 0.00 O ATOM 2017 CB ASP A 133 20.332 -2.022 9.559 1.00 0.00 C ATOM 2018 CG ASP A 133 21.210 -1.577 10.714 1.00 0.00 C ATOM 2019 OD1 ASP A 133 22.204 -2.274 11.007 1.00 0.00 O ATOM 2020 OD2 ASP A 133 20.903 -0.531 11.324 1.00 0.00 O ATOM 0 H ASP A 133 19.925 0.230 8.401 1.00 0.00 H new ATOM 0 HA ASP A 133 21.967 -1.853 8.155 1.00 0.00 H new ATOM 0 HB2 ASP A 133 19.339 -1.589 9.675 1.00 0.00 H new ATOM 0 HB3 ASP A 133 20.213 -3.105 9.594 1.00 0.00 H new ATOM 2025 N GLY A 134 19.465 -1.736 6.202 1.00 0.00 N ATOM 2026 CA GLY A 134 18.782 -2.408 5.094 1.00 0.00 C ATOM 2027 C GLY A 134 17.512 -3.161 5.493 1.00 0.00 C ATOM 2028 O GLY A 134 17.049 -4.015 4.740 1.00 0.00 O ATOM 0 H GLY A 134 19.325 -0.726 6.237 1.00 0.00 H new ATOM 0 HA2 GLY A 134 18.526 -1.666 4.338 1.00 0.00 H new ATOM 0 HA3 GLY A 134 19.474 -3.110 4.630 1.00 0.00 H new ATOM 2032 N GLN A 135 16.971 -2.881 6.684 1.00 0.00 N ATOM 2033 CA GLN A 135 15.751 -3.554 7.160 1.00 0.00 C ATOM 2034 C GLN A 135 14.882 -2.597 7.977 1.00 0.00 C ATOM 2035 O GLN A 135 15.385 -1.544 8.383 1.00 0.00 O ATOM 2036 CB GLN A 135 16.144 -4.779 7.978 1.00 0.00 C ATOM 2037 CG GLN A 135 15.812 -6.074 7.274 1.00 0.00 C ATOM 2038 CD GLN A 135 16.733 -7.215 7.661 1.00 0.00 C ATOM 2039 OE1 GLN A 135 17.770 -7.431 7.033 1.00 0.00 O ATOM 2040 NE2 GLN A 135 16.359 -7.952 8.700 1.00 0.00 N ATOM 0 H GLN A 135 17.355 -2.196 7.336 1.00 0.00 H new ATOM 0 HA GLN A 135 15.157 -3.874 6.304 1.00 0.00 H new ATOM 0 HB2 GLN A 135 17.214 -4.746 8.186 1.00 0.00 H new ATOM 0 HB3 GLN A 135 15.631 -4.750 8.940 1.00 0.00 H new ATOM 0 HG2 GLN A 135 14.783 -6.352 7.503 1.00 0.00 H new ATOM 0 HG3 GLN A 135 15.868 -5.919 6.196 1.00 0.00 H new ATOM 0 HE21 GLN A 135 15.491 -7.737 9.192 1.00 0.00 H new ATOM 0 HE22 GLN A 135 16.939 -8.733 9.007 1.00 0.00 H new ATOM 2049 N VAL A 136 13.581 -2.918 8.242 1.00 0.00 N ATOM 2050 CA VAL A 136 12.784 -1.950 8.987 1.00 0.00 C ATOM 2051 C VAL A 136 12.293 -2.461 10.349 1.00 0.00 C ATOM 2052 O VAL A 136 11.521 -3.397 10.431 1.00 0.00 O ATOM 2053 CB VAL A 136 11.567 -1.431 8.166 1.00 0.00 C ATOM 2054 CG1 VAL A 136 10.987 -0.157 8.761 1.00 0.00 C ATOM 2055 CG2 VAL A 136 11.905 -1.185 6.701 1.00 0.00 C ATOM 0 H VAL A 136 13.107 -3.778 7.967 1.00 0.00 H new ATOM 0 HA VAL A 136 13.473 -1.127 9.174 1.00 0.00 H new ATOM 0 HB VAL A 136 10.824 -2.227 8.218 1.00 0.00 H new ATOM 0 HG11 VAL A 136 10.140 0.173 8.159 1.00 0.00 H new ATOM 0 HG12 VAL A 136 10.654 -0.350 9.781 1.00 0.00 H new ATOM 0 HG13 VAL A 136 11.751 0.621 8.770 1.00 0.00 H new ATOM 0 HG21 VAL A 136 11.019 -0.825 6.179 1.00 0.00 H new ATOM 0 HG22 VAL A 136 12.696 -0.439 6.631 1.00 0.00 H new ATOM 0 HG23 VAL A 136 12.242 -2.115 6.244 1.00 0.00 H new ATOM 2065 N ASN A 137 12.711 -1.772 11.410 1.00 0.00 N ATOM 2066 CA ASN A 137 12.297 -2.080 12.779 1.00 0.00 C ATOM 2067 C ASN A 137 10.871 -1.564 13.022 1.00 0.00 C ATOM 2068 O ASN A 137 10.272 -0.934 12.145 1.00 0.00 O ATOM 2069 CB ASN A 137 13.268 -1.437 13.783 1.00 0.00 C ATOM 2070 CG ASN A 137 13.404 -2.230 15.076 1.00 0.00 C ATOM 2071 OD1 ASN A 137 13.372 -3.463 15.078 1.00 0.00 O ATOM 2072 ND2 ASN A 137 13.558 -1.520 16.187 1.00 0.00 N ATOM 0 H ASN A 137 13.350 -0.980 11.344 1.00 0.00 H new ATOM 0 HA ASN A 137 12.313 -3.161 12.919 1.00 0.00 H new ATOM 0 HB2 ASN A 137 14.249 -1.340 13.319 1.00 0.00 H new ATOM 0 HB3 ASN A 137 12.925 -0.429 14.017 1.00 0.00 H new ATOM 0 HD21 ASN A 137 13.655 -1.993 17.085 1.00 0.00 H new ATOM 0 HD22 ASN A 137 13.579 -0.501 16.142 1.00 0.00 H new ATOM 2079 N TYR A 138 10.343 -1.837 14.216 1.00 0.00 N ATOM 2080 CA TYR A 138 8.973 -1.454 14.587 1.00 0.00 C ATOM 2081 C TYR A 138 8.774 0.064 14.746 1.00 0.00 C ATOM 2082 O TYR A 138 7.706 0.574 14.431 1.00 0.00 O ATOM 2083 CB TYR A 138 8.551 -2.185 15.879 1.00 0.00 C ATOM 2084 CG TYR A 138 9.487 -1.998 17.065 1.00 0.00 C ATOM 2085 CD1 TYR A 138 10.633 -2.774 17.200 1.00 0.00 C ATOM 2086 CD2 TYR A 138 9.216 -1.052 18.045 1.00 0.00 C ATOM 2087 CE1 TYR A 138 11.482 -2.610 18.278 1.00 0.00 C ATOM 2088 CE2 TYR A 138 10.062 -0.882 19.126 1.00 0.00 C ATOM 2089 CZ TYR A 138 11.192 -1.664 19.237 1.00 0.00 C ATOM 2090 OH TYR A 138 12.036 -1.498 20.312 1.00 0.00 O ATOM 0 H TYR A 138 10.848 -2.328 14.954 1.00 0.00 H new ATOM 0 HA TYR A 138 8.335 -1.758 13.757 1.00 0.00 H new ATOM 0 HB2 TYR A 138 7.557 -1.841 16.164 1.00 0.00 H new ATOM 0 HB3 TYR A 138 8.470 -3.251 15.665 1.00 0.00 H new ATOM 0 HD1 TYR A 138 10.863 -3.517 16.450 1.00 0.00 H new ATOM 0 HD2 TYR A 138 8.331 -0.439 17.962 1.00 0.00 H new ATOM 0 HE1 TYR A 138 12.368 -3.220 18.368 1.00 0.00 H new ATOM 0 HE2 TYR A 138 9.839 -0.141 19.879 1.00 0.00 H new ATOM 0 HH TYR A 138 11.689 -0.791 20.894 1.00 0.00 H new ATOM 2100 N GLU A 139 9.814 0.760 15.221 1.00 0.00 N ATOM 2101 CA GLU A 139 9.770 2.206 15.491 1.00 0.00 C ATOM 2102 C GLU A 139 9.721 3.127 14.289 1.00 0.00 C ATOM 2103 O GLU A 139 9.004 4.132 14.337 1.00 0.00 O ATOM 2104 CB GLU A 139 10.954 2.607 16.381 1.00 0.00 C ATOM 2105 CG GLU A 139 10.804 2.199 17.844 1.00 0.00 C ATOM 2106 CD GLU A 139 9.910 3.139 18.634 1.00 0.00 C ATOM 2107 OE1 GLU A 139 10.435 4.120 19.202 1.00 0.00 O ATOM 2108 OE2 GLU A 139 8.687 2.892 18.685 1.00 0.00 O ATOM 0 H GLU A 139 10.717 0.335 15.431 1.00 0.00 H new ATOM 0 HA GLU A 139 8.810 2.348 15.987 1.00 0.00 H new ATOM 0 HB2 GLU A 139 11.863 2.157 15.981 1.00 0.00 H new ATOM 0 HB3 GLU A 139 11.084 3.688 16.328 1.00 0.00 H new ATOM 0 HG2 GLU A 139 10.395 1.190 17.894 1.00 0.00 H new ATOM 0 HG3 GLU A 139 11.789 2.167 18.309 1.00 0.00 H new ATOM 2115 N GLU A 140 10.452 2.831 13.225 1.00 0.00 N ATOM 2116 CA GLU A 140 10.488 3.764 12.117 1.00 0.00 C ATOM 2117 C GLU A 140 9.276 3.745 11.161 1.00 0.00 C ATOM 2118 O GLU A 140 8.717 4.806 10.869 1.00 0.00 O ATOM 2119 CB GLU A 140 11.796 3.629 11.329 1.00 0.00 C ATOM 2120 CG GLU A 140 13.026 4.172 12.054 1.00 0.00 C ATOM 2121 CD GLU A 140 13.563 3.219 13.109 1.00 0.00 C ATOM 2122 OE1 GLU A 140 13.121 3.313 14.274 1.00 0.00 O ATOM 2123 OE2 GLU A 140 14.424 2.380 12.769 1.00 0.00 O ATOM 0 H GLU A 140 11.008 1.984 13.108 1.00 0.00 H new ATOM 0 HA GLU A 140 10.431 4.739 12.600 1.00 0.00 H new ATOM 0 HB2 GLU A 140 11.960 2.577 11.098 1.00 0.00 H new ATOM 0 HB3 GLU A 140 11.689 4.151 10.378 1.00 0.00 H new ATOM 0 HG2 GLU A 140 13.810 4.377 11.325 1.00 0.00 H new ATOM 0 HG3 GLU A 140 12.773 5.122 12.525 1.00 0.00 H new ATOM 2130 N PHE A 141 8.872 2.559 10.680 1.00 0.00 N ATOM 2131 CA PHE A 141 7.734 2.440 9.738 1.00 0.00 C ATOM 2132 C PHE A 141 6.369 2.823 10.347 1.00 0.00 C ATOM 2133 O PHE A 141 5.451 3.188 9.606 1.00 0.00 O ATOM 2134 CB PHE A 141 7.691 1.040 9.097 1.00 0.00 C ATOM 2135 CG PHE A 141 6.551 0.829 8.133 1.00 0.00 C ATOM 2136 CD1 PHE A 141 6.659 1.251 6.818 1.00 0.00 C ATOM 2137 CD2 PHE A 141 5.376 0.225 8.546 1.00 0.00 C ATOM 2138 CE1 PHE A 141 5.618 1.074 5.933 1.00 0.00 C ATOM 2139 CE2 PHE A 141 4.329 0.047 7.664 1.00 0.00 C ATOM 2140 CZ PHE A 141 4.452 0.473 6.357 1.00 0.00 C ATOM 0 H PHE A 141 9.310 1.670 10.922 1.00 0.00 H new ATOM 0 HA PHE A 141 7.918 3.178 8.957 1.00 0.00 H new ATOM 0 HB2 PHE A 141 8.631 0.865 8.573 1.00 0.00 H new ATOM 0 HB3 PHE A 141 7.624 0.294 9.889 1.00 0.00 H new ATOM 0 HD1 PHE A 141 7.570 1.724 6.483 1.00 0.00 H new ATOM 0 HD2 PHE A 141 5.277 -0.110 9.568 1.00 0.00 H new ATOM 0 HE1 PHE A 141 5.715 1.405 4.910 1.00 0.00 H new ATOM 0 HE2 PHE A 141 3.416 -0.424 7.996 1.00 0.00 H new ATOM 0 HZ PHE A 141 3.634 0.335 5.666 1.00 0.00 H new ATOM 2150 N VAL A 142 6.235 2.747 11.677 1.00 0.00 N ATOM 2151 CA VAL A 142 4.973 3.062 12.357 1.00 0.00 C ATOM 2152 C VAL A 142 4.733 4.559 12.338 1.00 0.00 C ATOM 2153 O VAL A 142 3.628 5.054 12.103 1.00 0.00 O ATOM 2154 CB VAL A 142 4.957 2.546 13.811 1.00 0.00 C ATOM 2155 CG1 VAL A 142 4.744 1.048 13.820 1.00 0.00 C ATOM 2156 CG2 VAL A 142 6.217 2.920 14.600 1.00 0.00 C ATOM 0 H VAL A 142 6.989 2.469 12.305 1.00 0.00 H new ATOM 0 HA VAL A 142 4.173 2.555 11.817 1.00 0.00 H new ATOM 0 HB VAL A 142 4.127 3.040 14.317 1.00 0.00 H new ATOM 0 HG11 VAL A 142 4.733 0.688 14.849 1.00 0.00 H new ATOM 0 HG12 VAL A 142 3.792 0.813 13.344 1.00 0.00 H new ATOM 0 HG13 VAL A 142 5.553 0.562 13.274 1.00 0.00 H new ATOM 0 HG21 VAL A 142 6.141 2.527 15.614 1.00 0.00 H new ATOM 0 HG22 VAL A 142 7.093 2.494 14.110 1.00 0.00 H new ATOM 0 HG23 VAL A 142 6.314 4.005 14.638 1.00 0.00 H new ATOM 2166 N GLN A 143 5.837 5.237 12.601 1.00 0.00 N ATOM 2167 CA GLN A 143 5.954 6.679 12.630 1.00 0.00 C ATOM 2168 C GLN A 143 5.469 7.299 11.317 1.00 0.00 C ATOM 2169 O GLN A 143 4.901 8.394 11.289 1.00 0.00 O ATOM 2170 CB GLN A 143 7.437 6.967 12.852 1.00 0.00 C ATOM 2171 CG GLN A 143 7.749 8.348 13.420 1.00 0.00 C ATOM 2172 CD GLN A 143 7.519 8.444 14.919 1.00 0.00 C ATOM 2173 OE1 GLN A 143 8.421 8.186 15.715 1.00 0.00 O ATOM 2174 NE2 GLN A 143 6.305 8.816 15.308 1.00 0.00 N ATOM 0 H GLN A 143 6.719 4.770 12.810 1.00 0.00 H new ATOM 0 HA GLN A 143 5.337 7.112 13.417 1.00 0.00 H new ATOM 0 HB2 GLN A 143 7.841 6.213 13.528 1.00 0.00 H new ATOM 0 HB3 GLN A 143 7.959 6.855 11.902 1.00 0.00 H new ATOM 0 HG2 GLN A 143 8.787 8.598 13.201 1.00 0.00 H new ATOM 0 HG3 GLN A 143 7.130 9.090 12.916 1.00 0.00 H new ATOM 0 HE21 GLN A 143 5.587 9.020 14.613 1.00 0.00 H new ATOM 0 HE22 GLN A 143 6.091 8.897 16.302 1.00 0.00 H new ATOM 2183 N MET A 144 5.735 6.567 10.244 1.00 0.00 N ATOM 2184 CA MET A 144 5.369 6.937 8.900 1.00 0.00 C ATOM 2185 C MET A 144 3.882 6.747 8.596 1.00 0.00 C ATOM 2186 O MET A 144 3.373 7.350 7.656 1.00 0.00 O ATOM 2187 CB MET A 144 6.278 6.220 7.920 1.00 0.00 C ATOM 2188 CG MET A 144 7.444 7.099 7.515 1.00 0.00 C ATOM 2189 SD MET A 144 8.215 7.935 8.925 1.00 0.00 S ATOM 2190 CE MET A 144 8.663 9.507 8.192 1.00 0.00 C ATOM 0 H MET A 144 6.226 5.675 10.295 1.00 0.00 H new ATOM 0 HA MET A 144 5.519 8.011 8.790 1.00 0.00 H new ATOM 0 HB2 MET A 144 6.651 5.300 8.371 1.00 0.00 H new ATOM 0 HB3 MET A 144 5.710 5.933 7.035 1.00 0.00 H new ATOM 0 HG2 MET A 144 8.192 6.491 7.006 1.00 0.00 H new ATOM 0 HG3 MET A 144 7.099 7.846 6.800 1.00 0.00 H new ATOM 0 HE1 MET A 144 9.165 10.125 8.936 1.00 0.00 H new ATOM 0 HE2 MET A 144 9.333 9.338 7.349 1.00 0.00 H new ATOM 0 HE3 MET A 144 7.764 10.016 7.844 1.00 0.00 H new ATOM 2200 N MET A 145 3.204 5.868 9.348 1.00 0.00 N ATOM 2201 CA MET A 145 1.762 5.640 9.142 1.00 0.00 C ATOM 2202 C MET A 145 0.956 6.633 9.971 1.00 0.00 C ATOM 2203 O MET A 145 -0.112 7.075 9.538 1.00 0.00 O ATOM 2204 CB MET A 145 1.383 4.185 9.469 1.00 0.00 C ATOM 2205 CG MET A 145 0.061 3.719 8.865 1.00 0.00 C ATOM 2206 SD MET A 145 -1.374 4.433 9.695 1.00 0.00 S ATOM 2207 CE MET A 145 -2.712 3.616 8.831 1.00 0.00 C ATOM 0 H MET A 145 3.620 5.310 10.093 1.00 0.00 H new ATOM 0 HA MET A 145 1.524 5.804 8.091 1.00 0.00 H new ATOM 0 HB2 MET A 145 2.179 3.529 9.117 1.00 0.00 H new ATOM 0 HB3 MET A 145 1.332 4.072 10.552 1.00 0.00 H new ATOM 0 HG2 MET A 145 0.035 3.986 7.809 1.00 0.00 H new ATOM 0 HG3 MET A 145 0.004 2.632 8.920 1.00 0.00 H new ATOM 0 HE1 MET A 145 -3.290 4.354 8.275 1.00 0.00 H new ATOM 0 HE2 MET A 145 -2.303 2.880 8.139 1.00 0.00 H new ATOM 0 HE3 MET A 145 -3.359 3.116 9.552 1.00 0.00 H new ATOM 2217 N THR A 146 1.465 6.981 11.165 1.00 0.00 N ATOM 2218 CA THR A 146 0.830 8.003 11.996 1.00 0.00 C ATOM 2219 C THR A 146 1.004 9.368 11.297 1.00 0.00 C ATOM 2220 O THR A 146 0.375 10.365 11.662 1.00 0.00 O ATOM 2221 CB THR A 146 1.386 8.010 13.452 1.00 0.00 C ATOM 2222 OG1 THR A 146 0.881 9.135 14.184 1.00 0.00 O ATOM 2223 CG2 THR A 146 2.912 8.008 13.503 1.00 0.00 C ATOM 0 H THR A 146 2.307 6.571 11.569 1.00 0.00 H new ATOM 0 HA THR A 146 -0.232 7.780 12.098 1.00 0.00 H new ATOM 0 HB THR A 146 1.041 7.086 13.915 1.00 0.00 H new ATOM 0 HG1 THR A 146 1.240 9.120 15.096 1.00 0.00 H new ATOM 0 HG21 THR A 146 3.241 8.013 14.542 1.00 0.00 H new ATOM 0 HG22 THR A 146 3.291 7.115 13.006 1.00 0.00 H new ATOM 0 HG23 THR A 146 3.294 8.895 12.997 1.00 0.00 H new ATOM 2231 N ALA A 147 1.892 9.356 10.275 1.00 0.00 N ATOM 2232 CA ALA A 147 2.165 10.491 9.417 1.00 0.00 C ATOM 2233 C ALA A 147 2.614 10.006 8.038 1.00 0.00 C ATOM 2234 O ALA A 147 3.803 10.036 7.689 1.00 0.00 O ATOM 2235 CB ALA A 147 3.228 11.394 10.000 1.00 0.00 C ATOM 0 H ALA A 147 2.441 8.531 10.034 1.00 0.00 H new ATOM 0 HA ALA A 147 1.243 11.065 9.330 1.00 0.00 H new ATOM 0 HB1 ALA A 147 3.403 12.233 9.326 1.00 0.00 H new ATOM 0 HB2 ALA A 147 2.896 11.770 10.968 1.00 0.00 H new ATOM 0 HB3 ALA A 147 4.153 10.832 10.127 1.00 0.00 H new ATOM 2241 N LYS A 148 1.638 9.532 7.272 1.00 0.00 N ATOM 2242 CA LYS A 148 1.840 9.063 5.885 1.00 0.00 C ATOM 2243 C LYS A 148 2.437 10.159 4.991 1.00 0.00 C ATOM 2244 O LYS A 148 3.521 9.924 4.416 1.00 0.00 O ATOM 2245 CB LYS A 148 0.508 8.586 5.290 1.00 0.00 C ATOM 2246 CG LYS A 148 -0.063 7.343 5.958 1.00 0.00 C ATOM 2247 CD LYS A 148 -1.563 7.248 5.745 1.00 0.00 C ATOM 2248 CE LYS A 148 -2.134 5.984 6.363 1.00 0.00 C ATOM 2249 NZ LYS A 148 -3.607 5.885 6.163 1.00 0.00 N ATOM 2250 OXT LYS A 148 1.821 11.242 4.886 1.00 0.00 O ATOM 0 H LYS A 148 0.671 9.457 7.589 1.00 0.00 H new ATOM 0 HA LYS A 148 2.548 8.235 5.921 1.00 0.00 H new ATOM 0 HB2 LYS A 148 -0.221 9.393 5.366 1.00 0.00 H new ATOM 0 HB3 LYS A 148 0.649 8.382 4.229 1.00 0.00 H new ATOM 0 HG2 LYS A 148 0.422 6.454 5.554 1.00 0.00 H new ATOM 0 HG3 LYS A 148 0.155 7.368 7.026 1.00 0.00 H new ATOM 0 HD2 LYS A 148 -2.050 8.120 6.182 1.00 0.00 H new ATOM 0 HD3 LYS A 148 -1.782 7.263 4.677 1.00 0.00 H new ATOM 0 HE2 LYS A 148 -1.648 5.113 5.923 1.00 0.00 H new ATOM 0 HE3 LYS A 148 -1.910 5.968 7.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 -3.905 4.894 6.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 -4.094 6.468 6.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 -3.852 6.224 5.211 1.00 0.00 H new TER 2264 LYS A 148 HETATM 2265 N TPO B 495 10.124 4.525 -0.764 1.00 0.00 N HETATM 2266 CA TPO B 495 10.087 5.319 0.489 1.00 0.00 C HETATM 2267 CB TPO B 495 9.606 6.765 0.225 1.00 0.00 C HETATM 2268 CG2 TPO B 495 10.678 7.585 -0.481 1.00 0.00 C HETATM 2269 OG1 TPO B 495 8.413 6.750 -0.567 1.00 0.00 O HETATM 2270 C TPO B 495 9.160 4.675 1.515 1.00 0.00 C HETATM 2271 O TPO B 495 7.986 4.435 1.227 1.00 0.00 O HETATM 0 HG23 TPO B 495 11.573 7.626 0.140 1.00 0.00 H new HETATM 0 HG22 TPO B 495 10.921 7.121 -1.437 1.00 0.00 H new HETATM 0 HG21 TPO B 495 10.309 8.596 -0.652 1.00 0.00 H new HETATM 0 HB TPO B 495 9.399 7.229 1.189 1.00 0.00 H new HETATM 0 HA TPO B 495 11.105 5.344 0.879 1.00 0.00 H new HETATM 0 H2 TPO B 495 10.423 3.550 -0.741 1.00 0.00 H new HETATM 0 H TPO B 495 9.850 4.954 -1.648 1.00 0.00 H new ATOM 2280 N PHE B 496 9.697 4.415 2.722 1.00 0.00 N ATOM 2281 CA PHE B 496 8.935 3.812 3.839 1.00 0.00 C ATOM 2282 C PHE B 496 7.668 4.651 4.163 1.00 0.00 C ATOM 2283 O PHE B 496 6.676 4.125 4.674 1.00 0.00 O ATOM 2284 CB PHE B 496 9.865 3.634 5.071 1.00 0.00 C ATOM 2285 CG PHE B 496 10.177 4.847 5.927 1.00 0.00 C ATOM 2286 CD1 PHE B 496 10.574 6.047 5.364 1.00 0.00 C ATOM 2287 CD2 PHE B 496 10.131 4.747 7.311 1.00 0.00 C ATOM 2288 CE1 PHE B 496 10.911 7.123 6.162 1.00 0.00 C ATOM 2289 CE2 PHE B 496 10.477 5.816 8.110 1.00 0.00 C ATOM 2290 CZ PHE B 496 10.868 7.006 7.534 1.00 0.00 C ATOM 0 H PHE B 496 10.670 4.616 2.953 1.00 0.00 H new ATOM 0 HA PHE B 496 8.582 2.823 3.546 1.00 0.00 H new ATOM 0 HB2 PHE B 496 9.417 2.879 5.717 1.00 0.00 H new ATOM 0 HB3 PHE B 496 10.812 3.228 4.715 1.00 0.00 H new ATOM 0 HD1 PHE B 496 10.621 6.143 4.289 1.00 0.00 H new ATOM 0 HD2 PHE B 496 9.820 3.819 7.768 1.00 0.00 H new ATOM 0 HE1 PHE B 496 11.209 8.057 5.710 1.00 0.00 H new ATOM 0 HE2 PHE B 496 10.442 5.721 9.185 1.00 0.00 H new ATOM 0 HZ PHE B 496 11.140 7.845 8.157 1.00 0.00 H new ATOM 2300 N LYS B 497 7.739 5.967 3.847 1.00 0.00 N ATOM 2301 CA LYS B 497 6.640 6.935 4.073 1.00 0.00 C ATOM 2302 C LYS B 497 5.446 6.715 3.128 1.00 0.00 C ATOM 2303 O LYS B 497 4.307 6.583 3.585 1.00 0.00 O ATOM 2304 CB LYS B 497 7.140 8.381 3.871 1.00 0.00 C ATOM 2305 CG LYS B 497 8.301 8.799 4.774 1.00 0.00 C ATOM 2306 CD LYS B 497 9.413 9.533 4.010 1.00 0.00 C ATOM 2307 CE LYS B 497 9.104 11.016 3.820 1.00 0.00 C ATOM 2308 NZ LYS B 497 10.183 11.717 3.070 1.00 0.00 N ATOM 0 H LYS B 497 8.567 6.389 3.425 1.00 0.00 H new ATOM 0 HA LYS B 497 6.309 6.774 5.099 1.00 0.00 H new ATOM 0 HB2 LYS B 497 7.447 8.501 2.832 1.00 0.00 H new ATOM 0 HB3 LYS B 497 6.307 9.064 4.038 1.00 0.00 H new ATOM 0 HG2 LYS B 497 7.924 9.444 5.568 1.00 0.00 H new ATOM 0 HG3 LYS B 497 8.719 7.914 5.254 1.00 0.00 H new ATOM 0 HD2 LYS B 497 10.353 9.426 4.551 1.00 0.00 H new ATOM 0 HD3 LYS B 497 9.551 9.065 3.035 1.00 0.00 H new ATOM 0 HE2 LYS B 497 8.161 11.124 3.285 1.00 0.00 H new ATOM 0 HE3 LYS B 497 8.974 11.487 4.794 1.00 0.00 H new ATOM 0 HZ1 LYS B 497 9.935 12.721 2.962 1.00 0.00 H new ATOM 0 HZ2 LYS B 497 11.078 11.636 3.593 1.00 0.00 H new ATOM 0 HZ3 LYS B 497 10.290 11.284 2.130 1.00 0.00 H new ATOM 2322 N GLU B 498 5.724 6.677 1.813 1.00 0.00 N ATOM 2323 CA GLU B 498 4.691 6.510 0.775 1.00 0.00 C ATOM 2324 C GLU B 498 4.043 5.118 0.814 1.00 0.00 C ATOM 2325 O GLU B 498 2.849 4.979 0.531 1.00 0.00 O ATOM 2326 CB GLU B 498 5.297 6.785 -0.610 1.00 0.00 C ATOM 2327 CG GLU B 498 4.278 7.181 -1.674 1.00 0.00 C ATOM 2328 CD GLU B 498 4.917 7.434 -3.026 1.00 0.00 C ATOM 2329 OE1 GLU B 498 5.312 8.589 -3.289 1.00 0.00 O ATOM 2330 OE2 GLU B 498 5.022 6.476 -3.821 1.00 0.00 O ATOM 0 H GLU B 498 6.670 6.761 1.440 1.00 0.00 H new ATOM 0 HA GLU B 498 3.900 7.232 0.977 1.00 0.00 H new ATOM 0 HB2 GLU B 498 6.037 7.580 -0.518 1.00 0.00 H new ATOM 0 HB3 GLU B 498 5.827 5.893 -0.945 1.00 0.00 H new ATOM 0 HG2 GLU B 498 3.533 6.391 -1.770 1.00 0.00 H new ATOM 0 HG3 GLU B 498 3.751 8.079 -1.351 1.00 0.00 H new ATOM 2337 N VAL B 499 4.843 4.099 1.161 1.00 0.00 N ATOM 2338 CA VAL B 499 4.376 2.700 1.244 1.00 0.00 C ATOM 2339 C VAL B 499 3.176 2.542 2.202 1.00 0.00 C ATOM 2340 O VAL B 499 2.326 1.672 1.991 1.00 0.00 O ATOM 2341 CB VAL B 499 5.525 1.750 1.696 1.00 0.00 C ATOM 2342 CG1 VAL B 499 5.038 0.306 1.818 1.00 0.00 C ATOM 2343 CG2 VAL B 499 6.699 1.811 0.726 1.00 0.00 C ATOM 0 H VAL B 499 5.829 4.217 1.392 1.00 0.00 H new ATOM 0 HA VAL B 499 4.052 2.424 0.241 1.00 0.00 H new ATOM 0 HB VAL B 499 5.856 2.091 2.677 1.00 0.00 H new ATOM 0 HG11 VAL B 499 5.864 -0.331 2.135 1.00 0.00 H new ATOM 0 HG12 VAL B 499 4.236 0.254 2.554 1.00 0.00 H new ATOM 0 HG13 VAL B 499 4.667 -0.036 0.852 1.00 0.00 H new ATOM 0 HG21 VAL B 499 7.487 1.138 1.065 1.00 0.00 H new ATOM 0 HG22 VAL B 499 6.367 1.509 -0.267 1.00 0.00 H new ATOM 0 HG23 VAL B 499 7.084 2.830 0.685 1.00 0.00 H new ATOM 2353 N ALA B 500 3.116 3.393 3.239 1.00 0.00 N ATOM 2354 CA ALA B 500 2.039 3.351 4.240 1.00 0.00 C ATOM 2355 C ALA B 500 0.649 3.515 3.609 1.00 0.00 C ATOM 2356 O ALA B 500 -0.251 2.722 3.881 1.00 0.00 O ATOM 2357 CB ALA B 500 2.275 4.416 5.304 1.00 0.00 C ATOM 0 H ALA B 500 3.807 4.124 3.406 1.00 0.00 H new ATOM 0 HA ALA B 500 2.061 2.365 4.705 1.00 0.00 H new ATOM 0 HB1 ALA B 500 1.473 4.378 6.041 1.00 0.00 H new ATOM 0 HB2 ALA B 500 3.230 4.233 5.797 1.00 0.00 H new ATOM 0 HB3 ALA B 500 2.291 5.400 4.836 1.00 0.00 H new ATOM 2363 N ASN B 501 0.492 4.545 2.765 1.00 0.00 N ATOM 2364 CA ASN B 501 -0.780 4.827 2.079 1.00 0.00 C ATOM 2365 C ASN B 501 -1.082 3.809 0.959 1.00 0.00 C ATOM 2366 O ASN B 501 -2.248 3.592 0.616 1.00 0.00 O ATOM 2367 CB ASN B 501 -0.749 6.248 1.500 1.00 0.00 C ATOM 2368 CG ASN B 501 -2.136 6.826 1.267 1.00 0.00 C ATOM 2369 OD1 ASN B 501 -2.739 6.616 0.215 1.00 0.00 O ATOM 2370 ND2 ASN B 501 -2.643 7.564 2.247 1.00 0.00 N ATOM 0 H ASN B 501 1.238 5.203 2.539 1.00 0.00 H new ATOM 0 HA ASN B 501 -1.577 4.740 2.817 1.00 0.00 H new ATOM 0 HB2 ASN B 501 -0.200 6.899 2.180 1.00 0.00 H new ATOM 0 HB3 ASN B 501 -0.203 6.238 0.557 1.00 0.00 H new ATOM 0 HD21 ASN B 501 -3.567 7.983 2.144 1.00 0.00 H new ATOM 0 HD22 ASN B 501 -2.108 7.712 3.103 1.00 0.00 H new ATOM 2377 N ALA B 502 -0.025 3.196 0.403 1.00 0.00 N ATOM 2378 CA ALA B 502 -0.155 2.229 -0.698 1.00 0.00 C ATOM 2379 C ALA B 502 -0.639 0.840 -0.247 1.00 0.00 C ATOM 2380 O ALA B 502 -1.652 0.348 -0.747 1.00 0.00 O ATOM 2381 CB ALA B 502 1.169 2.117 -1.444 1.00 0.00 C ATOM 0 H ALA B 502 0.937 3.355 0.702 1.00 0.00 H new ATOM 0 HA ALA B 502 -0.929 2.613 -1.363 1.00 0.00 H new ATOM 0 HB1 ALA B 502 1.068 1.400 -2.259 1.00 0.00 H new ATOM 0 HB2 ALA B 502 1.441 3.091 -1.850 1.00 0.00 H new ATOM 0 HB3 ALA B 502 1.946 1.780 -0.758 1.00 0.00 H new ATOM 2387 N VAL B 503 0.094 0.209 0.685 1.00 0.00 N ATOM 2388 CA VAL B 503 -0.250 -1.137 1.183 1.00 0.00 C ATOM 2389 C VAL B 503 -1.494 -1.142 2.114 1.00 0.00 C ATOM 2390 O VAL B 503 -2.205 -2.149 2.180 1.00 0.00 O ATOM 2391 CB VAL B 503 0.989 -1.830 1.858 1.00 0.00 C ATOM 2392 CG1 VAL B 503 1.498 -1.060 3.079 1.00 0.00 C ATOM 2393 CG2 VAL B 503 0.689 -3.280 2.241 1.00 0.00 C ATOM 0 H VAL B 503 0.930 0.609 1.111 1.00 0.00 H new ATOM 0 HA VAL B 503 -0.529 -1.728 0.310 1.00 0.00 H new ATOM 0 HB VAL B 503 1.780 -1.825 1.108 1.00 0.00 H new ATOM 0 HG11 VAL B 503 2.354 -1.582 3.507 1.00 0.00 H new ATOM 0 HG12 VAL B 503 1.798 -0.057 2.777 1.00 0.00 H new ATOM 0 HG13 VAL B 503 0.705 -0.993 3.823 1.00 0.00 H new ATOM 0 HG21 VAL B 503 1.570 -3.724 2.704 1.00 0.00 H new ATOM 0 HG22 VAL B 503 -0.143 -3.306 2.945 1.00 0.00 H new ATOM 0 HG23 VAL B 503 0.426 -3.845 1.347 1.00 0.00 H new ATOM 2403 N LYS B 504 -1.743 -0.024 2.819 1.00 0.00 N ATOM 2404 CA LYS B 504 -2.886 0.079 3.748 1.00 0.00 C ATOM 2405 C LYS B 504 -4.240 0.179 3.019 1.00 0.00 C ATOM 2406 O LYS B 504 -5.247 -0.323 3.528 1.00 0.00 O ATOM 2407 CB LYS B 504 -2.703 1.276 4.701 1.00 0.00 C ATOM 2408 CG LYS B 504 -3.425 1.133 6.044 1.00 0.00 C ATOM 2409 CD LYS B 504 -4.849 1.671 5.984 1.00 0.00 C ATOM 2410 CE LYS B 504 -5.734 1.016 7.030 1.00 0.00 C ATOM 2411 NZ LYS B 504 -7.067 1.675 7.124 1.00 0.00 N ATOM 0 H LYS B 504 -1.171 0.819 2.765 1.00 0.00 H new ATOM 0 HA LYS B 504 -2.903 -0.844 4.327 1.00 0.00 H new ATOM 0 HB2 LYS B 504 -1.638 1.416 4.888 1.00 0.00 H new ATOM 0 HB3 LYS B 504 -3.061 2.178 4.204 1.00 0.00 H new ATOM 0 HG2 LYS B 504 -3.446 0.083 6.335 1.00 0.00 H new ATOM 0 HG3 LYS B 504 -2.868 1.666 6.814 1.00 0.00 H new ATOM 0 HD2 LYS B 504 -4.839 2.750 6.138 1.00 0.00 H new ATOM 0 HD3 LYS B 504 -5.265 1.495 4.992 1.00 0.00 H new ATOM 0 HE2 LYS B 504 -5.867 -0.038 6.784 1.00 0.00 H new ATOM 0 HE3 LYS B 504 -5.240 1.057 8.001 1.00 0.00 H new ATOM 0 HZ1 LYS B 504 -7.640 1.198 7.849 1.00 0.00 H new ATOM 0 HZ2 LYS B 504 -6.943 2.674 7.383 1.00 0.00 H new ATOM 0 HZ3 LYS B 504 -7.550 1.613 6.205 1.00 0.00 H new ATOM 2425 N ILE B 505 -4.264 0.822 1.837 1.00 0.00 N ATOM 2426 CA ILE B 505 -5.510 0.977 1.056 1.00 0.00 C ATOM 2427 C ILE B 505 -6.026 -0.390 0.546 1.00 0.00 C ATOM 2428 O ILE B 505 -7.237 -0.605 0.444 1.00 0.00 O ATOM 2429 CB ILE B 505 -5.335 2.007 -0.116 1.00 0.00 C ATOM 2430 CG1 ILE B 505 -6.695 2.388 -0.731 1.00 0.00 C ATOM 2431 CG2 ILE B 505 -4.383 1.496 -1.202 1.00 0.00 C ATOM 2432 CD1 ILE B 505 -6.852 3.873 -0.992 1.00 0.00 C ATOM 0 H ILE B 505 -3.442 1.241 1.402 1.00 0.00 H new ATOM 0 HA ILE B 505 -6.268 1.383 1.725 1.00 0.00 H new ATOM 0 HB ILE B 505 -4.886 2.900 0.319 1.00 0.00 H new ATOM 0 HG12 ILE B 505 -6.824 1.848 -1.669 1.00 0.00 H new ATOM 0 HG13 ILE B 505 -7.491 2.060 -0.062 1.00 0.00 H new ATOM 0 HG21 ILE B 505 -4.295 2.244 -1.990 1.00 0.00 H new ATOM 0 HG22 ILE B 505 -3.401 1.310 -0.767 1.00 0.00 H new ATOM 0 HG23 ILE B 505 -4.775 0.570 -1.623 1.00 0.00 H new ATOM 0 HD11 ILE B 505 -7.834 4.065 -1.425 1.00 0.00 H new ATOM 0 HD12 ILE B 505 -6.756 4.419 -0.054 1.00 0.00 H new ATOM 0 HD13 ILE B 505 -6.079 4.204 -1.685 1.00 0.00 H new ATOM 2444 N SER B 506 -5.086 -1.289 0.236 1.00 0.00 N ATOM 2445 CA SER B 506 -5.411 -2.637 -0.231 1.00 0.00 C ATOM 2446 C SER B 506 -5.357 -3.634 0.939 1.00 0.00 C ATOM 2447 O SER B 506 -5.316 -4.853 0.741 1.00 0.00 O ATOM 2448 CB SER B 506 -4.443 -3.048 -1.351 1.00 0.00 C ATOM 2449 OG SER B 506 -3.094 -2.957 -0.925 1.00 0.00 O ATOM 0 H SER B 506 -4.085 -1.103 0.302 1.00 0.00 H new ATOM 0 HA SER B 506 -6.425 -2.643 -0.632 1.00 0.00 H new ATOM 0 HB2 SER B 506 -4.659 -4.069 -1.665 1.00 0.00 H new ATOM 0 HB3 SER B 506 -4.596 -2.408 -2.220 1.00 0.00 H new ATOM 0 HG SER B 506 -2.556 -3.625 -1.399 1.00 0.00 H new ATOM 2455 N ALA B 507 -5.369 -3.090 2.160 1.00 0.00 N ATOM 2456 CA ALA B 507 -5.330 -3.891 3.382 1.00 0.00 C ATOM 2457 C ALA B 507 -6.691 -3.909 4.083 1.00 0.00 C ATOM 2458 O ALA B 507 -6.890 -4.656 5.047 1.00 0.00 O ATOM 2459 CB ALA B 507 -4.259 -3.354 4.316 1.00 0.00 C ATOM 0 H ALA B 507 -5.406 -2.084 2.326 1.00 0.00 H new ATOM 0 HA ALA B 507 -5.087 -4.918 3.109 1.00 0.00 H new ATOM 0 HB1 ALA B 507 -4.234 -3.955 5.225 1.00 0.00 H new ATOM 0 HB2 ALA B 507 -3.288 -3.403 3.823 1.00 0.00 H new ATOM 0 HB3 ALA B 507 -4.485 -2.319 4.571 1.00 0.00 H new ATOM 2465 N SER B 508 -7.627 -3.083 3.584 1.00 0.00 N ATOM 2466 CA SER B 508 -8.980 -2.986 4.147 1.00 0.00 C ATOM 2467 C SER B 508 -9.864 -4.170 3.726 1.00 0.00 C ATOM 2468 O SER B 508 -10.913 -4.408 4.331 1.00 0.00 O ATOM 2469 CB SER B 508 -9.633 -1.667 3.720 1.00 0.00 C ATOM 2470 OG SER B 508 -9.622 -1.520 2.310 1.00 0.00 O ATOM 0 H SER B 508 -7.466 -2.469 2.785 1.00 0.00 H new ATOM 0 HA SER B 508 -8.887 -3.014 5.233 1.00 0.00 H new ATOM 0 HB2 SER B 508 -10.660 -1.633 4.083 1.00 0.00 H new ATOM 0 HB3 SER B 508 -9.104 -0.832 4.179 1.00 0.00 H new ATOM 0 HG SER B 508 -8.751 -1.174 2.024 1.00 0.00 H new ATOM 2476 N LEU B 509 -9.426 -4.907 2.693 1.00 0.00 N ATOM 2477 CA LEU B 509 -10.168 -6.069 2.192 1.00 0.00 C ATOM 2478 C LEU B 509 -9.757 -7.363 2.908 1.00 0.00 C ATOM 2479 O LEU B 509 -10.508 -8.343 2.899 1.00 0.00 O ATOM 2480 CB LEU B 509 -9.977 -6.221 0.676 1.00 0.00 C ATOM 2481 CG LEU B 509 -11.098 -5.625 -0.191 1.00 0.00 C ATOM 2482 CD1 LEU B 509 -10.575 -5.267 -1.574 1.00 0.00 C ATOM 2483 CD2 LEU B 509 -12.268 -6.597 -0.311 1.00 0.00 C ATOM 0 H LEU B 509 -8.560 -4.716 2.189 1.00 0.00 H new ATOM 0 HA LEU B 509 -11.223 -5.893 2.403 1.00 0.00 H new ATOM 0 HB2 LEU B 509 -9.035 -5.750 0.396 1.00 0.00 H new ATOM 0 HB3 LEU B 509 -9.885 -7.282 0.443 1.00 0.00 H new ATOM 0 HG LEU B 509 -11.450 -4.716 0.297 1.00 0.00 H new ATOM 0 HD11 LEU B 509 -11.384 -4.847 -2.171 1.00 0.00 H new ATOM 0 HD12 LEU B 509 -9.774 -4.534 -1.481 1.00 0.00 H new ATOM 0 HD13 LEU B 509 -10.192 -6.164 -2.061 1.00 0.00 H new ATOM 0 HD21 LEU B 509 -13.048 -6.153 -0.929 1.00 0.00 H new ATOM 0 HD22 LEU B 509 -11.925 -7.524 -0.770 1.00 0.00 H new ATOM 0 HD23 LEU B 509 -12.668 -6.810 0.681 1.00 0.00 H new ATOM 2495 N MET B 510 -8.565 -7.356 3.523 1.00 0.00 N ATOM 2496 CA MET B 510 -8.055 -8.519 4.253 1.00 0.00 C ATOM 2497 C MET B 510 -8.296 -8.349 5.757 1.00 0.00 C ATOM 2498 O MET B 510 -9.033 -9.177 6.333 1.00 0.00 O ATOM 2499 CB MET B 510 -6.557 -8.723 3.960 1.00 0.00 C ATOM 2500 CG MET B 510 -6.078 -10.164 4.125 1.00 0.00 C ATOM 2501 SD MET B 510 -6.080 -10.709 5.844 1.00 0.00 S ATOM 2502 CE MET B 510 -5.608 -12.427 5.656 1.00 0.00 C ATOM 2503 OXT MET B 510 -7.755 -7.385 6.343 1.00 0.00 O ATOM 0 H MET B 510 -7.936 -6.553 3.527 1.00 0.00 H new ATOM 0 HA MET B 510 -8.592 -9.406 3.917 1.00 0.00 H new ATOM 0 HB2 MET B 510 -6.350 -8.397 2.941 1.00 0.00 H new ATOM 0 HB3 MET B 510 -5.978 -8.081 4.624 1.00 0.00 H new ATOM 0 HG2 MET B 510 -6.717 -10.824 3.539 1.00 0.00 H new ATOM 0 HG3 MET B 510 -5.070 -10.255 3.721 1.00 0.00 H new ATOM 0 HE1 MET B 510 -5.548 -12.897 6.637 1.00 0.00 H new ATOM 0 HE2 MET B 510 -6.352 -12.944 5.050 1.00 0.00 H new ATOM 0 HE3 MET B 510 -4.636 -12.486 5.166 1.00 0.00 H new TER 2513 MET B 510