USER MOD reduce.3.24.130724 H: found=0, std=0, add=1288, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1276 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 34 ASN : amide:sc= -0.263 K(o=-0.33,f=-1.5!) USER MOD Set 1.2: A 37 GLN : amide:sc= -0.0671 K(o=-0.33,f=-2.4!) USER MOD Set 2.1: A 17 THR OG1 : rot -71:sc= 0.13 USER MOD Set 2.2: A 20 SER OG : rot 100:sc= 1.01 USER MOD Single : A 1 MET CE :methyl 143:sc= 0 (180deg=-0.594) USER MOD Single : A 1 MET N :NH3+ -120:sc= 0.0931 (180deg=-0.225) USER MOD Single : A 4 SER OG : rot 170:sc= -1.46 USER MOD Single : A 5 ASN :FLIP amide:sc= -2.13 F(o=-2.8!,f=-2.1) USER MOD Single : A 8 LYS NZ :NH3+ -129:sc= -0.649 (180deg=-1.6) USER MOD Single : A 15 SER OG : rot -5:sc= 0.287 USER MOD Single : A 19 LYS NZ :NH3+ -161:sc= -0.966 (180deg=-1.58) USER MOD Single : A 25 MET CE :methyl -105:sc= -0.564 (180deg=-5.62!) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= -0.203 X(o=-0.2,f=-0.32) USER MOD Single : A 31 GLN : amide:sc= -0.303 K(o=-0.3,f=-2.1) USER MOD Single : A 33 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= -0.128 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0.00632 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ -132:sc= 0.117! (180deg=-1.29!) USER MOD Single : A 59 ASN : amide:sc= -2.05! C(o=-2.1!,f=-15!) USER MOD Single : A 68 ASN : amide:sc= -0.0286 K(o=-0.029,f=-1.6) USER MOD Single : A 69 LYS NZ :NH3+ 162:sc= -0.0218 (180deg=-0.445) USER MOD Single : A 72 HIS : no HD1:sc= -0.113 X(o=-0.11,f=-0.14) USER MOD Single : A 73 HIS : no HD1:sc= -1.42 K(o=-1.4,f=-2.2!) USER MOD Single : A 74 HIS : no HE2:sc=-0.00198 K(o=-0.002,f=-1.5!) USER MOD Single : A 75 HIS : no HD1:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 76 HIS : no HD1:sc= -0.254 X(o=-0.25,f=-0.37) USER MOD Single : A 77 HIS : no HD1:sc= -0.0642 X(o=-0.064,f=0) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -118:sc= 0.0359 (180deg=-0.179) USER MOD Single : B 4 SER OG : rot 180:sc= 0 USER MOD Single : B 5 ASN :FLIP amide:sc= -2.01! C(o=-3.3!,f=-2!) USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 SER OG : rot 63:sc= 1.1 USER MOD Single : B 17 THR OG1 : rot 180:sc= 0.044 USER MOD Single : B 19 LYS NZ :NH3+ -160:sc= -0.0704 (180deg=-0.65) USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 25 MET CE :methyl 137:sc= -0.319 (180deg=-2.8!) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 30 GLN : amide:sc= -0.479 K(o=-0.48,f=-1.2) USER MOD Single : B 31 GLN : amide:sc= -0.158 X(o=-0.16,f=-0.099) USER MOD Single : B 33 CYS SG : rot 76:sc= 0.447 USER MOD Single : B 34 ASN : amide:sc= -0.0585 K(o=-0.059,f=-1.7!) USER MOD Single : B 37 GLN : amide:sc= -0.179 X(o=-0.18,f=-0.22) USER MOD Single : B 38 SER OG : rot -101:sc= 0.0215 USER MOD Single : B 40 THR OG1 : rot -21:sc= 0.533 USER MOD Single : B 46 LYS NZ :NH3+ -164:sc= -0.0332 (180deg=-0.322) USER MOD Single : B 47 TYR OH : rot 180:sc= 0 USER MOD Single : B 53 SER OG : rot -62:sc= 0.93 USER MOD Single : B 54 LYS NZ :NH3+ -153:sc= -4.25! (180deg=-5.08!) USER MOD Single : B 59 ASN : amide:sc= -2.37! C(o=-2.4!,f=-14!) USER MOD Single : B 68 ASN : amide:sc= -1.78! C(o=-1.8!,f=-4.1!) USER MOD Single : B 69 LYS NZ :NH3+ 162:sc= -0.0581 (180deg=-0.444) USER MOD Single : B 72 HIS : no HE2:sc= -2! C(o=-2!,f=-5.9!) USER MOD Single : B 73 HIS :FLIP no HD1:sc= -0.535 F(o=-1.9,f=-0.53) USER MOD Single : B 74 HIS : no HE2:sc= -0.268 K(o=-0.27,f=-3!) USER MOD Single : B 75 HIS : no HD1:sc= -3.39! C(o=-3.4!,f=-6.1!) USER MOD Single : B 76 HIS : no HE2:sc= -0.51 K(o=-0.51,f=-3.1!) USER MOD Single : B 77 HIS : no HD1:sc= -0.606 K(o=-0.61,f=-1.4) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 11.049 14.918 5.827 1.00 0.00 N ATOM 2 CA MET A 1 10.232 14.351 6.939 1.00 0.00 C ATOM 3 C MET A 1 9.730 12.958 6.562 1.00 0.00 C ATOM 4 O MET A 1 9.957 12.477 5.471 1.00 0.00 O ATOM 5 CB MET A 1 9.038 15.263 7.214 1.00 0.00 C ATOM 6 CG MET A 1 9.527 16.556 7.870 1.00 0.00 C ATOM 7 SD MET A 1 8.117 17.645 8.197 1.00 0.00 S ATOM 8 CE MET A 1 8.045 18.432 6.568 1.00 0.00 C ATOM 0 H1 MET A 1 12.012 15.114 6.168 1.00 0.00 H new ATOM 0 H2 MET A 1 11.092 14.235 5.044 1.00 0.00 H new ATOM 0 H3 MET A 1 10.614 15.801 5.492 1.00 0.00 H new ATOM 0 HA MET A 1 10.851 14.279 7.833 1.00 0.00 H new ATOM 0 HB2 MET A 1 8.517 15.489 6.284 1.00 0.00 H new ATOM 0 HB3 MET A 1 8.324 14.759 7.865 1.00 0.00 H new ATOM 0 HG2 MET A 1 10.047 16.329 8.801 1.00 0.00 H new ATOM 0 HG3 MET A 1 10.243 17.057 7.219 1.00 0.00 H new ATOM 0 HE1 MET A 1 7.004 18.600 6.291 1.00 0.00 H new ATOM 0 HE2 MET A 1 8.570 19.387 6.602 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.517 17.784 5.830 1.00 0.00 H new ATOM 20 N GLU A 2 9.055 12.301 7.467 1.00 0.00 N ATOM 21 CA GLU A 2 8.543 10.929 7.178 1.00 0.00 C ATOM 22 C GLU A 2 7.205 11.001 6.434 1.00 0.00 C ATOM 23 O GLU A 2 6.616 12.051 6.284 1.00 0.00 O ATOM 24 CB GLU A 2 8.358 10.181 8.499 1.00 0.00 C ATOM 25 CG GLU A 2 7.199 10.799 9.284 1.00 0.00 C ATOM 26 CD GLU A 2 7.251 10.308 10.731 1.00 0.00 C ATOM 27 OE1 GLU A 2 7.677 9.183 10.937 1.00 0.00 O ATOM 28 OE2 GLU A 2 6.866 11.064 11.606 1.00 0.00 O ATOM 0 H GLU A 2 8.835 12.656 8.397 1.00 0.00 H new ATOM 0 HA GLU A 2 9.260 10.403 6.548 1.00 0.00 H new ATOM 0 HB2 GLU A 2 8.158 9.127 8.306 1.00 0.00 H new ATOM 0 HB3 GLU A 2 9.275 10.229 9.087 1.00 0.00 H new ATOM 0 HG2 GLU A 2 7.263 11.887 9.254 1.00 0.00 H new ATOM 0 HG3 GLU A 2 6.248 10.523 8.828 1.00 0.00 H new ATOM 35 N LEU A 3 6.726 9.877 5.970 1.00 0.00 N ATOM 36 CA LEU A 3 5.430 9.844 5.232 1.00 0.00 C ATOM 37 C LEU A 3 4.289 10.278 6.153 1.00 0.00 C ATOM 38 O LEU A 3 3.382 10.971 5.743 1.00 0.00 O ATOM 39 CB LEU A 3 5.173 8.414 4.743 1.00 0.00 C ATOM 40 CG LEU A 3 3.868 8.344 3.933 1.00 0.00 C ATOM 41 CD1 LEU A 3 3.961 9.241 2.685 1.00 0.00 C ATOM 42 CD2 LEU A 3 3.629 6.888 3.511 1.00 0.00 C ATOM 0 H LEU A 3 7.183 8.971 6.072 1.00 0.00 H new ATOM 0 HA LEU A 3 5.479 10.527 4.384 1.00 0.00 H new ATOM 0 HB2 LEU A 3 6.008 8.079 4.127 1.00 0.00 H new ATOM 0 HB3 LEU A 3 5.115 7.738 5.596 1.00 0.00 H new ATOM 0 HG LEU A 3 3.040 8.697 4.547 1.00 0.00 H new ATOM 0 HD11 LEU A 3 3.029 9.180 2.123 1.00 0.00 H new ATOM 0 HD12 LEU A 3 4.133 10.273 2.991 1.00 0.00 H new ATOM 0 HD13 LEU A 3 4.786 8.906 2.057 1.00 0.00 H new ATOM 0 HD21 LEU A 3 2.706 6.823 2.935 1.00 0.00 H new ATOM 0 HD22 LEU A 3 4.463 6.545 2.899 1.00 0.00 H new ATOM 0 HD23 LEU A 3 3.548 6.261 4.399 1.00 0.00 H new ATOM 54 N SER A 4 4.311 9.862 7.387 1.00 0.00 N ATOM 55 CA SER A 4 3.208 10.237 8.317 1.00 0.00 C ATOM 56 C SER A 4 3.091 11.760 8.415 1.00 0.00 C ATOM 57 O SER A 4 2.006 12.304 8.439 1.00 0.00 O ATOM 58 CB SER A 4 3.506 9.664 9.700 1.00 0.00 C ATOM 59 OG SER A 4 4.448 10.498 10.358 1.00 0.00 O ATOM 0 H SER A 4 5.043 9.279 7.793 1.00 0.00 H new ATOM 0 HA SER A 4 2.269 9.834 7.938 1.00 0.00 H new ATOM 0 HB2 SER A 4 2.589 9.599 10.285 1.00 0.00 H new ATOM 0 HB3 SER A 4 3.899 8.651 9.610 1.00 0.00 H new ATOM 0 HG SER A 4 4.522 10.230 11.298 1.00 0.00 H new ATOM 65 N ASN A 5 4.193 12.455 8.475 1.00 0.00 N ATOM 66 CA ASN A 5 4.130 13.941 8.576 1.00 0.00 C ATOM 67 C ASN A 5 3.505 14.522 7.305 1.00 0.00 C ATOM 68 O ASN A 5 2.628 15.363 7.357 1.00 0.00 O ATOM 69 CB ASN A 5 5.550 14.480 8.735 1.00 0.00 C ATOM 70 CG ASN A 5 5.502 15.937 9.192 1.00 0.00 C ATOM 71 OD1 ASN A 5 4.709 16.775 8.582 1.00 0.00 O flip ATOM 72 ND2 ASN A 5 6.193 16.318 10.116 1.00 0.00 N flip ATOM 0 H ASN A 5 5.133 12.060 8.459 1.00 0.00 H new ATOM 0 HA ASN A 5 3.521 14.227 9.434 1.00 0.00 H new ATOM 0 HB2 ASN A 5 6.098 13.879 9.461 1.00 0.00 H new ATOM 0 HB3 ASN A 5 6.086 14.403 7.789 1.00 0.00 H new ATOM 0 HD21 ASN A 5 6.813 15.663 10.593 1.00 0.00 H new ATOM 0 HD22 ASN A 5 6.153 17.292 10.415 1.00 0.00 H new ATOM 79 N GLU A 6 3.948 14.074 6.163 1.00 0.00 N ATOM 80 CA GLU A 6 3.387 14.588 4.883 1.00 0.00 C ATOM 81 C GLU A 6 1.946 14.095 4.732 1.00 0.00 C ATOM 82 O GLU A 6 1.088 14.794 4.234 1.00 0.00 O ATOM 83 CB GLU A 6 4.246 14.068 3.717 1.00 0.00 C ATOM 84 CG GLU A 6 5.457 14.984 3.508 1.00 0.00 C ATOM 85 CD GLU A 6 6.254 15.095 4.808 1.00 0.00 C ATOM 86 OE1 GLU A 6 6.923 14.136 5.153 1.00 0.00 O ATOM 87 OE2 GLU A 6 6.179 16.137 5.438 1.00 0.00 O ATOM 0 H GLU A 6 4.679 13.370 6.061 1.00 0.00 H new ATOM 0 HA GLU A 6 3.394 15.678 4.880 1.00 0.00 H new ATOM 0 HB2 GLU A 6 4.580 13.052 3.926 1.00 0.00 H new ATOM 0 HB3 GLU A 6 3.650 14.026 2.806 1.00 0.00 H new ATOM 0 HG2 GLU A 6 6.091 14.588 2.715 1.00 0.00 H new ATOM 0 HG3 GLU A 6 5.126 15.972 3.188 1.00 0.00 H new ATOM 94 N LEU A 7 1.679 12.889 5.151 1.00 0.00 N ATOM 95 CA LEU A 7 0.302 12.343 5.026 1.00 0.00 C ATOM 96 C LEU A 7 -0.656 13.180 5.878 1.00 0.00 C ATOM 97 O LEU A 7 -1.756 13.493 5.468 1.00 0.00 O ATOM 98 CB LEU A 7 0.296 10.890 5.515 1.00 0.00 C ATOM 99 CG LEU A 7 -1.064 10.242 5.223 1.00 0.00 C ATOM 100 CD1 LEU A 7 -1.292 10.142 3.699 1.00 0.00 C ATOM 101 CD2 LEU A 7 -1.091 8.844 5.851 1.00 0.00 C ATOM 0 H LEU A 7 2.358 12.258 5.576 1.00 0.00 H new ATOM 0 HA LEU A 7 -0.020 12.380 3.985 1.00 0.00 H new ATOM 0 HB2 LEU A 7 1.089 10.328 5.021 1.00 0.00 H new ATOM 0 HB3 LEU A 7 0.501 10.857 6.585 1.00 0.00 H new ATOM 0 HG LEU A 7 -1.859 10.853 5.650 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -2.260 9.681 3.505 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -1.272 11.140 3.262 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -0.505 9.534 3.252 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -2.053 8.373 5.650 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -0.294 8.237 5.422 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -0.945 8.926 6.928 1.00 0.00 H new ATOM 113 N LYS A 8 -0.244 13.544 7.063 1.00 0.00 N ATOM 114 CA LYS A 8 -1.122 14.358 7.952 1.00 0.00 C ATOM 115 C LYS A 8 -1.416 15.712 7.299 1.00 0.00 C ATOM 116 O LYS A 8 -2.526 16.203 7.338 1.00 0.00 O ATOM 117 CB LYS A 8 -0.409 14.582 9.285 1.00 0.00 C ATOM 118 CG LYS A 8 -1.344 15.305 10.252 1.00 0.00 C ATOM 119 CD LYS A 8 -0.656 15.452 11.609 1.00 0.00 C ATOM 120 CE LYS A 8 -1.602 16.148 12.588 1.00 0.00 C ATOM 121 NZ LYS A 8 -1.929 17.509 12.078 1.00 0.00 N ATOM 0 H LYS A 8 0.668 13.311 7.455 1.00 0.00 H new ATOM 0 HA LYS A 8 -2.062 13.830 8.115 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -0.100 13.626 9.708 1.00 0.00 H new ATOM 0 HB3 LYS A 8 0.496 15.170 9.131 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -1.606 16.286 9.857 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -2.274 14.747 10.362 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -0.374 14.472 11.994 1.00 0.00 H new ATOM 0 HD3 LYS A 8 0.263 16.029 11.502 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -2.514 15.563 12.707 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -1.138 16.218 13.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -1.764 18.210 12.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -1.325 17.728 11.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -2.927 17.541 11.789 1.00 0.00 H new ATOM 135 N VAL A 9 -0.430 16.318 6.701 1.00 0.00 N ATOM 136 CA VAL A 9 -0.644 17.639 6.051 1.00 0.00 C ATOM 137 C VAL A 9 -1.687 17.506 4.937 1.00 0.00 C ATOM 138 O VAL A 9 -2.576 18.324 4.808 1.00 0.00 O ATOM 139 CB VAL A 9 0.682 18.122 5.463 1.00 0.00 C ATOM 140 CG1 VAL A 9 0.454 19.399 4.654 1.00 0.00 C ATOM 141 CG2 VAL A 9 1.667 18.408 6.601 1.00 0.00 C ATOM 0 H VAL A 9 0.520 15.953 6.634 1.00 0.00 H new ATOM 0 HA VAL A 9 -1.004 18.358 6.787 1.00 0.00 H new ATOM 0 HB VAL A 9 1.090 17.351 4.810 1.00 0.00 H new ATOM 0 HG11 VAL A 9 1.402 19.740 4.237 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -0.247 19.196 3.844 1.00 0.00 H new ATOM 0 HG13 VAL A 9 0.044 20.173 5.303 1.00 0.00 H new ATOM 0 HG21 VAL A 9 2.614 18.753 6.185 1.00 0.00 H new ATOM 0 HG22 VAL A 9 1.256 19.178 7.253 1.00 0.00 H new ATOM 0 HG23 VAL A 9 1.834 17.497 7.176 1.00 0.00 H new ATOM 151 N GLU A 10 -1.590 16.484 4.131 1.00 0.00 N ATOM 152 CA GLU A 10 -2.574 16.305 3.029 1.00 0.00 C ATOM 153 C GLU A 10 -3.986 16.208 3.613 1.00 0.00 C ATOM 154 O GLU A 10 -4.923 16.780 3.092 1.00 0.00 O ATOM 155 CB GLU A 10 -2.245 15.010 2.293 1.00 0.00 C ATOM 156 CG GLU A 10 -0.892 15.149 1.597 1.00 0.00 C ATOM 157 CD GLU A 10 -0.491 13.795 1.013 1.00 0.00 C ATOM 158 OE1 GLU A 10 -0.952 12.793 1.532 1.00 0.00 O ATOM 159 OE2 GLU A 10 0.279 13.783 0.067 1.00 0.00 O ATOM 0 H GLU A 10 -0.870 15.764 4.189 1.00 0.00 H new ATOM 0 HA GLU A 10 -2.525 17.152 2.345 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -2.221 14.176 2.995 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -3.021 14.788 1.561 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -0.950 15.897 0.807 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -0.138 15.492 2.305 1.00 0.00 H new ATOM 166 N ARG A 11 -4.145 15.495 4.696 1.00 0.00 N ATOM 167 CA ARG A 11 -5.494 15.369 5.311 1.00 0.00 C ATOM 168 C ARG A 11 -6.026 16.767 5.616 1.00 0.00 C ATOM 169 O ARG A 11 -7.155 17.095 5.313 1.00 0.00 O ATOM 170 CB ARG A 11 -5.369 14.589 6.622 1.00 0.00 C ATOM 171 CG ARG A 11 -6.758 14.269 7.177 1.00 0.00 C ATOM 172 CD ARG A 11 -6.616 13.715 8.596 1.00 0.00 C ATOM 173 NE ARG A 11 -5.861 12.430 8.557 1.00 0.00 N ATOM 174 CZ ARG A 11 -5.277 11.985 9.635 1.00 0.00 C ATOM 175 NH1 ARG A 11 -5.342 12.672 10.746 1.00 0.00 N ATOM 176 NH2 ARG A 11 -4.624 10.856 9.604 1.00 0.00 N ATOM 0 H ARG A 11 -3.399 14.996 5.179 1.00 0.00 H new ATOM 0 HA ARG A 11 -6.170 14.850 4.631 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -4.814 13.666 6.454 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -4.804 15.172 7.349 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -7.376 15.167 7.184 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -7.260 13.542 6.538 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -6.096 14.435 9.228 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -7.601 13.557 9.036 1.00 0.00 H new ATOM 0 HE ARG A 11 -5.801 11.899 7.688 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -5.850 13.556 10.770 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -4.885 12.323 11.589 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -4.570 10.322 8.737 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -4.167 10.508 10.447 1.00 0.00 H new ATOM 190 N ILE A 12 -5.208 17.594 6.206 1.00 0.00 N ATOM 191 CA ILE A 12 -5.633 18.982 6.531 1.00 0.00 C ATOM 192 C ILE A 12 -5.868 19.760 5.232 1.00 0.00 C ATOM 193 O ILE A 12 -6.820 20.505 5.105 1.00 0.00 O ATOM 194 CB ILE A 12 -4.532 19.666 7.344 1.00 0.00 C ATOM 195 CG1 ILE A 12 -4.416 18.984 8.710 1.00 0.00 C ATOM 196 CG2 ILE A 12 -4.880 21.145 7.540 1.00 0.00 C ATOM 197 CD1 ILE A 12 -3.128 19.440 9.395 1.00 0.00 C ATOM 0 H ILE A 12 -4.253 17.363 6.479 1.00 0.00 H new ATOM 0 HA ILE A 12 -6.556 18.958 7.110 1.00 0.00 H new ATOM 0 HB ILE A 12 -3.584 19.587 6.812 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -5.278 19.234 9.328 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -4.413 17.901 8.589 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -4.094 21.630 8.119 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -4.966 21.630 6.568 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -5.827 21.228 8.072 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -3.042 18.956 10.368 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -2.272 19.168 8.778 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -3.150 20.522 9.528 1.00 0.00 H new ATOM 209 N ARG A 13 -4.994 19.603 4.273 1.00 0.00 N ATOM 210 CA ARG A 13 -5.146 20.343 2.990 1.00 0.00 C ATOM 211 C ARG A 13 -6.520 20.062 2.384 1.00 0.00 C ATOM 212 O ARG A 13 -7.204 20.962 1.940 1.00 0.00 O ATOM 213 CB ARG A 13 -4.055 19.880 2.020 1.00 0.00 C ATOM 214 CG ARG A 13 -4.124 20.697 0.728 1.00 0.00 C ATOM 215 CD ARG A 13 -3.033 20.220 -0.234 1.00 0.00 C ATOM 216 NE ARG A 13 -1.689 20.502 0.352 1.00 0.00 N ATOM 217 CZ ARG A 13 -1.137 21.676 0.199 1.00 0.00 C ATOM 218 NH1 ARG A 13 -1.766 22.615 -0.455 1.00 0.00 N ATOM 219 NH2 ARG A 13 0.045 21.910 0.702 1.00 0.00 N ATOM 0 H ARG A 13 -4.179 18.992 4.325 1.00 0.00 H new ATOM 0 HA ARG A 13 -5.054 21.414 3.173 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -3.074 19.995 2.481 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -4.180 18.820 1.797 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -5.105 20.586 0.266 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -3.993 21.757 0.947 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -3.142 19.152 -0.422 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -3.135 20.725 -1.195 1.00 0.00 H new ATOM 0 HE ARG A 13 -1.200 19.775 0.874 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -2.690 22.432 -0.847 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -1.334 23.531 -0.574 1.00 0.00 H new ATOM 0 HH21 ARG A 13 0.536 21.177 1.213 1.00 0.00 H new ATOM 0 HH22 ARG A 13 0.477 22.826 0.583 1.00 0.00 H new ATOM 233 N LEU A 14 -6.934 18.824 2.371 1.00 0.00 N ATOM 234 CA LEU A 14 -8.270 18.478 1.801 1.00 0.00 C ATOM 235 C LEU A 14 -9.253 18.238 2.952 1.00 0.00 C ATOM 236 O LEU A 14 -10.402 17.904 2.743 1.00 0.00 O ATOM 237 CB LEU A 14 -8.133 17.212 0.956 1.00 0.00 C ATOM 238 CG LEU A 14 -7.130 17.451 -0.184 1.00 0.00 C ATOM 239 CD1 LEU A 14 -6.947 16.151 -0.976 1.00 0.00 C ATOM 240 CD2 LEU A 14 -7.642 18.564 -1.120 1.00 0.00 C ATOM 0 H LEU A 14 -6.402 18.032 2.732 1.00 0.00 H new ATOM 0 HA LEU A 14 -8.640 19.290 1.176 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -7.798 16.383 1.579 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -9.103 16.931 0.546 1.00 0.00 H new ATOM 0 HG LEU A 14 -6.174 17.762 0.238 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -6.236 16.315 -1.786 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -6.569 15.372 -0.314 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -7.905 15.840 -1.392 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -6.923 18.724 -1.923 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -8.601 18.269 -1.545 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -7.765 19.487 -0.554 1.00 0.00 H new ATOM 252 N SER A 15 -8.802 18.417 4.169 1.00 0.00 N ATOM 253 CA SER A 15 -9.688 18.213 5.356 1.00 0.00 C ATOM 254 C SER A 15 -10.547 16.958 5.176 1.00 0.00 C ATOM 255 O SER A 15 -11.691 17.031 4.775 1.00 0.00 O ATOM 256 CB SER A 15 -10.588 19.435 5.534 1.00 0.00 C ATOM 257 OG SER A 15 -9.781 20.606 5.553 1.00 0.00 O ATOM 0 H SER A 15 -7.848 18.699 4.392 1.00 0.00 H new ATOM 0 HA SER A 15 -9.067 18.083 6.242 1.00 0.00 H new ATOM 0 HB2 SER A 15 -11.313 19.490 4.722 1.00 0.00 H new ATOM 0 HB3 SER A 15 -11.155 19.353 6.462 1.00 0.00 H new ATOM 0 HG SER A 15 -8.835 20.352 5.532 1.00 0.00 H new ATOM 263 N LEU A 16 -9.996 15.809 5.478 1.00 0.00 N ATOM 264 CA LEU A 16 -10.760 14.521 5.342 1.00 0.00 C ATOM 265 C LEU A 16 -11.150 14.002 6.725 1.00 0.00 C ATOM 266 O LEU A 16 -10.503 14.278 7.713 1.00 0.00 O ATOM 267 CB LEU A 16 -9.880 13.476 4.631 1.00 0.00 C ATOM 268 CG LEU A 16 -10.092 13.561 3.120 1.00 0.00 C ATOM 269 CD1 LEU A 16 -9.892 15.004 2.651 1.00 0.00 C ATOM 270 CD2 LEU A 16 -9.090 12.636 2.423 1.00 0.00 C ATOM 0 H LEU A 16 -9.040 15.703 5.817 1.00 0.00 H new ATOM 0 HA LEU A 16 -11.663 14.698 4.757 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -8.831 13.648 4.870 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -10.128 12.476 4.986 1.00 0.00 H new ATOM 0 HG LEU A 16 -11.106 13.250 2.870 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -10.044 15.061 1.573 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -10.610 15.653 3.153 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.880 15.328 2.892 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -9.234 12.690 1.344 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -8.075 12.947 2.670 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -9.247 11.611 2.759 1.00 0.00 H new ATOM 282 N THR A 17 -12.216 13.248 6.785 1.00 0.00 N ATOM 283 CA THR A 17 -12.694 12.686 8.087 1.00 0.00 C ATOM 284 C THR A 17 -12.522 11.168 8.090 1.00 0.00 C ATOM 285 O THR A 17 -12.691 10.509 7.084 1.00 0.00 O ATOM 286 CB THR A 17 -14.175 13.024 8.262 1.00 0.00 C ATOM 287 OG1 THR A 17 -14.903 12.552 7.137 1.00 0.00 O ATOM 288 CG2 THR A 17 -14.337 14.539 8.383 1.00 0.00 C ATOM 0 H THR A 17 -12.785 12.993 5.977 1.00 0.00 H new ATOM 0 HA THR A 17 -12.113 13.116 8.903 1.00 0.00 H new ATOM 0 HB THR A 17 -14.557 12.546 9.164 1.00 0.00 H new ATOM 0 HG1 THR A 17 -14.690 13.103 6.355 1.00 0.00 H new ATOM 0 HG21 THR A 17 -15.392 14.783 8.508 1.00 0.00 H new ATOM 0 HG22 THR A 17 -13.777 14.897 9.247 1.00 0.00 H new ATOM 0 HG23 THR A 17 -13.958 15.019 7.481 1.00 0.00 H new ATOM 296 N ALA A 18 -12.189 10.611 9.220 1.00 0.00 N ATOM 297 CA ALA A 18 -12.006 9.138 9.308 1.00 0.00 C ATOM 298 C ALA A 18 -13.336 8.438 9.032 1.00 0.00 C ATOM 299 O ALA A 18 -13.382 7.398 8.406 1.00 0.00 O ATOM 300 CB ALA A 18 -11.523 8.786 10.715 1.00 0.00 C ATOM 0 H ALA A 18 -12.035 11.117 10.092 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.273 8.811 8.571 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -11.385 7.708 10.793 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -10.576 9.288 10.911 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -12.264 9.111 11.446 1.00 0.00 H new ATOM 306 N LYS A 19 -14.424 8.996 9.490 1.00 0.00 N ATOM 307 CA LYS A 19 -15.742 8.361 9.249 1.00 0.00 C ATOM 308 C LYS A 19 -16.034 8.326 7.748 1.00 0.00 C ATOM 309 O LYS A 19 -16.487 7.331 7.218 1.00 0.00 O ATOM 310 CB LYS A 19 -16.821 9.179 9.955 1.00 0.00 C ATOM 311 CG LYS A 19 -16.661 9.047 11.471 1.00 0.00 C ATOM 312 CD LYS A 19 -17.833 9.746 12.171 1.00 0.00 C ATOM 313 CE LYS A 19 -17.856 11.239 11.817 1.00 0.00 C ATOM 314 NZ LYS A 19 -16.464 11.768 11.734 1.00 0.00 N ATOM 0 H LYS A 19 -14.452 9.866 10.021 1.00 0.00 H new ATOM 0 HA LYS A 19 -15.733 7.342 9.635 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -16.747 10.226 9.662 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -17.809 8.833 9.653 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -16.630 7.995 11.754 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -15.717 9.491 11.788 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -18.772 9.281 11.873 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -17.745 9.623 13.251 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -18.367 11.387 10.866 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -18.419 11.791 12.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -16.481 12.805 11.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -15.894 11.369 12.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -16.045 11.500 10.821 1.00 0.00 H new ATOM 328 N SER A 20 -15.782 9.405 7.057 1.00 0.00 N ATOM 329 CA SER A 20 -16.048 9.429 5.593 1.00 0.00 C ATOM 330 C SER A 20 -15.179 8.386 4.888 1.00 0.00 C ATOM 331 O SER A 20 -15.649 7.619 4.073 1.00 0.00 O ATOM 332 CB SER A 20 -15.708 10.818 5.051 1.00 0.00 C ATOM 333 OG SER A 20 -16.584 11.773 5.632 1.00 0.00 O ATOM 0 H SER A 20 -15.404 10.270 7.444 1.00 0.00 H new ATOM 0 HA SER A 20 -17.098 9.201 5.410 1.00 0.00 H new ATOM 0 HB2 SER A 20 -14.673 11.068 5.282 1.00 0.00 H new ATOM 0 HB3 SER A 20 -15.804 10.832 3.965 1.00 0.00 H new ATOM 0 HG SER A 20 -16.126 12.234 6.366 1.00 0.00 H new ATOM 339 N VAL A 21 -13.914 8.355 5.202 1.00 0.00 N ATOM 340 CA VAL A 21 -13.000 7.370 4.560 1.00 0.00 C ATOM 341 C VAL A 21 -13.338 5.955 5.039 1.00 0.00 C ATOM 342 O VAL A 21 -13.378 5.018 4.267 1.00 0.00 O ATOM 343 CB VAL A 21 -11.557 7.707 4.940 1.00 0.00 C ATOM 344 CG1 VAL A 21 -10.618 6.622 4.413 1.00 0.00 C ATOM 345 CG2 VAL A 21 -11.172 9.058 4.329 1.00 0.00 C ATOM 0 H VAL A 21 -13.471 8.974 5.881 1.00 0.00 H new ATOM 0 HA VAL A 21 -13.119 7.416 3.477 1.00 0.00 H new ATOM 0 HB VAL A 21 -11.472 7.760 6.025 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -9.591 6.866 4.686 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -10.891 5.661 4.849 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -10.701 6.564 3.328 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -10.144 9.300 4.599 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -11.259 9.005 3.244 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -11.838 9.832 4.709 1.00 0.00 H new ATOM 355 N ALA A 22 -13.567 5.796 6.313 1.00 0.00 N ATOM 356 CA ALA A 22 -13.883 4.448 6.861 1.00 0.00 C ATOM 357 C ALA A 22 -15.190 3.922 6.268 1.00 0.00 C ATOM 358 O ALA A 22 -15.314 2.753 5.967 1.00 0.00 O ATOM 359 CB ALA A 22 -14.019 4.550 8.381 1.00 0.00 C ATOM 0 H ALA A 22 -13.549 6.548 7.002 1.00 0.00 H new ATOM 0 HA ALA A 22 -13.080 3.759 6.600 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -14.251 3.568 8.792 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -13.082 4.910 8.807 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -14.821 5.245 8.629 1.00 0.00 H new ATOM 365 N GLU A 23 -16.170 4.764 6.106 1.00 0.00 N ATOM 366 CA GLU A 23 -17.461 4.288 5.542 1.00 0.00 C ATOM 367 C GLU A 23 -17.265 3.903 4.073 1.00 0.00 C ATOM 368 O GLU A 23 -17.798 2.918 3.604 1.00 0.00 O ATOM 369 CB GLU A 23 -18.504 5.402 5.666 1.00 0.00 C ATOM 370 CG GLU A 23 -19.887 4.867 5.286 1.00 0.00 C ATOM 371 CD GLU A 23 -20.953 5.876 5.721 1.00 0.00 C ATOM 372 OE1 GLU A 23 -20.593 7.015 5.966 1.00 0.00 O ATOM 373 OE2 GLU A 23 -22.107 5.493 5.801 1.00 0.00 O ATOM 0 H GLU A 23 -16.134 5.756 6.338 1.00 0.00 H new ATOM 0 HA GLU A 23 -17.807 3.412 6.091 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -18.520 5.784 6.687 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -18.237 6.236 5.017 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -19.943 4.701 4.210 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -20.063 3.904 5.766 1.00 0.00 H new ATOM 380 N GLU A 24 -16.502 4.673 3.343 1.00 0.00 N ATOM 381 CA GLU A 24 -16.271 4.354 1.905 1.00 0.00 C ATOM 382 C GLU A 24 -15.339 3.140 1.781 1.00 0.00 C ATOM 383 O GLU A 24 -15.558 2.255 0.978 1.00 0.00 O ATOM 384 CB GLU A 24 -15.627 5.571 1.223 1.00 0.00 C ATOM 385 CG GLU A 24 -15.891 5.522 -0.285 1.00 0.00 C ATOM 386 CD GLU A 24 -17.343 5.923 -0.567 1.00 0.00 C ATOM 387 OE1 GLU A 24 -17.912 6.637 0.243 1.00 0.00 O ATOM 388 OE2 GLU A 24 -17.863 5.504 -1.588 1.00 0.00 O ATOM 0 H GLU A 24 -16.028 5.510 3.682 1.00 0.00 H new ATOM 0 HA GLU A 24 -17.221 4.119 1.425 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -16.033 6.491 1.643 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -14.554 5.580 1.413 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -15.210 6.195 -0.806 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -15.700 4.518 -0.665 1.00 0.00 H new ATOM 395 N MET A 25 -14.300 3.104 2.568 1.00 0.00 N ATOM 396 CA MET A 25 -13.339 1.965 2.505 1.00 0.00 C ATOM 397 C MET A 25 -14.034 0.671 2.932 1.00 0.00 C ATOM 398 O MET A 25 -13.796 -0.381 2.373 1.00 0.00 O ATOM 399 CB MET A 25 -12.165 2.255 3.444 1.00 0.00 C ATOM 400 CG MET A 25 -11.227 3.282 2.799 1.00 0.00 C ATOM 401 SD MET A 25 -10.371 2.535 1.386 1.00 0.00 S ATOM 402 CE MET A 25 -9.072 1.660 2.302 1.00 0.00 C ATOM 0 H MET A 25 -14.073 3.820 3.258 1.00 0.00 H new ATOM 0 HA MET A 25 -12.976 1.848 1.484 1.00 0.00 H new ATOM 0 HB2 MET A 25 -12.534 2.634 4.397 1.00 0.00 H new ATOM 0 HB3 MET A 25 -11.621 1.335 3.656 1.00 0.00 H new ATOM 0 HG2 MET A 25 -11.796 4.152 2.472 1.00 0.00 H new ATOM 0 HG3 MET A 25 -10.500 3.634 3.531 1.00 0.00 H new ATOM 0 HE1 MET A 25 -8.127 2.191 2.189 1.00 0.00 H new ATOM 0 HE2 MET A 25 -9.339 1.614 3.358 1.00 0.00 H new ATOM 0 HE3 MET A 25 -8.969 0.648 1.910 1.00 0.00 H new ATOM 412 N GLY A 26 -14.882 0.733 3.928 1.00 0.00 N ATOM 413 CA GLY A 26 -15.584 -0.499 4.401 1.00 0.00 C ATOM 414 C GLY A 26 -14.852 -1.065 5.621 1.00 0.00 C ATOM 415 O GLY A 26 -14.957 -2.235 5.924 1.00 0.00 O ATOM 0 H GLY A 26 -15.119 1.586 4.435 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -16.617 -0.266 4.659 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -15.614 -1.242 3.604 1.00 0.00 H new ATOM 419 N ILE A 27 -14.108 -0.238 6.324 1.00 0.00 N ATOM 420 CA ILE A 27 -13.356 -0.716 7.535 1.00 0.00 C ATOM 421 C ILE A 27 -13.731 0.132 8.749 1.00 0.00 C ATOM 422 O ILE A 27 -14.279 1.208 8.627 1.00 0.00 O ATOM 423 CB ILE A 27 -11.848 -0.608 7.285 1.00 0.00 C ATOM 424 CG1 ILE A 27 -11.473 0.838 6.948 1.00 0.00 C ATOM 425 CG2 ILE A 27 -11.453 -1.521 6.124 1.00 0.00 C ATOM 426 CD1 ILE A 27 -9.954 0.950 6.824 1.00 0.00 C ATOM 0 H ILE A 27 -13.989 0.752 6.110 1.00 0.00 H new ATOM 0 HA ILE A 27 -13.619 -1.756 7.727 1.00 0.00 H new ATOM 0 HB ILE A 27 -11.317 -0.913 8.187 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -11.949 1.141 6.015 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -11.837 1.511 7.725 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -10.380 -1.442 5.948 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -11.706 -2.552 6.370 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -11.991 -1.220 5.225 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -9.683 1.978 6.584 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -9.490 0.663 7.768 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -9.604 0.288 6.032 1.00 0.00 H new ATOM 438 N SER A 28 -13.443 -0.353 9.922 1.00 0.00 N ATOM 439 CA SER A 28 -13.784 0.409 11.153 1.00 0.00 C ATOM 440 C SER A 28 -12.751 1.514 11.388 1.00 0.00 C ATOM 441 O SER A 28 -11.692 1.526 10.798 1.00 0.00 O ATOM 442 CB SER A 28 -13.776 -0.548 12.342 1.00 0.00 C ATOM 443 OG SER A 28 -12.451 -1.019 12.548 1.00 0.00 O ATOM 0 H SER A 28 -12.984 -1.249 10.082 1.00 0.00 H new ATOM 0 HA SER A 28 -14.769 0.861 11.039 1.00 0.00 H new ATOM 0 HB2 SER A 28 -14.138 -0.041 13.236 1.00 0.00 H new ATOM 0 HB3 SER A 28 -14.449 -1.385 12.156 1.00 0.00 H new ATOM 0 HG SER A 28 -12.437 -1.633 13.311 1.00 0.00 H new ATOM 449 N ARG A 29 -13.055 2.435 12.260 1.00 0.00 N ATOM 450 CA ARG A 29 -12.104 3.539 12.560 1.00 0.00 C ATOM 451 C ARG A 29 -10.834 2.947 13.175 1.00 0.00 C ATOM 452 O ARG A 29 -9.739 3.420 12.943 1.00 0.00 O ATOM 453 CB ARG A 29 -12.746 4.513 13.554 1.00 0.00 C ATOM 454 CG ARG A 29 -13.815 5.367 12.852 1.00 0.00 C ATOM 455 CD ARG A 29 -15.040 4.518 12.468 1.00 0.00 C ATOM 456 NE ARG A 29 -15.429 3.634 13.620 1.00 0.00 N ATOM 457 CZ ARG A 29 -16.660 3.611 14.096 1.00 0.00 C ATOM 458 NH1 ARG A 29 -17.614 4.342 13.572 1.00 0.00 N ATOM 459 NH2 ARG A 29 -16.939 2.832 15.107 1.00 0.00 N ATOM 0 H ARG A 29 -13.931 2.469 12.782 1.00 0.00 H new ATOM 0 HA ARG A 29 -11.857 4.073 11.642 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -13.197 3.958 14.377 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -11.981 5.159 13.986 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -14.124 6.180 13.509 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -13.390 5.823 11.958 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -15.873 5.167 12.198 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -14.813 3.910 11.592 1.00 0.00 H new ATOM 0 HE ARG A 29 -14.722 3.035 14.046 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -17.414 4.948 12.776 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -18.557 4.305 13.960 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -16.209 2.251 15.519 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -17.886 2.805 15.484 1.00 0.00 H new ATOM 473 N GLN A 30 -10.973 1.916 13.961 1.00 0.00 N ATOM 474 CA GLN A 30 -9.778 1.294 14.593 1.00 0.00 C ATOM 475 C GLN A 30 -8.776 0.900 13.509 1.00 0.00 C ATOM 476 O GLN A 30 -7.593 1.151 13.623 1.00 0.00 O ATOM 477 CB GLN A 30 -10.206 0.037 15.350 1.00 0.00 C ATOM 478 CG GLN A 30 -11.181 0.413 16.470 1.00 0.00 C ATOM 479 CD GLN A 30 -10.467 1.286 17.502 1.00 0.00 C ATOM 480 OE1 GLN A 30 -9.423 0.919 18.007 1.00 0.00 O ATOM 481 NE2 GLN A 30 -10.987 2.435 17.837 1.00 0.00 N ATOM 0 H GLN A 30 -11.864 1.477 14.193 1.00 0.00 H new ATOM 0 HA GLN A 30 -9.319 2.005 15.279 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -10.678 -0.668 14.666 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -9.332 -0.462 15.768 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -12.036 0.947 16.057 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -11.568 -0.488 16.946 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -11.862 2.742 17.413 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -10.518 3.026 18.523 1.00 0.00 H new ATOM 490 N GLN A 31 -9.241 0.289 12.456 1.00 0.00 N ATOM 491 CA GLN A 31 -8.319 -0.120 11.362 1.00 0.00 C ATOM 492 C GLN A 31 -7.706 1.128 10.734 1.00 0.00 C ATOM 493 O GLN A 31 -6.524 1.184 10.464 1.00 0.00 O ATOM 494 CB GLN A 31 -9.122 -0.888 10.308 1.00 0.00 C ATOM 495 CG GLN A 31 -8.199 -1.391 9.196 1.00 0.00 C ATOM 496 CD GLN A 31 -7.211 -2.405 9.770 1.00 0.00 C ATOM 497 OE1 GLN A 31 -7.464 -3.000 10.799 1.00 0.00 O ATOM 498 NE2 GLN A 31 -6.088 -2.628 9.146 1.00 0.00 N ATOM 0 H GLN A 31 -10.222 0.055 12.306 1.00 0.00 H new ATOM 0 HA GLN A 31 -7.523 -0.754 11.753 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -9.633 -1.730 10.774 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -9.892 -0.242 9.886 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -8.787 -1.851 8.402 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -7.660 -0.555 8.751 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -5.876 -2.128 8.282 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -5.421 -3.302 9.521 1.00 0.00 H new ATOM 507 N LEU A 32 -8.502 2.132 10.507 1.00 0.00 N ATOM 508 CA LEU A 32 -7.972 3.379 9.902 1.00 0.00 C ATOM 509 C LEU A 32 -6.951 4.003 10.860 1.00 0.00 C ATOM 510 O LEU A 32 -5.926 4.509 10.453 1.00 0.00 O ATOM 511 CB LEU A 32 -9.131 4.356 9.657 1.00 0.00 C ATOM 512 CG LEU A 32 -8.731 5.399 8.595 1.00 0.00 C ATOM 513 CD1 LEU A 32 -8.926 4.826 7.183 1.00 0.00 C ATOM 514 CD2 LEU A 32 -9.601 6.649 8.750 1.00 0.00 C ATOM 0 H LEU A 32 -9.500 2.141 10.716 1.00 0.00 H new ATOM 0 HA LEU A 32 -7.487 3.158 8.951 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -10.014 3.809 9.326 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -9.397 4.857 10.588 1.00 0.00 H new ATOM 0 HG LEU A 32 -7.681 5.655 8.737 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -8.639 5.574 6.444 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -8.304 3.939 7.061 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -9.973 4.558 7.041 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -9.317 7.386 7.998 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -10.649 6.381 8.618 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -9.457 7.071 9.744 1.00 0.00 H new ATOM 526 N CYS A 33 -7.234 3.965 12.131 1.00 0.00 N ATOM 527 CA CYS A 33 -6.298 4.550 13.132 1.00 0.00 C ATOM 528 C CYS A 33 -4.939 3.849 13.044 1.00 0.00 C ATOM 529 O CYS A 33 -3.902 4.458 13.221 1.00 0.00 O ATOM 530 CB CYS A 33 -6.898 4.364 14.538 1.00 0.00 C ATOM 531 SG CYS A 33 -6.468 5.782 15.578 1.00 0.00 S ATOM 0 H CYS A 33 -8.080 3.551 12.523 1.00 0.00 H new ATOM 0 HA CYS A 33 -6.155 5.612 12.931 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -7.981 4.265 14.471 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -6.521 3.445 14.986 1.00 0.00 H new ATOM 0 HG CYS A 33 -6.978 5.622 16.763 1.00 0.00 H new ATOM 537 N ASN A 34 -4.938 2.576 12.770 1.00 0.00 N ATOM 538 CA ASN A 34 -3.654 1.835 12.673 1.00 0.00 C ATOM 539 C ASN A 34 -2.818 2.426 11.534 1.00 0.00 C ATOM 540 O ASN A 34 -1.622 2.597 11.654 1.00 0.00 O ATOM 541 CB ASN A 34 -3.963 0.356 12.397 1.00 0.00 C ATOM 542 CG ASN A 34 -2.801 -0.527 12.860 1.00 0.00 C ATOM 543 OD1 ASN A 34 -2.102 -0.192 13.796 1.00 0.00 O ATOM 544 ND2 ASN A 34 -2.571 -1.654 12.244 1.00 0.00 N ATOM 0 H ASN A 34 -5.775 2.016 12.609 1.00 0.00 H new ATOM 0 HA ASN A 34 -3.091 1.920 13.603 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -4.877 0.066 12.915 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -4.139 0.207 11.332 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -1.804 -2.254 12.548 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -3.158 -1.935 11.458 1.00 0.00 H new ATOM 551 N ILE A 35 -3.440 2.748 10.432 1.00 0.00 N ATOM 552 CA ILE A 35 -2.676 3.334 9.293 1.00 0.00 C ATOM 553 C ILE A 35 -2.078 4.678 9.722 1.00 0.00 C ATOM 554 O ILE A 35 -0.928 4.966 9.461 1.00 0.00 O ATOM 555 CB ILE A 35 -3.623 3.542 8.109 1.00 0.00 C ATOM 556 CG1 ILE A 35 -4.069 2.179 7.575 1.00 0.00 C ATOM 557 CG2 ILE A 35 -2.903 4.314 6.999 1.00 0.00 C ATOM 558 CD1 ILE A 35 -5.229 2.369 6.596 1.00 0.00 C ATOM 0 H ILE A 35 -4.440 2.631 10.271 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.871 2.660 9.000 1.00 0.00 H new ATOM 0 HB ILE A 35 -4.493 4.112 8.436 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.237 1.682 7.077 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -4.377 1.536 8.400 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.581 4.460 6.158 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.583 5.284 7.379 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.032 3.748 6.669 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -5.547 1.398 6.216 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -6.063 2.849 7.109 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -4.905 2.996 5.765 1.00 0.00 H new ATOM 570 N GLU A 36 -2.845 5.496 10.388 1.00 0.00 N ATOM 571 CA GLU A 36 -2.317 6.814 10.844 1.00 0.00 C ATOM 572 C GLU A 36 -1.287 6.570 11.948 1.00 0.00 C ATOM 573 O GLU A 36 -0.540 7.448 12.330 1.00 0.00 O ATOM 574 CB GLU A 36 -3.473 7.657 11.398 1.00 0.00 C ATOM 575 CG GLU A 36 -2.983 9.070 11.745 1.00 0.00 C ATOM 576 CD GLU A 36 -4.125 9.868 12.374 1.00 0.00 C ATOM 577 OE1 GLU A 36 -5.267 9.502 12.157 1.00 0.00 O ATOM 578 OE2 GLU A 36 -3.837 10.835 13.059 1.00 0.00 O ATOM 0 H GLU A 36 -3.816 5.309 10.637 1.00 0.00 H new ATOM 0 HA GLU A 36 -1.852 7.343 10.012 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -4.276 7.713 10.663 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.887 7.180 12.286 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.141 9.015 12.435 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -2.626 9.573 10.846 1.00 0.00 H new ATOM 585 N GLN A 37 -1.238 5.380 12.468 1.00 0.00 N ATOM 586 CA GLN A 37 -0.268 5.089 13.555 1.00 0.00 C ATOM 587 C GLN A 37 1.148 5.040 12.973 1.00 0.00 C ATOM 588 O GLN A 37 1.971 4.239 13.369 1.00 0.00 O ATOM 589 CB GLN A 37 -0.625 3.739 14.196 1.00 0.00 C ATOM 590 CG GLN A 37 -0.001 3.648 15.590 1.00 0.00 C ATOM 591 CD GLN A 37 -0.394 2.324 16.247 1.00 0.00 C ATOM 592 OE1 GLN A 37 -1.078 1.514 15.652 1.00 0.00 O ATOM 593 NE2 GLN A 37 0.011 2.070 17.462 1.00 0.00 N ATOM 0 H GLN A 37 -1.827 4.596 12.188 1.00 0.00 H new ATOM 0 HA GLN A 37 -0.311 5.870 14.314 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -1.708 3.633 14.264 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -0.264 2.922 13.571 1.00 0.00 H new ATOM 0 HG2 GLN A 37 1.084 3.721 15.518 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -0.337 4.483 16.204 1.00 0.00 H new ATOM 0 HE21 GLN A 37 0.585 2.750 17.961 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -0.246 1.192 17.912 1.00 0.00 H new ATOM 602 N SER A 38 1.436 5.909 12.040 1.00 0.00 N ATOM 603 CA SER A 38 2.798 5.949 11.427 1.00 0.00 C ATOM 604 C SER A 38 3.252 4.544 11.011 1.00 0.00 C ATOM 605 O SER A 38 2.798 4.011 10.018 1.00 0.00 O ATOM 606 CB SER A 38 3.786 6.519 12.443 1.00 0.00 C ATOM 607 OG SER A 38 5.080 6.563 11.860 1.00 0.00 O ATOM 0 H SER A 38 0.781 6.599 11.673 1.00 0.00 H new ATOM 0 HA SER A 38 2.764 6.579 10.538 1.00 0.00 H new ATOM 0 HB2 SER A 38 3.477 7.519 12.748 1.00 0.00 H new ATOM 0 HB3 SER A 38 3.799 5.902 13.341 1.00 0.00 H new ATOM 0 HG SER A 38 5.718 6.930 12.507 1.00 0.00 H new ATOM 613 N GLU A 39 4.157 3.960 11.757 1.00 0.00 N ATOM 614 CA GLU A 39 4.675 2.601 11.422 1.00 0.00 C ATOM 615 C GLU A 39 5.309 2.609 10.031 1.00 0.00 C ATOM 616 O GLU A 39 4.856 3.276 9.124 1.00 0.00 O ATOM 617 CB GLU A 39 3.548 1.554 11.503 1.00 0.00 C ATOM 618 CG GLU A 39 3.261 1.228 12.978 1.00 0.00 C ATOM 619 CD GLU A 39 4.462 0.484 13.571 1.00 0.00 C ATOM 620 OE1 GLU A 39 5.225 -0.075 12.801 1.00 0.00 O ATOM 621 OE2 GLU A 39 4.603 0.499 14.783 1.00 0.00 O ATOM 0 H GLU A 39 4.563 4.375 12.595 1.00 0.00 H new ATOM 0 HA GLU A 39 5.439 2.329 12.150 1.00 0.00 H new ATOM 0 HB2 GLU A 39 2.647 1.934 11.021 1.00 0.00 H new ATOM 0 HB3 GLU A 39 3.838 0.649 10.969 1.00 0.00 H new ATOM 0 HG2 GLU A 39 3.074 2.145 13.536 1.00 0.00 H new ATOM 0 HG3 GLU A 39 2.362 0.617 13.060 1.00 0.00 H new ATOM 628 N THR A 40 6.377 1.877 9.876 1.00 0.00 N ATOM 629 CA THR A 40 7.088 1.835 8.570 1.00 0.00 C ATOM 630 C THR A 40 6.170 1.259 7.491 1.00 0.00 C ATOM 631 O THR A 40 5.426 0.329 7.720 1.00 0.00 O ATOM 632 CB THR A 40 8.330 0.957 8.715 1.00 0.00 C ATOM 633 OG1 THR A 40 7.973 -0.270 9.340 1.00 0.00 O ATOM 634 CG2 THR A 40 9.356 1.690 9.579 1.00 0.00 C ATOM 0 H THR A 40 6.791 1.300 10.608 1.00 0.00 H new ATOM 0 HA THR A 40 7.378 2.844 8.278 1.00 0.00 H new ATOM 0 HB THR A 40 8.754 0.750 7.732 1.00 0.00 H new ATOM 0 HG1 THR A 40 8.769 -0.834 9.432 1.00 0.00 H new ATOM 0 HG21 THR A 40 10.247 1.072 9.689 1.00 0.00 H new ATOM 0 HG22 THR A 40 9.625 2.633 9.103 1.00 0.00 H new ATOM 0 HG23 THR A 40 8.929 1.889 10.562 1.00 0.00 H new ATOM 642 N ALA A 41 6.211 1.826 6.319 1.00 0.00 N ATOM 643 CA ALA A 41 5.334 1.342 5.217 1.00 0.00 C ATOM 644 C ALA A 41 5.831 -0.028 4.709 1.00 0.00 C ATOM 645 O ALA A 41 7.003 -0.336 4.792 1.00 0.00 O ATOM 646 CB ALA A 41 5.380 2.364 4.077 1.00 0.00 C ATOM 0 H ALA A 41 6.818 2.609 6.075 1.00 0.00 H new ATOM 0 HA ALA A 41 4.312 1.228 5.579 1.00 0.00 H new ATOM 0 HB1 ALA A 41 4.743 2.026 3.260 1.00 0.00 H new ATOM 0 HB2 ALA A 41 5.025 3.329 4.439 1.00 0.00 H new ATOM 0 HB3 ALA A 41 6.405 2.465 3.720 1.00 0.00 H new ATOM 652 N PRO A 42 4.940 -0.840 4.181 1.00 0.00 N ATOM 653 CA PRO A 42 5.288 -2.198 3.642 1.00 0.00 C ATOM 654 C PRO A 42 6.208 -2.143 2.407 1.00 0.00 C ATOM 655 O PRO A 42 6.236 -1.174 1.677 1.00 0.00 O ATOM 656 CB PRO A 42 3.920 -2.818 3.286 1.00 0.00 C ATOM 657 CG PRO A 42 2.984 -1.657 3.129 1.00 0.00 C ATOM 658 CD PRO A 42 3.498 -0.557 4.052 1.00 0.00 C ATOM 0 HA PRO A 42 5.852 -2.780 4.371 1.00 0.00 H new ATOM 0 HB2 PRO A 42 3.980 -3.401 2.367 1.00 0.00 H new ATOM 0 HB3 PRO A 42 3.579 -3.494 4.070 1.00 0.00 H new ATOM 0 HG2 PRO A 42 2.960 -1.315 2.094 1.00 0.00 H new ATOM 0 HG3 PRO A 42 1.966 -1.941 3.394 1.00 0.00 H new ATOM 0 HD2 PRO A 42 3.322 0.432 3.630 1.00 0.00 H new ATOM 0 HD3 PRO A 42 2.998 -0.583 5.020 1.00 0.00 H new ATOM 666 N VAL A 43 6.957 -3.193 2.179 1.00 0.00 N ATOM 667 CA VAL A 43 7.884 -3.239 1.009 1.00 0.00 C ATOM 668 C VAL A 43 7.085 -3.199 -0.299 1.00 0.00 C ATOM 669 O VAL A 43 7.595 -2.816 -1.332 1.00 0.00 O ATOM 670 CB VAL A 43 8.699 -4.537 1.066 1.00 0.00 C ATOM 671 CG1 VAL A 43 9.608 -4.523 2.297 1.00 0.00 C ATOM 672 CG2 VAL A 43 7.745 -5.727 1.164 1.00 0.00 C ATOM 0 H VAL A 43 6.965 -4.030 2.762 1.00 0.00 H new ATOM 0 HA VAL A 43 8.550 -2.377 1.044 1.00 0.00 H new ATOM 0 HB VAL A 43 9.307 -4.620 0.165 1.00 0.00 H new ATOM 0 HG11 VAL A 43 10.185 -5.447 2.334 1.00 0.00 H new ATOM 0 HG12 VAL A 43 10.288 -3.673 2.238 1.00 0.00 H new ATOM 0 HG13 VAL A 43 9.000 -4.439 3.198 1.00 0.00 H new ATOM 0 HG21 VAL A 43 8.320 -6.652 1.205 1.00 0.00 H new ATOM 0 HG22 VAL A 43 7.141 -5.635 2.066 1.00 0.00 H new ATOM 0 HG23 VAL A 43 7.093 -5.743 0.291 1.00 0.00 H new ATOM 682 N VAL A 44 5.841 -3.596 -0.272 1.00 0.00 N ATOM 683 CA VAL A 44 5.034 -3.580 -1.526 1.00 0.00 C ATOM 684 C VAL A 44 4.995 -2.148 -2.076 1.00 0.00 C ATOM 685 O VAL A 44 5.098 -1.927 -3.264 1.00 0.00 O ATOM 686 CB VAL A 44 3.609 -4.069 -1.222 1.00 0.00 C ATOM 687 CG1 VAL A 44 3.680 -5.311 -0.332 1.00 0.00 C ATOM 688 CG2 VAL A 44 2.822 -2.974 -0.495 1.00 0.00 C ATOM 0 H VAL A 44 5.351 -3.929 0.559 1.00 0.00 H new ATOM 0 HA VAL A 44 5.483 -4.240 -2.268 1.00 0.00 H new ATOM 0 HB VAL A 44 3.107 -4.310 -2.159 1.00 0.00 H new ATOM 0 HG11 VAL A 44 2.671 -5.661 -0.114 1.00 0.00 H new ATOM 0 HG12 VAL A 44 4.233 -6.097 -0.847 1.00 0.00 H new ATOM 0 HG13 VAL A 44 4.187 -5.062 0.600 1.00 0.00 H new ATOM 0 HG21 VAL A 44 1.814 -3.330 -0.284 1.00 0.00 H new ATOM 0 HG22 VAL A 44 3.323 -2.726 0.441 1.00 0.00 H new ATOM 0 HG23 VAL A 44 2.769 -2.085 -1.124 1.00 0.00 H new ATOM 698 N VAL A 45 4.856 -1.177 -1.212 1.00 0.00 N ATOM 699 CA VAL A 45 4.819 0.237 -1.676 1.00 0.00 C ATOM 700 C VAL A 45 6.158 0.588 -2.329 1.00 0.00 C ATOM 701 O VAL A 45 6.209 1.203 -3.376 1.00 0.00 O ATOM 702 CB VAL A 45 4.565 1.152 -0.472 1.00 0.00 C ATOM 703 CG1 VAL A 45 4.797 2.610 -0.870 1.00 0.00 C ATOM 704 CG2 VAL A 45 3.120 0.982 0.001 1.00 0.00 C ATOM 0 H VAL A 45 4.767 -1.305 -0.204 1.00 0.00 H new ATOM 0 HA VAL A 45 4.020 0.372 -2.405 1.00 0.00 H new ATOM 0 HB VAL A 45 5.250 0.884 0.332 1.00 0.00 H new ATOM 0 HG11 VAL A 45 4.615 3.255 -0.011 1.00 0.00 H new ATOM 0 HG12 VAL A 45 5.826 2.736 -1.207 1.00 0.00 H new ATOM 0 HG13 VAL A 45 4.116 2.880 -1.677 1.00 0.00 H new ATOM 0 HG21 VAL A 45 2.938 1.632 0.857 1.00 0.00 H new ATOM 0 HG22 VAL A 45 2.439 1.248 -0.807 1.00 0.00 H new ATOM 0 HG23 VAL A 45 2.952 -0.055 0.291 1.00 0.00 H new ATOM 714 N LYS A 46 7.239 0.200 -1.718 1.00 0.00 N ATOM 715 CA LYS A 46 8.577 0.503 -2.292 1.00 0.00 C ATOM 716 C LYS A 46 8.692 -0.174 -3.659 1.00 0.00 C ATOM 717 O LYS A 46 9.193 0.395 -4.608 1.00 0.00 O ATOM 718 CB LYS A 46 9.653 -0.055 -1.355 1.00 0.00 C ATOM 719 CG LYS A 46 9.464 0.486 0.074 1.00 0.00 C ATOM 720 CD LYS A 46 9.810 1.976 0.143 1.00 0.00 C ATOM 721 CE LYS A 46 9.714 2.456 1.592 1.00 0.00 C ATOM 722 NZ LYS A 46 10.098 3.893 1.654 1.00 0.00 N ATOM 0 H LYS A 46 7.254 -0.318 -0.839 1.00 0.00 H new ATOM 0 HA LYS A 46 8.707 1.580 -2.403 1.00 0.00 H new ATOM 0 HB2 LYS A 46 9.605 -1.144 -1.346 1.00 0.00 H new ATOM 0 HB3 LYS A 46 10.641 0.218 -1.725 1.00 0.00 H new ATOM 0 HG2 LYS A 46 8.433 0.333 0.392 1.00 0.00 H new ATOM 0 HG3 LYS A 46 10.097 -0.071 0.765 1.00 0.00 H new ATOM 0 HD2 LYS A 46 10.816 2.145 -0.241 1.00 0.00 H new ATOM 0 HD3 LYS A 46 9.128 2.548 -0.487 1.00 0.00 H new ATOM 0 HE2 LYS A 46 8.699 2.321 1.967 1.00 0.00 H new ATOM 0 HE3 LYS A 46 10.370 1.863 2.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 10.035 4.227 2.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 11.073 4.007 1.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 9.454 4.450 1.057 1.00 0.00 H new ATOM 736 N TYR A 47 8.216 -1.381 -3.768 1.00 0.00 N ATOM 737 CA TYR A 47 8.275 -2.098 -5.068 1.00 0.00 C ATOM 738 C TYR A 47 7.498 -1.292 -6.112 1.00 0.00 C ATOM 739 O TYR A 47 7.947 -1.089 -7.227 1.00 0.00 O ATOM 740 CB TYR A 47 7.650 -3.482 -4.885 1.00 0.00 C ATOM 741 CG TYR A 47 7.510 -4.166 -6.224 1.00 0.00 C ATOM 742 CD1 TYR A 47 8.650 -4.441 -6.987 1.00 0.00 C ATOM 743 CD2 TYR A 47 6.243 -4.520 -6.703 1.00 0.00 C ATOM 744 CE1 TYR A 47 8.523 -5.074 -8.230 1.00 0.00 C ATOM 745 CE2 TYR A 47 6.115 -5.151 -7.943 1.00 0.00 C ATOM 746 CZ TYR A 47 7.255 -5.428 -8.708 1.00 0.00 C ATOM 747 OH TYR A 47 7.129 -6.050 -9.932 1.00 0.00 O ATOM 0 H TYR A 47 7.786 -1.905 -3.006 1.00 0.00 H new ATOM 0 HA TYR A 47 9.305 -2.210 -5.405 1.00 0.00 H new ATOM 0 HB2 TYR A 47 8.270 -4.085 -4.222 1.00 0.00 H new ATOM 0 HB3 TYR A 47 6.673 -3.389 -4.411 1.00 0.00 H new ATOM 0 HD1 TYR A 47 9.627 -4.165 -6.618 1.00 0.00 H new ATOM 0 HD2 TYR A 47 5.364 -4.305 -6.114 1.00 0.00 H new ATOM 0 HE1 TYR A 47 9.402 -5.289 -8.819 1.00 0.00 H new ATOM 0 HE2 TYR A 47 5.137 -5.425 -8.311 1.00 0.00 H new ATOM 0 HH TYR A 47 6.182 -6.228 -10.113 1.00 0.00 H new ATOM 757 N ILE A 48 6.343 -0.812 -5.747 1.00 0.00 N ATOM 758 CA ILE A 48 5.532 -0.001 -6.691 1.00 0.00 C ATOM 759 C ILE A 48 6.305 1.271 -7.048 1.00 0.00 C ATOM 760 O ILE A 48 6.352 1.682 -8.190 1.00 0.00 O ATOM 761 CB ILE A 48 4.204 0.369 -6.027 1.00 0.00 C ATOM 762 CG1 ILE A 48 3.357 -0.897 -5.845 1.00 0.00 C ATOM 763 CG2 ILE A 48 3.452 1.371 -6.907 1.00 0.00 C ATOM 764 CD1 ILE A 48 2.143 -0.582 -4.969 1.00 0.00 C ATOM 0 H ILE A 48 5.924 -0.949 -4.827 1.00 0.00 H new ATOM 0 HA ILE A 48 5.333 -0.572 -7.598 1.00 0.00 H new ATOM 0 HB ILE A 48 4.396 0.820 -5.054 1.00 0.00 H new ATOM 0 HG12 ILE A 48 3.030 -1.271 -6.815 1.00 0.00 H new ATOM 0 HG13 ILE A 48 3.955 -1.684 -5.385 1.00 0.00 H new ATOM 0 HG21 ILE A 48 2.506 1.634 -6.433 1.00 0.00 H new ATOM 0 HG22 ILE A 48 4.056 2.269 -7.034 1.00 0.00 H new ATOM 0 HG23 ILE A 48 3.257 0.924 -7.882 1.00 0.00 H new ATOM 0 HD11 ILE A 48 1.543 -1.483 -4.841 1.00 0.00 H new ATOM 0 HD12 ILE A 48 2.479 -0.229 -3.994 1.00 0.00 H new ATOM 0 HD13 ILE A 48 1.540 0.191 -5.447 1.00 0.00 H new ATOM 776 N ALA A 49 6.913 1.897 -6.079 1.00 0.00 N ATOM 777 CA ALA A 49 7.681 3.139 -6.362 1.00 0.00 C ATOM 778 C ALA A 49 8.724 2.861 -7.442 1.00 0.00 C ATOM 779 O ALA A 49 8.988 3.688 -8.290 1.00 0.00 O ATOM 780 CB ALA A 49 8.389 3.593 -5.085 1.00 0.00 C ATOM 0 H ALA A 49 6.911 1.601 -5.103 1.00 0.00 H new ATOM 0 HA ALA A 49 7.000 3.918 -6.706 1.00 0.00 H new ATOM 0 HB1 ALA A 49 8.954 4.503 -5.286 1.00 0.00 H new ATOM 0 HB2 ALA A 49 7.649 3.789 -4.309 1.00 0.00 H new ATOM 0 HB3 ALA A 49 9.069 2.811 -4.748 1.00 0.00 H new ATOM 786 N PHE A 50 9.326 1.703 -7.415 1.00 0.00 N ATOM 787 CA PHE A 50 10.354 1.378 -8.439 1.00 0.00 C ATOM 788 C PHE A 50 9.697 1.382 -9.823 1.00 0.00 C ATOM 789 O PHE A 50 10.213 1.947 -10.766 1.00 0.00 O ATOM 790 CB PHE A 50 10.956 -0.005 -8.131 1.00 0.00 C ATOM 791 CG PHE A 50 12.365 -0.083 -8.672 1.00 0.00 C ATOM 792 CD1 PHE A 50 13.383 0.630 -8.029 1.00 0.00 C ATOM 793 CD2 PHE A 50 12.658 -0.857 -9.803 1.00 0.00 C ATOM 794 CE1 PHE A 50 14.693 0.572 -8.512 1.00 0.00 C ATOM 795 CE2 PHE A 50 13.972 -0.915 -10.287 1.00 0.00 C ATOM 796 CZ PHE A 50 14.989 -0.200 -9.640 1.00 0.00 C ATOM 0 H PHE A 50 9.149 0.970 -6.728 1.00 0.00 H new ATOM 0 HA PHE A 50 11.153 2.120 -8.423 1.00 0.00 H new ATOM 0 HB2 PHE A 50 10.960 -0.178 -7.055 1.00 0.00 H new ATOM 0 HB3 PHE A 50 10.342 -0.787 -8.578 1.00 0.00 H new ATOM 0 HD1 PHE A 50 13.156 1.226 -7.158 1.00 0.00 H new ATOM 0 HD2 PHE A 50 11.873 -1.407 -10.300 1.00 0.00 H new ATOM 0 HE1 PHE A 50 15.477 1.123 -8.014 1.00 0.00 H new ATOM 0 HE2 PHE A 50 14.201 -1.511 -11.158 1.00 0.00 H new ATOM 0 HZ PHE A 50 16.002 -0.245 -10.013 1.00 0.00 H new ATOM 806 N LEU A 51 8.551 0.763 -9.947 1.00 0.00 N ATOM 807 CA LEU A 51 7.852 0.738 -11.266 1.00 0.00 C ATOM 808 C LEU A 51 7.511 2.169 -11.684 1.00 0.00 C ATOM 809 O LEU A 51 7.573 2.519 -12.848 1.00 0.00 O ATOM 810 CB LEU A 51 6.566 -0.083 -11.152 1.00 0.00 C ATOM 811 CG LEU A 51 6.877 -1.466 -10.576 1.00 0.00 C ATOM 812 CD1 LEU A 51 5.578 -2.269 -10.469 1.00 0.00 C ATOM 813 CD2 LEU A 51 7.869 -2.207 -11.490 1.00 0.00 C ATOM 0 H LEU A 51 8.070 0.274 -9.192 1.00 0.00 H new ATOM 0 HA LEU A 51 8.502 0.284 -12.014 1.00 0.00 H new ATOM 0 HB2 LEU A 51 5.850 0.434 -10.512 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.102 -0.185 -12.133 1.00 0.00 H new ATOM 0 HG LEU A 51 7.324 -1.354 -9.588 1.00 0.00 H new ATOM 0 HD11 LEU A 51 5.793 -3.256 -10.059 1.00 0.00 H new ATOM 0 HD12 LEU A 51 4.881 -1.748 -9.813 1.00 0.00 H new ATOM 0 HD13 LEU A 51 5.134 -2.376 -11.459 1.00 0.00 H new ATOM 0 HD21 LEU A 51 8.084 -3.190 -11.072 1.00 0.00 H new ATOM 0 HD22 LEU A 51 7.433 -2.322 -12.482 1.00 0.00 H new ATOM 0 HD23 LEU A 51 8.793 -1.634 -11.564 1.00 0.00 H new ATOM 825 N ARG A 52 7.156 3.000 -10.746 1.00 0.00 N ATOM 826 CA ARG A 52 6.821 4.407 -11.086 1.00 0.00 C ATOM 827 C ARG A 52 8.046 5.050 -11.734 1.00 0.00 C ATOM 828 O ARG A 52 7.942 5.791 -12.688 1.00 0.00 O ATOM 829 CB ARG A 52 6.454 5.165 -9.805 1.00 0.00 C ATOM 830 CG ARG A 52 5.958 6.585 -10.142 1.00 0.00 C ATOM 831 CD ARG A 52 4.451 6.566 -10.438 1.00 0.00 C ATOM 832 NE ARG A 52 4.053 7.867 -11.052 1.00 0.00 N ATOM 833 CZ ARG A 52 3.746 8.887 -10.297 1.00 0.00 C ATOM 834 NH1 ARG A 52 3.805 8.783 -8.996 1.00 0.00 N ATOM 835 NH2 ARG A 52 3.389 10.015 -10.847 1.00 0.00 N ATOM 0 H ARG A 52 7.084 2.764 -9.756 1.00 0.00 H new ATOM 0 HA ARG A 52 5.975 4.441 -11.773 1.00 0.00 H new ATOM 0 HB2 ARG A 52 5.680 4.622 -9.263 1.00 0.00 H new ATOM 0 HB3 ARG A 52 7.322 5.223 -9.148 1.00 0.00 H new ATOM 0 HG2 ARG A 52 6.164 7.257 -9.309 1.00 0.00 H new ATOM 0 HG3 ARG A 52 6.500 6.972 -11.005 1.00 0.00 H new ATOM 0 HD2 ARG A 52 4.211 5.744 -11.112 1.00 0.00 H new ATOM 0 HD3 ARG A 52 3.890 6.398 -9.519 1.00 0.00 H new ATOM 0 HE ARG A 52 4.021 7.960 -12.067 1.00 0.00 H new ATOM 0 HH11 ARG A 52 4.092 7.903 -8.567 1.00 0.00 H new ATOM 0 HH12 ARG A 52 3.565 9.582 -8.409 1.00 0.00 H new ATOM 0 HH21 ARG A 52 3.351 10.097 -11.863 1.00 0.00 H new ATOM 0 HH22 ARG A 52 3.148 10.814 -10.261 1.00 0.00 H new ATOM 849 N SER A 53 9.209 4.767 -11.220 1.00 0.00 N ATOM 850 CA SER A 53 10.445 5.351 -11.801 1.00 0.00 C ATOM 851 C SER A 53 10.515 5.020 -13.292 1.00 0.00 C ATOM 852 O SER A 53 11.063 5.766 -14.078 1.00 0.00 O ATOM 853 CB SER A 53 11.661 4.760 -11.093 1.00 0.00 C ATOM 854 OG SER A 53 11.506 4.925 -9.690 1.00 0.00 O ATOM 0 H SER A 53 9.356 4.153 -10.419 1.00 0.00 H new ATOM 0 HA SER A 53 10.434 6.433 -11.671 1.00 0.00 H new ATOM 0 HB2 SER A 53 11.763 3.703 -11.339 1.00 0.00 H new ATOM 0 HB3 SER A 53 12.571 5.255 -11.432 1.00 0.00 H new ATOM 0 HG SER A 53 12.283 4.546 -9.228 1.00 0.00 H new ATOM 860 N LYS A 54 9.968 3.902 -13.687 1.00 0.00 N ATOM 861 CA LYS A 54 10.010 3.519 -15.125 1.00 0.00 C ATOM 862 C LYS A 54 8.864 4.224 -15.864 1.00 0.00 C ATOM 863 O LYS A 54 8.673 4.041 -17.049 1.00 0.00 O ATOM 864 CB LYS A 54 9.855 1.993 -15.237 1.00 0.00 C ATOM 865 CG LYS A 54 11.219 1.305 -15.060 1.00 0.00 C ATOM 866 CD LYS A 54 11.764 1.578 -13.656 1.00 0.00 C ATOM 867 CE LYS A 54 13.054 0.784 -13.440 1.00 0.00 C ATOM 868 NZ LYS A 54 13.590 1.073 -12.080 1.00 0.00 N ATOM 0 H LYS A 54 9.494 3.238 -13.075 1.00 0.00 H new ATOM 0 HA LYS A 54 10.959 3.818 -15.571 1.00 0.00 H new ATOM 0 HB2 LYS A 54 9.158 1.635 -14.479 1.00 0.00 H new ATOM 0 HB3 LYS A 54 9.432 1.734 -16.208 1.00 0.00 H new ATOM 0 HG2 LYS A 54 11.117 0.231 -15.217 1.00 0.00 H new ATOM 0 HG3 LYS A 54 11.921 1.672 -15.809 1.00 0.00 H new ATOM 0 HD2 LYS A 54 11.956 2.644 -13.531 1.00 0.00 H new ATOM 0 HD3 LYS A 54 11.023 1.298 -12.907 1.00 0.00 H new ATOM 0 HE2 LYS A 54 12.860 -0.283 -13.547 1.00 0.00 H new ATOM 0 HE3 LYS A 54 13.790 1.052 -14.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 14.605 1.290 -12.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 13.087 1.888 -11.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 13.452 0.243 -11.469 1.00 0.00 H new ATOM 882 N GLY A 55 8.112 5.041 -15.173 1.00 0.00 N ATOM 883 CA GLY A 55 6.993 5.773 -15.835 1.00 0.00 C ATOM 884 C GLY A 55 5.776 4.858 -16.007 1.00 0.00 C ATOM 885 O GLY A 55 4.959 5.072 -16.879 1.00 0.00 O ATOM 0 H GLY A 55 8.225 5.233 -14.178 1.00 0.00 H new ATOM 0 HA2 GLY A 55 6.719 6.644 -15.240 1.00 0.00 H new ATOM 0 HA3 GLY A 55 7.318 6.142 -16.808 1.00 0.00 H new ATOM 889 N VAL A 56 5.639 3.844 -15.198 1.00 0.00 N ATOM 890 CA VAL A 56 4.464 2.936 -15.353 1.00 0.00 C ATOM 891 C VAL A 56 3.176 3.691 -15.015 1.00 0.00 C ATOM 892 O VAL A 56 3.103 4.417 -14.046 1.00 0.00 O ATOM 893 CB VAL A 56 4.630 1.724 -14.432 1.00 0.00 C ATOM 894 CG1 VAL A 56 3.342 0.894 -14.422 1.00 0.00 C ATOM 895 CG2 VAL A 56 5.787 0.863 -14.950 1.00 0.00 C ATOM 0 H VAL A 56 6.282 3.605 -14.443 1.00 0.00 H new ATOM 0 HA VAL A 56 4.404 2.591 -16.385 1.00 0.00 H new ATOM 0 HB VAL A 56 4.841 2.063 -13.418 1.00 0.00 H new ATOM 0 HG11 VAL A 56 3.469 0.034 -13.765 1.00 0.00 H new ATOM 0 HG12 VAL A 56 2.516 1.508 -14.062 1.00 0.00 H new ATOM 0 HG13 VAL A 56 3.124 0.549 -15.433 1.00 0.00 H new ATOM 0 HG21 VAL A 56 5.914 -0.004 -14.301 1.00 0.00 H new ATOM 0 HG22 VAL A 56 5.566 0.528 -15.964 1.00 0.00 H new ATOM 0 HG23 VAL A 56 6.705 1.451 -14.954 1.00 0.00 H new ATOM 905 N ASP A 57 2.157 3.533 -15.821 1.00 0.00 N ATOM 906 CA ASP A 57 0.876 4.252 -15.561 1.00 0.00 C ATOM 907 C ASP A 57 0.109 3.566 -14.427 1.00 0.00 C ATOM 908 O ASP A 57 -0.649 2.641 -14.640 1.00 0.00 O ATOM 909 CB ASP A 57 0.026 4.249 -16.834 1.00 0.00 C ATOM 910 CG ASP A 57 0.095 2.870 -17.492 1.00 0.00 C ATOM 911 OD1 ASP A 57 -0.175 1.896 -16.812 1.00 0.00 O ATOM 912 OD2 ASP A 57 0.423 2.813 -18.666 1.00 0.00 O ATOM 0 H ASP A 57 2.158 2.936 -16.648 1.00 0.00 H new ATOM 0 HA ASP A 57 1.094 5.279 -15.268 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -1.008 4.498 -16.594 1.00 0.00 H new ATOM 0 HB3 ASP A 57 0.385 5.012 -17.525 1.00 0.00 H new ATOM 917 N LEU A 58 0.293 4.027 -13.222 1.00 0.00 N ATOM 918 CA LEU A 58 -0.424 3.425 -12.062 1.00 0.00 C ATOM 919 C LEU A 58 -1.803 4.081 -11.945 1.00 0.00 C ATOM 920 O LEU A 58 -2.666 3.622 -11.224 1.00 0.00 O ATOM 921 CB LEU A 58 0.384 3.697 -10.781 1.00 0.00 C ATOM 922 CG LEU A 58 -0.020 2.710 -9.667 1.00 0.00 C ATOM 923 CD1 LEU A 58 0.794 1.416 -9.796 1.00 0.00 C ATOM 924 CD2 LEU A 58 0.246 3.338 -8.292 1.00 0.00 C ATOM 0 H LEU A 58 0.914 4.801 -12.988 1.00 0.00 H new ATOM 0 HA LEU A 58 -0.537 2.350 -12.201 1.00 0.00 H new ATOM 0 HB2 LEU A 58 1.450 3.603 -10.989 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.214 4.721 -10.447 1.00 0.00 H new ATOM 0 HG LEU A 58 -1.082 2.484 -9.765 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.504 0.723 -9.006 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.601 0.960 -10.767 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.856 1.644 -9.706 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.042 2.636 -7.510 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.306 3.572 -8.198 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -0.338 4.253 -8.191 1.00 0.00 H new ATOM 936 N ASN A 59 -2.007 5.160 -12.644 1.00 0.00 N ATOM 937 CA ASN A 59 -3.318 5.863 -12.574 1.00 0.00 C ATOM 938 C ASN A 59 -4.428 4.959 -13.107 1.00 0.00 C ATOM 939 O ASN A 59 -5.482 4.838 -12.515 1.00 0.00 O ATOM 940 CB ASN A 59 -3.246 7.136 -13.418 1.00 0.00 C ATOM 941 CG ASN A 59 -2.848 6.770 -14.849 1.00 0.00 C ATOM 942 OD1 ASN A 59 -2.384 5.676 -15.099 1.00 0.00 O ATOM 943 ND2 ASN A 59 -3.005 7.642 -15.807 1.00 0.00 N ATOM 0 H ASN A 59 -1.320 5.588 -13.264 1.00 0.00 H new ATOM 0 HA ASN A 59 -3.538 6.116 -11.537 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -4.211 7.644 -13.415 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -2.520 7.828 -12.992 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -2.738 7.404 -16.762 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -3.394 8.562 -15.601 1.00 0.00 H new ATOM 950 N ALA A 60 -4.204 4.321 -14.220 1.00 0.00 N ATOM 951 CA ALA A 60 -5.245 3.429 -14.792 1.00 0.00 C ATOM 952 C ALA A 60 -5.395 2.171 -13.933 1.00 0.00 C ATOM 953 O ALA A 60 -6.489 1.691 -13.705 1.00 0.00 O ATOM 954 CB ALA A 60 -4.825 3.029 -16.206 1.00 0.00 C ATOM 0 H ALA A 60 -3.340 4.380 -14.760 1.00 0.00 H new ATOM 0 HA ALA A 60 -6.200 3.955 -14.815 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -5.581 2.373 -16.638 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -4.724 3.923 -16.822 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.870 2.505 -16.167 1.00 0.00 H new ATOM 960 N LEU A 61 -4.305 1.624 -13.467 1.00 0.00 N ATOM 961 CA LEU A 61 -4.386 0.386 -12.644 1.00 0.00 C ATOM 962 C LEU A 61 -5.177 0.666 -11.360 1.00 0.00 C ATOM 963 O LEU A 61 -6.077 -0.065 -11.000 1.00 0.00 O ATOM 964 CB LEU A 61 -2.956 -0.055 -12.296 1.00 0.00 C ATOM 965 CG LEU A 61 -2.919 -1.548 -11.954 1.00 0.00 C ATOM 966 CD1 LEU A 61 -1.458 -1.983 -11.776 1.00 0.00 C ATOM 967 CD2 LEU A 61 -3.715 -1.828 -10.665 1.00 0.00 C ATOM 0 H LEU A 61 -3.362 1.982 -13.621 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.895 -0.403 -13.198 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -2.293 0.147 -13.137 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -2.586 0.526 -11.451 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.376 -2.114 -12.765 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -1.422 -3.045 -11.532 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -0.910 -1.804 -12.701 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -1.003 -1.410 -10.968 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.677 -2.893 -10.438 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -3.280 -1.266 -9.839 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.752 -1.523 -10.804 1.00 0.00 H new ATOM 979 N PHE A 62 -4.850 1.725 -10.677 1.00 0.00 N ATOM 980 CA PHE A 62 -5.569 2.070 -9.416 1.00 0.00 C ATOM 981 C PHE A 62 -7.004 2.533 -9.722 1.00 0.00 C ATOM 982 O PHE A 62 -7.915 2.286 -8.961 1.00 0.00 O ATOM 983 CB PHE A 62 -4.793 3.190 -8.691 1.00 0.00 C ATOM 984 CG PHE A 62 -3.765 2.593 -7.747 1.00 0.00 C ATOM 985 CD1 PHE A 62 -2.924 1.558 -8.180 1.00 0.00 C ATOM 986 CD2 PHE A 62 -3.656 3.077 -6.437 1.00 0.00 C ATOM 987 CE1 PHE A 62 -1.978 1.011 -7.303 1.00 0.00 C ATOM 988 CE2 PHE A 62 -2.710 2.529 -5.562 1.00 0.00 C ATOM 989 CZ PHE A 62 -1.871 1.496 -5.995 1.00 0.00 C ATOM 0 H PHE A 62 -4.108 2.374 -10.939 1.00 0.00 H new ATOM 0 HA PHE A 62 -5.627 1.188 -8.779 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -4.298 3.830 -9.421 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -5.486 3.820 -8.133 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -3.005 1.182 -9.189 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -4.303 3.874 -6.101 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -1.330 0.214 -7.637 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -2.628 2.904 -4.552 1.00 0.00 H new ATOM 0 HZ PHE A 62 -1.141 1.073 -5.320 1.00 0.00 H new ATOM 999 N ASP A 63 -7.207 3.225 -10.810 1.00 0.00 N ATOM 1000 CA ASP A 63 -8.578 3.728 -11.132 1.00 0.00 C ATOM 1001 C ASP A 63 -9.593 2.578 -11.241 1.00 0.00 C ATOM 1002 O ASP A 63 -10.659 2.640 -10.662 1.00 0.00 O ATOM 1003 CB ASP A 63 -8.519 4.499 -12.463 1.00 0.00 C ATOM 1004 CG ASP A 63 -8.138 5.962 -12.212 1.00 0.00 C ATOM 1005 OD1 ASP A 63 -7.546 6.234 -11.181 1.00 0.00 O ATOM 1006 OD2 ASP A 63 -8.462 6.787 -13.051 1.00 0.00 O ATOM 0 H ASP A 63 -6.486 3.465 -11.490 1.00 0.00 H new ATOM 0 HA ASP A 63 -8.909 4.382 -10.325 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -7.791 4.035 -13.128 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -9.486 4.448 -12.964 1.00 0.00 H new ATOM 1011 N ARG A 64 -9.292 1.539 -11.966 1.00 0.00 N ATOM 1012 CA ARG A 64 -10.272 0.418 -12.087 1.00 0.00 C ATOM 1013 C ARG A 64 -10.521 -0.215 -10.716 1.00 0.00 C ATOM 1014 O ARG A 64 -11.638 -0.538 -10.366 1.00 0.00 O ATOM 1015 CB ARG A 64 -9.731 -0.631 -13.065 1.00 0.00 C ATOM 1016 CG ARG A 64 -10.642 -1.871 -13.076 1.00 0.00 C ATOM 1017 CD ARG A 64 -10.189 -2.846 -14.176 1.00 0.00 C ATOM 1018 NE ARG A 64 -10.564 -4.241 -13.785 1.00 0.00 N ATOM 1019 CZ ARG A 64 -11.700 -4.775 -14.151 1.00 0.00 C ATOM 1020 NH1 ARG A 64 -12.561 -4.100 -14.866 1.00 0.00 N ATOM 1021 NH2 ARG A 64 -11.974 -6.000 -13.789 1.00 0.00 N ATOM 0 H ARG A 64 -8.418 1.414 -12.477 1.00 0.00 H new ATOM 0 HA ARG A 64 -11.218 0.806 -12.466 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -9.671 -0.207 -14.067 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -8.719 -0.917 -12.779 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -10.610 -2.365 -12.105 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -11.676 -1.571 -13.247 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -10.656 -2.584 -15.125 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -9.111 -2.774 -14.321 1.00 0.00 H new ATOM 0 HE ARG A 64 -9.917 -4.789 -13.218 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -12.351 -3.142 -15.147 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -13.443 -4.531 -15.143 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -11.305 -6.528 -13.228 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -12.857 -6.429 -14.068 1.00 0.00 H new ATOM 1035 N ILE A 65 -9.494 -0.403 -9.942 1.00 0.00 N ATOM 1036 CA ILE A 65 -9.673 -1.030 -8.606 1.00 0.00 C ATOM 1037 C ILE A 65 -10.568 -0.149 -7.724 1.00 0.00 C ATOM 1038 O ILE A 65 -11.442 -0.636 -7.034 1.00 0.00 O ATOM 1039 CB ILE A 65 -8.300 -1.187 -7.949 1.00 0.00 C ATOM 1040 CG1 ILE A 65 -7.480 -2.212 -8.737 1.00 0.00 C ATOM 1041 CG2 ILE A 65 -8.471 -1.669 -6.505 1.00 0.00 C ATOM 1042 CD1 ILE A 65 -6.029 -2.178 -8.259 1.00 0.00 C ATOM 0 H ILE A 65 -8.534 -0.149 -10.177 1.00 0.00 H new ATOM 0 HA ILE A 65 -10.147 -2.005 -8.721 1.00 0.00 H new ATOM 0 HB ILE A 65 -7.784 -0.227 -7.947 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -7.896 -3.210 -8.600 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -7.528 -1.990 -9.803 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -7.491 -1.780 -6.040 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -9.058 -0.941 -5.945 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -8.985 -2.630 -6.501 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -5.444 -2.907 -8.819 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -5.616 -1.182 -8.419 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -5.990 -2.420 -7.197 1.00 0.00 H new ATOM 1054 N ILE A 66 -10.356 1.138 -7.731 1.00 0.00 N ATOM 1055 CA ILE A 66 -11.192 2.035 -6.880 1.00 0.00 C ATOM 1056 C ILE A 66 -12.664 1.956 -7.290 1.00 0.00 C ATOM 1057 O ILE A 66 -13.488 1.417 -6.580 1.00 0.00 O ATOM 1058 CB ILE A 66 -10.712 3.481 -7.049 1.00 0.00 C ATOM 1059 CG1 ILE A 66 -9.309 3.630 -6.463 1.00 0.00 C ATOM 1060 CG2 ILE A 66 -11.667 4.437 -6.324 1.00 0.00 C ATOM 1061 CD1 ILE A 66 -8.721 4.965 -6.920 1.00 0.00 C ATOM 0 H ILE A 66 -9.642 1.608 -8.287 1.00 0.00 H new ATOM 0 HA ILE A 66 -11.095 1.717 -5.842 1.00 0.00 H new ATOM 0 HB ILE A 66 -10.693 3.725 -8.111 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -9.349 3.588 -5.375 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -8.674 2.807 -6.790 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -11.319 5.463 -6.449 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -12.668 4.340 -6.744 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -11.694 4.189 -5.263 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -7.719 5.082 -6.507 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -8.670 4.986 -8.009 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -9.355 5.780 -6.571 1.00 0.00 H new ATOM 1073 N VAL A 67 -13.008 2.522 -8.413 1.00 0.00 N ATOM 1074 CA VAL A 67 -14.434 2.517 -8.842 1.00 0.00 C ATOM 1075 C VAL A 67 -14.843 1.145 -9.386 1.00 0.00 C ATOM 1076 O VAL A 67 -14.200 0.580 -10.245 1.00 0.00 O ATOM 1077 CB VAL A 67 -14.641 3.584 -9.924 1.00 0.00 C ATOM 1078 CG1 VAL A 67 -14.699 4.973 -9.280 1.00 0.00 C ATOM 1079 CG2 VAL A 67 -13.474 3.534 -10.916 1.00 0.00 C ATOM 0 H VAL A 67 -12.364 2.988 -9.052 1.00 0.00 H new ATOM 0 HA VAL A 67 -15.057 2.738 -7.975 1.00 0.00 H new ATOM 0 HB VAL A 67 -15.578 3.390 -10.446 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -14.846 5.727 -10.053 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -15.528 5.012 -8.573 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -13.764 5.170 -8.755 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -13.619 4.291 -11.686 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -12.540 3.726 -10.389 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -13.433 2.548 -11.380 1.00 0.00 H new ATOM 1089 N ASN A 68 -15.935 0.626 -8.893 1.00 0.00 N ATOM 1090 CA ASN A 68 -16.447 -0.690 -9.365 1.00 0.00 C ATOM 1091 C ASN A 68 -17.579 -0.435 -10.359 1.00 0.00 C ATOM 1092 O ASN A 68 -17.962 -1.299 -11.123 1.00 0.00 O ATOM 1093 CB ASN A 68 -16.990 -1.464 -8.166 1.00 0.00 C ATOM 1094 CG ASN A 68 -17.421 -2.863 -8.600 1.00 0.00 C ATOM 1095 OD1 ASN A 68 -16.918 -3.399 -9.569 1.00 0.00 O ATOM 1096 ND2 ASN A 68 -18.341 -3.482 -7.914 1.00 0.00 N ATOM 0 H ASN A 68 -16.503 1.068 -8.170 1.00 0.00 H new ATOM 0 HA ASN A 68 -15.653 -1.264 -9.842 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -16.226 -1.534 -7.391 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -17.837 -0.932 -7.732 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -18.640 -4.417 -8.190 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -18.762 -3.031 -7.102 1.00 0.00 H new ATOM 1103 N LYS A 69 -18.121 0.753 -10.341 1.00 0.00 N ATOM 1104 CA LYS A 69 -19.240 1.093 -11.267 1.00 0.00 C ATOM 1105 C LYS A 69 -18.732 1.158 -12.709 1.00 0.00 C ATOM 1106 O LYS A 69 -17.545 1.173 -12.961 1.00 0.00 O ATOM 1107 CB LYS A 69 -19.836 2.455 -10.873 1.00 0.00 C ATOM 1108 CG LYS A 69 -21.275 2.563 -11.391 1.00 0.00 C ATOM 1109 CD LYS A 69 -21.905 3.863 -10.892 1.00 0.00 C ATOM 1110 CE LYS A 69 -23.317 3.991 -11.465 1.00 0.00 C ATOM 1111 NZ LYS A 69 -24.169 2.891 -10.931 1.00 0.00 N ATOM 0 H LYS A 69 -17.834 1.509 -9.719 1.00 0.00 H new ATOM 0 HA LYS A 69 -20.006 0.321 -11.195 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -19.821 2.569 -9.789 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -19.230 3.261 -11.287 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -21.282 2.539 -12.481 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -21.860 1.709 -11.049 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -21.940 3.869 -9.803 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -21.298 4.715 -11.196 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -23.743 4.958 -11.199 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -23.285 3.946 -12.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -25.172 3.135 -11.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -23.958 2.010 -11.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -23.972 2.760 -9.918 1.00 0.00 H new ATOM 1125 N LEU A 70 -19.642 1.200 -13.649 1.00 0.00 N ATOM 1126 CA LEU A 70 -19.270 1.272 -15.089 1.00 0.00 C ATOM 1127 C LEU A 70 -18.900 -0.128 -15.587 1.00 0.00 C ATOM 1128 O LEU A 70 -17.981 -0.292 -16.363 1.00 0.00 O ATOM 1129 CB LEU A 70 -18.080 2.237 -15.288 1.00 0.00 C ATOM 1130 CG LEU A 70 -18.145 2.877 -16.693 1.00 0.00 C ATOM 1131 CD1 LEU A 70 -19.040 4.123 -16.668 1.00 0.00 C ATOM 1132 CD2 LEU A 70 -16.737 3.281 -17.152 1.00 0.00 C ATOM 0 H LEU A 70 -20.646 1.187 -13.472 1.00 0.00 H new ATOM 0 HA LEU A 70 -20.119 1.648 -15.660 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -18.101 3.015 -14.524 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -17.140 1.698 -15.169 1.00 0.00 H new ATOM 0 HG LEU A 70 -18.561 2.146 -17.386 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -19.077 4.564 -17.664 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -20.046 3.842 -16.358 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -18.633 4.849 -15.964 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -16.793 3.731 -18.143 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -16.318 4.001 -16.449 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -16.099 2.398 -17.190 1.00 0.00 H new ATOM 1144 N GLU A 71 -19.610 -1.137 -15.142 1.00 0.00 N ATOM 1145 CA GLU A 71 -19.307 -2.537 -15.579 1.00 0.00 C ATOM 1146 C GLU A 71 -20.597 -3.228 -16.038 1.00 0.00 C ATOM 1147 O GLU A 71 -21.593 -2.589 -16.310 1.00 0.00 O ATOM 1148 CB GLU A 71 -18.693 -3.303 -14.407 1.00 0.00 C ATOM 1149 CG GLU A 71 -19.503 -3.041 -13.136 1.00 0.00 C ATOM 1150 CD GLU A 71 -18.938 -3.893 -11.999 1.00 0.00 C ATOM 1151 OE1 GLU A 71 -17.818 -4.360 -12.137 1.00 0.00 O ATOM 1152 OE2 GLU A 71 -19.633 -4.069 -11.013 1.00 0.00 O ATOM 0 H GLU A 71 -20.391 -1.050 -14.491 1.00 0.00 H new ATOM 0 HA GLU A 71 -18.603 -2.519 -16.411 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -18.678 -4.371 -14.626 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -17.658 -2.993 -14.260 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -19.458 -1.984 -12.872 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -20.553 -3.284 -13.302 1.00 0.00 H new ATOM 1159 N HIS A 72 -20.573 -4.533 -16.138 1.00 0.00 N ATOM 1160 CA HIS A 72 -21.777 -5.293 -16.596 1.00 0.00 C ATOM 1161 C HIS A 72 -23.052 -4.715 -15.981 1.00 0.00 C ATOM 1162 O HIS A 72 -23.786 -3.983 -16.615 1.00 0.00 O ATOM 1163 CB HIS A 72 -21.647 -6.747 -16.145 1.00 0.00 C ATOM 1164 CG HIS A 72 -20.402 -7.360 -16.722 1.00 0.00 C ATOM 1165 ND1 HIS A 72 -20.092 -7.283 -18.073 1.00 0.00 N ATOM 1166 CD2 HIS A 72 -19.394 -8.091 -16.145 1.00 0.00 C ATOM 1167 CE1 HIS A 72 -18.940 -7.955 -18.262 1.00 0.00 C ATOM 1168 NE2 HIS A 72 -18.477 -8.465 -17.119 1.00 0.00 N ATOM 0 H HIS A 72 -19.762 -5.111 -15.919 1.00 0.00 H new ATOM 0 HA HIS A 72 -21.838 -5.222 -17.682 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -21.615 -6.796 -15.057 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -22.522 -7.314 -16.464 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -19.324 -8.337 -15.096 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -18.452 -8.067 -19.219 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -17.628 -9.014 -16.988 1.00 0.00 H new ATOM 1176 N HIS A 73 -23.325 -5.056 -14.754 1.00 0.00 N ATOM 1177 CA HIS A 73 -24.556 -4.552 -14.090 1.00 0.00 C ATOM 1178 C HIS A 73 -24.523 -4.967 -12.618 1.00 0.00 C ATOM 1179 O HIS A 73 -25.446 -5.574 -12.111 1.00 0.00 O ATOM 1180 CB HIS A 73 -25.779 -5.167 -14.775 1.00 0.00 C ATOM 1181 CG HIS A 73 -27.030 -4.718 -14.078 1.00 0.00 C ATOM 1182 ND1 HIS A 73 -27.801 -5.582 -13.315 1.00 0.00 N ATOM 1183 CD2 HIS A 73 -27.657 -3.499 -14.015 1.00 0.00 C ATOM 1184 CE1 HIS A 73 -28.840 -4.879 -12.830 1.00 0.00 C ATOM 1185 NE2 HIS A 73 -28.797 -3.606 -13.226 1.00 0.00 N ATOM 0 H HIS A 73 -22.744 -5.666 -14.179 1.00 0.00 H new ATOM 0 HA HIS A 73 -24.610 -3.466 -14.163 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -25.809 -4.869 -15.823 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -25.710 -6.255 -14.754 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -27.318 -2.597 -14.502 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -29.612 -5.293 -12.199 1.00 0.00 H new ATOM 0 HE2 HIS A 73 -29.461 -2.866 -12.998 1.00 0.00 H new ATOM 1193 N HIS A 74 -23.461 -4.645 -11.929 1.00 0.00 N ATOM 1194 CA HIS A 74 -23.351 -5.020 -10.487 1.00 0.00 C ATOM 1195 C HIS A 74 -23.759 -6.482 -10.298 1.00 0.00 C ATOM 1196 O HIS A 74 -23.792 -7.252 -11.236 1.00 0.00 O ATOM 1197 CB HIS A 74 -24.271 -4.132 -9.653 1.00 0.00 C ATOM 1198 CG HIS A 74 -23.989 -2.691 -9.962 1.00 0.00 C ATOM 1199 ND1 HIS A 74 -24.997 -1.742 -10.043 1.00 0.00 N ATOM 1200 CD2 HIS A 74 -22.818 -2.019 -10.214 1.00 0.00 C ATOM 1201 CE1 HIS A 74 -24.422 -0.562 -10.332 1.00 0.00 C ATOM 1202 NE2 HIS A 74 -23.097 -0.676 -10.446 1.00 0.00 N ATOM 0 H HIS A 74 -22.661 -4.136 -12.304 1.00 0.00 H new ATOM 0 HA HIS A 74 -22.319 -4.885 -10.164 1.00 0.00 H new ATOM 0 HB2 HIS A 74 -25.314 -4.364 -9.870 1.00 0.00 H new ATOM 0 HB3 HIS A 74 -24.116 -4.325 -8.591 1.00 0.00 H new ATOM 0 HD1 HIS A 74 -25.994 -1.909 -9.908 1.00 0.00 H new ATOM 0 HD2 HIS A 74 -21.834 -2.464 -10.230 1.00 0.00 H new ATOM 0 HE1 HIS A 74 -24.965 0.363 -10.457 1.00 0.00 H new ATOM 1210 N HIS A 75 -24.060 -6.869 -9.081 1.00 0.00 N ATOM 1211 CA HIS A 75 -24.465 -8.285 -8.803 1.00 0.00 C ATOM 1212 C HIS A 75 -25.710 -8.294 -7.911 1.00 0.00 C ATOM 1213 O HIS A 75 -25.803 -7.570 -6.942 1.00 0.00 O ATOM 1214 CB HIS A 75 -23.309 -9.013 -8.099 1.00 0.00 C ATOM 1215 CG HIS A 75 -22.317 -9.485 -9.129 1.00 0.00 C ATOM 1216 ND1 HIS A 75 -21.348 -8.649 -9.665 1.00 0.00 N ATOM 1217 CD2 HIS A 75 -22.154 -10.697 -9.752 1.00 0.00 C ATOM 1218 CE1 HIS A 75 -20.652 -9.364 -10.570 1.00 0.00 C ATOM 1219 NE2 HIS A 75 -21.105 -10.615 -10.659 1.00 0.00 N ATOM 0 H HIS A 75 -24.042 -6.261 -8.263 1.00 0.00 H new ATOM 0 HA HIS A 75 -24.694 -8.794 -9.739 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -22.823 -8.345 -7.388 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -23.691 -9.861 -7.530 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -22.749 -11.579 -9.566 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -19.830 -8.973 -11.151 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -20.755 -11.356 -11.266 1.00 0.00 H new ATOM 1227 N HIS A 76 -26.668 -9.110 -8.247 1.00 0.00 N ATOM 1228 CA HIS A 76 -27.921 -9.179 -7.444 1.00 0.00 C ATOM 1229 C HIS A 76 -27.713 -10.121 -6.253 1.00 0.00 C ATOM 1230 O HIS A 76 -26.820 -10.943 -6.244 1.00 0.00 O ATOM 1231 CB HIS A 76 -29.061 -9.695 -8.348 1.00 0.00 C ATOM 1232 CG HIS A 76 -29.796 -8.530 -8.960 1.00 0.00 C ATOM 1233 ND1 HIS A 76 -29.239 -7.261 -9.032 1.00 0.00 N ATOM 1234 CD2 HIS A 76 -31.052 -8.419 -9.508 1.00 0.00 C ATOM 1235 CE1 HIS A 76 -30.149 -6.449 -9.602 1.00 0.00 C ATOM 1236 NE2 HIS A 76 -31.268 -7.106 -9.909 1.00 0.00 N ATOM 0 H HIS A 76 -26.637 -9.738 -9.050 1.00 0.00 H new ATOM 0 HA HIS A 76 -28.182 -8.191 -7.064 1.00 0.00 H new ATOM 0 HB2 HIS A 76 -28.654 -10.333 -9.133 1.00 0.00 H new ATOM 0 HB3 HIS A 76 -29.751 -10.306 -7.766 1.00 0.00 H new ATOM 0 HD2 HIS A 76 -31.761 -9.227 -9.611 1.00 0.00 H new ATOM 0 HE1 HIS A 76 -29.992 -5.397 -9.787 1.00 0.00 H new ATOM 0 HE2 HIS A 76 -32.107 -6.725 -10.347 1.00 0.00 H new ATOM 1244 N HIS A 77 -28.536 -9.990 -5.247 1.00 0.00 N ATOM 1245 CA HIS A 77 -28.408 -10.857 -4.043 1.00 0.00 C ATOM 1246 C HIS A 77 -28.231 -12.324 -4.471 1.00 0.00 C ATOM 1247 O HIS A 77 -27.968 -13.146 -3.608 1.00 0.00 O ATOM 1248 CB HIS A 77 -29.670 -10.680 -3.173 1.00 0.00 C ATOM 1249 CG HIS A 77 -30.771 -11.607 -3.633 1.00 0.00 C ATOM 1250 ND1 HIS A 77 -31.341 -12.549 -2.788 1.00 0.00 N ATOM 1251 CD2 HIS A 77 -31.396 -11.763 -4.846 1.00 0.00 C ATOM 1252 CE1 HIS A 77 -32.262 -13.227 -3.498 1.00 0.00 C ATOM 1253 NE2 HIS A 77 -32.333 -12.788 -4.755 1.00 0.00 N ATOM 1254 OXT HIS A 77 -28.367 -12.599 -5.652 1.00 0.00 O ATOM 0 H HIS A 77 -29.298 -9.313 -5.209 1.00 0.00 H new ATOM 0 HA HIS A 77 -27.531 -10.572 -3.462 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -29.430 -10.883 -2.129 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -30.012 -9.646 -3.226 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -31.192 -11.181 -5.733 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -32.868 -14.027 -3.099 1.00 0.00 H new ATOM 0 HE2 HIS A 77 -32.946 -13.131 -5.495 1.00 0.00 H new TER 1262 HIS A 77 ATOM 1263 N MET B 1 -8.931 -7.816 -13.702 1.00 0.00 N ATOM 1264 CA MET B 1 -7.674 -8.606 -13.558 1.00 0.00 C ATOM 1265 C MET B 1 -7.176 -8.538 -12.113 1.00 0.00 C ATOM 1266 O MET B 1 -7.436 -7.592 -11.400 1.00 0.00 O ATOM 1267 CB MET B 1 -6.603 -8.045 -14.496 1.00 0.00 C ATOM 1268 CG MET B 1 -6.968 -8.381 -15.941 1.00 0.00 C ATOM 1269 SD MET B 1 -5.677 -7.759 -17.046 1.00 0.00 S ATOM 1270 CE MET B 1 -6.529 -8.099 -18.605 1.00 0.00 C ATOM 0 H1 MET B 1 -9.707 -8.447 -13.989 1.00 0.00 H new ATOM 0 H2 MET B 1 -9.166 -7.369 -12.793 1.00 0.00 H new ATOM 0 H3 MET B 1 -8.798 -7.081 -14.425 1.00 0.00 H new ATOM 0 HA MET B 1 -7.876 -9.645 -13.818 1.00 0.00 H new ATOM 0 HB2 MET B 1 -6.524 -6.965 -14.371 1.00 0.00 H new ATOM 0 HB3 MET B 1 -5.629 -8.467 -14.248 1.00 0.00 H new ATOM 0 HG2 MET B 1 -7.075 -9.459 -16.059 1.00 0.00 H new ATOM 0 HG3 MET B 1 -7.929 -7.935 -16.198 1.00 0.00 H new ATOM 0 HE1 MET B 1 -5.900 -7.787 -19.439 1.00 0.00 H new ATOM 0 HE2 MET B 1 -6.732 -9.167 -18.683 1.00 0.00 H new ATOM 0 HE3 MET B 1 -7.469 -7.548 -18.634 1.00 0.00 H new ATOM 1282 N GLU B 2 -6.466 -9.544 -11.677 1.00 0.00 N ATOM 1283 CA GLU B 2 -5.955 -9.551 -10.276 1.00 0.00 C ATOM 1284 C GLU B 2 -4.718 -8.658 -10.161 1.00 0.00 C ATOM 1285 O GLU B 2 -4.122 -8.279 -11.146 1.00 0.00 O ATOM 1286 CB GLU B 2 -5.599 -10.982 -9.876 1.00 0.00 C ATOM 1287 CG GLU B 2 -5.102 -11.003 -8.426 1.00 0.00 C ATOM 1288 CD GLU B 2 -5.185 -12.429 -7.880 1.00 0.00 C ATOM 1289 OE1 GLU B 2 -4.340 -13.233 -8.237 1.00 0.00 O ATOM 1290 OE2 GLU B 2 -6.101 -12.695 -7.119 1.00 0.00 O ATOM 0 H GLU B 2 -6.218 -10.363 -12.232 1.00 0.00 H new ATOM 0 HA GLU B 2 -6.727 -9.166 -9.610 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -6.471 -11.627 -9.981 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -4.830 -11.375 -10.540 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -4.074 -10.643 -8.377 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -5.705 -10.332 -7.814 1.00 0.00 H new ATOM 1297 N LEU B 3 -4.332 -8.320 -8.957 1.00 0.00 N ATOM 1298 CA LEU B 3 -3.140 -7.443 -8.757 1.00 0.00 C ATOM 1299 C LEU B 3 -1.891 -8.104 -9.342 1.00 0.00 C ATOM 1300 O LEU B 3 -1.097 -7.473 -10.013 1.00 0.00 O ATOM 1301 CB LEU B 3 -2.942 -7.226 -7.252 1.00 0.00 C ATOM 1302 CG LEU B 3 -1.682 -6.389 -6.983 1.00 0.00 C ATOM 1303 CD1 LEU B 3 -1.754 -5.051 -7.737 1.00 0.00 C ATOM 1304 CD2 LEU B 3 -1.574 -6.127 -5.478 1.00 0.00 C ATOM 0 H LEU B 3 -4.795 -8.617 -8.098 1.00 0.00 H new ATOM 0 HA LEU B 3 -3.300 -6.490 -9.262 1.00 0.00 H new ATOM 0 HB2 LEU B 3 -3.814 -6.723 -6.835 1.00 0.00 H new ATOM 0 HB3 LEU B 3 -2.858 -8.189 -6.749 1.00 0.00 H new ATOM 0 HG LEU B 3 -0.806 -6.935 -7.332 1.00 0.00 H new ATOM 0 HD11 LEU B 3 -0.854 -4.471 -7.535 1.00 0.00 H new ATOM 0 HD12 LEU B 3 -1.831 -5.240 -8.808 1.00 0.00 H new ATOM 0 HD13 LEU B 3 -2.628 -4.492 -7.403 1.00 0.00 H new ATOM 0 HD21 LEU B 3 -0.683 -5.533 -5.275 1.00 0.00 H new ATOM 0 HD22 LEU B 3 -2.456 -5.584 -5.139 1.00 0.00 H new ATOM 0 HD23 LEU B 3 -1.506 -7.077 -4.947 1.00 0.00 H new ATOM 1316 N SER B 4 -1.708 -9.365 -9.091 1.00 0.00 N ATOM 1317 CA SER B 4 -0.509 -10.069 -9.622 1.00 0.00 C ATOM 1318 C SER B 4 -0.507 -10.036 -11.153 1.00 0.00 C ATOM 1319 O SER B 4 0.532 -9.977 -11.779 1.00 0.00 O ATOM 1320 CB SER B 4 -0.528 -11.516 -9.140 1.00 0.00 C ATOM 1321 OG SER B 4 0.378 -12.283 -9.917 1.00 0.00 O ATOM 0 H SER B 4 -2.340 -9.944 -8.538 1.00 0.00 H new ATOM 0 HA SER B 4 0.390 -9.569 -9.262 1.00 0.00 H new ATOM 0 HB2 SER B 4 -0.252 -11.564 -8.087 1.00 0.00 H new ATOM 0 HB3 SER B 4 -1.534 -11.926 -9.225 1.00 0.00 H new ATOM 0 HG SER B 4 0.368 -13.213 -9.608 1.00 0.00 H new ATOM 1327 N ASN B 5 -1.659 -10.099 -11.760 1.00 0.00 N ATOM 1328 CA ASN B 5 -1.724 -10.101 -13.248 1.00 0.00 C ATOM 1329 C ASN B 5 -1.137 -8.812 -13.835 1.00 0.00 C ATOM 1330 O ASN B 5 -0.405 -8.850 -14.804 1.00 0.00 O ATOM 1331 CB ASN B 5 -3.186 -10.219 -13.671 1.00 0.00 C ATOM 1332 CG ASN B 5 -3.291 -10.143 -15.194 1.00 0.00 C ATOM 1333 OD1 ASN B 5 -3.549 -8.996 -15.759 1.00 0.00 O flip ATOM 1334 ND2 ASN B 5 -3.135 -11.137 -15.876 1.00 0.00 N flip ATOM 0 H ASN B 5 -2.562 -10.149 -11.288 1.00 0.00 H new ATOM 0 HA ASN B 5 -1.140 -10.942 -13.621 1.00 0.00 H new ATOM 0 HB2 ASN B 5 -3.602 -11.161 -13.315 1.00 0.00 H new ATOM 0 HB3 ASN B 5 -3.771 -9.420 -13.216 1.00 0.00 H new ATOM 0 HD21 ASN B 5 -2.933 -12.033 -15.433 1.00 0.00 H new ATOM 0 HD22 ASN B 5 -3.206 -11.075 -16.892 1.00 0.00 H new ATOM 1341 N GLU B 6 -1.452 -7.670 -13.280 1.00 0.00 N ATOM 1342 CA GLU B 6 -0.904 -6.405 -13.852 1.00 0.00 C ATOM 1343 C GLU B 6 0.601 -6.315 -13.593 1.00 0.00 C ATOM 1344 O GLU B 6 1.363 -5.949 -14.462 1.00 0.00 O ATOM 1345 CB GLU B 6 -1.598 -5.185 -13.226 1.00 0.00 C ATOM 1346 CG GLU B 6 -3.101 -5.130 -13.636 1.00 0.00 C ATOM 1347 CD GLU B 6 -4.012 -5.607 -12.494 1.00 0.00 C ATOM 1348 OE1 GLU B 6 -3.496 -6.069 -11.495 1.00 0.00 O ATOM 1349 OE2 GLU B 6 -5.219 -5.490 -12.641 1.00 0.00 O ATOM 0 H GLU B 6 -2.057 -7.559 -12.466 1.00 0.00 H new ATOM 0 HA GLU B 6 -1.089 -6.411 -14.926 1.00 0.00 H new ATOM 0 HB2 GLU B 6 -1.514 -5.231 -12.140 1.00 0.00 H new ATOM 0 HB3 GLU B 6 -1.096 -4.272 -13.546 1.00 0.00 H new ATOM 0 HG2 GLU B 6 -3.367 -4.110 -13.914 1.00 0.00 H new ATOM 0 HG3 GLU B 6 -3.263 -5.752 -14.516 1.00 0.00 H new ATOM 1356 N LEU B 7 1.040 -6.648 -12.415 1.00 0.00 N ATOM 1357 CA LEU B 7 2.499 -6.573 -12.122 1.00 0.00 C ATOM 1358 C LEU B 7 3.245 -7.535 -13.051 1.00 0.00 C ATOM 1359 O LEU B 7 4.309 -7.228 -13.552 1.00 0.00 O ATOM 1360 CB LEU B 7 2.735 -6.961 -10.653 1.00 0.00 C ATOM 1361 CG LEU B 7 2.580 -5.731 -9.744 1.00 0.00 C ATOM 1362 CD1 LEU B 7 1.255 -5.013 -10.042 1.00 0.00 C ATOM 1363 CD2 LEU B 7 2.604 -6.187 -8.279 1.00 0.00 C ATOM 0 H LEU B 7 0.456 -6.968 -11.643 1.00 0.00 H new ATOM 0 HA LEU B 7 2.867 -5.561 -12.287 1.00 0.00 H new ATOM 0 HB2 LEU B 7 2.026 -7.733 -10.355 1.00 0.00 H new ATOM 0 HB3 LEU B 7 3.733 -7.384 -10.537 1.00 0.00 H new ATOM 0 HG LEU B 7 3.401 -5.038 -9.930 1.00 0.00 H new ATOM 0 HD11 LEU B 7 1.158 -4.144 -9.391 1.00 0.00 H new ATOM 0 HD12 LEU B 7 1.242 -4.690 -11.083 1.00 0.00 H new ATOM 0 HD13 LEU B 7 0.424 -5.695 -9.863 1.00 0.00 H new ATOM 0 HD21 LEU B 7 2.495 -5.321 -7.626 1.00 0.00 H new ATOM 0 HD22 LEU B 7 1.783 -6.882 -8.101 1.00 0.00 H new ATOM 0 HD23 LEU B 7 3.551 -6.683 -8.068 1.00 0.00 H new ATOM 1375 N LYS B 8 2.698 -8.692 -13.290 1.00 0.00 N ATOM 1376 CA LYS B 8 3.378 -9.665 -14.186 1.00 0.00 C ATOM 1377 C LYS B 8 3.513 -9.069 -15.593 1.00 0.00 C ATOM 1378 O LYS B 8 4.554 -9.155 -16.213 1.00 0.00 O ATOM 1379 CB LYS B 8 2.542 -10.942 -14.251 1.00 0.00 C ATOM 1380 CG LYS B 8 3.289 -11.998 -15.062 1.00 0.00 C ATOM 1381 CD LYS B 8 2.479 -13.293 -15.076 1.00 0.00 C ATOM 1382 CE LYS B 8 3.237 -14.353 -15.872 1.00 0.00 C ATOM 1383 NZ LYS B 8 2.463 -15.625 -15.876 1.00 0.00 N ATOM 0 H LYS B 8 1.808 -9.006 -12.903 1.00 0.00 H new ATOM 0 HA LYS B 8 4.372 -9.889 -13.799 1.00 0.00 H new ATOM 0 HB2 LYS B 8 2.345 -11.312 -13.245 1.00 0.00 H new ATOM 0 HB3 LYS B 8 1.575 -10.733 -14.708 1.00 0.00 H new ATOM 0 HG2 LYS B 8 3.448 -11.645 -16.081 1.00 0.00 H new ATOM 0 HG3 LYS B 8 4.273 -12.176 -14.629 1.00 0.00 H new ATOM 0 HD2 LYS B 8 2.308 -13.640 -14.057 1.00 0.00 H new ATOM 0 HD3 LYS B 8 1.500 -13.118 -15.521 1.00 0.00 H new ATOM 0 HE2 LYS B 8 3.396 -14.010 -16.894 1.00 0.00 H new ATOM 0 HE3 LYS B 8 4.221 -14.516 -15.434 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 2.981 -16.345 -16.419 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 2.333 -15.955 -14.898 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 1.533 -15.464 -16.314 1.00 0.00 H new ATOM 1397 N VAL B 9 2.471 -8.470 -16.104 1.00 0.00 N ATOM 1398 CA VAL B 9 2.540 -7.876 -17.471 1.00 0.00 C ATOM 1399 C VAL B 9 3.560 -6.732 -17.501 1.00 0.00 C ATOM 1400 O VAL B 9 4.369 -6.636 -18.403 1.00 0.00 O ATOM 1401 CB VAL B 9 1.163 -7.336 -17.855 1.00 0.00 C ATOM 1402 CG1 VAL B 9 1.253 -6.616 -19.202 1.00 0.00 C ATOM 1403 CG2 VAL B 9 0.168 -8.497 -17.957 1.00 0.00 C ATOM 0 H VAL B 9 1.572 -8.366 -15.633 1.00 0.00 H new ATOM 0 HA VAL B 9 2.849 -8.645 -18.179 1.00 0.00 H new ATOM 0 HB VAL B 9 0.823 -6.635 -17.093 1.00 0.00 H new ATOM 0 HG11 VAL B 9 0.270 -6.231 -19.475 1.00 0.00 H new ATOM 0 HG12 VAL B 9 1.958 -5.789 -19.126 1.00 0.00 H new ATOM 0 HG13 VAL B 9 1.594 -7.315 -19.966 1.00 0.00 H new ATOM 0 HG21 VAL B 9 -0.814 -8.112 -18.231 1.00 0.00 H new ATOM 0 HG22 VAL B 9 0.507 -9.201 -18.717 1.00 0.00 H new ATOM 0 HG23 VAL B 9 0.103 -9.006 -16.995 1.00 0.00 H new ATOM 1413 N GLU B 10 3.526 -5.860 -16.531 1.00 0.00 N ATOM 1414 CA GLU B 10 4.488 -4.723 -16.517 1.00 0.00 C ATOM 1415 C GLU B 10 5.914 -5.268 -16.411 1.00 0.00 C ATOM 1416 O GLU B 10 6.836 -4.746 -17.004 1.00 0.00 O ATOM 1417 CB GLU B 10 4.198 -3.842 -15.300 1.00 0.00 C ATOM 1418 CG GLU B 10 2.773 -3.288 -15.389 1.00 0.00 C ATOM 1419 CD GLU B 10 2.704 -2.208 -16.466 1.00 0.00 C ATOM 1420 OE1 GLU B 10 3.742 -1.657 -16.793 1.00 0.00 O ATOM 1421 OE2 GLU B 10 1.613 -1.943 -16.941 1.00 0.00 O ATOM 0 H GLU B 10 2.873 -5.886 -15.748 1.00 0.00 H new ATOM 0 HA GLU B 10 4.385 -4.141 -17.433 1.00 0.00 H new ATOM 0 HB2 GLU B 10 4.317 -4.421 -14.384 1.00 0.00 H new ATOM 0 HB3 GLU B 10 4.915 -3.022 -15.254 1.00 0.00 H new ATOM 0 HG2 GLU B 10 2.074 -4.092 -15.622 1.00 0.00 H new ATOM 0 HG3 GLU B 10 2.473 -2.874 -14.426 1.00 0.00 H new ATOM 1428 N ARG B 11 6.098 -6.312 -15.650 1.00 0.00 N ATOM 1429 CA ARG B 11 7.457 -6.895 -15.489 1.00 0.00 C ATOM 1430 C ARG B 11 7.984 -7.359 -16.850 1.00 0.00 C ATOM 1431 O ARG B 11 9.136 -7.157 -17.177 1.00 0.00 O ATOM 1432 CB ARG B 11 7.384 -8.092 -14.524 1.00 0.00 C ATOM 1433 CG ARG B 11 8.743 -8.303 -13.830 1.00 0.00 C ATOM 1434 CD ARG B 11 8.866 -9.749 -13.328 1.00 0.00 C ATOM 1435 NE ARG B 11 9.836 -9.789 -12.187 1.00 0.00 N ATOM 1436 CZ ARG B 11 10.654 -10.803 -12.019 1.00 0.00 C ATOM 1437 NH1 ARG B 11 10.671 -11.801 -12.865 1.00 0.00 N ATOM 1438 NH2 ARG B 11 11.458 -10.817 -10.991 1.00 0.00 N ATOM 0 H ARG B 11 5.360 -6.788 -15.131 1.00 0.00 H new ATOM 0 HA ARG B 11 8.132 -6.141 -15.084 1.00 0.00 H new ATOM 0 HB2 ARG B 11 6.609 -7.919 -13.777 1.00 0.00 H new ATOM 0 HB3 ARG B 11 7.104 -8.992 -15.071 1.00 0.00 H new ATOM 0 HG2 ARG B 11 9.553 -8.082 -14.526 1.00 0.00 H new ATOM 0 HG3 ARG B 11 8.844 -7.611 -12.994 1.00 0.00 H new ATOM 0 HD2 ARG B 11 7.893 -10.120 -13.008 1.00 0.00 H new ATOM 0 HD3 ARG B 11 9.206 -10.400 -14.134 1.00 0.00 H new ATOM 0 HE ARG B 11 9.862 -9.012 -11.526 1.00 0.00 H new ATOM 0 HH11 ARG B 11 10.043 -11.799 -13.669 1.00 0.00 H new ATOM 0 HH12 ARG B 11 11.312 -12.581 -12.721 1.00 0.00 H new ATOM 0 HH21 ARG B 11 11.448 -10.044 -10.325 1.00 0.00 H new ATOM 0 HH22 ARG B 11 12.096 -11.601 -10.853 1.00 0.00 H new ATOM 1452 N ILE B 12 7.150 -7.990 -17.638 1.00 0.00 N ATOM 1453 CA ILE B 12 7.603 -8.475 -18.973 1.00 0.00 C ATOM 1454 C ILE B 12 7.986 -7.280 -19.848 1.00 0.00 C ATOM 1455 O ILE B 12 9.002 -7.288 -20.513 1.00 0.00 O ATOM 1456 CB ILE B 12 6.460 -9.245 -19.644 1.00 0.00 C ATOM 1457 CG1 ILE B 12 6.181 -10.531 -18.863 1.00 0.00 C ATOM 1458 CG2 ILE B 12 6.853 -9.602 -21.082 1.00 0.00 C ATOM 1459 CD1 ILE B 12 4.865 -11.142 -19.346 1.00 0.00 C ATOM 0 H ILE B 12 6.175 -8.189 -17.413 1.00 0.00 H new ATOM 0 HA ILE B 12 8.467 -9.128 -18.849 1.00 0.00 H new ATOM 0 HB ILE B 12 5.566 -8.622 -19.655 1.00 0.00 H new ATOM 0 HG12 ILE B 12 6.997 -11.240 -19.004 1.00 0.00 H new ATOM 0 HG13 ILE B 12 6.125 -10.317 -17.796 1.00 0.00 H new ATOM 0 HG21 ILE B 12 6.039 -10.149 -21.557 1.00 0.00 H new ATOM 0 HG22 ILE B 12 7.051 -8.688 -21.642 1.00 0.00 H new ATOM 0 HG23 ILE B 12 7.749 -10.222 -21.071 1.00 0.00 H new ATOM 0 HD11 ILE B 12 4.664 -12.058 -18.791 1.00 0.00 H new ATOM 0 HD12 ILE B 12 4.053 -10.433 -19.182 1.00 0.00 H new ATOM 0 HD13 ILE B 12 4.939 -11.370 -20.409 1.00 0.00 H new ATOM 1471 N ARG B 13 7.181 -6.249 -19.851 1.00 0.00 N ATOM 1472 CA ARG B 13 7.504 -5.060 -20.687 1.00 0.00 C ATOM 1473 C ARG B 13 8.782 -4.407 -20.168 1.00 0.00 C ATOM 1474 O ARG B 13 9.626 -3.979 -20.928 1.00 0.00 O ATOM 1475 CB ARG B 13 6.362 -4.042 -20.621 1.00 0.00 C ATOM 1476 CG ARG B 13 5.134 -4.576 -21.368 1.00 0.00 C ATOM 1477 CD ARG B 13 4.157 -3.426 -21.616 1.00 0.00 C ATOM 1478 NE ARG B 13 3.774 -2.802 -20.317 1.00 0.00 N ATOM 1479 CZ ARG B 13 3.343 -1.568 -20.288 1.00 0.00 C ATOM 1480 NH1 ARG B 13 3.249 -0.880 -21.394 1.00 0.00 N ATOM 1481 NH2 ARG B 13 3.011 -1.019 -19.154 1.00 0.00 N ATOM 0 H ARG B 13 6.318 -6.181 -19.312 1.00 0.00 H new ATOM 0 HA ARG B 13 7.641 -5.381 -21.719 1.00 0.00 H new ATOM 0 HB2 ARG B 13 6.105 -3.840 -19.581 1.00 0.00 H new ATOM 0 HB3 ARG B 13 6.681 -3.097 -21.060 1.00 0.00 H new ATOM 0 HG2 ARG B 13 5.436 -5.023 -22.315 1.00 0.00 H new ATOM 0 HG3 ARG B 13 4.651 -5.360 -20.785 1.00 0.00 H new ATOM 0 HD2 ARG B 13 4.615 -2.681 -22.267 1.00 0.00 H new ATOM 0 HD3 ARG B 13 3.269 -3.795 -22.129 1.00 0.00 H new ATOM 0 HE ARG B 13 3.848 -3.337 -19.452 1.00 0.00 H new ATOM 0 HH11 ARG B 13 3.512 -1.305 -22.283 1.00 0.00 H new ATOM 0 HH12 ARG B 13 2.912 0.083 -21.369 1.00 0.00 H new ATOM 0 HH21 ARG B 13 3.087 -1.552 -18.288 1.00 0.00 H new ATOM 0 HH22 ARG B 13 2.675 -0.056 -19.133 1.00 0.00 H new ATOM 1495 N LEU B 14 8.934 -4.330 -18.875 1.00 0.00 N ATOM 1496 CA LEU B 14 10.159 -3.709 -18.302 1.00 0.00 C ATOM 1497 C LEU B 14 11.222 -4.792 -18.122 1.00 0.00 C ATOM 1498 O LEU B 14 12.350 -4.509 -17.764 1.00 0.00 O ATOM 1499 CB LEU B 14 9.821 -3.090 -16.943 1.00 0.00 C ATOM 1500 CG LEU B 14 8.700 -2.055 -17.107 1.00 0.00 C ATOM 1501 CD1 LEU B 14 8.336 -1.484 -15.733 1.00 0.00 C ATOM 1502 CD2 LEU B 14 9.161 -0.918 -18.039 1.00 0.00 C ATOM 0 H LEU B 14 8.260 -4.672 -18.189 1.00 0.00 H new ATOM 0 HA LEU B 14 10.534 -2.933 -18.969 1.00 0.00 H new ATOM 0 HB2 LEU B 14 9.511 -3.868 -16.246 1.00 0.00 H new ATOM 0 HB3 LEU B 14 10.706 -2.616 -16.519 1.00 0.00 H new ATOM 0 HG LEU B 14 7.826 -2.536 -17.547 1.00 0.00 H new ATOM 0 HD11 LEU B 14 7.540 -0.748 -15.844 1.00 0.00 H new ATOM 0 HD12 LEU B 14 7.997 -2.290 -15.082 1.00 0.00 H new ATOM 0 HD13 LEU B 14 9.212 -1.007 -15.293 1.00 0.00 H new ATOM 0 HD21 LEU B 14 8.358 -0.189 -18.148 1.00 0.00 H new ATOM 0 HD22 LEU B 14 10.038 -0.431 -17.612 1.00 0.00 H new ATOM 0 HD23 LEU B 14 9.414 -1.329 -19.016 1.00 0.00 H new ATOM 1514 N SER B 15 10.862 -6.031 -18.369 1.00 0.00 N ATOM 1515 CA SER B 15 11.832 -7.163 -18.217 1.00 0.00 C ATOM 1516 C SER B 15 12.712 -6.932 -16.986 1.00 0.00 C ATOM 1517 O SER B 15 13.915 -6.805 -17.089 1.00 0.00 O ATOM 1518 CB SER B 15 12.706 -7.270 -19.470 1.00 0.00 C ATOM 1519 OG SER B 15 13.624 -6.186 -19.503 1.00 0.00 O ATOM 0 H SER B 15 9.928 -6.308 -18.672 1.00 0.00 H new ATOM 0 HA SER B 15 11.278 -8.093 -18.089 1.00 0.00 H new ATOM 0 HB2 SER B 15 13.246 -8.217 -19.470 1.00 0.00 H new ATOM 0 HB3 SER B 15 12.082 -7.259 -20.363 1.00 0.00 H new ATOM 0 HG SER B 15 14.225 -6.242 -18.731 1.00 0.00 H new ATOM 1525 N LEU B 16 12.113 -6.860 -15.822 1.00 0.00 N ATOM 1526 CA LEU B 16 12.904 -6.618 -14.570 1.00 0.00 C ATOM 1527 C LEU B 16 13.031 -7.923 -13.786 1.00 0.00 C ATOM 1528 O LEU B 16 12.057 -8.576 -13.476 1.00 0.00 O ATOM 1529 CB LEU B 16 12.174 -5.573 -13.723 1.00 0.00 C ATOM 1530 CG LEU B 16 12.078 -4.259 -14.510 1.00 0.00 C ATOM 1531 CD1 LEU B 16 11.212 -3.266 -13.732 1.00 0.00 C ATOM 1532 CD2 LEU B 16 13.482 -3.661 -14.726 1.00 0.00 C ATOM 0 H LEU B 16 11.107 -6.958 -15.683 1.00 0.00 H new ATOM 0 HA LEU B 16 13.901 -6.258 -14.822 1.00 0.00 H new ATOM 0 HB2 LEU B 16 11.177 -5.929 -13.465 1.00 0.00 H new ATOM 0 HB3 LEU B 16 12.707 -5.411 -12.786 1.00 0.00 H new ATOM 0 HG LEU B 16 11.628 -4.459 -15.483 1.00 0.00 H new ATOM 0 HD11 LEU B 16 11.142 -2.331 -14.288 1.00 0.00 H new ATOM 0 HD12 LEU B 16 10.214 -3.683 -13.595 1.00 0.00 H new ATOM 0 HD13 LEU B 16 11.663 -3.076 -12.758 1.00 0.00 H new ATOM 0 HD21 LEU B 16 13.399 -2.729 -15.286 1.00 0.00 H new ATOM 0 HD22 LEU B 16 13.946 -3.464 -13.760 1.00 0.00 H new ATOM 0 HD23 LEU B 16 14.096 -4.367 -15.286 1.00 0.00 H new ATOM 1544 N THR B 17 14.237 -8.314 -13.477 1.00 0.00 N ATOM 1545 CA THR B 17 14.451 -9.587 -12.728 1.00 0.00 C ATOM 1546 C THR B 17 14.384 -9.340 -11.221 1.00 0.00 C ATOM 1547 O THR B 17 14.498 -8.227 -10.749 1.00 0.00 O ATOM 1548 CB THR B 17 15.824 -10.148 -13.095 1.00 0.00 C ATOM 1549 OG1 THR B 17 16.778 -9.095 -13.076 1.00 0.00 O ATOM 1550 CG2 THR B 17 15.769 -10.767 -14.494 1.00 0.00 C ATOM 0 H THR B 17 15.089 -7.804 -13.712 1.00 0.00 H new ATOM 0 HA THR B 17 13.670 -10.298 -12.996 1.00 0.00 H new ATOM 0 HB THR B 17 16.111 -10.915 -12.375 1.00 0.00 H new ATOM 0 HG1 THR B 17 17.661 -9.450 -13.309 1.00 0.00 H new ATOM 0 HG21 THR B 17 16.749 -11.167 -14.754 1.00 0.00 H new ATOM 0 HG22 THR B 17 15.034 -11.572 -14.507 1.00 0.00 H new ATOM 0 HG23 THR B 17 15.484 -10.004 -15.219 1.00 0.00 H new ATOM 1558 N ALA B 18 14.210 -10.389 -10.467 1.00 0.00 N ATOM 1559 CA ALA B 18 14.143 -10.256 -8.990 1.00 0.00 C ATOM 1560 C ALA B 18 15.513 -9.840 -8.452 1.00 0.00 C ATOM 1561 O ALA B 18 15.618 -9.076 -7.511 1.00 0.00 O ATOM 1562 CB ALA B 18 13.740 -11.604 -8.391 1.00 0.00 C ATOM 0 H ALA B 18 14.111 -11.342 -10.817 1.00 0.00 H new ATOM 0 HA ALA B 18 13.409 -9.498 -8.717 1.00 0.00 H new ATOM 0 HB1 ALA B 18 13.687 -11.519 -7.306 1.00 0.00 H new ATOM 0 HB2 ALA B 18 12.765 -11.898 -8.780 1.00 0.00 H new ATOM 0 HB3 ALA B 18 14.480 -12.358 -8.660 1.00 0.00 H new ATOM 1568 N LYS B 19 16.564 -10.347 -9.035 1.00 0.00 N ATOM 1569 CA LYS B 19 17.932 -9.997 -8.556 1.00 0.00 C ATOM 1570 C LYS B 19 18.175 -8.493 -8.713 1.00 0.00 C ATOM 1571 O LYS B 19 18.692 -7.845 -7.825 1.00 0.00 O ATOM 1572 CB LYS B 19 18.962 -10.769 -9.384 1.00 0.00 C ATOM 1573 CG LYS B 19 20.363 -10.522 -8.826 1.00 0.00 C ATOM 1574 CD LYS B 19 21.375 -11.355 -9.614 1.00 0.00 C ATOM 1575 CE LYS B 19 22.774 -11.138 -9.039 1.00 0.00 C ATOM 1576 NZ LYS B 19 23.134 -9.695 -9.146 1.00 0.00 N ATOM 0 H LYS B 19 16.535 -10.991 -9.825 1.00 0.00 H new ATOM 0 HA LYS B 19 18.026 -10.262 -7.503 1.00 0.00 H new ATOM 0 HB2 LYS B 19 18.735 -11.835 -9.363 1.00 0.00 H new ATOM 0 HB3 LYS B 19 18.915 -10.454 -10.426 1.00 0.00 H new ATOM 0 HG2 LYS B 19 20.613 -9.463 -8.896 1.00 0.00 H new ATOM 0 HG3 LYS B 19 20.399 -10.789 -7.770 1.00 0.00 H new ATOM 0 HD2 LYS B 19 21.110 -12.411 -9.564 1.00 0.00 H new ATOM 0 HD3 LYS B 19 21.355 -11.071 -10.666 1.00 0.00 H new ATOM 0 HE2 LYS B 19 22.804 -11.456 -7.997 1.00 0.00 H new ATOM 0 HE3 LYS B 19 23.500 -11.746 -9.579 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 24.167 -9.589 -9.083 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 22.803 -9.321 -10.058 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 22.684 -9.167 -8.371 1.00 0.00 H new ATOM 1590 N SER B 20 17.814 -7.933 -9.835 1.00 0.00 N ATOM 1591 CA SER B 20 18.032 -6.473 -10.043 1.00 0.00 C ATOM 1592 C SER B 20 17.244 -5.668 -9.008 1.00 0.00 C ATOM 1593 O SER B 20 17.765 -4.770 -8.370 1.00 0.00 O ATOM 1594 CB SER B 20 17.545 -6.107 -11.443 1.00 0.00 C ATOM 1595 OG SER B 20 17.738 -4.718 -11.665 1.00 0.00 O ATOM 0 H SER B 20 17.378 -8.423 -10.616 1.00 0.00 H new ATOM 0 HA SER B 20 19.092 -6.242 -9.934 1.00 0.00 H new ATOM 0 HB2 SER B 20 18.089 -6.684 -12.191 1.00 0.00 H new ATOM 0 HB3 SER B 20 16.490 -6.360 -11.550 1.00 0.00 H new ATOM 0 HG SER B 20 17.427 -4.484 -12.564 1.00 0.00 H new ATOM 1601 N VAL B 21 15.993 -5.988 -8.830 1.00 0.00 N ATOM 1602 CA VAL B 21 15.170 -5.245 -7.842 1.00 0.00 C ATOM 1603 C VAL B 21 15.735 -5.475 -6.441 1.00 0.00 C ATOM 1604 O VAL B 21 15.863 -4.561 -5.651 1.00 0.00 O ATOM 1605 CB VAL B 21 13.732 -5.755 -7.907 1.00 0.00 C ATOM 1606 CG1 VAL B 21 12.897 -5.058 -6.838 1.00 0.00 C ATOM 1607 CG2 VAL B 21 13.143 -5.456 -9.287 1.00 0.00 C ATOM 0 H VAL B 21 15.506 -6.733 -9.328 1.00 0.00 H new ATOM 0 HA VAL B 21 15.189 -4.179 -8.068 1.00 0.00 H new ATOM 0 HB VAL B 21 13.722 -6.831 -7.734 1.00 0.00 H new ATOM 0 HG11 VAL B 21 11.870 -5.422 -6.884 1.00 0.00 H new ATOM 0 HG12 VAL B 21 13.314 -5.272 -5.854 1.00 0.00 H new ATOM 0 HG13 VAL B 21 12.909 -3.982 -7.011 1.00 0.00 H new ATOM 0 HG21 VAL B 21 12.117 -5.821 -9.331 1.00 0.00 H new ATOM 0 HG22 VAL B 21 13.154 -4.380 -9.462 1.00 0.00 H new ATOM 0 HG23 VAL B 21 13.738 -5.954 -10.052 1.00 0.00 H new ATOM 1617 N ALA B 22 16.077 -6.692 -6.130 1.00 0.00 N ATOM 1618 CA ALA B 22 16.635 -6.994 -4.784 1.00 0.00 C ATOM 1619 C ALA B 22 17.941 -6.224 -4.580 1.00 0.00 C ATOM 1620 O ALA B 22 18.290 -5.864 -3.474 1.00 0.00 O ATOM 1621 CB ALA B 22 16.904 -8.494 -4.682 1.00 0.00 C ATOM 0 H ALA B 22 15.994 -7.495 -6.753 1.00 0.00 H new ATOM 0 HA ALA B 22 15.922 -6.694 -4.017 1.00 0.00 H new ATOM 0 HB1 ALA B 22 17.313 -8.724 -3.698 1.00 0.00 H new ATOM 0 HB2 ALA B 22 15.972 -9.041 -4.824 1.00 0.00 H new ATOM 0 HB3 ALA B 22 17.619 -8.789 -5.450 1.00 0.00 H new ATOM 1627 N GLU B 23 18.669 -5.968 -5.632 1.00 0.00 N ATOM 1628 CA GLU B 23 19.950 -5.226 -5.486 1.00 0.00 C ATOM 1629 C GLU B 23 19.649 -3.813 -4.977 1.00 0.00 C ATOM 1630 O GLU B 23 20.299 -3.310 -4.083 1.00 0.00 O ATOM 1631 CB GLU B 23 20.642 -5.151 -6.861 1.00 0.00 C ATOM 1632 CG GLU B 23 22.167 -5.038 -6.693 1.00 0.00 C ATOM 1633 CD GLU B 23 22.769 -6.430 -6.467 1.00 0.00 C ATOM 1634 OE1 GLU B 23 22.142 -7.221 -5.782 1.00 0.00 O ATOM 1635 OE2 GLU B 23 23.846 -6.678 -6.984 1.00 0.00 O ATOM 0 H GLU B 23 18.431 -6.241 -6.586 1.00 0.00 H new ATOM 0 HA GLU B 23 20.605 -5.734 -4.778 1.00 0.00 H new ATOM 0 HB2 GLU B 23 20.400 -6.039 -7.445 1.00 0.00 H new ATOM 0 HB3 GLU B 23 20.267 -4.292 -7.417 1.00 0.00 H new ATOM 0 HG2 GLU B 23 22.607 -4.581 -7.579 1.00 0.00 H new ATOM 0 HG3 GLU B 23 22.402 -4.389 -5.850 1.00 0.00 H new ATOM 1642 N GLU B 24 18.665 -3.172 -5.545 1.00 0.00 N ATOM 1643 CA GLU B 24 18.320 -1.790 -5.102 1.00 0.00 C ATOM 1644 C GLU B 24 17.501 -1.856 -3.810 1.00 0.00 C ATOM 1645 O GLU B 24 17.754 -1.143 -2.859 1.00 0.00 O ATOM 1646 CB GLU B 24 17.499 -1.090 -6.194 1.00 0.00 C ATOM 1647 CG GLU B 24 18.040 -1.467 -7.580 1.00 0.00 C ATOM 1648 CD GLU B 24 19.492 -1.003 -7.715 1.00 0.00 C ATOM 1649 OE1 GLU B 24 19.911 -0.186 -6.911 1.00 0.00 O ATOM 1650 OE2 GLU B 24 20.158 -1.471 -8.622 1.00 0.00 O ATOM 0 H GLU B 24 18.085 -3.545 -6.297 1.00 0.00 H new ATOM 0 HA GLU B 24 19.237 -1.228 -4.922 1.00 0.00 H new ATOM 0 HB2 GLU B 24 16.451 -1.378 -6.113 1.00 0.00 H new ATOM 0 HB3 GLU B 24 17.544 -0.009 -6.058 1.00 0.00 H new ATOM 0 HG2 GLU B 24 17.979 -2.546 -7.723 1.00 0.00 H new ATOM 0 HG3 GLU B 24 17.428 -1.007 -8.356 1.00 0.00 H new ATOM 1657 N MET B 25 16.519 -2.710 -3.780 1.00 0.00 N ATOM 1658 CA MET B 25 15.665 -2.840 -2.570 1.00 0.00 C ATOM 1659 C MET B 25 16.507 -3.364 -1.405 1.00 0.00 C ATOM 1660 O MET B 25 16.347 -2.942 -0.278 1.00 0.00 O ATOM 1661 CB MET B 25 14.535 -3.824 -2.874 1.00 0.00 C ATOM 1662 CG MET B 25 13.484 -3.149 -3.760 1.00 0.00 C ATOM 1663 SD MET B 25 12.567 -1.918 -2.798 1.00 0.00 S ATOM 1664 CE MET B 25 11.379 -3.050 -2.021 1.00 0.00 C ATOM 0 H MET B 25 16.269 -3.330 -4.551 1.00 0.00 H new ATOM 0 HA MET B 25 15.249 -1.870 -2.299 1.00 0.00 H new ATOM 0 HB2 MET B 25 14.934 -4.706 -3.375 1.00 0.00 H new ATOM 0 HB3 MET B 25 14.077 -4.164 -1.945 1.00 0.00 H new ATOM 0 HG2 MET B 25 13.967 -2.671 -4.613 1.00 0.00 H new ATOM 0 HG3 MET B 25 12.798 -3.896 -4.159 1.00 0.00 H new ATOM 0 HE1 MET B 25 11.264 -2.790 -0.969 1.00 0.00 H new ATOM 0 HE2 MET B 25 10.415 -2.967 -2.523 1.00 0.00 H new ATOM 0 HE3 MET B 25 11.744 -4.074 -2.104 1.00 0.00 H new ATOM 1674 N GLY B 26 17.393 -4.290 -1.663 1.00 0.00 N ATOM 1675 CA GLY B 26 18.231 -4.840 -0.560 1.00 0.00 C ATOM 1676 C GLY B 26 17.453 -5.940 0.168 1.00 0.00 C ATOM 1677 O GLY B 26 17.610 -6.131 1.357 1.00 0.00 O ATOM 0 H GLY B 26 17.571 -4.687 -2.586 1.00 0.00 H new ATOM 0 HA2 GLY B 26 19.162 -5.242 -0.961 1.00 0.00 H new ATOM 0 HA3 GLY B 26 18.500 -4.047 0.138 1.00 0.00 H new ATOM 1681 N ILE B 27 16.609 -6.660 -0.537 1.00 0.00 N ATOM 1682 CA ILE B 27 15.800 -7.752 0.104 1.00 0.00 C ATOM 1683 C ILE B 27 16.090 -9.085 -0.584 1.00 0.00 C ATOM 1684 O ILE B 27 16.710 -9.141 -1.625 1.00 0.00 O ATOM 1685 CB ILE B 27 14.307 -7.426 -0.022 1.00 0.00 C ATOM 1686 CG1 ILE B 27 13.919 -7.283 -1.500 1.00 0.00 C ATOM 1687 CG2 ILE B 27 14.012 -6.118 0.715 1.00 0.00 C ATOM 1688 CD1 ILE B 27 12.408 -7.071 -1.611 1.00 0.00 C ATOM 0 H ILE B 27 16.444 -6.538 -1.536 1.00 0.00 H new ATOM 0 HA ILE B 27 16.070 -7.825 1.158 1.00 0.00 H new ATOM 0 HB ILE B 27 13.725 -8.236 0.418 1.00 0.00 H new ATOM 0 HG12 ILE B 27 14.449 -6.442 -1.947 1.00 0.00 H new ATOM 0 HG13 ILE B 27 14.214 -8.175 -2.053 1.00 0.00 H new ATOM 0 HG21 ILE B 27 12.951 -5.882 0.628 1.00 0.00 H new ATOM 0 HG22 ILE B 27 14.274 -6.226 1.767 1.00 0.00 H new ATOM 0 HG23 ILE B 27 14.600 -5.312 0.275 1.00 0.00 H new ATOM 0 HD11 ILE B 27 12.131 -6.969 -2.660 1.00 0.00 H new ATOM 0 HD12 ILE B 27 11.888 -7.926 -1.180 1.00 0.00 H new ATOM 0 HD13 ILE B 27 12.127 -6.166 -1.072 1.00 0.00 H new ATOM 1700 N SER B 28 15.651 -10.161 0.002 1.00 0.00 N ATOM 1701 CA SER B 28 15.902 -11.497 -0.598 1.00 0.00 C ATOM 1702 C SER B 28 15.095 -11.654 -1.890 1.00 0.00 C ATOM 1703 O SER B 28 14.049 -11.060 -2.063 1.00 0.00 O ATOM 1704 CB SER B 28 15.475 -12.570 0.402 1.00 0.00 C ATOM 1705 OG SER B 28 16.460 -12.680 1.421 1.00 0.00 O ATOM 0 H SER B 28 15.126 -10.172 0.876 1.00 0.00 H new ATOM 0 HA SER B 28 16.962 -11.599 -0.831 1.00 0.00 H new ATOM 0 HB2 SER B 28 14.510 -12.313 0.839 1.00 0.00 H new ATOM 0 HB3 SER B 28 15.351 -13.527 -0.105 1.00 0.00 H new ATOM 0 HG SER B 28 16.189 -13.366 2.066 1.00 0.00 H new ATOM 1711 N ARG B 29 15.578 -12.465 -2.790 1.00 0.00 N ATOM 1712 CA ARG B 29 14.864 -12.695 -4.079 1.00 0.00 C ATOM 1713 C ARG B 29 13.515 -13.357 -3.782 1.00 0.00 C ATOM 1714 O ARG B 29 12.508 -13.049 -4.388 1.00 0.00 O ATOM 1715 CB ARG B 29 15.721 -13.631 -4.941 1.00 0.00 C ATOM 1716 CG ARG B 29 17.055 -12.941 -5.246 1.00 0.00 C ATOM 1717 CD ARG B 29 18.021 -13.919 -5.930 1.00 0.00 C ATOM 1718 NE ARG B 29 17.697 -14.024 -7.390 1.00 0.00 N ATOM 1719 CZ ARG B 29 17.296 -15.152 -7.942 1.00 0.00 C ATOM 1720 NH1 ARG B 29 17.120 -16.242 -7.234 1.00 0.00 N ATOM 1721 NH2 ARG B 29 17.070 -15.183 -9.227 1.00 0.00 N ATOM 0 H ARG B 29 16.449 -12.986 -2.686 1.00 0.00 H new ATOM 0 HA ARG B 29 14.698 -11.755 -4.605 1.00 0.00 H new ATOM 0 HB2 ARG B 29 15.894 -14.572 -4.419 1.00 0.00 H new ATOM 0 HB3 ARG B 29 15.201 -13.872 -5.868 1.00 0.00 H new ATOM 0 HG2 ARG B 29 16.886 -12.077 -5.889 1.00 0.00 H new ATOM 0 HG3 ARG B 29 17.498 -12.569 -4.322 1.00 0.00 H new ATOM 0 HD2 ARG B 29 19.048 -13.578 -5.801 1.00 0.00 H new ATOM 0 HD3 ARG B 29 17.949 -14.901 -5.462 1.00 0.00 H new ATOM 0 HE ARG B 29 17.790 -13.194 -7.976 1.00 0.00 H new ATOM 0 HH11 ARG B 29 17.294 -16.231 -6.229 1.00 0.00 H new ATOM 0 HH12 ARG B 29 16.809 -17.101 -7.688 1.00 0.00 H new ATOM 0 HH21 ARG B 29 17.204 -14.342 -9.789 1.00 0.00 H new ATOM 0 HH22 ARG B 29 16.759 -16.048 -9.669 1.00 0.00 H new ATOM 1735 N GLN B 30 13.495 -14.263 -2.839 1.00 0.00 N ATOM 1736 CA GLN B 30 12.225 -14.956 -2.479 1.00 0.00 C ATOM 1737 C GLN B 30 11.242 -13.953 -1.874 1.00 0.00 C ATOM 1738 O GLN B 30 10.058 -13.988 -2.144 1.00 0.00 O ATOM 1739 CB GLN B 30 12.521 -16.045 -1.448 1.00 0.00 C ATOM 1740 CG GLN B 30 13.403 -17.128 -2.075 1.00 0.00 C ATOM 1741 CD GLN B 30 12.611 -17.879 -3.147 1.00 0.00 C ATOM 1742 OE1 GLN B 30 12.528 -17.442 -4.279 1.00 0.00 O ATOM 1743 NE2 GLN B 30 12.021 -19.000 -2.834 1.00 0.00 N ATOM 0 H GLN B 30 14.311 -14.554 -2.300 1.00 0.00 H new ATOM 0 HA GLN B 30 11.789 -15.398 -3.375 1.00 0.00 H new ATOM 0 HB2 GLN B 30 13.022 -15.612 -0.582 1.00 0.00 H new ATOM 0 HB3 GLN B 30 11.589 -16.484 -1.091 1.00 0.00 H new ATOM 0 HG2 GLN B 30 14.292 -16.677 -2.515 1.00 0.00 H new ATOM 0 HG3 GLN B 30 13.744 -17.823 -1.307 1.00 0.00 H new ATOM 0 HE21 GLN B 30 12.091 -19.366 -1.884 1.00 0.00 H new ATOM 0 HE22 GLN B 30 11.490 -19.511 -3.539 1.00 0.00 H new ATOM 1752 N GLN B 31 11.723 -13.061 -1.053 1.00 0.00 N ATOM 1753 CA GLN B 31 10.821 -12.058 -0.424 1.00 0.00 C ATOM 1754 C GLN B 31 10.117 -11.256 -1.514 1.00 0.00 C ATOM 1755 O GLN B 31 8.936 -10.981 -1.430 1.00 0.00 O ATOM 1756 CB GLN B 31 11.653 -11.113 0.446 1.00 0.00 C ATOM 1757 CG GLN B 31 12.044 -11.822 1.744 1.00 0.00 C ATOM 1758 CD GLN B 31 10.839 -11.867 2.686 1.00 0.00 C ATOM 1759 OE1 GLN B 31 10.390 -12.930 3.067 1.00 0.00 O ATOM 1760 NE2 GLN B 31 10.296 -10.748 3.078 1.00 0.00 N ATOM 0 H GLN B 31 12.706 -12.984 -0.790 1.00 0.00 H new ATOM 0 HA GLN B 31 10.077 -12.565 0.191 1.00 0.00 H new ATOM 0 HB2 GLN B 31 12.547 -10.799 -0.093 1.00 0.00 H new ATOM 0 HB3 GLN B 31 11.083 -10.211 0.670 1.00 0.00 H new ATOM 0 HG2 GLN B 31 12.388 -12.834 1.529 1.00 0.00 H new ATOM 0 HG3 GLN B 31 12.872 -11.298 2.221 1.00 0.00 H new ATOM 0 HE21 GLN B 31 10.675 -9.857 2.757 1.00 0.00 H new ATOM 0 HE22 GLN B 31 9.492 -10.764 3.706 1.00 0.00 H new ATOM 1769 N LEU B 32 10.826 -10.879 -2.539 1.00 0.00 N ATOM 1770 CA LEU B 32 10.189 -10.097 -3.629 1.00 0.00 C ATOM 1771 C LEU B 32 9.108 -10.956 -4.284 1.00 0.00 C ATOM 1772 O LEU B 32 8.029 -10.491 -4.590 1.00 0.00 O ATOM 1773 CB LEU B 32 11.248 -9.724 -4.671 1.00 0.00 C ATOM 1774 CG LEU B 32 10.661 -8.738 -5.701 1.00 0.00 C ATOM 1775 CD1 LEU B 32 10.734 -7.302 -5.166 1.00 0.00 C ATOM 1776 CD2 LEU B 32 11.468 -8.819 -6.997 1.00 0.00 C ATOM 0 H LEU B 32 11.818 -11.079 -2.668 1.00 0.00 H new ATOM 0 HA LEU B 32 9.745 -9.187 -3.225 1.00 0.00 H new ATOM 0 HB2 LEU B 32 12.111 -9.275 -4.178 1.00 0.00 H new ATOM 0 HB3 LEU B 32 11.602 -10.622 -5.178 1.00 0.00 H new ATOM 0 HG LEU B 32 9.620 -9.003 -5.885 1.00 0.00 H new ATOM 0 HD11 LEU B 32 10.316 -6.617 -5.904 1.00 0.00 H new ATOM 0 HD12 LEU B 32 10.164 -7.229 -4.240 1.00 0.00 H new ATOM 0 HD13 LEU B 32 11.774 -7.038 -4.974 1.00 0.00 H new ATOM 0 HD21 LEU B 32 11.055 -8.123 -7.727 1.00 0.00 H new ATOM 0 HD22 LEU B 32 12.507 -8.559 -6.795 1.00 0.00 H new ATOM 0 HD23 LEU B 32 11.418 -9.833 -7.394 1.00 0.00 H new ATOM 1788 N CYS B 33 9.389 -12.212 -4.491 1.00 0.00 N ATOM 1789 CA CYS B 33 8.382 -13.110 -5.118 1.00 0.00 C ATOM 1790 C CYS B 33 7.144 -13.177 -4.225 1.00 0.00 C ATOM 1791 O CYS B 33 6.030 -13.294 -4.696 1.00 0.00 O ATOM 1792 CB CYS B 33 8.982 -14.509 -5.273 1.00 0.00 C ATOM 1793 SG CYS B 33 10.364 -14.442 -6.440 1.00 0.00 S ATOM 0 H CYS B 33 10.276 -12.656 -4.252 1.00 0.00 H new ATOM 0 HA CYS B 33 8.102 -12.726 -6.099 1.00 0.00 H new ATOM 0 HB2 CYS B 33 9.325 -14.879 -4.307 1.00 0.00 H new ATOM 0 HB3 CYS B 33 8.223 -15.205 -5.630 1.00 0.00 H new ATOM 0 HG CYS B 33 11.396 -13.905 -5.860 1.00 0.00 H new ATOM 1799 N ASN B 34 7.333 -13.103 -2.938 1.00 0.00 N ATOM 1800 CA ASN B 34 6.178 -13.160 -2.003 1.00 0.00 C ATOM 1801 C ASN B 34 5.262 -11.961 -2.258 1.00 0.00 C ATOM 1802 O ASN B 34 4.054 -12.071 -2.209 1.00 0.00 O ATOM 1803 CB ASN B 34 6.695 -13.120 -0.565 1.00 0.00 C ATOM 1804 CG ASN B 34 5.577 -13.530 0.393 1.00 0.00 C ATOM 1805 OD1 ASN B 34 4.468 -13.798 -0.025 1.00 0.00 O ATOM 1806 ND2 ASN B 34 5.825 -13.598 1.673 1.00 0.00 N ATOM 0 H ASN B 34 8.245 -13.005 -2.491 1.00 0.00 H new ATOM 0 HA ASN B 34 5.617 -14.081 -2.161 1.00 0.00 H new ATOM 0 HB2 ASN B 34 7.546 -13.792 -0.455 1.00 0.00 H new ATOM 0 HB3 ASN B 34 7.047 -12.117 -0.322 1.00 0.00 H new ATOM 0 HD21 ASN B 34 5.088 -13.876 2.321 1.00 0.00 H new ATOM 0 HD22 ASN B 34 6.756 -13.373 2.025 1.00 0.00 H new ATOM 1813 N ILE B 35 5.826 -10.816 -2.532 1.00 0.00 N ATOM 1814 CA ILE B 35 4.982 -9.617 -2.787 1.00 0.00 C ATOM 1815 C ILE B 35 4.123 -9.869 -4.030 1.00 0.00 C ATOM 1816 O ILE B 35 2.945 -9.577 -4.053 1.00 0.00 O ATOM 1817 CB ILE B 35 5.888 -8.405 -3.034 1.00 0.00 C ATOM 1818 CG1 ILE B 35 6.646 -8.064 -1.745 1.00 0.00 C ATOM 1819 CG2 ILE B 35 5.036 -7.206 -3.461 1.00 0.00 C ATOM 1820 CD1 ILE B 35 7.701 -6.990 -2.033 1.00 0.00 C ATOM 0 H ILE B 35 6.832 -10.660 -2.590 1.00 0.00 H new ATOM 0 HA ILE B 35 4.341 -9.424 -1.927 1.00 0.00 H new ATOM 0 HB ILE B 35 6.602 -8.640 -3.824 1.00 0.00 H new ATOM 0 HG12 ILE B 35 5.949 -7.708 -0.986 1.00 0.00 H new ATOM 0 HG13 ILE B 35 7.124 -8.959 -1.345 1.00 0.00 H new ATOM 0 HG21 ILE B 35 5.681 -6.345 -3.636 1.00 0.00 H new ATOM 0 HG22 ILE B 35 4.499 -7.449 -4.378 1.00 0.00 H new ATOM 0 HG23 ILE B 35 4.321 -6.969 -2.673 1.00 0.00 H new ATOM 0 HD11 ILE B 35 8.237 -6.751 -1.114 1.00 0.00 H new ATOM 0 HD12 ILE B 35 8.405 -7.362 -2.778 1.00 0.00 H new ATOM 0 HD13 ILE B 35 7.212 -6.092 -2.412 1.00 0.00 H new ATOM 1832 N GLU B 36 4.708 -10.412 -5.062 1.00 0.00 N ATOM 1833 CA GLU B 36 3.938 -10.687 -6.308 1.00 0.00 C ATOM 1834 C GLU B 36 2.990 -11.869 -6.088 1.00 0.00 C ATOM 1835 O GLU B 36 1.937 -11.950 -6.687 1.00 0.00 O ATOM 1836 CB GLU B 36 4.911 -11.013 -7.440 1.00 0.00 C ATOM 1837 CG GLU B 36 5.822 -9.808 -7.685 1.00 0.00 C ATOM 1838 CD GLU B 36 6.718 -10.085 -8.893 1.00 0.00 C ATOM 1839 OE1 GLU B 36 6.184 -10.216 -9.982 1.00 0.00 O ATOM 1840 OE2 GLU B 36 7.920 -10.163 -8.708 1.00 0.00 O ATOM 0 H GLU B 36 5.692 -10.679 -5.096 1.00 0.00 H new ATOM 0 HA GLU B 36 3.351 -9.807 -6.570 1.00 0.00 H new ATOM 0 HB2 GLU B 36 5.507 -11.888 -7.182 1.00 0.00 H new ATOM 0 HB3 GLU B 36 4.361 -11.259 -8.348 1.00 0.00 H new ATOM 0 HG2 GLU B 36 5.222 -8.915 -7.860 1.00 0.00 H new ATOM 0 HG3 GLU B 36 6.432 -9.614 -6.803 1.00 0.00 H new ATOM 1847 N GLN B 37 3.360 -12.792 -5.241 1.00 0.00 N ATOM 1848 CA GLN B 37 2.489 -13.978 -4.984 1.00 0.00 C ATOM 1849 C GLN B 37 1.598 -13.706 -3.770 1.00 0.00 C ATOM 1850 O GLN B 37 0.981 -14.602 -3.229 1.00 0.00 O ATOM 1851 CB GLN B 37 3.375 -15.195 -4.700 1.00 0.00 C ATOM 1852 CG GLN B 37 4.201 -15.535 -5.945 1.00 0.00 C ATOM 1853 CD GLN B 37 3.271 -15.975 -7.077 1.00 0.00 C ATOM 1854 OE1 GLN B 37 2.491 -16.894 -6.914 1.00 0.00 O ATOM 1855 NE2 GLN B 37 3.318 -15.354 -8.223 1.00 0.00 N ATOM 0 H GLN B 37 4.232 -12.776 -4.713 1.00 0.00 H new ATOM 0 HA GLN B 37 1.863 -14.170 -5.856 1.00 0.00 H new ATOM 0 HB2 GLN B 37 4.036 -14.987 -3.859 1.00 0.00 H new ATOM 0 HB3 GLN B 37 2.758 -16.048 -4.417 1.00 0.00 H new ATOM 0 HG2 GLN B 37 4.782 -14.667 -6.256 1.00 0.00 H new ATOM 0 HG3 GLN B 37 4.912 -16.329 -5.716 1.00 0.00 H new ATOM 0 HE21 GLN B 37 3.972 -14.583 -8.359 1.00 0.00 H new ATOM 0 HE22 GLN B 37 2.700 -15.639 -8.983 1.00 0.00 H new ATOM 1864 N SER B 38 1.535 -12.479 -3.330 1.00 0.00 N ATOM 1865 CA SER B 38 0.698 -12.154 -2.140 1.00 0.00 C ATOM 1866 C SER B 38 -0.789 -12.303 -2.474 1.00 0.00 C ATOM 1867 O SER B 38 -1.199 -12.201 -3.612 1.00 0.00 O ATOM 1868 CB SER B 38 0.973 -10.714 -1.715 1.00 0.00 C ATOM 1869 OG SER B 38 0.206 -9.834 -2.526 1.00 0.00 O ATOM 0 H SER B 38 2.027 -11.687 -3.743 1.00 0.00 H new ATOM 0 HA SER B 38 0.949 -12.841 -1.332 1.00 0.00 H new ATOM 0 HB2 SER B 38 0.716 -10.577 -0.665 1.00 0.00 H new ATOM 0 HB3 SER B 38 2.035 -10.489 -1.816 1.00 0.00 H new ATOM 0 HG SER B 38 0.778 -9.447 -3.221 1.00 0.00 H new ATOM 1875 N GLU B 39 -1.597 -12.540 -1.476 1.00 0.00 N ATOM 1876 CA GLU B 39 -3.060 -12.694 -1.708 1.00 0.00 C ATOM 1877 C GLU B 39 -3.670 -11.345 -2.110 1.00 0.00 C ATOM 1878 O GLU B 39 -4.559 -11.280 -2.934 1.00 0.00 O ATOM 1879 CB GLU B 39 -3.732 -13.199 -0.425 1.00 0.00 C ATOM 1880 CG GLU B 39 -3.181 -12.432 0.785 1.00 0.00 C ATOM 1881 CD GLU B 39 -4.135 -12.584 1.971 1.00 0.00 C ATOM 1882 OE1 GLU B 39 -4.237 -13.682 2.489 1.00 0.00 O ATOM 1883 OE2 GLU B 39 -4.746 -11.594 2.341 1.00 0.00 O ATOM 0 H GLU B 39 -1.303 -12.634 -0.504 1.00 0.00 H new ATOM 0 HA GLU B 39 -3.221 -13.413 -2.511 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -4.812 -13.065 -0.492 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -3.550 -14.267 -0.304 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -2.194 -12.811 1.049 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -3.061 -11.378 0.535 1.00 0.00 H new ATOM 1890 N THR B 40 -3.211 -10.269 -1.530 1.00 0.00 N ATOM 1891 CA THR B 40 -3.777 -8.936 -1.880 1.00 0.00 C ATOM 1892 C THR B 40 -2.868 -7.835 -1.336 1.00 0.00 C ATOM 1893 O THR B 40 -1.993 -8.078 -0.528 1.00 0.00 O ATOM 1894 CB THR B 40 -5.171 -8.792 -1.265 1.00 0.00 C ATOM 1895 OG1 THR B 40 -6.011 -9.835 -1.740 1.00 0.00 O ATOM 1896 CG2 THR B 40 -5.769 -7.437 -1.653 1.00 0.00 C ATOM 0 H THR B 40 -2.469 -10.256 -0.830 1.00 0.00 H new ATOM 0 HA THR B 40 -3.847 -8.849 -2.964 1.00 0.00 H new ATOM 0 HB THR B 40 -5.093 -8.854 -0.180 1.00 0.00 H new ATOM 0 HG1 THR B 40 -5.645 -10.195 -2.575 1.00 0.00 H new ATOM 0 HG21 THR B 40 -6.761 -7.338 -1.213 1.00 0.00 H new ATOM 0 HG22 THR B 40 -5.127 -6.637 -1.284 1.00 0.00 H new ATOM 0 HG23 THR B 40 -5.845 -7.370 -2.738 1.00 0.00 H new ATOM 1904 N ALA B 41 -3.070 -6.623 -1.772 1.00 0.00 N ATOM 1905 CA ALA B 41 -2.219 -5.500 -1.285 1.00 0.00 C ATOM 1906 C ALA B 41 -2.790 -4.963 0.043 1.00 0.00 C ATOM 1907 O ALA B 41 -3.974 -5.069 0.299 1.00 0.00 O ATOM 1908 CB ALA B 41 -2.230 -4.389 -2.342 1.00 0.00 C ATOM 0 H ALA B 41 -3.789 -6.360 -2.446 1.00 0.00 H new ATOM 0 HA ALA B 41 -1.198 -5.844 -1.118 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -1.612 -3.558 -2.003 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -1.834 -4.776 -3.281 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -3.252 -4.042 -2.495 1.00 0.00 H new ATOM 1914 N PRO B 42 -1.956 -4.386 0.880 1.00 0.00 N ATOM 1915 CA PRO B 42 -2.391 -3.820 2.198 1.00 0.00 C ATOM 1916 C PRO B 42 -3.372 -2.642 2.047 1.00 0.00 C ATOM 1917 O PRO B 42 -3.400 -1.964 1.041 1.00 0.00 O ATOM 1918 CB PRO B 42 -1.074 -3.369 2.865 1.00 0.00 C ATOM 1919 CG PRO B 42 -0.080 -3.238 1.749 1.00 0.00 C ATOM 1920 CD PRO B 42 -0.509 -4.223 0.664 1.00 0.00 C ATOM 0 HA PRO B 42 -2.939 -4.555 2.788 1.00 0.00 H new ATOM 0 HB2 PRO B 42 -1.204 -2.421 3.387 1.00 0.00 H new ATOM 0 HB3 PRO B 42 -0.740 -4.097 3.604 1.00 0.00 H new ATOM 0 HG2 PRO B 42 -0.064 -2.219 1.363 1.00 0.00 H new ATOM 0 HG3 PRO B 42 0.928 -3.462 2.099 1.00 0.00 H new ATOM 0 HD2 PRO B 42 -0.296 -3.836 -0.333 1.00 0.00 H new ATOM 0 HD3 PRO B 42 0.018 -5.173 0.757 1.00 0.00 H new ATOM 1928 N VAL B 43 -4.176 -2.404 3.053 1.00 0.00 N ATOM 1929 CA VAL B 43 -5.163 -1.286 2.996 1.00 0.00 C ATOM 1930 C VAL B 43 -4.439 0.060 2.889 1.00 0.00 C ATOM 1931 O VAL B 43 -4.970 1.019 2.365 1.00 0.00 O ATOM 1932 CB VAL B 43 -6.016 -1.300 4.270 1.00 0.00 C ATOM 1933 CG1 VAL B 43 -6.848 -2.582 4.315 1.00 0.00 C ATOM 1934 CG2 VAL B 43 -5.106 -1.259 5.498 1.00 0.00 C ATOM 0 H VAL B 43 -4.190 -2.943 3.919 1.00 0.00 H new ATOM 0 HA VAL B 43 -5.797 -1.418 2.119 1.00 0.00 H new ATOM 0 HB VAL B 43 -6.674 -0.431 4.268 1.00 0.00 H new ATOM 0 HG11 VAL B 43 -7.454 -2.591 5.221 1.00 0.00 H new ATOM 0 HG12 VAL B 43 -7.500 -2.624 3.442 1.00 0.00 H new ATOM 0 HG13 VAL B 43 -6.184 -3.447 4.314 1.00 0.00 H new ATOM 0 HG21 VAL B 43 -5.715 -1.269 6.402 1.00 0.00 H new ATOM 0 HG22 VAL B 43 -4.449 -2.129 5.493 1.00 0.00 H new ATOM 0 HG23 VAL B 43 -4.505 -0.350 5.475 1.00 0.00 H new ATOM 1944 N VAL B 44 -3.238 0.145 3.386 1.00 0.00 N ATOM 1945 CA VAL B 44 -2.497 1.435 3.321 1.00 0.00 C ATOM 1946 C VAL B 44 -2.459 1.919 1.867 1.00 0.00 C ATOM 1947 O VAL B 44 -2.561 3.097 1.591 1.00 0.00 O ATOM 1948 CB VAL B 44 -1.067 1.213 3.830 1.00 0.00 C ATOM 1949 CG1 VAL B 44 -0.270 0.392 2.805 1.00 0.00 C ATOM 1950 CG2 VAL B 44 -0.383 2.563 4.062 1.00 0.00 C ATOM 0 H VAL B 44 -2.737 -0.622 3.834 1.00 0.00 H new ATOM 0 HA VAL B 44 -2.992 2.184 3.939 1.00 0.00 H new ATOM 0 HB VAL B 44 -1.104 0.666 4.772 1.00 0.00 H new ATOM 0 HG11 VAL B 44 0.745 0.238 3.172 1.00 0.00 H new ATOM 0 HG12 VAL B 44 -0.753 -0.574 2.657 1.00 0.00 H new ATOM 0 HG13 VAL B 44 -0.235 0.929 1.857 1.00 0.00 H new ATOM 0 HG21 VAL B 44 0.632 2.399 4.423 1.00 0.00 H new ATOM 0 HG22 VAL B 44 -0.349 3.120 3.125 1.00 0.00 H new ATOM 0 HG23 VAL B 44 -0.944 3.133 4.803 1.00 0.00 H new ATOM 1960 N VAL B 45 -2.325 1.013 0.937 1.00 0.00 N ATOM 1961 CA VAL B 45 -2.292 1.413 -0.496 1.00 0.00 C ATOM 1962 C VAL B 45 -3.640 2.027 -0.871 1.00 0.00 C ATOM 1963 O VAL B 45 -3.711 3.052 -1.518 1.00 0.00 O ATOM 1964 CB VAL B 45 -2.029 0.176 -1.356 1.00 0.00 C ATOM 1965 CG1 VAL B 45 -2.152 0.545 -2.833 1.00 0.00 C ATOM 1966 CG2 VAL B 45 -0.616 -0.348 -1.077 1.00 0.00 C ATOM 0 H VAL B 45 -2.237 0.012 1.110 1.00 0.00 H new ATOM 0 HA VAL B 45 -1.500 2.143 -0.664 1.00 0.00 H new ATOM 0 HB VAL B 45 -2.759 -0.596 -1.113 1.00 0.00 H new ATOM 0 HG11 VAL B 45 -1.964 -0.337 -3.445 1.00 0.00 H new ATOM 0 HG12 VAL B 45 -3.157 0.918 -3.032 1.00 0.00 H new ATOM 0 HG13 VAL B 45 -1.423 1.318 -3.077 1.00 0.00 H new ATOM 0 HG21 VAL B 45 -0.427 -1.230 -1.689 1.00 0.00 H new ATOM 0 HG22 VAL B 45 0.113 0.425 -1.320 1.00 0.00 H new ATOM 0 HG23 VAL B 45 -0.527 -0.612 -0.023 1.00 0.00 H new ATOM 1976 N LYS B 46 -4.711 1.412 -0.453 1.00 0.00 N ATOM 1977 CA LYS B 46 -6.058 1.957 -0.769 1.00 0.00 C ATOM 1978 C LYS B 46 -6.207 3.339 -0.130 1.00 0.00 C ATOM 1979 O LYS B 46 -6.789 4.238 -0.702 1.00 0.00 O ATOM 1980 CB LYS B 46 -7.127 1.013 -0.217 1.00 0.00 C ATOM 1981 CG LYS B 46 -7.134 -0.281 -1.031 1.00 0.00 C ATOM 1982 CD LYS B 46 -8.181 -1.237 -0.458 1.00 0.00 C ATOM 1983 CE LYS B 46 -8.131 -2.562 -1.219 1.00 0.00 C ATOM 1984 NZ LYS B 46 -8.571 -2.342 -2.625 1.00 0.00 N ATOM 0 H LYS B 46 -4.710 0.552 0.096 1.00 0.00 H new ATOM 0 HA LYS B 46 -6.177 2.045 -1.849 1.00 0.00 H new ATOM 0 HB2 LYS B 46 -6.927 0.794 0.832 1.00 0.00 H new ATOM 0 HB3 LYS B 46 -8.106 1.489 -0.263 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -7.356 -0.065 -2.076 1.00 0.00 H new ATOM 0 HG3 LYS B 46 -6.148 -0.746 -1.004 1.00 0.00 H new ATOM 0 HD2 LYS B 46 -7.993 -1.407 0.602 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -9.175 -0.796 -0.539 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -7.119 -2.966 -1.202 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -8.775 -3.296 -0.735 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -8.798 -3.257 -3.065 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -9.415 -1.734 -2.634 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -7.807 -1.881 -3.160 1.00 0.00 H new ATOM 1998 N TYR B 47 -5.682 3.517 1.053 1.00 0.00 N ATOM 1999 CA TYR B 47 -5.793 4.841 1.725 1.00 0.00 C ATOM 2000 C TYR B 47 -5.138 5.902 0.836 1.00 0.00 C ATOM 2001 O TYR B 47 -5.711 6.940 0.552 1.00 0.00 O ATOM 2002 CB TYR B 47 -5.061 4.771 3.065 1.00 0.00 C ATOM 2003 CG TYR B 47 -5.292 6.047 3.834 1.00 0.00 C ATOM 2004 CD1 TYR B 47 -4.536 7.186 3.542 1.00 0.00 C ATOM 2005 CD2 TYR B 47 -6.269 6.090 4.836 1.00 0.00 C ATOM 2006 CE1 TYR B 47 -4.755 8.370 4.254 1.00 0.00 C ATOM 2007 CE2 TYR B 47 -6.488 7.276 5.546 1.00 0.00 C ATOM 2008 CZ TYR B 47 -5.731 8.415 5.255 1.00 0.00 C ATOM 2009 OH TYR B 47 -5.947 9.583 5.953 1.00 0.00 O ATOM 0 H TYR B 47 -5.182 2.802 1.581 1.00 0.00 H new ATOM 0 HA TYR B 47 -6.839 5.099 1.890 1.00 0.00 H new ATOM 0 HB2 TYR B 47 -5.417 3.917 3.642 1.00 0.00 H new ATOM 0 HB3 TYR B 47 -3.994 4.622 2.901 1.00 0.00 H new ATOM 0 HD1 TYR B 47 -3.784 7.152 2.768 1.00 0.00 H new ATOM 0 HD2 TYR B 47 -6.853 5.209 5.061 1.00 0.00 H new ATOM 0 HE1 TYR B 47 -4.170 9.250 4.031 1.00 0.00 H new ATOM 0 HE2 TYR B 47 -7.242 7.311 6.319 1.00 0.00 H new ATOM 0 HH TYR B 47 -6.660 9.444 6.611 1.00 0.00 H new ATOM 2019 N ILE B 48 -3.950 5.634 0.371 1.00 0.00 N ATOM 2020 CA ILE B 48 -3.259 6.601 -0.521 1.00 0.00 C ATOM 2021 C ILE B 48 -4.067 6.729 -1.810 1.00 0.00 C ATOM 2022 O ILE B 48 -4.262 7.809 -2.332 1.00 0.00 O ATOM 2023 CB ILE B 48 -1.852 6.096 -0.839 1.00 0.00 C ATOM 2024 CG1 ILE B 48 -1.094 5.838 0.466 1.00 0.00 C ATOM 2025 CG2 ILE B 48 -1.108 7.151 -1.656 1.00 0.00 C ATOM 2026 CD1 ILE B 48 0.197 5.075 0.161 1.00 0.00 C ATOM 0 H ILE B 48 -3.427 4.782 0.573 1.00 0.00 H new ATOM 0 HA ILE B 48 -3.179 7.572 -0.032 1.00 0.00 H new ATOM 0 HB ILE B 48 -1.919 5.170 -1.410 1.00 0.00 H new ATOM 0 HG12 ILE B 48 -0.864 6.783 0.959 1.00 0.00 H new ATOM 0 HG13 ILE B 48 -1.715 5.264 1.153 1.00 0.00 H new ATOM 0 HG21 ILE B 48 -0.104 6.793 -1.884 1.00 0.00 H new ATOM 0 HG22 ILE B 48 -1.646 7.338 -2.585 1.00 0.00 H new ATOM 0 HG23 ILE B 48 -1.042 8.076 -1.082 1.00 0.00 H new ATOM 0 HD11 ILE B 48 0.738 4.890 1.089 1.00 0.00 H new ATOM 0 HD12 ILE B 48 -0.046 4.124 -0.313 1.00 0.00 H new ATOM 0 HD13 ILE B 48 0.819 5.667 -0.510 1.00 0.00 H new ATOM 2038 N ALA B 49 -4.546 5.630 -2.322 1.00 0.00 N ATOM 2039 CA ALA B 49 -5.348 5.677 -3.573 1.00 0.00 C ATOM 2040 C ALA B 49 -6.517 6.640 -3.379 1.00 0.00 C ATOM 2041 O ALA B 49 -6.886 7.368 -4.279 1.00 0.00 O ATOM 2042 CB ALA B 49 -5.881 4.277 -3.877 1.00 0.00 C ATOM 0 H ALA B 49 -4.415 4.699 -1.926 1.00 0.00 H new ATOM 0 HA ALA B 49 -4.729 6.018 -4.402 1.00 0.00 H new ATOM 0 HB1 ALA B 49 -6.471 4.303 -4.793 1.00 0.00 H new ATOM 0 HB2 ALA B 49 -5.045 3.589 -4.003 1.00 0.00 H new ATOM 0 HB3 ALA B 49 -6.508 3.939 -3.052 1.00 0.00 H new ATOM 2048 N PHE B 50 -7.095 6.664 -2.210 1.00 0.00 N ATOM 2049 CA PHE B 50 -8.226 7.595 -1.968 1.00 0.00 C ATOM 2050 C PHE B 50 -7.712 9.017 -2.178 1.00 0.00 C ATOM 2051 O PHE B 50 -8.338 9.829 -2.829 1.00 0.00 O ATOM 2052 CB PHE B 50 -8.723 7.427 -0.531 1.00 0.00 C ATOM 2053 CG PHE B 50 -10.040 8.142 -0.359 1.00 0.00 C ATOM 2054 CD1 PHE B 50 -11.232 7.493 -0.704 1.00 0.00 C ATOM 2055 CD2 PHE B 50 -10.076 9.446 0.148 1.00 0.00 C ATOM 2056 CE1 PHE B 50 -12.459 8.145 -0.539 1.00 0.00 C ATOM 2057 CE2 PHE B 50 -11.303 10.100 0.311 1.00 0.00 C ATOM 2058 CZ PHE B 50 -12.495 9.450 -0.032 1.00 0.00 C ATOM 0 H PHE B 50 -6.832 6.080 -1.416 1.00 0.00 H new ATOM 0 HA PHE B 50 -9.051 7.387 -2.649 1.00 0.00 H new ATOM 0 HB2 PHE B 50 -8.840 6.369 -0.298 1.00 0.00 H new ATOM 0 HB3 PHE B 50 -7.988 7.827 0.167 1.00 0.00 H new ATOM 0 HD1 PHE B 50 -11.204 6.488 -1.098 1.00 0.00 H new ATOM 0 HD2 PHE B 50 -9.157 9.948 0.413 1.00 0.00 H new ATOM 0 HE1 PHE B 50 -13.378 7.642 -0.802 1.00 0.00 H new ATOM 0 HE2 PHE B 50 -11.330 11.107 0.702 1.00 0.00 H new ATOM 0 HZ PHE B 50 -13.441 9.955 0.094 1.00 0.00 H new ATOM 2068 N LEU B 51 -6.560 9.314 -1.638 1.00 0.00 N ATOM 2069 CA LEU B 51 -5.979 10.676 -1.811 1.00 0.00 C ATOM 2070 C LEU B 51 -5.691 10.919 -3.295 1.00 0.00 C ATOM 2071 O LEU B 51 -5.938 11.988 -3.818 1.00 0.00 O ATOM 2072 CB LEU B 51 -4.679 10.772 -1.011 1.00 0.00 C ATOM 2073 CG LEU B 51 -4.983 10.733 0.493 1.00 0.00 C ATOM 2074 CD1 LEU B 51 -3.665 10.608 1.259 1.00 0.00 C ATOM 2075 CD2 LEU B 51 -5.722 12.016 0.931 1.00 0.00 C ATOM 0 H LEU B 51 -5.996 8.670 -1.083 1.00 0.00 H new ATOM 0 HA LEU B 51 -6.683 11.427 -1.453 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -4.017 9.948 -1.278 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -4.156 11.695 -1.261 1.00 0.00 H new ATOM 0 HG LEU B 51 -5.624 9.878 0.709 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -3.868 10.579 2.330 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -3.157 9.691 0.961 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -3.030 11.465 1.033 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -5.929 11.970 2.000 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -5.099 12.885 0.719 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -6.661 12.100 0.383 1.00 0.00 H new ATOM 2087 N ARG B 52 -5.175 9.937 -3.982 1.00 0.00 N ATOM 2088 CA ARG B 52 -4.881 10.116 -5.432 1.00 0.00 C ATOM 2089 C ARG B 52 -6.194 10.276 -6.191 1.00 0.00 C ATOM 2090 O ARG B 52 -6.244 10.881 -7.242 1.00 0.00 O ATOM 2091 CB ARG B 52 -4.113 8.884 -5.940 1.00 0.00 C ATOM 2092 CG ARG B 52 -3.962 8.897 -7.478 1.00 0.00 C ATOM 2093 CD ARG B 52 -3.158 10.127 -7.964 1.00 0.00 C ATOM 2094 NE ARG B 52 -4.100 11.105 -8.605 1.00 0.00 N ATOM 2095 CZ ARG B 52 -4.264 11.125 -9.911 1.00 0.00 C ATOM 2096 NH1 ARG B 52 -3.654 10.255 -10.670 1.00 0.00 N ATOM 2097 NH2 ARG B 52 -5.066 12.002 -10.459 1.00 0.00 N ATOM 0 H ARG B 52 -4.944 9.019 -3.602 1.00 0.00 H new ATOM 0 HA ARG B 52 -4.272 11.006 -5.590 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -3.126 8.855 -5.478 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -4.636 7.978 -5.634 1.00 0.00 H new ATOM 0 HG2 ARG B 52 -3.462 7.984 -7.802 1.00 0.00 H new ATOM 0 HG3 ARG B 52 -4.949 8.901 -7.941 1.00 0.00 H new ATOM 0 HD2 ARG B 52 -2.643 10.595 -7.125 1.00 0.00 H new ATOM 0 HD3 ARG B 52 -2.393 9.819 -8.677 1.00 0.00 H new ATOM 0 HE ARG B 52 -4.619 11.761 -8.022 1.00 0.00 H new ATOM 0 HH11 ARG B 52 -3.044 9.552 -10.252 1.00 0.00 H new ATOM 0 HH12 ARG B 52 -3.787 10.278 -11.681 1.00 0.00 H new ATOM 0 HH21 ARG B 52 -5.565 12.672 -9.874 1.00 0.00 H new ATOM 0 HH22 ARG B 52 -5.192 12.016 -11.471 1.00 0.00 H new ATOM 2111 N SER B 53 -7.263 9.747 -5.669 1.00 0.00 N ATOM 2112 CA SER B 53 -8.565 9.882 -6.368 1.00 0.00 C ATOM 2113 C SER B 53 -8.953 11.359 -6.424 1.00 0.00 C ATOM 2114 O SER B 53 -9.709 11.782 -7.276 1.00 0.00 O ATOM 2115 CB SER B 53 -9.631 9.098 -5.610 1.00 0.00 C ATOM 2116 OG SER B 53 -10.065 9.856 -4.490 1.00 0.00 O ATOM 0 H SER B 53 -7.290 9.229 -4.791 1.00 0.00 H new ATOM 0 HA SER B 53 -8.483 9.489 -7.381 1.00 0.00 H new ATOM 0 HB2 SER B 53 -10.474 8.882 -6.266 1.00 0.00 H new ATOM 0 HB3 SER B 53 -9.229 8.140 -5.281 1.00 0.00 H new ATOM 0 HG SER B 53 -9.311 10.000 -3.881 1.00 0.00 H new ATOM 2122 N LYS B 54 -8.427 12.153 -5.529 1.00 0.00 N ATOM 2123 CA LYS B 54 -8.746 13.608 -5.530 1.00 0.00 C ATOM 2124 C LYS B 54 -7.677 14.352 -6.330 1.00 0.00 C ATOM 2125 O LYS B 54 -7.707 15.560 -6.453 1.00 0.00 O ATOM 2126 CB LYS B 54 -8.771 14.117 -4.088 1.00 0.00 C ATOM 2127 CG LYS B 54 -9.989 13.530 -3.368 1.00 0.00 C ATOM 2128 CD LYS B 54 -10.025 14.034 -1.925 1.00 0.00 C ATOM 2129 CE LYS B 54 -11.284 13.509 -1.232 1.00 0.00 C ATOM 2130 NZ LYS B 54 -11.324 14.005 0.173 1.00 0.00 N ATOM 0 H LYS B 54 -7.787 11.853 -4.794 1.00 0.00 H new ATOM 0 HA LYS B 54 -9.721 13.779 -5.987 1.00 0.00 H new ATOM 0 HB2 LYS B 54 -7.855 13.829 -3.572 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -8.816 15.206 -4.075 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -10.904 13.817 -3.887 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -9.943 12.441 -3.382 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -9.136 13.700 -1.390 1.00 0.00 H new ATOM 0 HD3 LYS B 54 -10.016 15.124 -1.909 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -12.172 13.839 -1.770 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -11.291 12.419 -1.244 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -11.864 13.338 0.761 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 -10.354 14.085 0.541 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 -11.782 14.938 0.199 1.00 0.00 H new ATOM 2144 N GLY B 55 -6.735 13.634 -6.890 1.00 0.00 N ATOM 2145 CA GLY B 55 -5.669 14.292 -7.699 1.00 0.00 C ATOM 2146 C GLY B 55 -4.522 14.758 -6.801 1.00 0.00 C ATOM 2147 O GLY B 55 -3.810 15.683 -7.137 1.00 0.00 O ATOM 0 H GLY B 55 -6.660 12.619 -6.820 1.00 0.00 H new ATOM 0 HA2 GLY B 55 -5.292 13.596 -8.448 1.00 0.00 H new ATOM 0 HA3 GLY B 55 -6.086 15.144 -8.236 1.00 0.00 H new ATOM 2151 N VAL B 56 -4.323 14.139 -5.671 1.00 0.00 N ATOM 2152 CA VAL B 56 -3.206 14.584 -4.791 1.00 0.00 C ATOM 2153 C VAL B 56 -1.871 14.245 -5.465 1.00 0.00 C ATOM 2154 O VAL B 56 -1.654 13.144 -5.922 1.00 0.00 O ATOM 2155 CB VAL B 56 -3.322 13.888 -3.434 1.00 0.00 C ATOM 2156 CG1 VAL B 56 -2.080 14.179 -2.585 1.00 0.00 C ATOM 2157 CG2 VAL B 56 -4.562 14.429 -2.721 1.00 0.00 C ATOM 0 H VAL B 56 -4.876 13.356 -5.322 1.00 0.00 H new ATOM 0 HA VAL B 56 -3.256 15.661 -4.633 1.00 0.00 H new ATOM 0 HB VAL B 56 -3.403 12.811 -3.578 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -2.173 13.679 -1.621 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -1.193 13.812 -3.100 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -1.990 15.254 -2.429 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -4.663 13.945 -1.750 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -4.461 15.505 -2.581 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -5.447 14.223 -3.323 1.00 0.00 H new ATOM 2167 N ASP B 57 -0.985 15.204 -5.547 1.00 0.00 N ATOM 2168 CA ASP B 57 0.330 14.971 -6.215 1.00 0.00 C ATOM 2169 C ASP B 57 1.091 13.827 -5.546 1.00 0.00 C ATOM 2170 O ASP B 57 1.727 14.002 -4.527 1.00 0.00 O ATOM 2171 CB ASP B 57 1.159 16.248 -6.114 1.00 0.00 C ATOM 2172 CG ASP B 57 0.514 17.333 -6.976 1.00 0.00 C ATOM 2173 OD1 ASP B 57 0.586 17.218 -8.187 1.00 0.00 O ATOM 2174 OD2 ASP B 57 -0.045 18.257 -6.409 1.00 0.00 O ATOM 0 H ASP B 57 -1.118 16.145 -5.177 1.00 0.00 H new ATOM 0 HA ASP B 57 0.154 14.703 -7.257 1.00 0.00 H new ATOM 0 HB2 ASP B 57 1.217 16.577 -5.077 1.00 0.00 H new ATOM 0 HB3 ASP B 57 2.180 16.061 -6.447 1.00 0.00 H new ATOM 2179 N LEU B 58 1.050 12.657 -6.128 1.00 0.00 N ATOM 2180 CA LEU B 58 1.789 11.498 -5.550 1.00 0.00 C ATOM 2181 C LEU B 58 3.186 11.462 -6.187 1.00 0.00 C ATOM 2182 O LEU B 58 4.087 10.800 -5.712 1.00 0.00 O ATOM 2183 CB LEU B 58 1.006 10.199 -5.874 1.00 0.00 C ATOM 2184 CG LEU B 58 0.842 9.328 -4.614 1.00 0.00 C ATOM 2185 CD1 LEU B 58 -0.297 9.876 -3.754 1.00 0.00 C ATOM 2186 CD2 LEU B 58 0.524 7.881 -5.019 1.00 0.00 C ATOM 0 H LEU B 58 0.533 12.454 -6.984 1.00 0.00 H new ATOM 0 HA LEU B 58 1.886 11.588 -4.468 1.00 0.00 H new ATOM 0 HB2 LEU B 58 0.025 10.452 -6.277 1.00 0.00 H new ATOM 0 HB3 LEU B 58 1.532 9.635 -6.645 1.00 0.00 H new ATOM 0 HG LEU B 58 1.771 9.348 -4.044 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -0.410 9.258 -2.864 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -0.069 10.900 -3.458 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -1.225 9.861 -4.326 1.00 0.00 H new ATOM 0 HD21 LEU B 58 0.409 7.270 -4.124 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -0.401 7.859 -5.595 1.00 0.00 H new ATOM 0 HD23 LEU B 58 1.338 7.486 -5.626 1.00 0.00 H new ATOM 2198 N ASN B 59 3.362 12.167 -7.272 1.00 0.00 N ATOM 2199 CA ASN B 59 4.683 12.176 -7.960 1.00 0.00 C ATOM 2200 C ASN B 59 5.741 12.841 -7.079 1.00 0.00 C ATOM 2201 O ASN B 59 6.871 12.401 -7.018 1.00 0.00 O ATOM 2202 CB ASN B 59 4.558 12.938 -9.281 1.00 0.00 C ATOM 2203 CG ASN B 59 3.955 14.321 -9.026 1.00 0.00 C ATOM 2204 OD1 ASN B 59 3.730 14.704 -7.896 1.00 0.00 O ATOM 2205 ND2 ASN B 59 3.675 15.092 -10.039 1.00 0.00 N ATOM 0 H ASN B 59 2.643 12.740 -7.713 1.00 0.00 H new ATOM 0 HA ASN B 59 4.990 11.148 -8.154 1.00 0.00 H new ATOM 0 HB2 ASN B 59 5.538 13.039 -9.748 1.00 0.00 H new ATOM 0 HB3 ASN B 59 3.930 12.380 -9.976 1.00 0.00 H new ATOM 0 HD21 ASN B 59 3.268 16.014 -9.881 1.00 0.00 H new ATOM 0 HD22 ASN B 59 3.863 14.773 -10.990 1.00 0.00 H new ATOM 2212 N ALA B 60 5.392 13.898 -6.401 1.00 0.00 N ATOM 2213 CA ALA B 60 6.384 14.589 -5.535 1.00 0.00 C ATOM 2214 C ALA B 60 6.465 13.890 -4.181 1.00 0.00 C ATOM 2215 O ALA B 60 7.501 13.863 -3.547 1.00 0.00 O ATOM 2216 CB ALA B 60 5.944 16.038 -5.334 1.00 0.00 C ATOM 0 H ALA B 60 4.460 14.313 -6.410 1.00 0.00 H new ATOM 0 HA ALA B 60 7.365 14.561 -6.010 1.00 0.00 H new ATOM 0 HB1 ALA B 60 6.666 16.553 -4.700 1.00 0.00 H new ATOM 0 HB2 ALA B 60 5.888 16.539 -6.301 1.00 0.00 H new ATOM 0 HB3 ALA B 60 4.964 16.058 -4.858 1.00 0.00 H new ATOM 2222 N LEU B 61 5.382 13.325 -3.726 1.00 0.00 N ATOM 2223 CA LEU B 61 5.409 12.635 -2.408 1.00 0.00 C ATOM 2224 C LEU B 61 6.385 11.456 -2.462 1.00 0.00 C ATOM 2225 O LEU B 61 7.158 11.238 -1.552 1.00 0.00 O ATOM 2226 CB LEU B 61 4.000 12.123 -2.084 1.00 0.00 C ATOM 2227 CG LEU B 61 3.993 11.371 -0.744 1.00 0.00 C ATOM 2228 CD1 LEU B 61 4.507 12.280 0.388 1.00 0.00 C ATOM 2229 CD2 LEU B 61 2.560 10.920 -0.435 1.00 0.00 C ATOM 0 H LEU B 61 4.483 13.311 -4.208 1.00 0.00 H new ATOM 0 HA LEU B 61 5.735 13.331 -1.635 1.00 0.00 H new ATOM 0 HB2 LEU B 61 3.304 12.961 -2.041 1.00 0.00 H new ATOM 0 HB3 LEU B 61 3.655 11.463 -2.880 1.00 0.00 H new ATOM 0 HG LEU B 61 4.650 10.504 -0.815 1.00 0.00 H new ATOM 0 HD11 LEU B 61 4.495 11.731 1.329 1.00 0.00 H new ATOM 0 HD12 LEU B 61 5.526 12.597 0.166 1.00 0.00 H new ATOM 0 HD13 LEU B 61 3.864 13.156 0.471 1.00 0.00 H new ATOM 0 HD21 LEU B 61 2.544 10.385 0.514 1.00 0.00 H new ATOM 0 HD22 LEU B 61 1.910 11.792 -0.371 1.00 0.00 H new ATOM 0 HD23 LEU B 61 2.207 10.262 -1.229 1.00 0.00 H new ATOM 2241 N PHE B 62 6.345 10.689 -3.518 1.00 0.00 N ATOM 2242 CA PHE B 62 7.254 9.511 -3.638 1.00 0.00 C ATOM 2243 C PHE B 62 8.630 9.931 -4.178 1.00 0.00 C ATOM 2244 O PHE B 62 9.640 9.351 -3.831 1.00 0.00 O ATOM 2245 CB PHE B 62 6.602 8.479 -4.573 1.00 0.00 C ATOM 2246 CG PHE B 62 5.632 7.619 -3.788 1.00 0.00 C ATOM 2247 CD1 PHE B 62 6.112 6.581 -2.980 1.00 0.00 C ATOM 2248 CD2 PHE B 62 4.258 7.862 -3.868 1.00 0.00 C ATOM 2249 CE1 PHE B 62 5.216 5.787 -2.256 1.00 0.00 C ATOM 2250 CE2 PHE B 62 3.361 7.067 -3.142 1.00 0.00 C ATOM 2251 CZ PHE B 62 3.840 6.030 -2.336 1.00 0.00 C ATOM 0 H PHE B 62 5.717 10.829 -4.309 1.00 0.00 H new ATOM 0 HA PHE B 62 7.408 9.072 -2.652 1.00 0.00 H new ATOM 0 HB2 PHE B 62 6.079 8.987 -5.383 1.00 0.00 H new ATOM 0 HB3 PHE B 62 7.368 7.854 -5.031 1.00 0.00 H new ATOM 0 HD1 PHE B 62 7.174 6.393 -2.916 1.00 0.00 H new ATOM 0 HD2 PHE B 62 3.887 8.663 -4.490 1.00 0.00 H new ATOM 0 HE1 PHE B 62 5.587 4.985 -1.634 1.00 0.00 H new ATOM 0 HE2 PHE B 62 2.299 7.255 -3.205 1.00 0.00 H new ATOM 0 HZ PHE B 62 3.149 5.417 -1.776 1.00 0.00 H new ATOM 2261 N ASP B 63 8.684 10.917 -5.028 1.00 0.00 N ATOM 2262 CA ASP B 63 10.001 11.344 -5.586 1.00 0.00 C ATOM 2263 C ASP B 63 10.924 11.827 -4.464 1.00 0.00 C ATOM 2264 O ASP B 63 12.100 11.522 -4.440 1.00 0.00 O ATOM 2265 CB ASP B 63 9.780 12.484 -6.578 1.00 0.00 C ATOM 2266 CG ASP B 63 11.128 12.977 -7.100 1.00 0.00 C ATOM 2267 OD1 ASP B 63 11.702 12.298 -7.934 1.00 0.00 O ATOM 2268 OD2 ASP B 63 11.566 14.025 -6.654 1.00 0.00 O ATOM 0 H ASP B 63 7.878 11.445 -5.361 1.00 0.00 H new ATOM 0 HA ASP B 63 10.465 10.494 -6.087 1.00 0.00 H new ATOM 0 HB2 ASP B 63 9.160 12.143 -7.407 1.00 0.00 H new ATOM 0 HB3 ASP B 63 9.245 13.301 -6.095 1.00 0.00 H new ATOM 2273 N ARG B 64 10.405 12.587 -3.540 1.00 0.00 N ATOM 2274 CA ARG B 64 11.249 13.104 -2.426 1.00 0.00 C ATOM 2275 C ARG B 64 11.797 11.931 -1.605 1.00 0.00 C ATOM 2276 O ARG B 64 12.937 11.934 -1.183 1.00 0.00 O ATOM 2277 CB ARG B 64 10.388 13.996 -1.528 1.00 0.00 C ATOM 2278 CG ARG B 64 11.280 14.892 -0.658 1.00 0.00 C ATOM 2279 CD ARG B 64 10.470 15.423 0.531 1.00 0.00 C ATOM 2280 NE ARG B 64 11.133 16.642 1.085 1.00 0.00 N ATOM 2281 CZ ARG B 64 10.425 17.557 1.696 1.00 0.00 C ATOM 2282 NH1 ARG B 64 9.134 17.401 1.840 1.00 0.00 N ATOM 2283 NH2 ARG B 64 11.004 18.627 2.165 1.00 0.00 N ATOM 0 H ARG B 64 9.427 12.874 -3.508 1.00 0.00 H new ATOM 0 HA ARG B 64 12.083 13.677 -2.831 1.00 0.00 H new ATOM 0 HB2 ARG B 64 9.728 14.612 -2.140 1.00 0.00 H new ATOM 0 HB3 ARG B 64 9.751 13.379 -0.894 1.00 0.00 H new ATOM 0 HG2 ARG B 64 12.142 14.328 -0.301 1.00 0.00 H new ATOM 0 HG3 ARG B 64 11.665 15.723 -1.249 1.00 0.00 H new ATOM 0 HD2 ARG B 64 9.454 15.661 0.215 1.00 0.00 H new ATOM 0 HD3 ARG B 64 10.392 14.657 1.302 1.00 0.00 H new ATOM 0 HE ARG B 64 12.141 16.761 0.987 1.00 0.00 H new ATOM 0 HH11 ARG B 64 8.678 16.565 1.476 1.00 0.00 H new ATOM 0 HH12 ARG B 64 8.584 18.116 2.317 1.00 0.00 H new ATOM 0 HH21 ARG B 64 12.010 18.752 2.056 1.00 0.00 H new ATOM 0 HH22 ARG B 64 10.450 19.339 2.641 1.00 0.00 H new ATOM 2297 N ILE B 65 10.987 10.938 -1.362 1.00 0.00 N ATOM 2298 CA ILE B 65 11.446 9.775 -0.552 1.00 0.00 C ATOM 2299 C ILE B 65 12.596 9.052 -1.267 1.00 0.00 C ATOM 2300 O ILE B 65 13.571 8.671 -0.651 1.00 0.00 O ATOM 2301 CB ILE B 65 10.274 8.806 -0.351 1.00 0.00 C ATOM 2302 CG1 ILE B 65 9.218 9.469 0.542 1.00 0.00 C ATOM 2303 CG2 ILE B 65 10.773 7.521 0.318 1.00 0.00 C ATOM 2304 CD1 ILE B 65 7.945 8.620 0.555 1.00 0.00 C ATOM 0 H ILE B 65 10.023 10.882 -1.691 1.00 0.00 H new ATOM 0 HA ILE B 65 11.802 10.130 0.415 1.00 0.00 H new ATOM 0 HB ILE B 65 9.837 8.560 -1.319 1.00 0.00 H new ATOM 0 HG12 ILE B 65 9.603 9.580 1.556 1.00 0.00 H new ATOM 0 HG13 ILE B 65 8.995 10.471 0.175 1.00 0.00 H new ATOM 0 HG21 ILE B 65 9.937 6.836 0.459 1.00 0.00 H new ATOM 0 HG22 ILE B 65 11.526 7.050 -0.314 1.00 0.00 H new ATOM 0 HG23 ILE B 65 11.212 7.762 1.286 1.00 0.00 H new ATOM 0 HD11 ILE B 65 7.198 9.095 1.191 1.00 0.00 H new ATOM 0 HD12 ILE B 65 7.556 8.532 -0.459 1.00 0.00 H new ATOM 0 HD13 ILE B 65 8.174 7.627 0.943 1.00 0.00 H new ATOM 2316 N ILE B 66 12.492 8.847 -2.552 1.00 0.00 N ATOM 2317 CA ILE B 66 13.582 8.134 -3.282 1.00 0.00 C ATOM 2318 C ILE B 66 14.848 9.004 -3.319 1.00 0.00 C ATOM 2319 O ILE B 66 15.598 9.062 -2.367 1.00 0.00 O ATOM 2320 CB ILE B 66 13.123 7.838 -4.716 1.00 0.00 C ATOM 2321 CG1 ILE B 66 11.836 7.011 -4.683 1.00 0.00 C ATOM 2322 CG2 ILE B 66 14.214 7.047 -5.456 1.00 0.00 C ATOM 2323 CD1 ILE B 66 11.241 6.960 -6.093 1.00 0.00 C ATOM 0 H ILE B 66 11.703 9.141 -3.127 1.00 0.00 H new ATOM 0 HA ILE B 66 13.807 7.200 -2.767 1.00 0.00 H new ATOM 0 HB ILE B 66 12.940 8.779 -5.234 1.00 0.00 H new ATOM 0 HG12 ILE B 66 12.045 6.003 -4.326 1.00 0.00 H new ATOM 0 HG13 ILE B 66 11.122 7.453 -3.989 1.00 0.00 H new ATOM 0 HG21 ILE B 66 13.885 6.838 -6.474 1.00 0.00 H new ATOM 0 HG22 ILE B 66 15.132 7.633 -5.484 1.00 0.00 H new ATOM 0 HG23 ILE B 66 14.399 6.108 -4.935 1.00 0.00 H new ATOM 0 HD11 ILE B 66 10.323 6.372 -6.080 1.00 0.00 H new ATOM 0 HD12 ILE B 66 11.019 7.972 -6.431 1.00 0.00 H new ATOM 0 HD13 ILE B 66 11.957 6.499 -6.774 1.00 0.00 H new ATOM 2335 N VAL B 67 15.084 9.674 -4.421 1.00 0.00 N ATOM 2336 CA VAL B 67 16.294 10.542 -4.562 1.00 0.00 C ATOM 2337 C VAL B 67 17.568 9.728 -4.314 1.00 0.00 C ATOM 2338 O VAL B 67 17.749 9.131 -3.274 1.00 0.00 O ATOM 2339 CB VAL B 67 16.216 11.706 -3.579 1.00 0.00 C ATOM 2340 CG1 VAL B 67 17.283 12.741 -3.943 1.00 0.00 C ATOM 2341 CG2 VAL B 67 14.830 12.349 -3.674 1.00 0.00 C ATOM 0 H VAL B 67 14.479 9.655 -5.242 1.00 0.00 H new ATOM 0 HA VAL B 67 16.326 10.935 -5.578 1.00 0.00 H new ATOM 0 HB VAL B 67 16.385 11.348 -2.564 1.00 0.00 H new ATOM 0 HG11 VAL B 67 17.233 13.576 -3.244 1.00 0.00 H new ATOM 0 HG12 VAL B 67 18.270 12.281 -3.889 1.00 0.00 H new ATOM 0 HG13 VAL B 67 17.107 13.104 -4.956 1.00 0.00 H new ATOM 0 HG21 VAL B 67 14.767 13.182 -2.974 1.00 0.00 H new ATOM 0 HG22 VAL B 67 14.667 12.714 -4.688 1.00 0.00 H new ATOM 0 HG23 VAL B 67 14.068 11.609 -3.428 1.00 0.00 H new ATOM 2351 N ASN B 68 18.449 9.692 -5.280 1.00 0.00 N ATOM 2352 CA ASN B 68 19.708 8.907 -5.128 1.00 0.00 C ATOM 2353 C ASN B 68 20.749 9.718 -4.347 1.00 0.00 C ATOM 2354 O ASN B 68 20.420 10.584 -3.563 1.00 0.00 O ATOM 2355 CB ASN B 68 20.251 8.573 -6.524 1.00 0.00 C ATOM 2356 CG ASN B 68 21.131 7.323 -6.471 1.00 0.00 C ATOM 2357 OD1 ASN B 68 21.177 6.634 -5.470 1.00 0.00 O ATOM 2358 ND2 ASN B 68 21.834 7.000 -7.518 1.00 0.00 N ATOM 0 H ASN B 68 18.349 10.176 -6.172 1.00 0.00 H new ATOM 0 HA ASN B 68 19.501 7.989 -4.578 1.00 0.00 H new ATOM 0 HB2 ASN B 68 19.423 8.413 -7.214 1.00 0.00 H new ATOM 0 HB3 ASN B 68 20.827 9.415 -6.908 1.00 0.00 H new ATOM 0 HD21 ASN B 68 22.424 6.168 -7.499 1.00 0.00 H new ATOM 0 HD22 ASN B 68 21.795 7.579 -8.357 1.00 0.00 H new ATOM 2365 N LYS B 69 22.005 9.430 -4.557 1.00 0.00 N ATOM 2366 CA LYS B 69 23.075 10.168 -3.829 1.00 0.00 C ATOM 2367 C LYS B 69 23.338 11.514 -4.509 1.00 0.00 C ATOM 2368 O LYS B 69 24.049 11.591 -5.487 1.00 0.00 O ATOM 2369 CB LYS B 69 24.356 9.333 -3.850 1.00 0.00 C ATOM 2370 CG LYS B 69 24.169 8.099 -2.970 1.00 0.00 C ATOM 2371 CD LYS B 69 25.446 7.257 -2.986 1.00 0.00 C ATOM 2372 CE LYS B 69 25.289 6.076 -2.026 1.00 0.00 C ATOM 2373 NZ LYS B 69 24.172 5.204 -2.487 1.00 0.00 N ATOM 0 H LYS B 69 22.336 8.714 -5.203 1.00 0.00 H new ATOM 0 HA LYS B 69 22.759 10.344 -2.801 1.00 0.00 H new ATOM 0 HB2 LYS B 69 24.592 9.033 -4.871 1.00 0.00 H new ATOM 0 HB3 LYS B 69 25.196 9.926 -3.490 1.00 0.00 H new ATOM 0 HG2 LYS B 69 23.933 8.400 -1.949 1.00 0.00 H new ATOM 0 HG3 LYS B 69 23.327 7.508 -3.330 1.00 0.00 H new ATOM 0 HD2 LYS B 69 25.644 6.896 -3.995 1.00 0.00 H new ATOM 0 HD3 LYS B 69 26.300 7.867 -2.693 1.00 0.00 H new ATOM 0 HE2 LYS B 69 26.216 5.504 -1.982 1.00 0.00 H new ATOM 0 HE3 LYS B 69 25.089 6.438 -1.017 1.00 0.00 H new ATOM 0 HZ1 LYS B 69 24.253 4.269 -2.038 1.00 0.00 H new ATOM 0 HZ2 LYS B 69 23.263 5.636 -2.225 1.00 0.00 H new ATOM 0 HZ3 LYS B 69 24.219 5.097 -3.520 1.00 0.00 H new ATOM 2387 N LEU B 70 22.776 12.576 -3.987 1.00 0.00 N ATOM 2388 CA LEU B 70 22.991 13.930 -4.583 1.00 0.00 C ATOM 2389 C LEU B 70 23.345 14.907 -3.461 1.00 0.00 C ATOM 2390 O LEU B 70 24.443 15.422 -3.393 1.00 0.00 O ATOM 2391 CB LEU B 70 21.699 14.387 -5.284 1.00 0.00 C ATOM 2392 CG LEU B 70 22.040 15.390 -6.388 1.00 0.00 C ATOM 2393 CD1 LEU B 70 20.757 15.825 -7.102 1.00 0.00 C ATOM 2394 CD2 LEU B 70 22.735 16.615 -5.781 1.00 0.00 C ATOM 0 H LEU B 70 22.172 12.562 -3.165 1.00 0.00 H new ATOM 0 HA LEU B 70 23.801 13.898 -5.312 1.00 0.00 H new ATOM 0 HB2 LEU B 70 21.180 13.527 -5.708 1.00 0.00 H new ATOM 0 HB3 LEU B 70 21.023 14.843 -4.561 1.00 0.00 H new ATOM 0 HG LEU B 70 22.710 14.918 -7.107 1.00 0.00 H new ATOM 0 HD11 LEU B 70 21.002 16.539 -7.888 1.00 0.00 H new ATOM 0 HD12 LEU B 70 20.272 14.954 -7.542 1.00 0.00 H new ATOM 0 HD13 LEU B 70 20.082 16.292 -6.385 1.00 0.00 H new ATOM 0 HD21 LEU B 70 22.976 17.326 -6.572 1.00 0.00 H new ATOM 0 HD22 LEU B 70 22.072 17.088 -5.057 1.00 0.00 H new ATOM 0 HD23 LEU B 70 23.653 16.303 -5.282 1.00 0.00 H new ATOM 2406 N GLU B 71 22.415 15.154 -2.577 1.00 0.00 N ATOM 2407 CA GLU B 71 22.664 16.088 -1.434 1.00 0.00 C ATOM 2408 C GLU B 71 22.782 15.280 -0.141 1.00 0.00 C ATOM 2409 O GLU B 71 22.168 15.594 0.860 1.00 0.00 O ATOM 2410 CB GLU B 71 21.503 17.093 -1.332 1.00 0.00 C ATOM 2411 CG GLU B 71 20.151 16.366 -1.286 1.00 0.00 C ATOM 2412 CD GLU B 71 19.031 17.371 -1.570 1.00 0.00 C ATOM 2413 OE1 GLU B 71 19.183 18.520 -1.189 1.00 0.00 O ATOM 2414 OE2 GLU B 71 18.046 16.977 -2.172 1.00 0.00 O ATOM 0 H GLU B 71 21.481 14.744 -2.597 1.00 0.00 H new ATOM 0 HA GLU B 71 23.591 16.637 -1.597 1.00 0.00 H new ATOM 0 HB2 GLU B 71 21.623 17.703 -0.437 1.00 0.00 H new ATOM 0 HB3 GLU B 71 21.527 17.771 -2.185 1.00 0.00 H new ATOM 0 HG2 GLU B 71 20.131 15.563 -2.022 1.00 0.00 H new ATOM 0 HG3 GLU B 71 20.005 15.906 -0.309 1.00 0.00 H new ATOM 2421 N HIS B 72 23.568 14.231 -0.156 1.00 0.00 N ATOM 2422 CA HIS B 72 23.731 13.390 1.072 1.00 0.00 C ATOM 2423 C HIS B 72 25.132 12.773 1.099 1.00 0.00 C ATOM 2424 O HIS B 72 25.890 12.851 0.151 1.00 0.00 O ATOM 2425 CB HIS B 72 22.671 12.263 1.079 1.00 0.00 C ATOM 2426 CG HIS B 72 21.431 12.702 1.823 1.00 0.00 C ATOM 2427 ND1 HIS B 72 21.324 13.949 2.426 1.00 0.00 N ATOM 2428 CD2 HIS B 72 20.245 12.055 2.090 1.00 0.00 C ATOM 2429 CE1 HIS B 72 20.119 14.012 3.022 1.00 0.00 C ATOM 2430 NE2 HIS B 72 19.425 12.886 2.846 1.00 0.00 N ATOM 0 H HIS B 72 24.104 13.920 -0.966 1.00 0.00 H new ATOM 0 HA HIS B 72 23.597 14.019 1.952 1.00 0.00 H new ATOM 0 HB2 HIS B 72 22.411 11.995 0.055 1.00 0.00 H new ATOM 0 HB3 HIS B 72 23.085 11.370 1.547 1.00 0.00 H new ATOM 0 HD1 HIS B 72 22.031 14.684 2.418 1.00 0.00 H new ATOM 0 HD2 HIS B 72 19.991 11.057 1.763 1.00 0.00 H new ATOM 0 HE1 HIS B 72 19.759 14.867 3.574 1.00 0.00 H new ATOM 2438 N HIS B 73 25.465 12.155 2.194 1.00 0.00 N ATOM 2439 CA HIS B 73 26.793 11.507 2.333 1.00 0.00 C ATOM 2440 C HIS B 73 26.679 10.433 3.419 1.00 0.00 C ATOM 2441 O HIS B 73 27.349 10.475 4.431 1.00 0.00 O ATOM 2442 CB HIS B 73 27.839 12.557 2.722 1.00 0.00 C ATOM 2443 CG HIS B 73 27.335 13.389 3.870 1.00 0.00 C ATOM 2444 ND1 HIS B 73 26.254 13.247 4.707 1.00 0.00 N flip ATOM 2445 CD2 HIS B 73 27.982 14.547 4.282 1.00 0.00 C flip ATOM 2446 CE1 HIS B 73 26.235 14.295 5.622 1.00 0.00 C flip ATOM 2447 NE2 HIS B 73 27.293 15.049 5.324 1.00 0.00 N flip ATOM 0 H HIS B 73 24.862 12.071 3.012 1.00 0.00 H new ATOM 0 HA HIS B 73 27.103 11.052 1.392 1.00 0.00 H new ATOM 0 HB2 HIS B 73 28.772 12.067 3.000 1.00 0.00 H new ATOM 0 HB3 HIS B 73 28.058 13.197 1.867 1.00 0.00 H new ATOM 0 HD2 HIS B 73 28.876 14.968 3.846 1.00 0.00 H new ATOM 0 HE1 HIS B 73 25.514 14.462 6.409 1.00 0.00 H new ATOM 0 HE2 HIS B 73 27.549 15.901 5.823 1.00 0.00 H new ATOM 2455 N HIS B 74 25.812 9.475 3.208 1.00 0.00 N ATOM 2456 CA HIS B 74 25.615 8.386 4.210 1.00 0.00 C ATOM 2457 C HIS B 74 25.462 8.983 5.613 1.00 0.00 C ATOM 2458 O HIS B 74 24.512 9.681 5.899 1.00 0.00 O ATOM 2459 CB HIS B 74 26.816 7.439 4.185 1.00 0.00 C ATOM 2460 CG HIS B 74 27.076 6.997 2.774 1.00 0.00 C ATOM 2461 ND1 HIS B 74 28.310 7.169 2.165 1.00 0.00 N ATOM 2462 CD2 HIS B 74 26.275 6.392 1.838 1.00 0.00 C ATOM 2463 CE1 HIS B 74 28.218 6.679 0.917 1.00 0.00 C ATOM 2464 NE2 HIS B 74 27.001 6.194 0.668 1.00 0.00 N ATOM 0 H HIS B 74 25.227 9.401 2.376 1.00 0.00 H new ATOM 0 HA HIS B 74 24.710 7.833 3.958 1.00 0.00 H new ATOM 0 HB2 HIS B 74 27.696 7.940 4.588 1.00 0.00 H new ATOM 0 HB3 HIS B 74 26.623 6.573 4.819 1.00 0.00 H new ATOM 0 HD1 HIS B 74 29.137 7.591 2.587 1.00 0.00 H new ATOM 0 HD2 HIS B 74 25.242 6.113 1.987 1.00 0.00 H new ATOM 0 HE1 HIS B 74 29.029 6.678 0.204 1.00 0.00 H new ATOM 2472 N HIS B 75 26.389 8.700 6.493 1.00 0.00 N ATOM 2473 CA HIS B 75 26.310 9.230 7.888 1.00 0.00 C ATOM 2474 C HIS B 75 27.696 9.705 8.314 1.00 0.00 C ATOM 2475 O HIS B 75 28.111 10.803 8.003 1.00 0.00 O ATOM 2476 CB HIS B 75 25.845 8.113 8.823 1.00 0.00 C ATOM 2477 CG HIS B 75 25.841 8.613 10.239 1.00 0.00 C ATOM 2478 ND1 HIS B 75 26.251 9.897 10.570 1.00 0.00 N ATOM 2479 CD2 HIS B 75 25.476 8.019 11.422 1.00 0.00 C ATOM 2480 CE1 HIS B 75 26.125 10.033 11.903 1.00 0.00 C ATOM 2481 NE2 HIS B 75 25.656 8.919 12.468 1.00 0.00 N ATOM 0 H HIS B 75 27.205 8.119 6.302 1.00 0.00 H new ATOM 0 HA HIS B 75 25.605 10.060 7.934 1.00 0.00 H new ATOM 0 HB2 HIS B 75 24.846 7.781 8.541 1.00 0.00 H new ATOM 0 HB3 HIS B 75 26.505 7.250 8.733 1.00 0.00 H new ATOM 0 HD2 HIS B 75 25.106 7.009 11.525 1.00 0.00 H new ATOM 0 HE1 HIS B 75 26.373 10.932 12.448 1.00 0.00 H new ATOM 0 HE2 HIS B 75 25.469 8.760 13.458 1.00 0.00 H new ATOM 2489 N HIS B 76 28.423 8.887 9.022 1.00 0.00 N ATOM 2490 CA HIS B 76 29.789 9.293 9.461 1.00 0.00 C ATOM 2491 C HIS B 76 30.624 8.030 9.695 1.00 0.00 C ATOM 2492 O HIS B 76 31.589 8.041 10.432 1.00 0.00 O ATOM 2493 CB HIS B 76 29.685 10.141 10.757 1.00 0.00 C ATOM 2494 CG HIS B 76 30.096 11.577 10.501 1.00 0.00 C ATOM 2495 ND1 HIS B 76 30.114 12.136 9.227 1.00 0.00 N ATOM 2496 CD2 HIS B 76 30.530 12.572 11.348 1.00 0.00 C ATOM 2497 CE1 HIS B 76 30.550 13.405 9.343 1.00 0.00 C ATOM 2498 NE2 HIS B 76 30.816 13.718 10.612 1.00 0.00 N ATOM 0 H HIS B 76 28.131 7.955 9.316 1.00 0.00 H new ATOM 0 HA HIS B 76 30.272 9.900 8.696 1.00 0.00 H new ATOM 0 HB2 HIS B 76 28.662 10.113 11.133 1.00 0.00 H new ATOM 0 HB3 HIS B 76 30.321 9.709 11.530 1.00 0.00 H new ATOM 0 HD1 HIS B 76 29.845 11.669 8.361 1.00 0.00 H new ATOM 0 HD2 HIS B 76 30.633 12.478 12.419 1.00 0.00 H new ATOM 0 HE1 HIS B 76 30.669 14.084 8.512 1.00 0.00 H new ATOM 2506 N HIS B 77 30.264 6.945 9.065 1.00 0.00 N ATOM 2507 CA HIS B 77 31.038 5.681 9.239 1.00 0.00 C ATOM 2508 C HIS B 77 31.016 4.897 7.926 1.00 0.00 C ATOM 2509 O HIS B 77 32.070 4.748 7.331 1.00 0.00 O ATOM 2510 CB HIS B 77 30.399 4.844 10.348 1.00 0.00 C ATOM 2511 CG HIS B 77 30.665 5.491 11.679 1.00 0.00 C ATOM 2512 ND1 HIS B 77 29.809 6.435 12.231 1.00 0.00 N ATOM 2513 CD2 HIS B 77 31.691 5.344 12.582 1.00 0.00 C ATOM 2514 CE1 HIS B 77 30.331 6.816 13.412 1.00 0.00 C ATOM 2515 NE2 HIS B 77 31.476 6.181 13.670 1.00 0.00 N ATOM 2516 OXT HIS B 77 29.944 4.464 7.535 1.00 0.00 O ATOM 0 H HIS B 77 29.465 6.879 8.435 1.00 0.00 H new ATOM 0 HA HIS B 77 32.068 5.912 9.510 1.00 0.00 H new ATOM 0 HB2 HIS B 77 29.325 4.758 10.181 1.00 0.00 H new ATOM 0 HB3 HIS B 77 30.805 3.833 10.335 1.00 0.00 H new ATOM 0 HD2 HIS B 77 32.535 4.680 12.464 1.00 0.00 H new ATOM 0 HE1 HIS B 77 29.879 7.545 14.069 1.00 0.00 H new ATOM 0 HE2 HIS B 77 32.069 6.288 14.493 1.00 0.00 H new TER 2524 HIS B 77