USER MOD reduce.3.24.130724 H: found=0, std=0, add=1194, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1190 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 128 THR OG1 : rot 180:sc= 1.35 USER MOD Set 1.2: A 131 SER OG : rot 61:sc= 1.36 USER MOD Set 2.1: A 114 GLN : amide:sc= -1.01 K(o=-1.1,f=-0.52) USER MOD Set 2.2: A 118 MET CE :methyl -166:sc= -0.0589 (180deg=-0.346) USER MOD Set 3.1: A 30 ASN : amide:sc= -2.92 K(o=-1.3,f=-5.8!) USER MOD Set 3.2: A 94 SER OG : rot 72:sc= 1.23 USER MOD Set 3.3: A 101 TYR OH : rot -143:sc= 1.26 USER MOD Set 3.4: A 141 MET CE :methyl 172:sc= -0.845 (180deg=-0.999) USER MOD Set 4.1: A 75 CYS SG : rot -55:sc= 0.0677! USER MOD Set 4.2: A 83 ASN : amide:sc= 0.573! C(o=0.64!,f=-13!) USER MOD Set 5.1: A 29 HIS : no HD1:sc= -1.49 K(o=-5.9,f=-6.6) USER MOD Set 5.2: A 129 HIS : no HE2:sc= -3.15 K(o=-5.9,f=-4.9) USER MOD Set 5.3: A 137 CYS SG : rot -169:sc= -1.24! USER MOD Set 6.1: A 27 THR OG1 : rot -177:sc= 0.708 USER MOD Set 6.2: A 86 SER OG : rot -45:sc= 0.379 USER MOD Set 7.1: A 21 MET CE :methyl -170:sc= 0 (180deg=0) USER MOD Set 7.2: A 85 GLN : amide:sc= -0.618 K(o=-0.62,f=-0.00093) USER MOD Single : A 4 GLN : amide:sc= -1.44 K(o=-1.4,f=-0.3) USER MOD Single : A 5 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0522) USER MOD Single : A 6 LYS NZ :NH3+ 165:sc= -0.038 (180deg=-0.3) USER MOD Single : A 11 SER OG : rot 84:sc= 1.25 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ -170:sc= -0.0449 (180deg=-0.313) USER MOD Single : A 17 CYS SG : rot 51:sc= -0.273 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 27:sc= 0.103 USER MOD Single : A 22 LYS NZ :NH3+ 167:sc= -0.0221 (180deg=-0.23) USER MOD Single : A 24 LYS NZ :NH3+ 176:sc= 0.828 (180deg=0.813) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 107:sc= 1.19 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 39 ASN : amide:sc= -0.863 K(o=-0.86,f=-2.6!) USER MOD Single : A 42 SER OG : rot 80:sc= 1.24 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 MET CE :methyl -178:sc= -1.71 (180deg=-1.74) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 ASN : amide:sc= -3.52! C(o=-3.5!,f=-1.5!) USER MOD Single : A 48 ASN : amide:sc= -1.44! C(o=-1.4!,f=-3!) USER MOD Single : A 49 ASN : amide:sc= -0.544 X(o=-0.54,f=-0.075) USER MOD Single : A 52 SER OG : rot 140:sc= -0.986 USER MOD Single : A 54 HIS : no HD1:sc= -0.115 K(o=-0.11,f=-10!) USER MOD Single : A 60 LYS NZ :NH3+ 143:sc= -0.642 (180deg=-1.72!) USER MOD Single : A 61 LYS NZ :NH3+ 146:sc= 1.17 (180deg=0.683) USER MOD Single : A 64 GLN : amide:sc= -0.0256 K(o=-0.026,f=-4.3!) USER MOD Single : A 71 ASN : amide:sc= -0.333 K(o=-0.33,f=-3.7!) USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 81 SER OG : rot 180:sc= -0.0204 USER MOD Single : A 88 SER OG : rot -50:sc= -0.677 USER MOD Single : A 92 CYS SG : rot 90:sc= -3.33! USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 0:sc= 0.457 USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 163:sc= 1.27 (180deg=1.11) USER MOD Single : A 107 ASN : amide:sc= 0.394 K(o=0.39,f=-0.57) USER MOD Single : A 116 MET CE :methyl -176:sc= -1.27 (180deg=-1.38) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 120 ASN : amide:sc=-0.00474 X(o=-0.0047,f=0) USER MOD Single : A 125 ASN : amide:sc= -0.726 K(o=-0.73,f=-2.9) USER MOD Single : A 130 GLN : amide:sc= -1.74! K(o=-1.7!,f=-0.95) USER MOD Single : A 133 SER OG : rot -38:sc= 0.348 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 TYR OH : rot 90:sc= -0.714 USER MOD Single : A 139 HIS : no HD1:sc= -0.379 K(o=-0.38,f=-0.91) USER MOD Single : A 152 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 153 LYS NZ :NH3+ -175:sc= 1.24 (180deg=1.16) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 35 N ILE A 3 9.757 8.879 0.511 1.00 54.44 N ATOM 36 CA ILE A 3 8.621 8.844 -0.370 1.00 12.42 C ATOM 37 C ILE A 3 8.673 10.046 -1.318 1.00 22.22 C ATOM 38 O ILE A 3 8.855 11.195 -0.881 1.00 23.24 O ATOM 39 CB ILE A 3 7.246 8.826 0.406 1.00 20.34 C ATOM 40 CG1 ILE A 3 7.040 7.546 1.261 1.00 60.10 C ATOM 41 CG2 ILE A 3 6.089 8.974 -0.547 1.00 11.44 C ATOM 42 CD1 ILE A 3 7.956 7.396 2.453 1.00 33.41 C ATOM 0 HA ILE A 3 8.676 7.914 -0.936 1.00 12.42 H new ATOM 0 HB ILE A 3 7.282 9.676 1.088 1.00 20.34 H new ATOM 0 HG12 ILE A 3 6.009 7.530 1.615 1.00 60.10 H new ATOM 0 HG13 ILE A 3 7.169 6.677 0.616 1.00 60.10 H new ATOM 0 HG21 ILE A 3 5.153 8.959 0.012 1.00 11.44 H new ATOM 0 HG22 ILE A 3 6.177 9.920 -1.082 1.00 11.44 H new ATOM 0 HG23 ILE A 3 6.099 8.151 -1.261 1.00 11.44 H new ATOM 0 HD11 ILE A 3 7.724 6.468 2.976 1.00 33.41 H new ATOM 0 HD12 ILE A 3 8.992 7.372 2.115 1.00 33.41 H new ATOM 0 HD13 ILE A 3 7.814 8.239 3.129 1.00 33.41 H new ATOM 54 N GLN A 4 8.520 9.783 -2.589 1.00 14.14 N ATOM 55 CA GLN A 4 8.569 10.792 -3.605 1.00 34.24 C ATOM 56 C GLN A 4 7.169 11.217 -3.908 1.00 42.41 C ATOM 57 O GLN A 4 6.260 10.404 -3.899 1.00 74.25 O ATOM 58 CB GLN A 4 9.219 10.212 -4.834 1.00 31.43 C ATOM 59 CG GLN A 4 9.444 11.175 -5.972 1.00 61.24 C ATOM 60 CD GLN A 4 10.361 10.603 -7.023 1.00 30.02 C ATOM 61 OE1 GLN A 4 11.563 10.824 -6.996 1.00 61.04 O ATOM 62 NE2 GLN A 4 9.837 9.774 -7.867 1.00 2.33 N ATOM 0 H GLN A 4 8.355 8.843 -2.950 1.00 14.14 H new ATOM 0 HA GLN A 4 9.147 11.654 -3.273 1.00 34.24 H new ATOM 0 HB2 GLN A 4 10.181 9.786 -4.547 1.00 31.43 H new ATOM 0 HB3 GLN A 4 8.601 9.390 -5.195 1.00 31.43 H new ATOM 0 HG2 GLN A 4 8.486 11.430 -6.426 1.00 61.24 H new ATOM 0 HG3 GLN A 4 9.869 12.101 -5.585 1.00 61.24 H new ATOM 0 HE21 GLN A 4 8.830 9.611 -7.864 1.00 2.33 H new ATOM 0 HE22 GLN A 4 10.431 9.283 -8.535 1.00 2.33 H new ATOM 71 N LYS A 5 6.987 12.453 -4.168 1.00 13.23 N ATOM 72 CA LYS A 5 5.687 12.970 -4.370 1.00 44.01 C ATOM 73 C LYS A 5 5.398 13.247 -5.817 1.00 62.55 C ATOM 74 O LYS A 5 5.999 14.116 -6.438 1.00 72.11 O ATOM 75 CB LYS A 5 5.464 14.196 -3.493 1.00 13.53 C ATOM 76 CG LYS A 5 5.549 13.886 -2.003 1.00 12.25 C ATOM 77 CD LYS A 5 4.435 12.934 -1.582 1.00 32.44 C ATOM 78 CE LYS A 5 4.604 12.448 -0.158 1.00 23.53 C ATOM 79 NZ LYS A 5 4.669 13.547 0.826 1.00 42.03 N ATOM 0 H LYS A 5 7.737 13.140 -4.248 1.00 13.23 H new ATOM 0 HA LYS A 5 4.973 12.204 -4.068 1.00 44.01 H new ATOM 0 HB2 LYS A 5 6.205 14.955 -3.743 1.00 13.53 H new ATOM 0 HB3 LYS A 5 4.485 14.621 -3.715 1.00 13.53 H new ATOM 0 HG2 LYS A 5 6.518 13.442 -1.774 1.00 12.25 H new ATOM 0 HG3 LYS A 5 5.479 14.811 -1.430 1.00 12.25 H new ATOM 0 HD2 LYS A 5 3.473 13.437 -1.680 1.00 32.44 H new ATOM 0 HD3 LYS A 5 4.417 12.078 -2.256 1.00 32.44 H new ATOM 0 HE2 LYS A 5 3.773 11.790 0.096 1.00 23.53 H new ATOM 0 HE3 LYS A 5 5.515 11.853 -0.089 1.00 23.53 H new ATOM 0 HZ1 LYS A 5 4.665 13.152 1.788 1.00 42.03 H new ATOM 0 HZ2 LYS A 5 5.542 14.093 0.679 1.00 42.03 H new ATOM 0 HZ3 LYS A 5 3.846 14.171 0.705 1.00 42.03 H new ATOM 93 N LYS A 6 4.508 12.459 -6.353 1.00 3.35 N ATOM 94 CA LYS A 6 3.970 12.653 -7.675 1.00 4.45 C ATOM 95 C LYS A 6 2.485 12.591 -7.534 1.00 63.35 C ATOM 96 O LYS A 6 1.775 12.120 -8.428 1.00 54.23 O ATOM 97 CB LYS A 6 4.444 11.575 -8.662 1.00 74.02 C ATOM 98 CG LYS A 6 5.944 11.529 -8.872 1.00 35.20 C ATOM 99 CD LYS A 6 6.337 10.552 -9.990 1.00 72.31 C ATOM 100 CE LYS A 6 5.843 11.021 -11.362 1.00 15.53 C ATOM 101 NZ LYS A 6 6.366 12.364 -11.721 1.00 15.23 N ATOM 0 H LYS A 6 4.126 11.644 -5.873 1.00 3.35 H new ATOM 0 HA LYS A 6 4.310 13.607 -8.077 1.00 4.45 H new ATOM 0 HB2 LYS A 6 4.110 10.601 -8.304 1.00 74.02 H new ATOM 0 HB3 LYS A 6 3.960 11.744 -9.624 1.00 74.02 H new ATOM 0 HG2 LYS A 6 6.307 12.527 -9.118 1.00 35.20 H new ATOM 0 HG3 LYS A 6 6.432 11.233 -7.943 1.00 35.20 H new ATOM 0 HD2 LYS A 6 7.421 10.444 -10.013 1.00 72.31 H new ATOM 0 HD3 LYS A 6 5.923 9.567 -9.773 1.00 72.31 H new ATOM 0 HE2 LYS A 6 6.147 10.300 -12.121 1.00 15.53 H new ATOM 0 HE3 LYS A 6 4.753 11.045 -11.364 1.00 15.53 H new ATOM 0 HZ1 LYS A 6 6.223 12.532 -12.737 1.00 15.23 H new ATOM 0 HZ2 LYS A 6 5.860 13.091 -11.176 1.00 15.23 H new ATOM 0 HZ3 LYS A 6 7.382 12.411 -11.502 1.00 15.23 H new ATOM 115 N LEU A 7 2.028 13.092 -6.374 1.00 22.34 N ATOM 116 CA LEU A 7 0.619 13.140 -6.004 1.00 53.54 C ATOM 117 C LEU A 7 -0.255 13.639 -7.149 1.00 34.54 C ATOM 118 O LEU A 7 0.145 14.516 -7.938 1.00 71.13 O ATOM 119 CB LEU A 7 0.406 13.989 -4.741 1.00 34.34 C ATOM 120 CG LEU A 7 1.106 13.502 -3.456 1.00 35.04 C ATOM 121 CD1 LEU A 7 0.813 14.446 -2.308 1.00 32.01 C ATOM 122 CD2 LEU A 7 0.673 12.084 -3.091 1.00 23.24 C ATOM 0 H LEU A 7 2.645 13.480 -5.660 1.00 22.34 H new ATOM 0 HA LEU A 7 0.312 12.118 -5.783 1.00 53.54 H new ATOM 0 HB2 LEU A 7 0.746 15.003 -4.951 1.00 34.34 H new ATOM 0 HB3 LEU A 7 -0.665 14.046 -4.545 1.00 34.34 H new ATOM 0 HG LEU A 7 2.179 13.490 -3.645 1.00 35.04 H new ATOM 0 HD11 LEU A 7 1.313 14.090 -1.407 1.00 32.01 H new ATOM 0 HD12 LEU A 7 1.177 15.443 -2.555 1.00 32.01 H new ATOM 0 HD13 LEU A 7 -0.262 14.485 -2.134 1.00 32.01 H new ATOM 0 HD21 LEU A 7 1.184 11.770 -2.181 1.00 23.24 H new ATOM 0 HD22 LEU A 7 -0.404 12.063 -2.927 1.00 23.24 H new ATOM 0 HD23 LEU A 7 0.930 11.405 -3.904 1.00 23.24 H new ATOM 134 N VAL A 8 -1.433 13.101 -7.213 1.00 2.41 N ATOM 135 CA VAL A 8 -2.337 13.299 -8.306 1.00 21.03 C ATOM 136 C VAL A 8 -2.910 14.740 -8.350 1.00 14.32 C ATOM 137 O VAL A 8 -2.987 15.440 -7.327 1.00 1.53 O ATOM 138 CB VAL A 8 -3.480 12.268 -8.208 1.00 31.33 C ATOM 139 CG1 VAL A 8 -4.392 12.547 -7.029 1.00 55.21 C ATOM 140 CG2 VAL A 8 -4.242 12.178 -9.481 1.00 1.13 C ATOM 0 H VAL A 8 -1.805 12.493 -6.484 1.00 2.41 H new ATOM 0 HA VAL A 8 -1.781 13.157 -9.233 1.00 21.03 H new ATOM 0 HB VAL A 8 -3.022 11.295 -8.033 1.00 31.33 H new ATOM 0 HG11 VAL A 8 -5.183 11.798 -6.996 1.00 55.21 H new ATOM 0 HG12 VAL A 8 -3.815 12.506 -6.105 1.00 55.21 H new ATOM 0 HG13 VAL A 8 -4.834 13.537 -7.137 1.00 55.21 H new ATOM 0 HG21 VAL A 8 -5.040 11.442 -9.376 1.00 1.13 H new ATOM 0 HG22 VAL A 8 -4.674 13.151 -9.716 1.00 1.13 H new ATOM 0 HG23 VAL A 8 -3.572 11.875 -10.285 1.00 1.13 H new ATOM 150 N ASP A 9 -3.270 15.176 -9.551 1.00 15.22 N ATOM 151 CA ASP A 9 -3.790 16.507 -9.780 1.00 22.51 C ATOM 152 C ASP A 9 -5.239 16.574 -9.313 1.00 21.03 C ATOM 153 O ASP A 9 -5.963 15.582 -9.424 1.00 15.31 O ATOM 154 CB ASP A 9 -3.706 16.840 -11.279 1.00 43.23 C ATOM 155 CG ASP A 9 -4.137 18.252 -11.603 1.00 41.43 C ATOM 156 OD1 ASP A 9 -3.279 19.156 -11.590 1.00 1.54 O ATOM 157 OD2 ASP A 9 -5.339 18.485 -11.877 1.00 31.15 O ATOM 0 H ASP A 9 -3.207 14.608 -10.396 1.00 15.22 H new ATOM 0 HA ASP A 9 -3.200 17.232 -9.219 1.00 22.51 H new ATOM 0 HB2 ASP A 9 -2.681 16.693 -11.620 1.00 43.23 H new ATOM 0 HB3 ASP A 9 -4.330 16.140 -11.835 1.00 43.23 H new ATOM 162 N PRO A 10 -5.683 17.733 -8.763 1.00 65.22 N ATOM 163 CA PRO A 10 -7.069 17.939 -8.305 1.00 45.45 C ATOM 164 C PRO A 10 -8.149 17.496 -9.304 1.00 42.42 C ATOM 165 O PRO A 10 -9.257 17.126 -8.897 1.00 2.20 O ATOM 166 CB PRO A 10 -7.148 19.445 -8.081 1.00 35.31 C ATOM 167 CG PRO A 10 -5.768 19.827 -7.696 1.00 14.42 C ATOM 168 CD PRO A 10 -4.853 18.932 -8.490 1.00 3.45 C ATOM 0 HA PRO A 10 -7.270 17.332 -7.422 1.00 45.45 H new ATOM 0 HB2 PRO A 10 -7.469 19.966 -8.983 1.00 35.31 H new ATOM 0 HB3 PRO A 10 -7.864 19.694 -7.298 1.00 35.31 H new ATOM 0 HG2 PRO A 10 -5.577 20.877 -7.919 1.00 14.42 H new ATOM 0 HG3 PRO A 10 -5.611 19.695 -6.626 1.00 14.42 H new ATOM 0 HD2 PRO A 10 -4.526 19.411 -9.413 1.00 3.45 H new ATOM 0 HD3 PRO A 10 -3.955 18.677 -7.927 1.00 3.45 H new ATOM 176 N SER A 11 -7.821 17.489 -10.581 1.00 30.41 N ATOM 177 CA SER A 11 -8.776 17.131 -11.617 1.00 62.45 C ATOM 178 C SER A 11 -9.085 15.639 -11.559 1.00 72.23 C ATOM 179 O SER A 11 -10.139 15.183 -12.003 1.00 51.21 O ATOM 180 CB SER A 11 -8.178 17.444 -12.977 1.00 14.44 C ATOM 181 OG SER A 11 -7.699 18.776 -13.022 1.00 11.24 O ATOM 0 H SER A 11 -6.893 17.729 -10.930 1.00 30.41 H new ATOM 0 HA SER A 11 -9.693 17.700 -11.460 1.00 62.45 H new ATOM 0 HB2 SER A 11 -7.363 16.752 -13.188 1.00 14.44 H new ATOM 0 HB3 SER A 11 -8.930 17.297 -13.752 1.00 14.44 H new ATOM 0 HG SER A 11 -6.794 18.811 -12.647 1.00 11.24 H new ATOM 187 N LYS A 12 -8.157 14.888 -11.004 1.00 12.12 N ATOM 188 CA LYS A 12 -8.258 13.448 -10.985 1.00 20.22 C ATOM 189 C LYS A 12 -8.707 12.975 -9.631 1.00 12.11 C ATOM 190 O LYS A 12 -8.904 11.757 -9.429 1.00 64.54 O ATOM 191 CB LYS A 12 -6.898 12.844 -11.243 1.00 22.23 C ATOM 192 CG LYS A 12 -6.089 13.536 -12.323 1.00 65.33 C ATOM 193 CD LYS A 12 -6.794 13.532 -13.638 1.00 52.11 C ATOM 194 CE LYS A 12 -6.872 12.133 -14.225 1.00 31.32 C ATOM 195 NZ LYS A 12 -7.501 12.121 -15.554 1.00 74.33 N ATOM 0 H LYS A 12 -7.318 15.257 -10.557 1.00 12.12 H new ATOM 0 HA LYS A 12 -8.974 13.146 -11.749 1.00 20.22 H new ATOM 0 HB2 LYS A 12 -6.327 12.860 -10.315 1.00 22.23 H new ATOM 0 HB3 LYS A 12 -7.027 11.798 -11.520 1.00 22.23 H new ATOM 0 HG2 LYS A 12 -5.888 14.564 -12.023 1.00 65.33 H new ATOM 0 HG3 LYS A 12 -5.124 13.040 -12.427 1.00 65.33 H new ATOM 0 HD2 LYS A 12 -7.800 13.932 -13.513 1.00 52.11 H new ATOM 0 HD3 LYS A 12 -6.273 14.191 -14.333 1.00 52.11 H new ATOM 0 HE2 LYS A 12 -5.868 11.715 -14.297 1.00 31.32 H new ATOM 0 HE3 LYS A 12 -7.438 11.490 -13.551 1.00 31.32 H new ATOM 0 HZ1 LYS A 12 -7.532 11.146 -15.914 1.00 74.33 H new ATOM 0 HZ2 LYS A 12 -8.469 12.495 -15.483 1.00 74.33 H new ATOM 0 HZ3 LYS A 12 -6.947 12.713 -16.205 1.00 74.33 H new ATOM 209 N TYR A 13 -8.873 13.917 -8.688 1.00 4.24 N ATOM 210 CA TYR A 13 -9.187 13.554 -7.338 1.00 11.03 C ATOM 211 C TYR A 13 -10.412 12.728 -7.232 1.00 60.43 C ATOM 212 O TYR A 13 -10.392 11.763 -6.562 1.00 23.44 O ATOM 213 CB TYR A 13 -9.324 14.749 -6.398 1.00 73.32 C ATOM 214 CG TYR A 13 -8.060 15.383 -5.870 1.00 31.12 C ATOM 215 CD1 TYR A 13 -6.883 14.663 -5.726 1.00 14.31 C ATOM 216 CD2 TYR A 13 -8.069 16.704 -5.457 1.00 5.04 C ATOM 217 CE1 TYR A 13 -5.755 15.247 -5.189 1.00 31.41 C ATOM 218 CE2 TYR A 13 -6.947 17.296 -4.930 1.00 14.03 C ATOM 219 CZ TYR A 13 -5.794 16.564 -4.796 1.00 31.23 C ATOM 220 OH TYR A 13 -4.680 17.155 -4.252 1.00 4.24 O ATOM 0 H TYR A 13 -8.792 14.920 -8.854 1.00 4.24 H new ATOM 0 HA TYR A 13 -8.326 12.964 -7.024 1.00 11.03 H new ATOM 0 HB2 TYR A 13 -9.892 15.520 -6.918 1.00 73.32 H new ATOM 0 HB3 TYR A 13 -9.922 14.435 -5.543 1.00 73.32 H new ATOM 0 HD1 TYR A 13 -6.850 13.630 -6.039 1.00 14.31 H new ATOM 0 HD2 TYR A 13 -8.977 17.281 -5.551 1.00 5.04 H new ATOM 0 HE1 TYR A 13 -4.847 14.673 -5.078 1.00 31.41 H new ATOM 0 HE2 TYR A 13 -6.972 18.331 -4.623 1.00 14.03 H new ATOM 0 HH TYR A 13 -4.880 18.088 -4.031 1.00 4.24 H new ATOM 230 N GLY A 14 -11.424 13.021 -7.981 1.00 51.02 N ATOM 231 CA GLY A 14 -12.660 12.298 -7.748 1.00 41.43 C ATOM 232 C GLY A 14 -12.823 11.092 -8.610 1.00 13.43 C ATOM 233 O GLY A 14 -13.902 10.541 -8.726 1.00 52.45 O ATOM 0 H GLY A 14 -11.439 13.717 -8.727 1.00 51.02 H new ATOM 0 HA2 GLY A 14 -12.701 11.994 -6.702 1.00 41.43 H new ATOM 0 HA3 GLY A 14 -13.501 12.971 -7.917 1.00 41.43 H new ATOM 237 N THR A 15 -11.757 10.682 -9.224 1.00 54.34 N ATOM 238 CA THR A 15 -11.761 9.463 -9.966 1.00 51.40 C ATOM 239 C THR A 15 -10.826 8.458 -9.269 1.00 73.30 C ATOM 240 O THR A 15 -10.892 7.249 -9.492 1.00 74.24 O ATOM 241 CB THR A 15 -11.330 9.701 -11.421 1.00 3.33 C ATOM 242 OG1 THR A 15 -12.145 10.742 -11.980 1.00 65.40 O ATOM 243 CG2 THR A 15 -11.527 8.443 -12.241 1.00 24.43 C ATOM 0 H THR A 15 -10.867 11.179 -9.225 1.00 54.34 H new ATOM 0 HA THR A 15 -12.773 9.058 -9.995 1.00 51.40 H new ATOM 0 HB THR A 15 -10.277 9.981 -11.439 1.00 3.33 H new ATOM 0 HG1 THR A 15 -11.877 10.904 -12.909 1.00 65.40 H new ATOM 0 HG21 THR A 15 -11.217 8.627 -13.270 1.00 24.43 H new ATOM 0 HG22 THR A 15 -10.927 7.637 -11.820 1.00 24.43 H new ATOM 0 HG23 THR A 15 -12.579 8.159 -12.224 1.00 24.43 H new ATOM 251 N LYS A 16 -9.941 8.981 -8.442 1.00 64.41 N ATOM 252 CA LYS A 16 -9.044 8.153 -7.654 1.00 5.53 C ATOM 253 C LYS A 16 -9.523 8.147 -6.195 1.00 11.21 C ATOM 254 O LYS A 16 -9.664 7.096 -5.573 1.00 70.34 O ATOM 255 CB LYS A 16 -7.611 8.704 -7.719 1.00 23.42 C ATOM 256 CG LYS A 16 -6.922 8.796 -9.115 1.00 24.15 C ATOM 257 CD LYS A 16 -6.485 7.439 -9.736 1.00 40.13 C ATOM 258 CE LYS A 16 -7.627 6.568 -10.204 1.00 35.40 C ATOM 259 NZ LYS A 16 -8.456 7.243 -11.215 1.00 74.11 N ATOM 0 H LYS A 16 -9.823 9.984 -8.297 1.00 64.41 H new ATOM 0 HA LYS A 16 -9.048 7.139 -8.055 1.00 5.53 H new ATOM 0 HB2 LYS A 16 -7.618 9.703 -7.284 1.00 23.42 H new ATOM 0 HB3 LYS A 16 -6.985 8.082 -7.079 1.00 23.42 H new ATOM 0 HG2 LYS A 16 -7.605 9.289 -9.806 1.00 24.15 H new ATOM 0 HG3 LYS A 16 -6.043 9.435 -9.026 1.00 24.15 H new ATOM 0 HD2 LYS A 16 -5.825 7.636 -10.581 1.00 40.13 H new ATOM 0 HD3 LYS A 16 -5.902 6.887 -8.998 1.00 40.13 H new ATOM 0 HE2 LYS A 16 -7.230 5.642 -10.620 1.00 35.40 H new ATOM 0 HE3 LYS A 16 -8.247 6.294 -9.351 1.00 35.40 H new ATOM 0 HZ1 LYS A 16 -9.318 6.687 -11.385 1.00 74.11 H new ATOM 0 HZ2 LYS A 16 -8.717 8.190 -10.874 1.00 74.11 H new ATOM 0 HZ3 LYS A 16 -7.920 7.330 -12.102 1.00 74.11 H new ATOM 273 N CYS A 17 -9.803 9.330 -5.680 1.00 0.31 N ATOM 274 CA CYS A 17 -10.234 9.502 -4.311 1.00 74.41 C ATOM 275 C CYS A 17 -11.299 10.623 -4.175 1.00 55.25 C ATOM 276 O CYS A 17 -11.001 11.725 -3.692 1.00 52.11 O ATOM 277 CB CYS A 17 -9.025 9.800 -3.437 1.00 53.32 C ATOM 278 SG CYS A 17 -8.054 11.242 -3.959 1.00 2.31 S ATOM 0 H CYS A 17 -9.736 10.202 -6.205 1.00 0.31 H new ATOM 0 HA CYS A 17 -10.705 8.576 -3.981 1.00 74.41 H new ATOM 0 HB2 CYS A 17 -9.363 9.957 -2.413 1.00 53.32 H new ATOM 0 HB3 CYS A 17 -8.375 8.925 -3.427 1.00 53.32 H new ATOM 0 HG CYS A 17 -8.845 12.259 -4.130 1.00 2.31 H new ATOM 284 N PRO A 18 -12.543 10.391 -4.686 1.00 73.20 N ATOM 285 CA PRO A 18 -13.632 11.389 -4.599 1.00 55.20 C ATOM 286 C PRO A 18 -14.057 11.629 -3.168 1.00 23.01 C ATOM 287 O PRO A 18 -14.681 12.635 -2.839 1.00 1.21 O ATOM 288 CB PRO A 18 -14.786 10.763 -5.402 1.00 33.23 C ATOM 289 CG PRO A 18 -14.448 9.313 -5.548 1.00 60.53 C ATOM 290 CD PRO A 18 -12.957 9.180 -5.409 1.00 52.23 C ATOM 0 HA PRO A 18 -13.321 12.360 -4.984 1.00 55.20 H new ATOM 0 HB2 PRO A 18 -15.736 10.892 -4.884 1.00 33.23 H new ATOM 0 HB3 PRO A 18 -14.887 11.240 -6.377 1.00 33.23 H new ATOM 0 HG2 PRO A 18 -14.958 8.722 -4.787 1.00 60.53 H new ATOM 0 HG3 PRO A 18 -14.778 8.938 -6.517 1.00 60.53 H new ATOM 0 HD2 PRO A 18 -12.689 8.278 -4.858 1.00 52.23 H new ATOM 0 HD3 PRO A 18 -12.472 9.115 -6.383 1.00 52.23 H new ATOM 298 N TYR A 19 -13.703 10.710 -2.336 1.00 71.53 N ATOM 299 CA TYR A 19 -14.031 10.780 -0.941 1.00 40.30 C ATOM 300 C TYR A 19 -12.831 11.157 -0.106 1.00 53.42 C ATOM 301 O TYR A 19 -11.677 10.876 -0.443 1.00 60.04 O ATOM 302 CB TYR A 19 -14.636 9.470 -0.429 1.00 55.15 C ATOM 303 CG TYR A 19 -15.936 9.097 -1.092 1.00 3.14 C ATOM 304 CD1 TYR A 19 -15.948 8.496 -2.334 1.00 33.44 C ATOM 305 CD2 TYR A 19 -17.150 9.358 -0.478 1.00 33.51 C ATOM 306 CE1 TYR A 19 -17.124 8.161 -2.953 1.00 52.51 C ATOM 307 CE2 TYR A 19 -18.342 9.025 -1.088 1.00 3.31 C ATOM 308 CZ TYR A 19 -18.324 8.426 -2.327 1.00 2.14 C ATOM 309 OH TYR A 19 -19.511 8.082 -2.946 1.00 3.21 O ATOM 0 H TYR A 19 -13.173 9.879 -2.600 1.00 71.53 H new ATOM 0 HA TYR A 19 -14.782 11.563 -0.840 1.00 40.30 H new ATOM 0 HB2 TYR A 19 -13.917 8.665 -0.583 1.00 55.15 H new ATOM 0 HB3 TYR A 19 -14.798 9.552 0.646 1.00 55.15 H new ATOM 0 HD1 TYR A 19 -15.011 8.285 -2.829 1.00 33.44 H new ATOM 0 HD2 TYR A 19 -17.164 9.830 0.494 1.00 33.51 H new ATOM 0 HE1 TYR A 19 -17.111 7.692 -3.926 1.00 52.51 H new ATOM 0 HE2 TYR A 19 -19.281 9.233 -0.597 1.00 3.31 H new ATOM 0 HH TYR A 19 -20.264 8.335 -2.373 1.00 3.21 H new ATOM 319 N THR A 20 -13.118 11.784 0.964 1.00 45.23 N ATOM 320 CA THR A 20 -12.146 12.219 1.906 1.00 33.23 C ATOM 321 C THR A 20 -12.342 11.465 3.199 1.00 53.33 C ATOM 322 O THR A 20 -13.445 11.455 3.756 1.00 23.22 O ATOM 323 CB THR A 20 -12.239 13.744 2.153 1.00 4.23 C ATOM 324 OG1 THR A 20 -13.603 14.129 2.471 1.00 25.10 O ATOM 325 CG2 THR A 20 -11.758 14.526 0.947 1.00 74.34 C ATOM 0 H THR A 20 -14.074 12.023 1.227 1.00 45.23 H new ATOM 0 HA THR A 20 -11.154 12.015 1.504 1.00 33.23 H new ATOM 0 HB THR A 20 -11.594 13.979 2.999 1.00 4.23 H new ATOM 0 HG1 THR A 20 -14.072 13.369 2.875 1.00 25.10 H new ATOM 0 HG21 THR A 20 -11.836 15.594 1.151 1.00 74.34 H new ATOM 0 HG22 THR A 20 -10.719 14.271 0.739 1.00 74.34 H new ATOM 0 HG23 THR A 20 -12.373 14.276 0.082 1.00 74.34 H new ATOM 333 N MET A 21 -11.311 10.815 3.658 1.00 33.05 N ATOM 334 CA MET A 21 -11.415 10.027 4.878 1.00 1.02 C ATOM 335 C MET A 21 -10.043 9.757 5.459 1.00 63.01 C ATOM 336 O MET A 21 -9.073 9.673 4.724 1.00 5.43 O ATOM 337 CB MET A 21 -12.169 8.708 4.625 1.00 40.25 C ATOM 338 CG MET A 21 -12.397 7.897 5.884 1.00 45.02 C ATOM 339 SD MET A 21 -13.353 8.812 7.109 1.00 10.34 S ATOM 340 CE MET A 21 -13.308 7.680 8.489 1.00 54.43 C ATOM 0 H MET A 21 -10.391 10.807 3.219 1.00 33.05 H new ATOM 0 HA MET A 21 -11.987 10.606 5.603 1.00 1.02 H new ATOM 0 HB2 MET A 21 -13.132 8.930 4.165 1.00 40.25 H new ATOM 0 HB3 MET A 21 -11.606 8.107 3.911 1.00 40.25 H new ATOM 0 HG2 MET A 21 -12.919 6.974 5.632 1.00 45.02 H new ATOM 0 HG3 MET A 21 -11.436 7.613 6.312 1.00 45.02 H new ATOM 0 HE1 MET A 21 -14.000 8.019 9.260 1.00 54.43 H new ATOM 0 HE2 MET A 21 -13.599 6.685 8.153 1.00 54.43 H new ATOM 0 HE3 MET A 21 -12.298 7.644 8.898 1.00 54.43 H new ATOM 350 N LYS A 22 -9.965 9.625 6.766 1.00 3.25 N ATOM 351 CA LYS A 22 -8.705 9.366 7.413 1.00 14.41 C ATOM 352 C LYS A 22 -8.481 7.856 7.531 1.00 34.40 C ATOM 353 O LYS A 22 -9.365 7.112 7.991 1.00 30.54 O ATOM 354 CB LYS A 22 -8.651 10.030 8.791 1.00 65.53 C ATOM 355 CG LYS A 22 -8.871 11.542 8.764 1.00 23.10 C ATOM 356 CD LYS A 22 -7.862 12.236 7.867 1.00 72.13 C ATOM 357 CE LYS A 22 -8.060 13.749 7.857 1.00 24.20 C ATOM 358 NZ LYS A 22 -7.904 14.345 9.202 1.00 2.33 N ATOM 0 H LYS A 22 -10.762 9.694 7.398 1.00 3.25 H new ATOM 0 HA LYS A 22 -7.908 9.794 6.806 1.00 14.41 H new ATOM 0 HB2 LYS A 22 -9.407 9.575 9.432 1.00 65.53 H new ATOM 0 HB3 LYS A 22 -7.682 9.823 9.245 1.00 65.53 H new ATOM 0 HG2 LYS A 22 -9.880 11.757 8.413 1.00 23.10 H new ATOM 0 HG3 LYS A 22 -8.794 11.940 9.776 1.00 23.10 H new ATOM 0 HD2 LYS A 22 -6.853 12.004 8.207 1.00 72.13 H new ATOM 0 HD3 LYS A 22 -7.953 11.851 6.851 1.00 72.13 H new ATOM 0 HE2 LYS A 22 -7.341 14.203 7.175 1.00 24.20 H new ATOM 0 HE3 LYS A 22 -9.053 13.981 7.472 1.00 24.20 H new ATOM 0 HZ1 LYS A 22 -7.827 15.379 9.117 1.00 2.33 H new ATOM 0 HZ2 LYS A 22 -8.731 14.106 9.786 1.00 2.33 H new ATOM 0 HZ3 LYS A 22 -7.044 13.970 9.650 1.00 2.33 H new ATOM 372 N PRO A 23 -7.301 7.392 7.106 1.00 72.01 N ATOM 373 CA PRO A 23 -6.963 5.972 7.058 1.00 52.10 C ATOM 374 C PRO A 23 -6.827 5.335 8.434 1.00 23.33 C ATOM 375 O PRO A 23 -6.215 5.900 9.354 1.00 21.14 O ATOM 376 CB PRO A 23 -5.622 5.945 6.326 1.00 51.54 C ATOM 377 CG PRO A 23 -5.031 7.283 6.580 1.00 1.24 C ATOM 378 CD PRO A 23 -6.187 8.232 6.633 1.00 53.34 C ATOM 0 HA PRO A 23 -7.750 5.398 6.568 1.00 52.10 H new ATOM 0 HB2 PRO A 23 -4.980 5.150 6.704 1.00 51.54 H new ATOM 0 HB3 PRO A 23 -5.756 5.767 5.259 1.00 51.54 H new ATOM 0 HG2 PRO A 23 -4.473 7.293 7.516 1.00 1.24 H new ATOM 0 HG3 PRO A 23 -4.333 7.559 5.790 1.00 1.24 H new ATOM 0 HD2 PRO A 23 -5.994 9.062 7.312 1.00 53.34 H new ATOM 0 HD3 PRO A 23 -6.397 8.663 5.654 1.00 53.34 H new ATOM 386 N LYS A 24 -7.408 4.167 8.570 1.00 3.40 N ATOM 387 CA LYS A 24 -7.336 3.410 9.785 1.00 72.52 C ATOM 388 C LYS A 24 -6.656 2.074 9.520 1.00 62.42 C ATOM 389 O LYS A 24 -6.109 1.452 10.426 1.00 70.24 O ATOM 390 CB LYS A 24 -8.742 3.177 10.328 1.00 60.11 C ATOM 391 CG LYS A 24 -8.859 2.323 11.601 1.00 33.10 C ATOM 392 CD LYS A 24 -8.487 3.040 12.921 1.00 60.14 C ATOM 393 CE LYS A 24 -7.008 3.365 13.077 1.00 42.21 C ATOM 394 NZ LYS A 24 -6.731 3.988 14.386 1.00 32.00 N ATOM 0 H LYS A 24 -7.947 3.716 7.831 1.00 3.40 H new ATOM 0 HA LYS A 24 -6.755 3.965 10.521 1.00 72.52 H new ATOM 0 HB2 LYS A 24 -9.195 4.148 10.527 1.00 60.11 H new ATOM 0 HB3 LYS A 24 -9.335 2.704 9.545 1.00 60.11 H new ATOM 0 HG2 LYS A 24 -9.884 1.960 11.681 1.00 33.10 H new ATOM 0 HG3 LYS A 24 -8.219 1.448 11.490 1.00 33.10 H new ATOM 0 HD2 LYS A 24 -9.057 3.967 12.988 1.00 60.14 H new ATOM 0 HD3 LYS A 24 -8.797 2.414 13.758 1.00 60.14 H new ATOM 0 HE2 LYS A 24 -6.420 2.453 12.974 1.00 42.21 H new ATOM 0 HE3 LYS A 24 -6.695 4.037 12.278 1.00 42.21 H new ATOM 0 HZ1 LYS A 24 -5.707 4.136 14.490 1.00 32.00 H new ATOM 0 HZ2 LYS A 24 -7.221 4.904 14.445 1.00 32.00 H new ATOM 0 HZ3 LYS A 24 -7.070 3.364 15.146 1.00 32.00 H new ATOM 408 N TYR A 25 -6.698 1.629 8.285 1.00 12.21 N ATOM 409 CA TYR A 25 -6.105 0.361 7.932 1.00 4.43 C ATOM 410 C TYR A 25 -5.047 0.567 6.878 1.00 4.11 C ATOM 411 O TYR A 25 -4.872 1.677 6.376 1.00 63.14 O ATOM 412 CB TYR A 25 -7.147 -0.604 7.366 1.00 51.13 C ATOM 413 CG TYR A 25 -8.351 -0.884 8.241 1.00 40.32 C ATOM 414 CD1 TYR A 25 -9.453 -0.038 8.227 1.00 12.22 C ATOM 415 CD2 TYR A 25 -8.396 -2.003 9.061 1.00 15.41 C ATOM 416 CE1 TYR A 25 -10.561 -0.296 9.001 1.00 31.51 C ATOM 417 CE2 TYR A 25 -9.505 -2.268 9.844 1.00 73.21 C ATOM 418 CZ TYR A 25 -10.584 -1.410 9.809 1.00 33.40 C ATOM 419 OH TYR A 25 -11.700 -1.676 10.576 1.00 35.24 O ATOM 0 H TYR A 25 -7.136 2.126 7.509 1.00 12.21 H new ATOM 0 HA TYR A 25 -5.675 -0.062 8.840 1.00 4.43 H new ATOM 0 HB2 TYR A 25 -7.501 -0.205 6.415 1.00 51.13 H new ATOM 0 HB3 TYR A 25 -6.654 -1.552 7.150 1.00 51.13 H new ATOM 0 HD1 TYR A 25 -9.440 0.839 7.597 1.00 12.22 H new ATOM 0 HD2 TYR A 25 -7.552 -2.677 9.088 1.00 15.41 H new ATOM 0 HE1 TYR A 25 -11.409 0.373 8.975 1.00 31.51 H new ATOM 0 HE2 TYR A 25 -9.526 -3.141 10.479 1.00 73.21 H new ATOM 0 HH TYR A 25 -11.556 -2.499 11.088 1.00 35.24 H new ATOM 429 N ILE A 26 -4.370 -0.497 6.526 1.00 2.32 N ATOM 430 CA ILE A 26 -3.383 -0.478 5.468 1.00 73.20 C ATOM 431 C ILE A 26 -3.529 -1.743 4.653 1.00 50.40 C ATOM 432 O ILE A 26 -3.616 -2.832 5.205 1.00 3.31 O ATOM 433 CB ILE A 26 -1.915 -0.358 6.001 1.00 12.41 C ATOM 434 CG1 ILE A 26 -1.730 0.958 6.771 1.00 72.25 C ATOM 435 CG2 ILE A 26 -0.901 -0.456 4.852 1.00 51.24 C ATOM 436 CD1 ILE A 26 -0.347 1.170 7.336 1.00 11.53 C ATOM 0 H ILE A 26 -4.487 -1.409 6.967 1.00 2.32 H new ATOM 0 HA ILE A 26 -3.565 0.407 4.859 1.00 73.20 H new ATOM 0 HB ILE A 26 -1.734 -1.189 6.682 1.00 12.41 H new ATOM 0 HG12 ILE A 26 -1.967 1.788 6.106 1.00 72.25 H new ATOM 0 HG13 ILE A 26 -2.450 0.989 7.589 1.00 72.25 H new ATOM 0 HG21 ILE A 26 0.110 -0.370 5.250 1.00 51.24 H new ATOM 0 HG22 ILE A 26 -1.012 -1.417 4.350 1.00 51.24 H new ATOM 0 HG23 ILE A 26 -1.080 0.349 4.139 1.00 51.24 H new ATOM 0 HD11 ILE A 26 -0.311 2.124 7.862 1.00 11.53 H new ATOM 0 HD12 ILE A 26 -0.110 0.364 8.030 1.00 11.53 H new ATOM 0 HD13 ILE A 26 0.381 1.176 6.524 1.00 11.53 H new ATOM 448 N THR A 27 -3.591 -1.596 3.369 1.00 14.12 N ATOM 449 CA THR A 27 -3.720 -2.716 2.494 1.00 41.34 C ATOM 450 C THR A 27 -2.456 -2.836 1.651 1.00 2.13 C ATOM 451 O THR A 27 -2.097 -1.903 0.908 1.00 71.12 O ATOM 452 CB THR A 27 -4.943 -2.547 1.570 1.00 21.20 C ATOM 453 OG1 THR A 27 -6.102 -2.266 2.362 1.00 35.41 O ATOM 454 CG2 THR A 27 -5.192 -3.817 0.766 1.00 11.42 C ATOM 0 H THR A 27 -3.553 -0.693 2.896 1.00 14.12 H new ATOM 0 HA THR A 27 -3.860 -3.618 3.090 1.00 41.34 H new ATOM 0 HB THR A 27 -4.745 -1.725 0.882 1.00 21.20 H new ATOM 0 HG1 THR A 27 -6.888 -2.204 1.781 1.00 35.41 H new ATOM 0 HG21 THR A 27 -6.059 -3.675 0.121 1.00 11.42 H new ATOM 0 HG22 THR A 27 -4.317 -4.038 0.154 1.00 11.42 H new ATOM 0 HG23 THR A 27 -5.378 -4.648 1.447 1.00 11.42 H new ATOM 462 N VAL A 28 -1.787 -3.954 1.759 1.00 51.42 N ATOM 463 CA VAL A 28 -0.567 -4.180 1.021 1.00 43.03 C ATOM 464 C VAL A 28 -0.887 -4.969 -0.238 1.00 24.30 C ATOM 465 O VAL A 28 -1.702 -5.906 -0.216 1.00 75.30 O ATOM 466 CB VAL A 28 0.467 -4.948 1.878 1.00 4.15 C ATOM 467 CG1 VAL A 28 1.776 -5.130 1.126 1.00 61.54 C ATOM 468 CG2 VAL A 28 0.701 -4.211 3.181 1.00 4.22 C ATOM 0 H VAL A 28 -2.068 -4.731 2.357 1.00 51.42 H new ATOM 0 HA VAL A 28 -0.133 -3.216 0.755 1.00 43.03 H new ATOM 0 HB VAL A 28 0.069 -5.939 2.095 1.00 4.15 H new ATOM 0 HG11 VAL A 28 2.483 -5.673 1.753 1.00 61.54 H new ATOM 0 HG12 VAL A 28 1.595 -5.694 0.211 1.00 61.54 H new ATOM 0 HG13 VAL A 28 2.190 -4.154 0.874 1.00 61.54 H new ATOM 0 HG21 VAL A 28 1.430 -4.756 3.781 1.00 4.22 H new ATOM 0 HG22 VAL A 28 1.079 -3.211 2.970 1.00 4.22 H new ATOM 0 HG23 VAL A 28 -0.238 -4.136 3.730 1.00 4.22 H new ATOM 478 N HIS A 29 -0.305 -4.564 -1.329 1.00 40.13 N ATOM 479 CA HIS A 29 -0.529 -5.198 -2.601 1.00 71.11 C ATOM 480 C HIS A 29 0.821 -5.560 -3.182 1.00 63.42 C ATOM 481 O HIS A 29 1.830 -4.910 -2.881 1.00 53.14 O ATOM 482 CB HIS A 29 -1.241 -4.232 -3.598 1.00 71.32 C ATOM 483 CG HIS A 29 -2.505 -3.559 -3.088 1.00 10.12 C ATOM 484 ND1 HIS A 29 -3.799 -3.863 -3.525 1.00 73.15 N ATOM 485 CD2 HIS A 29 -2.656 -2.574 -2.169 1.00 12.22 C ATOM 486 CE1 HIS A 29 -4.658 -3.087 -2.885 1.00 10.22 C ATOM 487 NE2 HIS A 29 -3.994 -2.301 -2.061 1.00 53.54 N ATOM 0 H HIS A 29 0.344 -3.778 -1.364 1.00 40.13 H new ATOM 0 HA HIS A 29 -1.160 -6.074 -2.453 1.00 71.11 H new ATOM 0 HB2 HIS A 29 -0.533 -3.456 -3.889 1.00 71.32 H new ATOM 0 HB3 HIS A 29 -1.490 -4.792 -4.500 1.00 71.32 H new ATOM 0 HD2 HIS A 29 -1.862 -2.090 -1.619 1.00 12.22 H new ATOM 0 HE1 HIS A 29 -5.730 -3.096 -3.016 1.00 10.22 H new ATOM 0 HE2 HIS A 29 -4.409 -1.603 -1.444 1.00 53.54 H new ATOM 495 N ASN A 30 0.847 -6.577 -3.974 1.00 72.03 N ATOM 496 CA ASN A 30 2.043 -6.951 -4.690 1.00 35.50 C ATOM 497 C ASN A 30 1.801 -6.650 -6.136 1.00 65.33 C ATOM 498 O ASN A 30 0.680 -6.871 -6.626 1.00 52.54 O ATOM 499 CB ASN A 30 2.363 -8.463 -4.542 1.00 13.04 C ATOM 500 CG ASN A 30 2.926 -8.919 -3.177 1.00 63.13 C ATOM 501 OD1 ASN A 30 2.695 -10.055 -2.754 1.00 63.13 O ATOM 502 ND2 ASN A 30 3.695 -8.086 -2.516 1.00 52.04 N ATOM 0 H ASN A 30 0.044 -7.181 -4.151 1.00 72.03 H new ATOM 0 HA ASN A 30 2.890 -6.396 -4.285 1.00 35.50 H new ATOM 0 HB2 ASN A 30 1.451 -9.026 -4.740 1.00 13.04 H new ATOM 0 HB3 ASN A 30 3.080 -8.737 -5.316 1.00 13.04 H new ATOM 0 HD21 ASN A 30 4.116 -8.373 -1.632 1.00 52.04 H new ATOM 0 HD22 ASN A 30 3.871 -7.152 -2.886 1.00 52.04 H new ATOM 509 N THR A 31 2.802 -6.171 -6.839 1.00 52.45 N ATOM 510 CA THR A 31 2.630 -5.877 -8.229 1.00 51.45 C ATOM 511 C THR A 31 2.529 -7.151 -9.029 1.00 3.40 C ATOM 512 O THR A 31 3.308 -8.095 -8.826 1.00 64.43 O ATOM 513 CB THR A 31 3.749 -4.978 -8.799 1.00 31.02 C ATOM 514 OG1 THR A 31 5.049 -5.556 -8.558 1.00 42.15 O ATOM 515 CG2 THR A 31 3.677 -3.576 -8.237 1.00 44.43 C ATOM 0 H THR A 31 3.733 -5.981 -6.468 1.00 52.45 H new ATOM 0 HA THR A 31 1.699 -5.316 -8.315 1.00 51.45 H new ATOM 0 HB THR A 31 3.596 -4.912 -9.876 1.00 31.02 H new ATOM 0 HG1 THR A 31 5.409 -5.913 -9.397 1.00 42.15 H new ATOM 0 HG21 THR A 31 4.480 -2.972 -8.661 1.00 44.43 H new ATOM 0 HG22 THR A 31 2.715 -3.131 -8.492 1.00 44.43 H new ATOM 0 HG23 THR A 31 3.784 -3.613 -7.153 1.00 44.43 H new ATOM 523 N TYR A 32 1.579 -7.185 -9.927 1.00 12.12 N ATOM 524 CA TYR A 32 1.353 -8.350 -10.737 1.00 3.32 C ATOM 525 C TYR A 32 2.403 -8.397 -11.830 1.00 34.44 C ATOM 526 O TYR A 32 2.677 -9.448 -12.399 1.00 5.40 O ATOM 527 CB TYR A 32 -0.073 -8.341 -11.322 1.00 33.10 C ATOM 528 CG TYR A 32 -0.459 -9.628 -12.024 1.00 12.21 C ATOM 529 CD1 TYR A 32 -0.942 -10.706 -11.296 1.00 12.34 C ATOM 530 CD2 TYR A 32 -0.325 -9.776 -13.401 1.00 25.35 C ATOM 531 CE1 TYR A 32 -1.282 -11.888 -11.911 1.00 60.44 C ATOM 532 CE2 TYR A 32 -0.661 -10.963 -14.025 1.00 61.13 C ATOM 533 CZ TYR A 32 -1.139 -12.015 -13.273 1.00 53.13 C ATOM 534 OH TYR A 32 -1.468 -13.213 -13.888 1.00 2.25 O ATOM 0 H TYR A 32 0.944 -6.409 -10.116 1.00 12.12 H new ATOM 0 HA TYR A 32 1.439 -9.247 -10.124 1.00 3.32 H new ATOM 0 HB2 TYR A 32 -0.784 -8.151 -10.518 1.00 33.10 H new ATOM 0 HB3 TYR A 32 -0.160 -7.514 -12.027 1.00 33.10 H new ATOM 0 HD1 TYR A 32 -1.053 -10.615 -10.226 1.00 12.34 H new ATOM 0 HD2 TYR A 32 0.047 -8.951 -13.991 1.00 25.35 H new ATOM 0 HE1 TYR A 32 -1.660 -12.714 -11.327 1.00 60.44 H new ATOM 0 HE2 TYR A 32 -0.550 -11.065 -15.094 1.00 61.13 H new ATOM 0 HH TYR A 32 -1.311 -13.139 -14.853 1.00 2.25 H new ATOM 544 N ASN A 33 2.999 -7.260 -12.087 1.00 5.12 N ATOM 545 CA ASN A 33 4.056 -7.137 -13.060 1.00 73.24 C ATOM 546 C ASN A 33 5.303 -6.639 -12.355 1.00 22.05 C ATOM 547 O ASN A 33 5.258 -6.274 -11.165 1.00 44.14 O ATOM 548 CB ASN A 33 3.668 -6.163 -14.187 1.00 21.42 C ATOM 549 CG ASN A 33 2.452 -6.605 -14.998 1.00 40.42 C ATOM 550 OD1 ASN A 33 2.197 -7.798 -15.177 1.00 43.34 O ATOM 551 ND2 ASN A 33 1.698 -5.648 -15.489 1.00 1.20 N ATOM 0 H ASN A 33 2.762 -6.384 -11.622 1.00 5.12 H new ATOM 0 HA ASN A 33 4.237 -8.112 -13.513 1.00 73.24 H new ATOM 0 HB2 ASN A 33 3.466 -5.183 -13.753 1.00 21.42 H new ATOM 0 HB3 ASN A 33 4.517 -6.045 -14.860 1.00 21.42 H new ATOM 0 HD21 ASN A 33 0.871 -5.881 -16.038 1.00 1.20 H new ATOM 0 HD22 ASN A 33 1.940 -4.671 -15.321 1.00 1.20 H new ATOM 558 N ASP A 34 6.397 -6.645 -13.035 1.00 54.41 N ATOM 559 CA ASP A 34 7.633 -6.157 -12.478 1.00 5.55 C ATOM 560 C ASP A 34 7.976 -4.827 -13.105 1.00 3.44 C ATOM 561 O ASP A 34 8.283 -4.740 -14.287 1.00 41.14 O ATOM 562 CB ASP A 34 8.787 -7.187 -12.604 1.00 45.23 C ATOM 563 CG ASP A 34 9.108 -7.607 -14.027 1.00 74.04 C ATOM 564 OD1 ASP A 34 8.419 -8.489 -14.561 1.00 13.52 O ATOM 565 OD2 ASP A 34 10.057 -7.067 -14.621 1.00 55.44 O ATOM 0 H ASP A 34 6.471 -6.986 -13.993 1.00 54.41 H new ATOM 0 HA ASP A 34 7.496 -6.010 -11.407 1.00 5.55 H new ATOM 0 HB2 ASP A 34 9.685 -6.764 -12.153 1.00 45.23 H new ATOM 0 HB3 ASP A 34 8.528 -8.075 -12.027 1.00 45.23 H new ATOM 570 N ALA A 35 7.884 -3.789 -12.315 1.00 21.20 N ATOM 571 CA ALA A 35 8.098 -2.450 -12.790 1.00 72.41 C ATOM 572 C ALA A 35 8.545 -1.572 -11.630 1.00 12.23 C ATOM 573 O ALA A 35 8.382 -1.964 -10.475 1.00 35.04 O ATOM 574 CB ALA A 35 6.787 -1.912 -13.381 1.00 50.25 C ATOM 0 H ALA A 35 7.658 -3.850 -11.322 1.00 21.20 H new ATOM 0 HA ALA A 35 8.869 -2.445 -13.560 1.00 72.41 H new ATOM 0 HB1 ALA A 35 6.941 -0.896 -13.744 1.00 50.25 H new ATOM 0 HB2 ALA A 35 6.472 -2.549 -14.208 1.00 50.25 H new ATOM 0 HB3 ALA A 35 6.015 -1.909 -12.611 1.00 50.25 H new ATOM 580 N PRO A 36 9.164 -0.408 -11.921 1.00 63.53 N ATOM 581 CA PRO A 36 9.520 0.582 -10.924 1.00 53.32 C ATOM 582 C PRO A 36 8.301 1.245 -10.375 1.00 5.11 C ATOM 583 O PRO A 36 7.284 1.388 -11.078 1.00 4.21 O ATOM 584 CB PRO A 36 10.345 1.624 -11.649 1.00 60.21 C ATOM 585 CG PRO A 36 10.606 1.079 -12.978 1.00 4.21 C ATOM 586 CD PRO A 36 9.574 0.026 -13.250 1.00 25.33 C ATOM 0 HA PRO A 36 10.056 0.117 -10.097 1.00 53.32 H new ATOM 0 HB2 PRO A 36 9.808 2.570 -11.714 1.00 60.21 H new ATOM 0 HB3 PRO A 36 11.277 1.822 -11.119 1.00 60.21 H new ATOM 0 HG2 PRO A 36 10.557 1.866 -13.730 1.00 4.21 H new ATOM 0 HG3 PRO A 36 11.608 0.654 -13.027 1.00 4.21 H new ATOM 0 HD2 PRO A 36 8.734 0.426 -13.817 1.00 25.33 H new ATOM 0 HD3 PRO A 36 9.987 -0.799 -13.831 1.00 25.33 H new ATOM 594 N ALA A 37 8.396 1.642 -9.153 1.00 34.31 N ATOM 595 CA ALA A 37 7.273 2.278 -8.437 1.00 71.22 C ATOM 596 C ALA A 37 6.783 3.518 -9.181 1.00 62.25 C ATOM 597 O ALA A 37 5.592 3.844 -9.174 1.00 21.53 O ATOM 598 CB ALA A 37 7.683 2.637 -7.025 1.00 72.31 C ATOM 0 H ALA A 37 9.244 1.548 -8.595 1.00 34.31 H new ATOM 0 HA ALA A 37 6.451 1.563 -8.391 1.00 71.22 H new ATOM 0 HB1 ALA A 37 6.844 3.105 -6.510 1.00 72.31 H new ATOM 0 HB2 ALA A 37 7.978 1.734 -6.491 1.00 72.31 H new ATOM 0 HB3 ALA A 37 8.523 3.331 -7.055 1.00 72.31 H new ATOM 604 N GLU A 38 7.717 4.179 -9.839 1.00 71.43 N ATOM 605 CA GLU A 38 7.458 5.364 -10.642 1.00 44.21 C ATOM 606 C GLU A 38 6.427 5.050 -11.732 1.00 14.23 C ATOM 607 O GLU A 38 5.478 5.811 -11.961 1.00 13.44 O ATOM 608 CB GLU A 38 8.777 5.811 -11.273 1.00 74.50 C ATOM 609 CG GLU A 38 8.706 7.068 -12.111 1.00 64.15 C ATOM 610 CD GLU A 38 10.045 7.403 -12.709 1.00 52.41 C ATOM 611 OE1 GLU A 38 10.870 8.035 -12.025 1.00 4.01 O ATOM 612 OE2 GLU A 38 10.310 7.005 -13.855 1.00 74.34 O ATOM 0 H GLU A 38 8.699 3.903 -9.831 1.00 71.43 H new ATOM 0 HA GLU A 38 7.055 6.160 -10.016 1.00 44.21 H new ATOM 0 HB2 GLU A 38 9.506 5.967 -10.477 1.00 74.50 H new ATOM 0 HB3 GLU A 38 9.154 5.000 -11.897 1.00 74.50 H new ATOM 0 HG2 GLU A 38 7.973 6.936 -12.907 1.00 64.15 H new ATOM 0 HG3 GLU A 38 8.362 7.899 -11.495 1.00 64.15 H new ATOM 619 N ASN A 39 6.606 3.910 -12.358 1.00 33.14 N ATOM 620 CA ASN A 39 5.753 3.460 -13.433 1.00 22.21 C ATOM 621 C ASN A 39 4.390 3.076 -12.914 1.00 24.52 C ATOM 622 O ASN A 39 3.367 3.377 -13.542 1.00 71.12 O ATOM 623 CB ASN A 39 6.378 2.260 -14.138 1.00 64.21 C ATOM 624 CG ASN A 39 7.684 2.566 -14.864 1.00 23.52 C ATOM 625 OD1 ASN A 39 8.442 3.461 -14.484 1.00 11.43 O ATOM 626 ND2 ASN A 39 7.971 1.812 -15.889 1.00 4.24 N ATOM 0 H ASN A 39 7.359 3.260 -12.132 1.00 33.14 H new ATOM 0 HA ASN A 39 5.644 4.283 -14.139 1.00 22.21 H new ATOM 0 HB2 ASN A 39 6.560 1.476 -13.403 1.00 64.21 H new ATOM 0 HB3 ASN A 39 5.661 1.862 -14.857 1.00 64.21 H new ATOM 0 HD21 ASN A 39 8.842 1.955 -16.399 1.00 4.24 H new ATOM 0 HD22 ASN A 39 7.324 1.079 -16.180 1.00 4.24 H new ATOM 633 N GLU A 40 4.367 2.442 -11.750 1.00 10.11 N ATOM 634 CA GLU A 40 3.117 1.989 -11.164 1.00 3.33 C ATOM 635 C GLU A 40 2.242 3.152 -10.767 1.00 54.25 C ATOM 636 O GLU A 40 1.033 3.122 -10.973 1.00 54.34 O ATOM 637 CB GLU A 40 3.354 1.033 -9.993 1.00 51.43 C ATOM 638 CG GLU A 40 3.895 -0.324 -10.417 1.00 3.42 C ATOM 639 CD GLU A 40 2.908 -1.078 -11.289 1.00 53.25 C ATOM 640 OE1 GLU A 40 2.022 -1.773 -10.741 1.00 43.10 O ATOM 641 OE2 GLU A 40 2.977 -0.974 -12.534 1.00 24.34 O ATOM 0 H GLU A 40 5.197 2.231 -11.196 1.00 10.11 H new ATOM 0 HA GLU A 40 2.583 1.427 -11.931 1.00 3.33 H new ATOM 0 HB2 GLU A 40 4.054 1.492 -9.295 1.00 51.43 H new ATOM 0 HB3 GLU A 40 2.416 0.890 -9.456 1.00 51.43 H new ATOM 0 HG2 GLU A 40 4.830 -0.189 -10.960 1.00 3.42 H new ATOM 0 HG3 GLU A 40 4.124 -0.917 -9.531 1.00 3.42 H new ATOM 648 N VAL A 41 2.856 4.193 -10.240 1.00 4.13 N ATOM 649 CA VAL A 41 2.112 5.383 -9.846 1.00 11.20 C ATOM 650 C VAL A 41 1.567 6.091 -11.067 1.00 65.12 C ATOM 651 O VAL A 41 0.385 6.451 -11.106 1.00 11.21 O ATOM 652 CB VAL A 41 2.951 6.357 -8.985 1.00 40.13 C ATOM 653 CG1 VAL A 41 2.165 7.631 -8.671 1.00 52.52 C ATOM 654 CG2 VAL A 41 3.346 5.678 -7.698 1.00 33.44 C ATOM 0 H VAL A 41 3.861 4.244 -10.074 1.00 4.13 H new ATOM 0 HA VAL A 41 1.283 5.047 -9.223 1.00 11.20 H new ATOM 0 HB VAL A 41 3.842 6.634 -9.549 1.00 40.13 H new ATOM 0 HG11 VAL A 41 2.779 8.297 -8.065 1.00 52.52 H new ATOM 0 HG12 VAL A 41 1.896 8.131 -9.601 1.00 52.52 H new ATOM 0 HG13 VAL A 41 1.259 7.374 -8.123 1.00 52.52 H new ATOM 0 HG21 VAL A 41 3.937 6.364 -7.091 1.00 33.44 H new ATOM 0 HG22 VAL A 41 2.450 5.388 -7.149 1.00 33.44 H new ATOM 0 HG23 VAL A 41 3.937 4.790 -7.922 1.00 33.44 H new ATOM 664 N SER A 42 2.419 6.266 -12.067 1.00 61.42 N ATOM 665 CA SER A 42 2.028 6.883 -13.320 1.00 34.32 C ATOM 666 C SER A 42 0.839 6.139 -13.962 1.00 45.31 C ATOM 667 O SER A 42 -0.076 6.763 -14.505 1.00 1.33 O ATOM 668 CB SER A 42 3.223 6.918 -14.263 1.00 62.44 C ATOM 669 OG SER A 42 4.308 7.610 -13.656 1.00 71.30 O ATOM 0 H SER A 42 3.398 5.984 -12.030 1.00 61.42 H new ATOM 0 HA SER A 42 1.701 7.904 -13.122 1.00 34.32 H new ATOM 0 HB2 SER A 42 3.526 5.902 -14.516 1.00 62.44 H new ATOM 0 HB3 SER A 42 2.945 7.409 -15.196 1.00 62.44 H new ATOM 0 HG SER A 42 4.769 7.012 -13.031 1.00 71.30 H new ATOM 675 N TYR A 43 0.846 4.812 -13.873 1.00 63.22 N ATOM 676 CA TYR A 43 -0.246 4.010 -14.400 1.00 32.55 C ATOM 677 C TYR A 43 -1.477 4.155 -13.512 1.00 54.34 C ATOM 678 O TYR A 43 -2.593 4.267 -14.001 1.00 64.15 O ATOM 679 CB TYR A 43 0.157 2.528 -14.487 1.00 54.12 C ATOM 680 CG TYR A 43 -0.900 1.626 -15.112 1.00 43.40 C ATOM 681 CD1 TYR A 43 -1.893 1.041 -14.336 1.00 74.43 C ATOM 682 CD2 TYR A 43 -0.901 1.367 -16.475 1.00 0.33 C ATOM 683 CE1 TYR A 43 -2.853 0.225 -14.895 1.00 72.11 C ATOM 684 CE2 TYR A 43 -1.860 0.549 -17.046 1.00 4.54 C ATOM 685 CZ TYR A 43 -2.834 -0.019 -16.250 1.00 54.33 C ATOM 686 OH TYR A 43 -3.794 -0.833 -16.815 1.00 41.44 O ATOM 0 H TYR A 43 1.596 4.273 -13.441 1.00 63.22 H new ATOM 0 HA TYR A 43 -0.478 4.368 -15.403 1.00 32.55 H new ATOM 0 HB2 TYR A 43 1.076 2.447 -15.067 1.00 54.12 H new ATOM 0 HB3 TYR A 43 0.380 2.165 -13.484 1.00 54.12 H new ATOM 0 HD1 TYR A 43 -1.913 1.230 -13.273 1.00 74.43 H new ATOM 0 HD2 TYR A 43 -0.141 1.811 -17.101 1.00 0.33 H new ATOM 0 HE1 TYR A 43 -3.616 -0.220 -14.274 1.00 72.11 H new ATOM 0 HE2 TYR A 43 -1.846 0.356 -18.109 1.00 4.54 H new ATOM 0 HH TYR A 43 -3.639 -0.901 -17.780 1.00 41.44 H new ATOM 696 N MET A 44 -1.257 4.165 -12.213 1.00 74.35 N ATOM 697 CA MET A 44 -2.326 4.244 -11.238 1.00 63.21 C ATOM 698 C MET A 44 -3.144 5.515 -11.380 1.00 44.11 C ATOM 699 O MET A 44 -4.378 5.455 -11.443 1.00 4.55 O ATOM 700 CB MET A 44 -1.774 4.038 -9.826 1.00 74.11 C ATOM 701 CG MET A 44 -2.796 4.092 -8.702 1.00 43.33 C ATOM 702 SD MET A 44 -3.246 5.760 -8.178 1.00 12.23 S ATOM 703 CE MET A 44 -1.661 6.335 -7.539 1.00 1.21 C ATOM 0 H MET A 44 -0.325 4.118 -11.801 1.00 74.35 H new ATOM 0 HA MET A 44 -3.027 3.433 -11.434 1.00 63.21 H new ATOM 0 HB2 MET A 44 -1.273 3.071 -9.790 1.00 74.11 H new ATOM 0 HB3 MET A 44 -1.015 4.798 -9.638 1.00 74.11 H new ATOM 0 HG2 MET A 44 -3.698 3.570 -9.023 1.00 43.33 H new ATOM 0 HG3 MET A 44 -2.402 3.549 -7.843 1.00 43.33 H new ATOM 0 HE1 MET A 44 -1.774 7.343 -7.141 1.00 1.21 H new ATOM 0 HE2 MET A 44 -1.324 5.667 -6.746 1.00 1.21 H new ATOM 0 HE3 MET A 44 -0.926 6.343 -8.343 1.00 1.21 H new ATOM 713 N ILE A 45 -2.468 6.643 -11.486 1.00 15.34 N ATOM 714 CA ILE A 45 -3.142 7.928 -11.657 1.00 34.04 C ATOM 715 C ILE A 45 -3.737 8.045 -13.061 1.00 72.22 C ATOM 716 O ILE A 45 -4.563 8.912 -13.335 1.00 62.43 O ATOM 717 CB ILE A 45 -2.207 9.139 -11.364 1.00 62.12 C ATOM 718 CG1 ILE A 45 -0.973 9.124 -12.284 1.00 32.31 C ATOM 719 CG2 ILE A 45 -1.796 9.150 -9.895 1.00 32.51 C ATOM 720 CD1 ILE A 45 -0.016 10.278 -12.056 1.00 43.34 C ATOM 0 H ILE A 45 -1.450 6.702 -11.457 1.00 15.34 H new ATOM 0 HA ILE A 45 -3.947 7.959 -10.923 1.00 34.04 H new ATOM 0 HB ILE A 45 -2.760 10.055 -11.572 1.00 62.12 H new ATOM 0 HG12 ILE A 45 -0.436 8.187 -12.138 1.00 32.31 H new ATOM 0 HG13 ILE A 45 -1.307 9.142 -13.322 1.00 32.31 H new ATOM 0 HG21 ILE A 45 -1.143 10.002 -9.706 1.00 32.51 H new ATOM 0 HG22 ILE A 45 -2.685 9.228 -9.269 1.00 32.51 H new ATOM 0 HG23 ILE A 45 -1.266 8.227 -9.659 1.00 32.51 H new ATOM 0 HD11 ILE A 45 0.826 10.194 -12.743 1.00 43.34 H new ATOM 0 HD12 ILE A 45 -0.534 11.221 -12.231 1.00 43.34 H new ATOM 0 HD13 ILE A 45 0.350 10.250 -11.030 1.00 43.34 H new ATOM 732 N SER A 46 -3.317 7.149 -13.930 1.00 33.23 N ATOM 733 CA SER A 46 -3.790 7.090 -15.282 1.00 21.01 C ATOM 734 C SER A 46 -5.097 6.285 -15.334 1.00 64.14 C ATOM 735 O SER A 46 -5.884 6.416 -16.286 1.00 61.24 O ATOM 736 CB SER A 46 -2.707 6.452 -16.169 1.00 54.10 C ATOM 737 OG SER A 46 -3.061 6.408 -17.539 1.00 52.45 O ATOM 0 H SER A 46 -2.626 6.433 -13.705 1.00 33.23 H new ATOM 0 HA SER A 46 -3.995 8.094 -15.654 1.00 21.01 H new ATOM 0 HB2 SER A 46 -1.779 7.013 -16.058 1.00 54.10 H new ATOM 0 HB3 SER A 46 -2.510 5.439 -15.819 1.00 54.10 H new ATOM 0 HG SER A 46 -2.335 5.995 -18.051 1.00 52.45 H new ATOM 743 N ASN A 47 -5.349 5.464 -14.295 1.00 32.40 N ATOM 744 CA ASN A 47 -6.592 4.692 -14.240 1.00 54.22 C ATOM 745 C ASN A 47 -7.760 5.593 -14.049 1.00 2.42 C ATOM 746 O ASN A 47 -7.621 6.793 -13.791 1.00 4.24 O ATOM 747 CB ASN A 47 -6.648 3.614 -13.136 1.00 12.34 C ATOM 748 CG ASN A 47 -5.671 2.497 -13.292 1.00 20.50 C ATOM 749 OD1 ASN A 47 -5.927 1.511 -13.972 1.00 74.40 O ATOM 750 ND2 ASN A 47 -4.610 2.609 -12.620 1.00 50.23 N ATOM 0 H ASN A 47 -4.721 5.324 -13.503 1.00 32.40 H new ATOM 0 HA ASN A 47 -6.625 4.175 -15.199 1.00 54.22 H new ATOM 0 HB2 ASN A 47 -6.477 4.094 -12.172 1.00 12.34 H new ATOM 0 HB3 ASN A 47 -7.654 3.195 -13.109 1.00 12.34 H new ATOM 0 HD21 ASN A 47 -3.920 1.858 -12.628 1.00 50.23 H new ATOM 0 HD22 ASN A 47 -4.442 3.451 -12.069 1.00 50.23 H new ATOM 757 N ASN A 48 -8.893 5.012 -14.098 1.00 3.44 N ATOM 758 CA ASN A 48 -10.143 5.752 -14.037 1.00 32.13 C ATOM 759 C ASN A 48 -11.275 4.881 -13.505 1.00 12.34 C ATOM 760 O ASN A 48 -12.176 5.358 -12.832 1.00 42.14 O ATOM 761 CB ASN A 48 -10.486 6.291 -15.448 1.00 0.15 C ATOM 762 CG ASN A 48 -11.800 7.065 -15.526 1.00 54.22 C ATOM 763 OD1 ASN A 48 -11.832 8.268 -15.309 1.00 73.41 O ATOM 764 ND2 ASN A 48 -12.870 6.398 -15.894 1.00 51.50 N ATOM 0 H ASN A 48 -9.008 4.002 -14.182 1.00 3.44 H new ATOM 0 HA ASN A 48 -10.024 6.588 -13.348 1.00 32.13 H new ATOM 0 HB2 ASN A 48 -9.676 6.939 -15.783 1.00 0.15 H new ATOM 0 HB3 ASN A 48 -10.531 5.452 -16.143 1.00 0.15 H new ATOM 0 HD21 ASN A 48 -13.760 6.883 -16.006 1.00 51.50 H new ATOM 0 HD22 ASN A 48 -12.811 5.395 -16.068 1.00 51.50 H new ATOM 771 N ASN A 49 -11.193 3.608 -13.775 1.00 23.22 N ATOM 772 CA ASN A 49 -12.266 2.683 -13.443 1.00 15.35 C ATOM 773 C ASN A 49 -12.329 2.266 -11.959 1.00 55.22 C ATOM 774 O ASN A 49 -13.197 2.745 -11.226 1.00 71.55 O ATOM 775 CB ASN A 49 -12.287 1.465 -14.393 1.00 43.30 C ATOM 776 CG ASN A 49 -13.436 0.504 -14.107 1.00 75.24 C ATOM 777 OD1 ASN A 49 -14.543 0.690 -14.606 1.00 11.22 O ATOM 778 ND2 ASN A 49 -13.175 -0.537 -13.358 1.00 50.33 N ATOM 0 H ASN A 49 -10.389 3.174 -14.229 1.00 23.22 H new ATOM 0 HA ASN A 49 -13.183 3.251 -13.602 1.00 15.35 H new ATOM 0 HB2 ASN A 49 -12.362 1.816 -15.422 1.00 43.30 H new ATOM 0 HB3 ASN A 49 -11.342 0.928 -14.307 1.00 43.30 H new ATOM 0 HD21 ASN A 49 -13.903 -1.227 -13.172 1.00 50.33 H new ATOM 0 HD22 ASN A 49 -12.244 -0.659 -12.960 1.00 50.33 H new ATOM 785 N GLU A 50 -11.419 1.413 -11.495 1.00 33.03 N ATOM 786 CA GLU A 50 -11.576 0.878 -10.136 1.00 42.43 C ATOM 787 C GLU A 50 -10.240 0.728 -9.358 1.00 43.21 C ATOM 788 O GLU A 50 -10.249 0.389 -8.179 1.00 1.15 O ATOM 789 CB GLU A 50 -12.270 -0.491 -10.216 1.00 12.13 C ATOM 790 CG GLU A 50 -12.731 -1.045 -8.883 1.00 4.24 C ATOM 791 CD GLU A 50 -13.155 -2.472 -8.969 1.00 43.32 C ATOM 792 OE1 GLU A 50 -14.309 -2.748 -9.336 1.00 41.14 O ATOM 793 OE2 GLU A 50 -12.327 -3.355 -8.670 1.00 54.31 O ATOM 0 H GLU A 50 -10.600 1.086 -12.008 1.00 33.03 H new ATOM 0 HA GLU A 50 -12.175 1.602 -9.583 1.00 42.43 H new ATOM 0 HB2 GLU A 50 -13.132 -0.408 -10.878 1.00 12.13 H new ATOM 0 HB3 GLU A 50 -11.585 -1.205 -10.673 1.00 12.13 H new ATOM 0 HG2 GLU A 50 -11.923 -0.953 -8.157 1.00 4.24 H new ATOM 0 HG3 GLU A 50 -13.562 -0.445 -8.513 1.00 4.24 H new ATOM 800 N VAL A 51 -9.103 0.937 -9.982 1.00 61.43 N ATOM 801 CA VAL A 51 -7.873 0.756 -9.217 1.00 44.02 C ATOM 802 C VAL A 51 -7.182 2.081 -8.906 1.00 3.12 C ATOM 803 O VAL A 51 -7.031 2.948 -9.779 1.00 32.10 O ATOM 804 CB VAL A 51 -6.875 -0.202 -9.942 1.00 73.23 C ATOM 805 CG1 VAL A 51 -5.601 -0.391 -9.121 1.00 21.01 C ATOM 806 CG2 VAL A 51 -7.528 -1.549 -10.210 1.00 12.42 C ATOM 0 H VAL A 51 -8.994 1.216 -10.957 1.00 61.43 H new ATOM 0 HA VAL A 51 -8.173 0.300 -8.273 1.00 44.02 H new ATOM 0 HB VAL A 51 -6.605 0.255 -10.894 1.00 73.23 H new ATOM 0 HG11 VAL A 51 -4.924 -1.062 -9.649 1.00 21.01 H new ATOM 0 HG12 VAL A 51 -5.115 0.574 -8.976 1.00 21.01 H new ATOM 0 HG13 VAL A 51 -5.853 -0.820 -8.151 1.00 21.01 H new ATOM 0 HG21 VAL A 51 -6.818 -2.203 -10.716 1.00 12.42 H new ATOM 0 HG22 VAL A 51 -7.829 -2.002 -9.265 1.00 12.42 H new ATOM 0 HG23 VAL A 51 -8.405 -1.409 -10.841 1.00 12.42 H new ATOM 816 N SER A 52 -6.828 2.249 -7.648 1.00 24.12 N ATOM 817 CA SER A 52 -6.004 3.336 -7.161 1.00 54.20 C ATOM 818 C SER A 52 -5.149 2.815 -5.985 1.00 42.52 C ATOM 819 O SER A 52 -5.366 1.700 -5.511 1.00 2.31 O ATOM 820 CB SER A 52 -6.895 4.484 -6.687 1.00 43.14 C ATOM 821 OG SER A 52 -7.808 4.850 -7.702 1.00 22.53 O ATOM 0 H SER A 52 -7.117 1.608 -6.909 1.00 24.12 H new ATOM 0 HA SER A 52 -5.356 3.701 -7.958 1.00 54.20 H new ATOM 0 HB2 SER A 52 -7.438 4.185 -5.791 1.00 43.14 H new ATOM 0 HB3 SER A 52 -6.280 5.342 -6.415 1.00 43.14 H new ATOM 0 HG SER A 52 -8.682 5.040 -7.302 1.00 22.53 H new ATOM 827 N PHE A 53 -4.189 3.597 -5.541 1.00 62.44 N ATOM 828 CA PHE A 53 -3.409 3.276 -4.361 1.00 30.13 C ATOM 829 C PHE A 53 -2.721 4.532 -3.888 1.00 45.13 C ATOM 830 O PHE A 53 -2.721 5.518 -4.596 1.00 65.45 O ATOM 831 CB PHE A 53 -2.379 2.117 -4.580 1.00 62.41 C ATOM 832 CG PHE A 53 -1.267 2.394 -5.557 1.00 4.34 C ATOM 833 CD1 PHE A 53 -0.257 3.277 -5.233 1.00 23.14 C ATOM 834 CD2 PHE A 53 -1.228 1.769 -6.784 1.00 23.34 C ATOM 835 CE1 PHE A 53 0.755 3.541 -6.096 1.00 41.20 C ATOM 836 CE2 PHE A 53 -0.198 2.028 -7.664 1.00 11.22 C ATOM 837 CZ PHE A 53 0.793 2.918 -7.319 1.00 2.23 C ATOM 0 H PHE A 53 -3.925 4.475 -5.987 1.00 62.44 H new ATOM 0 HA PHE A 53 -4.094 2.903 -3.600 1.00 30.13 H new ATOM 0 HB2 PHE A 53 -1.935 1.866 -3.617 1.00 62.41 H new ATOM 0 HB3 PHE A 53 -2.922 1.235 -4.920 1.00 62.41 H new ATOM 0 HD1 PHE A 53 -0.273 3.768 -4.271 1.00 23.14 H new ATOM 0 HD2 PHE A 53 -2.007 1.073 -7.058 1.00 23.34 H new ATOM 0 HE1 PHE A 53 1.531 4.241 -5.822 1.00 41.20 H new ATOM 0 HE2 PHE A 53 -0.169 1.533 -8.623 1.00 11.22 H new ATOM 0 HZ PHE A 53 1.598 3.126 -8.008 1.00 2.23 H new ATOM 847 N HIS A 54 -2.115 4.492 -2.738 1.00 33.14 N ATOM 848 CA HIS A 54 -1.456 5.665 -2.210 1.00 2.02 C ATOM 849 C HIS A 54 -0.002 5.704 -2.573 1.00 11.40 C ATOM 850 O HIS A 54 0.435 6.583 -3.320 1.00 71.44 O ATOM 851 CB HIS A 54 -1.616 5.773 -0.689 1.00 20.14 C ATOM 852 CG HIS A 54 -3.015 6.006 -0.227 1.00 31.22 C ATOM 853 ND1 HIS A 54 -3.890 4.967 -0.032 1.00 41.11 N ATOM 854 CD2 HIS A 54 -3.633 7.170 0.074 1.00 30.21 C ATOM 855 CE1 HIS A 54 -5.019 5.536 0.380 1.00 51.11 C ATOM 856 NE2 HIS A 54 -4.904 6.853 0.456 1.00 64.15 N ATOM 0 H HIS A 54 -2.060 3.665 -2.144 1.00 33.14 H new ATOM 0 HA HIS A 54 -1.947 6.522 -2.671 1.00 2.02 H new ATOM 0 HB2 HIS A 54 -1.244 4.856 -0.232 1.00 20.14 H new ATOM 0 HB3 HIS A 54 -0.988 6.587 -0.328 1.00 20.14 H new ATOM 0 HD2 HIS A 54 -3.204 8.160 0.022 1.00 30.21 H new ATOM 0 HE1 HIS A 54 -5.919 4.991 0.623 1.00 51.11 H new ATOM 0 HE2 HIS A 54 -5.630 7.508 0.746 1.00 64.15 H new ATOM 864 N ILE A 55 0.740 4.744 -2.087 1.00 51.21 N ATOM 865 CA ILE A 55 2.173 4.775 -2.219 1.00 72.45 C ATOM 866 C ILE A 55 2.677 3.502 -2.873 1.00 1.12 C ATOM 867 O ILE A 55 2.257 2.397 -2.514 1.00 14.15 O ATOM 868 CB ILE A 55 2.844 4.894 -0.819 1.00 72.52 C ATOM 869 CG1 ILE A 55 2.236 6.058 -0.015 1.00 23.45 C ATOM 870 CG2 ILE A 55 4.331 5.169 -1.025 1.00 11.44 C ATOM 871 CD1 ILE A 55 2.501 6.013 1.472 1.00 33.05 C ATOM 0 H ILE A 55 0.375 3.929 -1.595 1.00 51.21 H new ATOM 0 HA ILE A 55 2.429 5.637 -2.835 1.00 72.45 H new ATOM 0 HB ILE A 55 2.684 3.968 -0.267 1.00 72.52 H new ATOM 0 HG12 ILE A 55 2.626 6.996 -0.410 1.00 23.45 H new ATOM 0 HG13 ILE A 55 1.158 6.068 -0.177 1.00 23.45 H new ATOM 0 HG21 ILE A 55 4.823 5.256 -0.056 1.00 11.44 H new ATOM 0 HG22 ILE A 55 4.778 4.349 -1.586 1.00 11.44 H new ATOM 0 HG23 ILE A 55 4.456 6.099 -1.580 1.00 11.44 H new ATOM 0 HD11 ILE A 55 2.033 6.873 1.951 1.00 33.05 H new ATOM 0 HD12 ILE A 55 2.085 5.095 1.888 1.00 33.05 H new ATOM 0 HD13 ILE A 55 3.576 6.038 1.651 1.00 33.05 H new ATOM 883 N ALA A 56 3.550 3.659 -3.823 1.00 2.34 N ATOM 884 CA ALA A 56 4.197 2.529 -4.462 1.00 23.12 C ATOM 885 C ALA A 56 5.657 2.532 -4.100 1.00 65.42 C ATOM 886 O ALA A 56 6.320 3.555 -4.207 1.00 10.45 O ATOM 887 CB ALA A 56 4.038 2.577 -5.966 1.00 53.05 C ATOM 0 H ALA A 56 3.840 4.568 -4.183 1.00 2.34 H new ATOM 0 HA ALA A 56 3.724 1.612 -4.109 1.00 23.12 H new ATOM 0 HB1 ALA A 56 4.535 1.715 -6.412 1.00 53.05 H new ATOM 0 HB2 ALA A 56 2.978 2.557 -6.221 1.00 53.05 H new ATOM 0 HB3 ALA A 56 4.486 3.493 -6.350 1.00 53.05 H new ATOM 893 N VAL A 57 6.147 1.417 -3.653 1.00 13.13 N ATOM 894 CA VAL A 57 7.540 1.294 -3.262 1.00 64.41 C ATOM 895 C VAL A 57 8.243 0.209 -4.083 1.00 21.42 C ATOM 896 O VAL A 57 7.763 -0.931 -4.155 1.00 44.12 O ATOM 897 CB VAL A 57 7.659 0.942 -1.752 1.00 42.45 C ATOM 898 CG1 VAL A 57 9.109 0.860 -1.325 1.00 62.32 C ATOM 899 CG2 VAL A 57 6.914 1.952 -0.899 1.00 74.21 C ATOM 0 H VAL A 57 5.603 0.561 -3.545 1.00 13.13 H new ATOM 0 HA VAL A 57 8.019 2.255 -3.449 1.00 64.41 H new ATOM 0 HB VAL A 57 7.203 -0.037 -1.604 1.00 42.45 H new ATOM 0 HG11 VAL A 57 9.163 0.613 -0.265 1.00 62.32 H new ATOM 0 HG12 VAL A 57 9.616 0.088 -1.904 1.00 62.32 H new ATOM 0 HG13 VAL A 57 9.594 1.821 -1.498 1.00 62.32 H new ATOM 0 HG21 VAL A 57 7.013 1.683 0.153 1.00 74.21 H new ATOM 0 HG22 VAL A 57 7.334 2.945 -1.061 1.00 74.21 H new ATOM 0 HG23 VAL A 57 5.860 1.954 -1.175 1.00 74.21 H new ATOM 909 N ASP A 58 9.357 0.561 -4.707 1.00 1.44 N ATOM 910 CA ASP A 58 10.145 -0.419 -5.432 1.00 0.35 C ATOM 911 C ASP A 58 11.523 -0.520 -4.812 1.00 13.40 C ATOM 912 O ASP A 58 11.797 0.106 -3.775 1.00 22.34 O ATOM 913 CB ASP A 58 10.237 -0.159 -6.980 1.00 60.22 C ATOM 914 CG ASP A 58 11.173 0.957 -7.449 1.00 60.04 C ATOM 915 OD1 ASP A 58 12.372 0.695 -7.626 1.00 55.22 O ATOM 916 OD2 ASP A 58 10.709 2.063 -7.713 1.00 54.24 O ATOM 0 H ASP A 58 9.732 1.510 -4.725 1.00 1.44 H new ATOM 0 HA ASP A 58 9.622 -1.371 -5.339 1.00 0.35 H new ATOM 0 HB2 ASP A 58 10.550 -1.086 -7.460 1.00 60.22 H new ATOM 0 HB3 ASP A 58 9.235 0.066 -7.345 1.00 60.22 H new ATOM 921 N ASP A 59 12.370 -1.334 -5.409 1.00 54.22 N ATOM 922 CA ASP A 59 13.747 -1.539 -4.928 1.00 23.20 C ATOM 923 C ASP A 59 14.545 -0.250 -4.896 1.00 74.30 C ATOM 924 O ASP A 59 15.406 -0.060 -4.028 1.00 21.25 O ATOM 925 CB ASP A 59 14.472 -2.653 -5.739 1.00 74.23 C ATOM 926 CG ASP A 59 16.002 -2.556 -5.751 1.00 21.34 C ATOM 927 OD1 ASP A 59 16.653 -2.935 -4.781 1.00 73.45 O ATOM 928 OD2 ASP A 59 16.560 -2.099 -6.758 1.00 42.04 O ATOM 0 H ASP A 59 12.137 -1.877 -6.240 1.00 54.22 H new ATOM 0 HA ASP A 59 13.676 -1.881 -3.896 1.00 23.20 H new ATOM 0 HB2 ASP A 59 14.188 -3.622 -5.330 1.00 74.23 H new ATOM 0 HB3 ASP A 59 14.113 -2.624 -6.768 1.00 74.23 H new ATOM 933 N LYS A 60 14.233 0.654 -5.779 1.00 53.04 N ATOM 934 CA LYS A 60 14.984 1.882 -5.878 1.00 4.03 C ATOM 935 C LYS A 60 14.289 3.022 -5.147 1.00 40.53 C ATOM 936 O LYS A 60 14.823 3.575 -4.183 1.00 1.41 O ATOM 937 CB LYS A 60 15.160 2.288 -7.339 1.00 12.02 C ATOM 938 CG LYS A 60 15.744 1.226 -8.247 1.00 41.43 C ATOM 939 CD LYS A 60 17.160 0.738 -7.872 1.00 54.33 C ATOM 940 CE LYS A 60 18.253 1.826 -7.894 1.00 54.13 C ATOM 941 NZ LYS A 60 18.248 2.712 -6.695 1.00 64.34 N ATOM 0 H LYS A 60 13.464 0.568 -6.443 1.00 53.04 H new ATOM 0 HA LYS A 60 15.955 1.697 -5.418 1.00 4.03 H new ATOM 0 HB2 LYS A 60 14.189 2.585 -7.735 1.00 12.02 H new ATOM 0 HB3 LYS A 60 15.802 3.168 -7.378 1.00 12.02 H new ATOM 0 HG2 LYS A 60 15.072 0.368 -8.253 1.00 41.43 H new ATOM 0 HG3 LYS A 60 15.771 1.617 -9.264 1.00 41.43 H new ATOM 0 HD2 LYS A 60 17.124 0.300 -6.874 1.00 54.33 H new ATOM 0 HD3 LYS A 60 17.447 -0.058 -8.559 1.00 54.33 H new ATOM 0 HE2 LYS A 60 19.228 1.346 -7.975 1.00 54.13 H new ATOM 0 HE3 LYS A 60 18.124 2.438 -8.787 1.00 54.13 H new ATOM 0 HZ1 LYS A 60 19.227 2.948 -6.434 1.00 64.34 H new ATOM 0 HZ2 LYS A 60 17.727 3.586 -6.911 1.00 64.34 H new ATOM 0 HZ3 LYS A 60 17.787 2.221 -5.902 1.00 64.34 H new ATOM 955 N LYS A 61 13.109 3.346 -5.589 1.00 42.23 N ATOM 956 CA LYS A 61 12.408 4.517 -5.134 1.00 24.43 C ATOM 957 C LYS A 61 10.982 4.226 -4.739 1.00 71.13 C ATOM 958 O LYS A 61 10.445 3.159 -5.023 1.00 45.02 O ATOM 959 CB LYS A 61 12.527 5.642 -6.178 1.00 64.41 C ATOM 960 CG LYS A 61 12.273 5.181 -7.600 1.00 34.11 C ATOM 961 CD LYS A 61 12.566 6.279 -8.595 1.00 41.13 C ATOM 962 CE LYS A 61 12.538 5.735 -10.011 1.00 11.21 C ATOM 963 NZ LYS A 61 12.938 6.742 -11.009 1.00 60.11 N ATOM 0 H LYS A 61 12.598 2.800 -6.283 1.00 42.23 H new ATOM 0 HA LYS A 61 12.885 4.863 -4.217 1.00 24.43 H new ATOM 0 HB2 LYS A 61 11.819 6.433 -5.930 1.00 64.41 H new ATOM 0 HB3 LYS A 61 13.525 6.077 -6.119 1.00 64.41 H new ATOM 0 HG2 LYS A 61 12.895 4.313 -7.820 1.00 34.11 H new ATOM 0 HG3 LYS A 61 11.235 4.863 -7.701 1.00 34.11 H new ATOM 0 HD2 LYS A 61 11.831 7.077 -8.491 1.00 41.13 H new ATOM 0 HD3 LYS A 61 13.543 6.716 -8.386 1.00 41.13 H new ATOM 0 HE2 LYS A 61 13.204 4.875 -10.080 1.00 11.21 H new ATOM 0 HE3 LYS A 61 11.534 5.379 -10.241 1.00 11.21 H new ATOM 0 HZ1 LYS A 61 13.447 6.276 -11.787 1.00 60.11 H new ATOM 0 HZ2 LYS A 61 12.091 7.215 -11.384 1.00 60.11 H new ATOM 0 HZ3 LYS A 61 13.559 7.447 -10.562 1.00 60.11 H new ATOM 977 N ALA A 62 10.404 5.146 -4.041 1.00 13.35 N ATOM 978 CA ALA A 62 9.064 5.020 -3.568 1.00 12.33 C ATOM 979 C ALA A 62 8.344 6.242 -3.981 1.00 3.53 C ATOM 980 O ALA A 62 8.795 7.343 -3.713 1.00 64.14 O ATOM 981 CB ALA A 62 9.034 4.879 -2.054 1.00 33.13 C ATOM 0 H ALA A 62 10.856 6.022 -3.778 1.00 13.35 H new ATOM 0 HA ALA A 62 8.596 4.128 -3.985 1.00 12.33 H new ATOM 0 HB1 ALA A 62 8.001 4.785 -1.718 1.00 33.13 H new ATOM 0 HB2 ALA A 62 9.594 3.991 -1.760 1.00 33.13 H new ATOM 0 HB3 ALA A 62 9.485 5.760 -1.598 1.00 33.13 H new ATOM 987 N ILE A 63 7.248 6.078 -4.616 1.00 15.11 N ATOM 988 CA ILE A 63 6.530 7.188 -5.129 1.00 52.41 C ATOM 989 C ILE A 63 5.140 7.169 -4.588 1.00 41.02 C ATOM 990 O ILE A 63 4.473 6.134 -4.596 1.00 54.33 O ATOM 991 CB ILE A 63 6.460 7.234 -6.708 1.00 71.20 C ATOM 992 CG1 ILE A 63 7.847 7.317 -7.384 1.00 11.31 C ATOM 993 CG2 ILE A 63 5.617 8.403 -7.171 1.00 31.52 C ATOM 994 CD1 ILE A 63 8.666 6.051 -7.353 1.00 34.30 C ATOM 0 H ILE A 63 6.819 5.171 -4.798 1.00 15.11 H new ATOM 0 HA ILE A 63 7.075 8.077 -4.811 1.00 52.41 H new ATOM 0 HB ILE A 63 6.004 6.291 -7.010 1.00 71.20 H new ATOM 0 HG12 ILE A 63 7.707 7.612 -8.424 1.00 11.31 H new ATOM 0 HG13 ILE A 63 8.419 8.110 -6.902 1.00 11.31 H new ATOM 0 HG21 ILE A 63 5.581 8.417 -8.260 1.00 31.52 H new ATOM 0 HG22 ILE A 63 4.606 8.302 -6.776 1.00 31.52 H new ATOM 0 HG23 ILE A 63 6.056 9.333 -6.810 1.00 31.52 H new ATOM 0 HD11 ILE A 63 9.619 6.222 -7.854 1.00 34.30 H new ATOM 0 HD12 ILE A 63 8.848 5.760 -6.318 1.00 34.30 H new ATOM 0 HD13 ILE A 63 8.125 5.255 -7.864 1.00 34.30 H new ATOM 1006 N GLN A 64 4.707 8.273 -4.106 1.00 1.34 N ATOM 1007 CA GLN A 64 3.346 8.368 -3.655 1.00 21.44 C ATOM 1008 C GLN A 64 2.527 9.141 -4.672 1.00 52.42 C ATOM 1009 O GLN A 64 3.007 10.139 -5.246 1.00 43.14 O ATOM 1010 CB GLN A 64 3.240 9.034 -2.306 1.00 33.25 C ATOM 1011 CG GLN A 64 1.858 8.930 -1.717 1.00 4.42 C ATOM 1012 CD GLN A 64 1.697 9.685 -0.424 1.00 31.44 C ATOM 1013 OE1 GLN A 64 2.648 9.867 0.333 1.00 35.03 O ATOM 1014 NE2 GLN A 64 0.500 10.093 -0.145 1.00 1.22 N ATOM 0 H GLN A 64 5.260 9.125 -4.008 1.00 1.34 H new ATOM 0 HA GLN A 64 2.960 7.354 -3.552 1.00 21.44 H new ATOM 0 HB2 GLN A 64 3.957 8.579 -1.623 1.00 33.25 H new ATOM 0 HB3 GLN A 64 3.512 10.085 -2.401 1.00 33.25 H new ATOM 0 HG2 GLN A 64 1.134 9.306 -2.440 1.00 4.42 H new ATOM 0 HG3 GLN A 64 1.622 7.879 -1.547 1.00 4.42 H new ATOM 0 HE21 GLN A 64 -0.263 9.922 -0.800 1.00 1.22 H new ATOM 0 HE22 GLN A 64 0.320 10.585 0.730 1.00 1.22 H new ATOM 1023 N GLY A 65 1.312 8.689 -4.885 1.00 24.12 N ATOM 1024 CA GLY A 65 0.444 9.308 -5.873 1.00 2.34 C ATOM 1025 C GLY A 65 -0.867 9.825 -5.298 1.00 35.04 C ATOM 1026 O GLY A 65 -1.362 10.854 -5.718 1.00 43.54 O ATOM 0 H GLY A 65 0.899 7.898 -4.391 1.00 24.12 H new ATOM 0 HA2 GLY A 65 0.976 10.135 -6.343 1.00 2.34 H new ATOM 0 HA3 GLY A 65 0.226 8.583 -6.657 1.00 2.34 H new ATOM 1030 N ILE A 66 -1.426 9.126 -4.353 1.00 54.54 N ATOM 1031 CA ILE A 66 -2.688 9.552 -3.753 1.00 64.21 C ATOM 1032 C ILE A 66 -2.458 9.996 -2.316 1.00 60.41 C ATOM 1033 O ILE A 66 -1.703 9.352 -1.585 1.00 44.02 O ATOM 1034 CB ILE A 66 -3.767 8.421 -3.850 1.00 64.24 C ATOM 1035 CG1 ILE A 66 -4.116 8.165 -5.321 1.00 24.33 C ATOM 1036 CG2 ILE A 66 -5.029 8.716 -3.032 1.00 54.14 C ATOM 1037 CD1 ILE A 66 -4.757 9.326 -6.018 1.00 32.23 C ATOM 0 H ILE A 66 -1.042 8.261 -3.973 1.00 54.54 H new ATOM 0 HA ILE A 66 -3.073 10.405 -4.311 1.00 64.21 H new ATOM 0 HB ILE A 66 -3.332 7.522 -3.413 1.00 64.24 H new ATOM 0 HG12 ILE A 66 -3.206 7.894 -5.856 1.00 24.33 H new ATOM 0 HG13 ILE A 66 -4.787 7.308 -5.378 1.00 24.33 H new ATOM 0 HG21 ILE A 66 -5.735 7.893 -3.143 1.00 54.14 H new ATOM 0 HG22 ILE A 66 -4.763 8.827 -1.981 1.00 54.14 H new ATOM 0 HG23 ILE A 66 -5.487 9.638 -3.390 1.00 54.14 H new ATOM 0 HD11 ILE A 66 -4.969 9.057 -7.053 1.00 32.23 H new ATOM 0 HD12 ILE A 66 -5.687 9.586 -5.512 1.00 32.23 H new ATOM 0 HD13 ILE A 66 -4.081 10.181 -5.997 1.00 32.23 H new ATOM 1049 N PRO A 67 -3.055 11.142 -1.909 1.00 70.52 N ATOM 1050 CA PRO A 67 -2.900 11.668 -0.555 1.00 12.53 C ATOM 1051 C PRO A 67 -3.534 10.748 0.489 1.00 11.32 C ATOM 1052 O PRO A 67 -4.684 10.329 0.350 1.00 55.31 O ATOM 1053 CB PRO A 67 -3.622 13.022 -0.599 1.00 24.13 C ATOM 1054 CG PRO A 67 -4.564 12.925 -1.747 1.00 54.22 C ATOM 1055 CD PRO A 67 -3.930 12.004 -2.740 1.00 10.41 C ATOM 0 HA PRO A 67 -1.852 11.752 -0.267 1.00 12.53 H new ATOM 0 HB2 PRO A 67 -4.155 13.215 0.332 1.00 24.13 H new ATOM 0 HB3 PRO A 67 -2.916 13.841 -0.737 1.00 24.13 H new ATOM 0 HG2 PRO A 67 -5.531 12.540 -1.424 1.00 54.22 H new ATOM 0 HG3 PRO A 67 -4.742 13.906 -2.187 1.00 54.22 H new ATOM 0 HD2 PRO A 67 -4.676 11.418 -3.277 1.00 10.41 H new ATOM 0 HD3 PRO A 67 -3.358 12.553 -3.488 1.00 10.41 H new ATOM 1063 N LEU A 68 -2.780 10.475 1.537 1.00 44.41 N ATOM 1064 CA LEU A 68 -3.175 9.557 2.619 1.00 43.14 C ATOM 1065 C LEU A 68 -4.467 9.972 3.321 1.00 71.04 C ATOM 1066 O LEU A 68 -5.141 9.151 3.898 1.00 4.01 O ATOM 1067 CB LEU A 68 -2.045 9.464 3.630 1.00 3.25 C ATOM 1068 CG LEU A 68 -0.743 8.836 3.136 1.00 51.30 C ATOM 1069 CD1 LEU A 68 0.356 9.070 4.147 1.00 2.01 C ATOM 1070 CD2 LEU A 68 -0.930 7.337 2.919 1.00 32.42 C ATOM 0 H LEU A 68 -1.857 10.886 1.674 1.00 44.41 H new ATOM 0 HA LEU A 68 -3.369 8.586 2.164 1.00 43.14 H new ATOM 0 HB2 LEU A 68 -1.825 10.469 3.990 1.00 3.25 H new ATOM 0 HB3 LEU A 68 -2.399 8.889 4.486 1.00 3.25 H new ATOM 0 HG LEU A 68 -0.467 9.300 2.189 1.00 51.30 H new ATOM 0 HD11 LEU A 68 1.282 8.620 3.789 1.00 2.01 H new ATOM 0 HD12 LEU A 68 0.503 10.141 4.284 1.00 2.01 H new ATOM 0 HD13 LEU A 68 0.077 8.618 5.099 1.00 2.01 H new ATOM 0 HD21 LEU A 68 0.005 6.901 2.567 1.00 32.42 H new ATOM 0 HD22 LEU A 68 -1.219 6.867 3.859 1.00 32.42 H new ATOM 0 HD23 LEU A 68 -1.710 7.171 2.176 1.00 32.42 H new ATOM 1082 N GLU A 69 -4.804 11.246 3.253 1.00 22.10 N ATOM 1083 CA GLU A 69 -6.016 11.754 3.896 1.00 71.42 C ATOM 1084 C GLU A 69 -7.253 11.526 3.038 1.00 13.50 C ATOM 1085 O GLU A 69 -8.333 12.071 3.324 1.00 72.52 O ATOM 1086 CB GLU A 69 -5.876 13.227 4.200 1.00 25.23 C ATOM 1087 CG GLU A 69 -4.809 13.559 5.214 1.00 40.00 C ATOM 1088 CD GLU A 69 -4.674 15.040 5.398 1.00 40.52 C ATOM 1089 OE1 GLU A 69 -5.519 15.642 6.083 1.00 20.20 O ATOM 1090 OE2 GLU A 69 -3.723 15.635 4.844 1.00 11.04 O ATOM 0 H GLU A 69 -4.260 11.954 2.760 1.00 22.10 H new ATOM 0 HA GLU A 69 -6.142 11.199 4.826 1.00 71.42 H new ATOM 0 HB2 GLU A 69 -5.656 13.757 3.273 1.00 25.23 H new ATOM 0 HB3 GLU A 69 -6.833 13.603 4.562 1.00 25.23 H new ATOM 0 HG2 GLU A 69 -5.054 13.093 6.168 1.00 40.00 H new ATOM 0 HG3 GLU A 69 -3.855 13.142 4.891 1.00 40.00 H new ATOM 1097 N ARG A 70 -7.105 10.768 1.990 1.00 74.13 N ATOM 1098 CA ARG A 70 -8.201 10.423 1.131 1.00 61.13 C ATOM 1099 C ARG A 70 -8.211 8.957 0.837 1.00 23.11 C ATOM 1100 O ARG A 70 -7.242 8.250 1.129 1.00 15.13 O ATOM 1101 CB ARG A 70 -8.280 11.235 -0.162 1.00 54.21 C ATOM 1102 CG ARG A 70 -8.712 12.675 0.000 1.00 52.21 C ATOM 1103 CD ARG A 70 -7.569 13.585 0.463 1.00 34.43 C ATOM 1104 NE ARG A 70 -7.978 14.990 0.561 1.00 13.34 N ATOM 1105 CZ ARG A 70 -7.256 15.980 1.120 1.00 30.45 C ATOM 1106 NH1 ARG A 70 -6.075 15.720 1.681 1.00 33.44 N ATOM 1107 NH2 ARG A 70 -7.716 17.226 1.101 1.00 20.04 N ATOM 0 H ARG A 70 -6.211 10.368 1.705 1.00 74.13 H new ATOM 0 HA ARG A 70 -9.096 10.688 1.694 1.00 61.13 H new ATOM 0 HB2 ARG A 70 -7.301 11.219 -0.641 1.00 54.21 H new ATOM 0 HB3 ARG A 70 -8.975 10.739 -0.840 1.00 54.21 H new ATOM 0 HG2 ARG A 70 -9.102 13.042 -0.949 1.00 52.21 H new ATOM 0 HG3 ARG A 70 -9.528 12.727 0.721 1.00 52.21 H new ATOM 0 HD2 ARG A 70 -7.209 13.246 1.434 1.00 34.43 H new ATOM 0 HD3 ARG A 70 -6.735 13.500 -0.234 1.00 34.43 H new ATOM 0 HE ARG A 70 -8.888 15.239 0.172 1.00 13.34 H new ATOM 0 HH11 ARG A 70 -5.713 14.766 1.689 1.00 33.44 H new ATOM 0 HH12 ARG A 70 -5.533 16.475 2.103 1.00 33.44 H new ATOM 0 HH21 ARG A 70 -8.614 17.431 0.664 1.00 20.04 H new ATOM 0 HH22 ARG A 70 -7.171 17.977 1.524 1.00 20.04 H new ATOM 1121 N ASN A 71 -9.301 8.505 0.267 1.00 22.13 N ATOM 1122 CA ASN A 71 -9.503 7.099 -0.010 1.00 14.33 C ATOM 1123 C ASN A 71 -8.678 6.661 -1.219 1.00 1.32 C ATOM 1124 O ASN A 71 -8.041 7.467 -1.880 1.00 2.20 O ATOM 1125 CB ASN A 71 -11.003 6.816 -0.301 1.00 1.04 C ATOM 1126 CG ASN A 71 -11.479 7.280 -1.684 1.00 4.42 C ATOM 1127 OD1 ASN A 71 -11.916 8.398 -1.865 1.00 21.22 O ATOM 1128 ND2 ASN A 71 -11.423 6.394 -2.655 1.00 72.23 N ATOM 0 H ASN A 71 -10.077 9.102 -0.020 1.00 22.13 H new ATOM 0 HA ASN A 71 -9.184 6.538 0.868 1.00 14.33 H new ATOM 0 HB2 ASN A 71 -11.183 5.745 -0.209 1.00 1.04 H new ATOM 0 HB3 ASN A 71 -11.607 7.307 0.462 1.00 1.04 H new ATOM 0 HD21 ASN A 71 -11.752 6.639 -3.589 1.00 72.23 H new ATOM 0 HD22 ASN A 71 -11.051 5.462 -2.474 1.00 72.23 H new ATOM 1135 N ALA A 72 -8.705 5.391 -1.488 1.00 72.43 N ATOM 1136 CA ALA A 72 -8.103 4.836 -2.662 1.00 32.01 C ATOM 1137 C ALA A 72 -8.876 3.611 -3.003 1.00 44.11 C ATOM 1138 O ALA A 72 -9.270 2.866 -2.098 1.00 33.10 O ATOM 1139 CB ALA A 72 -6.643 4.483 -2.426 1.00 73.10 C ATOM 0 H ALA A 72 -9.154 4.699 -0.887 1.00 72.43 H new ATOM 0 HA ALA A 72 -8.125 5.563 -3.474 1.00 32.01 H new ATOM 0 HB1 ALA A 72 -6.218 4.064 -3.338 1.00 73.10 H new ATOM 0 HB2 ALA A 72 -6.092 5.381 -2.148 1.00 73.10 H new ATOM 0 HB3 ALA A 72 -6.571 3.750 -1.623 1.00 73.10 H new ATOM 1145 N TRP A 73 -9.157 3.399 -4.261 1.00 73.04 N ATOM 1146 CA TRP A 73 -9.865 2.212 -4.621 1.00 22.15 C ATOM 1147 C TRP A 73 -8.855 1.089 -4.688 1.00 75.11 C ATOM 1148 O TRP A 73 -8.081 0.992 -5.625 1.00 22.42 O ATOM 1149 CB TRP A 73 -10.543 2.404 -5.972 1.00 73.13 C ATOM 1150 CG TRP A 73 -11.463 3.600 -6.045 1.00 35.14 C ATOM 1151 CD1 TRP A 73 -11.453 4.570 -7.002 1.00 43.41 C ATOM 1152 CD2 TRP A 73 -12.489 3.978 -5.109 1.00 12.54 C ATOM 1153 NE1 TRP A 73 -12.425 5.507 -6.735 1.00 24.13 N ATOM 1154 CE2 TRP A 73 -13.067 5.166 -5.579 1.00 33.03 C ATOM 1155 CE3 TRP A 73 -12.979 3.422 -3.930 1.00 43.11 C ATOM 1156 CZ2 TRP A 73 -14.101 5.807 -4.909 1.00 55.50 C ATOM 1157 CZ3 TRP A 73 -14.001 4.054 -3.263 1.00 71.43 C ATOM 1158 CH2 TRP A 73 -14.555 5.241 -3.756 1.00 14.35 C ATOM 0 H TRP A 73 -8.912 4.019 -5.033 1.00 73.04 H new ATOM 0 HA TRP A 73 -10.639 1.981 -3.890 1.00 22.15 H new ATOM 0 HB2 TRP A 73 -9.775 2.504 -6.739 1.00 73.13 H new ATOM 0 HB3 TRP A 73 -11.114 1.507 -6.209 1.00 73.13 H new ATOM 0 HD1 TRP A 73 -10.781 4.599 -7.847 1.00 43.41 H new ATOM 0 HE1 TRP A 73 -12.632 6.325 -7.308 1.00 24.13 H new ATOM 0 HE3 TRP A 73 -12.560 2.504 -3.544 1.00 43.11 H new ATOM 0 HZ2 TRP A 73 -14.530 6.722 -5.289 1.00 55.50 H new ATOM 0 HZ3 TRP A 73 -14.382 3.629 -2.346 1.00 71.43 H new ATOM 0 HH2 TRP A 73 -15.357 5.717 -3.212 1.00 14.35 H new ATOM 1169 N ALA A 74 -8.866 0.258 -3.693 1.00 10.53 N ATOM 1170 CA ALA A 74 -7.865 -0.758 -3.572 1.00 23.14 C ATOM 1171 C ALA A 74 -8.424 -2.124 -3.330 1.00 62.31 C ATOM 1172 O ALA A 74 -7.909 -3.107 -3.837 1.00 74.31 O ATOM 1173 CB ALA A 74 -6.926 -0.402 -2.462 1.00 0.52 C ATOM 0 H ALA A 74 -9.562 0.263 -2.947 1.00 10.53 H new ATOM 0 HA ALA A 74 -7.344 -0.798 -4.529 1.00 23.14 H new ATOM 0 HB1 ALA A 74 -6.163 -1.175 -2.369 1.00 0.52 H new ATOM 0 HB2 ALA A 74 -6.449 0.554 -2.681 1.00 0.52 H new ATOM 0 HB3 ALA A 74 -7.481 -0.325 -1.527 1.00 0.52 H new ATOM 1179 N CYS A 75 -9.443 -2.202 -2.523 1.00 11.12 N ATOM 1180 CA CYS A 75 -9.956 -3.476 -2.136 1.00 55.23 C ATOM 1181 C CYS A 75 -10.987 -3.983 -3.131 1.00 32.55 C ATOM 1182 O CYS A 75 -11.121 -5.191 -3.332 1.00 13.40 O ATOM 1183 CB CYS A 75 -10.522 -3.424 -0.710 1.00 21.51 C ATOM 1184 SG CYS A 75 -11.911 -2.303 -0.453 1.00 62.11 S ATOM 0 H CYS A 75 -9.930 -1.400 -2.124 1.00 11.12 H new ATOM 0 HA CYS A 75 -9.131 -4.188 -2.140 1.00 55.23 H new ATOM 0 HB2 CYS A 75 -10.835 -4.429 -0.427 1.00 21.51 H new ATOM 0 HB3 CYS A 75 -9.719 -3.137 -0.031 1.00 21.51 H new ATOM 0 HG CYS A 75 -11.579 -1.106 -0.835 1.00 62.11 H new ATOM 1190 N GLY A 76 -11.698 -3.048 -3.755 1.00 24.52 N ATOM 1191 CA GLY A 76 -12.734 -3.396 -4.718 1.00 1.31 C ATOM 1192 C GLY A 76 -13.994 -3.889 -4.034 1.00 32.43 C ATOM 1193 O GLY A 76 -14.826 -4.570 -4.636 1.00 52.42 O ATOM 0 H GLY A 76 -11.575 -2.046 -3.610 1.00 24.52 H new ATOM 0 HA2 GLY A 76 -12.969 -2.525 -5.330 1.00 1.31 H new ATOM 0 HA3 GLY A 76 -12.360 -4.167 -5.392 1.00 1.31 H new ATOM 1197 N ASP A 77 -14.138 -3.533 -2.771 1.00 0.22 N ATOM 1198 CA ASP A 77 -15.279 -3.984 -1.973 1.00 74.10 C ATOM 1199 C ASP A 77 -16.312 -2.858 -1.847 1.00 21.50 C ATOM 1200 O ASP A 77 -17.270 -2.934 -1.080 1.00 52.32 O ATOM 1201 CB ASP A 77 -14.785 -4.473 -0.593 1.00 45.41 C ATOM 1202 CG ASP A 77 -15.865 -5.140 0.243 1.00 10.24 C ATOM 1203 OD1 ASP A 77 -16.305 -6.233 -0.114 1.00 71.54 O ATOM 1204 OD2 ASP A 77 -16.248 -4.595 1.298 1.00 75.11 O ATOM 0 H ASP A 77 -13.483 -2.933 -2.269 1.00 0.22 H new ATOM 0 HA ASP A 77 -15.770 -4.821 -2.469 1.00 74.10 H new ATOM 0 HB2 ASP A 77 -13.965 -5.176 -0.739 1.00 45.41 H new ATOM 0 HB3 ASP A 77 -14.382 -3.624 -0.040 1.00 45.41 H new ATOM 1209 N GLY A 78 -16.116 -1.817 -2.622 1.00 32.53 N ATOM 1210 CA GLY A 78 -17.026 -0.705 -2.603 1.00 43.25 C ATOM 1211 C GLY A 78 -16.493 0.330 -1.701 1.00 70.43 C ATOM 1212 O GLY A 78 -15.674 1.146 -2.114 1.00 74.35 O ATOM 0 H GLY A 78 -15.335 -1.720 -3.271 1.00 32.53 H new ATOM 0 HA2 GLY A 78 -17.150 -0.302 -3.608 1.00 43.25 H new ATOM 0 HA3 GLY A 78 -18.011 -1.029 -2.266 1.00 43.25 H new ATOM 1216 N ASN A 79 -16.932 0.304 -0.476 1.00 44.44 N ATOM 1217 CA ASN A 79 -16.352 1.154 0.533 1.00 42.40 C ATOM 1218 C ASN A 79 -15.537 0.270 1.434 1.00 13.33 C ATOM 1219 O ASN A 79 -14.459 0.654 1.883 1.00 25.01 O ATOM 1220 CB ASN A 79 -17.435 1.847 1.382 1.00 71.52 C ATOM 1221 CG ASN A 79 -18.435 2.652 0.577 1.00 1.42 C ATOM 1222 OD1 ASN A 79 -18.132 3.162 -0.495 1.00 4.41 O ATOM 1223 ND2 ASN A 79 -19.620 2.785 1.093 1.00 10.11 N ATOM 0 H ASN A 79 -17.689 -0.295 -0.148 1.00 44.44 H new ATOM 0 HA ASN A 79 -15.753 1.929 0.054 1.00 42.40 H new ATOM 0 HB2 ASN A 79 -17.971 1.090 1.954 1.00 71.52 H new ATOM 0 HB3 ASN A 79 -16.950 2.506 2.102 1.00 71.52 H new ATOM 0 HD21 ASN A 79 -20.332 3.328 0.603 1.00 10.11 H new ATOM 0 HD22 ASN A 79 -19.839 2.347 1.988 1.00 10.11 H new ATOM 1230 N GLY A 80 -16.030 -0.976 1.588 1.00 2.41 N ATOM 1231 CA GLY A 80 -15.448 -1.984 2.437 1.00 21.23 C ATOM 1232 C GLY A 80 -14.946 -1.453 3.733 1.00 53.44 C ATOM 1233 O GLY A 80 -15.692 -1.221 4.679 1.00 23.31 O ATOM 0 H GLY A 80 -16.868 -1.297 1.103 1.00 2.41 H new ATOM 0 HA2 GLY A 80 -16.192 -2.756 2.634 1.00 21.23 H new ATOM 0 HA3 GLY A 80 -14.625 -2.463 1.907 1.00 21.23 H new ATOM 1237 N SER A 81 -13.683 -1.281 3.760 1.00 54.11 N ATOM 1238 CA SER A 81 -12.966 -0.724 4.844 1.00 34.05 C ATOM 1239 C SER A 81 -11.728 -0.069 4.266 1.00 43.52 C ATOM 1240 O SER A 81 -11.311 1.008 4.699 1.00 12.32 O ATOM 1241 CB SER A 81 -12.584 -1.821 5.850 1.00 13.24 C ATOM 1242 OG SER A 81 -13.750 -2.486 6.348 1.00 45.11 O ATOM 0 H SER A 81 -13.081 -1.541 2.978 1.00 54.11 H new ATOM 0 HA SER A 81 -13.571 0.008 5.379 1.00 34.05 H new ATOM 0 HB2 SER A 81 -11.924 -2.545 5.372 1.00 13.24 H new ATOM 0 HB3 SER A 81 -12.029 -1.382 6.679 1.00 13.24 H new ATOM 0 HG SER A 81 -13.483 -3.181 6.985 1.00 45.11 H new ATOM 1248 N GLY A 82 -11.155 -0.718 3.244 1.00 4.12 N ATOM 1249 CA GLY A 82 -9.965 -0.178 2.624 1.00 21.01 C ATOM 1250 C GLY A 82 -10.264 0.931 1.648 1.00 55.22 C ATOM 1251 O GLY A 82 -9.622 1.983 1.694 1.00 75.14 O ATOM 0 H GLY A 82 -11.494 -1.594 2.846 1.00 4.12 H new ATOM 0 HA2 GLY A 82 -9.296 0.197 3.399 1.00 21.01 H new ATOM 0 HA3 GLY A 82 -9.436 -0.978 2.106 1.00 21.01 H new ATOM 1255 N ASN A 83 -11.240 0.707 0.761 1.00 11.31 N ATOM 1256 CA ASN A 83 -11.688 1.742 -0.186 1.00 53.22 C ATOM 1257 C ASN A 83 -12.161 3.003 0.508 1.00 11.31 C ATOM 1258 O ASN A 83 -12.176 4.070 -0.087 1.00 43.13 O ATOM 1259 CB ASN A 83 -12.791 1.214 -1.083 1.00 10.25 C ATOM 1260 CG ASN A 83 -12.303 0.444 -2.292 1.00 4.41 C ATOM 1261 OD1 ASN A 83 -11.222 -0.130 -2.303 1.00 40.44 O ATOM 1262 ND2 ASN A 83 -13.126 0.393 -3.296 1.00 11.42 N ATOM 0 H ASN A 83 -11.736 -0.180 0.677 1.00 11.31 H new ATOM 0 HA ASN A 83 -10.818 2.001 -0.789 1.00 53.22 H new ATOM 0 HB2 ASN A 83 -13.442 0.567 -0.495 1.00 10.25 H new ATOM 0 HB3 ASN A 83 -13.398 2.053 -1.423 1.00 10.25 H new ATOM 0 HD21 ASN A 83 -12.880 -0.139 -4.131 1.00 11.42 H new ATOM 0 HD22 ASN A 83 -14.018 0.885 -3.249 1.00 11.42 H new ATOM 1269 N ARG A 84 -12.585 2.864 1.744 1.00 3.54 N ATOM 1270 CA ARG A 84 -13.014 3.995 2.531 1.00 75.44 C ATOM 1271 C ARG A 84 -11.877 4.585 3.375 1.00 73.50 C ATOM 1272 O ARG A 84 -11.587 5.768 3.260 1.00 5.22 O ATOM 1273 CB ARG A 84 -14.233 3.638 3.392 1.00 63.24 C ATOM 1274 CG ARG A 84 -14.745 4.758 4.309 1.00 30.42 C ATOM 1275 CD ARG A 84 -15.096 6.047 3.548 1.00 10.14 C ATOM 1276 NE ARG A 84 -16.067 5.835 2.471 1.00 71.01 N ATOM 1277 CZ ARG A 84 -17.355 6.205 2.512 1.00 34.11 C ATOM 1278 NH1 ARG A 84 -17.882 6.681 3.638 1.00 33.51 N ATOM 1279 NH2 ARG A 84 -18.119 6.073 1.427 1.00 43.03 N ATOM 0 H ARG A 84 -12.642 1.968 2.229 1.00 3.54 H new ATOM 0 HA ARG A 84 -13.315 4.775 1.832 1.00 75.44 H new ATOM 0 HB2 ARG A 84 -15.045 3.333 2.732 1.00 63.24 H new ATOM 0 HB3 ARG A 84 -13.981 2.775 4.008 1.00 63.24 H new ATOM 0 HG2 ARG A 84 -15.628 4.407 4.843 1.00 30.42 H new ATOM 0 HG3 ARG A 84 -13.986 4.981 5.059 1.00 30.42 H new ATOM 0 HD2 ARG A 84 -15.496 6.778 4.250 1.00 10.14 H new ATOM 0 HD3 ARG A 84 -14.185 6.473 3.128 1.00 10.14 H new ATOM 0 HE ARG A 84 -15.738 5.370 1.625 1.00 71.01 H new ATOM 0 HH11 ARG A 84 -17.305 6.766 4.475 1.00 33.51 H new ATOM 0 HH12 ARG A 84 -18.862 6.961 3.664 1.00 33.51 H new ATOM 0 HH21 ARG A 84 -17.723 5.691 0.568 1.00 43.03 H new ATOM 0 HH22 ARG A 84 -19.099 6.354 1.456 1.00 43.03 H new ATOM 1293 N GLN A 85 -11.229 3.782 4.221 1.00 70.32 N ATOM 1294 CA GLN A 85 -10.194 4.341 5.079 1.00 35.30 C ATOM 1295 C GLN A 85 -8.961 3.449 5.266 1.00 74.13 C ATOM 1296 O GLN A 85 -8.727 2.867 6.345 1.00 11.44 O ATOM 1297 CB GLN A 85 -10.751 4.794 6.432 1.00 14.30 C ATOM 1298 CG GLN A 85 -11.392 3.689 7.254 1.00 60.04 C ATOM 1299 CD GLN A 85 -11.871 4.160 8.618 1.00 65.24 C ATOM 1300 OE1 GLN A 85 -12.829 3.628 9.171 1.00 32.11 O ATOM 1301 NE2 GLN A 85 -11.221 5.167 9.169 1.00 32.13 N ATOM 0 H GLN A 85 -11.396 2.781 4.327 1.00 70.32 H new ATOM 0 HA GLN A 85 -9.841 5.217 4.535 1.00 35.30 H new ATOM 0 HB2 GLN A 85 -9.943 5.238 7.013 1.00 14.30 H new ATOM 0 HB3 GLN A 85 -11.489 5.578 6.262 1.00 14.30 H new ATOM 0 HG2 GLN A 85 -12.237 3.277 6.702 1.00 60.04 H new ATOM 0 HG3 GLN A 85 -10.673 2.880 7.387 1.00 60.04 H new ATOM 0 HE21 GLN A 85 -10.428 5.588 8.685 1.00 32.13 H new ATOM 0 HE22 GLN A 85 -11.511 5.524 10.079 1.00 32.13 H new ATOM 1310 N SER A 86 -8.190 3.319 4.254 1.00 43.04 N ATOM 1311 CA SER A 86 -6.960 2.606 4.387 1.00 42.32 C ATOM 1312 C SER A 86 -5.922 3.248 3.545 1.00 54.45 C ATOM 1313 O SER A 86 -6.189 4.218 2.855 1.00 55.14 O ATOM 1314 CB SER A 86 -7.083 1.127 3.992 1.00 64.32 C ATOM 1315 OG SER A 86 -7.289 0.972 2.599 1.00 30.24 O ATOM 0 H SER A 86 -8.379 3.692 3.324 1.00 43.04 H new ATOM 0 HA SER A 86 -6.683 2.641 5.441 1.00 42.32 H new ATOM 0 HB2 SER A 86 -6.179 0.595 4.288 1.00 64.32 H new ATOM 0 HB3 SER A 86 -7.912 0.673 4.535 1.00 64.32 H new ATOM 0 HG SER A 86 -7.964 1.614 2.295 1.00 30.24 H new ATOM 1321 N ILE A 87 -4.767 2.700 3.603 1.00 2.34 N ATOM 1322 CA ILE A 87 -3.671 3.129 2.808 1.00 2.41 C ATOM 1323 C ILE A 87 -3.303 1.998 1.921 1.00 13.04 C ATOM 1324 O ILE A 87 -3.163 0.870 2.379 1.00 71.20 O ATOM 1325 CB ILE A 87 -2.452 3.511 3.659 1.00 33.43 C ATOM 1326 CG1 ILE A 87 -2.826 4.637 4.611 1.00 63.03 C ATOM 1327 CG2 ILE A 87 -1.315 3.944 2.733 1.00 73.53 C ATOM 1328 CD1 ILE A 87 -1.787 4.962 5.650 1.00 62.41 C ATOM 0 H ILE A 87 -4.548 1.919 4.221 1.00 2.34 H new ATOM 0 HA ILE A 87 -3.965 4.016 2.247 1.00 2.41 H new ATOM 0 HB ILE A 87 -2.125 2.655 4.249 1.00 33.43 H new ATOM 0 HG12 ILE A 87 -3.027 5.535 4.027 1.00 63.03 H new ATOM 0 HG13 ILE A 87 -3.754 4.371 5.117 1.00 63.03 H new ATOM 0 HG21 ILE A 87 -0.444 4.217 3.329 1.00 73.53 H new ATOM 0 HG22 ILE A 87 -1.055 3.121 2.067 1.00 73.53 H new ATOM 0 HG23 ILE A 87 -1.634 4.802 2.142 1.00 73.53 H new ATOM 0 HD11 ILE A 87 -2.145 5.776 6.280 1.00 62.41 H new ATOM 0 HD12 ILE A 87 -1.600 4.082 6.265 1.00 62.41 H new ATOM 0 HD13 ILE A 87 -0.862 5.264 5.158 1.00 62.41 H new ATOM 1340 N SER A 88 -3.175 2.261 0.683 1.00 41.20 N ATOM 1341 CA SER A 88 -2.837 1.247 -0.227 1.00 12.03 C ATOM 1342 C SER A 88 -1.370 1.331 -0.560 1.00 43.02 C ATOM 1343 O SER A 88 -0.898 2.346 -1.090 1.00 31.45 O ATOM 1344 CB SER A 88 -3.675 1.416 -1.449 1.00 42.51 C ATOM 1345 OG SER A 88 -5.030 1.442 -1.088 1.00 41.40 O ATOM 0 H SER A 88 -3.302 3.186 0.271 1.00 41.20 H new ATOM 0 HA SER A 88 -3.025 0.264 0.205 1.00 12.03 H new ATOM 0 HB2 SER A 88 -3.407 2.340 -1.962 1.00 42.51 H new ATOM 0 HB3 SER A 88 -3.489 0.599 -2.146 1.00 42.51 H new ATOM 0 HG SER A 88 -5.229 0.677 -0.509 1.00 41.40 H new ATOM 1351 N VAL A 89 -0.658 0.284 -0.243 1.00 31.42 N ATOM 1352 CA VAL A 89 0.756 0.209 -0.509 1.00 73.11 C ATOM 1353 C VAL A 89 1.005 -0.797 -1.612 1.00 41.43 C ATOM 1354 O VAL A 89 0.563 -1.945 -1.529 1.00 74.31 O ATOM 1355 CB VAL A 89 1.560 -0.181 0.762 1.00 42.45 C ATOM 1356 CG1 VAL A 89 3.059 -0.244 0.468 1.00 14.53 C ATOM 1357 CG2 VAL A 89 1.281 0.808 1.886 1.00 32.11 C ATOM 0 H VAL A 89 -1.042 -0.546 0.209 1.00 31.42 H new ATOM 0 HA VAL A 89 1.098 1.196 -0.822 1.00 73.11 H new ATOM 0 HB VAL A 89 1.237 -1.173 1.077 1.00 42.45 H new ATOM 0 HG11 VAL A 89 3.597 -0.519 1.375 1.00 14.53 H new ATOM 0 HG12 VAL A 89 3.247 -0.989 -0.305 1.00 14.53 H new ATOM 0 HG13 VAL A 89 3.404 0.731 0.124 1.00 14.53 H new ATOM 0 HG21 VAL A 89 1.850 0.523 2.771 1.00 32.11 H new ATOM 0 HG22 VAL A 89 1.576 1.809 1.571 1.00 32.11 H new ATOM 0 HG23 VAL A 89 0.217 0.800 2.122 1.00 32.11 H new ATOM 1367 N GLU A 90 1.667 -0.356 -2.632 1.00 11.01 N ATOM 1368 CA GLU A 90 1.976 -1.173 -3.779 1.00 64.00 C ATOM 1369 C GLU A 90 3.463 -1.542 -3.723 1.00 55.54 C ATOM 1370 O GLU A 90 4.322 -0.653 -3.720 1.00 43.14 O ATOM 1371 CB GLU A 90 1.700 -0.344 -5.047 1.00 51.23 C ATOM 1372 CG GLU A 90 1.863 -1.083 -6.363 1.00 30.41 C ATOM 1373 CD GLU A 90 0.790 -2.116 -6.595 1.00 41.20 C ATOM 1374 OE1 GLU A 90 0.891 -3.228 -6.063 1.00 4.25 O ATOM 1375 OE2 GLU A 90 -0.172 -1.822 -7.345 1.00 4.54 O ATOM 0 H GLU A 90 2.018 0.599 -2.701 1.00 11.01 H new ATOM 0 HA GLU A 90 1.371 -2.080 -3.788 1.00 64.00 H new ATOM 0 HB2 GLU A 90 0.682 0.043 -4.992 1.00 51.23 H new ATOM 0 HB3 GLU A 90 2.369 0.517 -5.049 1.00 51.23 H new ATOM 0 HG2 GLU A 90 1.850 -0.363 -7.182 1.00 30.41 H new ATOM 0 HG3 GLU A 90 2.838 -1.570 -6.382 1.00 30.41 H new ATOM 1382 N ILE A 91 3.774 -2.820 -3.654 1.00 43.10 N ATOM 1383 CA ILE A 91 5.166 -3.247 -3.643 1.00 32.13 C ATOM 1384 C ILE A 91 5.554 -3.664 -5.030 1.00 31.22 C ATOM 1385 O ILE A 91 5.007 -4.627 -5.579 1.00 73.40 O ATOM 1386 CB ILE A 91 5.433 -4.421 -2.671 1.00 44.11 C ATOM 1387 CG1 ILE A 91 5.014 -4.035 -1.260 1.00 43.41 C ATOM 1388 CG2 ILE A 91 6.916 -4.801 -2.700 1.00 2.25 C ATOM 1389 CD1 ILE A 91 5.188 -5.138 -0.241 1.00 52.32 C ATOM 0 H ILE A 91 3.093 -3.578 -3.605 1.00 43.10 H new ATOM 0 HA ILE A 91 5.762 -2.402 -3.297 1.00 32.13 H new ATOM 0 HB ILE A 91 4.846 -5.283 -2.987 1.00 44.11 H new ATOM 0 HG12 ILE A 91 5.595 -3.168 -0.944 1.00 43.41 H new ATOM 0 HG13 ILE A 91 3.968 -3.730 -1.274 1.00 43.41 H new ATOM 0 HG21 ILE A 91 7.093 -5.628 -2.013 1.00 2.25 H new ATOM 0 HG22 ILE A 91 7.195 -5.102 -3.710 1.00 2.25 H new ATOM 0 HG23 ILE A 91 7.517 -3.943 -2.398 1.00 2.25 H new ATOM 0 HD11 ILE A 91 4.867 -4.783 0.738 1.00 52.32 H new ATOM 0 HD12 ILE A 91 4.585 -5.999 -0.530 1.00 52.32 H new ATOM 0 HD13 ILE A 91 6.237 -5.429 -0.195 1.00 52.32 H new ATOM 1401 N CYS A 92 6.479 -2.968 -5.589 1.00 22.02 N ATOM 1402 CA CYS A 92 6.886 -3.214 -6.928 1.00 24.03 C ATOM 1403 C CYS A 92 7.874 -4.354 -7.013 1.00 21.51 C ATOM 1404 O CYS A 92 8.482 -4.733 -6.022 1.00 32.44 O ATOM 1405 CB CYS A 92 7.430 -1.952 -7.525 1.00 3.41 C ATOM 1406 SG CYS A 92 6.234 -0.611 -7.470 1.00 63.31 S ATOM 0 H CYS A 92 6.978 -2.207 -5.128 1.00 22.02 H new ATOM 0 HA CYS A 92 6.017 -3.524 -7.508 1.00 24.03 H new ATOM 0 HB2 CYS A 92 8.331 -1.656 -6.988 1.00 3.41 H new ATOM 0 HB3 CYS A 92 7.721 -2.136 -8.559 1.00 3.41 H new ATOM 0 HG CYS A 92 6.371 0.047 -6.357 1.00 63.31 H new ATOM 1412 N TYR A 93 7.985 -4.927 -8.213 1.00 51.53 N ATOM 1413 CA TYR A 93 8.882 -6.051 -8.496 1.00 42.51 C ATOM 1414 C TYR A 93 8.425 -7.335 -7.817 1.00 2.23 C ATOM 1415 O TYR A 93 9.142 -8.330 -7.813 1.00 53.40 O ATOM 1416 CB TYR A 93 10.352 -5.725 -8.158 1.00 42.14 C ATOM 1417 CG TYR A 93 10.944 -4.623 -9.006 1.00 21.35 C ATOM 1418 CD1 TYR A 93 11.231 -4.838 -10.346 1.00 14.04 C ATOM 1419 CD2 TYR A 93 11.229 -3.379 -8.468 1.00 23.24 C ATOM 1420 CE1 TYR A 93 11.779 -3.842 -11.127 1.00 34.21 C ATOM 1421 CE2 TYR A 93 11.781 -2.378 -9.244 1.00 14.13 C ATOM 1422 CZ TYR A 93 12.051 -2.616 -10.572 1.00 23.22 C ATOM 1423 OH TYR A 93 12.595 -1.617 -11.353 1.00 43.34 O ATOM 0 H TYR A 93 7.449 -4.621 -9.025 1.00 51.53 H new ATOM 0 HA TYR A 93 8.831 -6.220 -9.572 1.00 42.51 H new ATOM 0 HB2 TYR A 93 10.419 -5.438 -7.108 1.00 42.14 H new ATOM 0 HB3 TYR A 93 10.952 -6.627 -8.281 1.00 42.14 H new ATOM 0 HD1 TYR A 93 11.022 -5.802 -10.785 1.00 14.04 H new ATOM 0 HD2 TYR A 93 11.017 -3.189 -7.426 1.00 23.24 H new ATOM 0 HE1 TYR A 93 11.993 -4.025 -12.170 1.00 34.21 H new ATOM 0 HE2 TYR A 93 12.000 -1.413 -8.810 1.00 14.13 H new ATOM 0 HH TYR A 93 12.726 -0.812 -10.810 1.00 43.34 H new ATOM 1433 N SER A 94 7.202 -7.331 -7.295 1.00 23.02 N ATOM 1434 CA SER A 94 6.652 -8.506 -6.654 1.00 11.24 C ATOM 1435 C SER A 94 6.561 -9.661 -7.625 1.00 32.53 C ATOM 1436 O SER A 94 6.789 -10.815 -7.257 1.00 4.42 O ATOM 1437 CB SER A 94 5.305 -8.209 -6.075 1.00 42.43 C ATOM 1438 OG SER A 94 5.377 -7.192 -5.094 1.00 43.02 O ATOM 0 H SER A 94 6.578 -6.524 -7.307 1.00 23.02 H new ATOM 0 HA SER A 94 7.325 -8.792 -5.845 1.00 11.24 H new ATOM 0 HB2 SER A 94 4.625 -7.902 -6.870 1.00 42.43 H new ATOM 0 HB3 SER A 94 4.890 -9.115 -5.633 1.00 42.43 H new ATOM 0 HG SER A 94 5.542 -6.329 -5.529 1.00 43.02 H new ATOM 1444 N LYS A 95 6.220 -9.354 -8.859 1.00 23.40 N ATOM 1445 CA LYS A 95 6.195 -10.327 -9.879 1.00 72.42 C ATOM 1446 C LYS A 95 7.580 -10.941 -10.163 1.00 12.01 C ATOM 1447 O LYS A 95 7.689 -12.150 -10.288 1.00 64.34 O ATOM 1448 CB LYS A 95 5.547 -9.781 -11.140 1.00 62.14 C ATOM 1449 CG LYS A 95 5.735 -10.678 -12.333 1.00 11.54 C ATOM 1450 CD LYS A 95 5.139 -12.044 -12.080 1.00 74.11 C ATOM 1451 CE LYS A 95 5.861 -13.054 -12.887 1.00 23.34 C ATOM 1452 NZ LYS A 95 5.358 -14.421 -12.657 1.00 31.40 N ATOM 0 H LYS A 95 5.956 -8.417 -9.162 1.00 23.40 H new ATOM 0 HA LYS A 95 5.578 -11.147 -9.513 1.00 72.42 H new ATOM 0 HB2 LYS A 95 4.481 -9.640 -10.962 1.00 62.14 H new ATOM 0 HB3 LYS A 95 5.965 -8.799 -11.361 1.00 62.14 H new ATOM 0 HG2 LYS A 95 5.266 -10.229 -13.208 1.00 11.54 H new ATOM 0 HG3 LYS A 95 6.798 -10.776 -12.556 1.00 11.54 H new ATOM 0 HD2 LYS A 95 5.208 -12.292 -11.021 1.00 74.11 H new ATOM 0 HD3 LYS A 95 4.080 -12.045 -12.339 1.00 74.11 H new ATOM 0 HE2 LYS A 95 5.764 -12.807 -13.944 1.00 23.34 H new ATOM 0 HE3 LYS A 95 6.923 -13.015 -12.647 1.00 23.34 H new ATOM 0 HZ1 LYS A 95 5.894 -15.092 -13.244 1.00 31.40 H new ATOM 0 HZ2 LYS A 95 5.474 -14.669 -11.654 1.00 31.40 H new ATOM 0 HZ3 LYS A 95 4.351 -14.468 -12.911 1.00 31.40 H new ATOM 1466 N SER A 96 8.616 -10.139 -10.251 1.00 33.04 N ATOM 1467 CA SER A 96 9.925 -10.711 -10.537 1.00 12.04 C ATOM 1468 C SER A 96 10.449 -11.540 -9.345 1.00 72.25 C ATOM 1469 O SER A 96 11.256 -12.466 -9.519 1.00 41.31 O ATOM 1470 CB SER A 96 10.916 -9.636 -11.005 1.00 42.34 C ATOM 1471 OG SER A 96 10.986 -8.554 -10.098 1.00 60.32 O ATOM 0 H SER A 96 8.591 -9.126 -10.135 1.00 33.04 H new ATOM 0 HA SER A 96 9.817 -11.407 -11.369 1.00 12.04 H new ATOM 0 HB2 SER A 96 11.905 -10.079 -11.119 1.00 42.34 H new ATOM 0 HB3 SER A 96 10.616 -9.268 -11.986 1.00 42.34 H new ATOM 0 HG SER A 96 10.383 -8.720 -9.344 1.00 60.32 H new ATOM 1477 N GLY A 97 9.932 -11.217 -8.147 1.00 64.44 N ATOM 1478 CA GLY A 97 10.166 -11.991 -6.902 1.00 71.03 C ATOM 1479 C GLY A 97 11.602 -12.164 -6.448 1.00 34.40 C ATOM 1480 O GLY A 97 11.861 -12.828 -5.449 1.00 44.20 O ATOM 0 H GLY A 97 9.333 -10.404 -8.008 1.00 64.44 H new ATOM 0 HA2 GLY A 97 9.614 -11.508 -6.096 1.00 71.03 H new ATOM 0 HA3 GLY A 97 9.733 -12.982 -7.035 1.00 71.03 H new ATOM 1484 N GLY A 98 12.486 -11.604 -7.157 1.00 13.32 N ATOM 1485 CA GLY A 98 13.878 -11.725 -6.864 1.00 20.23 C ATOM 1486 C GLY A 98 14.369 -10.611 -6.007 1.00 62.41 C ATOM 1487 O GLY A 98 13.590 -10.005 -5.267 1.00 34.31 O ATOM 0 H GLY A 98 12.278 -11.034 -7.977 1.00 13.32 H new ATOM 0 HA2 GLY A 98 14.061 -12.675 -6.363 1.00 20.23 H new ATOM 0 HA3 GLY A 98 14.444 -11.742 -7.795 1.00 20.23 H new ATOM 1491 N ASP A 99 15.637 -10.303 -6.139 1.00 24.22 N ATOM 1492 CA ASP A 99 16.319 -9.311 -5.307 1.00 11.54 C ATOM 1493 C ASP A 99 15.616 -7.960 -5.315 1.00 60.51 C ATOM 1494 O ASP A 99 15.535 -7.287 -4.278 1.00 33.33 O ATOM 1495 CB ASP A 99 17.765 -9.151 -5.745 1.00 74.53 C ATOM 1496 CG ASP A 99 18.521 -8.210 -4.856 1.00 25.32 C ATOM 1497 OD1 ASP A 99 18.952 -8.639 -3.765 1.00 14.14 O ATOM 1498 OD2 ASP A 99 18.729 -7.051 -5.230 1.00 71.21 O ATOM 0 H ASP A 99 16.244 -10.736 -6.836 1.00 24.22 H new ATOM 0 HA ASP A 99 16.290 -9.684 -4.283 1.00 11.54 H new ATOM 0 HB2 ASP A 99 18.255 -10.125 -5.742 1.00 74.53 H new ATOM 0 HB3 ASP A 99 17.794 -8.783 -6.771 1.00 74.53 H new ATOM 1503 N ARG A 100 15.082 -7.584 -6.472 1.00 0.44 N ATOM 1504 CA ARG A 100 14.359 -6.339 -6.612 1.00 74.14 C ATOM 1505 C ARG A 100 13.131 -6.331 -5.699 1.00 45.42 C ATOM 1506 O ARG A 100 12.811 -5.315 -5.094 1.00 75.12 O ATOM 1507 CB ARG A 100 13.942 -6.105 -8.067 1.00 62.52 C ATOM 1508 CG ARG A 100 15.092 -5.963 -9.059 1.00 5.01 C ATOM 1509 CD ARG A 100 15.938 -4.722 -8.798 1.00 62.12 C ATOM 1510 NE ARG A 100 17.039 -4.618 -9.766 1.00 53.02 N ATOM 1511 CZ ARG A 100 17.978 -3.650 -9.786 1.00 24.33 C ATOM 1512 NH1 ARG A 100 17.969 -2.662 -8.890 1.00 53.21 N ATOM 1513 NH2 ARG A 100 18.928 -3.683 -10.710 1.00 41.34 N ATOM 0 H ARG A 100 15.141 -8.133 -7.329 1.00 0.44 H new ATOM 0 HA ARG A 100 15.023 -5.527 -6.316 1.00 74.14 H new ATOM 0 HB2 ARG A 100 13.310 -6.934 -8.385 1.00 62.52 H new ATOM 0 HB3 ARG A 100 13.331 -5.203 -8.112 1.00 62.52 H new ATOM 0 HG2 ARG A 100 15.725 -6.848 -9.005 1.00 5.01 H new ATOM 0 HG3 ARG A 100 14.691 -5.919 -10.072 1.00 5.01 H new ATOM 0 HD2 ARG A 100 15.312 -3.832 -8.858 1.00 62.12 H new ATOM 0 HD3 ARG A 100 16.342 -4.760 -7.786 1.00 62.12 H new ATOM 0 HE ARG A 100 17.098 -5.340 -10.484 1.00 53.02 H new ATOM 0 HH11 ARG A 100 17.244 -2.630 -8.174 1.00 53.21 H new ATOM 0 HH12 ARG A 100 18.688 -1.939 -8.921 1.00 53.21 H new ATOM 0 HH21 ARG A 100 18.945 -4.436 -11.398 1.00 41.34 H new ATOM 0 HH22 ARG A 100 19.642 -2.955 -10.733 1.00 41.34 H new ATOM 1527 N TYR A 101 12.458 -7.480 -5.579 1.00 62.25 N ATOM 1528 CA TYR A 101 11.311 -7.572 -4.712 1.00 54.45 C ATOM 1529 C TYR A 101 11.714 -7.500 -3.253 1.00 62.12 C ATOM 1530 O TYR A 101 11.081 -6.797 -2.473 1.00 55.01 O ATOM 1531 CB TYR A 101 10.492 -8.836 -4.972 1.00 53.01 C ATOM 1532 CG TYR A 101 9.404 -9.034 -3.945 1.00 21.41 C ATOM 1533 CD1 TYR A 101 8.321 -8.178 -3.881 1.00 1.20 C ATOM 1534 CD2 TYR A 101 9.478 -10.062 -3.026 1.00 72.24 C ATOM 1535 CE1 TYR A 101 7.343 -8.336 -2.928 1.00 44.02 C ATOM 1536 CE2 TYR A 101 8.501 -10.228 -2.076 1.00 21.13 C ATOM 1537 CZ TYR A 101 7.434 -9.360 -2.033 1.00 70.03 C ATOM 1538 OH TYR A 101 6.470 -9.514 -1.072 1.00 51.23 O ATOM 0 H TYR A 101 12.695 -8.342 -6.071 1.00 62.25 H new ATOM 0 HA TYR A 101 10.680 -6.713 -4.941 1.00 54.45 H new ATOM 0 HB2 TYR A 101 10.046 -8.779 -5.965 1.00 53.01 H new ATOM 0 HB3 TYR A 101 11.154 -9.702 -4.969 1.00 53.01 H new ATOM 0 HD1 TYR A 101 8.242 -7.370 -4.593 1.00 1.20 H new ATOM 0 HD2 TYR A 101 10.315 -10.744 -3.055 1.00 72.24 H new ATOM 0 HE1 TYR A 101 6.507 -7.653 -2.889 1.00 44.02 H new ATOM 0 HE2 TYR A 101 8.570 -11.038 -1.364 1.00 21.13 H new ATOM 0 HH TYR A 101 6.885 -9.816 -0.237 1.00 51.23 H new ATOM 1548 N TYR A 102 12.767 -8.212 -2.890 1.00 23.42 N ATOM 1549 CA TYR A 102 13.220 -8.239 -1.506 1.00 2.41 C ATOM 1550 C TYR A 102 13.528 -6.861 -0.981 1.00 33.01 C ATOM 1551 O TYR A 102 13.154 -6.528 0.138 1.00 15.15 O ATOM 1552 CB TYR A 102 14.371 -9.215 -1.295 1.00 75.13 C ATOM 1553 CG TYR A 102 13.915 -10.637 -1.446 1.00 62.35 C ATOM 1554 CD1 TYR A 102 13.911 -11.249 -2.673 1.00 51.21 C ATOM 1555 CD2 TYR A 102 13.452 -11.351 -0.356 1.00 52.44 C ATOM 1556 CE1 TYR A 102 13.468 -12.531 -2.835 1.00 71.42 C ATOM 1557 CE2 TYR A 102 13.002 -12.639 -0.495 1.00 60.41 C ATOM 1558 CZ TYR A 102 13.008 -13.230 -1.739 1.00 35.20 C ATOM 1559 OH TYR A 102 12.557 -14.523 -1.883 1.00 25.41 O ATOM 0 H TYR A 102 13.324 -8.778 -3.530 1.00 23.42 H new ATOM 0 HA TYR A 102 12.387 -8.615 -0.911 1.00 2.41 H new ATOM 0 HB2 TYR A 102 15.164 -9.007 -2.014 1.00 75.13 H new ATOM 0 HB3 TYR A 102 14.796 -9.071 -0.302 1.00 75.13 H new ATOM 0 HD1 TYR A 102 14.267 -10.703 -3.534 1.00 51.21 H new ATOM 0 HD2 TYR A 102 13.445 -10.887 0.619 1.00 52.44 H new ATOM 0 HE1 TYR A 102 13.478 -12.992 -3.811 1.00 71.42 H new ATOM 0 HE2 TYR A 102 12.645 -13.186 0.365 1.00 60.41 H new ATOM 0 HH TYR A 102 12.270 -14.868 -1.012 1.00 25.41 H new ATOM 1569 N LYS A 103 14.176 -6.053 -1.790 1.00 52.33 N ATOM 1570 CA LYS A 103 14.433 -4.685 -1.415 1.00 42.44 C ATOM 1571 C LYS A 103 13.170 -3.848 -1.428 1.00 33.53 C ATOM 1572 O LYS A 103 12.944 -3.093 -0.506 1.00 15.51 O ATOM 1573 CB LYS A 103 15.504 -4.045 -2.269 1.00 34.31 C ATOM 1574 CG LYS A 103 16.948 -4.355 -1.881 1.00 32.21 C ATOM 1575 CD LYS A 103 17.303 -5.830 -1.880 1.00 25.24 C ATOM 1576 CE LYS A 103 18.758 -6.007 -1.480 1.00 33.13 C ATOM 1577 NZ LYS A 103 19.163 -7.418 -1.415 1.00 2.24 N ATOM 0 H LYS A 103 14.532 -6.320 -2.708 1.00 52.33 H new ATOM 0 HA LYS A 103 14.806 -4.718 -0.391 1.00 42.44 H new ATOM 0 HB2 LYS A 103 15.352 -4.358 -3.302 1.00 34.31 H new ATOM 0 HB3 LYS A 103 15.366 -2.964 -2.240 1.00 34.31 H new ATOM 0 HG2 LYS A 103 17.614 -3.836 -2.570 1.00 32.21 H new ATOM 0 HG3 LYS A 103 17.138 -3.949 -0.887 1.00 32.21 H new ATOM 0 HD2 LYS A 103 16.657 -6.369 -1.187 1.00 25.24 H new ATOM 0 HD3 LYS A 103 17.134 -6.255 -2.869 1.00 25.24 H new ATOM 0 HE2 LYS A 103 19.393 -5.484 -2.195 1.00 33.13 H new ATOM 0 HE3 LYS A 103 18.922 -5.541 -0.508 1.00 33.13 H new ATOM 0 HZ1 LYS A 103 20.201 -7.482 -1.425 1.00 2.24 H new ATOM 0 HZ2 LYS A 103 18.798 -7.844 -0.539 1.00 2.24 H new ATOM 0 HZ3 LYS A 103 18.777 -7.928 -2.235 1.00 2.24 H new ATOM 1591 N ALA A 104 12.337 -4.003 -2.461 1.00 32.12 N ATOM 1592 CA ALA A 104 11.077 -3.253 -2.561 1.00 54.35 C ATOM 1593 C ALA A 104 10.210 -3.476 -1.322 1.00 53.34 C ATOM 1594 O ALA A 104 9.727 -2.527 -0.699 1.00 54.35 O ATOM 1595 CB ALA A 104 10.321 -3.690 -3.791 1.00 63.02 C ATOM 0 H ALA A 104 12.510 -4.639 -3.239 1.00 32.12 H new ATOM 0 HA ALA A 104 11.314 -2.191 -2.632 1.00 54.35 H new ATOM 0 HB1 ALA A 104 9.387 -3.132 -3.862 1.00 63.02 H new ATOM 0 HB2 ALA A 104 10.926 -3.499 -4.677 1.00 63.02 H new ATOM 0 HB3 ALA A 104 10.102 -4.756 -3.724 1.00 63.02 H new ATOM 1601 N GLU A 105 10.048 -4.730 -0.971 1.00 34.54 N ATOM 1602 CA GLU A 105 9.307 -5.155 0.193 1.00 63.01 C ATOM 1603 C GLU A 105 9.942 -4.607 1.473 1.00 31.05 C ATOM 1604 O GLU A 105 9.255 -4.102 2.362 1.00 42.20 O ATOM 1605 CB GLU A 105 9.329 -6.664 0.218 1.00 25.22 C ATOM 1606 CG GLU A 105 8.710 -7.299 1.425 1.00 62.32 C ATOM 1607 CD GLU A 105 8.929 -8.768 1.408 1.00 3.53 C ATOM 1608 OE1 GLU A 105 10.080 -9.203 1.690 1.00 22.40 O ATOM 1609 OE2 GLU A 105 8.000 -9.507 1.076 1.00 35.33 O ATOM 0 H GLU A 105 10.440 -5.506 -1.504 1.00 34.54 H new ATOM 0 HA GLU A 105 8.285 -4.779 0.142 1.00 63.01 H new ATOM 0 HB2 GLU A 105 8.813 -7.032 -0.669 1.00 25.22 H new ATOM 0 HB3 GLU A 105 10.365 -6.996 0.145 1.00 25.22 H new ATOM 0 HG2 GLU A 105 9.141 -6.871 2.330 1.00 62.32 H new ATOM 0 HG3 GLU A 105 7.642 -7.085 1.449 1.00 62.32 H new ATOM 1616 N ASP A 106 11.252 -4.694 1.545 1.00 0.20 N ATOM 1617 CA ASP A 106 11.996 -4.254 2.721 1.00 2.00 C ATOM 1618 C ASP A 106 11.917 -2.740 2.867 1.00 1.22 C ATOM 1619 O ASP A 106 11.903 -2.217 3.962 1.00 75.24 O ATOM 1620 CB ASP A 106 13.448 -4.716 2.628 1.00 14.40 C ATOM 1621 CG ASP A 106 14.257 -4.414 3.859 1.00 52.12 C ATOM 1622 OD1 ASP A 106 14.229 -5.233 4.806 1.00 11.32 O ATOM 1623 OD2 ASP A 106 14.955 -3.369 3.889 1.00 53.32 O ATOM 0 H ASP A 106 11.836 -5.069 0.798 1.00 0.20 H new ATOM 0 HA ASP A 106 11.548 -4.703 3.608 1.00 2.00 H new ATOM 0 HB2 ASP A 106 13.467 -5.790 2.445 1.00 14.40 H new ATOM 0 HB3 ASP A 106 13.918 -4.238 1.768 1.00 14.40 H new ATOM 1628 N ASN A 107 11.846 -2.050 1.759 1.00 73.32 N ATOM 1629 CA ASN A 107 11.696 -0.598 1.773 1.00 54.01 C ATOM 1630 C ASN A 107 10.291 -0.225 2.234 1.00 51.21 C ATOM 1631 O ASN A 107 10.095 0.793 2.914 1.00 25.03 O ATOM 1632 CB ASN A 107 11.980 0.028 0.389 1.00 13.34 C ATOM 1633 CG ASN A 107 13.413 -0.137 -0.094 1.00 24.51 C ATOM 1634 OD1 ASN A 107 14.356 -0.205 0.701 1.00 22.23 O ATOM 1635 ND2 ASN A 107 13.592 -0.196 -1.398 1.00 33.02 N ATOM 0 H ASN A 107 11.889 -2.462 0.827 1.00 73.32 H new ATOM 0 HA ASN A 107 12.431 -0.198 2.471 1.00 54.01 H new ATOM 0 HB2 ASN A 107 11.309 -0.420 -0.344 1.00 13.34 H new ATOM 0 HB3 ASN A 107 11.743 1.091 0.429 1.00 13.34 H new ATOM 0 HD21 ASN A 107 14.532 -0.301 -1.779 1.00 33.02 H new ATOM 0 HD22 ASN A 107 12.790 -0.137 -2.026 1.00 33.02 H new ATOM 1642 N ALA A 108 9.318 -1.062 1.879 1.00 60.41 N ATOM 1643 CA ALA A 108 7.938 -0.833 2.241 1.00 73.33 C ATOM 1644 C ALA A 108 7.714 -0.902 3.747 1.00 55.15 C ATOM 1645 O ALA A 108 6.886 -0.176 4.259 1.00 21.41 O ATOM 1646 CB ALA A 108 7.014 -1.794 1.505 1.00 65.41 C ATOM 0 H ALA A 108 9.472 -1.911 1.335 1.00 60.41 H new ATOM 0 HA ALA A 108 7.693 0.183 1.932 1.00 73.33 H new ATOM 0 HB1 ALA A 108 5.981 -1.600 1.796 1.00 65.41 H new ATOM 0 HB2 ALA A 108 7.121 -1.650 0.430 1.00 65.41 H new ATOM 0 HB3 ALA A 108 7.277 -2.820 1.762 1.00 65.41 H new ATOM 1652 N VAL A 109 8.474 -1.754 4.461 1.00 32.33 N ATOM 1653 CA VAL A 109 8.291 -1.905 5.919 1.00 42.43 C ATOM 1654 C VAL A 109 8.366 -0.553 6.663 1.00 33.33 C ATOM 1655 O VAL A 109 7.551 -0.272 7.524 1.00 62.51 O ATOM 1656 CB VAL A 109 9.271 -2.942 6.562 1.00 73.21 C ATOM 1657 CG1 VAL A 109 9.213 -4.266 5.855 1.00 35.41 C ATOM 1658 CG2 VAL A 109 10.699 -2.445 6.670 1.00 74.12 C ATOM 0 H VAL A 109 9.208 -2.339 4.062 1.00 32.33 H new ATOM 0 HA VAL A 109 7.283 -2.302 6.038 1.00 42.43 H new ATOM 0 HB VAL A 109 8.921 -3.080 7.585 1.00 73.21 H new ATOM 0 HG11 VAL A 109 9.906 -4.962 6.328 1.00 35.41 H new ATOM 0 HG12 VAL A 109 8.201 -4.666 5.914 1.00 35.41 H new ATOM 0 HG13 VAL A 109 9.490 -4.133 4.809 1.00 35.41 H new ATOM 0 HG21 VAL A 109 11.320 -3.217 7.125 1.00 74.12 H new ATOM 0 HG22 VAL A 109 11.080 -2.213 5.675 1.00 74.12 H new ATOM 0 HG23 VAL A 109 10.726 -1.547 7.288 1.00 74.12 H new ATOM 1668 N ASP A 110 9.333 0.264 6.295 1.00 13.30 N ATOM 1669 CA ASP A 110 9.516 1.600 6.857 1.00 32.14 C ATOM 1670 C ASP A 110 8.373 2.504 6.501 1.00 70.22 C ATOM 1671 O ASP A 110 7.862 3.237 7.350 1.00 51.02 O ATOM 1672 CB ASP A 110 10.803 2.202 6.341 1.00 41.24 C ATOM 1673 CG ASP A 110 11.037 3.628 6.828 1.00 24.34 C ATOM 1674 OD1 ASP A 110 11.472 3.814 7.981 1.00 74.03 O ATOM 1675 OD2 ASP A 110 10.821 4.576 6.048 1.00 63.31 O ATOM 0 H ASP A 110 10.027 0.021 5.588 1.00 13.30 H new ATOM 0 HA ASP A 110 9.556 1.503 7.942 1.00 32.14 H new ATOM 0 HB2 ASP A 110 11.640 1.577 6.653 1.00 41.24 H new ATOM 0 HB3 ASP A 110 10.788 2.195 5.251 1.00 41.24 H new ATOM 1680 N VAL A 111 7.961 2.444 5.249 1.00 60.43 N ATOM 1681 CA VAL A 111 6.880 3.270 4.771 1.00 13.20 C ATOM 1682 C VAL A 111 5.591 2.889 5.468 1.00 52.33 C ATOM 1683 O VAL A 111 4.817 3.737 5.860 1.00 15.22 O ATOM 1684 CB VAL A 111 6.695 3.167 3.237 1.00 63.24 C ATOM 1685 CG1 VAL A 111 5.583 4.098 2.767 1.00 52.20 C ATOM 1686 CG2 VAL A 111 7.994 3.494 2.525 1.00 75.11 C ATOM 0 H VAL A 111 8.364 1.826 4.544 1.00 60.43 H new ATOM 0 HA VAL A 111 7.137 4.304 5.002 1.00 13.20 H new ATOM 0 HB VAL A 111 6.412 2.143 2.993 1.00 63.24 H new ATOM 0 HG11 VAL A 111 5.468 4.011 1.687 1.00 52.20 H new ATOM 0 HG12 VAL A 111 4.648 3.823 3.254 1.00 52.20 H new ATOM 0 HG13 VAL A 111 5.837 5.127 3.023 1.00 52.20 H new ATOM 0 HG21 VAL A 111 7.848 3.417 1.448 1.00 75.11 H new ATOM 0 HG22 VAL A 111 8.302 4.508 2.778 1.00 75.11 H new ATOM 0 HG23 VAL A 111 8.767 2.792 2.837 1.00 75.11 H new ATOM 1696 N VAL A 112 5.399 1.617 5.669 1.00 31.21 N ATOM 1697 CA VAL A 112 4.189 1.154 6.317 1.00 20.24 C ATOM 1698 C VAL A 112 4.237 1.512 7.804 1.00 22.24 C ATOM 1699 O VAL A 112 3.247 1.957 8.383 1.00 23.41 O ATOM 1700 CB VAL A 112 3.950 -0.372 6.109 1.00 72.44 C ATOM 1701 CG1 VAL A 112 2.678 -0.825 6.813 1.00 4.44 C ATOM 1702 CG2 VAL A 112 3.846 -0.700 4.629 1.00 33.23 C ATOM 0 H VAL A 112 6.053 0.882 5.399 1.00 31.21 H new ATOM 0 HA VAL A 112 3.342 1.659 5.853 1.00 20.24 H new ATOM 0 HB VAL A 112 4.801 -0.900 6.538 1.00 72.44 H new ATOM 0 HG11 VAL A 112 2.534 -1.893 6.652 1.00 4.44 H new ATOM 0 HG12 VAL A 112 2.763 -0.627 7.881 1.00 4.44 H new ATOM 0 HG13 VAL A 112 1.825 -0.279 6.410 1.00 4.44 H new ATOM 0 HG21 VAL A 112 3.679 -1.770 4.504 1.00 33.23 H new ATOM 0 HG22 VAL A 112 3.013 -0.150 4.192 1.00 33.23 H new ATOM 0 HG23 VAL A 112 4.771 -0.416 4.128 1.00 33.23 H new ATOM 1712 N ARG A 113 5.411 1.366 8.391 1.00 73.24 N ATOM 1713 CA ARG A 113 5.652 1.685 9.767 1.00 20.13 C ATOM 1714 C ARG A 113 5.372 3.160 10.061 1.00 44.33 C ATOM 1715 O ARG A 113 4.715 3.483 11.044 1.00 64.54 O ATOM 1716 CB ARG A 113 7.088 1.355 10.072 1.00 20.20 C ATOM 1717 CG ARG A 113 7.514 1.605 11.466 1.00 53.21 C ATOM 1718 CD ARG A 113 8.941 1.213 11.622 1.00 72.01 C ATOM 1719 NE ARG A 113 9.881 2.069 10.875 1.00 64.14 N ATOM 1720 CZ ARG A 113 11.201 2.135 11.131 1.00 25.45 C ATOM 1721 NH1 ARG A 113 11.714 1.483 12.168 1.00 10.43 N ATOM 1722 NH2 ARG A 113 11.996 2.837 10.351 1.00 25.40 N ATOM 0 H ARG A 113 6.235 1.014 7.904 1.00 73.24 H new ATOM 0 HA ARG A 113 4.980 1.103 10.397 1.00 20.13 H new ATOM 0 HB2 ARG A 113 7.258 0.303 9.841 1.00 20.20 H new ATOM 0 HB3 ARG A 113 7.726 1.935 9.405 1.00 20.20 H new ATOM 0 HG2 ARG A 113 7.385 2.658 11.714 1.00 53.21 H new ATOM 0 HG3 ARG A 113 6.891 1.036 12.156 1.00 53.21 H new ATOM 0 HD2 ARG A 113 9.202 1.241 12.680 1.00 72.01 H new ATOM 0 HD3 ARG A 113 9.063 0.182 11.291 1.00 72.01 H new ATOM 0 HE ARG A 113 9.509 2.645 10.120 1.00 64.14 H new ATOM 0 HH11 ARG A 113 11.107 0.930 12.773 1.00 10.43 H new ATOM 0 HH12 ARG A 113 12.715 1.535 12.359 1.00 10.43 H new ATOM 0 HH21 ARG A 113 11.613 3.335 9.547 1.00 25.40 H new ATOM 0 HH22 ARG A 113 12.995 2.883 10.550 1.00 25.40 H new ATOM 1736 N GLN A 114 5.852 4.043 9.196 1.00 61.54 N ATOM 1737 CA GLN A 114 5.668 5.478 9.392 1.00 72.51 C ATOM 1738 C GLN A 114 4.205 5.860 9.299 1.00 53.43 C ATOM 1739 O GLN A 114 3.736 6.721 10.018 1.00 2.30 O ATOM 1740 CB GLN A 114 6.534 6.286 8.426 1.00 4.51 C ATOM 1741 CG GLN A 114 6.242 6.094 6.967 1.00 0.43 C ATOM 1742 CD GLN A 114 7.186 6.875 6.091 1.00 21.53 C ATOM 1743 OE1 GLN A 114 6.920 8.015 5.742 1.00 31.51 O ATOM 1744 NE2 GLN A 114 8.306 6.278 5.744 1.00 12.24 N ATOM 0 H GLN A 114 6.370 3.794 8.354 1.00 61.54 H new ATOM 0 HA GLN A 114 6.001 5.724 10.400 1.00 72.51 H new ATOM 0 HB2 GLN A 114 6.419 7.344 8.664 1.00 4.51 H new ATOM 0 HB3 GLN A 114 7.579 6.031 8.604 1.00 4.51 H new ATOM 0 HG2 GLN A 114 6.312 5.035 6.720 1.00 0.43 H new ATOM 0 HG3 GLN A 114 5.217 6.402 6.760 1.00 0.43 H new ATOM 0 HE21 GLN A 114 8.493 5.325 6.055 1.00 12.24 H new ATOM 0 HE22 GLN A 114 8.987 6.768 5.164 1.00 12.24 H new ATOM 1753 N LEU A 115 3.498 5.185 8.441 1.00 24.25 N ATOM 1754 CA LEU A 115 2.072 5.364 8.278 1.00 42.23 C ATOM 1755 C LEU A 115 1.375 4.954 9.551 1.00 15.23 C ATOM 1756 O LEU A 115 0.518 5.669 10.065 1.00 13.04 O ATOM 1757 CB LEU A 115 1.557 4.500 7.131 1.00 4.44 C ATOM 1758 CG LEU A 115 2.127 4.782 5.748 1.00 34.22 C ATOM 1759 CD1 LEU A 115 1.599 3.785 4.747 1.00 12.13 C ATOM 1760 CD2 LEU A 115 1.834 6.199 5.314 1.00 24.11 C ATOM 0 H LEU A 115 3.897 4.480 7.820 1.00 24.25 H new ATOM 0 HA LEU A 115 1.869 6.411 8.055 1.00 42.23 H new ATOM 0 HB2 LEU A 115 1.758 3.457 7.375 1.00 4.44 H new ATOM 0 HB3 LEU A 115 0.474 4.612 7.081 1.00 4.44 H new ATOM 0 HG LEU A 115 3.210 4.674 5.798 1.00 34.22 H new ATOM 0 HD11 LEU A 115 2.016 4.001 3.764 1.00 12.13 H new ATOM 0 HD12 LEU A 115 1.886 2.778 5.050 1.00 12.13 H new ATOM 0 HD13 LEU A 115 0.512 3.854 4.703 1.00 12.13 H new ATOM 0 HD21 LEU A 115 2.254 6.370 4.323 1.00 24.11 H new ATOM 0 HD22 LEU A 115 0.756 6.355 5.283 1.00 24.11 H new ATOM 0 HD23 LEU A 115 2.281 6.896 6.022 1.00 24.11 H new ATOM 1772 N MET A 116 1.780 3.807 10.080 1.00 30.22 N ATOM 1773 CA MET A 116 1.199 3.284 11.298 1.00 74.14 C ATOM 1774 C MET A 116 1.545 4.139 12.485 1.00 53.03 C ATOM 1775 O MET A 116 0.769 4.243 13.407 1.00 70.14 O ATOM 1776 CB MET A 116 1.611 1.838 11.589 1.00 43.10 C ATOM 1777 CG MET A 116 1.227 0.820 10.534 1.00 12.30 C ATOM 1778 SD MET A 116 1.458 -0.884 11.100 1.00 21.13 S ATOM 1779 CE MET A 116 3.159 -0.853 11.635 1.00 21.30 C ATOM 0 H MET A 116 2.513 3.222 9.678 1.00 30.22 H new ATOM 0 HA MET A 116 0.122 3.301 11.133 1.00 74.14 H new ATOM 0 HB2 MET A 116 2.693 1.807 11.720 1.00 43.10 H new ATOM 0 HB3 MET A 116 1.166 1.537 12.537 1.00 43.10 H new ATOM 0 HG2 MET A 116 0.184 0.968 10.253 1.00 12.30 H new ATOM 0 HG3 MET A 116 1.825 0.986 9.638 1.00 12.30 H new ATOM 0 HE1 MET A 116 3.462 -1.854 11.943 1.00 21.30 H new ATOM 0 HE2 MET A 116 3.793 -0.519 10.814 1.00 21.30 H new ATOM 0 HE3 MET A 116 3.263 -0.168 12.476 1.00 21.30 H new ATOM 1789 N SER A 117 2.699 4.741 12.463 1.00 65.53 N ATOM 1790 CA SER A 117 3.119 5.558 13.559 1.00 23.31 C ATOM 1791 C SER A 117 2.429 6.940 13.470 1.00 10.23 C ATOM 1792 O SER A 117 1.872 7.426 14.450 1.00 35.23 O ATOM 1793 CB SER A 117 4.662 5.675 13.559 1.00 5.45 C ATOM 1794 OG SER A 117 5.161 6.200 14.787 1.00 42.35 O ATOM 0 H SER A 117 3.366 4.680 11.694 1.00 65.53 H new ATOM 0 HA SER A 117 2.824 5.102 14.504 1.00 23.31 H new ATOM 0 HB2 SER A 117 5.099 4.693 13.381 1.00 5.45 H new ATOM 0 HB3 SER A 117 4.976 6.317 12.736 1.00 5.45 H new ATOM 0 HG SER A 117 6.139 6.256 14.746 1.00 42.35 H new ATOM 1800 N MET A 118 2.426 7.534 12.273 1.00 43.20 N ATOM 1801 CA MET A 118 1.820 8.855 12.071 1.00 73.20 C ATOM 1802 C MET A 118 0.315 8.830 12.193 1.00 5.44 C ATOM 1803 O MET A 118 -0.272 9.704 12.815 1.00 21.04 O ATOM 1804 CB MET A 118 2.211 9.485 10.726 1.00 74.21 C ATOM 1805 CG MET A 118 3.683 9.821 10.579 1.00 65.23 C ATOM 1806 SD MET A 118 4.064 10.668 9.022 1.00 14.22 S ATOM 1807 CE MET A 118 3.578 9.433 7.809 1.00 72.52 C ATOM 0 H MET A 118 2.834 7.124 11.433 1.00 43.20 H new ATOM 0 HA MET A 118 2.222 9.474 12.874 1.00 73.20 H new ATOM 0 HB2 MET A 118 1.928 8.801 9.926 1.00 74.21 H new ATOM 0 HB3 MET A 118 1.630 10.397 10.586 1.00 74.21 H new ATOM 0 HG2 MET A 118 3.991 10.451 11.414 1.00 65.23 H new ATOM 0 HG3 MET A 118 4.267 8.903 10.639 1.00 65.23 H new ATOM 0 HE1 MET A 118 3.979 9.705 6.832 1.00 72.52 H new ATOM 0 HE2 MET A 118 3.970 8.459 8.104 1.00 72.52 H new ATOM 0 HE3 MET A 118 2.490 9.385 7.754 1.00 72.52 H new ATOM 1817 N TYR A 119 -0.321 7.848 11.591 1.00 33.42 N ATOM 1818 CA TYR A 119 -1.785 7.784 11.651 1.00 75.12 C ATOM 1819 C TYR A 119 -2.295 6.940 12.786 1.00 51.05 C ATOM 1820 O TYR A 119 -3.489 6.949 13.078 1.00 41.00 O ATOM 1821 CB TYR A 119 -2.390 7.349 10.320 1.00 23.11 C ATOM 1822 CG TYR A 119 -2.284 8.413 9.255 1.00 22.32 C ATOM 1823 CD1 TYR A 119 -1.161 8.527 8.443 1.00 11.31 C ATOM 1824 CD2 TYR A 119 -3.314 9.324 9.080 1.00 62.22 C ATOM 1825 CE1 TYR A 119 -1.076 9.526 7.490 1.00 53.21 C ATOM 1826 CE2 TYR A 119 -3.240 10.315 8.131 1.00 53.01 C ATOM 1827 CZ TYR A 119 -2.121 10.415 7.338 1.00 75.34 C ATOM 1828 OH TYR A 119 -2.045 11.421 6.401 1.00 51.32 O ATOM 0 H TYR A 119 0.127 7.097 11.066 1.00 33.42 H new ATOM 0 HA TYR A 119 -2.118 8.802 11.852 1.00 75.12 H new ATOM 0 HB2 TYR A 119 -1.888 6.445 9.976 1.00 23.11 H new ATOM 0 HB3 TYR A 119 -3.439 7.093 10.469 1.00 23.11 H new ATOM 0 HD1 TYR A 119 -0.346 7.828 8.558 1.00 11.31 H new ATOM 0 HD2 TYR A 119 -4.193 9.253 9.703 1.00 62.22 H new ATOM 0 HE1 TYR A 119 -0.197 9.610 6.868 1.00 53.21 H new ATOM 0 HE2 TYR A 119 -4.056 11.012 8.009 1.00 53.01 H new ATOM 0 HH TYR A 119 -2.867 11.954 6.426 1.00 51.32 H new ATOM 1838 N ASN A 120 -1.394 6.256 13.434 1.00 20.11 N ATOM 1839 CA ASN A 120 -1.699 5.329 14.517 1.00 42.34 C ATOM 1840 C ASN A 120 -2.594 4.206 14.033 1.00 2.24 C ATOM 1841 O ASN A 120 -3.823 4.191 14.233 1.00 33.33 O ATOM 1842 CB ASN A 120 -2.218 5.989 15.811 1.00 24.11 C ATOM 1843 CG ASN A 120 -2.355 4.981 16.952 1.00 72.12 C ATOM 1844 OD1 ASN A 120 -1.399 4.730 17.680 1.00 33.13 O ATOM 1845 ND2 ASN A 120 -3.529 4.420 17.134 1.00 50.24 N ATOM 0 H ASN A 120 -0.397 6.321 13.227 1.00 20.11 H new ATOM 0 HA ASN A 120 -0.743 4.899 14.815 1.00 42.34 H new ATOM 0 HB2 ASN A 120 -1.537 6.785 16.110 1.00 24.11 H new ATOM 0 HB3 ASN A 120 -3.185 6.453 15.619 1.00 24.11 H new ATOM 0 HD21 ASN A 120 -3.664 3.756 17.897 1.00 50.24 H new ATOM 0 HD22 ASN A 120 -4.305 4.648 16.513 1.00 50.24 H new ATOM 1852 N ILE A 121 -1.977 3.345 13.301 1.00 44.23 N ATOM 1853 CA ILE A 121 -2.587 2.176 12.753 1.00 24.43 C ATOM 1854 C ILE A 121 -1.865 0.968 13.331 1.00 51.32 C ATOM 1855 O ILE A 121 -0.643 0.939 13.353 1.00 60.35 O ATOM 1856 CB ILE A 121 -2.440 2.176 11.202 1.00 44.43 C ATOM 1857 CG1 ILE A 121 -3.130 3.412 10.603 1.00 41.25 C ATOM 1858 CG2 ILE A 121 -2.997 0.892 10.593 1.00 63.54 C ATOM 1859 CD1 ILE A 121 -2.897 3.590 9.115 1.00 60.33 C ATOM 0 H ILE A 121 -0.991 3.437 13.055 1.00 44.23 H new ATOM 0 HA ILE A 121 -3.648 2.150 13.000 1.00 24.43 H new ATOM 0 HB ILE A 121 -1.378 2.219 10.960 1.00 44.43 H new ATOM 0 HG12 ILE A 121 -4.202 3.341 10.786 1.00 41.25 H new ATOM 0 HG13 ILE A 121 -2.776 4.301 11.124 1.00 41.25 H new ATOM 0 HG21 ILE A 121 -2.880 0.922 9.510 1.00 63.54 H new ATOM 0 HG22 ILE A 121 -2.455 0.035 10.993 1.00 63.54 H new ATOM 0 HG23 ILE A 121 -4.054 0.801 10.841 1.00 63.54 H new ATOM 0 HD11 ILE A 121 -3.417 4.484 8.770 1.00 60.33 H new ATOM 0 HD12 ILE A 121 -1.829 3.695 8.924 1.00 60.33 H new ATOM 0 HD13 ILE A 121 -3.278 2.720 8.580 1.00 60.33 H new ATOM 1871 N PRO A 122 -2.583 0.004 13.868 1.00 43.01 N ATOM 1872 CA PRO A 122 -1.974 -1.212 14.368 1.00 71.52 C ATOM 1873 C PRO A 122 -1.484 -2.094 13.229 1.00 21.10 C ATOM 1874 O PRO A 122 -2.022 -2.056 12.120 1.00 2.50 O ATOM 1875 CB PRO A 122 -3.089 -1.925 15.143 1.00 64.44 C ATOM 1876 CG PRO A 122 -4.292 -1.043 15.076 1.00 62.23 C ATOM 1877 CD PRO A 122 -4.031 0.026 14.057 1.00 61.44 C ATOM 0 HA PRO A 122 -1.104 -0.996 14.988 1.00 71.52 H new ATOM 0 HB2 PRO A 122 -3.300 -2.901 14.706 1.00 64.44 H new ATOM 0 HB3 PRO A 122 -2.792 -2.096 16.178 1.00 64.44 H new ATOM 0 HG2 PRO A 122 -5.174 -1.622 14.802 1.00 62.23 H new ATOM 0 HG3 PRO A 122 -4.493 -0.599 16.051 1.00 62.23 H new ATOM 0 HD2 PRO A 122 -4.556 -0.178 13.124 1.00 61.44 H new ATOM 0 HD3 PRO A 122 -4.371 1.000 14.408 1.00 61.44 H new ATOM 1885 N ILE A 123 -0.483 -2.903 13.514 1.00 32.45 N ATOM 1886 CA ILE A 123 0.097 -3.810 12.523 1.00 73.33 C ATOM 1887 C ILE A 123 -0.936 -4.898 12.141 1.00 10.21 C ATOM 1888 O ILE A 123 -0.851 -5.529 11.091 1.00 12.22 O ATOM 1889 CB ILE A 123 1.433 -4.445 13.061 1.00 52.14 C ATOM 1890 CG1 ILE A 123 2.101 -5.389 12.043 1.00 62.12 C ATOM 1891 CG2 ILE A 123 1.226 -5.146 14.389 1.00 34.44 C ATOM 1892 CD1 ILE A 123 2.578 -4.711 10.774 1.00 12.54 C ATOM 0 H ILE A 123 -0.045 -2.956 14.433 1.00 32.45 H new ATOM 0 HA ILE A 123 0.347 -3.245 11.625 1.00 73.33 H new ATOM 0 HB ILE A 123 2.118 -3.611 13.218 1.00 52.14 H new ATOM 0 HG12 ILE A 123 2.951 -5.875 12.521 1.00 62.12 H new ATOM 0 HG13 ILE A 123 1.393 -6.174 11.776 1.00 62.12 H new ATOM 0 HG21 ILE A 123 2.171 -5.571 14.727 1.00 34.44 H new ATOM 0 HG22 ILE A 123 0.866 -4.429 15.127 1.00 34.44 H new ATOM 0 HG23 ILE A 123 0.492 -5.943 14.269 1.00 34.44 H new ATOM 0 HD11 ILE A 123 3.035 -5.450 10.116 1.00 12.54 H new ATOM 0 HD12 ILE A 123 1.731 -4.249 10.268 1.00 12.54 H new ATOM 0 HD13 ILE A 123 3.312 -3.946 11.024 1.00 12.54 H new ATOM 1904 N GLU A 124 -1.931 -5.070 12.998 1.00 70.11 N ATOM 1905 CA GLU A 124 -2.998 -6.017 12.760 1.00 44.31 C ATOM 1906 C GLU A 124 -4.110 -5.362 11.891 1.00 52.11 C ATOM 1907 O GLU A 124 -5.129 -5.972 11.583 1.00 43.31 O ATOM 1908 CB GLU A 124 -3.540 -6.517 14.100 1.00 42.33 C ATOM 1909 CG GLU A 124 -4.509 -7.672 14.003 1.00 20.44 C ATOM 1910 CD GLU A 124 -4.970 -8.126 15.346 1.00 21.32 C ATOM 1911 OE1 GLU A 124 -4.229 -8.843 16.022 1.00 20.02 O ATOM 1912 OE2 GLU A 124 -6.093 -7.769 15.753 1.00 42.04 O ATOM 0 H GLU A 124 -2.017 -4.556 13.875 1.00 70.11 H new ATOM 0 HA GLU A 124 -2.618 -6.876 12.207 1.00 44.31 H new ATOM 0 HB2 GLU A 124 -2.700 -6.818 14.726 1.00 42.33 H new ATOM 0 HB3 GLU A 124 -4.034 -5.689 14.607 1.00 42.33 H new ATOM 0 HG2 GLU A 124 -5.370 -7.374 13.405 1.00 20.44 H new ATOM 0 HG3 GLU A 124 -4.032 -8.503 13.483 1.00 20.44 H new ATOM 1919 N ASN A 125 -3.908 -4.107 11.528 1.00 73.40 N ATOM 1920 CA ASN A 125 -4.807 -3.408 10.603 1.00 21.24 C ATOM 1921 C ASN A 125 -4.274 -3.454 9.215 1.00 21.32 C ATOM 1922 O ASN A 125 -4.899 -2.952 8.271 1.00 51.32 O ATOM 1923 CB ASN A 125 -5.070 -1.962 10.991 1.00 21.15 C ATOM 1924 CG ASN A 125 -6.095 -1.804 12.070 1.00 61.21 C ATOM 1925 OD1 ASN A 125 -6.259 -2.654 12.924 1.00 63.25 O ATOM 1926 ND2 ASN A 125 -6.784 -0.700 12.044 1.00 1.22 N ATOM 0 H ASN A 125 -3.126 -3.541 11.858 1.00 73.40 H new ATOM 0 HA ASN A 125 -5.758 -3.937 10.659 1.00 21.24 H new ATOM 0 HB2 ASN A 125 -4.135 -1.508 11.321 1.00 21.15 H new ATOM 0 HB3 ASN A 125 -5.397 -1.412 10.108 1.00 21.15 H new ATOM 0 HD21 ASN A 125 -7.492 -0.523 12.757 1.00 1.22 H new ATOM 0 HD22 ASN A 125 -6.616 -0.011 11.310 1.00 1.22 H new ATOM 1933 N VAL A 126 -3.119 -4.029 9.077 1.00 44.40 N ATOM 1934 CA VAL A 126 -2.542 -4.215 7.790 1.00 12.24 C ATOM 1935 C VAL A 126 -3.111 -5.508 7.245 1.00 30.44 C ATOM 1936 O VAL A 126 -2.888 -6.575 7.804 1.00 24.43 O ATOM 1937 CB VAL A 126 -0.995 -4.319 7.879 1.00 14.22 C ATOM 1938 CG1 VAL A 126 -0.378 -4.479 6.505 1.00 34.53 C ATOM 1939 CG2 VAL A 126 -0.411 -3.102 8.587 1.00 74.11 C ATOM 0 H VAL A 126 -2.556 -4.379 9.852 1.00 44.40 H new ATOM 0 HA VAL A 126 -2.772 -3.368 7.144 1.00 12.24 H new ATOM 0 HB VAL A 126 -0.755 -5.207 8.463 1.00 14.22 H new ATOM 0 HG11 VAL A 126 0.706 -4.549 6.599 1.00 34.53 H new ATOM 0 HG12 VAL A 126 -0.761 -5.386 6.037 1.00 34.53 H new ATOM 0 HG13 VAL A 126 -0.634 -3.617 5.889 1.00 34.53 H new ATOM 0 HG21 VAL A 126 0.674 -3.196 8.638 1.00 74.11 H new ATOM 0 HG22 VAL A 126 -0.671 -2.200 8.034 1.00 74.11 H new ATOM 0 HG23 VAL A 126 -0.817 -3.039 9.596 1.00 74.11 H new ATOM 1949 N ARG A 127 -3.862 -5.415 6.187 1.00 44.02 N ATOM 1950 CA ARG A 127 -4.515 -6.575 5.622 1.00 20.35 C ATOM 1951 C ARG A 127 -4.213 -6.690 4.150 1.00 73.12 C ATOM 1952 O ARG A 127 -3.689 -5.747 3.534 1.00 41.32 O ATOM 1953 CB ARG A 127 -6.037 -6.518 5.855 1.00 71.14 C ATOM 1954 CG ARG A 127 -6.461 -6.520 7.327 1.00 74.41 C ATOM 1955 CD ARG A 127 -5.984 -7.774 8.041 1.00 22.23 C ATOM 1956 NE ARG A 127 -6.409 -7.813 9.443 1.00 4.12 N ATOM 1957 CZ ARG A 127 -6.162 -8.819 10.293 1.00 35.45 C ATOM 1958 NH1 ARG A 127 -5.379 -9.827 9.931 1.00 61.34 N ATOM 1959 NH2 ARG A 127 -6.674 -8.799 11.511 1.00 10.15 N ATOM 0 H ARG A 127 -4.043 -4.543 5.689 1.00 44.02 H new ATOM 0 HA ARG A 127 -4.126 -7.459 6.126 1.00 20.35 H new ATOM 0 HB2 ARG A 127 -6.430 -5.619 5.379 1.00 71.14 H new ATOM 0 HB3 ARG A 127 -6.499 -7.370 5.357 1.00 71.14 H new ATOM 0 HG2 ARG A 127 -6.055 -5.640 7.825 1.00 74.41 H new ATOM 0 HG3 ARG A 127 -7.547 -6.452 7.394 1.00 74.41 H new ATOM 0 HD2 ARG A 127 -6.368 -8.653 7.523 1.00 22.23 H new ATOM 0 HD3 ARG A 127 -4.896 -7.826 7.992 1.00 22.23 H new ATOM 0 HE ARG A 127 -6.933 -7.013 9.799 1.00 4.12 H new ATOM 0 HH11 ARG A 127 -4.961 -9.839 9.001 1.00 61.34 H new ATOM 0 HH12 ARG A 127 -5.195 -10.590 10.583 1.00 61.34 H new ATOM 0 HH21 ARG A 127 -7.259 -8.017 11.806 1.00 10.15 H new ATOM 0 HH22 ARG A 127 -6.485 -9.566 12.156 1.00 10.15 H new ATOM 1973 N THR A 128 -4.521 -7.830 3.576 1.00 4.40 N ATOM 1974 CA THR A 128 -4.260 -8.036 2.191 1.00 43.21 C ATOM 1975 C THR A 128 -5.459 -7.573 1.389 1.00 32.21 C ATOM 1976 O THR A 128 -6.533 -7.315 1.935 1.00 51.20 O ATOM 1977 CB THR A 128 -4.030 -9.536 1.848 1.00 20.21 C ATOM 1978 OG1 THR A 128 -5.246 -10.256 1.949 1.00 43.11 O ATOM 1979 CG2 THR A 128 -3.019 -10.173 2.763 1.00 30.31 C ATOM 0 H THR A 128 -4.952 -8.621 4.055 1.00 4.40 H new ATOM 0 HA THR A 128 -3.358 -7.475 1.948 1.00 43.21 H new ATOM 0 HB THR A 128 -3.651 -9.573 0.827 1.00 20.21 H new ATOM 0 HG1 THR A 128 -5.088 -11.198 1.730 1.00 43.11 H new ATOM 0 HG21 THR A 128 -2.889 -11.220 2.489 1.00 30.31 H new ATOM 0 HG22 THR A 128 -2.066 -9.652 2.671 1.00 30.31 H new ATOM 0 HG23 THR A 128 -3.369 -10.109 3.793 1.00 30.31 H new ATOM 1987 N HIS A 129 -5.283 -7.497 0.096 1.00 33.01 N ATOM 1988 CA HIS A 129 -6.365 -7.188 -0.818 1.00 34.52 C ATOM 1989 C HIS A 129 -7.380 -8.361 -0.774 1.00 4.41 C ATOM 1990 O HIS A 129 -8.595 -8.173 -0.961 1.00 41.12 O ATOM 1991 CB HIS A 129 -5.763 -7.049 -2.226 1.00 1.31 C ATOM 1992 CG HIS A 129 -6.678 -6.561 -3.344 1.00 34.20 C ATOM 1993 ND1 HIS A 129 -6.226 -5.864 -4.463 1.00 14.40 N ATOM 1994 CD2 HIS A 129 -8.009 -6.724 -3.550 1.00 14.33 C ATOM 1995 CE1 HIS A 129 -7.230 -5.633 -5.277 1.00 71.12 C ATOM 1996 NE2 HIS A 129 -8.319 -6.144 -4.747 1.00 34.43 N ATOM 0 H HIS A 129 -4.383 -7.647 -0.360 1.00 33.01 H new ATOM 0 HA HIS A 129 -6.874 -6.263 -0.548 1.00 34.52 H new ATOM 0 HB2 HIS A 129 -4.917 -6.365 -2.163 1.00 1.31 H new ATOM 0 HB3 HIS A 129 -5.366 -8.021 -2.518 1.00 1.31 H new ATOM 0 HD1 HIS A 129 -5.261 -5.577 -4.625 1.00 14.40 H new ATOM 0 HD2 HIS A 129 -8.700 -7.223 -2.886 1.00 14.33 H new ATOM 0 HE1 HIS A 129 -7.171 -5.112 -6.221 1.00 71.12 H new ATOM 2004 N GLN A 130 -6.873 -9.565 -0.482 1.00 45.45 N ATOM 2005 CA GLN A 130 -7.708 -10.747 -0.460 1.00 40.01 C ATOM 2006 C GLN A 130 -8.510 -10.773 0.845 1.00 53.52 C ATOM 2007 O GLN A 130 -9.573 -11.356 0.917 1.00 21.43 O ATOM 2008 CB GLN A 130 -6.887 -12.040 -0.584 1.00 12.10 C ATOM 2009 CG GLN A 130 -7.720 -13.245 -1.047 1.00 44.10 C ATOM 2010 CD GLN A 130 -7.073 -14.560 -0.793 1.00 35.32 C ATOM 2011 OE1 GLN A 130 -7.203 -15.494 -1.571 1.00 34.04 O ATOM 2012 NE2 GLN A 130 -6.521 -14.686 0.348 1.00 25.11 N ATOM 0 H GLN A 130 -5.892 -9.734 -0.260 1.00 45.45 H new ATOM 0 HA GLN A 130 -8.376 -10.700 -1.320 1.00 40.01 H new ATOM 0 HB2 GLN A 130 -6.071 -11.878 -1.289 1.00 12.10 H new ATOM 0 HB3 GLN A 130 -6.434 -12.269 0.381 1.00 12.10 H new ATOM 0 HG2 GLN A 130 -8.685 -13.223 -0.541 1.00 44.10 H new ATOM 0 HG3 GLN A 130 -7.917 -13.149 -2.115 1.00 44.10 H new ATOM 0 HE21 GLN A 130 -6.434 -13.878 0.965 1.00 25.11 H new ATOM 0 HE22 GLN A 130 -6.166 -15.595 0.645 1.00 25.11 H new ATOM 2021 N SER A 131 -7.991 -10.121 1.859 1.00 51.24 N ATOM 2022 CA SER A 131 -8.654 -10.059 3.149 1.00 41.13 C ATOM 2023 C SER A 131 -9.949 -9.253 3.055 1.00 40.45 C ATOM 2024 O SER A 131 -10.838 -9.393 3.882 1.00 54.43 O ATOM 2025 CB SER A 131 -7.721 -9.437 4.194 1.00 11.44 C ATOM 2026 OG SER A 131 -6.502 -10.178 4.316 1.00 4.42 O ATOM 0 H SER A 131 -7.103 -9.620 1.818 1.00 51.24 H new ATOM 0 HA SER A 131 -8.903 -11.075 3.455 1.00 41.13 H new ATOM 0 HB2 SER A 131 -7.496 -8.407 3.916 1.00 11.44 H new ATOM 0 HB3 SER A 131 -8.226 -9.403 5.160 1.00 11.44 H new ATOM 0 HG SER A 131 -6.032 -10.178 3.456 1.00 4.42 H new ATOM 2032 N TRP A 132 -10.053 -8.423 2.033 1.00 2.32 N ATOM 2033 CA TRP A 132 -11.214 -7.592 1.877 1.00 61.14 C ATOM 2034 C TRP A 132 -12.255 -8.215 0.936 1.00 33.31 C ATOM 2035 O TRP A 132 -13.359 -8.538 1.352 1.00 5.33 O ATOM 2036 CB TRP A 132 -10.829 -6.209 1.369 1.00 22.10 C ATOM 2037 CG TRP A 132 -9.848 -5.452 2.234 1.00 73.42 C ATOM 2038 CD1 TRP A 132 -8.659 -4.922 1.833 1.00 12.52 C ATOM 2039 CD2 TRP A 132 -9.959 -5.154 3.641 1.00 73.14 C ATOM 2040 NE1 TRP A 132 -8.045 -4.285 2.878 1.00 40.41 N ATOM 2041 CE2 TRP A 132 -8.812 -4.420 4.000 1.00 65.13 C ATOM 2042 CE3 TRP A 132 -10.919 -5.425 4.624 1.00 74.34 C ATOM 2043 CZ2 TRP A 132 -8.595 -3.958 5.294 1.00 72.40 C ATOM 2044 CZ3 TRP A 132 -10.698 -4.966 5.909 1.00 74.44 C ATOM 2045 CH2 TRP A 132 -9.546 -4.239 6.234 1.00 63.23 C ATOM 0 H TRP A 132 -9.346 -8.313 1.306 1.00 2.32 H new ATOM 0 HA TRP A 132 -11.666 -7.502 2.865 1.00 61.14 H new ATOM 0 HB2 TRP A 132 -10.403 -6.312 0.371 1.00 22.10 H new ATOM 0 HB3 TRP A 132 -11.735 -5.612 1.269 1.00 22.10 H new ATOM 0 HD1 TRP A 132 -8.258 -4.994 0.833 1.00 12.52 H new ATOM 0 HE1 TRP A 132 -7.156 -3.788 2.827 1.00 40.41 H new ATOM 0 HE3 TRP A 132 -11.813 -5.981 4.383 1.00 74.34 H new ATOM 0 HZ2 TRP A 132 -7.707 -3.398 5.547 1.00 72.40 H new ATOM 0 HZ3 TRP A 132 -11.428 -5.172 6.678 1.00 74.44 H new ATOM 0 HH2 TRP A 132 -9.407 -3.894 7.248 1.00 63.23 H new ATOM 2056 N SER A 133 -11.891 -8.413 -0.322 1.00 33.34 N ATOM 2057 CA SER A 133 -12.849 -8.877 -1.325 1.00 20.41 C ATOM 2058 C SER A 133 -12.344 -10.187 -1.935 1.00 54.31 C ATOM 2059 O SER A 133 -12.869 -10.703 -2.921 1.00 31.43 O ATOM 2060 CB SER A 133 -13.032 -7.779 -2.402 1.00 5.32 C ATOM 2061 OG SER A 133 -14.033 -8.112 -3.344 1.00 4.43 O ATOM 0 H SER A 133 -10.946 -8.262 -0.675 1.00 33.34 H new ATOM 0 HA SER A 133 -13.820 -9.068 -0.868 1.00 20.41 H new ATOM 0 HB2 SER A 133 -13.291 -6.838 -1.917 1.00 5.32 H new ATOM 0 HB3 SER A 133 -12.086 -7.621 -2.921 1.00 5.32 H new ATOM 0 HG SER A 133 -13.988 -9.070 -3.545 1.00 4.43 H new ATOM 2067 N GLY A 134 -11.329 -10.710 -1.303 1.00 24.14 N ATOM 2068 CA GLY A 134 -10.698 -11.946 -1.694 1.00 64.10 C ATOM 2069 C GLY A 134 -10.101 -11.985 -3.081 1.00 52.10 C ATOM 2070 O GLY A 134 -10.093 -13.028 -3.735 1.00 2.13 O ATOM 0 H GLY A 134 -10.906 -10.279 -0.481 1.00 24.14 H new ATOM 0 HA2 GLY A 134 -9.909 -12.169 -0.976 1.00 64.10 H new ATOM 0 HA3 GLY A 134 -11.435 -12.745 -1.616 1.00 64.10 H new ATOM 2074 N LYS A 135 -9.607 -10.860 -3.538 1.00 4.02 N ATOM 2075 CA LYS A 135 -8.829 -10.856 -4.746 1.00 43.13 C ATOM 2076 C LYS A 135 -7.398 -11.139 -4.376 1.00 44.33 C ATOM 2077 O LYS A 135 -6.800 -10.408 -3.561 1.00 53.03 O ATOM 2078 CB LYS A 135 -8.946 -9.547 -5.534 1.00 74.22 C ATOM 2079 CG LYS A 135 -7.952 -9.469 -6.693 1.00 45.34 C ATOM 2080 CD LYS A 135 -8.160 -8.258 -7.579 1.00 74.40 C ATOM 2081 CE LYS A 135 -9.460 -8.338 -8.363 1.00 5.01 C ATOM 2082 NZ LYS A 135 -9.646 -7.167 -9.245 1.00 24.03 N ATOM 0 H LYS A 135 -9.729 -9.949 -3.097 1.00 4.02 H new ATOM 0 HA LYS A 135 -9.216 -11.627 -5.412 1.00 43.13 H new ATOM 0 HB2 LYS A 135 -9.960 -9.450 -5.922 1.00 74.22 H new ATOM 0 HB3 LYS A 135 -8.781 -8.706 -4.861 1.00 74.22 H new ATOM 0 HG2 LYS A 135 -6.938 -9.448 -6.293 1.00 45.34 H new ATOM 0 HG3 LYS A 135 -8.037 -10.372 -7.297 1.00 45.34 H new ATOM 0 HD2 LYS A 135 -8.162 -7.357 -6.966 1.00 74.40 H new ATOM 0 HD3 LYS A 135 -7.324 -8.169 -8.273 1.00 74.40 H new ATOM 0 HE2 LYS A 135 -9.467 -9.248 -8.962 1.00 5.01 H new ATOM 0 HE3 LYS A 135 -10.298 -8.407 -7.670 1.00 5.01 H new ATOM 0 HZ1 LYS A 135 -10.544 -7.261 -9.762 1.00 24.03 H new ATOM 0 HZ2 LYS A 135 -9.665 -6.300 -8.671 1.00 24.03 H new ATOM 0 HZ3 LYS A 135 -8.860 -7.115 -9.924 1.00 24.03 H new ATOM 2096 N TYR A 136 -6.856 -12.192 -4.930 1.00 62.44 N ATOM 2097 CA TYR A 136 -5.535 -12.623 -4.616 1.00 61.42 C ATOM 2098 C TYR A 136 -4.554 -11.668 -5.272 1.00 44.04 C ATOM 2099 O TYR A 136 -4.281 -11.734 -6.477 1.00 74.42 O ATOM 2100 CB TYR A 136 -5.341 -14.038 -5.129 1.00 4.53 C ATOM 2101 CG TYR A 136 -4.250 -14.817 -4.459 1.00 44.31 C ATOM 2102 CD1 TYR A 136 -4.400 -15.233 -3.147 1.00 25.12 C ATOM 2103 CD2 TYR A 136 -3.090 -15.169 -5.129 1.00 55.32 C ATOM 2104 CE1 TYR A 136 -3.427 -15.969 -2.528 1.00 1.02 C ATOM 2105 CE2 TYR A 136 -2.122 -15.913 -4.506 1.00 30.42 C ATOM 2106 CZ TYR A 136 -2.298 -16.306 -3.214 1.00 22.12 C ATOM 2107 OH TYR A 136 -1.347 -17.045 -2.607 1.00 41.10 O ATOM 0 H TYR A 136 -7.332 -12.775 -5.619 1.00 62.44 H new ATOM 0 HA TYR A 136 -5.368 -12.622 -3.539 1.00 61.42 H new ATOM 0 HB2 TYR A 136 -6.278 -14.582 -5.011 1.00 4.53 H new ATOM 0 HB3 TYR A 136 -5.130 -13.994 -6.198 1.00 4.53 H new ATOM 0 HD1 TYR A 136 -5.297 -14.973 -2.605 1.00 25.12 H new ATOM 0 HD2 TYR A 136 -2.947 -14.854 -6.152 1.00 55.32 H new ATOM 0 HE1 TYR A 136 -3.552 -16.281 -1.502 1.00 1.02 H new ATOM 0 HE2 TYR A 136 -1.223 -16.187 -5.038 1.00 30.42 H new ATOM 0 HH TYR A 136 -1.528 -17.997 -2.756 1.00 41.10 H new ATOM 2117 N CYS A 137 -4.083 -10.763 -4.488 1.00 53.24 N ATOM 2118 CA CYS A 137 -3.203 -9.735 -4.942 1.00 32.23 C ATOM 2119 C CYS A 137 -1.772 -9.969 -4.432 1.00 73.13 C ATOM 2120 O CYS A 137 -0.846 -10.038 -5.240 1.00 53.02 O ATOM 2121 CB CYS A 137 -3.770 -8.381 -4.531 1.00 74.35 C ATOM 2122 SG CYS A 137 -2.815 -6.943 -4.954 1.00 12.24 S ATOM 0 H CYS A 137 -4.301 -10.712 -3.493 1.00 53.24 H new ATOM 0 HA CYS A 137 -3.135 -9.754 -6.030 1.00 32.23 H new ATOM 0 HB2 CYS A 137 -4.757 -8.276 -4.982 1.00 74.35 H new ATOM 0 HB3 CYS A 137 -3.912 -8.387 -3.450 1.00 74.35 H new ATOM 0 HG CYS A 137 -3.307 -5.902 -4.350 1.00 12.24 H new ATOM 2127 N PRO A 138 -1.537 -10.127 -3.085 1.00 13.35 N ATOM 2128 CA PRO A 138 -0.209 -10.421 -2.587 1.00 23.03 C ATOM 2129 C PRO A 138 0.124 -11.912 -2.737 1.00 73.03 C ATOM 2130 O PRO A 138 0.399 -12.605 -1.757 1.00 35.00 O ATOM 2131 CB PRO A 138 -0.272 -10.008 -1.118 1.00 43.12 C ATOM 2132 CG PRO A 138 -1.682 -10.203 -0.726 1.00 62.20 C ATOM 2133 CD PRO A 138 -2.513 -10.012 -1.965 1.00 1.11 C ATOM 0 HA PRO A 138 0.573 -9.896 -3.136 1.00 23.03 H new ATOM 0 HB2 PRO A 138 0.395 -10.617 -0.508 1.00 43.12 H new ATOM 0 HB3 PRO A 138 0.034 -8.970 -0.986 1.00 43.12 H new ATOM 0 HG2 PRO A 138 -1.833 -11.199 -0.310 1.00 62.20 H new ATOM 0 HG3 PRO A 138 -1.970 -9.489 0.046 1.00 62.20 H new ATOM 0 HD2 PRO A 138 -3.295 -10.768 -2.040 1.00 1.11 H new ATOM 0 HD3 PRO A 138 -3.007 -9.041 -1.966 1.00 1.11 H new ATOM 2141 N HIS A 139 0.090 -12.383 -3.985 1.00 10.34 N ATOM 2142 CA HIS A 139 0.386 -13.778 -4.337 1.00 54.44 C ATOM 2143 C HIS A 139 1.728 -14.238 -3.746 1.00 21.32 C ATOM 2144 O HIS A 139 1.820 -15.307 -3.158 1.00 53.24 O ATOM 2145 CB HIS A 139 0.372 -13.975 -5.888 1.00 31.12 C ATOM 2146 CG HIS A 139 1.424 -13.182 -6.646 1.00 33.31 C ATOM 2147 ND1 HIS A 139 2.706 -13.638 -6.894 1.00 1.14 N ATOM 2148 CD2 HIS A 139 1.363 -11.939 -7.182 1.00 23.21 C ATOM 2149 CE1 HIS A 139 3.365 -12.683 -7.549 1.00 25.12 C ATOM 2150 NE2 HIS A 139 2.596 -11.627 -7.752 1.00 42.21 N ATOM 0 H HIS A 139 -0.146 -11.803 -4.790 1.00 10.34 H new ATOM 0 HA HIS A 139 -0.398 -14.398 -3.902 1.00 54.44 H new ATOM 0 HB2 HIS A 139 0.510 -15.034 -6.106 1.00 31.12 H new ATOM 0 HB3 HIS A 139 -0.612 -13.698 -6.265 1.00 31.12 H new ATOM 0 HD2 HIS A 139 0.497 -11.293 -7.170 1.00 23.21 H new ATOM 0 HE1 HIS A 139 4.393 -12.761 -7.872 1.00 25.12 H new ATOM 0 HE2 HIS A 139 2.852 -10.762 -8.228 1.00 42.21 H new ATOM 2158 N ARG A 140 2.741 -13.394 -3.900 1.00 41.04 N ATOM 2159 CA ARG A 140 4.056 -13.621 -3.441 1.00 34.03 C ATOM 2160 C ARG A 140 4.062 -13.890 -1.941 1.00 22.02 C ATOM 2161 O ARG A 140 4.722 -14.803 -1.462 1.00 21.25 O ATOM 2162 CB ARG A 140 4.866 -12.371 -3.762 1.00 13.22 C ATOM 2163 CG ARG A 140 6.323 -12.510 -3.518 1.00 24.01 C ATOM 2164 CD ARG A 140 6.906 -13.550 -4.429 1.00 44.44 C ATOM 2165 NE ARG A 140 6.800 -13.195 -5.855 1.00 54.11 N ATOM 2166 CZ ARG A 140 6.911 -14.068 -6.871 1.00 73.44 C ATOM 2167 NH1 ARG A 140 7.056 -15.360 -6.634 1.00 61.31 N ATOM 2168 NH2 ARG A 140 6.862 -13.634 -8.116 1.00 65.14 N ATOM 0 H ARG A 140 2.636 -12.497 -4.374 1.00 41.04 H new ATOM 0 HA ARG A 140 4.487 -14.496 -3.928 1.00 34.03 H new ATOM 0 HB2 ARG A 140 4.708 -12.108 -4.808 1.00 13.22 H new ATOM 0 HB3 ARG A 140 4.486 -11.542 -3.164 1.00 13.22 H new ATOM 0 HG2 ARG A 140 6.819 -11.553 -3.682 1.00 24.01 H new ATOM 0 HG3 ARG A 140 6.500 -12.787 -2.479 1.00 24.01 H new ATOM 0 HD2 ARG A 140 7.955 -13.700 -4.175 1.00 44.44 H new ATOM 0 HD3 ARG A 140 6.398 -14.499 -4.258 1.00 44.44 H new ATOM 0 HE ARG A 140 6.630 -12.217 -6.088 1.00 54.11 H new ATOM 0 HH11 ARG A 140 7.084 -15.702 -5.674 1.00 61.31 H new ATOM 0 HH12 ARG A 140 7.139 -16.015 -7.412 1.00 61.31 H new ATOM 0 HH21 ARG A 140 6.740 -12.639 -8.305 1.00 65.14 H new ATOM 0 HH22 ARG A 140 6.946 -14.293 -8.890 1.00 65.14 H new ATOM 2182 N MET A 141 3.327 -13.095 -1.218 1.00 4.25 N ATOM 2183 CA MET A 141 3.255 -13.239 0.202 1.00 24.21 C ATOM 2184 C MET A 141 2.398 -14.419 0.627 1.00 51.13 C ATOM 2185 O MET A 141 2.802 -15.193 1.463 1.00 0.01 O ATOM 2186 CB MET A 141 2.767 -11.978 0.866 1.00 55.22 C ATOM 2187 CG MET A 141 3.657 -10.783 0.673 1.00 22.44 C ATOM 2188 SD MET A 141 2.916 -9.339 1.391 1.00 3.12 S ATOM 2189 CE MET A 141 4.257 -8.218 1.365 1.00 73.50 C ATOM 0 H MET A 141 2.764 -12.333 -1.597 1.00 4.25 H new ATOM 0 HA MET A 141 4.274 -13.435 0.534 1.00 24.21 H new ATOM 0 HB2 MET A 141 1.775 -11.741 0.481 1.00 55.22 H new ATOM 0 HB3 MET A 141 2.658 -12.165 1.934 1.00 55.22 H new ATOM 0 HG2 MET A 141 4.629 -10.967 1.131 1.00 22.44 H new ATOM 0 HG3 MET A 141 3.832 -10.620 -0.390 1.00 22.44 H new ATOM 0 HE1 MET A 141 3.908 -7.226 1.652 1.00 73.50 H new ATOM 0 HE2 MET A 141 5.023 -8.550 2.066 1.00 73.50 H new ATOM 0 HE3 MET A 141 4.678 -8.177 0.360 1.00 73.50 H new ATOM 2199 N LEU A 142 1.238 -14.568 0.036 1.00 55.54 N ATOM 2200 CA LEU A 142 0.296 -15.572 0.490 1.00 52.05 C ATOM 2201 C LEU A 142 0.686 -16.992 0.084 1.00 31.02 C ATOM 2202 O LEU A 142 0.671 -17.903 0.914 1.00 51.44 O ATOM 2203 CB LEU A 142 -1.126 -15.224 0.034 1.00 3.44 C ATOM 2204 CG LEU A 142 -1.681 -13.881 0.533 1.00 61.12 C ATOM 2205 CD1 LEU A 142 -3.074 -13.617 -0.032 1.00 75.15 C ATOM 2206 CD2 LEU A 142 -1.706 -13.846 2.053 1.00 40.23 C ATOM 0 H LEU A 142 0.920 -14.011 -0.758 1.00 55.54 H new ATOM 0 HA LEU A 142 0.324 -15.559 1.580 1.00 52.05 H new ATOM 0 HB2 LEU A 142 -1.147 -15.221 -1.056 1.00 3.44 H new ATOM 0 HB3 LEU A 142 -1.797 -16.017 0.364 1.00 3.44 H new ATOM 0 HG LEU A 142 -1.019 -13.091 0.178 1.00 61.12 H new ATOM 0 HD11 LEU A 142 -3.441 -12.660 0.338 1.00 75.15 H new ATOM 0 HD12 LEU A 142 -3.026 -13.591 -1.121 1.00 75.15 H new ATOM 0 HD13 LEU A 142 -3.751 -14.412 0.282 1.00 75.15 H new ATOM 0 HD21 LEU A 142 -2.102 -12.887 2.388 1.00 40.23 H new ATOM 0 HD22 LEU A 142 -2.340 -14.651 2.425 1.00 40.23 H new ATOM 0 HD23 LEU A 142 -0.694 -13.975 2.437 1.00 40.23 H new ATOM 2218 N ALA A 143 1.073 -17.181 -1.166 1.00 72.55 N ATOM 2219 CA ALA A 143 1.386 -18.509 -1.669 1.00 21.40 C ATOM 2220 C ALA A 143 2.671 -19.019 -1.092 1.00 11.20 C ATOM 2221 O ALA A 143 2.845 -20.218 -0.896 1.00 12.14 O ATOM 2222 CB ALA A 143 1.452 -18.515 -3.187 1.00 5.41 C ATOM 0 H ALA A 143 1.178 -16.433 -1.851 1.00 72.55 H new ATOM 0 HA ALA A 143 0.583 -19.175 -1.355 1.00 21.40 H new ATOM 0 HB1 ALA A 143 1.688 -19.520 -3.537 1.00 5.41 H new ATOM 0 HB2 ALA A 143 0.490 -18.205 -3.594 1.00 5.41 H new ATOM 0 HB3 ALA A 143 2.226 -17.824 -3.520 1.00 5.41 H new ATOM 2228 N GLU A 144 3.561 -18.116 -0.798 1.00 24.43 N ATOM 2229 CA GLU A 144 4.854 -18.494 -0.314 1.00 10.21 C ATOM 2230 C GLU A 144 4.972 -18.311 1.197 1.00 33.41 C ATOM 2231 O GLU A 144 6.044 -18.482 1.763 1.00 13.43 O ATOM 2232 CB GLU A 144 5.931 -17.737 -1.082 1.00 32.15 C ATOM 2233 CG GLU A 144 5.793 -17.936 -2.588 1.00 13.24 C ATOM 2234 CD GLU A 144 6.935 -17.379 -3.385 1.00 41.41 C ATOM 2235 OE1 GLU A 144 8.096 -17.719 -3.095 1.00 61.25 O ATOM 2236 OE2 GLU A 144 6.688 -16.650 -4.359 1.00 10.45 O ATOM 0 H GLU A 144 3.413 -17.111 -0.886 1.00 24.43 H new ATOM 0 HA GLU A 144 4.998 -19.560 -0.493 1.00 10.21 H new ATOM 0 HB2 GLU A 144 5.867 -16.674 -0.848 1.00 32.15 H new ATOM 0 HB3 GLU A 144 6.915 -18.076 -0.759 1.00 32.15 H new ATOM 0 HG2 GLU A 144 5.704 -19.002 -2.796 1.00 13.24 H new ATOM 0 HG3 GLU A 144 4.867 -17.467 -2.923 1.00 13.24 H new ATOM 2243 N GLY A 145 3.847 -17.980 1.838 1.00 22.43 N ATOM 2244 CA GLY A 145 3.797 -17.843 3.293 1.00 31.22 C ATOM 2245 C GLY A 145 4.721 -16.774 3.827 1.00 4.25 C ATOM 2246 O GLY A 145 5.381 -16.961 4.849 1.00 62.02 O ATOM 0 H GLY A 145 2.959 -17.802 1.370 1.00 22.43 H new ATOM 0 HA2 GLY A 145 2.775 -17.613 3.594 1.00 31.22 H new ATOM 0 HA3 GLY A 145 4.056 -18.798 3.750 1.00 31.22 H new ATOM 2250 N ARG A 146 4.791 -15.675 3.131 1.00 34.42 N ATOM 2251 CA ARG A 146 5.685 -14.613 3.493 1.00 1.53 C ATOM 2252 C ARG A 146 5.013 -13.415 4.152 1.00 51.34 C ATOM 2253 O ARG A 146 5.695 -12.573 4.720 1.00 3.45 O ATOM 2254 CB ARG A 146 6.467 -14.156 2.324 1.00 23.44 C ATOM 2255 CG ARG A 146 7.323 -15.215 1.677 1.00 23.40 C ATOM 2256 CD ARG A 146 8.363 -14.515 0.900 1.00 5.23 C ATOM 2257 NE ARG A 146 9.016 -13.614 1.822 1.00 53.44 N ATOM 2258 CZ ARG A 146 9.523 -12.438 1.534 1.00 20.21 C ATOM 2259 NH1 ARG A 146 9.588 -12.024 0.278 1.00 12.54 N ATOM 2260 NH2 ARG A 146 9.994 -11.683 2.502 1.00 33.20 N ATOM 0 H ARG A 146 4.231 -15.490 2.299 1.00 34.42 H new ATOM 0 HA ARG A 146 6.344 -15.050 4.244 1.00 1.53 H new ATOM 0 HB2 ARG A 146 5.778 -13.760 1.577 1.00 23.44 H new ATOM 0 HB3 ARG A 146 7.108 -13.331 2.635 1.00 23.44 H new ATOM 0 HG2 ARG A 146 7.774 -15.860 2.431 1.00 23.40 H new ATOM 0 HG3 ARG A 146 6.722 -15.854 1.029 1.00 23.40 H new ATOM 0 HD2 ARG A 146 9.076 -15.223 0.477 1.00 5.23 H new ATOM 0 HD3 ARG A 146 7.924 -13.968 0.066 1.00 5.23 H new ATOM 0 HE ARG A 146 9.090 -13.922 2.792 1.00 53.44 H new ATOM 0 HH11 ARG A 146 9.243 -12.620 -0.474 1.00 12.54 H new ATOM 0 HH12 ARG A 146 9.983 -11.109 0.063 1.00 12.54 H new ATOM 0 HH21 ARG A 146 9.963 -12.013 3.467 1.00 33.20 H new ATOM 0 HH22 ARG A 146 10.390 -10.768 2.288 1.00 33.20 H new ATOM 2274 N TRP A 147 3.713 -13.324 4.030 1.00 52.55 N ATOM 2275 CA TRP A 147 2.924 -12.192 4.609 1.00 30.21 C ATOM 2276 C TRP A 147 3.286 -11.931 6.084 1.00 32.14 C ATOM 2277 O TRP A 147 3.570 -10.787 6.471 1.00 35.22 O ATOM 2278 CB TRP A 147 1.393 -12.415 4.462 1.00 32.22 C ATOM 2279 CG TRP A 147 0.567 -11.306 5.063 1.00 24.03 C ATOM 2280 CD1 TRP A 147 0.025 -11.282 6.307 1.00 52.12 C ATOM 2281 CD2 TRP A 147 0.207 -10.067 4.453 1.00 35.12 C ATOM 2282 NE1 TRP A 147 -0.626 -10.098 6.517 1.00 22.02 N ATOM 2283 CE2 TRP A 147 -0.535 -9.339 5.392 1.00 52.44 C ATOM 2284 CE3 TRP A 147 0.443 -9.501 3.216 1.00 54.34 C ATOM 2285 CZ2 TRP A 147 -1.034 -8.072 5.120 1.00 45.45 C ATOM 2286 CZ3 TRP A 147 -0.046 -8.261 2.945 1.00 12.45 C ATOM 2287 CH2 TRP A 147 -0.775 -7.556 3.883 1.00 10.33 C ATOM 0 H TRP A 147 3.146 -14.012 3.535 1.00 52.55 H new ATOM 0 HA TRP A 147 3.194 -11.307 4.033 1.00 30.21 H new ATOM 0 HB2 TRP A 147 1.147 -12.509 3.404 1.00 32.22 H new ATOM 0 HB3 TRP A 147 1.123 -13.358 4.938 1.00 32.22 H new ATOM 0 HD1 TRP A 147 0.097 -12.083 7.028 1.00 52.12 H new ATOM 0 HE1 TRP A 147 -1.102 -9.828 7.377 1.00 22.02 H new ATOM 0 HE3 TRP A 147 1.011 -10.038 2.470 1.00 54.34 H new ATOM 0 HZ2 TRP A 147 -1.602 -7.520 5.854 1.00 45.45 H new ATOM 0 HZ3 TRP A 147 0.139 -7.819 1.977 1.00 12.45 H new ATOM 0 HH2 TRP A 147 -1.149 -6.574 3.632 1.00 10.33 H new ATOM 2298 N GLY A 148 3.298 -12.989 6.881 1.00 44.30 N ATOM 2299 CA GLY A 148 3.641 -12.875 8.286 1.00 63.33 C ATOM 2300 C GLY A 148 5.055 -12.374 8.494 1.00 25.45 C ATOM 2301 O GLY A 148 5.340 -11.700 9.484 1.00 11.43 O ATOM 0 H GLY A 148 3.074 -13.936 6.576 1.00 44.30 H new ATOM 0 HA2 GLY A 148 2.942 -12.196 8.774 1.00 63.33 H new ATOM 0 HA3 GLY A 148 3.528 -13.848 8.765 1.00 63.33 H new ATOM 2305 N ALA A 149 5.941 -12.710 7.572 1.00 72.11 N ATOM 2306 CA ALA A 149 7.318 -12.268 7.635 1.00 50.24 C ATOM 2307 C ALA A 149 7.400 -10.778 7.354 1.00 21.43 C ATOM 2308 O ALA A 149 8.115 -10.049 8.047 1.00 32.23 O ATOM 2309 CB ALA A 149 8.191 -13.057 6.666 1.00 1.51 C ATOM 0 H ALA A 149 5.725 -13.294 6.764 1.00 72.11 H new ATOM 0 HA ALA A 149 7.696 -12.452 8.641 1.00 50.24 H new ATOM 0 HB1 ALA A 149 9.220 -12.705 6.734 1.00 1.51 H new ATOM 0 HB2 ALA A 149 8.153 -14.116 6.921 1.00 1.51 H new ATOM 0 HB3 ALA A 149 7.825 -12.915 5.649 1.00 1.51 H new ATOM 2315 N PHE A 150 6.644 -10.313 6.347 1.00 24.31 N ATOM 2316 CA PHE A 150 6.607 -8.892 6.035 1.00 20.02 C ATOM 2317 C PHE A 150 6.061 -8.111 7.216 1.00 20.55 C ATOM 2318 O PHE A 150 6.686 -7.157 7.672 1.00 33.34 O ATOM 2319 CB PHE A 150 5.796 -8.616 4.763 1.00 63.21 C ATOM 2320 CG PHE A 150 5.628 -7.143 4.429 1.00 34.35 C ATOM 2321 CD1 PHE A 150 6.727 -6.329 4.192 1.00 24.44 C ATOM 2322 CD2 PHE A 150 4.361 -6.583 4.334 1.00 44.14 C ATOM 2323 CE1 PHE A 150 6.560 -5.000 3.871 1.00 22.10 C ATOM 2324 CE2 PHE A 150 4.198 -5.249 4.013 1.00 71.44 C ATOM 2325 CZ PHE A 150 5.297 -4.460 3.781 1.00 71.23 C ATOM 0 H PHE A 150 6.061 -10.897 5.748 1.00 24.31 H new ATOM 0 HA PHE A 150 7.627 -8.559 5.842 1.00 20.02 H new ATOM 0 HB2 PHE A 150 6.282 -9.113 3.923 1.00 63.21 H new ATOM 0 HB3 PHE A 150 4.809 -9.066 4.872 1.00 63.21 H new ATOM 0 HD1 PHE A 150 7.723 -6.742 4.260 1.00 24.44 H new ATOM 0 HD2 PHE A 150 3.492 -7.198 4.513 1.00 44.14 H new ATOM 0 HE1 PHE A 150 7.424 -4.378 3.689 1.00 22.10 H new ATOM 0 HE2 PHE A 150 3.206 -4.827 3.945 1.00 71.44 H new ATOM 0 HZ PHE A 150 5.171 -3.418 3.528 1.00 71.23 H new ATOM 2335 N ILE A 151 4.919 -8.539 7.722 1.00 12.14 N ATOM 2336 CA ILE A 151 4.300 -7.935 8.881 1.00 40.03 C ATOM 2337 C ILE A 151 5.234 -7.915 10.106 1.00 73.41 C ATOM 2338 O ILE A 151 5.277 -6.924 10.849 1.00 10.00 O ATOM 2339 CB ILE A 151 2.912 -8.597 9.163 1.00 74.31 C ATOM 2340 CG1 ILE A 151 1.781 -7.829 8.453 1.00 51.43 C ATOM 2341 CG2 ILE A 151 2.628 -8.796 10.629 1.00 1.44 C ATOM 2342 CD1 ILE A 151 1.971 -7.664 6.963 1.00 21.54 C ATOM 0 H ILE A 151 4.393 -9.322 7.335 1.00 12.14 H new ATOM 0 HA ILE A 151 4.114 -6.884 8.660 1.00 40.03 H new ATOM 0 HB ILE A 151 2.956 -9.601 8.741 1.00 74.31 H new ATOM 0 HG12 ILE A 151 0.840 -8.349 8.630 1.00 51.43 H new ATOM 0 HG13 ILE A 151 1.690 -6.842 8.906 1.00 51.43 H new ATOM 0 HG21 ILE A 151 1.649 -9.259 10.750 1.00 1.44 H new ATOM 0 HG22 ILE A 151 3.391 -9.442 11.063 1.00 1.44 H new ATOM 0 HG23 ILE A 151 2.638 -7.831 11.136 1.00 1.44 H new ATOM 0 HD11 ILE A 151 1.128 -7.112 6.548 1.00 21.54 H new ATOM 0 HD12 ILE A 151 2.893 -7.115 6.772 1.00 21.54 H new ATOM 0 HD13 ILE A 151 2.029 -8.646 6.493 1.00 21.54 H new ATOM 2354 N GLN A 152 5.996 -8.984 10.288 1.00 31.51 N ATOM 2355 CA GLN A 152 6.974 -9.048 11.360 1.00 70.34 C ATOM 2356 C GLN A 152 8.011 -7.921 11.197 1.00 2.42 C ATOM 2357 O GLN A 152 8.344 -7.228 12.171 1.00 54.21 O ATOM 2358 CB GLN A 152 7.657 -10.416 11.375 1.00 13.11 C ATOM 2359 CG GLN A 152 8.687 -10.600 12.481 1.00 51.54 C ATOM 2360 CD GLN A 152 9.331 -11.968 12.444 1.00 72.54 C ATOM 2361 OE1 GLN A 152 9.467 -12.575 11.388 1.00 52.44 O ATOM 2362 NE2 GLN A 152 9.733 -12.459 13.582 1.00 52.13 N ATOM 0 H GLN A 152 5.954 -9.820 9.705 1.00 31.51 H new ATOM 0 HA GLN A 152 6.463 -8.912 12.313 1.00 70.34 H new ATOM 0 HB2 GLN A 152 6.893 -11.187 11.476 1.00 13.11 H new ATOM 0 HB3 GLN A 152 8.144 -10.574 10.413 1.00 13.11 H new ATOM 0 HG2 GLN A 152 9.458 -9.835 12.387 1.00 51.54 H new ATOM 0 HG3 GLN A 152 8.208 -10.453 13.449 1.00 51.54 H new ATOM 0 HE21 GLN A 152 9.604 -11.926 14.442 1.00 52.13 H new ATOM 0 HE22 GLN A 152 10.177 -13.377 13.613 1.00 52.13 H new ATOM 2371 N LYS A 153 8.490 -7.724 9.961 1.00 24.52 N ATOM 2372 CA LYS A 153 9.456 -6.682 9.655 1.00 14.23 C ATOM 2373 C LYS A 153 8.852 -5.292 9.834 1.00 73.33 C ATOM 2374 O LYS A 153 9.497 -4.420 10.411 1.00 52.41 O ATOM 2375 CB LYS A 153 9.946 -6.833 8.224 1.00 3.24 C ATOM 2376 CG LYS A 153 10.660 -8.137 7.922 1.00 52.14 C ATOM 2377 CD LYS A 153 10.764 -8.351 6.420 1.00 2.53 C ATOM 2378 CE LYS A 153 11.601 -7.277 5.690 1.00 11.20 C ATOM 2379 NZ LYS A 153 13.038 -7.282 6.073 1.00 52.31 N ATOM 0 H LYS A 153 8.215 -8.284 9.154 1.00 24.52 H new ATOM 0 HA LYS A 153 10.290 -6.789 10.348 1.00 14.23 H new ATOM 0 HB2 LYS A 153 9.092 -6.740 7.553 1.00 3.24 H new ATOM 0 HB3 LYS A 153 10.620 -6.007 7.998 1.00 3.24 H new ATOM 0 HG2 LYS A 153 11.657 -8.124 8.363 1.00 52.14 H new ATOM 0 HG3 LYS A 153 10.121 -8.968 8.377 1.00 52.14 H new ATOM 0 HD2 LYS A 153 11.205 -9.330 6.232 1.00 2.53 H new ATOM 0 HD3 LYS A 153 9.760 -8.366 5.995 1.00 2.53 H new ATOM 0 HE2 LYS A 153 11.519 -7.434 4.614 1.00 11.20 H new ATOM 0 HE3 LYS A 153 11.180 -6.294 5.902 1.00 11.20 H new ATOM 0 HZ1 LYS A 153 13.523 -6.486 5.612 1.00 52.31 H new ATOM 0 HZ2 LYS A 153 13.122 -7.188 7.105 1.00 52.31 H new ATOM 0 HZ3 LYS A 153 13.475 -8.176 5.770 1.00 52.31 H new ATOM 2393 N VAL A 154 7.625 -5.087 9.329 1.00 21.44 N ATOM 2394 CA VAL A 154 6.947 -3.792 9.403 1.00 35.42 C ATOM 2395 C VAL A 154 6.758 -3.334 10.840 1.00 50.33 C ATOM 2396 O VAL A 154 6.949 -2.151 11.149 1.00 20.34 O ATOM 2397 CB VAL A 154 5.558 -3.839 8.728 1.00 32.20 C ATOM 2398 CG1 VAL A 154 4.892 -2.498 8.792 1.00 74.31 C ATOM 2399 CG2 VAL A 154 5.647 -4.310 7.302 1.00 1.10 C ATOM 0 H VAL A 154 7.081 -5.812 8.861 1.00 21.44 H new ATOM 0 HA VAL A 154 7.590 -3.087 8.877 1.00 35.42 H new ATOM 0 HB VAL A 154 4.953 -4.559 9.279 1.00 32.20 H new ATOM 0 HG11 VAL A 154 3.915 -2.553 8.311 1.00 74.31 H new ATOM 0 HG12 VAL A 154 4.767 -2.203 9.834 1.00 74.31 H new ATOM 0 HG13 VAL A 154 5.508 -1.761 8.278 1.00 74.31 H new ATOM 0 HG21 VAL A 154 4.650 -4.329 6.862 1.00 1.10 H new ATOM 0 HG22 VAL A 154 6.281 -3.630 6.733 1.00 1.10 H new ATOM 0 HG23 VAL A 154 6.074 -5.312 7.276 1.00 1.10 H new ATOM 2409 N LYS A 155 6.403 -4.275 11.704 1.00 72.55 N ATOM 2410 CA LYS A 155 6.107 -4.022 13.070 1.00 0.31 C ATOM 2411 C LYS A 155 7.222 -3.220 13.778 1.00 70.34 C ATOM 2412 O LYS A 155 6.934 -2.349 14.601 1.00 14.02 O ATOM 2413 CB LYS A 155 5.845 -5.350 13.738 1.00 31.34 C ATOM 2414 CG LYS A 155 5.214 -5.248 15.073 1.00 24.23 C ATOM 2415 CD LYS A 155 4.832 -6.604 15.585 1.00 1.20 C ATOM 2416 CE LYS A 155 4.024 -6.448 16.821 1.00 2.35 C ATOM 2417 NZ LYS A 155 3.561 -7.735 17.368 1.00 52.13 N ATOM 0 H LYS A 155 6.316 -5.258 11.446 1.00 72.55 H new ATOM 0 HA LYS A 155 5.221 -3.391 13.141 1.00 0.31 H new ATOM 0 HB2 LYS A 155 5.204 -5.948 13.091 1.00 31.34 H new ATOM 0 HB3 LYS A 155 6.789 -5.887 13.835 1.00 31.34 H new ATOM 0 HG2 LYS A 155 5.903 -4.771 15.771 1.00 24.23 H new ATOM 0 HG3 LYS A 155 4.330 -4.614 15.015 1.00 24.23 H new ATOM 0 HD2 LYS A 155 4.262 -7.144 14.829 1.00 1.20 H new ATOM 0 HD3 LYS A 155 5.725 -7.193 15.792 1.00 1.20 H new ATOM 0 HE2 LYS A 155 4.618 -5.931 17.575 1.00 2.35 H new ATOM 0 HE3 LYS A 155 3.161 -5.818 16.608 1.00 2.35 H new ATOM 0 HZ1 LYS A 155 3.003 -7.566 18.229 1.00 52.13 H new ATOM 0 HZ2 LYS A 155 2.971 -8.220 16.662 1.00 52.13 H new ATOM 0 HZ3 LYS A 155 4.382 -8.330 17.599 1.00 52.13 H new ATOM 2431 N ASN A 156 8.485 -3.506 13.468 1.00 21.53 N ATOM 2432 CA ASN A 156 9.567 -2.701 14.044 1.00 51.02 C ATOM 2433 C ASN A 156 10.231 -1.809 13.020 1.00 15.03 C ATOM 2434 O ASN A 156 10.795 -0.782 13.364 1.00 24.14 O ATOM 2435 CB ASN A 156 10.626 -3.520 14.776 1.00 72.42 C ATOM 2436 CG ASN A 156 10.092 -4.288 15.956 1.00 20.44 C ATOM 2437 OD1 ASN A 156 9.724 -5.461 15.843 1.00 10.21 O ATOM 2438 ND2 ASN A 156 10.008 -3.636 17.073 1.00 44.14 N ATOM 0 H ASN A 156 8.781 -4.258 12.846 1.00 21.53 H new ATOM 0 HA ASN A 156 9.069 -2.077 14.787 1.00 51.02 H new ATOM 0 HB2 ASN A 156 11.080 -4.220 14.074 1.00 72.42 H new ATOM 0 HB3 ASN A 156 11.417 -2.852 15.117 1.00 72.42 H new ATOM 0 HD21 ASN A 156 9.626 -4.092 17.902 1.00 44.14 H new ATOM 0 HD22 ASN A 156 10.324 -2.667 17.123 1.00 44.14 H new ATOM 2445 N GLY A 157 10.177 -2.201 11.767 1.00 25.14 N ATOM 2446 CA GLY A 157 10.801 -1.423 10.716 1.00 32.12 C ATOM 2447 C GLY A 157 12.109 -2.018 10.291 1.00 74.34 C ATOM 2448 O GLY A 157 13.141 -1.355 10.325 1.00 11.02 O ATOM 0 H GLY A 157 9.710 -3.050 11.450 1.00 25.14 H new ATOM 0 HA2 GLY A 157 10.131 -1.366 9.858 1.00 32.12 H new ATOM 0 HA3 GLY A 157 10.961 -0.403 11.064 1.00 32.12 H new