USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1088 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 8 ASN : amide:sc= 0.096 K(o=-0.039,f=-1.5) USER MOD Set 1.2: A 18 LYS NZ :NH3+ 147:sc= -0.135 (180deg=-0.383) USER MOD Single : A 2 ASN : amide:sc= -0.238 K(o=-0.24,f=-2.9!) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot -42:sc= 0.0335 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 80:sc= 1.09 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 92:sc= 0.108 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 ASN : amide:sc= -0.0245 K(o=-0.024,f=-0.68) USER MOD Single : A 75 LYS NZ :NH3+ -168:sc= 0.0195 (180deg=0.00579) USER MOD Single : A 80 LYS NZ :NH3+ -121:sc= 0 (180deg=-0.542) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.175) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl 166:sc= -0.02 (180deg=-0.194) USER MOD Single : B 1 MET N :NH3+ -174:sc= 0.564 (180deg=0.486) USER MOD Single : B 2 ASN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : B 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0 USER MOD Single : B 8 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 13 THR OG1 : rot -46:sc= 0.0103 USER MOD Single : B 14 SER OG : rot 86:sc= 0 USER MOD Single : B 17 SER OG : rot 180:sc= 0 USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 22 THR OG1 : rot 71:sc= 0.815 USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 SER OG : rot 88:sc= -0.0389 USER MOD Single : B 33 THR OG1 : rot -21:sc= 0.845 USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 49 ASN : amide:sc= -0.01 K(o=-0.01,f=-1) USER MOD Single : B 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 19 N ASN A 2 -9.374 7.013 -1.995 1.00 0.00 N ATOM 20 CA ASN A 2 -8.633 8.103 -2.730 1.00 0.00 C ATOM 21 C ASN A 2 -7.534 8.840 -1.912 1.00 0.00 C ATOM 22 O ASN A 2 -6.532 9.243 -2.503 1.00 0.00 O ATOM 23 CB ASN A 2 -9.483 9.169 -3.489 1.00 0.00 C ATOM 24 CG ASN A 2 -10.324 10.164 -2.670 1.00 0.00 C ATOM 25 OD1 ASN A 2 -9.909 11.305 -2.473 1.00 0.00 O ATOM 26 ND2 ASN A 2 -11.506 9.778 -2.213 1.00 0.00 N ATOM 0 HA ASN A 2 -8.159 7.478 -3.487 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -8.804 9.748 -4.116 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -10.159 8.637 -4.158 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -12.088 10.431 -1.688 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -11.834 8.828 -2.386 1.00 0.00 H new ATOM 33 N LYS A 3 -7.780 9.005 -0.600 1.00 0.00 N ATOM 34 CA LYS A 3 -6.984 9.777 0.412 1.00 0.00 C ATOM 35 C LYS A 3 -7.934 10.665 1.294 1.00 0.00 C ATOM 36 O LYS A 3 -7.582 10.980 2.432 1.00 0.00 O ATOM 37 CB LYS A 3 -5.728 10.567 -0.063 1.00 0.00 C ATOM 38 CG LYS A 3 -4.729 11.003 1.035 1.00 0.00 C ATOM 39 CD LYS A 3 -3.439 11.617 0.449 1.00 0.00 C ATOM 40 CE LYS A 3 -2.307 11.902 1.455 1.00 0.00 C ATOM 41 NZ LYS A 3 -1.622 10.679 1.918 1.00 0.00 N ATOM 0 H LYS A 3 -8.600 8.575 -0.171 1.00 0.00 H new ATOM 0 HA LYS A 3 -6.519 8.988 1.003 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -5.192 9.953 -0.787 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -6.066 11.459 -0.590 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -5.209 11.730 1.690 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -4.471 10.141 1.650 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -3.056 10.943 -0.317 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -3.699 12.551 -0.049 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -1.577 12.567 0.993 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -2.718 12.429 2.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -0.872 10.935 2.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -2.308 10.053 2.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -1.203 10.187 1.104 1.00 0.00 H new ATOM 54 N THR A 4 -9.117 11.067 0.787 1.00 0.00 N ATOM 55 CA THR A 4 -10.159 11.821 1.462 1.00 0.00 C ATOM 56 C THR A 4 -11.251 10.885 2.052 1.00 0.00 C ATOM 57 O THR A 4 -11.720 11.164 3.159 1.00 0.00 O ATOM 58 CB THR A 4 -10.682 12.757 0.355 1.00 0.00 C ATOM 59 OG1 THR A 4 -9.679 13.669 -0.100 1.00 0.00 O ATOM 60 CG2 THR A 4 -11.841 13.561 0.863 1.00 0.00 C ATOM 0 H THR A 4 -9.375 10.851 -0.176 1.00 0.00 H new ATOM 0 HA THR A 4 -9.808 12.377 2.331 1.00 0.00 H new ATOM 0 HB THR A 4 -10.983 12.120 -0.476 1.00 0.00 H new ATOM 0 HG1 THR A 4 -10.052 14.242 -0.802 1.00 0.00 H new ATOM 0 HG21 THR A 4 -12.202 14.219 0.072 1.00 0.00 H new ATOM 0 HG22 THR A 4 -12.643 12.890 1.171 1.00 0.00 H new ATOM 0 HG23 THR A 4 -11.522 14.160 1.716 1.00 0.00 H new ATOM 68 N GLU A 5 -11.708 9.829 1.329 1.00 0.00 N ATOM 69 CA GLU A 5 -12.496 8.741 1.953 1.00 0.00 C ATOM 70 C GLU A 5 -11.682 8.038 3.117 1.00 0.00 C ATOM 71 O GLU A 5 -12.285 7.450 4.019 1.00 0.00 O ATOM 72 CB GLU A 5 -12.934 7.883 0.742 1.00 0.00 C ATOM 73 CG GLU A 5 -13.380 6.455 1.024 1.00 0.00 C ATOM 74 CD GLU A 5 -14.642 6.286 1.877 1.00 0.00 C ATOM 75 OE1 GLU A 5 -14.625 5.889 3.041 1.00 0.00 O ATOM 76 OE2 GLU A 5 -15.781 6.623 1.191 1.00 0.00 O ATOM 0 H GLU A 5 -11.546 9.711 0.329 1.00 0.00 H new ATOM 0 HA GLU A 5 -13.386 9.049 2.501 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -13.753 8.400 0.241 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -12.103 7.844 0.038 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -13.544 5.955 0.070 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -12.561 5.934 1.520 1.00 0.00 H new ATOM 84 N LEU A 6 -10.328 8.160 3.101 1.00 0.00 N ATOM 85 CA LEU A 6 -9.456 7.911 4.259 1.00 0.00 C ATOM 86 C LEU A 6 -9.830 8.798 5.477 1.00 0.00 C ATOM 87 O LEU A 6 -10.127 8.240 6.522 1.00 0.00 O ATOM 88 CB LEU A 6 -7.976 8.173 3.838 1.00 0.00 C ATOM 89 CG LEU A 6 -6.959 7.121 4.305 1.00 0.00 C ATOM 90 CD1 LEU A 6 -5.566 7.431 3.750 1.00 0.00 C ATOM 91 CD2 LEU A 6 -6.977 6.955 5.840 1.00 0.00 C ATOM 0 H LEU A 6 -9.813 8.439 2.266 1.00 0.00 H new ATOM 0 HA LEU A 6 -9.587 6.874 4.570 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -7.932 8.238 2.751 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -7.672 9.145 4.228 1.00 0.00 H new ATOM 0 HG LEU A 6 -7.252 6.153 3.898 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -4.861 6.674 4.093 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -5.600 7.429 2.661 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -5.244 8.412 4.101 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -6.245 6.203 6.133 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -6.729 7.906 6.312 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -7.970 6.639 6.160 1.00 0.00 H new ATOM 103 N ILE A 7 -9.864 10.138 5.327 1.00 0.00 N ATOM 104 CA ILE A 7 -10.215 11.133 6.390 1.00 0.00 C ATOM 105 C ILE A 7 -11.557 10.798 7.103 1.00 0.00 C ATOM 106 O ILE A 7 -11.603 10.777 8.336 1.00 0.00 O ATOM 107 CB ILE A 7 -10.212 12.602 5.817 1.00 0.00 C ATOM 108 CG1 ILE A 7 -8.913 12.929 5.023 1.00 0.00 C ATOM 109 CG2 ILE A 7 -10.451 13.680 6.904 1.00 0.00 C ATOM 110 CD1 ILE A 7 -8.968 14.105 4.051 1.00 0.00 C ATOM 0 H ILE A 7 -9.642 10.584 4.437 1.00 0.00 H new ATOM 0 HA ILE A 7 -9.439 11.069 7.152 1.00 0.00 H new ATOM 0 HB ILE A 7 -11.055 12.634 5.127 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -8.117 13.122 5.742 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -8.627 12.040 4.462 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -10.437 14.669 6.445 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -11.419 13.512 7.376 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -9.665 13.618 7.657 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -7.999 14.222 3.566 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -9.731 13.917 3.296 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -9.213 15.016 4.596 1.00 0.00 H new ATOM 122 N ASN A 8 -12.616 10.520 6.319 1.00 0.00 N ATOM 123 CA ASN A 8 -13.921 10.067 6.877 1.00 0.00 C ATOM 124 C ASN A 8 -13.906 8.674 7.582 1.00 0.00 C ATOM 125 O ASN A 8 -14.748 8.454 8.455 1.00 0.00 O ATOM 126 CB ASN A 8 -15.042 10.114 5.798 1.00 0.00 C ATOM 127 CG ASN A 8 -15.363 11.492 5.182 1.00 0.00 C ATOM 128 OD1 ASN A 8 -16.116 12.286 5.744 1.00 0.00 O ATOM 129 ND2 ASN A 8 -14.821 11.797 4.012 1.00 0.00 N ATOM 0 H ASN A 8 -12.602 10.598 5.302 1.00 0.00 H new ATOM 0 HA ASN A 8 -14.134 10.785 7.669 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -14.763 9.438 4.990 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -15.956 9.720 6.242 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -15.027 12.694 3.573 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -14.197 11.135 3.551 1.00 0.00 H new ATOM 136 N ALA A 9 -12.980 7.754 7.234 1.00 0.00 N ATOM 137 CA ALA A 9 -12.758 6.500 8.002 1.00 0.00 C ATOM 138 C ALA A 9 -12.200 6.713 9.419 1.00 0.00 C ATOM 139 O ALA A 9 -12.659 6.078 10.366 1.00 0.00 O ATOM 140 CB ALA A 9 -11.677 5.642 7.298 1.00 0.00 C ATOM 0 H ALA A 9 -12.369 7.853 6.423 1.00 0.00 H new ATOM 0 HA ALA A 9 -13.743 6.037 8.055 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -11.516 4.724 7.863 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -12.009 5.394 6.290 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -10.744 6.203 7.245 1.00 0.00 H new ATOM 146 N VAL A 10 -11.189 7.584 9.524 1.00 0.00 N ATOM 147 CA VAL A 10 -10.431 7.875 10.748 1.00 0.00 C ATOM 148 C VAL A 10 -11.267 8.606 11.751 1.00 0.00 C ATOM 149 O VAL A 10 -11.419 8.156 12.885 1.00 0.00 O ATOM 150 CB VAL A 10 -9.074 8.589 10.475 1.00 0.00 C ATOM 151 CG1 VAL A 10 -8.027 8.251 11.516 1.00 0.00 C ATOM 152 CG2 VAL A 10 -8.514 8.249 9.104 1.00 0.00 C ATOM 0 H VAL A 10 -10.863 8.128 8.725 1.00 0.00 H new ATOM 0 HA VAL A 10 -10.169 6.911 11.184 1.00 0.00 H new ATOM 0 HB VAL A 10 -9.296 9.655 10.522 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -7.099 8.773 11.282 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -8.379 8.561 12.500 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -7.848 7.176 11.516 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -7.568 8.770 8.958 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -8.351 7.174 9.034 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -9.221 8.560 8.335 1.00 0.00 H new ATOM 162 N ALA A 11 -11.836 9.712 11.279 1.00 0.00 N ATOM 163 CA ALA A 11 -12.768 10.470 12.089 1.00 0.00 C ATOM 164 C ALA A 11 -14.088 9.746 12.477 1.00 0.00 C ATOM 165 O ALA A 11 -14.670 10.112 13.501 1.00 0.00 O ATOM 166 CB ALA A 11 -12.974 11.824 11.412 1.00 0.00 C ATOM 0 H ALA A 11 -11.667 10.095 10.349 1.00 0.00 H new ATOM 0 HA ALA A 11 -12.322 10.604 13.074 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -13.673 12.421 11.998 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -12.019 12.346 11.343 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -13.377 11.673 10.411 1.00 0.00 H new ATOM 172 N GLU A 12 -14.531 8.715 11.710 1.00 0.00 N ATOM 173 CA GLU A 12 -15.649 7.844 12.134 1.00 0.00 C ATOM 174 C GLU A 12 -15.178 6.803 13.192 1.00 0.00 C ATOM 175 O GLU A 12 -15.787 6.751 14.265 1.00 0.00 O ATOM 176 CB GLU A 12 -16.334 7.226 10.886 1.00 0.00 C ATOM 177 CG GLU A 12 -17.556 6.328 11.170 1.00 0.00 C ATOM 178 CD GLU A 12 -18.212 5.812 9.887 1.00 0.00 C ATOM 179 OE1 GLU A 12 -17.897 4.753 9.344 1.00 0.00 O ATOM 180 OE2 GLU A 12 -19.179 6.664 9.417 1.00 0.00 O ATOM 0 H GLU A 12 -14.132 8.472 10.803 1.00 0.00 H new ATOM 0 HA GLU A 12 -16.411 8.435 12.642 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -16.647 8.036 10.227 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -15.594 6.640 10.341 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -17.247 5.481 11.782 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -18.289 6.889 11.749 1.00 0.00 H new ATOM 188 N THR A 13 -14.120 6.003 12.920 1.00 0.00 N ATOM 189 CA THR A 13 -13.637 4.957 13.887 1.00 0.00 C ATOM 190 C THR A 13 -12.643 5.338 15.026 1.00 0.00 C ATOM 191 O THR A 13 -12.151 4.476 15.761 1.00 0.00 O ATOM 192 CB THR A 13 -13.255 3.702 13.071 1.00 0.00 C ATOM 193 OG1 THR A 13 -13.475 2.523 13.839 1.00 0.00 O ATOM 194 CG2 THR A 13 -11.837 3.656 12.505 1.00 0.00 C ATOM 0 H THR A 13 -13.583 6.051 12.054 1.00 0.00 H new ATOM 0 HA THR A 13 -14.483 4.766 14.548 1.00 0.00 H new ATOM 0 HB THR A 13 -13.911 3.759 12.203 1.00 0.00 H new ATOM 0 HG1 THR A 13 -13.161 2.667 14.756 1.00 0.00 H new ATOM 0 HG21 THR A 13 -11.695 2.726 11.954 1.00 0.00 H new ATOM 0 HG22 THR A 13 -11.685 4.502 11.834 1.00 0.00 H new ATOM 0 HG23 THR A 13 -11.117 3.707 13.322 1.00 0.00 H new ATOM 202 N SER A 14 -12.416 6.638 15.166 1.00 0.00 N ATOM 203 CA SER A 14 -11.563 7.239 16.230 1.00 0.00 C ATOM 204 C SER A 14 -12.231 8.440 16.965 1.00 0.00 C ATOM 205 O SER A 14 -11.953 8.612 18.157 1.00 0.00 O ATOM 206 CB SER A 14 -10.170 7.634 15.676 1.00 0.00 C ATOM 207 OG SER A 14 -9.275 7.991 16.724 1.00 0.00 O ATOM 0 H SER A 14 -12.820 7.334 14.539 1.00 0.00 H new ATOM 0 HA SER A 14 -11.435 6.460 16.981 1.00 0.00 H new ATOM 0 HB2 SER A 14 -9.754 6.802 15.108 1.00 0.00 H new ATOM 0 HB3 SER A 14 -10.276 8.471 14.985 1.00 0.00 H new ATOM 0 HG SER A 14 -8.405 8.233 16.343 1.00 0.00 H new ATOM 213 N GLY A 15 -13.060 9.279 16.299 1.00 0.00 N ATOM 214 CA GLY A 15 -13.647 10.490 16.928 1.00 0.00 C ATOM 215 C GLY A 15 -12.660 11.618 17.284 1.00 0.00 C ATOM 216 O GLY A 15 -12.571 12.066 18.430 1.00 0.00 O ATOM 0 H GLY A 15 -13.338 9.141 15.327 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -14.401 10.895 16.253 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -14.164 10.187 17.839 1.00 0.00 H new ATOM 220 N LEU A 16 -11.959 12.066 16.244 1.00 0.00 N ATOM 221 CA LEU A 16 -10.970 13.163 16.288 1.00 0.00 C ATOM 222 C LEU A 16 -11.676 14.398 15.639 1.00 0.00 C ATOM 223 O LEU A 16 -12.737 14.855 16.080 1.00 0.00 O ATOM 224 CB LEU A 16 -9.527 12.614 15.965 1.00 0.00 C ATOM 225 CG LEU A 16 -9.428 11.723 14.715 1.00 0.00 C ATOM 226 CD1 LEU A 16 -10.156 12.183 13.504 1.00 0.00 C ATOM 227 CD2 LEU A 16 -8.240 10.831 14.317 1.00 0.00 C ATOM 0 H LEU A 16 -12.061 11.667 15.311 1.00 0.00 H new ATOM 0 HA LEU A 16 -10.669 13.603 17.239 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -8.853 13.462 15.841 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -9.171 12.046 16.825 1.00 0.00 H new ATOM 0 HG LEU A 16 -9.946 10.990 15.334 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -10.005 11.468 12.695 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -11.220 12.260 13.727 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -9.777 13.159 13.200 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -8.466 10.321 13.380 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -7.349 11.447 14.190 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -8.062 10.092 15.098 1.00 0.00 H new ATOM 239 N SER A 17 -11.041 14.916 14.610 1.00 0.00 N ATOM 240 CA SER A 17 -11.557 15.979 13.712 1.00 0.00 C ATOM 241 C SER A 17 -11.331 15.577 12.225 1.00 0.00 C ATOM 242 O SER A 17 -10.497 14.741 11.890 1.00 0.00 O ATOM 243 CB SER A 17 -10.903 17.339 14.029 1.00 0.00 C ATOM 244 OG SER A 17 -11.130 17.739 15.376 1.00 0.00 O ATOM 0 H SER A 17 -10.105 14.607 14.347 1.00 0.00 H new ATOM 0 HA SER A 17 -12.628 16.087 13.881 1.00 0.00 H new ATOM 0 HB2 SER A 17 -9.830 17.277 13.845 1.00 0.00 H new ATOM 0 HB3 SER A 17 -11.299 18.098 13.354 1.00 0.00 H new ATOM 0 HG SER A 17 -10.699 18.604 15.537 1.00 0.00 H new ATOM 250 N LYS A 18 -12.063 16.200 11.290 1.00 0.00 N ATOM 251 CA LYS A 18 -11.806 16.056 9.817 1.00 0.00 C ATOM 252 C LYS A 18 -10.373 16.586 9.479 1.00 0.00 C ATOM 253 O LYS A 18 -9.591 15.861 8.874 1.00 0.00 O ATOM 254 CB LYS A 18 -12.904 16.708 8.926 1.00 0.00 C ATOM 255 CG LYS A 18 -14.396 16.527 9.311 1.00 0.00 C ATOM 256 CD LYS A 18 -14.911 15.104 9.617 1.00 0.00 C ATOM 257 CE LYS A 18 -14.899 14.129 8.427 1.00 0.00 C ATOM 258 NZ LYS A 18 -15.548 12.860 8.799 1.00 0.00 N ATOM 0 H LYS A 18 -12.846 16.815 11.512 1.00 0.00 H new ATOM 0 HA LYS A 18 -11.855 14.994 9.578 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -12.702 17.779 8.887 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -12.777 16.323 7.914 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -14.589 17.145 10.188 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -14.999 16.930 8.498 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -14.305 14.681 10.418 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -15.931 15.178 9.994 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -15.417 14.575 7.578 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -13.872 13.942 8.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -16.031 12.460 7.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -14.829 12.189 9.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -16.243 13.033 9.553 1.00 0.00 H new ATOM 271 N LYS A 19 -10.011 17.791 9.965 1.00 0.00 N ATOM 272 CA LYS A 19 -8.620 18.321 9.933 1.00 0.00 C ATOM 273 C LYS A 19 -7.600 17.418 10.705 1.00 0.00 C ATOM 274 O LYS A 19 -6.500 17.241 10.179 1.00 0.00 O ATOM 275 CB LYS A 19 -8.554 19.779 10.464 1.00 0.00 C ATOM 276 CG LYS A 19 -9.271 20.821 9.575 1.00 0.00 C ATOM 277 CD LYS A 19 -9.158 22.256 10.124 1.00 0.00 C ATOM 278 CE LYS A 19 -9.868 23.289 9.230 1.00 0.00 C ATOM 279 NZ LYS A 19 -9.743 24.652 9.777 1.00 0.00 N ATOM 0 H LYS A 19 -10.676 18.433 10.395 1.00 0.00 H new ATOM 0 HA LYS A 19 -8.325 18.314 8.884 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -8.993 19.809 11.461 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -7.508 20.067 10.567 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -8.848 20.787 8.571 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -10.324 20.553 9.487 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -9.586 22.293 11.126 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -8.106 22.524 10.217 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -9.442 23.258 8.227 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -10.922 23.028 9.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -10.232 25.323 9.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -10.171 24.687 10.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -8.737 24.909 9.842 1.00 0.00 H new ATOM 292 N ASP A 20 -7.923 16.837 11.896 1.00 0.00 N ATOM 293 CA ASP A 20 -6.995 15.869 12.578 1.00 0.00 C ATOM 294 C ASP A 20 -6.800 14.517 11.821 1.00 0.00 C ATOM 295 O ASP A 20 -5.704 13.961 11.877 1.00 0.00 O ATOM 296 CB ASP A 20 -7.388 15.602 14.055 1.00 0.00 C ATOM 297 CG ASP A 20 -6.986 16.722 15.025 1.00 0.00 C ATOM 298 OD1 ASP A 20 -7.778 17.549 15.473 1.00 0.00 O ATOM 299 OD2 ASP A 20 -5.648 16.686 15.332 1.00 0.00 O ATOM 0 H ASP A 20 -8.794 17.012 12.398 1.00 0.00 H new ATOM 0 HA ASP A 20 -6.032 16.379 12.560 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -8.467 15.457 14.112 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -6.924 14.671 14.380 1.00 0.00 H new ATOM 305 N ALA A 21 -7.833 13.999 11.134 1.00 0.00 N ATOM 306 CA ALA A 21 -7.744 12.805 10.258 1.00 0.00 C ATOM 307 C ALA A 21 -6.933 13.053 8.949 1.00 0.00 C ATOM 308 O ALA A 21 -6.147 12.186 8.566 1.00 0.00 O ATOM 309 CB ALA A 21 -9.177 12.310 10.015 1.00 0.00 C ATOM 0 H ALA A 21 -8.770 14.400 11.169 1.00 0.00 H new ATOM 0 HA ALA A 21 -7.168 12.024 10.754 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -9.154 11.430 9.373 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -9.639 12.052 10.968 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -9.757 13.097 9.532 1.00 0.00 H new ATOM 315 N THR A 22 -7.085 14.227 8.295 1.00 0.00 N ATOM 316 CA THR A 22 -6.259 14.671 7.136 1.00 0.00 C ATOM 317 C THR A 22 -4.737 14.760 7.465 1.00 0.00 C ATOM 318 O THR A 22 -3.899 14.251 6.716 1.00 0.00 O ATOM 319 CB THR A 22 -6.811 16.035 6.616 1.00 0.00 C ATOM 320 OG1 THR A 22 -8.231 16.093 6.583 1.00 0.00 O ATOM 321 CG2 THR A 22 -6.349 16.306 5.192 1.00 0.00 C ATOM 0 H THR A 22 -7.797 14.909 8.558 1.00 0.00 H new ATOM 0 HA THR A 22 -6.340 13.916 6.354 1.00 0.00 H new ATOM 0 HB THR A 22 -6.427 16.772 7.321 1.00 0.00 H new ATOM 0 HG1 THR A 22 -8.572 16.281 7.482 1.00 0.00 H new ATOM 0 HG21 THR A 22 -6.749 17.263 4.856 1.00 0.00 H new ATOM 0 HG22 THR A 22 -5.260 16.337 5.163 1.00 0.00 H new ATOM 0 HG23 THR A 22 -6.707 15.513 4.536 1.00 0.00 H new ATOM 329 N LYS A 23 -4.425 15.406 8.598 1.00 0.00 N ATOM 330 CA LYS A 23 -3.068 15.455 9.191 1.00 0.00 C ATOM 331 C LYS A 23 -2.472 14.063 9.493 1.00 0.00 C ATOM 332 O LYS A 23 -1.374 13.783 9.037 1.00 0.00 O ATOM 333 CB LYS A 23 -3.149 16.190 10.561 1.00 0.00 C ATOM 334 CG LYS A 23 -3.288 17.725 10.492 1.00 0.00 C ATOM 335 CD LYS A 23 -3.481 18.354 11.887 1.00 0.00 C ATOM 336 CE LYS A 23 -3.699 19.875 11.831 1.00 0.00 C ATOM 337 NZ LYS A 23 -3.892 20.437 13.180 1.00 0.00 N ATOM 0 H LYS A 23 -5.117 15.921 9.143 1.00 0.00 H new ATOM 0 HA LYS A 23 -2.436 15.957 8.458 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -3.998 15.792 11.116 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -2.253 15.951 11.134 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -2.399 18.148 10.024 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -4.136 17.984 9.858 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -4.336 17.887 12.376 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -2.606 18.139 12.501 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -2.841 20.351 11.356 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -4.569 20.098 11.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -4.037 21.465 13.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -4.725 19.999 13.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -3.051 20.244 13.760 1.00 0.00 H new ATOM 350 N ALA A 24 -3.204 13.247 10.262 1.00 0.00 N ATOM 351 CA ALA A 24 -2.829 11.880 10.673 1.00 0.00 C ATOM 352 C ALA A 24 -2.510 10.867 9.549 1.00 0.00 C ATOM 353 O ALA A 24 -1.630 10.028 9.711 1.00 0.00 O ATOM 354 CB ALA A 24 -3.947 11.416 11.593 1.00 0.00 C ATOM 0 H ALA A 24 -4.112 13.529 10.632 1.00 0.00 H new ATOM 0 HA ALA A 24 -1.859 11.922 11.169 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -3.737 10.404 11.939 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -4.015 12.086 12.450 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -4.892 11.425 11.050 1.00 0.00 H new ATOM 360 N VAL A 25 -3.210 10.975 8.418 1.00 0.00 N ATOM 361 CA VAL A 25 -2.869 10.313 7.128 1.00 0.00 C ATOM 362 C VAL A 25 -1.498 10.864 6.623 1.00 0.00 C ATOM 363 O VAL A 25 -0.586 10.064 6.425 1.00 0.00 O ATOM 364 CB VAL A 25 -4.095 10.706 6.221 1.00 0.00 C ATOM 365 CG1 VAL A 25 -3.771 10.747 4.714 1.00 0.00 C ATOM 366 CG2 VAL A 25 -5.285 9.786 6.504 1.00 0.00 C ATOM 0 H VAL A 25 -4.058 11.539 8.358 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.735 9.232 7.162 1.00 0.00 H new ATOM 0 HB VAL A 25 -4.357 11.729 6.490 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -4.666 11.025 4.157 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -2.986 11.481 4.530 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -3.432 9.764 4.388 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -6.124 10.071 5.869 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.005 8.754 6.294 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -5.575 9.877 7.551 1.00 0.00 H new ATOM 376 N ASP A 26 -1.343 12.198 6.438 1.00 0.00 N ATOM 377 CA ASP A 26 0.001 12.822 6.169 1.00 0.00 C ATOM 378 C ASP A 26 0.957 12.945 7.431 1.00 0.00 C ATOM 379 O ASP A 26 1.765 13.860 7.605 1.00 0.00 O ATOM 380 CB ASP A 26 -0.280 14.188 5.510 1.00 0.00 C ATOM 381 CG ASP A 26 0.904 14.777 4.727 1.00 0.00 C ATOM 382 OD1 ASP A 26 1.302 14.319 3.657 1.00 0.00 O ATOM 383 OD2 ASP A 26 1.463 15.856 5.362 1.00 0.00 O ATOM 0 H ASP A 26 -2.114 12.865 6.467 1.00 0.00 H new ATOM 0 HA ASP A 26 0.569 12.163 5.513 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -1.129 14.083 4.834 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -0.575 14.896 6.284 1.00 0.00 H new ATOM 389 N ALA A 27 0.767 11.978 8.316 1.00 0.00 N ATOM 390 CA ALA A 27 1.536 11.667 9.534 1.00 0.00 C ATOM 391 C ALA A 27 2.073 10.210 9.425 1.00 0.00 C ATOM 392 O ALA A 27 3.250 9.967 9.706 1.00 0.00 O ATOM 393 CB ALA A 27 0.689 11.972 10.767 1.00 0.00 C ATOM 0 H ALA A 27 -0.004 11.321 8.196 1.00 0.00 H new ATOM 0 HA ALA A 27 2.417 12.300 9.641 1.00 0.00 H new ATOM 0 HB1 ALA A 27 1.260 11.741 11.667 1.00 0.00 H new ATOM 0 HB2 ALA A 27 0.418 13.028 10.770 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -0.216 11.365 10.746 1.00 0.00 H new ATOM 399 N VAL A 28 1.214 9.258 8.980 1.00 0.00 N ATOM 400 CA VAL A 28 1.623 7.904 8.532 1.00 0.00 C ATOM 401 C VAL A 28 2.479 8.084 7.237 1.00 0.00 C ATOM 402 O VAL A 28 3.702 8.004 7.280 1.00 0.00 O ATOM 403 CB VAL A 28 0.410 6.938 8.222 1.00 0.00 C ATOM 404 CG1 VAL A 28 0.896 5.500 8.100 1.00 0.00 C ATOM 405 CG2 VAL A 28 -0.760 6.956 9.178 1.00 0.00 C ATOM 0 H VAL A 28 0.207 9.412 8.922 1.00 0.00 H new ATOM 0 HA VAL A 28 2.179 7.436 9.344 1.00 0.00 H new ATOM 0 HB VAL A 28 0.020 7.340 7.287 1.00 0.00 H new ATOM 0 HG11 VAL A 28 0.050 4.847 7.887 1.00 0.00 H new ATOM 0 HG12 VAL A 28 1.623 5.429 7.291 1.00 0.00 H new ATOM 0 HG13 VAL A 28 1.364 5.194 9.035 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -1.516 6.246 8.842 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.419 6.678 10.175 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -1.190 7.957 9.207 1.00 0.00 H new ATOM 415 N PHE A 29 1.791 8.438 6.140 1.00 0.00 N ATOM 416 CA PHE A 29 2.335 8.619 4.768 1.00 0.00 C ATOM 417 C PHE A 29 3.211 9.898 4.560 1.00 0.00 C ATOM 418 O PHE A 29 3.398 10.325 3.419 1.00 0.00 O ATOM 419 CB PHE A 29 1.156 8.542 3.738 1.00 0.00 C ATOM 420 CG PHE A 29 0.218 7.327 3.872 1.00 0.00 C ATOM 421 CD1 PHE A 29 0.668 6.024 3.624 1.00 0.00 C ATOM 422 CD2 PHE A 29 -1.049 7.523 4.426 1.00 0.00 C ATOM 423 CE1 PHE A 29 -0.127 4.933 3.972 1.00 0.00 C ATOM 424 CE2 PHE A 29 -1.833 6.438 4.782 1.00 0.00 C ATOM 425 CZ PHE A 29 -1.373 5.145 4.560 1.00 0.00 C ATOM 0 H PHE A 29 0.788 8.617 6.179 1.00 0.00 H new ATOM 0 HA PHE A 29 3.039 7.803 4.601 1.00 0.00 H new ATOM 0 HB2 PHE A 29 0.559 9.449 3.832 1.00 0.00 H new ATOM 0 HB3 PHE A 29 1.578 8.541 2.733 1.00 0.00 H new ATOM 0 HD1 PHE A 29 1.631 5.864 3.163 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -1.419 8.526 4.578 1.00 0.00 H new ATOM 0 HE1 PHE A 29 0.221 3.928 3.787 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -2.802 6.597 5.232 1.00 0.00 H new ATOM 0 HZ PHE A 29 -1.984 4.301 4.844 1.00 0.00 H new ATOM 435 N ASP A 30 3.729 10.510 5.647 1.00 0.00 N ATOM 436 CA ASP A 30 4.811 11.531 5.600 1.00 0.00 C ATOM 437 C ASP A 30 6.101 10.951 6.243 1.00 0.00 C ATOM 438 O ASP A 30 7.177 11.071 5.657 1.00 0.00 O ATOM 439 CB ASP A 30 4.357 12.842 6.265 1.00 0.00 C ATOM 440 CG ASP A 30 5.193 14.069 5.885 1.00 0.00 C ATOM 441 OD1 ASP A 30 6.205 14.415 6.492 1.00 0.00 O ATOM 442 OD2 ASP A 30 4.679 14.726 4.796 1.00 0.00 O ATOM 0 H ASP A 30 3.408 10.310 6.594 1.00 0.00 H new ATOM 0 HA ASP A 30 5.038 11.776 4.562 1.00 0.00 H new ATOM 0 HB2 ASP A 30 3.317 13.029 5.997 1.00 0.00 H new ATOM 0 HB3 ASP A 30 4.390 12.716 7.347 1.00 0.00 H new ATOM 448 N SER A 31 5.997 10.333 7.435 1.00 0.00 N ATOM 449 CA SER A 31 7.124 9.573 8.049 1.00 0.00 C ATOM 450 C SER A 31 7.599 8.335 7.217 1.00 0.00 C ATOM 451 O SER A 31 8.783 8.003 7.291 1.00 0.00 O ATOM 452 CB SER A 31 6.782 9.112 9.475 1.00 0.00 C ATOM 453 OG SER A 31 6.353 10.200 10.287 1.00 0.00 O ATOM 0 H SER A 31 5.147 10.340 7.999 1.00 0.00 H new ATOM 0 HA SER A 31 7.950 10.284 8.068 1.00 0.00 H new ATOM 0 HB2 SER A 31 5.999 8.355 9.436 1.00 0.00 H new ATOM 0 HB3 SER A 31 7.656 8.643 9.926 1.00 0.00 H new ATOM 0 HG SER A 31 5.377 10.277 10.242 1.00 0.00 H new ATOM 459 N ILE A 32 6.718 7.668 6.431 1.00 0.00 N ATOM 460 CA ILE A 32 7.054 6.537 5.533 1.00 0.00 C ATOM 461 C ILE A 32 7.918 7.005 4.368 1.00 0.00 C ATOM 462 O ILE A 32 9.001 6.485 4.176 1.00 0.00 O ATOM 463 CB ILE A 32 5.767 5.809 5.054 1.00 0.00 C ATOM 464 CG1 ILE A 32 5.029 5.295 6.295 1.00 0.00 C ATOM 465 CG2 ILE A 32 6.191 4.671 4.097 1.00 0.00 C ATOM 466 CD1 ILE A 32 3.633 4.769 6.108 1.00 0.00 C ATOM 0 H ILE A 32 5.727 7.909 6.404 1.00 0.00 H new ATOM 0 HA ILE A 32 7.642 5.812 6.096 1.00 0.00 H new ATOM 0 HB ILE A 32 5.090 6.467 4.510 1.00 0.00 H new ATOM 0 HG12 ILE A 32 5.630 4.501 6.738 1.00 0.00 H new ATOM 0 HG13 ILE A 32 4.987 6.107 7.021 1.00 0.00 H new ATOM 0 HG21 ILE A 32 5.305 4.142 3.745 1.00 0.00 H new ATOM 0 HG22 ILE A 32 6.725 5.092 3.245 1.00 0.00 H new ATOM 0 HG23 ILE A 32 6.843 3.975 4.625 1.00 0.00 H new ATOM 0 HD11 ILE A 32 3.236 4.441 7.069 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.998 5.557 5.703 1.00 0.00 H new ATOM 0 HD13 ILE A 32 3.651 3.927 5.416 1.00 0.00 H new ATOM 478 N THR A 33 7.412 7.919 3.560 1.00 0.00 N ATOM 479 CA THR A 33 8.195 8.544 2.466 1.00 0.00 C ATOM 480 C THR A 33 9.517 9.239 2.943 1.00 0.00 C ATOM 481 O THR A 33 10.460 9.282 2.159 1.00 0.00 O ATOM 482 CB THR A 33 7.214 9.477 1.693 1.00 0.00 C ATOM 483 OG1 THR A 33 7.900 10.291 0.746 1.00 0.00 O ATOM 484 CG2 THR A 33 6.321 10.364 2.581 1.00 0.00 C ATOM 0 H THR A 33 6.453 8.260 3.628 1.00 0.00 H new ATOM 0 HA THR A 33 8.582 7.779 1.793 1.00 0.00 H new ATOM 0 HB THR A 33 6.545 8.786 1.180 1.00 0.00 H new ATOM 0 HG1 THR A 33 7.256 10.862 0.278 1.00 0.00 H new ATOM 0 HG21 THR A 33 5.675 10.976 1.951 1.00 0.00 H new ATOM 0 HG22 THR A 33 5.708 9.734 3.226 1.00 0.00 H new ATOM 0 HG23 THR A 33 6.947 11.011 3.195 1.00 0.00 H new ATOM 492 N GLU A 34 9.598 9.741 4.197 1.00 0.00 N ATOM 493 CA GLU A 34 10.888 10.103 4.846 1.00 0.00 C ATOM 494 C GLU A 34 11.732 8.823 5.170 1.00 0.00 C ATOM 495 O GLU A 34 12.950 8.899 5.024 1.00 0.00 O ATOM 496 CB GLU A 34 10.667 10.973 6.109 1.00 0.00 C ATOM 497 CG GLU A 34 10.180 12.412 5.829 1.00 0.00 C ATOM 498 CD GLU A 34 9.774 13.147 7.109 1.00 0.00 C ATOM 499 OE1 GLU A 34 8.665 13.034 7.631 1.00 0.00 O ATOM 500 OE2 GLU A 34 10.786 13.930 7.603 1.00 0.00 O ATOM 0 H GLU A 34 8.782 9.907 4.786 1.00 0.00 H new ATOM 0 HA GLU A 34 11.457 10.706 4.138 1.00 0.00 H new ATOM 0 HB2 GLU A 34 9.939 10.477 6.752 1.00 0.00 H new ATOM 0 HB3 GLU A 34 11.602 11.023 6.666 1.00 0.00 H new ATOM 0 HG2 GLU A 34 10.971 12.970 5.328 1.00 0.00 H new ATOM 0 HG3 GLU A 34 9.331 12.380 5.146 1.00 0.00 H new ATOM 508 N ALA A 35 11.136 7.666 5.573 1.00 0.00 N ATOM 509 CA ALA A 35 11.845 6.357 5.661 1.00 0.00 C ATOM 510 C ALA A 35 12.466 5.938 4.299 1.00 0.00 C ATOM 511 O ALA A 35 13.682 5.843 4.168 1.00 0.00 O ATOM 512 CB ALA A 35 10.908 5.196 6.180 1.00 0.00 C ATOM 0 H ALA A 35 10.154 7.614 5.845 1.00 0.00 H new ATOM 0 HA ALA A 35 12.645 6.508 6.386 1.00 0.00 H new ATOM 0 HB1 ALA A 35 11.473 4.265 6.225 1.00 0.00 H new ATOM 0 HB2 ALA A 35 10.538 5.444 7.175 1.00 0.00 H new ATOM 0 HB3 ALA A 35 10.066 5.076 5.499 1.00 0.00 H new ATOM 518 N LEU A 36 11.617 5.789 3.281 1.00 0.00 N ATOM 519 CA LEU A 36 11.950 5.347 1.912 1.00 0.00 C ATOM 520 C LEU A 36 12.904 6.298 1.198 1.00 0.00 C ATOM 521 O LEU A 36 13.926 5.833 0.690 1.00 0.00 O ATOM 522 CB LEU A 36 10.635 5.073 1.159 1.00 0.00 C ATOM 523 CG LEU A 36 9.648 4.145 1.966 1.00 0.00 C ATOM 524 CD1 LEU A 36 8.400 3.749 1.229 1.00 0.00 C ATOM 525 CD2 LEU A 36 10.297 2.848 2.460 1.00 0.00 C ATOM 0 H LEU A 36 10.621 5.982 3.388 1.00 0.00 H new ATOM 0 HA LEU A 36 12.517 4.417 1.950 1.00 0.00 H new ATOM 0 HB2 LEU A 36 10.141 6.021 0.944 1.00 0.00 H new ATOM 0 HB3 LEU A 36 10.862 4.607 0.200 1.00 0.00 H new ATOM 0 HG LEU A 36 9.378 4.788 2.804 1.00 0.00 H new ATOM 0 HD11 LEU A 36 7.787 3.112 1.867 1.00 0.00 H new ATOM 0 HD12 LEU A 36 7.837 4.643 0.960 1.00 0.00 H new ATOM 0 HD13 LEU A 36 8.669 3.204 0.324 1.00 0.00 H new ATOM 0 HD21 LEU A 36 9.561 2.258 3.007 1.00 0.00 H new ATOM 0 HD22 LEU A 36 10.660 2.275 1.607 1.00 0.00 H new ATOM 0 HD23 LEU A 36 11.132 3.087 3.118 1.00 0.00 H new ATOM 537 N ARG A 37 12.635 7.622 1.207 1.00 0.00 N ATOM 538 CA ARG A 37 13.599 8.582 0.638 1.00 0.00 C ATOM 539 C ARG A 37 14.987 8.600 1.375 1.00 0.00 C ATOM 540 O ARG A 37 15.991 8.899 0.724 1.00 0.00 O ATOM 541 CB ARG A 37 13.013 9.989 0.380 1.00 0.00 C ATOM 542 CG ARG A 37 13.174 11.012 1.526 1.00 0.00 C ATOM 543 CD ARG A 37 12.163 12.150 1.507 1.00 0.00 C ATOM 544 NE ARG A 37 12.273 13.039 0.321 1.00 0.00 N ATOM 545 CZ ARG A 37 11.246 13.715 -0.231 1.00 0.00 C ATOM 546 NH1 ARG A 37 9.996 13.680 0.227 1.00 0.00 N ATOM 547 NH2 ARG A 37 11.494 14.457 -1.295 1.00 0.00 N ATOM 0 H ARG A 37 11.786 8.038 1.589 1.00 0.00 H new ATOM 0 HA ARG A 37 13.815 8.191 -0.356 1.00 0.00 H new ATOM 0 HB2 ARG A 37 13.484 10.398 -0.514 1.00 0.00 H new ATOM 0 HB3 ARG A 37 11.950 9.883 0.161 1.00 0.00 H new ATOM 0 HG2 ARG A 37 13.093 10.487 2.478 1.00 0.00 H new ATOM 0 HG3 ARG A 37 14.178 11.435 1.480 1.00 0.00 H new ATOM 0 HD2 ARG A 37 11.158 11.730 1.541 1.00 0.00 H new ATOM 0 HD3 ARG A 37 12.289 12.748 2.409 1.00 0.00 H new ATOM 0 HE ARG A 37 13.193 13.145 -0.106 1.00 0.00 H new ATOM 0 HH11 ARG A 37 9.768 13.116 1.046 1.00 0.00 H new ATOM 0 HH12 ARG A 37 9.266 14.218 -0.241 1.00 0.00 H new ATOM 0 HH21 ARG A 37 12.440 14.505 -1.674 1.00 0.00 H new ATOM 0 HH22 ARG A 37 10.740 14.982 -1.738 1.00 0.00 H new ATOM 560 N LYS A 38 15.031 8.312 2.708 1.00 0.00 N ATOM 561 CA LYS A 38 16.304 8.321 3.480 1.00 0.00 C ATOM 562 C LYS A 38 17.093 6.959 3.512 1.00 0.00 C ATOM 563 O LYS A 38 18.189 6.913 4.078 1.00 0.00 O ATOM 564 CB LYS A 38 15.968 8.849 4.904 1.00 0.00 C ATOM 565 CG LYS A 38 17.147 9.333 5.782 1.00 0.00 C ATOM 566 CD LYS A 38 16.736 9.844 7.180 1.00 0.00 C ATOM 567 CE LYS A 38 15.946 11.169 7.183 1.00 0.00 C ATOM 568 NZ LYS A 38 15.644 11.614 8.555 1.00 0.00 N ATOM 0 H LYS A 38 14.209 8.074 3.262 1.00 0.00 H new ATOM 0 HA LYS A 38 17.007 8.977 2.966 1.00 0.00 H new ATOM 0 HB2 LYS A 38 15.265 9.675 4.799 1.00 0.00 H new ATOM 0 HB3 LYS A 38 15.450 8.056 5.443 1.00 0.00 H new ATOM 0 HG2 LYS A 38 17.855 8.513 5.902 1.00 0.00 H new ATOM 0 HG3 LYS A 38 17.671 10.131 5.257 1.00 0.00 H new ATOM 0 HD2 LYS A 38 16.133 9.078 7.668 1.00 0.00 H new ATOM 0 HD3 LYS A 38 17.635 9.973 7.782 1.00 0.00 H new ATOM 0 HE2 LYS A 38 16.522 11.938 6.668 1.00 0.00 H new ATOM 0 HE3 LYS A 38 15.017 11.041 6.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 15.112 12.507 8.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 15.074 10.890 9.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 16.532 11.759 9.076 1.00 0.00 H new ATOM 581 N GLY A 39 16.579 5.866 2.908 1.00 0.00 N ATOM 582 CA GLY A 39 17.173 4.508 3.028 1.00 0.00 C ATOM 583 C GLY A 39 16.829 3.784 4.360 1.00 0.00 C ATOM 584 O GLY A 39 17.713 3.206 4.996 1.00 0.00 O ATOM 0 H GLY A 39 15.743 5.895 2.324 1.00 0.00 H new ATOM 0 HA2 GLY A 39 16.828 3.897 2.194 1.00 0.00 H new ATOM 0 HA3 GLY A 39 18.256 4.587 2.938 1.00 0.00 H new ATOM 588 N ASP A 40 15.540 3.821 4.748 1.00 0.00 N ATOM 589 CA ASP A 40 15.028 3.267 6.031 1.00 0.00 C ATOM 590 C ASP A 40 13.774 2.387 5.813 1.00 0.00 C ATOM 591 O ASP A 40 12.874 2.713 5.033 1.00 0.00 O ATOM 592 CB ASP A 40 14.791 4.364 7.102 1.00 0.00 C ATOM 593 CG ASP A 40 16.049 5.099 7.588 1.00 0.00 C ATOM 594 OD1 ASP A 40 16.436 6.166 7.112 1.00 0.00 O ATOM 595 OD2 ASP A 40 16.687 4.425 8.598 1.00 0.00 O ATOM 0 H ASP A 40 14.808 4.242 4.175 1.00 0.00 H new ATOM 0 HA ASP A 40 15.812 2.621 6.427 1.00 0.00 H new ATOM 0 HB2 ASP A 40 14.096 5.099 6.696 1.00 0.00 H new ATOM 0 HB3 ASP A 40 14.304 3.907 7.963 1.00 0.00 H new ATOM 601 N LYS A 41 13.739 1.259 6.552 1.00 0.00 N ATOM 602 CA LYS A 41 12.577 0.339 6.577 1.00 0.00 C ATOM 603 C LYS A 41 11.529 0.903 7.575 1.00 0.00 C ATOM 604 O LYS A 41 11.856 1.465 8.629 1.00 0.00 O ATOM 605 CB LYS A 41 12.939 -1.101 7.033 1.00 0.00 C ATOM 606 CG LYS A 41 14.030 -1.834 6.219 1.00 0.00 C ATOM 607 CD LYS A 41 14.161 -3.335 6.558 1.00 0.00 C ATOM 608 CE LYS A 41 14.745 -3.630 7.954 1.00 0.00 C ATOM 609 NZ LYS A 41 14.869 -5.079 8.191 1.00 0.00 N ATOM 0 H LYS A 41 14.511 0.959 7.147 1.00 0.00 H new ATOM 0 HA LYS A 41 12.197 0.276 5.557 1.00 0.00 H new ATOM 0 HB2 LYS A 41 13.262 -1.057 8.073 1.00 0.00 H new ATOM 0 HB3 LYS A 41 12.032 -1.704 7.006 1.00 0.00 H new ATOM 0 HG2 LYS A 41 13.809 -1.729 5.157 1.00 0.00 H new ATOM 0 HG3 LYS A 41 14.989 -1.347 6.394 1.00 0.00 H new ATOM 0 HD2 LYS A 41 13.177 -3.797 6.485 1.00 0.00 H new ATOM 0 HD3 LYS A 41 14.792 -3.810 5.807 1.00 0.00 H new ATOM 0 HE2 LYS A 41 15.724 -3.160 8.047 1.00 0.00 H new ATOM 0 HE3 LYS A 41 14.105 -3.188 8.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 15.265 -5.243 9.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 13.931 -5.523 8.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 15.499 -5.495 7.476 1.00 0.00 H new ATOM 622 N VAL A 42 10.253 0.664 7.259 1.00 0.00 N ATOM 623 CA VAL A 42 9.107 1.141 8.038 1.00 0.00 C ATOM 624 C VAL A 42 8.829 0.005 9.068 1.00 0.00 C ATOM 625 O VAL A 42 9.732 -0.388 9.815 1.00 0.00 O ATOM 626 CB VAL A 42 8.116 1.540 6.889 1.00 0.00 C ATOM 627 CG1 VAL A 42 6.861 2.230 7.370 1.00 0.00 C ATOM 628 CG2 VAL A 42 8.632 2.597 5.871 1.00 0.00 C ATOM 0 H VAL A 42 9.982 0.123 6.438 1.00 0.00 H new ATOM 0 HA VAL A 42 9.138 2.011 8.694 1.00 0.00 H new ATOM 0 HB VAL A 42 7.968 0.555 6.446 1.00 0.00 H new ATOM 0 HG11 VAL A 42 6.229 2.473 6.516 1.00 0.00 H new ATOM 0 HG12 VAL A 42 6.319 1.569 8.046 1.00 0.00 H new ATOM 0 HG13 VAL A 42 7.128 3.147 7.896 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.861 2.791 5.126 1.00 0.00 H new ATOM 0 HG22 VAL A 42 8.870 3.522 6.396 1.00 0.00 H new ATOM 0 HG23 VAL A 42 9.527 2.220 5.377 1.00 0.00 H new ATOM 638 N GLN A 43 7.561 -0.364 9.208 1.00 0.00 N ATOM 639 CA GLN A 43 7.058 -1.596 9.875 1.00 0.00 C ATOM 640 C GLN A 43 5.541 -1.519 10.209 1.00 0.00 C ATOM 641 O GLN A 43 5.032 -0.464 10.590 1.00 0.00 O ATOM 642 CB GLN A 43 7.974 -2.444 10.813 1.00 0.00 C ATOM 643 CG GLN A 43 8.943 -3.315 9.981 1.00 0.00 C ATOM 644 CD GLN A 43 10.069 -4.015 10.757 1.00 0.00 C ATOM 645 OE1 GLN A 43 9.871 -4.575 11.835 1.00 0.00 O ATOM 646 NE2 GLN A 43 11.272 -4.018 10.199 1.00 0.00 N ATOM 0 H GLN A 43 6.800 0.210 8.844 1.00 0.00 H new ATOM 0 HA GLN A 43 7.169 -2.325 9.073 1.00 0.00 H new ATOM 0 HB2 GLN A 43 8.541 -1.785 11.470 1.00 0.00 H new ATOM 0 HB3 GLN A 43 7.361 -3.080 11.452 1.00 0.00 H new ATOM 0 HG2 GLN A 43 8.360 -4.077 9.464 1.00 0.00 H new ATOM 0 HG3 GLN A 43 9.396 -2.686 9.215 1.00 0.00 H new ATOM 0 HE21 GLN A 43 11.421 -3.550 9.305 1.00 0.00 H new ATOM 0 HE22 GLN A 43 12.049 -4.489 10.664 1.00 0.00 H new ATOM 655 N LEU A 44 4.810 -2.638 10.071 1.00 0.00 N ATOM 656 CA LEU A 44 3.358 -2.713 10.383 1.00 0.00 C ATOM 657 C LEU A 44 3.104 -4.166 10.867 1.00 0.00 C ATOM 658 O LEU A 44 3.117 -5.099 10.057 1.00 0.00 O ATOM 659 CB LEU A 44 2.440 -2.347 9.172 1.00 0.00 C ATOM 660 CG LEU A 44 2.526 -0.903 8.606 1.00 0.00 C ATOM 661 CD1 LEU A 44 1.802 -0.757 7.258 1.00 0.00 C ATOM 662 CD2 LEU A 44 1.960 0.135 9.584 1.00 0.00 C ATOM 0 H LEU A 44 5.202 -3.520 9.741 1.00 0.00 H new ATOM 0 HA LEU A 44 3.103 -1.976 11.144 1.00 0.00 H new ATOM 0 HB2 LEU A 44 2.666 -3.039 8.360 1.00 0.00 H new ATOM 0 HB3 LEU A 44 1.407 -2.529 9.468 1.00 0.00 H new ATOM 0 HG LEU A 44 3.589 -0.715 8.458 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.892 0.271 6.906 1.00 0.00 H new ATOM 0 HD12 LEU A 44 2.251 -1.431 6.529 1.00 0.00 H new ATOM 0 HD13 LEU A 44 0.748 -1.007 7.382 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.041 1.130 9.146 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.912 -0.088 9.786 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.524 0.102 10.516 1.00 0.00 H new ATOM 674 N ILE A 45 2.875 -4.388 12.180 1.00 0.00 N ATOM 675 CA ILE A 45 2.635 -5.757 12.727 1.00 0.00 C ATOM 676 C ILE A 45 1.224 -6.281 12.297 1.00 0.00 C ATOM 677 O ILE A 45 0.225 -5.552 12.308 1.00 0.00 O ATOM 678 CB ILE A 45 2.967 -5.838 14.253 1.00 0.00 C ATOM 679 CG1 ILE A 45 3.221 -7.298 14.730 1.00 0.00 C ATOM 680 CG2 ILE A 45 1.900 -5.136 15.111 1.00 0.00 C ATOM 681 CD1 ILE A 45 3.889 -7.439 16.108 1.00 0.00 C ATOM 0 H ILE A 45 2.850 -3.648 12.882 1.00 0.00 H new ATOM 0 HA ILE A 45 3.337 -6.462 12.282 1.00 0.00 H new ATOM 0 HB ILE A 45 3.902 -5.297 14.394 1.00 0.00 H new ATOM 0 HG12 ILE A 45 2.267 -7.825 14.753 1.00 0.00 H new ATOM 0 HG13 ILE A 45 3.845 -7.800 13.990 1.00 0.00 H new ATOM 0 HG21 ILE A 45 2.170 -5.216 16.164 1.00 0.00 H new ATOM 0 HG22 ILE A 45 1.841 -4.084 14.830 1.00 0.00 H new ATOM 0 HG23 ILE A 45 0.932 -5.610 14.947 1.00 0.00 H new ATOM 0 HD11 ILE A 45 4.019 -8.495 16.343 1.00 0.00 H new ATOM 0 HD12 ILE A 45 4.862 -6.948 16.093 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.260 -6.974 16.867 1.00 0.00 H new ATOM 693 N GLY A 46 1.203 -7.553 11.886 1.00 0.00 N ATOM 694 CA GLY A 46 -0.005 -8.205 11.309 1.00 0.00 C ATOM 695 C GLY A 46 -0.608 -7.619 9.993 1.00 0.00 C ATOM 696 O GLY A 46 -1.779 -7.884 9.707 1.00 0.00 O ATOM 0 H GLY A 46 2.014 -8.169 11.938 1.00 0.00 H new ATOM 0 HA2 GLY A 46 0.238 -9.252 11.126 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -0.786 -8.188 12.069 1.00 0.00 H new ATOM 700 N PHE A 47 0.178 -6.859 9.198 1.00 0.00 N ATOM 701 CA PHE A 47 -0.313 -6.111 8.018 1.00 0.00 C ATOM 702 C PHE A 47 0.759 -5.804 6.924 1.00 0.00 C ATOM 703 O PHE A 47 0.389 -5.837 5.747 1.00 0.00 O ATOM 704 CB PHE A 47 -0.900 -4.766 8.548 1.00 0.00 C ATOM 705 CG PHE A 47 -1.731 -4.000 7.499 1.00 0.00 C ATOM 706 CD1 PHE A 47 -3.063 -4.344 7.250 1.00 0.00 C ATOM 707 CD2 PHE A 47 -1.082 -3.106 6.638 1.00 0.00 C ATOM 708 CE1 PHE A 47 -3.708 -3.846 6.121 1.00 0.00 C ATOM 709 CE2 PHE A 47 -1.731 -2.622 5.508 1.00 0.00 C ATOM 710 CZ PHE A 47 -3.033 -3.018 5.238 1.00 0.00 C ATOM 0 H PHE A 47 1.179 -6.746 9.358 1.00 0.00 H new ATOM 0 HA PHE A 47 -1.047 -6.744 7.519 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -1.526 -4.970 9.417 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -0.082 -4.130 8.886 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -3.590 -4.995 7.932 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -0.072 -2.791 6.853 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -4.739 -4.106 5.932 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -1.223 -1.940 4.842 1.00 0.00 H new ATOM 0 HZ PHE A 47 -3.522 -2.680 4.337 1.00 0.00 H new ATOM 720 N GLY A 48 2.003 -5.408 7.272 1.00 0.00 N ATOM 721 CA GLY A 48 2.993 -4.971 6.270 1.00 0.00 C ATOM 722 C GLY A 48 4.440 -4.716 6.722 1.00 0.00 C ATOM 723 O GLY A 48 4.785 -4.732 7.904 1.00 0.00 O ATOM 0 H GLY A 48 2.342 -5.383 8.234 1.00 0.00 H new ATOM 0 HA2 GLY A 48 3.021 -5.725 5.483 1.00 0.00 H new ATOM 0 HA3 GLY A 48 2.621 -4.051 5.818 1.00 0.00 H new ATOM 727 N ASN A 49 5.294 -4.488 5.712 1.00 0.00 N ATOM 728 CA ASN A 49 6.730 -4.166 5.908 1.00 0.00 C ATOM 729 C ASN A 49 7.176 -3.450 4.605 1.00 0.00 C ATOM 730 O ASN A 49 7.394 -4.105 3.579 1.00 0.00 O ATOM 731 CB ASN A 49 7.562 -5.450 6.227 1.00 0.00 C ATOM 732 CG ASN A 49 9.066 -5.281 6.543 1.00 0.00 C ATOM 733 OD1 ASN A 49 9.499 -5.447 7.682 1.00 0.00 O ATOM 734 ND2 ASN A 49 9.908 -5.007 5.557 1.00 0.00 N ATOM 0 H ASN A 49 5.015 -4.520 4.731 1.00 0.00 H new ATOM 0 HA ASN A 49 6.896 -3.518 6.769 1.00 0.00 H new ATOM 0 HB2 ASN A 49 7.096 -5.947 7.078 1.00 0.00 H new ATOM 0 HB3 ASN A 49 7.474 -6.125 5.376 1.00 0.00 H new ATOM 0 HD21 ASN A 49 10.908 -4.935 5.745 1.00 0.00 H new ATOM 0 HD22 ASN A 49 9.556 -4.868 4.610 1.00 0.00 H new ATOM 741 N PHE A 50 7.320 -2.111 4.643 1.00 0.00 N ATOM 742 CA PHE A 50 7.825 -1.344 3.473 1.00 0.00 C ATOM 743 C PHE A 50 9.367 -1.266 3.523 1.00 0.00 C ATOM 744 O PHE A 50 9.971 -1.097 4.592 1.00 0.00 O ATOM 745 CB PHE A 50 7.406 0.147 3.394 1.00 0.00 C ATOM 746 CG PHE A 50 5.958 0.561 3.283 1.00 0.00 C ATOM 747 CD1 PHE A 50 5.154 0.561 4.427 1.00 0.00 C ATOM 748 CD2 PHE A 50 5.531 1.232 2.131 1.00 0.00 C ATOM 749 CE1 PHE A 50 3.904 1.164 4.397 1.00 0.00 C ATOM 750 CE2 PHE A 50 4.283 1.834 2.106 1.00 0.00 C ATOM 751 CZ PHE A 50 3.461 1.754 3.224 1.00 0.00 C ATOM 0 H PHE A 50 7.099 -1.538 5.457 1.00 0.00 H new ATOM 0 HA PHE A 50 7.399 -1.888 2.630 1.00 0.00 H new ATOM 0 HB2 PHE A 50 7.806 0.635 4.283 1.00 0.00 H new ATOM 0 HB3 PHE A 50 7.923 0.575 2.535 1.00 0.00 H new ATOM 0 HD1 PHE A 50 5.506 0.092 5.334 1.00 0.00 H new ATOM 0 HD2 PHE A 50 6.173 1.280 1.264 1.00 0.00 H new ATOM 0 HE1 PHE A 50 3.282 1.173 5.280 1.00 0.00 H new ATOM 0 HE2 PHE A 50 3.951 2.362 1.224 1.00 0.00 H new ATOM 0 HZ PHE A 50 2.461 2.158 3.178 1.00 0.00 H new ATOM 761 N GLU A 51 9.975 -1.303 2.328 1.00 0.00 N ATOM 762 CA GLU A 51 11.430 -1.073 2.187 1.00 0.00 C ATOM 763 C GLU A 51 11.810 -0.633 0.757 1.00 0.00 C ATOM 764 O GLU A 51 11.117 -0.904 -0.226 1.00 0.00 O ATOM 765 CB GLU A 51 12.281 -2.272 2.724 1.00 0.00 C ATOM 766 CG GLU A 51 12.101 -3.666 2.069 1.00 0.00 C ATOM 767 CD GLU A 51 12.779 -3.841 0.706 1.00 0.00 C ATOM 768 OE1 GLU A 51 12.176 -3.792 -0.366 1.00 0.00 O ATOM 769 OE2 GLU A 51 14.128 -4.056 0.825 1.00 0.00 O ATOM 0 H GLU A 51 9.491 -1.488 1.449 1.00 0.00 H new ATOM 0 HA GLU A 51 11.686 -0.232 2.832 1.00 0.00 H new ATOM 0 HB2 GLU A 51 13.332 -1.998 2.634 1.00 0.00 H new ATOM 0 HB3 GLU A 51 12.069 -2.377 3.788 1.00 0.00 H new ATOM 0 HG2 GLU A 51 12.491 -4.422 2.750 1.00 0.00 H new ATOM 0 HG3 GLU A 51 11.035 -3.860 1.954 1.00 0.00 H new ATOM 777 N VAL A 52 12.963 0.045 0.656 1.00 0.00 N ATOM 778 CA VAL A 52 13.498 0.580 -0.602 1.00 0.00 C ATOM 779 C VAL A 52 14.318 -0.533 -1.355 1.00 0.00 C ATOM 780 O VAL A 52 14.699 -1.547 -0.754 1.00 0.00 O ATOM 781 CB VAL A 52 14.233 1.876 -0.081 1.00 0.00 C ATOM 782 CG1 VAL A 52 15.756 1.722 -0.065 1.00 0.00 C ATOM 783 CG2 VAL A 52 13.712 3.127 -0.801 1.00 0.00 C ATOM 0 H VAL A 52 13.559 0.239 1.461 1.00 0.00 H new ATOM 0 HA VAL A 52 12.803 0.860 -1.394 1.00 0.00 H new ATOM 0 HB VAL A 52 13.980 2.018 0.970 1.00 0.00 H new ATOM 0 HG11 VAL A 52 16.211 2.642 0.302 1.00 0.00 H new ATOM 0 HG12 VAL A 52 16.031 0.895 0.590 1.00 0.00 H new ATOM 0 HG13 VAL A 52 16.112 1.519 -1.075 1.00 0.00 H new ATOM 0 HG21 VAL A 52 14.234 4.007 -0.425 1.00 0.00 H new ATOM 0 HG22 VAL A 52 13.889 3.031 -1.872 1.00 0.00 H new ATOM 0 HG23 VAL A 52 12.643 3.233 -0.618 1.00 0.00 H new ATOM 793 N ARG A 53 14.645 -0.326 -2.650 1.00 0.00 N ATOM 794 CA ARG A 53 15.379 -1.344 -3.435 1.00 0.00 C ATOM 795 C ARG A 53 16.541 -0.668 -4.207 1.00 0.00 C ATOM 796 O ARG A 53 16.300 -0.047 -5.244 1.00 0.00 O ATOM 797 CB ARG A 53 14.343 -1.983 -4.401 1.00 0.00 C ATOM 798 CG ARG A 53 14.654 -3.421 -4.875 1.00 0.00 C ATOM 799 CD ARG A 53 14.178 -4.562 -3.944 1.00 0.00 C ATOM 800 NE ARG A 53 14.843 -4.633 -2.616 1.00 0.00 N ATOM 801 CZ ARG A 53 16.070 -5.142 -2.386 1.00 0.00 C ATOM 802 NH1 ARG A 53 16.852 -5.657 -3.333 1.00 0.00 N ATOM 803 NH2 ARG A 53 16.527 -5.123 -1.148 1.00 0.00 N ATOM 0 H ARG A 53 14.417 0.523 -3.167 1.00 0.00 H new ATOM 0 HA ARG A 53 15.823 -2.111 -2.801 1.00 0.00 H new ATOM 0 HB2 ARG A 53 13.371 -1.987 -3.908 1.00 0.00 H new ATOM 0 HB3 ARG A 53 14.253 -1.344 -5.279 1.00 0.00 H new ATOM 0 HG2 ARG A 53 14.199 -3.565 -5.855 1.00 0.00 H new ATOM 0 HG3 ARG A 53 15.732 -3.513 -5.007 1.00 0.00 H new ATOM 0 HD2 ARG A 53 13.105 -4.453 -3.787 1.00 0.00 H new ATOM 0 HD3 ARG A 53 14.330 -5.512 -4.457 1.00 0.00 H new ATOM 0 HE ARG A 53 14.329 -4.267 -1.814 1.00 0.00 H new ATOM 0 HH11 ARG A 53 16.532 -5.682 -4.301 1.00 0.00 H new ATOM 0 HH12 ARG A 53 17.771 -6.026 -3.090 1.00 0.00 H new ATOM 0 HH21 ARG A 53 15.956 -4.731 -0.399 1.00 0.00 H new ATOM 0 HH22 ARG A 53 17.452 -5.500 -0.940 1.00 0.00 H new ATOM 1134 N LYS A 75 16.414 4.010 -5.525 1.00 0.00 N ATOM 1135 CA LYS A 75 16.036 3.216 -4.325 1.00 0.00 C ATOM 1136 C LYS A 75 14.497 3.067 -4.450 1.00 0.00 C ATOM 1137 O LYS A 75 13.735 4.022 -4.272 1.00 0.00 O ATOM 1138 CB LYS A 75 16.447 3.792 -2.964 1.00 0.00 C ATOM 1139 CG LYS A 75 17.848 4.435 -2.847 1.00 0.00 C ATOM 1140 CD LYS A 75 18.188 4.976 -1.439 1.00 0.00 C ATOM 1141 CE LYS A 75 17.339 6.159 -0.919 1.00 0.00 C ATOM 1142 NZ LYS A 75 17.484 7.386 -1.725 1.00 0.00 N ATOM 0 HA LYS A 75 16.582 2.272 -4.325 1.00 0.00 H new ATOM 0 HB2 LYS A 75 15.709 4.543 -2.681 1.00 0.00 H new ATOM 0 HB3 LYS A 75 16.384 2.990 -2.228 1.00 0.00 H new ATOM 0 HG2 LYS A 75 18.598 3.696 -3.130 1.00 0.00 H new ATOM 0 HG3 LYS A 75 17.920 5.253 -3.564 1.00 0.00 H new ATOM 0 HD2 LYS A 75 18.096 4.154 -0.729 1.00 0.00 H new ATOM 0 HD3 LYS A 75 19.234 5.283 -1.437 1.00 0.00 H new ATOM 0 HE2 LYS A 75 16.290 5.865 -0.905 1.00 0.00 H new ATOM 0 HE3 LYS A 75 17.623 6.375 0.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 17.058 8.187 -1.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 18.493 7.577 -1.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 17.003 7.260 -2.638 1.00 0.00 H new ATOM 1155 N VAL A 76 14.082 1.844 -4.785 1.00 0.00 N ATOM 1156 CA VAL A 76 12.737 1.542 -5.313 1.00 0.00 C ATOM 1157 C VAL A 76 11.734 1.128 -4.213 1.00 0.00 C ATOM 1158 O VAL A 76 11.908 0.062 -3.621 1.00 0.00 O ATOM 1159 CB VAL A 76 12.717 0.744 -6.654 1.00 0.00 C ATOM 1160 CG1 VAL A 76 13.911 1.113 -7.533 1.00 0.00 C ATOM 1161 CG2 VAL A 76 12.529 -0.770 -6.767 1.00 0.00 C ATOM 0 H VAL A 76 14.675 1.018 -4.698 1.00 0.00 H new ATOM 0 HA VAL A 76 12.326 2.490 -5.660 1.00 0.00 H new ATOM 0 HB VAL A 76 11.731 1.092 -6.963 1.00 0.00 H new ATOM 0 HG11 VAL A 76 13.871 0.541 -8.460 1.00 0.00 H new ATOM 0 HG12 VAL A 76 13.879 2.178 -7.762 1.00 0.00 H new ATOM 0 HG13 VAL A 76 14.836 0.883 -7.005 1.00 0.00 H new ATOM 0 HG21 VAL A 76 12.556 -1.063 -7.817 1.00 0.00 H new ATOM 0 HG22 VAL A 76 13.329 -1.277 -6.228 1.00 0.00 H new ATOM 0 HG23 VAL A 76 11.567 -1.050 -6.337 1.00 0.00 H new ATOM 1171 N PRO A 77 10.667 1.909 -3.913 1.00 0.00 N ATOM 1172 CA PRO A 77 9.795 1.631 -2.764 1.00 0.00 C ATOM 1173 C PRO A 77 8.750 0.527 -3.008 1.00 0.00 C ATOM 1174 O PRO A 77 8.027 0.471 -4.008 1.00 0.00 O ATOM 1175 CB PRO A 77 9.170 3.005 -2.518 1.00 0.00 C ATOM 1176 CG PRO A 77 9.083 3.662 -3.899 1.00 0.00 C ATOM 1177 CD PRO A 77 10.316 3.145 -4.635 1.00 0.00 C ATOM 0 HA PRO A 77 10.336 1.225 -1.909 1.00 0.00 H new ATOM 0 HB2 PRO A 77 8.184 2.913 -2.063 1.00 0.00 H new ATOM 0 HB3 PRO A 77 9.780 3.599 -1.838 1.00 0.00 H new ATOM 0 HG2 PRO A 77 8.164 3.384 -4.416 1.00 0.00 H new ATOM 0 HG3 PRO A 77 9.090 4.749 -3.824 1.00 0.00 H new ATOM 0 HD2 PRO A 77 10.101 2.947 -5.685 1.00 0.00 H new ATOM 0 HD3 PRO A 77 11.131 3.869 -4.608 1.00 0.00 H new ATOM 1185 N ALA A 78 8.735 -0.326 -1.994 1.00 0.00 N ATOM 1186 CA ALA A 78 7.918 -1.539 -1.943 1.00 0.00 C ATOM 1187 C ALA A 78 7.117 -1.593 -0.614 1.00 0.00 C ATOM 1188 O ALA A 78 7.388 -0.887 0.361 1.00 0.00 O ATOM 1189 CB ALA A 78 8.961 -2.662 -2.090 1.00 0.00 C ATOM 0 H ALA A 78 9.305 -0.193 -1.159 1.00 0.00 H new ATOM 0 HA ALA A 78 7.152 -1.608 -2.715 1.00 0.00 H new ATOM 0 HB1 ALA A 78 8.460 -3.630 -2.066 1.00 0.00 H new ATOM 0 HB2 ALA A 78 9.486 -2.549 -3.039 1.00 0.00 H new ATOM 0 HB3 ALA A 78 9.677 -2.603 -1.270 1.00 0.00 H new ATOM 1195 N PHE A 79 6.099 -2.454 -0.637 1.00 0.00 N ATOM 1196 CA PHE A 79 5.197 -2.733 0.514 1.00 0.00 C ATOM 1197 C PHE A 79 4.924 -4.269 0.420 1.00 0.00 C ATOM 1198 O PHE A 79 4.433 -4.812 -0.576 1.00 0.00 O ATOM 1199 CB PHE A 79 3.906 -1.881 0.518 1.00 0.00 C ATOM 1200 CG PHE A 79 2.725 -2.390 1.391 1.00 0.00 C ATOM 1201 CD1 PHE A 79 1.800 -3.295 0.846 1.00 0.00 C ATOM 1202 CD2 PHE A 79 2.586 -2.004 2.727 1.00 0.00 C ATOM 1203 CE1 PHE A 79 0.756 -3.793 1.617 1.00 0.00 C ATOM 1204 CE2 PHE A 79 1.538 -2.503 3.498 1.00 0.00 C ATOM 1205 CZ PHE A 79 0.631 -3.403 2.944 1.00 0.00 C ATOM 0 H PHE A 79 5.862 -2.996 -1.468 1.00 0.00 H new ATOM 0 HA PHE A 79 5.657 -2.454 1.462 1.00 0.00 H new ATOM 0 HB2 PHE A 79 4.165 -0.876 0.852 1.00 0.00 H new ATOM 0 HB3 PHE A 79 3.554 -1.795 -0.510 1.00 0.00 H new ATOM 0 HD1 PHE A 79 1.901 -3.607 -0.183 1.00 0.00 H new ATOM 0 HD2 PHE A 79 3.294 -1.316 3.164 1.00 0.00 H new ATOM 0 HE1 PHE A 79 0.044 -4.481 1.185 1.00 0.00 H new ATOM 0 HE2 PHE A 79 1.429 -2.191 4.526 1.00 0.00 H new ATOM 0 HZ PHE A 79 -0.172 -3.799 3.548 1.00 0.00 H new ATOM 1215 N LYS A 80 5.204 -4.907 1.544 1.00 0.00 N ATOM 1216 CA LYS A 80 4.829 -6.328 1.824 1.00 0.00 C ATOM 1217 C LYS A 80 3.413 -6.343 2.455 1.00 0.00 C ATOM 1218 O LYS A 80 3.120 -5.439 3.242 1.00 0.00 O ATOM 1219 CB LYS A 80 5.851 -6.969 2.800 1.00 0.00 C ATOM 1220 CG LYS A 80 7.173 -7.395 2.115 1.00 0.00 C ATOM 1221 CD LYS A 80 8.279 -7.958 3.035 1.00 0.00 C ATOM 1222 CE LYS A 80 8.002 -9.311 3.726 1.00 0.00 C ATOM 1223 NZ LYS A 80 7.165 -9.200 4.937 1.00 0.00 N ATOM 0 H LYS A 80 5.706 -4.466 2.315 1.00 0.00 H new ATOM 0 HA LYS A 80 4.833 -6.903 0.898 1.00 0.00 H new ATOM 0 HB2 LYS A 80 6.076 -6.260 3.596 1.00 0.00 H new ATOM 0 HB3 LYS A 80 5.396 -7.841 3.269 1.00 0.00 H new ATOM 0 HG2 LYS A 80 6.939 -8.148 1.363 1.00 0.00 H new ATOM 0 HG3 LYS A 80 7.576 -6.531 1.586 1.00 0.00 H new ATOM 0 HD2 LYS A 80 9.190 -8.060 2.445 1.00 0.00 H new ATOM 0 HD3 LYS A 80 8.483 -7.219 3.810 1.00 0.00 H new ATOM 0 HE2 LYS A 80 7.512 -9.977 3.016 1.00 0.00 H new ATOM 0 HE3 LYS A 80 8.952 -9.773 3.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 7.686 -9.576 5.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 6.930 -8.201 5.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 6.289 -9.745 4.805 1.00 0.00 H new ATOM 1236 N PRO A 81 2.498 -7.319 2.180 1.00 0.00 N ATOM 1237 CA PRO A 81 1.262 -7.478 2.992 1.00 0.00 C ATOM 1238 C PRO A 81 1.518 -8.251 4.340 1.00 0.00 C ATOM 1239 O PRO A 81 0.629 -8.944 4.835 1.00 0.00 O ATOM 1240 CB PRO A 81 0.370 -8.227 1.979 1.00 0.00 C ATOM 1241 CG PRO A 81 1.320 -9.103 1.159 1.00 0.00 C ATOM 1242 CD PRO A 81 2.606 -8.282 1.066 1.00 0.00 C ATOM 0 HA PRO A 81 0.819 -6.553 3.361 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -0.379 -8.833 2.490 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -0.168 -7.528 1.339 1.00 0.00 H new ATOM 0 HG2 PRO A 81 1.495 -10.063 1.645 1.00 0.00 H new ATOM 0 HG3 PRO A 81 0.912 -9.316 0.171 1.00 0.00 H new ATOM 0 HD2 PRO A 81 3.490 -8.912 1.168 1.00 0.00 H new ATOM 0 HD3 PRO A 81 2.686 -7.773 0.105 1.00 0.00 H new ATOM 1250 N GLY A 82 2.727 -8.117 4.939 1.00 0.00 N ATOM 1251 CA GLY A 82 3.179 -8.835 6.152 1.00 0.00 C ATOM 1252 C GLY A 82 2.943 -10.354 6.269 1.00 0.00 C ATOM 1253 O GLY A 82 3.079 -10.860 7.385 1.00 0.00 O ATOM 0 H GLY A 82 3.438 -7.482 4.576 1.00 0.00 H new ATOM 0 HA2 GLY A 82 4.251 -8.663 6.253 1.00 0.00 H new ATOM 0 HA3 GLY A 82 2.698 -8.363 7.009 1.00 0.00 H new ATOM 1257 N LYS A 83 2.587 -11.046 5.153 1.00 0.00 N ATOM 1258 CA LYS A 83 2.047 -12.455 5.159 1.00 0.00 C ATOM 1259 C LYS A 83 0.596 -12.593 5.742 1.00 0.00 C ATOM 1260 O LYS A 83 -0.309 -13.186 5.154 1.00 0.00 O ATOM 1261 CB LYS A 83 3.003 -13.505 5.800 1.00 0.00 C ATOM 1262 CG LYS A 83 3.818 -14.316 4.773 1.00 0.00 C ATOM 1263 CD LYS A 83 4.793 -15.317 5.432 1.00 0.00 C ATOM 1264 CE LYS A 83 5.611 -16.169 4.442 1.00 0.00 C ATOM 1265 NZ LYS A 83 6.630 -15.395 3.706 1.00 0.00 N ATOM 0 H LYS A 83 2.663 -10.651 4.216 1.00 0.00 H new ATOM 0 HA LYS A 83 1.983 -12.690 4.096 1.00 0.00 H new ATOM 0 HB2 LYS A 83 3.691 -12.993 6.472 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.416 -14.193 6.408 1.00 0.00 H new ATOM 0 HG2 LYS A 83 3.134 -14.859 4.121 1.00 0.00 H new ATOM 0 HG3 LYS A 83 4.382 -13.630 4.141 1.00 0.00 H new ATOM 0 HD2 LYS A 83 5.483 -14.764 6.070 1.00 0.00 H new ATOM 0 HD3 LYS A 83 4.224 -15.984 6.080 1.00 0.00 H new ATOM 0 HE2 LYS A 83 6.101 -16.975 4.987 1.00 0.00 H new ATOM 0 HE3 LYS A 83 4.932 -16.634 3.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 7.144 -16.026 3.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 6.166 -14.641 3.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 7.299 -14.972 4.381 1.00 0.00 H new ATOM 1278 N ALA A 84 0.470 -12.061 6.952 1.00 0.00 N ATOM 1279 CA ALA A 84 -0.741 -11.905 7.772 1.00 0.00 C ATOM 1280 C ALA A 84 -1.971 -11.260 7.097 1.00 0.00 C ATOM 1281 O ALA A 84 -3.086 -11.778 7.243 1.00 0.00 O ATOM 1282 CB ALA A 84 -0.222 -10.978 8.874 1.00 0.00 C ATOM 0 H ALA A 84 1.288 -11.690 7.436 1.00 0.00 H new ATOM 0 HA ALA A 84 -1.130 -12.880 8.064 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -1.026 -10.765 9.579 1.00 0.00 H new ATOM 0 HB2 ALA A 84 0.602 -11.462 9.399 1.00 0.00 H new ATOM 0 HB3 ALA A 84 0.128 -10.046 8.430 1.00 0.00 H new ATOM 1288 N LEU A 85 -1.782 -10.137 6.357 1.00 0.00 N ATOM 1289 CA LEU A 85 -2.838 -9.576 5.512 1.00 0.00 C ATOM 1290 C LEU A 85 -3.267 -10.627 4.447 1.00 0.00 C ATOM 1291 O LEU A 85 -4.465 -10.849 4.365 1.00 0.00 O ATOM 1292 CB LEU A 85 -2.440 -8.206 4.912 1.00 0.00 C ATOM 1293 CG LEU A 85 -3.566 -7.602 4.066 1.00 0.00 C ATOM 1294 CD1 LEU A 85 -4.794 -7.173 4.872 1.00 0.00 C ATOM 1295 CD2 LEU A 85 -3.041 -6.442 3.199 1.00 0.00 C ATOM 0 H LEU A 85 -0.907 -9.613 6.337 1.00 0.00 H new ATOM 0 HA LEU A 85 -3.712 -9.361 6.127 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -2.183 -7.518 5.718 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -1.548 -8.325 4.297 1.00 0.00 H new ATOM 0 HG LEU A 85 -3.910 -8.407 3.416 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -5.543 -6.756 4.199 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -5.211 -8.038 5.388 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -4.504 -6.419 5.603 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -3.859 -6.030 2.608 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -2.631 -5.664 3.842 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -2.261 -6.810 2.532 1.00 0.00 H new ATOM 1307 N LYS A 86 -2.362 -11.291 3.693 1.00 0.00 N ATOM 1308 CA LYS A 86 -2.737 -12.423 2.785 1.00 0.00 C ATOM 1309 C LYS A 86 -3.726 -13.445 3.447 1.00 0.00 C ATOM 1310 O LYS A 86 -4.698 -13.812 2.800 1.00 0.00 O ATOM 1311 CB LYS A 86 -1.471 -13.096 2.172 1.00 0.00 C ATOM 1312 CG LYS A 86 -1.596 -13.612 0.718 1.00 0.00 C ATOM 1313 CD LYS A 86 -2.422 -14.897 0.503 1.00 0.00 C ATOM 1314 CE LYS A 86 -2.512 -15.288 -0.983 1.00 0.00 C ATOM 1315 NZ LYS A 86 -3.257 -16.542 -1.180 1.00 0.00 N ATOM 0 H LYS A 86 -1.366 -11.071 3.688 1.00 0.00 H new ATOM 0 HA LYS A 86 -3.301 -11.995 1.956 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -0.652 -12.378 2.210 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -1.189 -13.935 2.808 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -2.037 -12.820 0.113 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -0.592 -13.786 0.332 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -1.972 -15.715 1.066 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -3.427 -14.752 0.900 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -2.998 -14.487 -1.540 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -1.507 -15.396 -1.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -3.110 -16.885 -2.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -2.918 -17.257 -0.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -4.271 -16.372 -1.023 1.00 0.00 H new ATOM 1328 N ASP A 87 -3.554 -13.784 4.745 1.00 0.00 N ATOM 1329 CA ASP A 87 -4.510 -14.588 5.548 1.00 0.00 C ATOM 1330 C ASP A 87 -5.923 -13.950 5.750 1.00 0.00 C ATOM 1331 O ASP A 87 -6.913 -14.683 5.699 1.00 0.00 O ATOM 1332 CB ASP A 87 -3.799 -14.857 6.899 1.00 0.00 C ATOM 1333 CG ASP A 87 -3.773 -16.335 7.299 1.00 0.00 C ATOM 1334 OD1 ASP A 87 -2.807 -17.072 7.109 1.00 0.00 O ATOM 1335 OD2 ASP A 87 -4.950 -16.733 7.882 1.00 0.00 O ATOM 0 H ASP A 87 -2.731 -13.502 5.276 1.00 0.00 H new ATOM 0 HA ASP A 87 -4.744 -15.504 5.005 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -2.775 -14.488 6.840 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -4.299 -14.287 7.682 1.00 0.00 H new ATOM 1341 N ALA A 88 -6.031 -12.618 5.988 1.00 0.00 N ATOM 1342 CA ALA A 88 -7.341 -11.893 5.932 1.00 0.00 C ATOM 1343 C ALA A 88 -8.151 -12.099 4.622 1.00 0.00 C ATOM 1344 O ALA A 88 -9.374 -12.264 4.658 1.00 0.00 O ATOM 1345 CB ALA A 88 -7.165 -10.345 5.962 1.00 0.00 C ATOM 0 H ALA A 88 -5.237 -12.022 6.220 1.00 0.00 H new ATOM 0 HA ALA A 88 -7.855 -12.309 6.799 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -8.144 -9.867 5.919 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -6.659 -10.054 6.882 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -6.569 -10.030 5.105 1.00 0.00 H new ATOM 1351 N VAL A 89 -7.431 -12.054 3.486 1.00 0.00 N ATOM 1352 CA VAL A 89 -8.023 -11.897 2.156 1.00 0.00 C ATOM 1353 C VAL A 89 -7.687 -13.053 1.156 1.00 0.00 C ATOM 1354 O VAL A 89 -7.852 -12.864 -0.052 1.00 0.00 O ATOM 1355 CB VAL A 89 -7.578 -10.417 1.837 1.00 0.00 C ATOM 1356 CG1 VAL A 89 -6.119 -10.006 2.096 1.00 0.00 C ATOM 1357 CG2 VAL A 89 -7.734 -10.042 0.401 1.00 0.00 C ATOM 0 H VAL A 89 -6.414 -12.127 3.471 1.00 0.00 H new ATOM 0 HA VAL A 89 -9.104 -12.007 2.075 1.00 0.00 H new ATOM 0 HB VAL A 89 -8.246 -9.919 2.540 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -5.982 -8.959 1.824 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -5.885 -10.140 3.152 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -5.454 -10.627 1.496 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -7.409 -9.012 0.257 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -7.127 -10.704 -0.216 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -8.781 -10.136 0.112 1.00 0.00 H new ATOM 1367 N LYS A 90 -7.329 -14.273 1.616 1.00 0.00 N ATOM 1368 CA LYS A 90 -6.880 -15.354 0.712 1.00 0.00 C ATOM 1369 C LYS A 90 -8.019 -15.977 -0.122 1.00 0.00 C ATOM 1370 O LYS A 90 -8.381 -15.479 -1.187 1.00 0.00 O ATOM 1371 CB LYS A 90 -6.057 -16.416 1.492 1.00 0.00 C ATOM 1372 CG LYS A 90 -6.758 -17.576 2.245 1.00 0.00 C ATOM 1373 CD LYS A 90 -7.457 -17.151 3.552 1.00 0.00 C ATOM 1374 CE LYS A 90 -8.098 -18.293 4.362 1.00 0.00 C ATOM 1375 NZ LYS A 90 -7.108 -19.182 5.001 1.00 0.00 N ATOM 0 H LYS A 90 -7.342 -14.532 2.602 1.00 0.00 H new ATOM 0 HA LYS A 90 -6.221 -14.895 -0.025 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -5.366 -16.869 0.781 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -5.455 -15.878 2.224 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -7.495 -18.031 1.583 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -6.019 -18.344 2.474 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -6.729 -16.644 4.185 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -8.230 -16.422 3.310 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -8.743 -17.867 5.131 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -8.735 -18.884 3.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -7.602 -19.929 5.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -6.508 -19.615 4.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -6.516 -18.630 5.653 1.00 0.00 H new ATOM 1389 N MET B 1 6.187 2.220 10.714 1.00 0.00 N ATOM 1390 CA MET B 1 7.143 2.194 11.827 1.00 0.00 C ATOM 1391 C MET B 1 6.517 1.281 12.939 1.00 0.00 C ATOM 1392 O MET B 1 5.737 1.729 13.762 1.00 0.00 O ATOM 1393 CB MET B 1 7.455 3.688 12.148 1.00 0.00 C ATOM 1394 CG MET B 1 8.862 4.179 11.770 1.00 0.00 C ATOM 1395 SD MET B 1 9.157 4.100 9.991 1.00 0.00 S ATOM 1396 CE MET B 1 8.071 5.385 9.342 1.00 0.00 C ATOM 0 H1 MET B 1 6.604 2.731 9.910 1.00 0.00 H new ATOM 0 H2 MET B 1 5.963 1.246 10.426 1.00 0.00 H new ATOM 0 H3 MET B 1 5.316 2.701 11.016 1.00 0.00 H new ATOM 0 HA MET B 1 8.119 1.742 11.648 1.00 0.00 H new ATOM 0 HB2 MET B 1 6.724 4.310 11.632 1.00 0.00 H new ATOM 0 HB3 MET B 1 7.311 3.847 13.217 1.00 0.00 H new ATOM 0 HG2 MET B 1 8.991 5.206 12.113 1.00 0.00 H new ATOM 0 HG3 MET B 1 9.607 3.574 12.287 1.00 0.00 H new ATOM 0 HE1 MET B 1 8.341 5.602 8.308 1.00 0.00 H new ATOM 0 HE2 MET B 1 7.037 5.042 9.383 1.00 0.00 H new ATOM 0 HE3 MET B 1 8.178 6.289 9.942 1.00 0.00 H new ATOM 1407 N ASN B 2 6.855 -0.021 12.923 1.00 0.00 N ATOM 1408 CA ASN B 2 6.291 -1.191 13.706 1.00 0.00 C ATOM 1409 C ASN B 2 4.871 -1.217 14.309 1.00 0.00 C ATOM 1410 O ASN B 2 4.533 -1.882 15.294 1.00 0.00 O ATOM 1411 CB ASN B 2 7.336 -1.893 14.582 1.00 0.00 C ATOM 1412 CG ASN B 2 8.094 -1.048 15.618 1.00 0.00 C ATOM 1413 OD1 ASN B 2 9.139 -0.470 15.323 1.00 0.00 O ATOM 1414 ND2 ASN B 2 7.596 -0.973 16.841 1.00 0.00 N ATOM 0 H ASN B 2 7.604 -0.337 12.307 1.00 0.00 H new ATOM 0 HA ASN B 2 6.028 -1.777 12.826 1.00 0.00 H new ATOM 0 HB2 ASN B 2 6.837 -2.703 15.113 1.00 0.00 H new ATOM 0 HB3 ASN B 2 8.072 -2.351 13.921 1.00 0.00 H new ATOM 0 HD21 ASN B 2 8.080 -0.430 17.556 1.00 0.00 H new ATOM 0 HD22 ASN B 2 6.728 -1.458 17.069 1.00 0.00 H new ATOM 1421 N LYS B 3 4.067 -0.459 13.590 1.00 0.00 N ATOM 1422 CA LYS B 3 2.700 -0.030 13.998 1.00 0.00 C ATOM 1423 C LYS B 3 2.569 0.763 15.348 1.00 0.00 C ATOM 1424 O LYS B 3 1.477 1.222 15.688 1.00 0.00 O ATOM 1425 CB LYS B 3 1.724 -1.231 13.863 1.00 0.00 C ATOM 1426 CG LYS B 3 0.284 -0.855 13.453 1.00 0.00 C ATOM 1427 CD LYS B 3 -0.635 -2.049 13.109 1.00 0.00 C ATOM 1428 CE LYS B 3 -1.205 -2.831 14.309 1.00 0.00 C ATOM 1429 NZ LYS B 3 -2.247 -2.084 15.041 1.00 0.00 N ATOM 0 H LYS B 3 4.335 -0.102 12.673 1.00 0.00 H new ATOM 0 HA LYS B 3 2.410 0.753 13.297 1.00 0.00 H new ATOM 0 HB2 LYS B 3 2.126 -1.926 13.126 1.00 0.00 H new ATOM 0 HB3 LYS B 3 1.689 -1.761 14.815 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -0.172 -0.288 14.265 1.00 0.00 H new ATOM 0 HG3 LYS B 3 0.331 -0.192 12.589 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -1.469 -1.680 12.512 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -0.076 -2.743 12.481 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -1.622 -3.774 13.956 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -0.394 -3.078 14.994 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -2.592 -2.659 15.836 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -1.847 -1.196 15.404 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -3.037 -1.871 14.399 1.00 0.00 H new ATOM 1442 N THR B 4 3.694 0.953 16.062 1.00 0.00 N ATOM 1443 CA THR B 4 3.829 1.600 17.352 1.00 0.00 C ATOM 1444 C THR B 4 4.845 2.772 17.266 1.00 0.00 C ATOM 1445 O THR B 4 4.547 3.838 17.824 1.00 0.00 O ATOM 1446 CB THR B 4 4.225 0.437 18.285 1.00 0.00 C ATOM 1447 OG1 THR B 4 3.168 -0.515 18.419 1.00 0.00 O ATOM 1448 CG2 THR B 4 4.527 0.984 19.648 1.00 0.00 C ATOM 0 H THR B 4 4.595 0.627 15.712 1.00 0.00 H new ATOM 0 HA THR B 4 2.930 2.090 17.726 1.00 0.00 H new ATOM 0 HB THR B 4 5.094 -0.057 17.850 1.00 0.00 H new ATOM 0 HG1 THR B 4 3.453 -1.239 19.015 1.00 0.00 H new ATOM 0 HG21 THR B 4 4.808 0.168 20.314 1.00 0.00 H new ATOM 0 HG22 THR B 4 5.349 1.696 19.580 1.00 0.00 H new ATOM 0 HG23 THR B 4 3.644 1.486 20.042 1.00 0.00 H new ATOM 1456 N GLU B 5 6.028 2.613 16.604 1.00 0.00 N ATOM 1457 CA GLU B 5 6.822 3.814 16.200 1.00 0.00 C ATOM 1458 C GLU B 5 5.970 4.748 15.230 1.00 0.00 C ATOM 1459 O GLU B 5 6.252 5.943 15.121 1.00 0.00 O ATOM 1460 CB GLU B 5 8.195 3.374 15.620 1.00 0.00 C ATOM 1461 CG GLU B 5 9.152 2.562 16.510 1.00 0.00 C ATOM 1462 CD GLU B 5 9.700 3.322 17.721 1.00 0.00 C ATOM 1463 OE1 GLU B 5 9.163 3.307 18.828 1.00 0.00 O ATOM 1464 OE2 GLU B 5 10.844 4.016 17.423 1.00 0.00 O ATOM 0 H GLU B 5 6.437 1.714 16.349 1.00 0.00 H new ATOM 0 HA GLU B 5 7.045 4.427 17.073 1.00 0.00 H new ATOM 0 HB2 GLU B 5 8.001 2.786 14.723 1.00 0.00 H new ATOM 0 HB3 GLU B 5 8.723 4.274 15.304 1.00 0.00 H new ATOM 0 HG2 GLU B 5 8.631 1.672 16.862 1.00 0.00 H new ATOM 0 HG3 GLU B 5 9.990 2.221 15.902 1.00 0.00 H new ATOM 1472 N LEU B 6 4.912 4.179 14.572 1.00 0.00 N ATOM 1473 CA LEU B 6 3.833 4.889 13.872 1.00 0.00 C ATOM 1474 C LEU B 6 3.066 5.817 14.831 1.00 0.00 C ATOM 1475 O LEU B 6 3.034 7.005 14.563 1.00 0.00 O ATOM 1476 CB LEU B 6 2.840 3.860 13.230 1.00 0.00 C ATOM 1477 CG LEU B 6 2.377 4.151 11.796 1.00 0.00 C ATOM 1478 CD1 LEU B 6 1.437 3.053 11.290 1.00 0.00 C ATOM 1479 CD2 LEU B 6 1.772 5.559 11.665 1.00 0.00 C ATOM 0 H LEU B 6 4.799 3.166 14.523 1.00 0.00 H new ATOM 0 HA LEU B 6 4.284 5.498 13.089 1.00 0.00 H new ATOM 0 HB2 LEU B 6 3.313 2.878 13.242 1.00 0.00 H new ATOM 0 HB3 LEU B 6 1.957 3.797 13.866 1.00 0.00 H new ATOM 0 HG LEU B 6 3.255 4.140 11.150 1.00 0.00 H new ATOM 0 HD11 LEU B 6 1.123 3.283 10.272 1.00 0.00 H new ATOM 0 HD12 LEU B 6 1.957 2.095 11.302 1.00 0.00 H new ATOM 0 HD13 LEU B 6 0.561 2.998 11.936 1.00 0.00 H new ATOM 0 HD21 LEU B 6 1.457 5.725 10.635 1.00 0.00 H new ATOM 0 HD22 LEU B 6 0.911 5.648 12.327 1.00 0.00 H new ATOM 0 HD23 LEU B 6 2.519 6.303 11.940 1.00 0.00 H new ATOM 1491 N ILE B 7 2.516 5.292 15.944 1.00 0.00 N ATOM 1492 CA ILE B 7 1.757 6.051 16.980 1.00 0.00 C ATOM 1493 C ILE B 7 2.517 7.314 17.464 1.00 0.00 C ATOM 1494 O ILE B 7 1.929 8.399 17.479 1.00 0.00 O ATOM 1495 CB ILE B 7 1.346 5.119 18.178 1.00 0.00 C ATOM 1496 CG1 ILE B 7 0.665 3.802 17.709 1.00 0.00 C ATOM 1497 CG2 ILE B 7 0.441 5.841 19.204 1.00 0.00 C ATOM 1498 CD1 ILE B 7 0.620 2.659 18.720 1.00 0.00 C ATOM 0 H ILE B 7 2.585 4.298 16.161 1.00 0.00 H new ATOM 0 HA ILE B 7 0.841 6.408 16.509 1.00 0.00 H new ATOM 0 HB ILE B 7 2.283 4.858 18.670 1.00 0.00 H new ATOM 0 HG12 ILE B 7 -0.358 4.034 17.411 1.00 0.00 H new ATOM 0 HG13 ILE B 7 1.184 3.449 16.818 1.00 0.00 H new ATOM 0 HG21 ILE B 7 0.186 5.154 20.011 1.00 0.00 H new ATOM 0 HG22 ILE B 7 0.970 6.701 19.614 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -0.471 6.177 18.711 1.00 0.00 H new ATOM 0 HD11 ILE B 7 0.121 1.798 18.274 1.00 0.00 H new ATOM 0 HD12 ILE B 7 1.636 2.383 19.003 1.00 0.00 H new ATOM 0 HD13 ILE B 7 0.071 2.978 19.606 1.00 0.00 H new ATOM 1510 N ASN B 8 3.809 7.161 17.822 1.00 0.00 N ATOM 1511 CA ASN B 8 4.650 8.341 18.182 1.00 0.00 C ATOM 1512 C ASN B 8 4.982 9.328 17.011 1.00 0.00 C ATOM 1513 O ASN B 8 5.281 10.491 17.292 1.00 0.00 O ATOM 1514 CB ASN B 8 5.932 7.903 18.942 1.00 0.00 C ATOM 1515 CG ASN B 8 5.697 7.196 20.294 1.00 0.00 C ATOM 1516 OD1 ASN B 8 5.273 7.811 21.273 1.00 0.00 O ATOM 1517 ND2 ASN B 8 5.960 5.900 20.374 1.00 0.00 N ATOM 0 H ASN B 8 4.290 6.263 17.872 1.00 0.00 H new ATOM 0 HA ASN B 8 4.019 8.930 18.847 1.00 0.00 H new ATOM 0 HB2 ASN B 8 6.504 7.235 18.298 1.00 0.00 H new ATOM 0 HB3 ASN B 8 6.549 8.785 19.116 1.00 0.00 H new ATOM 0 HD21 ASN B 8 5.812 5.403 21.252 1.00 0.00 H new ATOM 0 HD22 ASN B 8 6.311 5.399 19.557 1.00 0.00 H new ATOM 1524 N ALA B 9 4.916 8.900 15.732 1.00 0.00 N ATOM 1525 CA ALA B 9 4.987 9.813 14.560 1.00 0.00 C ATOM 1526 C ALA B 9 3.759 10.724 14.399 1.00 0.00 C ATOM 1527 O ALA B 9 3.906 11.916 14.141 1.00 0.00 O ATOM 1528 CB ALA B 9 5.005 8.999 13.241 1.00 0.00 C ATOM 0 H ALA B 9 4.812 7.917 15.479 1.00 0.00 H new ATOM 0 HA ALA B 9 5.886 10.402 14.741 1.00 0.00 H new ATOM 0 HB1 ALA B 9 5.057 9.682 12.393 1.00 0.00 H new ATOM 0 HB2 ALA B 9 5.874 8.341 13.231 1.00 0.00 H new ATOM 0 HB3 ALA B 9 4.096 8.401 13.170 1.00 0.00 H new ATOM 1534 N VAL B 10 2.563 10.126 14.510 1.00 0.00 N ATOM 1535 CA VAL B 10 1.259 10.765 14.291 1.00 0.00 C ATOM 1536 C VAL B 10 0.982 11.808 15.335 1.00 0.00 C ATOM 1537 O VAL B 10 0.713 12.963 15.015 1.00 0.00 O ATOM 1538 CB VAL B 10 0.084 9.749 14.166 1.00 0.00 C ATOM 1539 CG1 VAL B 10 -1.073 10.275 13.331 1.00 0.00 C ATOM 1540 CG2 VAL B 10 0.547 8.424 13.588 1.00 0.00 C ATOM 0 H VAL B 10 2.476 9.142 14.766 1.00 0.00 H new ATOM 0 HA VAL B 10 1.323 11.262 13.323 1.00 0.00 H new ATOM 0 HB VAL B 10 -0.274 9.599 15.185 1.00 0.00 H new ATOM 0 HG11 VAL B 10 -1.859 9.521 13.282 1.00 0.00 H new ATOM 0 HG12 VAL B 10 -1.468 11.182 13.788 1.00 0.00 H new ATOM 0 HG13 VAL B 10 -0.722 10.499 12.324 1.00 0.00 H new ATOM 0 HG21 VAL B 10 -0.300 7.742 13.516 1.00 0.00 H new ATOM 0 HG22 VAL B 10 0.967 8.587 12.595 1.00 0.00 H new ATOM 0 HG23 VAL B 10 1.308 7.990 14.237 1.00 0.00 H new ATOM 1550 N ALA B 11 1.102 11.360 16.585 1.00 0.00 N ATOM 1551 CA ALA B 11 0.976 12.249 17.720 1.00 0.00 C ATOM 1552 C ALA B 11 2.043 13.368 17.842 1.00 0.00 C ATOM 1553 O ALA B 11 1.722 14.413 18.416 1.00 0.00 O ATOM 1554 CB ALA B 11 0.855 11.371 18.968 1.00 0.00 C ATOM 0 H ALA B 11 1.286 10.387 16.828 1.00 0.00 H new ATOM 0 HA ALA B 11 0.078 12.851 17.578 1.00 0.00 H new ATOM 0 HB1 ALA B 11 0.758 12.004 19.850 1.00 0.00 H new ATOM 0 HB2 ALA B 11 -0.024 10.733 18.880 1.00 0.00 H new ATOM 0 HB3 ALA B 11 1.746 10.750 19.064 1.00 0.00 H new ATOM 1560 N GLU B 12 3.266 13.178 17.288 1.00 0.00 N ATOM 1561 CA GLU B 12 4.259 14.272 17.195 1.00 0.00 C ATOM 1562 C GLU B 12 3.945 15.243 16.018 1.00 0.00 C ATOM 1563 O GLU B 12 3.927 16.454 16.259 1.00 0.00 O ATOM 1564 CB GLU B 12 5.699 13.688 17.172 1.00 0.00 C ATOM 1565 CG GLU B 12 6.867 14.700 17.222 1.00 0.00 C ATOM 1566 CD GLU B 12 6.969 15.488 18.533 1.00 0.00 C ATOM 1567 OE1 GLU B 12 7.563 15.074 19.528 1.00 0.00 O ATOM 1568 OE2 GLU B 12 6.321 16.696 18.464 1.00 0.00 O ATOM 0 H GLU B 12 3.584 12.288 16.904 1.00 0.00 H new ATOM 0 HA GLU B 12 4.190 14.893 18.088 1.00 0.00 H new ATOM 0 HB2 GLU B 12 5.803 13.009 18.018 1.00 0.00 H new ATOM 0 HB3 GLU B 12 5.808 13.090 16.267 1.00 0.00 H new ATOM 0 HG2 GLU B 12 7.803 14.164 17.061 1.00 0.00 H new ATOM 0 HG3 GLU B 12 6.757 15.404 16.397 1.00 0.00 H new ATOM 1576 N THR B 13 3.688 14.747 14.784 1.00 0.00 N ATOM 1577 CA THR B 13 3.386 15.632 13.605 1.00 0.00 C ATOM 1578 C THR B 13 1.916 16.065 13.323 1.00 0.00 C ATOM 1579 O THR B 13 1.619 16.684 12.296 1.00 0.00 O ATOM 1580 CB THR B 13 4.169 15.095 12.384 1.00 0.00 C ATOM 1581 OG1 THR B 13 4.550 16.169 11.530 1.00 0.00 O ATOM 1582 CG2 THR B 13 3.494 14.019 11.533 1.00 0.00 C ATOM 0 H THR B 13 3.681 13.750 14.568 1.00 0.00 H new ATOM 0 HA THR B 13 3.742 16.623 13.887 1.00 0.00 H new ATOM 0 HB THR B 13 5.022 14.596 12.844 1.00 0.00 H new ATOM 0 HG1 THR B 13 3.787 16.769 11.399 1.00 0.00 H new ATOM 0 HG21 THR B 13 4.154 13.736 10.713 1.00 0.00 H new ATOM 0 HG22 THR B 13 3.286 13.145 12.150 1.00 0.00 H new ATOM 0 HG23 THR B 13 2.560 14.408 11.128 1.00 0.00 H new ATOM 1590 N SER B 14 1.041 15.767 14.277 1.00 0.00 N ATOM 1591 CA SER B 14 -0.405 16.140 14.244 1.00 0.00 C ATOM 1592 C SER B 14 -0.923 16.765 15.573 1.00 0.00 C ATOM 1593 O SER B 14 -1.814 17.618 15.506 1.00 0.00 O ATOM 1594 CB SER B 14 -1.324 14.960 13.841 1.00 0.00 C ATOM 1595 OG SER B 14 -0.895 14.336 12.637 1.00 0.00 O ATOM 0 H SER B 14 1.301 15.251 15.117 1.00 0.00 H new ATOM 0 HA SER B 14 -0.458 16.907 13.471 1.00 0.00 H new ATOM 0 HB2 SER B 14 -1.341 14.224 14.644 1.00 0.00 H new ATOM 0 HB3 SER B 14 -2.345 15.322 13.718 1.00 0.00 H new ATOM 0 HG SER B 14 -0.222 13.654 12.844 1.00 0.00 H new ATOM 1601 N GLY B 15 -0.425 16.344 16.760 1.00 0.00 N ATOM 1602 CA GLY B 15 -0.935 16.839 18.065 1.00 0.00 C ATOM 1603 C GLY B 15 -2.347 16.376 18.467 1.00 0.00 C ATOM 1604 O GLY B 15 -3.239 17.183 18.738 1.00 0.00 O ATOM 0 H GLY B 15 0.330 15.663 16.843 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -0.239 16.529 18.844 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -0.925 17.929 18.045 1.00 0.00 H new ATOM 1608 N LEU B 16 -2.483 15.053 18.529 1.00 0.00 N ATOM 1609 CA LEU B 16 -3.710 14.343 18.946 1.00 0.00 C ATOM 1610 C LEU B 16 -3.403 13.794 20.379 1.00 0.00 C ATOM 1611 O LEU B 16 -3.071 14.537 21.309 1.00 0.00 O ATOM 1612 CB LEU B 16 -4.332 13.555 17.730 1.00 0.00 C ATOM 1613 CG LEU B 16 -3.344 12.680 16.941 1.00 0.00 C ATOM 1614 CD1 LEU B 16 -2.411 11.842 17.736 1.00 0.00 C ATOM 1615 CD2 LEU B 16 -3.578 12.053 15.557 1.00 0.00 C ATOM 0 H LEU B 16 -1.724 14.417 18.285 1.00 0.00 H new ATOM 0 HA LEU B 16 -4.634 14.884 19.147 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -5.137 12.921 18.102 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -4.783 14.273 17.045 1.00 0.00 H new ATOM 0 HG LEU B 16 -2.950 13.634 16.590 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -1.769 11.274 17.063 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -1.797 12.482 18.370 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -2.982 11.154 18.360 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -2.695 11.488 15.260 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -4.439 11.385 15.601 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -3.767 12.841 14.828 1.00 0.00 H new ATOM 1627 N SER B 17 -3.553 12.495 20.515 1.00 0.00 N ATOM 1628 CA SER B 17 -3.164 11.692 21.701 1.00 0.00 C ATOM 1629 C SER B 17 -2.402 10.414 21.247 1.00 0.00 C ATOM 1630 O SER B 17 -2.534 9.944 20.123 1.00 0.00 O ATOM 1631 CB SER B 17 -4.391 11.326 22.557 1.00 0.00 C ATOM 1632 OG SER B 17 -5.102 12.479 22.995 1.00 0.00 O ATOM 0 H SER B 17 -3.967 11.923 19.779 1.00 0.00 H new ATOM 0 HA SER B 17 -2.502 12.295 22.323 1.00 0.00 H new ATOM 0 HB2 SER B 17 -5.058 10.687 21.979 1.00 0.00 H new ATOM 0 HB3 SER B 17 -4.069 10.749 23.423 1.00 0.00 H new ATOM 0 HG SER B 17 -5.873 12.203 23.533 1.00 0.00 H new ATOM 1638 N LYS B 18 -1.604 9.801 22.133 1.00 0.00 N ATOM 1639 CA LYS B 18 -0.989 8.455 21.878 1.00 0.00 C ATOM 1640 C LYS B 18 -2.099 7.364 21.696 1.00 0.00 C ATOM 1641 O LYS B 18 -2.044 6.608 20.730 1.00 0.00 O ATOM 1642 CB LYS B 18 0.072 8.162 22.970 1.00 0.00 C ATOM 1643 CG LYS B 18 1.028 6.999 22.633 1.00 0.00 C ATOM 1644 CD LYS B 18 2.212 6.879 23.607 1.00 0.00 C ATOM 1645 CE LYS B 18 3.117 5.677 23.279 1.00 0.00 C ATOM 1646 NZ LYS B 18 4.275 5.606 24.186 1.00 0.00 N ATOM 0 H LYS B 18 -1.359 10.202 23.038 1.00 0.00 H new ATOM 0 HA LYS B 18 -0.448 8.441 20.932 1.00 0.00 H new ATOM 0 HB2 LYS B 18 0.661 9.064 23.138 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -0.440 7.936 23.906 1.00 0.00 H new ATOM 0 HG2 LYS B 18 0.467 6.064 22.638 1.00 0.00 H new ATOM 0 HG3 LYS B 18 1.411 7.135 21.622 1.00 0.00 H new ATOM 0 HD2 LYS B 18 2.802 7.795 23.574 1.00 0.00 H new ATOM 0 HD3 LYS B 18 1.834 6.780 24.625 1.00 0.00 H new ATOM 0 HE2 LYS B 18 2.540 4.755 23.353 1.00 0.00 H new ATOM 0 HE3 LYS B 18 3.465 5.754 22.249 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 4.862 4.785 23.936 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 4.839 6.475 24.097 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 3.942 5.508 25.167 1.00 0.00 H new ATOM 1659 N LYS B 19 -3.140 7.354 22.552 1.00 0.00 N ATOM 1660 CA LYS B 19 -4.380 6.558 22.340 1.00 0.00 C ATOM 1661 C LYS B 19 -5.143 6.957 21.025 1.00 0.00 C ATOM 1662 O LYS B 19 -5.604 6.041 20.337 1.00 0.00 O ATOM 1663 CB LYS B 19 -5.266 6.669 23.612 1.00 0.00 C ATOM 1664 CG LYS B 19 -6.492 5.727 23.622 1.00 0.00 C ATOM 1665 CD LYS B 19 -7.311 5.806 24.929 1.00 0.00 C ATOM 1666 CE LYS B 19 -8.598 4.958 24.939 1.00 0.00 C ATOM 1667 NZ LYS B 19 -8.345 3.504 24.960 1.00 0.00 N ATOM 0 H LYS B 19 -3.151 7.898 23.415 1.00 0.00 H new ATOM 0 HA LYS B 19 -4.110 5.513 22.189 1.00 0.00 H new ATOM 0 HB2 LYS B 19 -4.652 6.455 24.487 1.00 0.00 H new ATOM 0 HB3 LYS B 19 -5.613 7.698 23.709 1.00 0.00 H new ATOM 0 HG2 LYS B 19 -7.139 5.975 22.780 1.00 0.00 H new ATOM 0 HG3 LYS B 19 -6.155 4.701 23.474 1.00 0.00 H new ATOM 0 HD2 LYS B 19 -6.678 5.489 25.758 1.00 0.00 H new ATOM 0 HD3 LYS B 19 -7.577 6.847 25.112 1.00 0.00 H new ATOM 0 HE2 LYS B 19 -9.194 5.228 25.811 1.00 0.00 H new ATOM 0 HE3 LYS B 19 -9.192 5.203 24.058 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 -9.251 2.994 24.966 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 -7.801 3.234 24.116 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 -7.804 3.258 25.813 1.00 0.00 H new ATOM 1680 N ASP B 20 -5.273 8.263 20.657 1.00 0.00 N ATOM 1681 CA ASP B 20 -5.888 8.657 19.344 1.00 0.00 C ATOM 1682 C ASP B 20 -5.043 8.275 18.088 1.00 0.00 C ATOM 1683 O ASP B 20 -5.635 7.984 17.051 1.00 0.00 O ATOM 1684 CB ASP B 20 -6.255 10.165 19.294 1.00 0.00 C ATOM 1685 CG ASP B 20 -7.558 10.513 20.025 1.00 0.00 C ATOM 1686 OD1 ASP B 20 -7.594 10.988 21.160 1.00 0.00 O ATOM 1687 OD2 ASP B 20 -8.668 10.232 19.267 1.00 0.00 O ATOM 0 H ASP B 20 -4.970 9.049 21.232 1.00 0.00 H new ATOM 0 HA ASP B 20 -6.801 8.064 19.296 1.00 0.00 H new ATOM 0 HB2 ASP B 20 -5.440 10.742 19.731 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -6.341 10.473 18.252 1.00 0.00 H new ATOM 1693 N ALA B 21 -3.700 8.281 18.171 1.00 0.00 N ATOM 1694 CA ALA B 21 -2.793 7.813 17.095 1.00 0.00 C ATOM 1695 C ALA B 21 -2.825 6.269 16.887 1.00 0.00 C ATOM 1696 O ALA B 21 -2.781 5.831 15.738 1.00 0.00 O ATOM 1697 CB ALA B 21 -1.389 8.370 17.371 1.00 0.00 C ATOM 0 H ALA B 21 -3.203 8.615 18.997 1.00 0.00 H new ATOM 0 HA ALA B 21 -3.143 8.200 16.138 1.00 0.00 H new ATOM 0 HB1 ALA B 21 -0.705 8.037 16.590 1.00 0.00 H new ATOM 0 HB2 ALA B 21 -1.425 9.459 17.381 1.00 0.00 H new ATOM 0 HB3 ALA B 21 -1.038 8.010 18.338 1.00 0.00 H new ATOM 1703 N THR B 22 -2.943 5.454 17.961 1.00 0.00 N ATOM 1704 CA THR B 22 -3.149 3.979 17.888 1.00 0.00 C ATOM 1705 C THR B 22 -4.441 3.583 17.107 1.00 0.00 C ATOM 1706 O THR B 22 -4.406 2.737 16.210 1.00 0.00 O ATOM 1707 CB THR B 22 -3.137 3.397 19.336 1.00 0.00 C ATOM 1708 OG1 THR B 22 -2.126 3.964 20.162 1.00 0.00 O ATOM 1709 CG2 THR B 22 -2.874 1.898 19.318 1.00 0.00 C ATOM 0 H THR B 22 -2.898 5.802 18.919 1.00 0.00 H new ATOM 0 HA THR B 22 -2.330 3.544 17.316 1.00 0.00 H new ATOM 0 HB THR B 22 -4.121 3.637 19.740 1.00 0.00 H new ATOM 0 HG1 THR B 22 -2.359 4.892 20.373 1.00 0.00 H new ATOM 0 HG21 THR B 22 -2.871 1.517 20.339 1.00 0.00 H new ATOM 0 HG22 THR B 22 -3.656 1.398 18.747 1.00 0.00 H new ATOM 0 HG23 THR B 22 -1.906 1.704 18.855 1.00 0.00 H new ATOM 1717 N LYS B 23 -5.555 4.232 17.472 1.00 0.00 N ATOM 1718 CA LYS B 23 -6.850 4.153 16.754 1.00 0.00 C ATOM 1719 C LYS B 23 -6.803 4.608 15.273 1.00 0.00 C ATOM 1720 O LYS B 23 -7.326 3.920 14.404 1.00 0.00 O ATOM 1721 CB LYS B 23 -7.827 5.135 17.465 1.00 0.00 C ATOM 1722 CG LYS B 23 -8.364 4.666 18.835 1.00 0.00 C ATOM 1723 CD LYS B 23 -9.205 5.746 19.550 1.00 0.00 C ATOM 1724 CE LYS B 23 -9.763 5.324 20.923 1.00 0.00 C ATOM 1725 NZ LYS B 23 -10.866 4.348 20.828 1.00 0.00 N ATOM 0 H LYS B 23 -5.590 4.841 18.290 1.00 0.00 H new ATOM 0 HA LYS B 23 -7.146 3.104 16.770 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -7.319 6.090 17.601 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -8.675 5.317 16.805 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -8.972 3.772 18.695 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -7.525 4.385 19.472 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -8.591 6.637 19.681 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -10.038 6.025 18.905 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -8.957 4.895 21.519 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -10.115 6.209 21.453 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -11.197 4.104 21.783 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -11.650 4.762 20.285 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -10.529 3.489 20.349 1.00 0.00 H new ATOM 1738 N ALA B 24 -6.219 5.788 15.040 1.00 0.00 N ATOM 1739 CA ALA B 24 -6.053 6.412 13.712 1.00 0.00 C ATOM 1740 C ALA B 24 -5.159 5.703 12.664 1.00 0.00 C ATOM 1741 O ALA B 24 -5.294 5.952 11.470 1.00 0.00 O ATOM 1742 CB ALA B 24 -5.561 7.820 13.973 1.00 0.00 C ATOM 0 H ALA B 24 -5.834 6.359 15.793 1.00 0.00 H new ATOM 0 HA ALA B 24 -7.026 6.351 13.225 1.00 0.00 H new ATOM 0 HB1 ALA B 24 -5.418 8.337 13.024 1.00 0.00 H new ATOM 0 HB2 ALA B 24 -6.296 8.357 14.572 1.00 0.00 H new ATOM 0 HB3 ALA B 24 -4.614 7.781 14.511 1.00 0.00 H new ATOM 1748 N VAL B 25 -4.265 4.846 13.136 1.00 0.00 N ATOM 1749 CA VAL B 25 -3.518 3.831 12.351 1.00 0.00 C ATOM 1750 C VAL B 25 -4.495 2.642 12.075 1.00 0.00 C ATOM 1751 O VAL B 25 -4.696 2.307 10.908 1.00 0.00 O ATOM 1752 CB VAL B 25 -2.337 3.480 13.326 1.00 0.00 C ATOM 1753 CG1 VAL B 25 -1.780 2.053 13.138 1.00 0.00 C ATOM 1754 CG2 VAL B 25 -1.227 4.538 13.232 1.00 0.00 C ATOM 0 H VAL B 25 -4.017 4.826 14.125 1.00 0.00 H new ATOM 0 HA VAL B 25 -3.140 4.133 11.374 1.00 0.00 H new ATOM 0 HB VAL B 25 -2.753 3.496 14.333 1.00 0.00 H new ATOM 0 HG11 VAL B 25 -0.968 1.883 13.845 1.00 0.00 H new ATOM 0 HG12 VAL B 25 -2.573 1.327 13.315 1.00 0.00 H new ATOM 0 HG13 VAL B 25 -1.405 1.940 12.121 1.00 0.00 H new ATOM 0 HG21 VAL B 25 -0.418 4.278 13.914 1.00 0.00 H new ATOM 0 HG22 VAL B 25 -0.844 4.574 12.212 1.00 0.00 H new ATOM 0 HG23 VAL B 25 -1.630 5.514 13.503 1.00 0.00 H new ATOM 1764 N ASP B 26 -5.091 2.019 13.126 1.00 0.00 N ATOM 1765 CA ASP B 26 -6.178 0.990 12.965 1.00 0.00 C ATOM 1766 C ASP B 26 -7.600 1.546 12.528 1.00 0.00 C ATOM 1767 O ASP B 26 -8.675 1.028 12.836 1.00 0.00 O ATOM 1768 CB ASP B 26 -6.234 0.227 14.308 1.00 0.00 C ATOM 1769 CG ASP B 26 -6.912 -1.149 14.244 1.00 0.00 C ATOM 1770 OD1 ASP B 26 -6.409 -2.126 13.689 1.00 0.00 O ATOM 1771 OD2 ASP B 26 -8.133 -1.159 14.869 1.00 0.00 O ATOM 0 H ASP B 26 -4.844 2.205 14.098 1.00 0.00 H new ATOM 0 HA ASP B 26 -5.927 0.343 12.125 1.00 0.00 H new ATOM 0 HB2 ASP B 26 -5.217 0.097 14.678 1.00 0.00 H new ATOM 0 HB3 ASP B 26 -6.762 0.842 15.037 1.00 0.00 H new ATOM 1777 N ALA B 27 -7.511 2.651 11.806 1.00 0.00 N ATOM 1778 CA ALA B 27 -8.560 3.405 11.105 1.00 0.00 C ATOM 1779 C ALA B 27 -8.265 3.334 9.586 1.00 0.00 C ATOM 1780 O ALA B 27 -9.124 2.917 8.805 1.00 0.00 O ATOM 1781 CB ALA B 27 -8.526 4.837 11.629 1.00 0.00 C ATOM 0 H ALA B 27 -6.603 3.098 11.677 1.00 0.00 H new ATOM 0 HA ALA B 27 -9.556 2.997 11.277 1.00 0.00 H new ATOM 0 HB1 ALA B 27 -9.294 5.426 11.128 1.00 0.00 H new ATOM 0 HB2 ALA B 27 -8.712 4.836 12.703 1.00 0.00 H new ATOM 0 HB3 ALA B 27 -7.547 5.274 11.431 1.00 0.00 H new ATOM 1787 N VAL B 28 -7.036 3.735 9.195 1.00 0.00 N ATOM 1788 CA VAL B 28 -6.471 3.551 7.838 1.00 0.00 C ATOM 1789 C VAL B 28 -6.441 2.032 7.486 1.00 0.00 C ATOM 1790 O VAL B 28 -7.154 1.577 6.596 1.00 0.00 O ATOM 1791 CB VAL B 28 -5.008 4.133 7.743 1.00 0.00 C ATOM 1792 CG1 VAL B 28 -4.595 4.262 6.292 1.00 0.00 C ATOM 1793 CG2 VAL B 28 -4.746 5.460 8.436 1.00 0.00 C ATOM 0 H VAL B 28 -6.392 4.208 9.829 1.00 0.00 H new ATOM 0 HA VAL B 28 -7.104 4.089 7.133 1.00 0.00 H new ATOM 0 HB VAL B 28 -4.411 3.403 8.290 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -3.584 4.665 6.236 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -4.622 3.281 5.817 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -5.282 4.933 5.777 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -3.704 5.745 8.293 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -5.394 6.227 8.011 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -4.952 5.361 9.502 1.00 0.00 H new ATOM 1803 N PHE B 29 -5.627 1.298 8.258 1.00 0.00 N ATOM 1804 CA PHE B 29 -5.378 -0.160 8.123 1.00 0.00 C ATOM 1805 C PHE B 29 -6.573 -1.074 8.528 1.00 0.00 C ATOM 1806 O PHE B 29 -6.474 -2.281 8.317 1.00 0.00 O ATOM 1807 CB PHE B 29 -4.001 -0.512 8.780 1.00 0.00 C ATOM 1808 CG PHE B 29 -2.807 0.346 8.292 1.00 0.00 C ATOM 1809 CD1 PHE B 29 -2.479 0.412 6.931 1.00 0.00 C ATOM 1810 CD2 PHE B 29 -2.191 1.228 9.183 1.00 0.00 C ATOM 1811 CE1 PHE B 29 -1.589 1.374 6.466 1.00 0.00 C ATOM 1812 CE2 PHE B 29 -1.313 2.200 8.717 1.00 0.00 C ATOM 1813 CZ PHE B 29 -1.022 2.277 7.358 1.00 0.00 C ATOM 0 H PHE B 29 -5.099 1.712 9.026 1.00 0.00 H new ATOM 0 HA PHE B 29 -5.302 -0.395 7.061 1.00 0.00 H new ATOM 0 HB2 PHE B 29 -4.092 -0.401 9.861 1.00 0.00 H new ATOM 0 HB3 PHE B 29 -3.779 -1.561 8.585 1.00 0.00 H new ATOM 0 HD1 PHE B 29 -2.921 -0.289 6.238 1.00 0.00 H new ATOM 0 HD2 PHE B 29 -2.398 1.154 10.240 1.00 0.00 H new ATOM 0 HE1 PHE B 29 -1.339 1.419 5.416 1.00 0.00 H new ATOM 0 HE2 PHE B 29 -0.858 2.894 9.408 1.00 0.00 H new ATOM 0 HZ PHE B 29 -0.352 3.042 6.995 1.00 0.00 H new ATOM 1823 N ASP B 30 -7.686 -0.533 9.077 1.00 0.00 N ATOM 1824 CA ASP B 30 -8.982 -1.266 9.165 1.00 0.00 C ATOM 1825 C ASP B 30 -9.815 -1.077 7.852 1.00 0.00 C ATOM 1826 O ASP B 30 -10.396 -2.035 7.340 1.00 0.00 O ATOM 1827 CB ASP B 30 -9.766 -0.770 10.399 1.00 0.00 C ATOM 1828 CG ASP B 30 -10.913 -1.692 10.833 1.00 0.00 C ATOM 1829 OD1 ASP B 30 -10.766 -2.630 11.616 1.00 0.00 O ATOM 1830 OD2 ASP B 30 -12.106 -1.350 10.249 1.00 0.00 O ATOM 0 H ASP B 30 -7.718 0.409 9.467 1.00 0.00 H new ATOM 0 HA ASP B 30 -8.787 -2.333 9.277 1.00 0.00 H new ATOM 0 HB2 ASP B 30 -9.073 -0.655 11.233 1.00 0.00 H new ATOM 0 HB3 ASP B 30 -10.172 0.218 10.183 1.00 0.00 H new ATOM 1836 N SER B 31 -9.874 0.170 7.349 1.00 0.00 N ATOM 1837 CA SER B 31 -10.547 0.530 6.070 1.00 0.00 C ATOM 1838 C SER B 31 -9.842 0.011 4.775 1.00 0.00 C ATOM 1839 O SER B 31 -10.553 -0.191 3.785 1.00 0.00 O ATOM 1840 CB SER B 31 -10.859 2.038 6.038 1.00 0.00 C ATOM 1841 OG SER B 31 -11.741 2.374 7.103 1.00 0.00 O ATOM 0 H SER B 31 -9.453 0.971 7.819 1.00 0.00 H new ATOM 0 HA SER B 31 -11.490 -0.016 6.057 1.00 0.00 H new ATOM 0 HB2 SER B 31 -9.936 2.611 6.125 1.00 0.00 H new ATOM 0 HB3 SER B 31 -11.311 2.304 5.083 1.00 0.00 H new ATOM 0 HG SER B 31 -11.220 2.577 7.908 1.00 0.00 H new ATOM 1847 N ILE B 32 -8.498 -0.230 4.741 1.00 0.00 N ATOM 1848 CA ILE B 32 -7.854 -1.019 3.670 1.00 0.00 C ATOM 1849 C ILE B 32 -8.425 -2.481 3.783 1.00 0.00 C ATOM 1850 O ILE B 32 -8.793 -3.027 2.749 1.00 0.00 O ATOM 1851 CB ILE B 32 -6.281 -1.128 3.765 1.00 0.00 C ATOM 1852 CG1 ILE B 32 -5.278 0.030 3.515 1.00 0.00 C ATOM 1853 CG2 ILE B 32 -5.860 -2.172 2.681 1.00 0.00 C ATOM 1854 CD1 ILE B 32 -5.126 1.313 4.335 1.00 0.00 C ATOM 0 H ILE B 32 -7.848 0.115 5.447 1.00 0.00 H new ATOM 0 HA ILE B 32 -8.070 -0.510 2.731 1.00 0.00 H new ATOM 0 HB ILE B 32 -6.187 -1.300 4.837 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -4.292 -0.435 3.522 1.00 0.00 H new ATOM 0 HG13 ILE B 32 -5.468 0.361 2.494 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -4.777 -2.294 2.695 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -6.336 -3.129 2.894 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -6.173 -1.822 1.697 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -4.335 1.927 3.906 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -6.064 1.868 4.320 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -4.871 1.059 5.364 1.00 0.00 H new ATOM 1866 N THR B 33 -8.359 -3.152 4.954 1.00 0.00 N ATOM 1867 CA THR B 33 -8.832 -4.562 5.088 1.00 0.00 C ATOM 1868 C THR B 33 -10.296 -4.808 4.664 1.00 0.00 C ATOM 1869 O THR B 33 -10.592 -5.876 4.145 1.00 0.00 O ATOM 1870 CB THR B 33 -8.510 -5.203 6.453 1.00 0.00 C ATOM 1871 OG1 THR B 33 -9.272 -4.635 7.512 1.00 0.00 O ATOM 1872 CG2 THR B 33 -7.023 -5.092 6.786 1.00 0.00 C ATOM 0 H THR B 33 -7.988 -2.752 5.816 1.00 0.00 H new ATOM 0 HA THR B 33 -8.230 -5.088 4.347 1.00 0.00 H new ATOM 0 HB THR B 33 -8.781 -6.255 6.362 1.00 0.00 H new ATOM 0 HG1 THR B 33 -9.594 -3.749 7.245 1.00 0.00 H new ATOM 0 HG21 THR B 33 -6.832 -5.554 7.755 1.00 0.00 H new ATOM 0 HG22 THR B 33 -6.439 -5.602 6.019 1.00 0.00 H new ATOM 0 HG23 THR B 33 -6.736 -4.041 6.822 1.00 0.00 H new ATOM 1880 N GLU B 34 -11.170 -3.810 4.842 1.00 0.00 N ATOM 1881 CA GLU B 34 -12.533 -3.815 4.269 1.00 0.00 C ATOM 1882 C GLU B 34 -12.543 -3.606 2.728 1.00 0.00 C ATOM 1883 O GLU B 34 -13.464 -4.116 2.089 1.00 0.00 O ATOM 1884 CB GLU B 34 -13.394 -2.742 4.988 1.00 0.00 C ATOM 1885 CG GLU B 34 -13.721 -3.034 6.468 1.00 0.00 C ATOM 1886 CD GLU B 34 -14.362 -1.838 7.175 1.00 0.00 C ATOM 1887 OE1 GLU B 34 -13.712 -0.921 7.677 1.00 0.00 O ATOM 1888 OE2 GLU B 34 -15.732 -1.909 7.178 1.00 0.00 O ATOM 0 H GLU B 34 -10.958 -2.974 5.386 1.00 0.00 H new ATOM 0 HA GLU B 34 -12.963 -4.803 4.436 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -12.874 -1.786 4.931 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -14.331 -2.628 4.443 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -14.394 -3.889 6.526 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -12.806 -3.313 6.990 1.00 0.00 H new ATOM 1896 N ALA B 35 -11.564 -2.893 2.117 1.00 0.00 N ATOM 1897 CA ALA B 35 -11.383 -2.883 0.653 1.00 0.00 C ATOM 1898 C ALA B 35 -10.906 -4.256 0.140 1.00 0.00 C ATOM 1899 O ALA B 35 -11.655 -4.928 -0.566 1.00 0.00 O ATOM 1900 CB ALA B 35 -10.373 -1.782 0.215 1.00 0.00 C ATOM 0 H ALA B 35 -10.889 -2.318 2.621 1.00 0.00 H new ATOM 0 HA ALA B 35 -12.355 -2.661 0.213 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -10.262 -1.801 -0.869 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -10.743 -0.805 0.525 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -9.406 -1.969 0.682 1.00 0.00 H new ATOM 1906 N LEU B 36 -9.715 -4.718 0.544 1.00 0.00 N ATOM 1907 CA LEU B 36 -9.089 -5.938 0.005 1.00 0.00 C ATOM 1908 C LEU B 36 -9.839 -7.203 0.389 1.00 0.00 C ATOM 1909 O LEU B 36 -10.043 -8.032 -0.504 1.00 0.00 O ATOM 1910 CB LEU B 36 -7.628 -5.886 0.446 1.00 0.00 C ATOM 1911 CG LEU B 36 -6.891 -4.576 -0.029 1.00 0.00 C ATOM 1912 CD1 LEU B 36 -5.439 -4.289 0.138 1.00 0.00 C ATOM 1913 CD2 LEU B 36 -7.349 -3.868 -1.342 1.00 0.00 C ATOM 0 H LEU B 36 -9.153 -4.255 1.258 1.00 0.00 H new ATOM 0 HA LEU B 36 -9.135 -5.974 -1.083 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -7.579 -5.951 1.533 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -7.103 -6.756 0.051 1.00 0.00 H new ATOM 0 HG LEU B 36 -7.345 -4.184 0.881 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -5.211 -3.311 -0.284 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -5.187 -4.294 1.198 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -4.856 -5.052 -0.378 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -6.732 -2.986 -1.514 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -7.242 -4.554 -2.182 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -8.393 -3.569 -1.249 1.00 0.00 H new ATOM 1925 N ARG B 37 -10.320 -7.351 1.651 1.00 0.00 N ATOM 1926 CA ARG B 37 -11.152 -8.522 1.969 1.00 0.00 C ATOM 1927 C ARG B 37 -12.493 -8.577 1.158 1.00 0.00 C ATOM 1928 O ARG B 37 -12.944 -9.687 0.860 1.00 0.00 O ATOM 1929 CB ARG B 37 -11.385 -8.755 3.488 1.00 0.00 C ATOM 1930 CG ARG B 37 -12.638 -8.081 4.113 1.00 0.00 C ATOM 1931 CD ARG B 37 -12.570 -8.005 5.635 1.00 0.00 C ATOM 1932 NE ARG B 37 -13.795 -7.403 6.215 1.00 0.00 N ATOM 1933 CZ ARG B 37 -13.862 -6.816 7.426 1.00 0.00 C ATOM 1934 NH1 ARG B 37 -12.821 -6.674 8.245 1.00 0.00 N ATOM 1935 NH2 ARG B 37 -15.032 -6.354 7.827 1.00 0.00 N ATOM 0 H ARG B 37 -10.153 -6.706 2.424 1.00 0.00 H new ATOM 0 HA ARG B 37 -10.546 -9.364 1.633 1.00 0.00 H new ATOM 0 HB2 ARG B 37 -11.454 -9.829 3.661 1.00 0.00 H new ATOM 0 HB3 ARG B 37 -10.505 -8.402 4.025 1.00 0.00 H new ATOM 0 HG2 ARG B 37 -12.744 -7.075 3.708 1.00 0.00 H new ATOM 0 HG3 ARG B 37 -13.528 -8.638 3.821 1.00 0.00 H new ATOM 0 HD2 ARG B 37 -12.430 -9.006 6.042 1.00 0.00 H new ATOM 0 HD3 ARG B 37 -11.702 -7.416 5.930 1.00 0.00 H new ATOM 0 HE ARG B 37 -14.648 -7.436 5.657 1.00 0.00 H new ATOM 0 HH11 ARG B 37 -11.903 -7.020 7.967 1.00 0.00 H new ATOM 0 HH12 ARG B 37 -12.942 -6.219 9.150 1.00 0.00 H new ATOM 0 HH21 ARG B 37 -15.850 -6.447 7.225 1.00 0.00 H new ATOM 0 HH22 ARG B 37 -15.117 -5.904 8.738 1.00 0.00 H new ATOM 1948 N LYS B 38 -13.126 -7.408 0.837 1.00 0.00 N ATOM 1949 CA LYS B 38 -14.451 -7.408 0.162 1.00 0.00 C ATOM 1950 C LYS B 38 -14.420 -7.412 -1.412 1.00 0.00 C ATOM 1951 O LYS B 38 -15.484 -7.357 -2.035 1.00 0.00 O ATOM 1952 CB LYS B 38 -15.226 -6.181 0.726 1.00 0.00 C ATOM 1953 CG LYS B 38 -16.762 -6.167 0.542 1.00 0.00 C ATOM 1954 CD LYS B 38 -17.478 -5.015 1.281 1.00 0.00 C ATOM 1955 CE LYS B 38 -17.199 -3.610 0.708 1.00 0.00 C ATOM 1956 NZ LYS B 38 -17.931 -2.569 1.450 1.00 0.00 N ATOM 0 H LYS B 38 -12.748 -6.481 1.031 1.00 0.00 H new ATOM 0 HA LYS B 38 -14.948 -8.353 0.383 1.00 0.00 H new ATOM 0 HB2 LYS B 38 -15.013 -6.109 1.793 1.00 0.00 H new ATOM 0 HB3 LYS B 38 -14.822 -5.283 0.259 1.00 0.00 H new ATOM 0 HG2 LYS B 38 -16.989 -6.097 -0.522 1.00 0.00 H new ATOM 0 HG3 LYS B 38 -17.167 -7.116 0.893 1.00 0.00 H new ATOM 0 HD2 LYS B 38 -18.552 -5.197 1.254 1.00 0.00 H new ATOM 0 HD3 LYS B 38 -17.178 -5.031 2.329 1.00 0.00 H new ATOM 0 HE2 LYS B 38 -16.129 -3.404 0.750 1.00 0.00 H new ATOM 0 HE3 LYS B 38 -17.488 -3.580 -0.343 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 -17.721 -1.637 1.039 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 -18.953 -2.752 1.388 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 -17.637 -2.582 2.447 1.00 0.00 H new ATOM 1969 N GLY B 39 -13.239 -7.489 -2.066 1.00 0.00 N ATOM 1970 CA GLY B 39 -13.112 -7.289 -3.536 1.00 0.00 C ATOM 1971 C GLY B 39 -13.247 -5.800 -3.973 1.00 0.00 C ATOM 1972 O GLY B 39 -13.976 -5.486 -4.916 1.00 0.00 O ATOM 0 H GLY B 39 -12.354 -7.689 -1.600 1.00 0.00 H new ATOM 0 HA2 GLY B 39 -12.145 -7.670 -3.865 1.00 0.00 H new ATOM 0 HA3 GLY B 39 -13.876 -7.879 -4.043 1.00 0.00 H new ATOM 1976 N ASP B 40 -12.529 -4.913 -3.262 1.00 0.00 N ATOM 1977 CA ASP B 40 -12.587 -3.434 -3.421 1.00 0.00 C ATOM 1978 C ASP B 40 -11.167 -2.812 -3.399 1.00 0.00 C ATOM 1979 O ASP B 40 -10.211 -3.374 -2.857 1.00 0.00 O ATOM 1980 CB ASP B 40 -13.591 -2.817 -2.404 1.00 0.00 C ATOM 1981 CG ASP B 40 -15.067 -2.917 -2.817 1.00 0.00 C ATOM 1982 OD1 ASP B 40 -15.644 -2.056 -3.479 1.00 0.00 O ATOM 1983 OD2 ASP B 40 -15.656 -4.072 -2.366 1.00 0.00 O ATOM 0 H ASP B 40 -11.872 -5.205 -2.539 1.00 0.00 H new ATOM 0 HA ASP B 40 -12.981 -3.185 -4.406 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -13.463 -3.313 -1.442 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -13.339 -1.767 -2.258 1.00 0.00 H new ATOM 1989 N LYS B 41 -11.052 -1.637 -4.046 1.00 0.00 N ATOM 1990 CA LYS B 41 -9.783 -0.874 -4.141 1.00 0.00 C ATOM 1991 C LYS B 41 -9.784 0.261 -3.085 1.00 0.00 C ATOM 1992 O LYS B 41 -10.816 0.874 -2.782 1.00 0.00 O ATOM 1993 CB LYS B 41 -9.582 -0.217 -5.538 1.00 0.00 C ATOM 1994 CG LYS B 41 -9.707 -1.140 -6.773 1.00 0.00 C ATOM 1995 CD LYS B 41 -9.178 -0.517 -8.083 1.00 0.00 C ATOM 1996 CE LYS B 41 -10.015 0.658 -8.624 1.00 0.00 C ATOM 1997 NZ LYS B 41 -9.449 1.188 -9.877 1.00 0.00 N ATOM 0 H LYS B 41 -11.834 -1.185 -4.520 1.00 0.00 H new ATOM 0 HA LYS B 41 -8.975 -1.586 -3.972 1.00 0.00 H new ATOM 0 HB2 LYS B 41 -10.310 0.588 -5.642 1.00 0.00 H new ATOM 0 HB3 LYS B 41 -8.594 0.242 -5.557 1.00 0.00 H new ATOM 0 HG2 LYS B 41 -9.164 -2.065 -6.578 1.00 0.00 H new ATOM 0 HG3 LYS B 41 -10.755 -1.408 -6.908 1.00 0.00 H new ATOM 0 HD2 LYS B 41 -8.157 -0.172 -7.918 1.00 0.00 H new ATOM 0 HD3 LYS B 41 -9.133 -1.294 -8.846 1.00 0.00 H new ATOM 0 HE2 LYS B 41 -11.039 0.328 -8.796 1.00 0.00 H new ATOM 0 HE3 LYS B 41 -10.057 1.451 -7.878 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 -10.035 1.978 -10.216 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 -8.480 1.524 -9.705 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 -9.432 0.436 -10.596 1.00 0.00 H new ATOM 2010 N VAL B 42 -8.581 0.604 -2.603 1.00 0.00 N ATOM 2011 CA VAL B 42 -8.356 1.685 -1.643 1.00 0.00 C ATOM 2012 C VAL B 42 -8.141 2.968 -2.528 1.00 0.00 C ATOM 2013 O VAL B 42 -8.874 3.210 -3.494 1.00 0.00 O ATOM 2014 CB VAL B 42 -7.175 1.152 -0.763 1.00 0.00 C ATOM 2015 CG1 VAL B 42 -6.998 1.932 0.523 1.00 0.00 C ATOM 2016 CG2 VAL B 42 -7.298 -0.287 -0.198 1.00 0.00 C ATOM 0 H VAL B 42 -7.723 0.126 -2.877 1.00 0.00 H new ATOM 0 HA VAL B 42 -9.142 1.966 -0.942 1.00 0.00 H new ATOM 0 HB VAL B 42 -6.371 1.233 -1.494 1.00 0.00 H new ATOM 0 HG11 VAL B 42 -6.165 1.516 1.089 1.00 0.00 H new ATOM 0 HG12 VAL B 42 -6.792 2.977 0.290 1.00 0.00 H new ATOM 0 HG13 VAL B 42 -7.910 1.866 1.117 1.00 0.00 H new ATOM 0 HG21 VAL B 42 -6.412 -0.524 0.391 1.00 0.00 H new ATOM 0 HG22 VAL B 42 -8.183 -0.355 0.435 1.00 0.00 H new ATOM 0 HG23 VAL B 42 -7.386 -0.995 -1.022 1.00 0.00 H new ATOM 2026 N GLN B 43 -7.236 3.838 -2.082 1.00 0.00 N ATOM 2027 CA GLN B 43 -6.593 4.921 -2.863 1.00 0.00 C ATOM 2028 C GLN B 43 -5.766 5.916 -2.005 1.00 0.00 C ATOM 2029 O GLN B 43 -6.197 6.314 -0.919 1.00 0.00 O ATOM 2030 CB GLN B 43 -7.112 5.385 -4.259 1.00 0.00 C ATOM 2031 CG GLN B 43 -6.776 4.393 -5.383 1.00 0.00 C ATOM 2032 CD GLN B 43 -7.424 4.709 -6.737 1.00 0.00 C ATOM 2033 OE1 GLN B 43 -6.930 5.532 -7.506 1.00 0.00 O ATOM 2034 NE2 GLN B 43 -8.526 4.048 -7.061 1.00 0.00 N ATOM 0 H GLN B 43 -6.907 3.814 -1.117 1.00 0.00 H new ATOM 0 HA GLN B 43 -5.891 4.298 -3.417 1.00 0.00 H new ATOM 0 HB2 GLN B 43 -8.193 5.521 -4.212 1.00 0.00 H new ATOM 0 HB3 GLN B 43 -6.679 6.356 -4.497 1.00 0.00 H new ATOM 0 HG2 GLN B 43 -5.694 4.365 -5.512 1.00 0.00 H new ATOM 0 HG3 GLN B 43 -7.086 3.395 -5.072 1.00 0.00 H new ATOM 0 HE21 GLN B 43 -8.923 3.369 -6.412 1.00 0.00 H new ATOM 0 HE22 GLN B 43 -8.977 4.218 -7.960 1.00 0.00 H new ATOM 2043 N LEU B 44 -4.559 6.284 -2.498 1.00 0.00 N ATOM 2044 CA LEU B 44 -3.623 7.202 -1.809 1.00 0.00 C ATOM 2045 C LEU B 44 -2.936 8.084 -2.878 1.00 0.00 C ATOM 2046 O LEU B 44 -2.022 7.625 -3.574 1.00 0.00 O ATOM 2047 CB LEU B 44 -2.549 6.397 -1.012 1.00 0.00 C ATOM 2048 CG LEU B 44 -3.036 5.883 0.364 1.00 0.00 C ATOM 2049 CD1 LEU B 44 -2.184 4.719 0.886 1.00 0.00 C ATOM 2050 CD2 LEU B 44 -3.044 7.019 1.401 1.00 0.00 C ATOM 0 H LEU B 44 -4.205 5.948 -3.394 1.00 0.00 H new ATOM 0 HA LEU B 44 -4.172 7.822 -1.100 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -2.229 5.546 -1.613 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -1.674 7.029 -0.863 1.00 0.00 H new ATOM 0 HG LEU B 44 -4.052 5.517 0.217 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -2.566 4.394 1.854 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -2.230 3.889 0.181 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -1.150 5.045 0.995 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -3.390 6.634 2.360 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -2.035 7.417 1.512 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -3.712 7.812 1.066 1.00 0.00 H new ATOM 2062 N ILE B 45 -3.355 9.365 -2.984 1.00 0.00 N ATOM 2063 CA ILE B 45 -2.717 10.352 -3.903 1.00 0.00 C ATOM 2064 C ILE B 45 -1.358 10.781 -3.262 1.00 0.00 C ATOM 2065 O ILE B 45 -1.222 10.970 -2.047 1.00 0.00 O ATOM 2066 CB ILE B 45 -3.711 11.485 -4.318 1.00 0.00 C ATOM 2067 CG1 ILE B 45 -3.424 12.179 -5.685 1.00 0.00 C ATOM 2068 CG2 ILE B 45 -3.995 12.488 -3.190 1.00 0.00 C ATOM 2069 CD1 ILE B 45 -2.332 13.261 -5.765 1.00 0.00 C ATOM 0 H ILE B 45 -4.133 9.746 -2.446 1.00 0.00 H new ATOM 0 HA ILE B 45 -2.470 9.921 -4.873 1.00 0.00 H new ATOM 0 HB ILE B 45 -4.638 10.940 -4.498 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -3.165 11.399 -6.401 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -4.356 12.628 -6.027 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -4.692 13.247 -3.545 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -4.431 11.965 -2.339 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -3.064 12.965 -2.884 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -2.266 13.636 -6.786 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -2.583 14.081 -5.093 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -1.373 12.833 -5.473 1.00 0.00 H new ATOM 2081 N GLY B 46 -0.351 10.875 -4.121 1.00 0.00 N ATOM 2082 CA GLY B 46 1.059 11.048 -3.683 1.00 0.00 C ATOM 2083 C GLY B 46 1.871 9.756 -3.382 1.00 0.00 C ATOM 2084 O GLY B 46 3.067 9.854 -3.094 1.00 0.00 O ATOM 0 H GLY B 46 -0.469 10.836 -5.133 1.00 0.00 H new ATOM 0 HA2 GLY B 46 1.587 11.607 -4.455 1.00 0.00 H new ATOM 0 HA3 GLY B 46 1.061 11.666 -2.785 1.00 0.00 H new ATOM 2088 N PHE B 47 1.252 8.566 -3.503 1.00 0.00 N ATOM 2089 CA PHE B 47 1.867 7.258 -3.311 1.00 0.00 C ATOM 2090 C PHE B 47 1.339 6.487 -4.584 1.00 0.00 C ATOM 2091 O PHE B 47 2.015 6.503 -5.617 1.00 0.00 O ATOM 2092 CB PHE B 47 1.399 6.832 -1.879 1.00 0.00 C ATOM 2093 CG PHE B 47 2.495 6.837 -0.786 1.00 0.00 C ATOM 2094 CD1 PHE B 47 2.842 8.019 -0.118 1.00 0.00 C ATOM 2095 CD2 PHE B 47 3.107 5.646 -0.396 1.00 0.00 C ATOM 2096 CE1 PHE B 47 3.786 7.997 0.910 1.00 0.00 C ATOM 2097 CE2 PHE B 47 4.032 5.617 0.640 1.00 0.00 C ATOM 2098 CZ PHE B 47 4.381 6.793 1.286 1.00 0.00 C ATOM 0 H PHE B 47 0.264 8.498 -3.749 1.00 0.00 H new ATOM 0 HA PHE B 47 2.948 7.118 -3.287 1.00 0.00 H new ATOM 0 HB2 PHE B 47 0.596 7.499 -1.566 1.00 0.00 H new ATOM 0 HB3 PHE B 47 0.975 5.829 -1.938 1.00 0.00 H new ATOM 0 HD1 PHE B 47 2.377 8.952 -0.400 1.00 0.00 H new ATOM 0 HD2 PHE B 47 2.857 4.729 -0.909 1.00 0.00 H new ATOM 0 HE1 PHE B 47 4.056 8.913 1.415 1.00 0.00 H new ATOM 0 HE2 PHE B 47 4.478 4.681 0.941 1.00 0.00 H new ATOM 0 HZ PHE B 47 5.113 6.777 2.080 1.00 0.00 H new ATOM 2108 N GLY B 48 0.147 5.857 -4.540 1.00 0.00 N ATOM 2109 CA GLY B 48 -0.508 5.236 -5.716 1.00 0.00 C ATOM 2110 C GLY B 48 -1.895 4.607 -5.401 1.00 0.00 C ATOM 2111 O GLY B 48 -2.851 5.341 -5.135 1.00 0.00 O ATOM 0 H GLY B 48 -0.395 5.763 -3.681 1.00 0.00 H new ATOM 0 HA2 GLY B 48 -0.629 5.990 -6.493 1.00 0.00 H new ATOM 0 HA3 GLY B 48 0.147 4.464 -6.120 1.00 0.00 H new ATOM 2115 N ASN B 49 -2.012 3.260 -5.465 1.00 0.00 N ATOM 2116 CA ASN B 49 -3.315 2.540 -5.332 1.00 0.00 C ATOM 2117 C ASN B 49 -3.148 1.094 -4.777 1.00 0.00 C ATOM 2118 O ASN B 49 -2.477 0.273 -5.407 1.00 0.00 O ATOM 2119 CB ASN B 49 -3.949 2.489 -6.767 1.00 0.00 C ATOM 2120 CG ASN B 49 -5.294 1.751 -6.993 1.00 0.00 C ATOM 2121 OD1 ASN B 49 -5.956 1.259 -6.080 1.00 0.00 O ATOM 2122 ND2 ASN B 49 -5.726 1.670 -8.241 1.00 0.00 N ATOM 0 H ASN B 49 -1.216 2.639 -5.609 1.00 0.00 H new ATOM 0 HA ASN B 49 -3.949 3.068 -4.619 1.00 0.00 H new ATOM 0 HB2 ASN B 49 -4.084 3.518 -7.099 1.00 0.00 H new ATOM 0 HB3 ASN B 49 -3.214 2.034 -7.431 1.00 0.00 H new ATOM 0 HD21 ASN B 49 -6.608 1.200 -8.446 1.00 0.00 H new ATOM 0 HD22 ASN B 49 -5.177 2.078 -8.998 1.00 0.00 H new ATOM 2129 N PHE B 50 -3.824 0.744 -3.657 1.00 0.00 N ATOM 2130 CA PHE B 50 -3.899 -0.680 -3.209 1.00 0.00 C ATOM 2131 C PHE B 50 -5.082 -1.374 -3.931 1.00 0.00 C ATOM 2132 O PHE B 50 -6.188 -0.823 -4.024 1.00 0.00 O ATOM 2133 CB PHE B 50 -4.251 -0.972 -1.720 1.00 0.00 C ATOM 2134 CG PHE B 50 -3.356 -0.622 -0.549 1.00 0.00 C ATOM 2135 CD1 PHE B 50 -3.348 0.696 -0.091 1.00 0.00 C ATOM 2136 CD2 PHE B 50 -2.842 -1.642 0.268 1.00 0.00 C ATOM 2137 CE1 PHE B 50 -2.749 1.010 1.122 1.00 0.00 C ATOM 2138 CE2 PHE B 50 -2.241 -1.323 1.482 1.00 0.00 C ATOM 2139 CZ PHE B 50 -2.180 0.004 1.889 1.00 0.00 C ATOM 0 H PHE B 50 -4.316 1.405 -3.056 1.00 0.00 H new ATOM 0 HA PHE B 50 -2.885 -1.023 -3.415 1.00 0.00 H new ATOM 0 HB2 PHE B 50 -5.204 -0.478 -1.531 1.00 0.00 H new ATOM 0 HB3 PHE B 50 -4.429 -2.045 -1.655 1.00 0.00 H new ATOM 0 HD1 PHE B 50 -3.809 1.474 -0.681 1.00 0.00 H new ATOM 0 HD2 PHE B 50 -2.913 -2.673 -0.046 1.00 0.00 H new ATOM 0 HE1 PHE B 50 -2.726 2.033 1.467 1.00 0.00 H new ATOM 0 HE2 PHE B 50 -1.825 -2.102 2.104 1.00 0.00 H new ATOM 0 HZ PHE B 50 -1.683 0.255 2.814 1.00 0.00 H new ATOM 2149 N GLU B 51 -4.851 -2.634 -4.332 1.00 0.00 N ATOM 2150 CA GLU B 51 -5.936 -3.505 -4.829 1.00 0.00 C ATOM 2151 C GLU B 51 -5.555 -5.002 -4.780 1.00 0.00 C ATOM 2152 O GLU B 51 -4.387 -5.391 -4.683 1.00 0.00 O ATOM 2153 CB GLU B 51 -6.500 -3.054 -6.216 1.00 0.00 C ATOM 2154 CG GLU B 51 -5.519 -3.131 -7.409 1.00 0.00 C ATOM 2155 CD GLU B 51 -6.141 -2.642 -8.718 1.00 0.00 C ATOM 2156 OE1 GLU B 51 -5.948 -1.518 -9.181 1.00 0.00 O ATOM 2157 OE2 GLU B 51 -6.931 -3.597 -9.306 1.00 0.00 O ATOM 0 H GLU B 51 -3.930 -3.073 -4.323 1.00 0.00 H new ATOM 0 HA GLU B 51 -6.767 -3.384 -4.134 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -7.370 -3.668 -6.448 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -6.850 -2.026 -6.126 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -4.635 -2.533 -7.186 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -5.185 -4.161 -7.533 1.00 0.00 H new ATOM 2165 N VAL B 52 -6.596 -5.846 -4.861 1.00 0.00 N ATOM 2166 CA VAL B 52 -6.492 -7.299 -4.736 1.00 0.00 C ATOM 2167 C VAL B 52 -6.275 -7.960 -6.146 1.00 0.00 C ATOM 2168 O VAL B 52 -6.583 -7.358 -7.184 1.00 0.00 O ATOM 2169 CB VAL B 52 -7.801 -7.607 -3.909 1.00 0.00 C ATOM 2170 CG1 VAL B 52 -8.893 -8.284 -4.740 1.00 0.00 C ATOM 2171 CG2 VAL B 52 -7.463 -8.326 -2.599 1.00 0.00 C ATOM 0 H VAL B 52 -7.551 -5.525 -5.019 1.00 0.00 H new ATOM 0 HA VAL B 52 -5.632 -7.726 -4.219 1.00 0.00 H new ATOM 0 HB VAL B 52 -8.248 -6.654 -3.627 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -9.765 -8.468 -4.113 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -9.173 -7.636 -5.570 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -8.519 -9.231 -5.129 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -8.381 -8.527 -2.047 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -6.959 -9.267 -2.820 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -6.808 -7.696 -1.997 1.00 0.00 H new ATOM 2181 N ARG B 53 -5.786 -9.217 -6.172 1.00 0.00 N ATOM 2182 CA ARG B 53 -5.546 -9.946 -7.453 1.00 0.00 C ATOM 2183 C ARG B 53 -6.085 -11.402 -7.362 1.00 0.00 C ATOM 2184 O ARG B 53 -5.388 -12.291 -6.861 1.00 0.00 O ATOM 2185 CB ARG B 53 -4.030 -9.900 -7.798 1.00 0.00 C ATOM 2186 CG ARG B 53 -3.677 -10.364 -9.231 1.00 0.00 C ATOM 2187 CD ARG B 53 -2.169 -10.538 -9.497 1.00 0.00 C ATOM 2188 NE ARG B 53 -1.620 -11.748 -8.831 1.00 0.00 N ATOM 2189 CZ ARG B 53 -0.318 -12.089 -8.816 1.00 0.00 C ATOM 2190 NH1 ARG B 53 0.644 -11.379 -9.404 1.00 0.00 N ATOM 2191 NH2 ARG B 53 0.028 -13.193 -8.179 1.00 0.00 N ATOM 0 H ARG B 53 -5.549 -9.751 -5.336 1.00 0.00 H new ATOM 0 HA ARG B 53 -6.090 -9.459 -8.262 1.00 0.00 H new ATOM 0 HB2 ARG B 53 -3.672 -8.879 -7.663 1.00 0.00 H new ATOM 0 HB3 ARG B 53 -3.490 -10.524 -7.086 1.00 0.00 H new ATOM 0 HG2 ARG B 53 -4.178 -11.312 -9.425 1.00 0.00 H new ATOM 0 HG3 ARG B 53 -4.077 -9.641 -9.942 1.00 0.00 H new ATOM 0 HD2 ARG B 53 -1.996 -10.606 -10.571 1.00 0.00 H new ATOM 0 HD3 ARG B 53 -1.635 -9.656 -9.143 1.00 0.00 H new ATOM 0 HE ARG B 53 -2.277 -12.364 -8.351 1.00 0.00 H new ATOM 0 HH11 ARG B 53 0.412 -10.521 -9.903 1.00 0.00 H new ATOM 0 HH12 ARG B 53 1.613 -11.694 -9.355 1.00 0.00 H new ATOM 0 HH21 ARG B 53 -0.683 -13.759 -7.717 1.00 0.00 H new ATOM 0 HH22 ARG B 53 1.007 -13.479 -8.149 1.00 0.00 H new ATOM 2522 N LYS B 75 -7.586 -14.015 -3.856 1.00 0.00 N ATOM 2523 CA LYS B 75 -7.274 -12.566 -3.973 1.00 0.00 C ATOM 2524 C LYS B 75 -5.969 -12.240 -3.198 1.00 0.00 C ATOM 2525 O LYS B 75 -5.832 -12.588 -2.020 1.00 0.00 O ATOM 2526 CB LYS B 75 -8.399 -11.588 -3.572 1.00 0.00 C ATOM 2527 CG LYS B 75 -9.860 -11.931 -3.962 1.00 0.00 C ATOM 2528 CD LYS B 75 -10.652 -12.818 -2.977 1.00 0.00 C ATOM 2529 CE LYS B 75 -11.017 -12.121 -1.650 1.00 0.00 C ATOM 2530 NZ LYS B 75 -11.774 -13.014 -0.757 1.00 0.00 N ATOM 0 HA LYS B 75 -7.149 -12.399 -5.043 1.00 0.00 H new ATOM 0 HB2 LYS B 75 -8.365 -11.472 -2.489 1.00 0.00 H new ATOM 0 HB3 LYS B 75 -8.161 -10.616 -4.004 1.00 0.00 H new ATOM 0 HG2 LYS B 75 -10.406 -10.996 -4.092 1.00 0.00 H new ATOM 0 HG3 LYS B 75 -9.845 -12.429 -4.932 1.00 0.00 H new ATOM 0 HD2 LYS B 75 -11.569 -13.152 -3.463 1.00 0.00 H new ATOM 0 HD3 LYS B 75 -10.065 -13.710 -2.756 1.00 0.00 H new ATOM 0 HE2 LYS B 75 -10.107 -11.792 -1.149 1.00 0.00 H new ATOM 0 HE3 LYS B 75 -11.607 -11.228 -1.858 1.00 0.00 H new ATOM 0 HZ1 LYS B 75 -12.002 -12.512 0.125 1.00 0.00 H new ATOM 0 HZ2 LYS B 75 -12.655 -13.308 -1.225 1.00 0.00 H new ATOM 0 HZ3 LYS B 75 -11.201 -13.854 -0.539 1.00 0.00 H new ATOM 2543 N VAL B 76 -5.027 -11.551 -3.860 1.00 0.00 N ATOM 2544 CA VAL B 76 -3.683 -11.307 -3.360 1.00 0.00 C ATOM 2545 C VAL B 76 -3.626 -9.769 -3.087 1.00 0.00 C ATOM 2546 O VAL B 76 -3.717 -8.973 -4.028 1.00 0.00 O ATOM 2547 CB VAL B 76 -2.793 -11.903 -4.493 1.00 0.00 C ATOM 2548 CG1 VAL B 76 -1.741 -10.973 -5.055 1.00 0.00 C ATOM 2549 CG2 VAL B 76 -2.184 -13.245 -4.103 1.00 0.00 C ATOM 0 H VAL B 76 -5.192 -11.142 -4.780 1.00 0.00 H new ATOM 0 HA VAL B 76 -3.353 -11.760 -2.425 1.00 0.00 H new ATOM 0 HB VAL B 76 -3.495 -12.060 -5.312 1.00 0.00 H new ATOM 0 HG11 VAL B 76 -1.180 -11.487 -5.835 1.00 0.00 H new ATOM 0 HG12 VAL B 76 -2.223 -10.091 -5.476 1.00 0.00 H new ATOM 0 HG13 VAL B 76 -1.061 -10.670 -4.259 1.00 0.00 H new ATOM 0 HG21 VAL B 76 -1.573 -13.620 -4.924 1.00 0.00 H new ATOM 0 HG22 VAL B 76 -1.563 -13.119 -3.216 1.00 0.00 H new ATOM 0 HG23 VAL B 76 -2.981 -13.958 -3.889 1.00 0.00 H new ATOM 2559 N PRO B 77 -3.449 -9.308 -1.835 1.00 0.00 N ATOM 2560 CA PRO B 77 -3.430 -7.873 -1.507 1.00 0.00 C ATOM 2561 C PRO B 77 -2.051 -7.233 -1.750 1.00 0.00 C ATOM 2562 O PRO B 77 -0.989 -7.728 -1.356 1.00 0.00 O ATOM 2563 CB PRO B 77 -3.828 -7.906 -0.031 1.00 0.00 C ATOM 2564 CG PRO B 77 -3.232 -9.223 0.490 1.00 0.00 C ATOM 2565 CD PRO B 77 -3.328 -10.195 -0.682 1.00 0.00 C ATOM 0 HA PRO B 77 -4.087 -7.260 -2.124 1.00 0.00 H new ATOM 0 HB2 PRO B 77 -3.429 -7.047 0.509 1.00 0.00 H new ATOM 0 HB3 PRO B 77 -4.911 -7.883 0.090 1.00 0.00 H new ATOM 0 HG2 PRO B 77 -2.198 -9.089 0.807 1.00 0.00 H new ATOM 0 HG3 PRO B 77 -3.785 -9.591 1.354 1.00 0.00 H new ATOM 0 HD2 PRO B 77 -2.445 -10.831 -0.753 1.00 0.00 H new ATOM 0 HD3 PRO B 77 -4.190 -10.856 -0.589 1.00 0.00 H new ATOM 2573 N ALA B 78 -2.160 -6.099 -2.428 1.00 0.00 N ATOM 2574 CA ALA B 78 -1.011 -5.333 -2.912 1.00 0.00 C ATOM 2575 C ALA B 78 -1.230 -3.823 -2.675 1.00 0.00 C ATOM 2576 O ALA B 78 -2.347 -3.338 -2.480 1.00 0.00 O ATOM 2577 CB ALA B 78 -0.954 -5.687 -4.409 1.00 0.00 C ATOM 0 H ALA B 78 -3.058 -5.677 -2.662 1.00 0.00 H new ATOM 0 HA ALA B 78 -0.078 -5.568 -2.400 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -0.120 -5.162 -4.876 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -0.816 -6.762 -4.524 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -1.886 -5.388 -4.889 1.00 0.00 H new ATOM 2583 N PHE B 79 -0.107 -3.106 -2.694 1.00 0.00 N ATOM 2584 CA PHE B 79 -0.070 -1.623 -2.611 1.00 0.00 C ATOM 2585 C PHE B 79 0.862 -1.165 -3.769 1.00 0.00 C ATOM 2586 O PHE B 79 1.952 -1.705 -3.994 1.00 0.00 O ATOM 2587 CB PHE B 79 0.380 -1.061 -1.241 1.00 0.00 C ATOM 2588 CG PHE B 79 0.353 0.472 -0.972 1.00 0.00 C ATOM 2589 CD1 PHE B 79 -0.387 1.395 -1.733 1.00 0.00 C ATOM 2590 CD2 PHE B 79 1.125 0.955 0.092 1.00 0.00 C ATOM 2591 CE1 PHE B 79 -0.246 2.764 -1.523 1.00 0.00 C ATOM 2592 CE2 PHE B 79 1.221 2.323 0.329 1.00 0.00 C ATOM 2593 CZ PHE B 79 0.587 3.224 -0.510 1.00 0.00 C ATOM 0 H PHE B 79 0.818 -3.530 -2.768 1.00 0.00 H new ATOM 0 HA PHE B 79 -1.080 -1.225 -2.710 1.00 0.00 H new ATOM 0 HB2 PHE B 79 -0.241 -1.533 -0.479 1.00 0.00 H new ATOM 0 HB3 PHE B 79 1.402 -1.400 -1.074 1.00 0.00 H new ATOM 0 HD1 PHE B 79 -1.072 1.038 -2.488 1.00 0.00 H new ATOM 0 HD2 PHE B 79 1.649 0.261 0.733 1.00 0.00 H new ATOM 0 HE1 PHE B 79 -0.782 3.466 -2.145 1.00 0.00 H new ATOM 0 HE2 PHE B 79 1.793 2.684 1.171 1.00 0.00 H new ATOM 0 HZ PHE B 79 0.740 4.285 -0.377 1.00 0.00 H new ATOM 2603 N LYS B 80 0.391 -0.148 -4.489 1.00 0.00 N ATOM 2604 CA LYS B 80 1.214 0.651 -5.432 1.00 0.00 C ATOM 2605 C LYS B 80 1.556 1.901 -4.580 1.00 0.00 C ATOM 2606 O LYS B 80 0.762 2.837 -4.595 1.00 0.00 O ATOM 2607 CB LYS B 80 0.477 0.954 -6.777 1.00 0.00 C ATOM 2608 CG LYS B 80 1.207 0.415 -8.028 1.00 0.00 C ATOM 2609 CD LYS B 80 0.497 0.712 -9.370 1.00 0.00 C ATOM 2610 CE LYS B 80 0.401 2.193 -9.800 1.00 0.00 C ATOM 2611 NZ LYS B 80 1.714 2.813 -10.060 1.00 0.00 N ATOM 0 H LYS B 80 -0.581 0.158 -4.443 1.00 0.00 H new ATOM 0 HA LYS B 80 2.107 0.139 -5.791 1.00 0.00 H new ATOM 0 HB2 LYS B 80 -0.523 0.521 -6.737 1.00 0.00 H new ATOM 0 HB3 LYS B 80 0.354 2.032 -6.877 1.00 0.00 H new ATOM 0 HG2 LYS B 80 2.209 0.844 -8.060 1.00 0.00 H new ATOM 0 HG3 LYS B 80 1.325 -0.664 -7.926 1.00 0.00 H new ATOM 0 HD2 LYS B 80 1.016 0.164 -10.156 1.00 0.00 H new ATOM 0 HD3 LYS B 80 -0.514 0.309 -9.315 1.00 0.00 H new ATOM 0 HE2 LYS B 80 -0.211 2.264 -10.699 1.00 0.00 H new ATOM 0 HE3 LYS B 80 -0.111 2.758 -9.021 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 1.580 3.804 -10.344 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 2.293 2.775 -9.197 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 2.197 2.297 -10.823 1.00 0.00 H new ATOM 2624 N PRO B 81 2.645 1.988 -3.754 1.00 0.00 N ATOM 2625 CA PRO B 81 3.106 3.320 -3.251 1.00 0.00 C ATOM 2626 C PRO B 81 3.896 4.177 -4.317 1.00 0.00 C ATOM 2627 O PRO B 81 4.260 5.338 -4.126 1.00 0.00 O ATOM 2628 CB PRO B 81 4.054 2.803 -2.146 1.00 0.00 C ATOM 2629 CG PRO B 81 4.769 1.588 -2.735 1.00 0.00 C ATOM 2630 CD PRO B 81 3.713 0.968 -3.655 1.00 0.00 C ATOM 0 HA PRO B 81 2.305 3.998 -2.957 1.00 0.00 H new ATOM 0 HB2 PRO B 81 4.769 3.572 -1.855 1.00 0.00 H new ATOM 0 HB3 PRO B 81 3.496 2.530 -1.250 1.00 0.00 H new ATOM 0 HG2 PRO B 81 5.664 1.876 -3.287 1.00 0.00 H new ATOM 0 HG3 PRO B 81 5.084 0.891 -1.958 1.00 0.00 H new ATOM 0 HD2 PRO B 81 4.130 0.737 -4.635 1.00 0.00 H new ATOM 0 HD3 PRO B 81 3.330 0.034 -3.243 1.00 0.00 H new ATOM 2638 N GLY B 82 3.823 3.699 -5.551 1.00 0.00 N ATOM 2639 CA GLY B 82 4.864 3.879 -6.551 1.00 0.00 C ATOM 2640 C GLY B 82 4.932 5.195 -7.238 1.00 0.00 C ATOM 2641 O GLY B 82 5.511 6.115 -6.696 1.00 0.00 O ATOM 0 H GLY B 82 3.023 3.165 -5.891 1.00 0.00 H new ATOM 0 HA2 GLY B 82 5.826 3.699 -6.072 1.00 0.00 H new ATOM 0 HA3 GLY B 82 4.738 3.108 -7.311 1.00 0.00 H new ATOM 2645 N LYS B 83 4.291 5.278 -8.383 1.00 0.00 N ATOM 2646 CA LYS B 83 4.444 6.445 -9.322 1.00 0.00 C ATOM 2647 C LYS B 83 4.888 7.865 -8.850 1.00 0.00 C ATOM 2648 O LYS B 83 5.803 8.501 -9.382 1.00 0.00 O ATOM 2649 CB LYS B 83 3.154 6.553 -10.183 1.00 0.00 C ATOM 2650 CG LYS B 83 3.263 5.850 -11.551 1.00 0.00 C ATOM 2651 CD LYS B 83 1.960 5.926 -12.369 1.00 0.00 C ATOM 2652 CE LYS B 83 2.073 5.212 -13.727 1.00 0.00 C ATOM 2653 NZ LYS B 83 0.813 5.295 -14.487 1.00 0.00 N ATOM 0 H LYS B 83 3.646 4.562 -8.717 1.00 0.00 H new ATOM 0 HA LYS B 83 5.355 6.157 -9.846 1.00 0.00 H new ATOM 0 HB2 LYS B 83 2.320 6.123 -9.628 1.00 0.00 H new ATOM 0 HB3 LYS B 83 2.921 7.606 -10.343 1.00 0.00 H new ATOM 0 HG2 LYS B 83 4.072 6.303 -12.123 1.00 0.00 H new ATOM 0 HG3 LYS B 83 3.529 4.804 -11.396 1.00 0.00 H new ATOM 0 HD2 LYS B 83 1.148 5.480 -11.795 1.00 0.00 H new ATOM 0 HD3 LYS B 83 1.698 6.971 -12.533 1.00 0.00 H new ATOM 0 HE2 LYS B 83 2.880 5.659 -14.308 1.00 0.00 H new ATOM 0 HE3 LYS B 83 2.335 4.166 -13.569 1.00 0.00 H new ATOM 0 HZ1 LYS B 83 0.923 4.804 -15.397 1.00 0.00 H new ATOM 0 HZ2 LYS B 83 0.049 4.847 -13.942 1.00 0.00 H new ATOM 0 HZ3 LYS B 83 0.576 6.293 -14.659 1.00 0.00 H new ATOM 2666 N ALA B 84 4.168 8.291 -7.834 1.00 0.00 N ATOM 2667 CA ALA B 84 4.383 9.547 -7.102 1.00 0.00 C ATOM 2668 C ALA B 84 5.527 9.485 -6.057 1.00 0.00 C ATOM 2669 O ALA B 84 6.397 10.367 -6.077 1.00 0.00 O ATOM 2670 CB ALA B 84 3.040 9.729 -6.436 1.00 0.00 C ATOM 0 H ALA B 84 3.379 7.757 -7.470 1.00 0.00 H new ATOM 0 HA ALA B 84 4.697 10.363 -7.752 1.00 0.00 H new ATOM 0 HB1 ALA B 84 3.049 10.643 -5.843 1.00 0.00 H new ATOM 0 HB2 ALA B 84 2.263 9.798 -7.197 1.00 0.00 H new ATOM 0 HB3 ALA B 84 2.838 8.877 -5.787 1.00 0.00 H new ATOM 2676 N LEU B 85 5.558 8.478 -5.139 1.00 0.00 N ATOM 2677 CA LEU B 85 6.746 8.237 -4.307 1.00 0.00 C ATOM 2678 C LEU B 85 8.032 7.944 -5.137 1.00 0.00 C ATOM 2679 O LEU B 85 9.091 8.361 -4.689 1.00 0.00 O ATOM 2680 CB LEU B 85 6.340 7.047 -3.450 1.00 0.00 C ATOM 2681 CG LEU B 85 7.290 6.685 -2.334 1.00 0.00 C ATOM 2682 CD1 LEU B 85 7.231 7.699 -1.193 1.00 0.00 C ATOM 2683 CD2 LEU B 85 6.862 5.302 -1.823 1.00 0.00 C ATOM 0 H LEU B 85 4.783 7.837 -4.967 1.00 0.00 H new ATOM 0 HA LEU B 85 7.018 9.116 -3.723 1.00 0.00 H new ATOM 0 HB2 LEU B 85 5.362 7.253 -3.016 1.00 0.00 H new ATOM 0 HB3 LEU B 85 6.224 6.179 -4.099 1.00 0.00 H new ATOM 0 HG LEU B 85 8.316 6.682 -2.703 1.00 0.00 H new ATOM 0 HD11 LEU B 85 7.928 7.405 -0.408 1.00 0.00 H new ATOM 0 HD12 LEU B 85 7.502 8.686 -1.569 1.00 0.00 H new ATOM 0 HD13 LEU B 85 6.220 7.731 -0.787 1.00 0.00 H new ATOM 0 HD21 LEU B 85 7.521 4.994 -1.011 1.00 0.00 H new ATOM 0 HD22 LEU B 85 5.836 5.350 -1.459 1.00 0.00 H new ATOM 0 HD23 LEU B 85 6.925 4.578 -2.636 1.00 0.00 H new ATOM 2695 N LYS B 86 7.961 7.283 -6.320 1.00 0.00 N ATOM 2696 CA LYS B 86 9.097 7.155 -7.266 1.00 0.00 C ATOM 2697 C LYS B 86 9.782 8.524 -7.612 1.00 0.00 C ATOM 2698 O LYS B 86 10.990 8.539 -7.839 1.00 0.00 O ATOM 2699 CB LYS B 86 8.634 6.339 -8.501 1.00 0.00 C ATOM 2700 CG LYS B 86 9.756 5.786 -9.405 1.00 0.00 C ATOM 2701 CD LYS B 86 10.656 4.705 -8.754 1.00 0.00 C ATOM 2702 CE LYS B 86 11.777 4.155 -9.656 1.00 0.00 C ATOM 2703 NZ LYS B 86 11.282 3.303 -10.754 1.00 0.00 N ATOM 0 H LYS B 86 7.111 6.822 -6.645 1.00 0.00 H new ATOM 0 HA LYS B 86 9.901 6.601 -6.780 1.00 0.00 H new ATOM 0 HB2 LYS B 86 8.029 5.502 -8.153 1.00 0.00 H new ATOM 0 HB3 LYS B 86 7.985 6.971 -9.107 1.00 0.00 H new ATOM 0 HG2 LYS B 86 9.303 5.366 -10.303 1.00 0.00 H new ATOM 0 HG3 LYS B 86 10.386 6.616 -9.724 1.00 0.00 H new ATOM 0 HD2 LYS B 86 11.108 5.124 -7.855 1.00 0.00 H new ATOM 0 HD3 LYS B 86 10.026 3.874 -8.436 1.00 0.00 H new ATOM 0 HE2 LYS B 86 12.336 4.990 -10.078 1.00 0.00 H new ATOM 0 HE3 LYS B 86 12.474 3.580 -9.046 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 12.086 2.966 -11.322 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 10.772 2.488 -10.358 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 10.638 3.854 -11.358 1.00 0.00 H new ATOM 2716 N ASP B 87 9.030 9.649 -7.600 1.00 0.00 N ATOM 2717 CA ASP B 87 9.579 11.021 -7.665 1.00 0.00 C ATOM 2718 C ASP B 87 10.173 11.535 -6.314 1.00 0.00 C ATOM 2719 O ASP B 87 11.237 12.159 -6.345 1.00 0.00 O ATOM 2720 CB ASP B 87 8.434 11.913 -8.211 1.00 0.00 C ATOM 2721 CG ASP B 87 8.880 12.829 -9.355 1.00 0.00 C ATOM 2722 OD1 ASP B 87 9.235 13.995 -9.187 1.00 0.00 O ATOM 2723 OD2 ASP B 87 8.846 12.197 -10.572 1.00 0.00 O ATOM 0 H ASP B 87 8.012 9.628 -7.544 1.00 0.00 H new ATOM 0 HA ASP B 87 10.445 11.049 -8.326 1.00 0.00 H new ATOM 0 HB2 ASP B 87 7.620 11.277 -8.559 1.00 0.00 H new ATOM 0 HB3 ASP B 87 8.037 12.522 -7.399 1.00 0.00 H new ATOM 2729 N ALA B 88 9.520 11.297 -5.149 1.00 0.00 N ATOM 2730 CA ALA B 88 10.132 11.586 -3.808 1.00 0.00 C ATOM 2731 C ALA B 88 11.495 10.886 -3.495 1.00 0.00 C ATOM 2732 O ALA B 88 12.356 11.450 -2.815 1.00 0.00 O ATOM 2733 CB ALA B 88 9.200 11.085 -2.673 1.00 0.00 C ATOM 0 H ALA B 88 8.578 10.909 -5.100 1.00 0.00 H new ATOM 0 HA ALA B 88 10.285 12.664 -3.852 1.00 0.00 H new ATOM 0 HB1 ALA B 88 9.655 11.301 -1.706 1.00 0.00 H new ATOM 0 HB2 ALA B 88 8.238 11.592 -2.742 1.00 0.00 H new ATOM 0 HB3 ALA B 88 9.051 10.010 -2.772 1.00 0.00 H new ATOM 2739 N VAL B 89 11.635 9.644 -3.979 1.00 0.00 N ATOM 2740 CA VAL B 89 12.689 8.690 -3.628 1.00 0.00 C ATOM 2741 C VAL B 89 13.876 8.558 -4.642 1.00 0.00 C ATOM 2742 O VAL B 89 14.845 7.859 -4.332 1.00 0.00 O ATOM 2743 CB VAL B 89 11.766 7.424 -3.450 1.00 0.00 C ATOM 2744 CG1 VAL B 89 11.557 6.606 -4.727 1.00 0.00 C ATOM 2745 CG2 VAL B 89 12.228 6.535 -2.334 1.00 0.00 C ATOM 0 H VAL B 89 10.981 9.261 -4.661 1.00 0.00 H new ATOM 0 HA VAL B 89 13.300 8.953 -2.764 1.00 0.00 H new ATOM 0 HB VAL B 89 10.793 7.841 -3.189 1.00 0.00 H new ATOM 0 HG11 VAL B 89 10.910 5.755 -4.512 1.00 0.00 H new ATOM 0 HG12 VAL B 89 11.092 7.232 -5.488 1.00 0.00 H new ATOM 0 HG13 VAL B 89 12.520 6.247 -5.091 1.00 0.00 H new ATOM 0 HG21 VAL B 89 11.560 5.678 -2.252 1.00 0.00 H new ATOM 0 HG22 VAL B 89 13.240 6.188 -2.541 1.00 0.00 H new ATOM 0 HG23 VAL B 89 12.220 7.093 -1.397 1.00 0.00 H new ATOM 2755 N LYS B 90 13.794 9.206 -5.827 1.00 0.00 N ATOM 2756 CA LYS B 90 14.796 9.095 -6.908 1.00 0.00 C ATOM 2757 C LYS B 90 16.168 9.702 -6.561 1.00 0.00 C ATOM 2758 O LYS B 90 17.110 8.981 -6.231 1.00 0.00 O ATOM 2759 CB LYS B 90 14.168 9.694 -8.189 1.00 0.00 C ATOM 2760 CG LYS B 90 13.997 11.230 -8.282 1.00 0.00 C ATOM 2761 CD LYS B 90 13.258 11.679 -9.562 1.00 0.00 C ATOM 2762 CE LYS B 90 12.853 13.166 -9.593 1.00 0.00 C ATOM 2763 NZ LYS B 90 14.002 14.084 -9.713 1.00 0.00 N ATOM 0 H LYS B 90 13.020 9.828 -6.060 1.00 0.00 H new ATOM 0 HA LYS B 90 15.033 8.043 -7.066 1.00 0.00 H new ATOM 0 HB2 LYS B 90 14.777 9.377 -9.036 1.00 0.00 H new ATOM 0 HB3 LYS B 90 13.184 9.243 -8.317 1.00 0.00 H new ATOM 0 HG2 LYS B 90 13.447 11.582 -7.409 1.00 0.00 H new ATOM 0 HG3 LYS B 90 14.979 11.702 -8.252 1.00 0.00 H new ATOM 0 HD2 LYS B 90 13.895 11.474 -10.422 1.00 0.00 H new ATOM 0 HD3 LYS B 90 12.361 11.071 -9.678 1.00 0.00 H new ATOM 0 HE2 LYS B 90 12.175 13.333 -10.430 1.00 0.00 H new ATOM 0 HE3 LYS B 90 12.301 13.404 -8.684 1.00 0.00 H new ATOM 0 HZ1 LYS B 90 13.661 15.066 -9.728 1.00 0.00 H new ATOM 0 HZ2 LYS B 90 14.639 13.951 -8.902 1.00 0.00 H new ATOM 0 HZ3 LYS B 90 14.517 13.882 -10.594 1.00 0.00 H new